NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
511004 | 2lct | 17632 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 661 H1 GLY 661 4.551 -15.028 -10.202 2 H2 GLY 661 H2 GLY 661 6.137 -15.085 -9.582 3 H3 GLY 661 H3 GLY 661 5.025 -16.306 -9.182 4 HA2 GLY 661 HA2 GLY 661 6.721 -16.056 -11.494 5 HA3 GLY 661 HA3 GLY 661 5.910 -17.485 -10.845 6 H HIS 662 H HIS 662 5.063 -14.376 -12.403 7 HA HIS 662 HA HIS 662 3.614 -13.884 -14.128 8 HB2 HIS 662 HB2 HIS 662 4.763 -16.116 -15.017 9 HB3 HIS 662 HB3 HIS 662 3.140 -16.759 -14.777 10 HD1 HIS 662 HD1 HIS 662 5.148 -14.680 -17.052 11 HD2 HIS 662 HD2 HIS 662 1.091 -15.253 -16.269 12 HE1 HIS 662 HE1 HIS 662 3.894 -13.738 -19.048 13 HE2 HIS 662 HE2 HIS 662 1.422 -14.081 -18.585 14 H MET 663 H MET 663 2.783 -14.517 -11.386 15 HA MET 663 HA MET 663 -0.074 -15.119 -11.916 16 HB2 MET 663 HB2 MET 663 1.560 -15.907 -9.481 17 HB3 MET 663 HB3 MET 663 -0.166 -16.199 -9.697 18 HG2 MET 663 HG2 MET 663 0.184 -17.791 -11.381 19 HG3 MET 663 HG3 MET 663 1.797 -17.182 -11.754 20 HE1 MET 663 HE1 MET 663 1.254 -20.717 -10.770 21 HE2 MET 663 HE2 MET 663 1.801 -19.583 -12.001 22 HE3 MET 663 HE3 MET 663 2.972 -20.369 -10.935 23 H GLN 664 H GLN 664 0.799 -14.466 -8.686 24 HA GLN 664 HA GLN 664 -0.372 -11.780 -8.892 25 HB2 GLN 664 HB2 GLN 664 -0.844 -13.734 -7.076 26 HB3 GLN 664 HB3 GLN 664 0.437 -12.855 -6.240 27 HG2 GLN 664 HG2 GLN 664 -1.765 -11.247 -7.477 28 HG3 GLN 664 HG3 GLN 664 -2.143 -12.148 -6.015 29 HE21 GLN 664 HE21 GLN 664 0.002 -11.874 -4.388 30 HE22 GLN 664 HE22 GLN 664 0.374 -10.242 -4.118 31 H ASP 665 H ASP 665 2.429 -12.709 -9.679 32 HA ASP 665 HA ASP 665 4.503 -11.924 -8.148 33 HB2 ASP 665 HB2 ASP 665 4.115 -11.026 -11.017 34 HB3 ASP 665 HB3 ASP 665 5.651 -11.220 -10.184 35 H LEU 666 H LEU 666 5.199 -10.144 -7.129 36 HA LEU 666 HA LEU 666 3.652 -7.680 -7.526 37 HB2 LEU 666 HB2 LEU 666 5.379 -8.526 -5.196 38 HB3 LEU 666 HB3 LEU 666 4.362 -7.084 -5.268 39 HG LEU 666 HG LEU 666 3.190 -9.816 -5.772 40 HD11 LEU 666 HD11 LEU 666 4.120 -10.148 -3.625 41 HD12 LEU 666 HD12 LEU 666 3.772 -8.494 -3.125 42 HD13 LEU 666 HD13 LEU 666 2.457 -9.652 -3.316 43 HD21 LEU 666 HD21 LEU 666 2.001 -7.284 -4.618 44 HD22 LEU 666 HD22 LEU 666 1.959 -7.695 -6.331 45 HD23 LEU 666 HD23 LEU 666 1.135 -8.719 -5.161 46 H SER 667 H SER 667 6.894 -8.960 -7.582 47 HA SER 667 HA SER 667 8.317 -6.513 -7.628 48 HB2 SER 667 HB2 SER 667 9.065 -9.147 -8.908 49 HB3 SER 667 HB3 SER 667 10.165 -7.826 -8.511 50 HG SER 667 HG SER 667 10.221 -9.300 -6.828 51 H VAL 668 H VAL 668 6.147 -7.785 -9.840 52 HA VAL 668 HA VAL 668 7.433 -6.722 -12.219 53 HB VAL 668 HB VAL 668 5.501 -7.576 -13.409 54 HG11 VAL 668 HG11 VAL 668 6.603 -9.395 -11.260 55 HG12 VAL 668 HG12 VAL 668 5.572 -9.981 -12.563 56 HG13 VAL 668 HG13 VAL 668 7.134 -9.255 -12.934 57 HG21 VAL 668 HG21 VAL 668 3.710 -6.974 -11.888 58 HG22 VAL 668 HG22 VAL 668 3.683 -8.727 -12.084 59 HG23 VAL 668 HG23 VAL 668 4.371 -8.014 -10.627 60 H HIS 669 H HIS 669 5.643 -5.498 -9.714 61 HA HIS 669 HA HIS 669 4.306 -3.411 -11.292 62 HB2 HIS 669 HB2 HIS 669 4.317 -3.757 -8.288 63 HB3 HIS 669 HB3 HIS 669 3.197 -2.799 -9.253 64 HD1 HIS 669 HD1 HIS 669 2.268 -4.658 -11.382 65 HD2 HIS 669 HD2 HIS 669 2.909 -5.954 -7.480 66 HE1 HIS 669 HE1 HIS 669 0.877 -6.758 -11.091 67 HE2 HIS 669 HE2 HIS 669 1.228 -7.547 -8.698 68 H LEU 670 H LEU 670 4.397 -1.241 -9.795 69 HA LEU 670 HA LEU 670 7.252 -0.629 -9.419 70 HB2 LEU 670 HB2 LEU 670 6.446 1.795 -10.060 71 HB3 LEU 670 HB3 LEU 670 6.912 0.657 -11.299 72 HG LEU 670 HG LEU 670 4.103 1.282 -10.403 73 HD11 LEU 670 HD11 LEU 670 3.862 2.388 -12.491 74 HD12 LEU 670 HD12 LEU 670 5.408 2.932 -11.843 75 HD13 LEU 670 HD13 LEU 670 5.366 1.705 -13.106 76 HD21 LEU 670 HD21 LEU 670 3.989 -0.099 -12.818 77 HD22 LEU 670 HD22 LEU 670 5.190 -0.989 -11.888 78 HD23 LEU 670 HD23 LEU 670 3.565 -0.754 -11.238 79 H TRP 671 H TRP 671 4.310 -0.956 -7.975 80 HA TRP 671 HA TRP 671 4.915 1.153 -6.047 81 HB2 TRP 671 HB2 TRP 671 2.588 0.567 -5.130 82 HB3 TRP 671 HB3 TRP 671 2.679 1.439 -6.654 83 HD1 TRP 671 HD1 TRP 671 1.392 0.450 -8.592 84 HE1 TRP 671 HE1 TRP 671 0.204 -1.793 -9.078 85 HE3 TRP 671 HE3 TRP 671 2.927 -2.242 -4.524 86 HZ2 TRP 671 HZ2 TRP 671 -0.008 -4.385 -7.911 87 HZ3 TRP 671 HZ3 TRP 671 2.217 -4.600 -4.244 88 HH2 TRP 671 HH2 TRP 671 0.751 -5.676 -5.932 89 H TYR 672 H TYR 672 5.554 -2.002 -6.566 90 HA TYR 672 HA TYR 672 5.266 -2.851 -3.762 91 HB2 TYR 672 HB2 TYR 672 4.542 -4.435 -5.490 92 HB3 TYR 672 HB3 TYR 672 6.152 -4.402 -6.207 93 HD1 TYR 672 HD2 TYR 672 4.673 -4.794 -2.769 94 HD2 TYR 672 HD1 TYR 672 7.520 -6.198 -5.667 95 HE1 TYR 672 HE2 TYR 672 5.417 -6.558 -1.192 96 HE2 TYR 672 HE1 TYR 672 8.258 -7.960 -4.087 97 HH TYR 672 HH TYR 672 7.312 -9.185 -2.141 98 H ALA 673 H ALA 673 6.874 -2.478 -2.403 99 HA ALA 673 HA ALA 673 9.629 -2.236 -3.467 100 HB1 ALA 673 HB1 ALA 673 8.477 -1.275 -0.834 101 HB2 ALA 673 HB2 ALA 673 8.740 -0.267 -2.258 102 HB3 ALA 673 HB3 ALA 673 10.116 -0.984 -1.419 103 H GLY 674 H GLY 674 7.543 -4.099 -1.471 104 HA2 GLY 674 HA2 GLY 674 7.841 -5.961 -0.160 105 HA3 GLY 674 HA3 GLY 674 9.171 -6.328 -1.243 106 HA PRO 675 HA PRO 675 11.654 -6.106 2.442 107 HB2 PRO 675 HB2 PRO 675 14.114 -6.037 1.177 108 HB3 PRO 675 HB3 PRO 675 13.176 -7.513 1.466 109 HG2 PRO 675 HG2 PRO 675 13.431 -5.886 -1.010 110 HG3 PRO 675 HG3 PRO 675 13.333 -7.645 -0.816 111 HD2 PRO 675 HD2 PRO 675 11.206 -6.146 -1.623 112 HD3 PRO 675 HD3 PRO 675 11.015 -7.635 -0.669 113 H MET 676 H MET 676 10.534 -3.767 2.216 114 HA MET 676 HA MET 676 12.750 -1.793 2.175 115 HB2 MET 676 HB2 MET 676 11.185 -1.535 0.255 116 HB3 MET 676 HB3 MET 676 9.867 -1.304 1.397 117 HG2 MET 676 HG2 MET 676 10.475 0.837 1.843 118 HG3 MET 676 HG3 MET 676 12.183 0.431 1.938 119 HE1 MET 676 HE1 MET 676 13.694 1.620 0.551 120 HE2 MET 676 HE2 MET 676 13.702 -0.010 -0.115 121 HE3 MET 676 HE3 MET 676 13.728 1.387 -1.194 122 H GLU 677 H GLU 677 12.597 -0.049 3.648 123 HA GLU 677 HA GLU 677 11.129 -0.701 6.109 124 HB2 GLU 677 HB2 GLU 677 12.686 0.956 7.147 125 HB3 GLU 677 HB3 GLU 677 13.505 -0.422 6.405 126 HG2 GLU 677 HG2 GLU 677 14.428 0.853 4.741 127 HG3 GLU 677 HG3 GLU 677 13.013 1.897 4.625 128 H ARG 678 H ARG 678 10.410 1.230 7.419 129 HA ARG 678 HA ARG 678 8.419 2.663 6.059 130 HB2 ARG 678 HB2 ARG 678 8.628 2.133 8.580 131 HB3 ARG 678 HB3 ARG 678 9.632 3.578 8.663 132 HG2 ARG 678 HG2 ARG 678 7.481 4.480 7.205 133 HG3 ARG 678 HG3 ARG 678 6.712 3.338 8.304 134 HD2 ARG 678 HD2 ARG 678 8.690 5.033 9.647 135 HD3 ARG 678 HD3 ARG 678 7.391 5.960 8.905 136 HE ARG 678 HE ARG 678 6.813 3.698 10.734 137 HH11 ARG 678 HH21 ARG 678 6.461 7.014 9.805 138 HH12 ARG 678 HH22 ARG 678 5.249 7.342 10.989 139 HH21 ARG 678 HH11 ARG 678 5.222 4.145 12.269 140 HH22 ARG 678 HH12 ARG 678 4.520 5.746 12.362 141 H ALA 679 H ALA 679 11.417 3.963 7.495 142 HA ALA 679 HA ALA 679 11.189 6.541 6.400 143 HB1 ALA 679 HB1 ALA 679 13.032 6.866 7.642 144 HB2 ALA 679 HB2 ALA 679 13.948 5.724 6.655 145 HB3 ALA 679 HB3 ALA 679 13.011 5.147 8.033 146 H GLY 680 H GLY 680 12.545 3.559 5.172 147 HA2 GLY 680 HA2 GLY 680 13.812 4.707 2.866 148 HA3 GLY 680 HA3 GLY 680 13.445 3.000 3.100 149 H ALA 681 H ALA 681 10.748 3.013 3.446 150 HA ALA 681 HA ALA 681 9.714 3.013 0.863 151 HB1 ALA 681 HB1 ALA 681 8.349 3.255 3.551 152 HB2 ALA 681 HB2 ALA 681 8.586 1.798 2.589 153 HB3 ALA 681 HB3 ALA 681 7.467 3.043 2.039 154 H GLU 682 H GLU 682 9.357 5.532 3.384 155 HA GLU 682 HA GLU 682 7.905 7.257 1.597 156 HB2 GLU 682 HB2 GLU 682 8.114 8.934 3.412 157 HB3 GLU 682 HB3 GLU 682 7.448 7.400 3.953 158 HG2 GLU 682 HG2 GLU 682 9.825 6.763 4.629 159 HG3 GLU 682 HG3 GLU 682 10.245 8.448 4.376 160 H SER 683 H SER 683 11.203 6.616 2.046 161 HA SER 683 HA SER 683 12.377 9.104 1.590 162 HB2 SER 683 HB2 SER 683 14.331 7.918 0.923 163 HB3 SER 683 HB3 SER 683 13.539 6.894 2.118 164 HG SER 683 HG SER 683 12.791 5.582 0.517 165 H ILE 684 H ILE 684 11.177 6.690 -0.670 166 HA ILE 684 HA ILE 684 11.803 8.292 -2.995 167 HB ILE 684 HB ILE 684 9.893 5.968 -2.989 168 HG12 ILE 684 HG12 ILE 684 12.588 5.104 -3.493 169 HG13 ILE 684 HG13 ILE 684 12.547 5.903 -1.923 170 HG21 ILE 684 HG21 ILE 684 12.029 6.219 -5.004 171 HG22 ILE 684 HG22 ILE 684 10.304 5.941 -5.224 172 HG23 ILE 684 HG23 ILE 684 10.908 7.577 -4.979 173 HD11 ILE 684 HD11 ILE 684 10.305 4.036 -2.482 174 HD12 ILE 684 HD12 ILE 684 11.893 3.300 -2.268 175 HD13 ILE 684 HD13 ILE 684 11.204 4.299 -0.990 176 H LEU 685 H LEU 685 8.851 7.263 -1.334 177 HA LEU 685 HA LEU 685 7.004 8.667 -2.908 178 HB2 LEU 685 HB2 LEU 685 7.041 7.407 -0.225 179 HB3 LEU 685 HB3 LEU 685 5.778 8.600 -0.495 180 HG LEU 685 HG LEU 685 4.881 7.386 -2.335 181 HD11 LEU 685 HD11 LEU 685 6.746 6.731 -3.618 182 HD12 LEU 685 HD12 LEU 685 7.519 5.932 -2.249 183 HD13 LEU 685 HD13 LEU 685 6.110 5.204 -3.015 184 HD21 LEU 685 HD21 LEU 685 4.786 4.978 -1.339 185 HD22 LEU 685 HD22 LEU 685 5.727 5.664 -0.016 186 HD23 LEU 685 HD23 LEU 685 4.128 6.308 -0.389 187 H ALA 686 H ALA 686 8.695 9.671 0.089 188 HA ALA 686 HA ALA 686 7.384 12.169 0.320 189 HB1 ALA 686 HB1 ALA 686 8.723 11.155 2.129 190 HB2 ALA 686 HB2 ALA 686 9.231 12.806 1.775 191 HB3 ALA 686 HB3 ALA 686 10.190 11.444 1.191 192 H ASN 687 H ASN 687 10.281 11.129 -1.405 193 HA ASN 687 HA ASN 687 10.970 13.743 -2.371 194 HB2 ASN 687 HB2 ASN 687 12.536 11.750 -2.149 195 HB3 ASN 687 HB3 ASN 687 11.758 11.088 -3.583 196 HD21 ASN 687 HD21 ASN 687 11.394 13.834 -4.797 197 HD22 ASN 687 HD22 ASN 687 12.951 14.281 -5.310 198 H ARG 688 H ARG 688 8.912 11.127 -3.449 199 HA ARG 688 HA ARG 688 8.553 12.141 -6.130 200 HB2 ARG 688 HB2 ARG 688 7.755 9.804 -4.608 201 HB3 ARG 688 HB3 ARG 688 6.386 10.468 -5.487 202 HG2 ARG 688 HG2 ARG 688 7.235 9.189 -7.189 203 HG3 ARG 688 HG3 ARG 688 8.261 10.603 -7.432 204 HD2 ARG 688 HD2 ARG 688 10.124 9.543 -6.640 205 HD3 ARG 688 HD3 ARG 688 9.229 8.692 -5.397 206 HE ARG 688 HE ARG 688 9.315 6.872 -6.807 207 HH11 ARG 688 HH21 ARG 688 9.113 9.733 -8.735 208 HH12 ARG 688 HH22 ARG 688 9.107 8.865 -10.230 209 HH21 ARG 688 HH11 ARG 688 9.347 5.774 -8.713 210 HH22 ARG 688 HH12 ARG 688 9.233 6.626 -10.249 211 H SER 689 H SER 689 6.178 12.518 -6.861 212 HA SER 689 HA SER 689 5.210 14.827 -5.464 213 HB2 SER 689 HB2 SER 689 5.051 14.621 -7.918 214 HB3 SER 689 HB3 SER 689 3.948 13.258 -7.727 215 HG SER 689 HG SER 689 2.419 14.668 -7.478 216 H ASP 690 H ASP 690 2.732 14.971 -5.090 217 HA ASP 690 HA ASP 690 2.096 13.112 -3.007 218 HB2 ASP 690 HB2 ASP 690 1.036 15.619 -4.017 219 HB3 ASP 690 HB3 ASP 690 -0.248 14.482 -3.611 220 H GLY 691 H GLY 691 0.658 11.461 -2.959 221 HA2 GLY 691 HA2 GLY 691 -1.174 10.179 -3.855 222 HA3 GLY 691 HA3 GLY 691 -0.765 10.780 -5.461 223 H THR 692 H THR 692 2.136 10.354 -4.437 224 HA THR 692 HA THR 692 2.615 7.902 -5.782 225 HB THR 692 HB THR 692 4.498 9.197 -3.800 226 HG1 THR 692 HG1 THR 692 4.130 10.908 -5.032 227 HG21 THR 692 HG21 THR 692 6.170 8.121 -4.988 228 HG22 THR 692 HG22 THR 692 4.865 6.942 -5.116 229 HG23 THR 692 HG23 THR 692 5.208 8.029 -6.460 230 H PHE 693 H PHE 693 2.594 5.840 -5.022 231 HA PHE 693 HA PHE 693 2.682 5.455 -2.098 232 HB2 PHE 693 HB2 PHE 693 0.767 3.979 -2.149 233 HB3 PHE 693 HB3 PHE 693 0.310 5.532 -2.842 234 HD1 PHE 693 HD2 PHE 693 1.100 2.005 -3.602 235 HD2 PHE 693 HD1 PHE 693 -0.174 5.777 -5.201 236 HE1 PHE 693 HE2 PHE 693 0.405 0.884 -5.701 237 HE2 PHE 693 HE1 PHE 693 -0.870 4.653 -7.300 238 HZ PHE 693 HZ PHE 693 -0.578 2.206 -7.550 239 H LEU 694 H LEU 694 3.035 3.234 -1.444 240 HA LEU 694 HA LEU 694 3.952 1.356 -3.431 241 HB2 LEU 694 HB2 LEU 694 6.241 1.298 -2.949 242 HB3 LEU 694 HB3 LEU 694 5.883 3.021 -3.009 243 HG LEU 694 HG LEU 694 5.444 2.705 -0.423 244 HD11 LEU 694 HD11 LEU 694 6.663 0.169 -1.252 245 HD12 LEU 694 HD12 LEU 694 7.539 0.964 0.054 246 HD13 LEU 694 HD13 LEU 694 5.831 0.577 0.248 247 HD21 LEU 694 HD21 LEU 694 7.268 4.029 -1.630 248 HD22 LEU 694 HD22 LEU 694 7.665 3.461 -0.013 249 HD23 LEU 694 HD23 LEU 694 8.295 2.612 -1.420 250 H VAL 695 H VAL 695 4.746 -0.658 -2.449 251 HA VAL 695 HA VAL 695 3.630 -1.095 0.255 252 HB VAL 695 HB VAL 695 3.343 -2.867 -2.178 253 HG11 VAL 695 HG11 VAL 695 2.118 -4.370 -0.694 254 HG12 VAL 695 HG12 VAL 695 3.752 -4.147 -0.077 255 HG13 VAL 695 HG13 VAL 695 2.400 -3.297 0.673 256 HG21 VAL 695 HG21 VAL 695 1.638 -0.898 -0.771 257 HG22 VAL 695 HG22 VAL 695 1.563 -1.464 -2.438 258 HG23 VAL 695 HG23 VAL 695 0.859 -2.432 -1.144 259 H ARG 696 H ARG 696 4.849 -2.217 1.625 260 HA ARG 696 HA ARG 696 7.347 -3.435 0.591 261 HB2 ARG 696 HB2 ARG 696 8.178 -2.975 2.991 262 HB3 ARG 696 HB3 ARG 696 8.039 -1.605 1.889 263 HG2 ARG 696 HG2 ARG 696 5.721 -1.208 2.848 264 HG3 ARG 696 HG3 ARG 696 6.122 -2.396 4.087 265 HD2 ARG 696 HD2 ARG 696 7.636 0.167 3.512 266 HD3 ARG 696 HD3 ARG 696 6.595 -0.134 4.900 267 HE ARG 696 HE ARG 696 9.090 -1.674 4.378 268 HH11 ARG 696 HH21 ARG 696 6.998 0.077 6.526 269 HH12 ARG 696 HH22 ARG 696 7.810 -0.491 7.944 270 HH21 ARG 696 HH11 ARG 696 10.100 -2.352 6.186 271 HH22 ARG 696 HH12 ARG 696 9.537 -1.869 7.757 272 H GLN 697 H GLN 697 8.177 -5.260 1.868 273 HA GLN 697 HA GLN 697 5.966 -6.889 2.985 274 HB2 GLN 697 HB2 GLN 697 6.664 -7.832 0.898 275 HB3 GLN 697 HB3 GLN 697 8.364 -7.688 1.333 276 HG2 GLN 697 HG2 GLN 697 7.169 -10.016 1.574 277 HG3 GLN 697 HG3 GLN 697 8.274 -9.477 2.833 278 HE21 GLN 697 HE21 GLN 697 7.437 -9.572 4.917 279 HE22 GLN 697 HE22 GLN 697 5.782 -9.591 5.298 280 H ARG 698 H ARG 698 6.207 -6.661 5.131 281 HA ARG 698 HA ARG 698 7.898 -8.211 6.598 282 HB2 ARG 698 HB2 ARG 698 9.310 -5.849 5.697 283 HB3 ARG 698 HB3 ARG 698 9.190 -5.860 7.453 284 HG2 ARG 698 HG2 ARG 698 9.799 -8.529 6.605 285 HG3 ARG 698 HG3 ARG 698 10.910 -7.437 5.787 286 HD2 ARG 698 HD2 ARG 698 11.709 -8.275 8.036 287 HD3 ARG 698 HD3 ARG 698 11.684 -6.525 7.866 288 HE ARG 698 HE ARG 698 9.757 -8.133 9.439 289 HH11 ARG 698 HH21 ARG 698 11.135 -5.102 8.534 290 HH12 ARG 698 HH22 ARG 698 10.266 -4.211 9.733 291 HH21 ARG 698 HH11 ARG 698 8.673 -6.949 11.028 292 HH22 ARG 698 HH12 ARG 698 8.934 -5.228 11.129 293 H VAL 699 H VAL 699 7.652 -7.930 8.861 294 HA VAL 699 HA VAL 699 6.277 -5.772 10.063 295 HB VAL 699 HB VAL 699 4.470 -6.788 8.566 296 HG11 VAL 699 HG11 VAL 699 3.683 -8.835 10.414 297 HG12 VAL 699 HG12 VAL 699 4.053 -8.984 8.697 298 HG13 VAL 699 HG13 VAL 699 5.336 -9.157 9.891 299 HG21 VAL 699 HG21 VAL 699 4.379 -5.952 11.347 300 HG22 VAL 699 HG22 VAL 699 3.250 -5.602 10.040 301 HG23 VAL 699 HG23 VAL 699 3.069 -7.078 10.987 302 H LYS 700 H LYS 700 4.728 -7.752 11.791 303 HA LYS 700 HA LYS 700 6.927 -9.199 13.081 304 HB2 LYS 700 HB2 LYS 700 6.065 -8.249 15.320 305 HB3 LYS 700 HB3 LYS 700 7.094 -7.218 14.325 306 HG2 LYS 700 HG2 LYS 700 5.049 -6.159 13.363 307 HG3 LYS 700 HG3 LYS 700 4.063 -7.134 14.450 308 HD2 LYS 700 HD2 LYS 700 6.230 -5.231 15.385 309 HD3 LYS 700 HD3 LYS 700 4.520 -4.809 15.304 310 HE2 LYS 700 HE2 LYS 700 5.701 -7.077 16.940 311 HE3 LYS 700 HE3 LYS 700 5.140 -5.532 17.579 312 HZ1 LYS 700 HZ1 LYS 700 3.082 -6.534 16.009 313 HZ2 LYS 700 HZ2 LYS 700 3.627 -7.867 16.941 314 HZ3 LYS 700 HZ3 LYS 700 3.119 -6.419 17.706 315 H ASP 701 H ASP 701 3.465 -8.584 12.776 316 HA ASP 701 HA ASP 701 2.843 -11.342 13.127 317 HB2 ASP 701 HB2 ASP 701 1.360 -10.775 15.233 318 HB3 ASP 701 HB3 ASP 701 3.059 -11.197 15.423 319 H ALA 702 H ALA 702 0.967 -8.553 14.253 320 HA ALA 702 HA ALA 702 -1.389 -9.317 12.900 321 HB1 ALA 702 HB1 ALA 702 -0.790 -6.496 13.762 322 HB2 ALA 702 HB2 ALA 702 -1.099 -7.781 14.930 323 HB3 ALA 702 HB3 ALA 702 -2.337 -7.342 13.754 324 H ALA 703 H ALA 703 0.476 -9.417 10.858 325 HA ALA 703 HA ALA 703 -0.789 -8.154 8.759 326 HB1 ALA 703 HB1 ALA 703 -0.319 -5.974 9.142 327 HB2 ALA 703 HB2 ALA 703 1.247 -6.379 8.442 328 HB3 ALA 703 HB3 ALA 703 1.046 -6.349 10.193 329 H GLU 704 H GLU 704 0.631 -7.873 6.773 330 HA GLU 704 HA GLU 704 2.862 -9.834 6.790 331 HB2 GLU 704 HB2 GLU 704 0.358 -9.927 5.328 332 HB3 GLU 704 HB3 GLU 704 1.722 -9.857 4.214 333 HG2 GLU 704 HG2 GLU 704 2.759 -11.781 5.259 334 HG3 GLU 704 HG3 GLU 704 1.548 -11.795 6.539 335 H PHE 705 H PHE 705 1.368 -7.629 4.431 336 HA PHE 705 HA PHE 705 4.030 -6.507 3.836 337 HB2 PHE 705 HB2 PHE 705 1.414 -6.327 2.316 338 HB3 PHE 705 HB3 PHE 705 2.917 -5.558 1.823 339 HD1 PHE 705 HD1 PHE 705 1.299 -8.852 2.443 340 HD2 PHE 705 HD2 PHE 705 4.657 -6.783 0.749 341 HE1 PHE 705 HE1 PHE 705 2.020 -10.940 1.324 342 HE2 PHE 705 HE2 PHE 705 5.378 -8.876 -0.374 343 HZ PHE 705 HZ PHE 705 4.058 -10.954 -0.085 344 H ALA 706 H ALA 706 3.906 -4.097 3.221 345 HA ALA 706 HA ALA 706 2.006 -2.674 4.968 346 HB1 ALA 706 HB1 ALA 706 4.474 -1.245 4.998 347 HB2 ALA 706 HB2 ALA 706 4.795 -2.915 5.473 348 HB3 ALA 706 HB3 ALA 706 3.603 -1.961 6.351 349 H ILE 707 H ILE 707 1.066 -1.019 4.047 350 HA ILE 707 HA ILE 707 1.927 -0.217 1.348 351 HB ILE 707 HB ILE 707 -0.607 0.705 2.683 352 HG12 ILE 707 HG12 ILE 707 -1.544 -1.415 1.407 353 HG13 ILE 707 HG13 ILE 707 0.083 -2.036 1.672 354 HG21 ILE 707 HG21 ILE 707 0.414 1.368 0.304 355 HG22 ILE 707 HG22 ILE 707 -0.333 -0.155 -0.175 356 HG23 ILE 707 HG23 ILE 707 -1.319 1.132 0.520 357 HD11 ILE 707 HD11 ILE 707 -2.071 -1.909 3.537 358 HD12 ILE 707 HD12 ILE 707 -0.447 -2.531 3.800 359 HD13 ILE 707 HD13 ILE 707 -0.805 -0.834 4.110 360 H SER 708 H SER 708 2.561 1.813 0.832 361 HA SER 708 HA SER 708 2.451 3.886 2.934 362 HB2 SER 708 HB2 SER 708 4.878 3.116 1.306 363 HB3 SER 708 HB3 SER 708 4.761 4.595 2.250 364 HG SER 708 HG SER 708 4.579 1.908 3.187 365 H ILE 709 H ILE 709 1.475 5.672 2.163 366 HA ILE 709 HA ILE 709 1.626 6.211 -0.753 367 HB ILE 709 HB ILE 709 -0.674 7.186 0.892 368 HG12 ILE 709 HG12 ILE 709 -1.707 4.934 -0.238 369 HG13 ILE 709 HG13 ILE 709 -0.096 4.368 0.217 370 HG21 ILE 709 HG21 ILE 709 -1.278 6.182 -1.746 371 HG22 ILE 709 HG22 ILE 709 -1.440 7.822 -1.118 372 HG23 ILE 709 HG23 ILE 709 0.089 7.295 -1.825 373 HD11 ILE 709 HD11 ILE 709 -0.479 5.365 2.497 374 HD12 ILE 709 HD12 ILE 709 -2.141 5.687 2.009 375 HD13 ILE 709 HD13 ILE 709 -1.562 4.024 2.110 376 H LYS 710 H LYS 710 2.125 8.215 -1.397 377 HA LYS 710 HA LYS 710 2.920 10.148 0.649 378 HB2 LYS 710 HB2 LYS 710 4.523 9.890 -1.115 379 HB3 LYS 710 HB3 LYS 710 3.274 10.009 -2.350 380 HG2 LYS 710 HG2 LYS 710 4.295 12.136 -2.361 381 HG3 LYS 710 HG3 LYS 710 2.827 12.369 -1.420 382 HD2 LYS 710 HD2 LYS 710 3.965 12.577 0.576 383 HD3 LYS 710 HD3 LYS 710 5.338 11.598 0.033 384 HE2 LYS 710 HE2 LYS 710 4.676 14.323 -1.113 385 HE3 LYS 710 HE3 LYS 710 5.819 14.080 0.209 386 HZ1 LYS 710 HZ1 LYS 710 7.352 13.705 -1.371 387 HZ2 LYS 710 HZ2 LYS 710 6.555 12.214 -1.677 388 HZ3 LYS 710 HZ3 LYS 710 6.180 13.592 -2.615 389 H TYR 711 H TYR 711 1.155 11.159 1.446 390 HA TYR 711 HA TYR 711 -0.504 12.672 -0.454 391 HB2 TYR 711 HB2 TYR 711 -1.701 10.552 -0.007 392 HB3 TYR 711 HB3 TYR 711 -1.649 10.904 1.719 393 HD1 TYR 711 HD1 TYR 711 -2.455 12.848 -1.396 394 HD2 TYR 711 HD2 TYR 711 -3.651 11.705 2.564 395 HE1 TYR 711 HE1 TYR 711 -4.512 14.217 -1.620 396 HE2 TYR 711 HE2 TYR 711 -5.711 13.060 2.341 397 HH TYR 711 HH TYR 711 -7.029 13.949 -0.307 398 H ASN 712 H ASN 712 -0.087 14.665 0.150 399 HA ASN 712 HA ASN 712 -0.417 16.554 1.504 400 HB2 ASN 712 HB2 ASN 712 -1.927 15.178 2.995 401 HB3 ASN 712 HB3 ASN 712 -0.488 14.682 3.880 402 HD21 ASN 712 HD21 ASN 712 -0.145 15.887 5.701 403 HD22 ASN 712 HD22 ASN 712 -0.556 17.533 5.870 404 H VAL 713 H VAL 713 1.921 15.902 0.469 405 HA VAL 713 HA VAL 713 4.217 15.864 0.710 406 HB VAL 713 HB VAL 713 5.094 17.718 2.011 407 HG11 VAL 713 HG11 VAL 713 3.891 19.484 0.929 408 HG12 VAL 713 HG12 VAL 713 3.752 18.081 -0.129 409 HG13 VAL 713 HG13 VAL 713 2.401 18.542 0.906 410 HG21 VAL 713 HG21 VAL 713 3.805 18.943 3.606 411 HG22 VAL 713 HG22 VAL 713 2.312 18.135 3.133 412 HG23 VAL 713 HG23 VAL 713 3.554 17.248 4.016 413 H GLU 714 H GLU 714 2.951 13.787 2.071 414 HA GLU 714 HA GLU 714 5.014 13.060 3.965 415 HB2 GLU 714 HB2 GLU 714 3.541 12.634 5.831 416 HB3 GLU 714 HB3 GLU 714 3.287 14.307 5.326 417 HG2 GLU 714 HG2 GLU 714 1.354 13.530 3.930 418 HG3 GLU 714 HG3 GLU 714 1.557 11.919 4.610 419 H VAL 715 H VAL 715 4.881 10.767 4.518 420 HA VAL 715 HA VAL 715 3.336 9.244 2.507 421 HB VAL 715 HB VAL 715 5.869 8.356 3.872 422 HG11 VAL 715 HG11 VAL 715 4.212 6.726 2.729 423 HG12 VAL 715 HG12 VAL 715 4.731 7.475 1.220 424 HG13 VAL 715 HG13 VAL 715 5.903 6.642 2.238 425 HG21 VAL 715 HG21 VAL 715 5.409 9.987 1.378 426 HG22 VAL 715 HG22 VAL 715 6.578 10.258 2.669 427 HG23 VAL 715 HG23 VAL 715 6.822 8.948 1.517 428 H LYS 716 H LYS 716 1.635 8.232 3.367 429 HA LYS 716 HA LYS 716 1.609 7.552 6.216 430 HB2 LYS 716 HB2 LYS 716 -0.625 6.880 4.325 431 HB3 LYS 716 HB3 LYS 716 -0.709 7.374 6.015 432 HG2 LYS 716 HG2 LYS 716 0.505 9.552 4.785 433 HG3 LYS 716 HG3 LYS 716 -0.686 9.027 3.592 434 HD2 LYS 716 HD2 LYS 716 -2.464 9.140 5.256 435 HD3 LYS 716 HD3 LYS 716 -1.297 9.541 6.519 436 HE2 LYS 716 HE2 LYS 716 -0.794 11.421 4.513 437 HE3 LYS 716 HE3 LYS 716 -2.553 11.289 4.549 438 HZ1 LYS 716 HZ1 LYS 716 -2.160 11.395 7.115 439 HZ2 LYS 716 HZ2 LYS 716 -0.687 12.167 6.664 440 HZ3 LYS 716 HZ3 LYS 716 -2.197 12.817 6.192 441 H HIS 717 H HIS 717 2.364 5.672 6.903 442 HA HIS 717 HA HIS 717 2.459 3.353 5.091 443 HB2 HIS 717 HB2 HIS 717 3.841 3.622 7.752 444 HB3 HIS 717 HB3 HIS 717 4.218 2.519 6.431 445 HD1 HIS 717 HD1 HIS 717 5.221 3.620 4.213 446 HD2 HIS 717 HD2 HIS 717 5.055 6.130 7.562 447 HE1 HIS 717 HE1 HIS 717 6.859 5.523 3.793 448 HE2 HIS 717 HE2 HIS 717 6.795 7.063 5.835 449 H ILE 718 H ILE 718 1.374 1.532 5.490 450 HA ILE 718 HA ILE 718 0.161 1.116 8.146 451 HB ILE 718 HB ILE 718 -1.357 0.898 5.539 452 HG12 ILE 718 HG12 ILE 718 -2.589 2.592 7.479 453 HG13 ILE 718 HG13 ILE 718 -0.910 3.100 7.317 454 HG21 ILE 718 HG21 ILE 718 -3.200 0.142 6.801 455 HG22 ILE 718 HG22 ILE 718 -1.851 -0.787 7.444 456 HG23 ILE 718 HG23 ILE 718 -2.467 0.607 8.332 457 HD11 ILE 718 HD11 ILE 718 -2.943 2.791 5.106 458 HD12 ILE 718 HD12 ILE 718 -2.195 4.288 5.662 459 HD13 ILE 718 HD13 ILE 718 -1.227 3.078 4.820 460 H LYS 719 H LYS 719 -0.050 -0.981 8.777 461 HA LYS 719 HA LYS 719 1.477 -2.970 7.285 462 HB2 LYS 719 HB2 LYS 719 0.986 -4.326 9.416 463 HB3 LYS 719 HB3 LYS 719 2.027 -2.917 9.575 464 HG2 LYS 719 HG2 LYS 719 0.563 -1.870 10.945 465 HG3 LYS 719 HG3 LYS 719 -0.792 -2.206 9.868 466 HD2 LYS 719 HD2 LYS 719 -0.022 -4.680 11.075 467 HD3 LYS 719 HD3 LYS 719 -0.139 -3.478 12.356 468 HE2 LYS 719 HE2 LYS 719 -2.361 -3.995 12.295 469 HE3 LYS 719 HE3 LYS 719 -2.385 -2.891 10.920 470 HZ1 LYS 719 HZ1 LYS 719 -1.898 -5.830 10.725 471 HZ2 LYS 719 HZ2 LYS 719 -3.436 -5.075 10.449 472 HZ3 LYS 719 HZ3 LYS 719 -2.096 -4.724 9.420 473 H ILE 720 H ILE 720 0.369 -3.961 5.689 474 HA ILE 720 HA ILE 720 -2.430 -4.373 5.625 475 HB ILE 720 HB ILE 720 -0.218 -4.818 3.890 476 HG12 ILE 720 HG12 ILE 720 -3.091 -5.389 3.203 477 HG13 ILE 720 HG13 ILE 720 -2.581 -3.751 3.601 478 HG21 ILE 720 HG21 ILE 720 -2.046 -7.235 4.117 479 HG22 ILE 720 HG22 ILE 720 -0.804 -6.982 2.892 480 HG23 ILE 720 HG23 ILE 720 -0.344 -7.209 4.579 481 HD11 ILE 720 HD11 ILE 720 -1.934 -3.547 1.447 482 HD12 ILE 720 HD12 ILE 720 -0.609 -4.647 1.838 483 HD13 ILE 720 HD13 ILE 720 -2.112 -5.279 1.163 484 H MET 721 H MET 721 -3.702 -6.159 6.005 485 HA MET 721 HA MET 721 -2.502 -8.216 7.758 486 HB2 MET 721 HB2 MET 721 -4.532 -6.754 8.451 487 HB3 MET 721 HB3 MET 721 -5.451 -7.807 7.383 488 HG2 MET 721 HG2 MET 721 -5.408 -8.582 9.787 489 HG3 MET 721 HG3 MET 721 -4.821 -9.774 8.632 490 HE1 MET 721 HE1 MET 721 -2.903 -10.564 11.672 491 HE2 MET 721 HE2 MET 721 -3.764 -9.134 12.237 492 HE3 MET 721 HE3 MET 721 -4.567 -10.290 11.167 493 H THR 722 H THR 722 -3.264 -10.430 7.495 494 HA THR 722 HA THR 722 -3.865 -11.068 4.667 495 HB THR 722 HB THR 722 -1.611 -11.751 5.340 496 HG1 THR 722 HG1 THR 722 -1.808 -13.879 4.729 497 HG21 THR 722 HG21 THR 722 -1.534 -13.690 7.053 498 HG22 THR 722 HG22 THR 722 -1.684 -12.045 7.668 499 HG23 THR 722 HG23 THR 722 -3.101 -13.090 7.589 500 H ALA 723 H ALA 723 -6.048 -10.543 5.929 501 HA ALA 723 HA ALA 723 -7.211 -12.497 7.585 502 HB1 ALA 723 HB1 ALA 723 -8.587 -10.633 5.645 503 HB2 ALA 723 HB2 ALA 723 -8.087 -10.210 7.281 504 HB3 ALA 723 HB3 ALA 723 -9.329 -11.438 7.029 505 H GLU 724 H GLU 724 -7.687 -14.519 7.166 506 HA GLU 724 HA GLU 724 -8.067 -16.472 6.002 507 HB2 GLU 724 HB2 GLU 724 -9.932 -14.948 4.223 508 HB3 GLU 724 HB3 GLU 724 -10.142 -16.531 4.968 509 HG2 GLU 724 HG2 GLU 724 -10.532 -13.806 6.159 510 HG3 GLU 724 HG3 GLU 724 -11.559 -15.229 6.278 511 H GLY 725 H GLY 725 -6.042 -14.486 4.899 512 HA2 GLY 725 HA2 GLY 725 -4.442 -15.032 3.209 513 HA3 GLY 725 HA3 GLY 725 -5.726 -15.795 2.278 514 H LEU 726 H LEU 726 -7.203 -13.094 3.282 515 HA LEU 726 HA LEU 726 -6.655 -11.705 0.762 516 HB2 LEU 726 HB2 LEU 726 -8.587 -10.887 2.943 517 HB3 LEU 726 HB3 LEU 726 -8.574 -10.355 1.264 518 HG LEU 726 HG LEU 726 -9.020 -13.223 2.133 519 HD11 LEU 726 HD11 LEU 726 -11.098 -11.330 1.034 520 HD12 LEU 726 HD12 LEU 726 -11.343 -12.865 1.866 521 HD13 LEU 726 HD13 LEU 726 -10.799 -11.451 2.767 522 HD21 LEU 726 HD21 LEU 726 -8.094 -12.937 -0.145 523 HD22 LEU 726 HD22 LEU 726 -9.767 -13.487 -0.210 524 HD23 LEU 726 HD23 LEU 726 -9.385 -11.796 -0.523 525 H TYR 727 H TYR 727 -5.858 -9.612 0.593 526 HA TYR 727 HA TYR 727 -4.364 -8.696 2.950 527 HB2 TYR 727 HB2 TYR 727 -4.117 -8.079 0.013 528 HB3 TYR 727 HB3 TYR 727 -3.230 -7.200 1.253 529 HD1 TYR 727 HD2 TYR 727 -3.607 -10.349 2.640 530 HD2 TYR 727 HD1 TYR 727 -1.484 -8.392 -0.534 531 HE1 TYR 727 HE2 TYR 727 -1.899 -12.130 2.690 532 HE2 TYR 727 HE1 TYR 727 0.233 -10.183 -0.482 533 HH TYR 727 HH TYR 727 0.499 -12.364 2.102 534 H ARG 728 H ARG 728 -4.805 -6.875 3.984 535 HA ARG 728 HA ARG 728 -6.653 -4.925 2.801 536 HB2 ARG 728 HB2 ARG 728 -7.598 -4.994 5.343 537 HB3 ARG 728 HB3 ARG 728 -8.334 -5.862 4.006 538 HG2 ARG 728 HG2 ARG 728 -6.999 -7.867 4.562 539 HG3 ARG 728 HG3 ARG 728 -6.248 -6.991 5.892 540 HD2 ARG 728 HD2 ARG 728 -9.122 -6.780 6.077 541 HD3 ARG 728 HD3 ARG 728 -8.653 -8.476 5.957 542 HE ARG 728 HE ARG 728 -7.083 -6.960 7.877 543 HH11 ARG 728 HH21 ARG 728 -9.952 -8.798 7.349 544 HH12 ARG 728 HH22 ARG 728 -10.154 -9.197 9.015 545 HH21 ARG 728 HH11 ARG 728 -7.346 -7.429 10.046 546 HH22 ARG 728 HH12 ARG 728 -8.690 -8.437 10.538 547 H ILE 729 H ILE 729 -6.215 -2.900 3.320 548 HA ILE 729 HA ILE 729 -3.807 -2.289 4.806 549 HB ILE 729 HB ILE 729 -5.799 -0.350 3.630 550 HG12 ILE 729 HG12 ILE 729 -3.555 -1.873 2.282 551 HG13 ILE 729 HG13 ILE 729 -5.269 -1.917 1.872 552 HG21 ILE 729 HG21 ILE 729 -4.264 0.922 4.805 553 HG22 ILE 729 HG22 ILE 729 -2.964 -0.247 4.585 554 HG23 ILE 729 HG23 ILE 729 -3.438 0.803 3.253 555 HD11 ILE 729 HD11 ILE 729 -4.565 -0.384 0.302 556 HD12 ILE 729 HD12 ILE 729 -4.880 0.720 1.642 557 HD13 ILE 729 HD13 ILE 729 -3.233 0.186 1.308 558 H THR 730 H THR 730 -7.265 -1.780 5.110 559 HA THR 730 HA THR 730 -6.879 -0.550 7.771 560 HB THR 730 HB THR 730 -8.170 0.711 6.135 561 HG1 THR 730 HG1 THR 730 -9.666 1.264 7.526 562 HG21 THR 730 HG21 THR 730 -9.499 -0.354 4.679 563 HG22 THR 730 HG22 THR 730 -9.269 -1.865 5.553 564 HG23 THR 730 HG23 THR 730 -10.578 -0.775 6.006 565 H GLU 731 H GLU 731 -7.515 -3.421 6.299 566 HA GLU 731 HA GLU 731 -8.034 -5.466 7.138 567 HB2 GLU 731 HB2 GLU 731 -8.578 -4.084 9.763 568 HB3 GLU 731 HB3 GLU 731 -8.248 -5.795 9.505 569 HG2 GLU 731 HG2 GLU 731 -6.114 -4.599 8.227 570 HG3 GLU 731 HG3 GLU 731 -6.373 -3.514 9.588 571 H LYS 732 H LYS 732 -10.044 -2.867 6.942 572 HA LYS 732 HA LYS 732 -12.515 -4.319 7.532 573 HB2 LYS 732 HB2 LYS 732 -12.426 -1.547 6.406 574 HB3 LYS 732 HB3 LYS 732 -13.563 -2.248 7.559 575 HG2 LYS 732 HG2 LYS 732 -10.679 -1.523 8.106 576 HG3 LYS 732 HG3 LYS 732 -12.093 -0.674 8.714 577 HD2 LYS 732 HD2 LYS 732 -11.984 -3.593 9.281 578 HD3 LYS 732 HD3 LYS 732 -10.801 -2.599 10.121 579 HE2 LYS 732 HE2 LYS 732 -13.336 -1.271 10.201 580 HE3 LYS 732 HE3 LYS 732 -13.542 -2.935 10.749 581 HZ1 LYS 732 HZ1 LYS 732 -11.754 -2.683 12.319 582 HZ2 LYS 732 HZ2 LYS 732 -11.406 -1.099 11.731 583 HZ3 LYS 732 HZ3 LYS 732 -12.875 -1.400 12.554 584 H LYS 733 H LYS 733 -10.638 -3.020 4.902 585 HA LYS 733 HA LYS 733 -12.430 -4.330 2.947 586 HB2 LYS 733 HB2 LYS 733 -12.628 -1.925 2.683 587 HB3 LYS 733 HB3 LYS 733 -10.878 -1.740 2.673 588 HG2 LYS 733 HG2 LYS 733 -11.518 -1.658 0.382 589 HG3 LYS 733 HG3 LYS 733 -10.883 -3.287 0.615 590 HD2 LYS 733 HD2 LYS 733 -12.983 -4.273 0.500 591 HD3 LYS 733 HD3 LYS 733 -13.812 -2.823 1.063 592 HE2 LYS 733 HE2 LYS 733 -12.378 -2.796 -1.581 593 HE3 LYS 733 HE3 LYS 733 -13.990 -3.503 -1.464 594 HZ1 LYS 733 HZ1 LYS 733 -13.308 -0.786 -1.644 595 HZ2 LYS 733 HZ2 LYS 733 -14.864 -1.474 -1.456 596 HZ3 LYS 733 HZ3 LYS 733 -13.958 -1.050 -0.085 597 H ALA 734 H ALA 734 -11.406 -6.155 2.371 598 HA ALA 734 HA ALA 734 -8.485 -6.063 1.925 599 HB1 ALA 734 HB1 ALA 734 -8.398 -8.376 2.515 600 HB2 ALA 734 HB2 ALA 734 -10.154 -8.523 2.455 601 HB3 ALA 734 HB3 ALA 734 -9.391 -7.585 3.736 602 H PHE 735 H PHE 735 -7.806 -7.964 0.430 603 HA PHE 735 HA PHE 735 -9.615 -8.409 -1.819 604 HB2 PHE 735 HB2 PHE 735 -7.349 -6.528 -1.890 605 HB3 PHE 735 HB3 PHE 735 -7.377 -7.694 -3.211 606 HD1 PHE 735 HD2 PHE 735 -9.410 -7.890 -4.668 607 HD2 PHE 735 HD1 PHE 735 -8.976 -4.794 -1.727 608 HE1 PHE 735 HE2 PHE 735 -11.240 -6.614 -5.746 609 HE2 PHE 735 HE1 PHE 735 -10.807 -3.515 -2.805 610 HZ PHE 735 HZ PHE 735 -11.943 -4.428 -4.813 611 H ARG 736 H ARG 736 -8.382 -9.751 -3.547 612 HA ARG 736 HA ARG 736 -7.709 -12.216 -2.527 613 HB2 ARG 736 HB2 ARG 736 -7.345 -10.862 -5.125 614 HB3 ARG 736 HB3 ARG 736 -6.285 -12.241 -4.837 615 HG2 ARG 736 HG2 ARG 736 -8.063 -13.452 -5.589 616 HG3 ARG 736 HG3 ARG 736 -8.660 -13.243 -3.941 617 HD2 ARG 736 HD2 ARG 736 -10.420 -12.571 -5.451 618 HD3 ARG 736 HD3 ARG 736 -9.776 -11.124 -4.687 619 HE ARG 736 HE ARG 736 -9.007 -10.397 -6.751 620 HH11 ARG 736 HH21 ARG 736 -9.856 -13.756 -6.892 621 HH12 ARG 736 HH22 ARG 736 -9.486 -13.908 -8.571 622 HH21 ARG 736 HH11 ARG 736 -8.478 -10.607 -8.904 623 HH22 ARG 736 HH12 ARG 736 -8.713 -12.137 -9.708 624 H GLY 737 H GLY 737 -5.389 -9.744 -3.666 625 HA2 GLY 737 HA2 GLY 737 -3.423 -10.762 -1.734 626 HA3 GLY 737 HA3 GLY 737 -2.973 -10.748 -3.436 627 H LEU 738 H LEU 738 -1.331 -9.241 -3.180 628 HA LEU 738 HA LEU 738 -1.788 -6.700 -1.905 629 HB2 LEU 738 HB2 LEU 738 0.471 -8.058 -3.265 630 HB3 LEU 738 HB3 LEU 738 0.487 -6.299 -3.304 631 HG LEU 738 HG LEU 738 0.370 -8.061 -0.843 632 HD11 LEU 738 HD11 LEU 738 2.605 -7.968 -1.356 633 HD12 LEU 738 HD12 LEU 738 2.453 -6.439 -2.220 634 HD13 LEU 738 HD13 LEU 738 2.460 -6.459 -0.458 635 HD21 LEU 738 HD21 LEU 738 0.662 -5.679 0.236 636 HD22 LEU 738 HD22 LEU 738 -0.106 -5.123 -1.249 637 HD23 LEU 738 HD23 LEU 738 -0.949 -6.248 -0.188 638 H THR 739 H THR 739 -1.055 -7.653 -5.249 639 HA THR 739 HA THR 739 -1.407 -5.233 -6.513 640 HB THR 739 HB THR 739 -2.437 -7.839 -7.654 641 HG1 THR 739 HG1 THR 739 -0.468 -8.431 -7.010 642 HG21 THR 739 HG21 THR 739 -2.180 -5.246 -8.675 643 HG22 THR 739 HG22 THR 739 -0.822 -6.136 -9.351 644 HG23 THR 739 HG23 THR 739 -2.469 -6.715 -9.601 645 H GLU 740 H GLU 740 -3.927 -7.697 -5.995 646 HA GLU 740 HA GLU 740 -6.088 -6.159 -6.942 647 HB2 GLU 740 HB2 GLU 740 -5.999 -8.397 -4.908 648 HB3 GLU 740 HB3 GLU 740 -7.486 -7.725 -5.570 649 HG2 GLU 740 HG2 GLU 740 -5.716 -8.325 -7.750 650 HG3 GLU 740 HG3 GLU 740 -5.811 -9.737 -6.702 651 H LEU 741 H LEU 741 -4.551 -6.307 -3.793 652 HA LEU 741 HA LEU 741 -6.611 -4.757 -2.493 653 HB2 LEU 741 HB2 LEU 741 -5.270 -6.465 -1.317 654 HB3 LEU 741 HB3 LEU 741 -3.822 -5.500 -1.568 655 HG LEU 741 HG LEU 741 -5.001 -5.316 0.710 656 HD11 LEU 741 HD11 LEU 741 -4.904 -2.564 -0.229 657 HD12 LEU 741 HD12 LEU 741 -3.871 -3.401 0.927 658 HD13 LEU 741 HD13 LEU 741 -3.531 -3.515 -0.795 659 HD21 LEU 741 HD21 LEU 741 -6.907 -3.845 0.850 660 HD22 LEU 741 HD22 LEU 741 -6.846 -3.521 -0.881 661 HD23 LEU 741 HD23 LEU 741 -7.293 -5.123 -0.300 662 H VAL 742 H VAL 742 -3.460 -4.109 -3.951 663 HA VAL 742 HA VAL 742 -3.536 -1.307 -3.076 664 HB VAL 742 HB VAL 742 -1.569 -2.854 -4.765 665 HG11 VAL 742 HG11 VAL 742 -1.776 0.047 -4.065 666 HG12 VAL 742 HG12 VAL 742 -0.182 -0.696 -4.176 667 HG13 VAL 742 HG13 VAL 742 -1.259 -0.710 -5.572 668 HG21 VAL 742 HG21 VAL 742 -0.910 -1.597 -2.150 669 HG22 VAL 742 HG22 VAL 742 -1.923 -3.039 -2.110 670 HG23 VAL 742 HG23 VAL 742 -0.326 -3.106 -2.852 671 H GLU 743 H GLU 743 -4.210 -3.196 -5.949 672 HA GLU 743 HA GLU 743 -4.342 -0.828 -7.625 673 HB2 GLU 743 HB2 GLU 743 -5.028 -3.718 -8.177 674 HB3 GLU 743 HB3 GLU 743 -5.114 -2.431 -9.373 675 HG2 GLU 743 HG2 GLU 743 -2.596 -3.100 -7.817 676 HG3 GLU 743 HG3 GLU 743 -2.960 -3.753 -9.410 677 H PHE 744 H PHE 744 -6.230 -1.626 -5.252 678 HA PHE 744 HA PHE 744 -8.716 -0.936 -6.703 679 HB2 PHE 744 HB2 PHE 744 -8.475 -3.223 -5.378 680 HB3 PHE 744 HB3 PHE 744 -8.848 -2.191 -3.996 681 HD1 PHE 744 HD2 PHE 744 -10.056 -3.357 -7.305 682 HD2 PHE 744 HD1 PHE 744 -11.038 -1.231 -3.706 683 HE1 PHE 744 HE2 PHE 744 -12.448 -3.356 -7.959 684 HE2 PHE 744 HE1 PHE 744 -13.431 -1.233 -4.359 685 HZ PHE 744 HZ PHE 744 -14.135 -2.295 -6.486 686 H TYR 745 H TYR 745 -6.857 -0.513 -3.705 687 HA TYR 745 HA TYR 745 -8.499 1.503 -2.583 688 HB2 TYR 745 HB2 TYR 745 -5.625 0.715 -2.225 689 HB3 TYR 745 HB3 TYR 745 -6.209 2.217 -1.519 690 HD1 TYR 745 HD1 TYR 745 -7.441 -1.322 -1.867 691 HD2 TYR 745 HD2 TYR 745 -6.917 2.094 0.701 692 HE1 TYR 745 HE1 TYR 745 -8.414 -2.587 0.041 693 HE2 TYR 745 HE2 TYR 745 -7.867 0.817 2.585 694 HH TYR 745 HH TYR 745 -8.863 -2.592 2.241 695 H GLN 746 H GLN 746 -6.479 1.461 -5.318 696 HA GLN 746 HA GLN 746 -5.734 4.212 -5.439 697 HB2 GLN 746 HB2 GLN 746 -5.477 3.713 -7.920 698 HB3 GLN 746 HB3 GLN 746 -4.533 2.686 -6.842 699 HG2 GLN 746 HG2 GLN 746 -5.693 0.822 -7.396 700 HG3 GLN 746 HG3 GLN 746 -7.239 1.661 -7.406 701 HE21 GLN 746 HE21 GLN 746 -4.669 0.459 -9.420 702 HE22 GLN 746 HE22 GLN 746 -5.284 1.053 -10.886 703 H GLN 747 H GLN 747 -8.636 2.474 -5.931 704 HA GLN 747 HA GLN 747 -9.932 4.794 -7.236 705 HB2 GLN 747 HB2 GLN 747 -11.206 2.083 -6.949 706 HB3 GLN 747 HB3 GLN 747 -11.508 3.331 -8.159 707 HG2 GLN 747 HG2 GLN 747 -8.751 2.589 -8.334 708 HG3 GLN 747 HG3 GLN 747 -9.705 1.111 -8.320 709 HE21 GLN 747 HE21 GLN 747 -8.224 2.627 -10.559 710 HE22 GLN 747 HE22 GLN 747 -9.405 2.777 -11.780 711 H ASN 748 H ASN 748 -10.127 2.476 -4.579 712 HA ASN 748 HA ASN 748 -12.480 3.640 -3.405 713 HB2 ASN 748 HB2 ASN 748 -10.432 1.633 -2.482 714 HB3 ASN 748 HB3 ASN 748 -11.658 2.248 -1.378 715 HD21 ASN 748 HD21 ASN 748 -12.642 2.077 -4.695 716 HD22 ASN 748 HD22 ASN 748 -13.578 0.671 -4.556 717 H SER 749 H SER 749 -12.435 5.655 -2.645 718 HA SER 749 HA SER 749 -10.283 7.232 -1.986 719 HB2 SER 749 HB2 SER 749 -12.256 8.139 -0.292 720 HB3 SER 749 HB3 SER 749 -12.081 8.586 -1.986 721 HG SER 749 HG SER 749 -13.842 6.790 -0.731 722 H LEU 750 H LEU 750 -8.721 6.916 -0.545 723 HA LEU 750 HA LEU 750 -8.712 5.051 1.501 724 HB2 LEU 750 HB2 LEU 750 -7.210 7.676 1.390 725 HB3 LEU 750 HB3 LEU 750 -6.828 6.340 2.473 726 HG LEU 750 HG LEU 750 -6.665 6.394 -0.539 727 HD11 LEU 750 HD11 LEU 750 -4.597 7.083 0.191 728 HD12 LEU 750 HD12 LEU 750 -4.754 6.259 1.741 729 HD13 LEU 750 HD13 LEU 750 -4.351 5.341 0.292 730 HD21 LEU 750 HD21 LEU 750 -7.577 4.260 -0.220 731 HD22 LEU 750 HD22 LEU 750 -5.845 3.942 -0.112 732 HD23 LEU 750 HD23 LEU 750 -6.810 4.069 1.358 733 H LYS 751 H LYS 751 -9.983 8.305 1.527 734 HA LYS 751 HA LYS 751 -10.183 8.830 4.246 735 HB2 LYS 751 HB2 LYS 751 -11.838 10.419 3.687 736 HB3 LYS 751 HB3 LYS 751 -10.815 10.312 2.257 737 HG2 LYS 751 HG2 LYS 751 -12.575 8.391 1.617 738 HG3 LYS 751 HG3 LYS 751 -13.615 9.357 2.659 739 HD2 LYS 751 HD2 LYS 751 -12.151 10.281 0.170 740 HD3 LYS 751 HD3 LYS 751 -13.893 10.191 0.418 741 HE2 LYS 751 HE2 LYS 751 -11.965 12.037 1.854 742 HE3 LYS 751 HE3 LYS 751 -13.172 12.509 0.658 743 HZ1 LYS 751 HZ1 LYS 751 -13.803 12.810 3.062 744 HZ2 LYS 751 HZ2 LYS 751 -14.914 11.934 2.117 745 HZ3 LYS 751 HZ3 LYS 751 -13.869 11.118 3.178 746 H ASP 752 H ASP 752 -11.802 6.437 2.380 747 HA ASP 752 HA ASP 752 -13.917 6.066 4.385 748 HB2 ASP 752 HB2 ASP 752 -13.462 4.531 1.820 749 HB3 ASP 752 HB3 ASP 752 -14.936 4.597 2.786 750 H CYS 753 H CYS 753 -10.993 4.578 3.188 751 HA CYS 753 HA CYS 753 -11.394 2.201 4.869 752 HB2 CYS 753 HB2 CYS 753 -9.279 2.910 2.824 753 HB3 CYS 753 HB3 CYS 753 -9.301 1.410 3.751 754 HG CYS 753 HG CYS 753 -10.583 0.936 1.530 755 H PHE 754 H PHE 754 -9.160 4.922 4.425 756 HA PHE 754 HA PHE 754 -7.507 4.111 6.668 757 HB2 PHE 754 HB2 PHE 754 -7.542 6.490 4.819 758 HB3 PHE 754 HB3 PHE 754 -6.434 6.386 6.184 759 HD1 PHE 754 HD2 PHE 754 -7.554 3.424 4.214 760 HD2 PHE 754 HD1 PHE 754 -4.408 6.265 4.905 761 HE1 PHE 754 HE2 PHE 754 -6.013 2.043 2.864 762 HE2 PHE 754 HE1 PHE 754 -2.877 4.883 3.558 763 HZ PHE 754 HZ PHE 754 -3.670 2.779 2.523 764 H LYS 755 H LYS 755 -7.857 7.458 6.716 765 HA LYS 755 HA LYS 755 -9.994 7.573 8.696 766 HB2 LYS 755 HB2 LYS 755 -8.136 6.830 10.051 767 HB3 LYS 755 HB3 LYS 755 -7.110 8.104 9.401 768 HG2 LYS 755 HG2 LYS 755 -8.513 9.817 10.434 769 HG3 LYS 755 HG3 LYS 755 -9.657 8.589 10.976 770 HD2 LYS 755 HD2 LYS 755 -8.447 8.444 12.870 771 HD3 LYS 755 HD3 LYS 755 -7.195 7.675 11.902 772 HE2 LYS 755 HE2 LYS 755 -7.416 10.569 12.726 773 HE3 LYS 755 HE3 LYS 755 -6.062 9.462 12.951 774 HZ1 LYS 755 HZ1 LYS 755 -6.300 9.461 10.282 775 HZ2 LYS 755 HZ2 LYS 755 -6.799 11.063 10.625 776 HZ3 LYS 755 HZ3 LYS 755 -5.262 10.500 11.130 777 H SER 756 H SER 756 -7.427 9.848 8.878 778 HA SER 756 HA SER 756 -9.152 11.965 7.954 779 HB2 SER 756 HB2 SER 756 -6.225 12.243 8.624 780 HB3 SER 756 HB3 SER 756 -7.503 13.446 8.780 781 HG SER 756 HG SER 756 -8.251 12.441 10.561 782 H LEU 757 H LEU 757 -8.149 9.827 6.121 783 HA LEU 757 HA LEU 757 -6.340 11.156 4.301 784 HB2 LEU 757 HB2 LEU 757 -7.620 8.488 4.532 785 HB3 LEU 757 HB3 LEU 757 -7.228 9.027 2.903 786 HG LEU 757 HG LEU 757 -5.425 7.710 4.193 787 HD11 LEU 757 HD11 LEU 757 -4.588 8.589 2.264 788 HD12 LEU 757 HD12 LEU 757 -5.113 10.224 2.654 789 HD13 LEU 757 HD13 LEU 757 -3.673 9.554 3.420 790 HD21 LEU 757 HD21 LEU 757 -4.254 8.711 5.911 791 HD22 LEU 757 HD22 LEU 757 -4.662 10.341 5.378 792 HD23 LEU 757 HD23 LEU 757 -5.860 9.360 6.220 793 H ASP 758 H ASP 758 -6.876 11.428 2.045 794 HA ASP 758 HA ASP 758 -9.625 11.622 1.228 795 HB2 ASP 758 HB2 ASP 758 -8.457 13.905 2.449 796 HB3 ASP 758 HB3 ASP 758 -8.555 14.241 0.723 797 H THR 759 H THR 759 -7.927 9.996 0.203 798 HA THR 759 HA THR 759 -7.583 10.865 -2.511 799 HB THR 759 HB THR 759 -5.534 11.814 -1.442 800 HG1 THR 759 HG1 THR 759 -4.640 11.364 -3.274 801 HG21 THR 759 HG21 THR 759 -3.767 10.003 -0.899 802 HG22 THR 759 HG22 THR 759 -5.008 10.309 0.314 803 HG23 THR 759 HG23 THR 759 -5.132 8.903 -0.742 804 H THR 760 H THR 760 -5.599 9.025 -3.197 805 HA THR 760 HA THR 760 -6.353 6.370 -2.295 806 HB THR 760 HB THR 760 -7.012 5.645 -4.611 807 HG1 THR 760 HG1 THR 760 -7.407 7.141 -6.106 808 HG21 THR 760 HG21 THR 760 -8.614 6.279 -2.687 809 HG22 THR 760 HG22 THR 760 -8.908 7.752 -3.612 810 HG23 THR 760 HG23 THR 760 -9.281 6.180 -4.315 811 H LEU 761 H LEU 761 -5.166 4.702 -3.678 812 HA LEU 761 HA LEU 761 -2.408 5.272 -3.773 813 HB2 LEU 761 HB2 LEU 761 -4.063 3.094 -5.094 814 HB3 LEU 761 HB3 LEU 761 -2.310 3.116 -5.113 815 HG LEU 761 HG LEU 761 -3.463 1.674 -3.312 816 HD11 LEU 761 HD11 LEU 761 -1.171 1.974 -3.055 817 HD12 LEU 761 HD12 LEU 761 -1.338 3.714 -2.796 818 HD13 LEU 761 HD13 LEU 761 -1.822 2.586 -1.535 819 HD21 LEU 761 HD21 LEU 761 -5.123 3.354 -2.583 820 HD22 LEU 761 HD22 LEU 761 -4.088 2.846 -1.255 821 HD23 LEU 761 HD23 LEU 761 -3.813 4.399 -2.034 822 H GLN 762 H GLN 762 -2.303 7.256 -4.937 823 HA GLN 762 HA GLN 762 -3.339 7.579 -7.558 824 HB2 GLN 762 HB2 GLN 762 -1.899 9.137 -5.601 825 HB3 GLN 762 HB3 GLN 762 -1.256 9.423 -7.215 826 HG2 GLN 762 HG2 GLN 762 -4.101 9.382 -7.425 827 HG3 GLN 762 HG3 GLN 762 -3.692 10.400 -6.047 828 HE21 GLN 762 HE21 GLN 762 -1.537 11.830 -6.699 829 HE22 GLN 762 HE22 GLN 762 -1.727 12.654 -8.169 830 H PHE 763 H PHE 763 0.096 7.449 -6.531 831 HA PHE 763 HA PHE 763 0.652 6.062 -9.089 832 HB2 PHE 763 HB2 PHE 763 2.110 8.482 -8.012 833 HB3 PHE 763 HB3 PHE 763 2.694 7.492 -9.350 834 HD1 PHE 763 HD1 PHE 763 1.247 7.246 -11.422 835 HD2 PHE 763 HD2 PHE 763 0.419 10.121 -8.343 836 HE1 PHE 763 HE1 PHE 763 -0.210 8.500 -12.986 837 HE2 PHE 763 HE2 PHE 763 -1.041 11.375 -9.905 838 HZ PHE 763 HZ PHE 763 -1.356 10.565 -12.227 839 HA PRO 764 HA PRO 764 3.261 3.460 -6.659 840 HB2 PRO 764 HB2 PRO 764 4.975 2.565 -8.564 841 HB3 PRO 764 HB3 PRO 764 3.267 2.084 -8.529 842 HG2 PRO 764 HG2 PRO 764 4.619 4.150 -10.190 843 HG3 PRO 764 HG3 PRO 764 3.396 2.964 -10.651 844 HD2 PRO 764 HD2 PRO 764 2.800 5.577 -10.142 845 HD3 PRO 764 HD3 PRO 764 1.648 4.249 -9.870 846 H PHE 765 H PHE 765 5.977 2.956 -6.872 847 HA PHE 765 HA PHE 765 7.150 5.648 -6.511 848 HB2 PHE 765 HB2 PHE 765 8.379 4.928 -4.657 849 HB3 PHE 765 HB3 PHE 765 6.804 4.178 -4.432 850 HD1 PHE 765 HD1 PHE 765 6.469 1.776 -5.031 851 HD2 PHE 765 HD2 PHE 765 10.348 3.609 -5.001 852 HE1 PHE 765 HE1 PHE 765 7.524 -0.462 -4.968 853 HE2 PHE 765 HE2 PHE 765 11.406 1.368 -4.937 854 HZ PHE 765 HZ PHE 765 9.992 -0.669 -4.919 855 H LYS 766 H LYS 766 7.470 2.526 -8.044 856 HA LYS 766 HA LYS 766 10.267 2.970 -8.716 857 HB2 LYS 766 HB2 LYS 766 8.377 0.977 -9.974 858 HB3 LYS 766 HB3 LYS 766 10.134 0.947 -10.003 859 HG2 LYS 766 HG2 LYS 766 9.567 1.102 -7.298 860 HG3 LYS 766 HG3 LYS 766 8.296 0.048 -7.899 861 HD2 LYS 766 HD2 LYS 766 10.927 -0.583 -9.026 862 HD3 LYS 766 HD3 LYS 766 10.869 -0.740 -7.274 863 HE2 LYS 766 HE2 LYS 766 10.131 -2.849 -7.893 864 HE3 LYS 766 HE3 LYS 766 8.590 -2.000 -7.786 865 HZ1 LYS 766 HZ1 LYS 766 9.450 -1.470 -10.314 866 HZ2 LYS 766 HZ2 LYS 766 9.912 -3.089 -10.089 867 HZ3 LYS 766 HZ3 LYS 766 8.275 -2.642 -9.895 868 H GLU 767 H GLU 767 7.143 3.665 -10.040 869 HA GLU 767 HA GLU 767 7.204 4.041 -12.630 870 HB2 GLU 767 HB2 GLU 767 5.991 5.444 -10.492 871 HB3 GLU 767 HB3 GLU 767 6.633 6.662 -11.588 872 HG2 GLU 767 HG2 GLU 767 5.560 4.968 -13.393 873 HG3 GLU 767 HG3 GLU 767 4.477 4.670 -12.043 874 H1 ASP 338 H1 ASP 338 9.004 3.780 17.628 875 H2 ASP 338 H2 ASP 338 8.990 3.601 17.374 876 H3 ASP 338 H3 ASP 338 8.786 2.224 18.364 877 HA ASP 338 HA ASP 338 6.890 1.898 17.245 878 HB2 ASP 338 HB2 ASP 338 5.043 3.602 18.083 879 HB3 ASP 338 HB3 ASP 338 5.765 2.458 19.210 880 H THR 339 H THR 339 7.122 5.449 17.401 881 HA THR 339 HA THR 339 5.760 6.169 15.134 882 HB THR 339 HB THR 339 6.595 7.861 16.610 883 HG1 THR 339 HG1 THR 339 7.312 7.838 13.943 884 HG21 THR 339 HG21 THR 339 9.384 7.142 15.671 885 HG22 THR 339 HG22 THR 339 8.951 8.349 16.879 886 HG23 THR 339 HG23 THR 339 8.705 6.638 17.217 887 H GLU 340 H GLU 340 8.713 4.393 15.148 888 HA GLU 340 HA GLU 340 9.514 5.204 12.473 889 HB2 GLU 340 HB2 GLU 340 10.571 2.726 13.781 890 HB3 GLU 340 HB3 GLU 340 11.407 3.909 12.778 891 HG2 GLU 340 HG2 GLU 340 12.245 4.429 14.891 892 HG3 GLU 340 HG3 GLU 340 10.888 5.546 14.775 893 H VAL 341 H VAL 341 7.424 2.832 13.870 894 HA VAL 341 HA VAL 341 7.296 1.390 11.279 895 HB VAL 341 HB VAL 341 7.882 0.307 13.678 896 HG11 VAL 341 HG11 VAL 341 5.982 -0.662 14.734 897 HG12 VAL 341 HG12 VAL 341 5.559 1.032 14.487 898 HG13 VAL 341 HG13 VAL 341 4.913 -0.206 13.409 899 HG21 VAL 341 HG21 VAL 341 6.487 -0.748 11.245 900 HG22 VAL 341 HG22 VAL 341 8.107 -1.096 11.843 901 HG23 VAL 341 HG23 VAL 341 6.703 -1.819 12.626 902 H PTR 342 H PTR 342 5.076 0.378 10.888 903 HA PTR 342 HA PTR 342 3.126 2.425 10.658 904 HB2 PTR 342 HB2 PTR 342 1.759 -0.026 10.430 905 HB3 PTR 342 HB3 PTR 342 2.430 0.939 9.115 906 HD1 PTR 342 HD1 PTR 342 3.414 -1.589 11.692 907 HD2 PTR 342 HD2 PTR 342 4.168 0.078 7.806 908 HE1 PTR 342 HE1 PTR 342 5.153 -3.307 11.290 909 HE2 PTR 342 HE2 PTR 342 5.897 -1.652 7.406 910 H GLU 343 H GLU 343 2.949 3.218 12.773 911 HA GLU 343 HA GLU 343 2.129 1.785 15.051 912 HB2 GLU 343 HB2 GLU 343 1.494 4.017 15.917 913 HB3 GLU 343 HB3 GLU 343 3.085 4.030 15.158 914 HG2 GLU 343 HG2 GLU 343 0.625 4.724 13.552 915 HG3 GLU 343 HG3 GLU 343 1.398 5.938 14.563 916 H SER 344 H SER 344 0.541 0.783 12.981 917 HA SER 344 HA SER 344 -1.658 0.486 12.268 918 HB2 SER 344 HB2 SER 344 -1.922 -0.844 14.145 919 HB3 SER 344 HB3 SER 344 -1.626 0.486 15.260 920 HG SER 344 HG SER 344 -3.689 1.359 14.354 921 HA PRO 345 HA PRO 345 -2.578 5.126 12.594 922 HB2 PRO 345 HB2 PRO 345 -2.975 4.639 9.678 923 HB3 PRO 345 HB3 PRO 345 -2.162 5.985 10.498 924 HG2 PRO 345 HG2 PRO 345 -0.786 4.079 9.241 925 HG3 PRO 345 HG3 PRO 345 -0.193 4.832 10.731 926 HD2 PRO 345 HD2 PRO 345 -1.383 2.117 10.340 927 HD3 PRO 345 HD3 PRO 345 -0.133 2.652 11.486 928 H PTR 346 H PTR 346 -4.166 2.959 10.237 929 HA PTR 346 HA PTR 346 -6.763 3.503 11.537 930 HB2 PTR 346 HB2 PTR 346 -6.711 3.212 8.576 931 HB3 PTR 346 HB3 PTR 346 -7.766 4.195 9.594 932 HD1 PTR 346 HD1 PTR 346 -5.273 4.443 7.195 933 HD2 PTR 346 HD2 PTR 346 -6.299 5.970 11.078 934 HE1 PTR 346 HE1 PTR 346 -3.838 6.439 6.805 935 HE2 PTR 346 HE2 PTR 346 -4.875 7.953 10.681 936 H ALA 347 H ALA 347 -8.164 1.799 11.621 937 HA ALA 347 HA ALA 347 -8.280 -0.442 10.022 938 HB1 ALA 347 HB1 ALA 347 -7.097 -2.074 11.721 939 HB2 ALA 347 HB2 ALA 347 -6.165 -0.633 12.134 940 HB3 ALA 347 HB3 ALA 347 -6.153 -1.246 10.481 941 H ASP 348 H ASP 348 -7.841 -0.826 13.490 942 HA ASP 348 HA ASP 348 -10.767 -0.875 13.845 943 HB2 ASP 348 HB2 ASP 348 -8.848 -2.945 14.945 944 HB3 ASP 348 HB3 ASP 348 -10.597 -2.924 15.150 945 HA PRO 349 HA PRO 349 -8.479 1.333 17.314 946 HB2 PRO 349 HB2 PRO 349 -8.761 3.925 16.603 947 HB3 PRO 349 HB3 PRO 349 -7.443 2.927 15.955 948 HG2 PRO 349 HG2 PRO 349 -9.989 3.768 14.677 949 HG3 PRO 349 HG3 PRO 349 -8.376 3.579 13.969 950 HD2 PRO 349 HD2 PRO 349 -10.442 1.704 13.773 951 HD3 PRO 349 HD3 PRO 349 -8.721 1.368 13.498 952 H GLU 350 H GLU 350 -9.743 1.543 19.089 953 HA GLU 350 HA GLU 350 -11.468 2.097 20.490 954 HB2 GLU 350 HB2 GLU 350 -12.173 3.894 18.168 955 HB3 GLU 350 HB3 GLU 350 -13.178 3.794 19.608 956 HG2 GLU 350 HG2 GLU 350 -11.778 5.538 20.211 957 HG3 GLU 350 HG3 GLU 350 -10.859 4.179 20.849 Start of MODEL 2 1 H1 GLY 661 H1 GLY 661 4.451 -15.272 -9.280 2 H2 GLY 661 H2 GLY 661 4.965 -15.131 -10.899 3 H3 GLY 661 H3 GLY 661 5.792 -16.167 -9.830 4 HA2 GLY 661 HA2 GLY 661 4.406 -17.495 -11.276 5 HA3 GLY 661 HA3 GLY 661 3.793 -17.554 -9.627 6 H HIS 662 H HIS 662 3.382 -14.570 -11.389 7 HA HIS 662 HA HIS 662 1.524 -13.520 -12.265 8 HB2 HIS 662 HB2 HIS 662 0.110 -16.155 -12.575 9 HB3 HIS 662 HB3 HIS 662 0.059 -14.740 -13.624 10 HD1 HIS 662 HD1 HIS 662 1.873 -17.900 -13.030 11 HD2 HIS 662 HD2 HIS 662 2.479 -14.414 -15.231 12 HE1 HIS 662 HE1 HIS 662 3.734 -18.411 -14.686 13 HE2 HIS 662 HE2 HIS 662 4.108 -16.290 -16.032 14 H MET 663 H MET 663 0.544 -16.272 -10.227 15 HA MET 663 HA MET 663 -1.895 -15.651 -9.351 16 HB2 MET 663 HB2 MET 663 0.455 -16.824 -8.040 17 HB3 MET 663 HB3 MET 663 -0.737 -16.159 -6.923 18 HG2 MET 663 HG2 MET 663 -1.722 -18.200 -7.217 19 HG3 MET 663 HG3 MET 663 -2.400 -17.414 -8.641 20 HE1 MET 663 HE1 MET 663 -2.459 -20.194 -8.328 21 HE2 MET 663 HE2 MET 663 -1.291 -21.229 -9.142 22 HE3 MET 663 HE3 MET 663 -0.941 -20.589 -7.534 23 H GLN 664 H GLN 664 0.946 -14.205 -7.735 24 HA GLN 664 HA GLN 664 -0.479 -11.694 -7.492 25 HB2 GLN 664 HB2 GLN 664 -1.308 -13.099 -5.583 26 HB3 GLN 664 HB3 GLN 664 0.346 -13.164 -4.980 27 HG2 GLN 664 HG2 GLN 664 -1.164 -11.356 -3.967 28 HG3 GLN 664 HG3 GLN 664 0.401 -10.824 -4.560 29 HE21 GLN 664 HE21 GLN 664 -2.437 -11.569 -6.621 30 HE22 GLN 664 HE22 GLN 664 -2.624 -9.980 -7.189 31 H ASP 665 H ASP 665 1.886 -12.432 -8.824 32 HA ASP 665 HA ASP 665 4.246 -11.895 -7.401 33 HB2 ASP 665 HB2 ASP 665 3.678 -11.189 -10.287 34 HB3 ASP 665 HB3 ASP 665 5.256 -11.446 -9.557 35 H LEU 666 H LEU 666 4.838 -10.086 -6.366 36 HA LEU 666 HA LEU 666 3.494 -7.572 -7.029 37 HB2 LEU 666 HB2 LEU 666 5.404 -8.107 -4.754 38 HB3 LEU 666 HB3 LEU 666 4.249 -6.782 -4.907 39 HG LEU 666 HG LEU 666 3.435 -9.697 -4.817 40 HD11 LEU 666 HD11 LEU 666 2.712 -9.124 -2.472 41 HD12 LEU 666 HD12 LEU 666 4.459 -9.179 -2.699 42 HD13 LEU 666 HD13 LEU 666 3.630 -7.626 -2.619 43 HD21 LEU 666 HD21 LEU 666 1.748 -8.357 -5.848 44 HD22 LEU 666 HD22 LEU 666 1.236 -8.565 -4.176 45 HD23 LEU 666 HD23 LEU 666 1.976 -7.048 -4.687 46 H SER 667 H SER 667 6.639 -9.072 -7.024 47 HA SER 667 HA SER 667 8.236 -6.795 -7.444 48 HB2 SER 667 HB2 SER 667 8.649 -9.657 -8.307 49 HB3 SER 667 HB3 SER 667 9.888 -8.404 -8.364 50 HG SER 667 HG SER 667 10.145 -9.361 -6.404 51 H VAL 668 H VAL 668 5.788 -7.855 -9.374 52 HA VAL 668 HA VAL 668 7.135 -7.152 -11.893 53 HB VAL 668 HB VAL 668 5.222 -8.084 -13.012 54 HG11 VAL 668 HG11 VAL 668 6.896 -9.673 -12.082 55 HG12 VAL 668 HG12 VAL 668 5.909 -9.824 -10.629 56 HG13 VAL 668 HG13 VAL 668 5.283 -10.381 -12.181 57 HG21 VAL 668 HG21 VAL 668 3.239 -7.625 -11.974 58 HG22 VAL 668 HG22 VAL 668 3.520 -9.166 -11.165 59 HG23 VAL 668 HG23 VAL 668 3.962 -7.658 -10.367 60 H HIS 669 H HIS 669 5.571 -5.698 -9.424 61 HA HIS 669 HA HIS 669 4.157 -3.691 -11.047 62 HB2 HIS 669 HB2 HIS 669 4.349 -3.962 -8.037 63 HB3 HIS 669 HB3 HIS 669 3.280 -2.880 -8.926 64 HD1 HIS 669 HD1 HIS 669 2.205 -4.765 -11.074 65 HD2 HIS 669 HD2 HIS 669 2.586 -5.842 -7.073 66 HE1 HIS 669 HE1 HIS 669 0.551 -6.644 -10.680 67 HE2 HIS 669 HE2 HIS 669 0.658 -7.223 -8.196 68 H LEU 670 H LEU 670 4.380 -1.432 -9.865 69 HA LEU 670 HA LEU 670 7.261 -0.856 -9.636 70 HB2 LEU 670 HB2 LEU 670 6.567 1.483 -10.441 71 HB3 LEU 670 HB3 LEU 670 6.667 0.209 -11.629 72 HG LEU 670 HG LEU 670 4.118 1.107 -10.272 73 HD11 LEU 670 HD11 LEU 670 5.125 1.610 -13.089 74 HD12 LEU 670 HD12 LEU 670 3.594 2.168 -12.415 75 HD13 LEU 670 HD13 LEU 670 5.116 2.805 -11.794 76 HD21 LEU 670 HD21 LEU 670 3.604 -0.192 -12.723 77 HD22 LEU 670 HD22 LEU 670 4.794 -1.199 -11.904 78 HD23 LEU 670 HD23 LEU 670 3.265 -0.813 -11.110 79 H TRP 671 H TRP 671 4.358 -0.974 -8.021 80 HA TRP 671 HA TRP 671 5.175 1.196 -6.236 81 HB2 TRP 671 HB2 TRP 671 2.867 0.811 -5.190 82 HB3 TRP 671 HB3 TRP 671 2.923 1.568 -6.774 83 HD1 TRP 671 HD1 TRP 671 1.497 0.506 -8.582 84 HE1 TRP 671 HE1 TRP 671 0.172 -1.701 -8.847 85 HE3 TRP 671 HE3 TRP 671 3.086 -1.944 -4.386 86 HZ2 TRP 671 HZ2 TRP 671 -0.107 -4.191 -7.455 87 HZ3 TRP 671 HZ3 TRP 671 2.278 -4.233 -3.887 88 HH2 TRP 671 HH2 TRP 671 0.681 -5.355 -5.416 89 H TYR 672 H TYR 672 5.629 -2.002 -6.611 90 HA TYR 672 HA TYR 672 5.347 -2.751 -3.795 91 HB2 TYR 672 HB2 TYR 672 4.658 -4.379 -5.492 92 HB3 TYR 672 HB3 TYR 672 6.279 -4.356 -6.189 93 HD1 TYR 672 HD2 TYR 672 4.722 -4.695 -2.783 94 HD2 TYR 672 HD1 TYR 672 7.687 -6.100 -5.559 95 HE1 TYR 672 HE2 TYR 672 5.463 -6.393 -1.137 96 HE2 TYR 672 HE1 TYR 672 8.421 -7.799 -3.908 97 HH TYR 672 HH TYR 672 7.525 -8.974 -1.963 98 H ALA 673 H ALA 673 6.920 -2.277 -2.420 99 HA ALA 673 HA ALA 673 9.695 -2.054 -3.415 100 HB1 ALA 673 HB1 ALA 673 8.576 -1.215 -0.727 101 HB2 ALA 673 HB2 ALA 673 8.687 -0.141 -2.124 102 HB3 ALA 673 HB3 ALA 673 10.154 -0.802 -1.400 103 H GLY 674 H GLY 674 7.568 -3.942 -1.500 104 HA2 GLY 674 HA2 GLY 674 7.844 -5.761 -0.118 105 HA3 GLY 674 HA3 GLY 674 9.070 -6.223 -1.288 106 HA PRO 675 HA PRO 675 11.890 -6.162 2.120 107 HB2 PRO 675 HB2 PRO 675 14.224 -5.898 0.633 108 HB3 PRO 675 HB3 PRO 675 13.378 -7.427 0.933 109 HG2 PRO 675 HG2 PRO 675 13.313 -5.664 -1.460 110 HG3 PRO 675 HG3 PRO 675 13.299 -7.433 -1.358 111 HD2 PRO 675 HD2 PRO 675 11.052 -6.007 -1.873 112 HD3 PRO 675 HD3 PRO 675 11.011 -7.524 -0.945 113 H MET 676 H MET 676 10.735 -3.864 2.274 114 HA MET 676 HA MET 676 12.918 -1.867 2.321 115 HB2 MET 676 HB2 MET 676 11.356 -1.443 0.396 116 HB3 MET 676 HB3 MET 676 10.062 -1.224 1.572 117 HG2 MET 676 HG2 MET 676 11.150 0.952 0.890 118 HG3 MET 676 HG3 MET 676 11.219 0.637 2.615 119 HE1 MET 676 HE1 MET 676 12.887 -0.200 -0.671 120 HE2 MET 676 HE2 MET 676 13.367 1.489 -0.545 121 HE3 MET 676 HE3 MET 676 14.585 0.212 -0.460 122 H GLU 677 H GLU 677 12.485 -0.053 3.768 123 HA GLU 677 HA GLU 677 11.011 -0.903 6.182 124 HB2 GLU 677 HB2 GLU 677 12.541 0.690 7.366 125 HB3 GLU 677 HB3 GLU 677 13.371 -0.680 6.618 126 HG2 GLU 677 HG2 GLU 677 14.490 0.659 5.167 127 HG3 GLU 677 HG3 GLU 677 13.054 1.617 4.816 128 H ARG 678 H ARG 678 10.195 0.955 7.522 129 HA ARG 678 HA ARG 678 8.297 2.470 6.168 130 HB2 ARG 678 HB2 ARG 678 8.461 1.954 8.680 131 HB3 ARG 678 HB3 ARG 678 9.540 3.346 8.774 132 HG2 ARG 678 HG2 ARG 678 7.464 4.381 7.314 133 HG3 ARG 678 HG3 ARG 678 6.614 3.256 8.372 134 HD2 ARG 678 HD2 ARG 678 6.751 4.795 10.005 135 HD3 ARG 678 HD3 ARG 678 8.496 4.551 10.018 136 HE ARG 678 HE ARG 678 8.184 6.298 7.954 137 HH11 ARG 678 HH21 ARG 678 7.007 6.199 11.220 138 HH12 ARG 678 HH22 ARG 678 6.906 7.930 11.370 139 HH21 ARG 678 HH11 ARG 678 8.183 8.520 8.173 140 HH22 ARG 678 HH12 ARG 678 7.607 9.241 9.656 141 H ALA 679 H ALA 679 11.326 3.728 7.599 142 HA ALA 679 HA ALA 679 11.126 6.305 6.488 143 HB1 ALA 679 HB1 ALA 679 13.070 6.673 7.596 144 HB2 ALA 679 HB2 ALA 679 13.850 5.262 6.881 145 HB3 ALA 679 HB3 ALA 679 12.789 5.069 8.276 146 H GLY 680 H GLY 680 12.406 3.289 5.256 147 HA2 GLY 680 HA2 GLY 680 13.775 4.413 2.999 148 HA3 GLY 680 HA3 GLY 680 13.315 2.722 3.197 149 H ALA 681 H ALA 681 10.614 2.932 3.561 150 HA ALA 681 HA ALA 681 9.627 3.043 0.940 151 HB1 ALA 681 HB1 ALA 681 8.649 1.951 3.101 152 HB2 ALA 681 HB2 ALA 681 7.543 2.547 1.866 153 HB3 ALA 681 HB3 ALA 681 7.847 3.505 3.315 154 H GLU 682 H GLU 682 9.269 5.440 3.590 155 HA GLU 682 HA GLU 682 7.906 7.291 1.862 156 HB2 GLU 682 HB2 GLU 682 8.100 8.864 3.760 157 HB3 GLU 682 HB3 GLU 682 7.424 7.309 4.236 158 HG2 GLU 682 HG2 GLU 682 9.930 6.703 4.751 159 HG3 GLU 682 HG3 GLU 682 10.129 8.442 4.824 160 H SER 683 H SER 683 11.165 6.500 2.292 161 HA SER 683 HA SER 683 12.435 8.971 1.990 162 HB2 SER 683 HB2 SER 683 14.356 7.755 1.299 163 HB3 SER 683 HB3 SER 683 13.506 6.684 2.410 164 HG SER 683 HG SER 683 12.776 5.483 0.727 165 H ILE 684 H ILE 684 11.167 6.722 -0.397 166 HA ILE 684 HA ILE 684 11.866 8.429 -2.634 167 HB ILE 684 HB ILE 684 9.927 6.135 -2.799 168 HG12 ILE 684 HG12 ILE 684 12.541 5.134 -3.237 169 HG13 ILE 684 HG13 ILE 684 12.608 6.003 -1.705 170 HG21 ILE 684 HG21 ILE 684 11.578 7.736 -4.601 171 HG22 ILE 684 HG22 ILE 684 11.857 6.009 -4.814 172 HG23 ILE 684 HG23 ILE 684 10.230 6.665 -4.976 173 HD11 ILE 684 HD11 ILE 684 10.369 4.729 -1.196 174 HD12 ILE 684 HD12 ILE 684 10.924 3.632 -2.459 175 HD13 ILE 684 HD13 ILE 684 11.907 3.885 -1.018 176 H LEU 685 H LEU 685 8.867 7.352 -1.069 177 HA LEU 685 HA LEU 685 7.070 8.862 -2.606 178 HB2 LEU 685 HB2 LEU 685 7.031 7.457 0.003 179 HB3 LEU 685 HB3 LEU 685 5.778 8.668 -0.244 180 HG LEU 685 HG LEU 685 4.916 7.551 -2.147 181 HD11 LEU 685 HD11 LEU 685 7.584 6.154 -2.155 182 HD12 LEU 685 HD12 LEU 685 6.195 5.428 -2.961 183 HD13 LEU 685 HD13 LEU 685 6.781 7.008 -3.470 184 HD21 LEU 685 HD21 LEU 685 4.885 5.061 -1.320 185 HD22 LEU 685 HD22 LEU 685 5.746 5.708 0.075 186 HD23 LEU 685 HD23 LEU 685 4.139 6.312 -0.328 187 H ALA 686 H ALA 686 8.733 9.710 0.461 188 HA ALA 686 HA ALA 686 7.411 12.197 0.784 189 HB1 ALA 686 HB1 ALA 686 10.191 11.439 1.699 190 HB2 ALA 686 HB2 ALA 686 8.698 11.091 2.573 191 HB3 ALA 686 HB3 ALA 686 9.202 12.761 2.322 192 H ASN 687 H ASN 687 10.281 11.224 -0.999 193 HA ASN 687 HA ASN 687 11.085 13.867 -1.761 194 HB2 ASN 687 HB2 ASN 687 12.902 12.683 -2.354 195 HB3 ASN 687 HB3 ASN 687 12.032 11.177 -2.102 196 HD21 ASN 687 HD21 ASN 687 12.143 13.796 -4.593 197 HD22 ASN 687 HD22 ASN 687 12.085 12.728 -5.909 198 H ARG 688 H ARG 688 9.033 11.362 -3.140 199 HA ARG 688 HA ARG 688 8.597 12.647 -5.661 200 HB2 ARG 688 HB2 ARG 688 7.716 10.231 -4.279 201 HB3 ARG 688 HB3 ARG 688 6.439 10.967 -5.239 202 HG2 ARG 688 HG2 ARG 688 7.560 9.505 -6.737 203 HG3 ARG 688 HG3 ARG 688 8.163 11.116 -7.136 204 HD2 ARG 688 HD2 ARG 688 10.165 10.754 -5.841 205 HD3 ARG 688 HD3 ARG 688 9.554 9.221 -5.227 206 HE ARG 688 HE ARG 688 9.522 8.864 -7.928 207 HH11 ARG 688 HH21 ARG 688 11.899 9.950 -5.655 208 HH12 ARG 688 HH22 ARG 688 13.230 9.330 -6.585 209 HH21 ARG 688 HH11 ARG 688 11.250 8.063 -9.107 210 HH22 ARG 688 HH12 ARG 688 12.863 8.267 -8.525 211 H SER 689 H SER 689 6.144 12.918 -6.306 212 HA SER 689 HA SER 689 5.156 15.138 -4.719 213 HB2 SER 689 HB2 SER 689 3.323 14.849 -6.683 214 HB3 SER 689 HB3 SER 689 4.846 15.708 -6.904 215 HG SER 689 HG SER 689 4.004 13.532 -8.156 216 H ASP 690 H ASP 690 2.812 15.310 -4.261 217 HA ASP 690 HA ASP 690 1.924 13.277 -2.554 218 HB2 ASP 690 HB2 ASP 690 0.844 15.786 -3.634 219 HB3 ASP 690 HB3 ASP 690 -0.376 14.594 -3.193 220 H GLY 691 H GLY 691 0.716 11.513 -2.805 221 HA2 GLY 691 HA2 GLY 691 -1.070 10.303 -3.935 222 HA3 GLY 691 HA3 GLY 691 -0.528 11.020 -5.451 223 H THR 692 H THR 692 2.302 10.582 -4.336 224 HA THR 692 HA THR 692 2.828 8.157 -5.732 225 HB THR 692 HB THR 692 4.688 9.421 -3.711 226 HG1 THR 692 HG1 THR 692 4.107 11.139 -4.959 227 HG21 THR 692 HG21 THR 692 5.400 8.311 -6.403 228 HG22 THR 692 HG22 THR 692 6.374 8.388 -4.936 229 HG23 THR 692 HG23 THR 692 5.076 7.200 -5.071 230 H PHE 693 H PHE 693 2.854 6.083 -5.010 231 HA PHE 693 HA PHE 693 2.874 5.635 -2.097 232 HB2 PHE 693 HB2 PHE 693 0.929 4.251 -2.149 233 HB3 PHE 693 HB3 PHE 693 0.509 5.763 -2.946 234 HD1 PHE 693 HD2 PHE 693 1.258 2.187 -3.457 235 HD2 PHE 693 HD1 PHE 693 0.121 5.872 -5.337 236 HE1 PHE 693 HE2 PHE 693 0.611 0.946 -5.503 237 HE2 PHE 693 HE1 PHE 693 -0.529 4.631 -7.384 238 HZ PHE 693 HZ PHE 693 -0.280 2.166 -7.467 239 H LEU 694 H LEU 694 3.077 3.334 -1.527 240 HA LEU 694 HA LEU 694 4.046 1.486 -3.496 241 HB2 LEU 694 HB2 LEU 694 6.342 1.384 -2.916 242 HB3 LEU 694 HB3 LEU 694 5.996 3.099 -3.130 243 HG LEU 694 HG LEU 694 5.478 3.018 -0.549 244 HD11 LEU 694 HD11 LEU 694 7.542 1.285 0.135 245 HD12 LEU 694 HD12 LEU 694 5.823 0.965 0.347 246 HD13 LEU 694 HD13 LEU 694 6.655 0.392 -1.096 247 HD21 LEU 694 HD21 LEU 694 7.220 4.420 -1.180 248 HD22 LEU 694 HD22 LEU 694 8.085 3.224 -0.224 249 HD23 LEU 694 HD23 LEU 694 8.109 3.126 -1.982 250 H VAL 695 H VAL 695 4.909 -0.523 -2.431 251 HA VAL 695 HA VAL 695 3.754 -0.909 0.265 252 HB VAL 695 HB VAL 695 3.456 -2.788 -2.086 253 HG11 VAL 695 HG11 VAL 695 1.998 -4.025 -0.461 254 HG12 VAL 695 HG12 VAL 695 3.701 -4.031 -0.016 255 HG13 VAL 695 HG13 VAL 695 2.575 -2.955 0.810 256 HG21 VAL 695 HG21 VAL 695 1.671 -1.464 -2.538 257 HG22 VAL 695 HG22 VAL 695 0.954 -2.129 -1.070 258 HG23 VAL 695 HG23 VAL 695 1.828 -0.600 -1.010 259 H ARG 696 H ARG 696 4.969 -2.084 1.654 260 HA ARG 696 HA ARG 696 7.397 -3.387 0.554 261 HB2 ARG 696 HB2 ARG 696 8.566 -2.721 2.630 262 HB3 ARG 696 HB3 ARG 696 8.017 -1.334 1.690 263 HG2 ARG 696 HG2 ARG 696 6.018 -1.151 3.143 264 HG3 ARG 696 HG3 ARG 696 6.603 -2.514 4.100 265 HD2 ARG 696 HD2 ARG 696 8.316 -0.074 3.653 266 HD3 ARG 696 HD3 ARG 696 7.133 -0.129 4.955 267 HE ARG 696 HE ARG 696 9.385 -2.065 4.669 268 HH11 ARG 696 HH21 ARG 696 7.238 -0.146 6.605 269 HH12 ARG 696 HH22 ARG 696 7.869 -0.745 8.098 270 HH21 ARG 696 HH11 ARG 696 10.172 -2.805 6.585 271 HH22 ARG 696 HH12 ARG 696 9.529 -2.237 8.092 272 H GLN 697 H GLN 697 8.396 -4.940 2.123 273 HA GLN 697 HA GLN 697 6.349 -6.498 3.598 274 HB2 GLN 697 HB2 GLN 697 6.623 -7.785 1.655 275 HB3 GLN 697 HB3 GLN 697 8.329 -7.383 1.510 276 HG2 GLN 697 HG2 GLN 697 8.071 -9.706 2.249 277 HG3 GLN 697 HG3 GLN 697 8.811 -8.749 3.526 278 HE21 GLN 697 HE21 GLN 697 5.442 -9.554 2.476 279 HE22 GLN 697 HE22 GLN 697 4.888 -9.866 4.049 280 H ARG 698 H ARG 698 6.989 -7.249 5.569 281 HA ARG 698 HA ARG 698 9.719 -7.636 6.306 282 HB2 ARG 698 HB2 ARG 698 9.044 -4.988 6.355 283 HB3 ARG 698 HB3 ARG 698 8.660 -5.469 8.006 284 HG2 ARG 698 HG2 ARG 698 11.257 -6.418 6.857 285 HG3 ARG 698 HG3 ARG 698 11.134 -4.720 7.310 286 HD2 ARG 698 HD2 ARG 698 11.944 -5.924 9.240 287 HD3 ARG 698 HD3 ARG 698 10.278 -5.453 9.558 288 HE ARG 698 HE ARG 698 9.597 -7.714 9.303 289 HH11 ARG 698 HH21 ARG 698 12.981 -7.246 8.777 290 HH12 ARG 698 HH22 ARG 698 13.367 -8.923 8.902 291 HH21 ARG 698 HH11 ARG 698 10.100 -9.906 9.443 292 HH22 ARG 698 HH12 ARG 698 11.754 -10.418 9.279 293 H VAL 699 H VAL 699 7.400 -9.213 6.437 294 HA VAL 699 HA VAL 699 5.925 -9.329 8.734 295 HB VAL 699 HB VAL 699 5.778 -10.993 6.930 296 HG11 VAL 699 HG11 VAL 699 8.487 -11.177 7.114 297 HG12 VAL 699 HG12 VAL 699 8.012 -12.611 8.024 298 HG13 VAL 699 HG13 VAL 699 7.478 -12.408 6.356 299 HG21 VAL 699 HG21 VAL 699 5.002 -12.666 8.317 300 HG22 VAL 699 HG22 VAL 699 6.447 -12.647 9.327 301 HG23 VAL 699 HG23 VAL 699 5.217 -11.397 9.522 302 H LYS 700 H LYS 700 6.277 -9.567 10.859 303 HA LYS 700 HA LYS 700 8.555 -10.938 11.954 304 HB2 LYS 700 HB2 LYS 700 9.640 -9.039 13.016 305 HB3 LYS 700 HB3 LYS 700 9.585 -8.758 11.277 306 HG2 LYS 700 HG2 LYS 700 7.451 -7.437 11.656 307 HG3 LYS 700 HG3 LYS 700 7.772 -7.557 13.387 308 HD2 LYS 700 HD2 LYS 700 10.093 -6.572 12.841 309 HD3 LYS 700 HD3 LYS 700 9.400 -6.142 11.277 310 HE2 LYS 700 HE2 LYS 700 8.235 -5.337 13.961 311 HE3 LYS 700 HE3 LYS 700 9.209 -4.286 12.929 312 HZ1 LYS 700 HZ1 LYS 700 7.488 -4.922 11.140 313 HZ2 LYS 700 HZ2 LYS 700 6.476 -5.353 12.472 314 HZ3 LYS 700 HZ3 LYS 700 7.076 -3.753 12.301 315 H ASP 701 H ASP 701 6.174 -8.403 12.628 316 HA ASP 701 HA ASP 701 5.723 -9.315 15.339 317 HB2 ASP 701 HB2 ASP 701 3.789 -7.531 15.003 318 HB3 ASP 701 HB3 ASP 701 5.463 -7.011 15.189 319 H ALA 702 H ALA 702 3.407 -8.629 12.766 320 HA ALA 702 HA ALA 702 2.283 -11.289 12.744 321 HB1 ALA 702 HB1 ALA 702 0.756 -9.035 14.072 322 HB2 ALA 702 HB2 ALA 702 1.276 -10.547 14.820 323 HB3 ALA 702 HB3 ALA 702 0.033 -10.564 13.568 324 H ALA 703 H ALA 703 2.993 -8.425 11.340 325 HA ALA 703 HA ALA 703 0.721 -8.359 9.489 326 HB1 ALA 703 HB1 ALA 703 1.355 -6.201 10.203 327 HB2 ALA 703 HB2 ALA 703 2.040 -6.352 8.585 328 HB3 ALA 703 HB3 ALA 703 3.072 -6.546 10.003 329 H GLU 704 H GLU 704 1.181 -8.115 7.178 330 HA GLU 704 HA GLU 704 3.290 -9.992 6.304 331 HB2 GLU 704 HB2 GLU 704 0.502 -9.724 5.670 332 HB3 GLU 704 HB3 GLU 704 1.440 -9.433 4.207 333 HG2 GLU 704 HG2 GLU 704 2.516 -11.687 5.700 334 HG3 GLU 704 HG3 GLU 704 0.813 -11.929 5.321 335 H PHE 705 H PHE 705 1.529 -7.573 4.425 336 HA PHE 705 HA PHE 705 4.119 -6.346 3.680 337 HB2 PHE 705 HB2 PHE 705 1.468 -6.357 2.216 338 HB3 PHE 705 HB3 PHE 705 2.910 -5.497 1.685 339 HD1 PHE 705 HD2 PHE 705 4.907 -6.707 0.931 340 HD2 PHE 705 HD1 PHE 705 1.323 -8.783 2.055 341 HE1 PHE 705 HE2 PHE 705 5.748 -8.763 -0.174 342 HE2 PHE 705 HE1 PHE 705 2.165 -10.834 0.952 343 HZ PHE 705 HZ PHE 705 4.376 -10.825 -0.162 344 H ALA 706 H ALA 706 4.045 -4.003 3.253 345 HA ALA 706 HA ALA 706 2.001 -2.635 4.893 346 HB1 ALA 706 HB1 ALA 706 4.288 -2.884 6.030 347 HB2 ALA 706 HB2 ALA 706 3.600 -1.262 5.952 348 HB3 ALA 706 HB3 ALA 706 4.872 -1.734 4.829 349 H ILE 707 H ILE 707 0.990 -1.074 3.887 350 HA ILE 707 HA ILE 707 1.910 -0.213 1.240 351 HB ILE 707 HB ILE 707 -0.629 0.599 2.674 352 HG12 ILE 707 HG12 ILE 707 -1.532 -1.259 1.019 353 HG13 ILE 707 HG13 ILE 707 0.101 -1.897 1.182 354 HG21 ILE 707 HG21 ILE 707 -0.164 1.991 0.762 355 HG22 ILE 707 HG22 ILE 707 0.289 0.595 -0.217 356 HG23 ILE 707 HG23 ILE 707 -1.392 0.829 0.260 357 HD11 ILE 707 HD11 ILE 707 -2.047 -2.215 2.991 358 HD12 ILE 707 HD12 ILE 707 -0.380 -2.738 3.209 359 HD13 ILE 707 HD13 ILE 707 -0.891 -1.152 3.780 360 H SER 708 H SER 708 2.451 1.873 0.707 361 HA SER 708 HA SER 708 2.442 3.896 2.855 362 HB2 SER 708 HB2 SER 708 4.839 3.057 1.220 363 HB3 SER 708 HB3 SER 708 4.775 4.548 2.153 364 HG SER 708 HG SER 708 4.598 1.860 3.068 365 H ILE 709 H ILE 709 1.523 5.728 2.116 366 HA ILE 709 HA ILE 709 1.715 6.342 -0.783 367 HB ILE 709 HB ILE 709 -0.612 7.295 0.840 368 HG12 ILE 709 HG12 ILE 709 -1.688 5.100 -0.288 369 HG13 ILE 709 HG13 ILE 709 -0.068 4.483 0.050 370 HG21 ILE 709 HG21 ILE 709 0.189 7.507 -1.837 371 HG22 ILE 709 HG22 ILE 709 -1.115 6.318 -1.852 372 HG23 ILE 709 HG23 ILE 709 -1.392 7.923 -1.173 373 HD11 ILE 709 HD11 ILE 709 -1.521 4.095 1.983 374 HD12 ILE 709 HD12 ILE 709 -0.281 5.282 2.391 375 HD13 ILE 709 HD13 ILE 709 -1.922 5.814 2.038 376 H LYS 710 H LYS 710 2.181 8.398 -1.357 377 HA LYS 710 HA LYS 710 2.994 10.238 0.775 378 HB2 LYS 710 HB2 LYS 710 4.607 10.022 -0.990 379 HB3 LYS 710 HB3 LYS 710 3.370 10.225 -2.226 380 HG2 LYS 710 HG2 LYS 710 4.485 12.322 -2.106 381 HG3 LYS 710 HG3 LYS 710 2.967 12.550 -1.250 382 HD2 LYS 710 HD2 LYS 710 3.980 12.650 0.827 383 HD3 LYS 710 HD3 LYS 710 5.382 11.694 0.324 384 HE2 LYS 710 HE2 LYS 710 4.786 14.472 -0.732 385 HE3 LYS 710 HE3 LYS 710 5.845 14.165 0.647 386 HZ1 LYS 710 HZ1 LYS 710 6.690 12.386 -1.273 387 HZ2 LYS 710 HZ2 LYS 710 6.384 13.816 -2.165 388 HZ3 LYS 710 HZ3 LYS 710 7.473 13.855 -0.844 389 H TYR 711 H TYR 711 1.213 11.208 1.601 390 HA TYR 711 HA TYR 711 -0.420 12.821 -0.246 391 HB2 TYR 711 HB2 TYR 711 -1.600 10.662 0.193 392 HB3 TYR 711 HB3 TYR 711 -1.587 11.048 1.912 393 HD1 TYR 711 HD1 TYR 711 -2.312 12.994 -1.229 394 HD2 TYR 711 HD2 TYR 711 -3.640 11.775 2.666 395 HE1 TYR 711 HE1 TYR 711 -4.382 14.336 -1.512 396 HE2 TYR 711 HE2 TYR 711 -5.710 13.104 2.383 397 HH TYR 711 HH TYR 711 -6.966 13.995 -0.249 398 H ASN 712 H ASN 712 -0.164 14.830 0.415 399 HA ASN 712 HA ASN 712 -0.378 16.666 1.818 400 HB2 ASN 712 HB2 ASN 712 -1.936 15.207 3.222 401 HB3 ASN 712 HB3 ASN 712 -0.515 14.784 4.174 402 HD21 ASN 712 HD21 ASN 712 -0.188 16.099 5.944 403 HD22 ASN 712 HD22 ASN 712 -0.713 17.710 6.068 404 H VAL 713 H VAL 713 1.973 16.033 0.839 405 HA VAL 713 HA VAL 713 4.261 15.969 1.138 406 HB VAL 713 HB VAL 713 5.120 17.760 2.534 407 HG11 VAL 713 HG11 VAL 713 2.897 19.350 1.808 408 HG12 VAL 713 HG12 VAL 713 4.370 19.085 0.874 409 HG13 VAL 713 HG13 VAL 713 2.967 18.043 0.626 410 HG21 VAL 713 HG21 VAL 713 3.557 17.229 4.494 411 HG22 VAL 713 HG22 VAL 713 3.797 18.939 4.142 412 HG23 VAL 713 HG23 VAL 713 2.318 18.133 3.624 413 H GLU 714 H GLU 714 2.957 13.831 2.381 414 HA GLU 714 HA GLU 714 4.991 13.031 4.279 415 HB2 GLU 714 HB2 GLU 714 3.459 12.451 6.076 416 HB3 GLU 714 HB3 GLU 714 3.270 14.168 5.706 417 HG2 GLU 714 HG2 GLU 714 1.263 13.755 4.451 418 HG3 GLU 714 HG3 GLU 714 1.513 12.015 4.494 419 H VAL 715 H VAL 715 4.808 10.726 4.791 420 HA VAL 715 HA VAL 715 3.344 9.265 2.680 421 HB VAL 715 HB VAL 715 5.860 8.357 4.066 422 HG11 VAL 715 HG11 VAL 715 4.421 6.617 3.025 423 HG12 VAL 715 HG12 VAL 715 4.496 7.494 1.495 424 HG13 VAL 715 HG13 VAL 715 5.958 6.787 2.181 425 HG21 VAL 715 HG21 VAL 715 6.581 10.269 2.892 426 HG22 VAL 715 HG22 VAL 715 6.830 8.976 1.723 427 HG23 VAL 715 HG23 VAL 715 5.419 10.020 1.591 428 H LYS 716 H LYS 716 1.618 8.268 3.497 429 HA LYS 716 HA LYS 716 1.567 7.479 6.315 430 HB2 LYS 716 HB2 LYS 716 -0.666 6.948 4.377 431 HB3 LYS 716 HB3 LYS 716 -0.752 7.324 6.098 432 HG2 LYS 716 HG2 LYS 716 0.477 9.574 5.110 433 HG3 LYS 716 HG3 LYS 716 -0.602 9.148 3.779 434 HD2 LYS 716 HD2 LYS 716 -2.524 9.171 5.239 435 HD3 LYS 716 HD3 LYS 716 -1.501 9.365 6.665 436 HE2 LYS 716 HE2 LYS 716 -0.882 11.437 4.757 437 HE3 LYS 716 HE3 LYS 716 -2.618 11.420 5.064 438 HZ1 LYS 716 HZ1 LYS 716 -2.128 11.419 7.459 439 HZ2 LYS 716 HZ2 LYS 716 -0.447 11.548 7.111 440 HZ3 LYS 716 HZ3 LYS 716 -1.517 12.804 6.677 441 H HIS 717 H HIS 717 2.130 5.521 6.984 442 HA HIS 717 HA HIS 717 2.204 3.306 5.047 443 HB2 HIS 717 HB2 HIS 717 3.618 3.358 7.699 444 HB3 HIS 717 HB3 HIS 717 3.950 2.340 6.300 445 HD1 HIS 717 HD1 HIS 717 5.052 3.525 4.190 446 HD2 HIS 717 HD2 HIS 717 4.879 5.846 7.671 447 HE1 HIS 717 HE1 HIS 717 6.729 5.421 3.900 448 HE2 HIS 717 HE2 HIS 717 6.670 6.810 6.030 449 H ILE 718 H ILE 718 1.211 1.423 5.432 450 HA ILE 718 HA ILE 718 -0.065 0.927 8.036 451 HB ILE 718 HB ILE 718 -1.565 0.769 5.411 452 HG12 ILE 718 HG12 ILE 718 -2.780 2.450 7.404 453 HG13 ILE 718 HG13 ILE 718 -1.124 2.985 7.141 454 HG21 ILE 718 HG21 ILE 718 -2.447 -0.935 6.771 455 HG22 ILE 718 HG22 ILE 718 -2.206 -0.008 8.252 456 HG23 ILE 718 HG23 ILE 718 -3.492 0.439 7.131 457 HD11 ILE 718 HD11 ILE 718 -1.726 2.694 4.602 458 HD12 ILE 718 HD12 ILE 718 -3.387 2.811 5.189 459 HD13 ILE 718 HD13 ILE 718 -2.259 4.137 5.466 460 H LYS 719 H LYS 719 -0.160 -1.206 8.583 461 HA LYS 719 HA LYS 719 1.320 -3.062 6.898 462 HB2 LYS 719 HB2 LYS 719 1.066 -4.587 8.873 463 HB3 LYS 719 HB3 LYS 719 1.886 -3.070 9.230 464 HG2 LYS 719 HG2 LYS 719 0.362 -2.650 10.829 465 HG3 LYS 719 HG3 LYS 719 -0.892 -2.592 9.591 466 HD2 LYS 719 HD2 LYS 719 -0.458 -5.316 9.908 467 HD3 LYS 719 HD3 LYS 719 -0.304 -4.696 11.551 468 HE2 LYS 719 HE2 LYS 719 -2.586 -4.927 11.517 469 HE3 LYS 719 HE3 LYS 719 -2.499 -3.329 10.773 470 HZ1 LYS 719 HZ1 LYS 719 -3.899 -4.975 9.545 471 HZ2 LYS 719 HZ2 LYS 719 -2.609 -4.282 8.601 472 HZ3 LYS 719 HZ3 LYS 719 -2.466 -5.866 9.233 473 H ILE 720 H ILE 720 0.419 -4.416 5.521 474 HA ILE 720 HA ILE 720 -2.435 -4.688 5.298 475 HB ILE 720 HB ILE 720 -0.138 -5.190 3.673 476 HG12 ILE 720 HG12 ILE 720 -2.939 -5.679 2.747 477 HG13 ILE 720 HG13 ILE 720 -2.509 -4.069 3.322 478 HG21 ILE 720 HG21 ILE 720 -0.417 -7.581 4.358 479 HG22 ILE 720 HG22 ILE 720 -2.077 -7.525 3.766 480 HG23 ILE 720 HG23 ILE 720 -0.735 -7.326 2.643 481 HD11 ILE 720 HD11 ILE 720 -1.840 -3.784 1.147 482 HD12 ILE 720 HD12 ILE 720 -0.368 -4.555 1.740 483 HD13 ILE 720 HD13 ILE 720 -1.588 -5.511 0.894 484 H MET 721 H MET 721 -3.593 -6.682 5.348 485 HA MET 721 HA MET 721 -2.545 -8.609 7.339 486 HB2 MET 721 HB2 MET 721 -4.792 -7.059 7.525 487 HB3 MET 721 HB3 MET 721 -5.450 -8.538 6.826 488 HG2 MET 721 HG2 MET 721 -5.514 -8.700 9.263 489 HG3 MET 721 HG3 MET 721 -4.317 -9.838 8.643 490 HE1 MET 721 HE1 MET 721 -4.170 -9.697 11.165 491 HE2 MET 721 HE2 MET 721 -2.454 -9.944 10.850 492 HE3 MET 721 HE3 MET 721 -2.977 -8.715 12.009 493 H THR 722 H THR 722 -3.910 -10.792 7.061 494 HA THR 722 HA THR 722 -4.084 -11.450 4.184 495 HB THR 722 HB THR 722 -1.969 -12.346 4.704 496 HG1 THR 722 HG1 THR 722 -4.031 -14.255 5.090 497 HG21 THR 722 HG21 THR 722 -1.995 -13.959 6.860 498 HG22 THR 722 HG22 THR 722 -1.577 -12.249 6.962 499 HG23 THR 722 HG23 THR 722 -3.205 -12.786 7.376 500 H ALA 723 H ALA 723 -6.257 -10.839 5.701 501 HA ALA 723 HA ALA 723 -7.566 -12.808 7.132 502 HB1 ALA 723 HB1 ALA 723 -9.639 -11.749 5.758 503 HB2 ALA 723 HB2 ALA 723 -8.412 -10.519 5.464 504 HB3 ALA 723 HB3 ALA 723 -8.858 -10.941 7.116 505 H GLU 724 H GLU 724 -7.818 -14.860 6.640 506 HA GLU 724 HA GLU 724 -8.113 -16.793 5.426 507 HB2 GLU 724 HB2 GLU 724 -10.043 -15.361 3.656 508 HB3 GLU 724 HB3 GLU 724 -10.194 -16.931 4.444 509 HG2 GLU 724 HG2 GLU 724 -10.693 -14.192 5.559 510 HG3 GLU 724 HG3 GLU 724 -11.662 -15.650 5.717 511 H GLY 725 H GLY 725 -6.169 -14.705 4.410 512 HA2 GLY 725 HA2 GLY 725 -4.546 -15.134 2.697 513 HA3 GLY 725 HA3 GLY 725 -5.810 -15.879 1.725 514 H LEU 726 H LEU 726 -7.320 -13.249 2.898 515 HA LEU 726 HA LEU 726 -6.833 -11.738 0.437 516 HB2 LEU 726 HB2 LEU 726 -8.758 -11.070 2.671 517 HB3 LEU 726 HB3 LEU 726 -8.791 -10.476 1.011 518 HG LEU 726 HG LEU 726 -9.088 -13.397 1.749 519 HD11 LEU 726 HD11 LEU 726 -11.165 -11.258 1.225 520 HD12 LEU 726 HD12 LEU 726 -11.514 -12.986 1.168 521 HD13 LEU 726 HD13 LEU 726 -10.983 -12.243 2.677 522 HD21 LEU 726 HD21 LEU 726 -9.209 -13.788 -0.483 523 HD22 LEU 726 HD22 LEU 726 -10.219 -12.370 -0.761 524 HD23 LEU 726 HD23 LEU 726 -8.467 -12.201 -0.671 525 H TYR 727 H TYR 727 -5.945 -9.705 0.319 526 HA TYR 727 HA TYR 727 -4.496 -8.809 2.707 527 HB2 TYR 727 HB2 TYR 727 -4.274 -8.130 -0.222 528 HB3 TYR 727 HB3 TYR 727 -3.411 -7.239 1.026 529 HD1 TYR 727 HD2 TYR 727 -3.710 -10.514 2.264 530 HD2 TYR 727 HD1 TYR 727 -1.586 -8.243 -0.693 531 HE1 TYR 727 HE2 TYR 727 -1.910 -12.219 2.233 532 HE2 TYR 727 HE1 TYR 727 0.210 -9.939 -0.719 533 HH TYR 727 HH TYR 727 0.656 -12.185 1.642 534 H ARG 728 H ARG 728 -4.800 -6.838 3.642 535 HA ARG 728 HA ARG 728 -6.723 -4.955 2.507 536 HB2 ARG 728 HB2 ARG 728 -7.714 -5.033 5.025 537 HB3 ARG 728 HB3 ARG 728 -8.410 -5.935 3.686 538 HG2 ARG 728 HG2 ARG 728 -7.008 -7.896 4.298 539 HG3 ARG 728 HG3 ARG 728 -6.361 -6.985 5.661 540 HD2 ARG 728 HD2 ARG 728 -9.244 -6.873 5.695 541 HD3 ARG 728 HD3 ARG 728 -8.714 -8.551 5.601 542 HE ARG 728 HE ARG 728 -7.320 -6.951 7.599 543 HH11 ARG 728 HH21 ARG 728 -10.004 -9.009 6.908 544 HH12 ARG 728 HH22 ARG 728 -10.229 -9.478 8.553 545 HH21 ARG 728 HH11 ARG 728 -7.609 -7.525 9.726 546 HH22 ARG 728 HH12 ARG 728 -8.886 -8.643 10.150 547 H ILE 729 H ILE 729 -6.382 -2.894 3.145 548 HA ILE 729 HA ILE 729 -3.977 -2.356 4.715 549 HB ILE 729 HB ILE 729 -5.795 -0.290 3.499 550 HG12 ILE 729 HG12 ILE 729 -3.721 -2.007 2.113 551 HG13 ILE 729 HG13 ILE 729 -5.431 -1.870 1.712 552 HG21 ILE 729 HG21 ILE 729 -3.322 0.621 3.119 553 HG22 ILE 729 HG22 ILE 729 -4.148 0.824 4.666 554 HG23 ILE 729 HG23 ILE 729 -2.970 -0.474 4.454 555 HD11 ILE 729 HD11 ILE 729 -4.504 -0.434 0.142 556 HD12 ILE 729 HD12 ILE 729 -4.845 0.691 1.459 557 HD13 ILE 729 HD13 ILE 729 -3.209 0.075 1.227 558 H THR 730 H THR 730 -7.431 -1.859 4.837 559 HA THR 730 HA THR 730 -7.190 -0.582 7.495 560 HB THR 730 HB THR 730 -8.351 0.691 5.763 561 HG1 THR 730 HG1 THR 730 -9.841 1.320 7.104 562 HG21 THR 730 HG21 THR 730 -10.780 -0.673 5.460 563 HG22 THR 730 HG22 THR 730 -9.548 -0.423 4.228 564 HG23 THR 730 HG23 THR 730 -9.527 -1.885 5.206 565 H GLU 731 H GLU 731 -7.865 -3.453 5.958 566 HA GLU 731 HA GLU 731 -8.508 -5.485 6.763 567 HB2 GLU 731 HB2 GLU 731 -9.073 -4.169 9.410 568 HB3 GLU 731 HB3 GLU 731 -8.645 -5.851 9.096 569 HG2 GLU 731 HG2 GLU 731 -6.588 -4.412 7.880 570 HG3 GLU 731 HG3 GLU 731 -6.896 -3.506 9.355 571 H LYS 732 H LYS 732 -10.400 -2.816 6.516 572 HA LYS 732 HA LYS 732 -12.935 -4.075 7.204 573 HB2 LYS 732 HB2 LYS 732 -12.679 -1.437 5.794 574 HB3 LYS 732 HB3 LYS 732 -13.881 -1.957 6.980 575 HG2 LYS 732 HG2 LYS 732 -10.960 -1.390 7.553 576 HG3 LYS 732 HG3 LYS 732 -12.312 -0.355 7.992 577 HD2 LYS 732 HD2 LYS 732 -12.460 -3.193 8.896 578 HD3 LYS 732 HD3 LYS 732 -11.265 -2.175 9.687 579 HE2 LYS 732 HE2 LYS 732 -13.644 -0.648 9.488 580 HE3 LYS 732 HE3 LYS 732 -14.096 -2.241 10.095 581 HZ1 LYS 732 HZ1 LYS 732 -11.723 -0.871 11.210 582 HZ2 LYS 732 HZ2 LYS 732 -13.286 -0.444 11.754 583 HZ3 LYS 732 HZ3 LYS 732 -12.740 -2.057 11.944 584 H LYS 733 H LYS 733 -11.102 -3.081 4.353 585 HA LYS 733 HA LYS 733 -12.903 -4.734 2.696 586 HB2 LYS 733 HB2 LYS 733 -13.545 -2.527 2.092 587 HB3 LYS 733 HB3 LYS 733 -11.875 -1.962 2.076 588 HG2 LYS 733 HG2 LYS 733 -12.827 -2.362 -0.223 589 HG3 LYS 733 HG3 LYS 733 -11.372 -3.299 0.113 590 HD2 LYS 733 HD2 LYS 733 -12.656 -5.299 0.528 591 HD3 LYS 733 HD3 LYS 733 -14.172 -4.398 0.509 592 HE2 LYS 733 HE2 LYS 733 -14.334 -4.724 -1.710 593 HE3 LYS 733 HE3 LYS 733 -12.818 -3.853 -1.945 594 HZ1 LYS 733 HZ1 LYS 733 -11.806 -6.149 -1.159 595 HZ2 LYS 733 HZ2 LYS 733 -13.294 -6.743 -1.754 596 HZ3 LYS 733 HZ3 LYS 733 -12.255 -5.887 -2.787 597 H ALA 734 H ALA 734 -11.614 -6.448 2.439 598 HA ALA 734 HA ALA 734 -8.791 -6.108 1.738 599 HB1 ALA 734 HB1 ALA 734 -9.809 -7.823 3.441 600 HB2 ALA 734 HB2 ALA 734 -8.496 -8.325 2.377 601 HB3 ALA 734 HB3 ALA 734 -10.160 -8.767 1.993 602 H PHE 735 H PHE 735 -8.120 -8.048 0.168 603 HA PHE 735 HA PHE 735 -9.915 -8.295 -2.122 604 HB2 PHE 735 HB2 PHE 735 -7.570 -6.507 -2.052 605 HB3 PHE 735 HB3 PHE 735 -7.654 -7.568 -3.454 606 HD1 PHE 735 HD2 PHE 735 -9.734 -7.591 -4.875 607 HD2 PHE 735 HD1 PHE 735 -9.080 -4.682 -1.789 608 HE1 PHE 735 HE2 PHE 735 -11.508 -6.161 -5.851 609 HE2 PHE 735 HE1 PHE 735 -10.855 -3.250 -2.762 610 HZ PHE 735 HZ PHE 735 -12.071 -3.990 -4.793 611 H ARG 736 H ARG 736 -8.646 -9.538 -3.931 612 HA ARG 736 HA ARG 736 -8.074 -12.098 -3.045 613 HB2 ARG 736 HB2 ARG 736 -7.539 -10.583 -5.546 614 HB3 ARG 736 HB3 ARG 736 -6.670 -12.095 -5.325 615 HG2 ARG 736 HG2 ARG 736 -8.623 -12.810 -6.388 616 HG3 ARG 736 HG3 ARG 736 -9.016 -13.061 -4.688 617 HD2 ARG 736 HD2 ARG 736 -10.513 -11.317 -4.631 618 HD3 ARG 736 HD3 ARG 736 -9.647 -10.385 -5.845 619 HE ARG 736 HE ARG 736 -11.621 -12.490 -6.341 620 HH11 ARG 736 HH21 ARG 736 -9.226 -10.295 -7.622 621 HH12 ARG 736 HH22 ARG 736 -9.815 -10.472 -9.250 622 HH21 ARG 736 HH11 ARG 736 -12.347 -12.648 -8.442 623 HH22 ARG 736 HH12 ARG 736 -11.561 -11.768 -9.703 624 H GLY 737 H GLY 737 -5.699 -9.615 -4.014 625 HA2 GLY 737 HA2 GLY 737 -3.783 -10.762 -2.114 626 HA3 GLY 737 HA3 GLY 737 -3.307 -10.668 -3.808 627 H LEU 738 H LEU 738 -1.604 -9.260 -3.107 628 HA LEU 738 HA LEU 738 -2.160 -6.739 -1.881 629 HB2 LEU 738 HB2 LEU 738 0.132 -8.260 -2.473 630 HB3 LEU 738 HB3 LEU 738 0.309 -6.764 -3.386 631 HG LEU 738 HG LEU 738 -0.308 -6.935 -0.421 632 HD11 LEU 738 HD11 LEU 738 1.988 -7.629 -0.959 633 HD12 LEU 738 HD12 LEU 738 2.217 -6.154 -1.899 634 HD13 LEU 738 HD13 LEU 738 1.979 -6.063 -0.156 635 HD21 LEU 738 HD21 LEU 738 0.341 -4.568 -2.196 636 HD22 LEU 738 HD22 LEU 738 -1.265 -4.956 -1.580 637 HD23 LEU 738 HD23 LEU 738 0.022 -4.514 -0.463 638 H THR 739 H THR 739 -1.251 -7.698 -5.190 639 HA THR 739 HA THR 739 -1.383 -5.205 -6.404 640 HB THR 739 HB THR 739 -2.392 -7.776 -7.639 641 HG1 THR 739 HG1 THR 739 -0.408 -8.233 -6.785 642 HG21 THR 739 HG21 THR 739 -1.042 -5.330 -8.812 643 HG22 THR 739 HG22 THR 739 -1.542 -6.760 -9.714 644 HG23 THR 739 HG23 THR 739 -2.754 -5.730 -8.955 645 H GLU 740 H GLU 740 -3.991 -7.603 -6.071 646 HA GLU 740 HA GLU 740 -6.043 -5.971 -7.120 647 HB2 GLU 740 HB2 GLU 740 -6.338 -8.178 -5.076 648 HB3 GLU 740 HB3 GLU 740 -7.571 -7.588 -6.190 649 HG2 GLU 740 HG2 GLU 740 -5.453 -8.219 -7.879 650 HG3 GLU 740 HG3 GLU 740 -5.386 -9.494 -6.666 651 H LEU 741 H LEU 741 -4.663 -6.223 -3.927 652 HA LEU 741 HA LEU 741 -6.759 -4.719 -2.646 653 HB2 LEU 741 HB2 LEU 741 -5.424 -6.447 -1.485 654 HB3 LEU 741 HB3 LEU 741 -3.983 -5.459 -1.684 655 HG LEU 741 HG LEU 741 -5.259 -5.362 0.567 656 HD11 LEU 741 HD11 LEU 741 -5.012 -2.585 -0.238 657 HD12 LEU 741 HD12 LEU 741 -4.034 -3.525 0.889 658 HD13 LEU 741 HD13 LEU 741 -3.669 -3.560 -0.832 659 HD21 LEU 741 HD21 LEU 741 -6.955 -3.416 -1.014 660 HD22 LEU 741 HD22 LEU 741 -7.494 -5.033 -0.564 661 HD23 LEU 741 HD23 LEU 741 -7.124 -3.847 0.685 662 H VAL 742 H VAL 742 -3.533 -4.026 -3.954 663 HA VAL 742 HA VAL 742 -3.728 -1.219 -3.099 664 HB VAL 742 HB VAL 742 -1.574 -2.822 -4.461 665 HG11 VAL 742 HG11 VAL 742 -1.311 -0.784 -5.584 666 HG12 VAL 742 HG12 VAL 742 -1.881 0.155 -4.204 667 HG13 VAL 742 HG13 VAL 742 -0.278 -0.578 -4.168 668 HG21 VAL 742 HG21 VAL 742 -2.155 -2.548 -1.837 669 HG22 VAL 742 HG22 VAL 742 -0.509 -2.729 -2.437 670 HG23 VAL 742 HG23 VAL 742 -1.137 -1.127 -2.063 671 H GLU 743 H GLU 743 -4.113 -3.144 -6.017 672 HA GLU 743 HA GLU 743 -4.131 -0.813 -7.736 673 HB2 GLU 743 HB2 GLU 743 -4.872 -3.701 -8.240 674 HB3 GLU 743 HB3 GLU 743 -4.920 -2.445 -9.474 675 HG2 GLU 743 HG2 GLU 743 -2.443 -3.093 -7.850 676 HG3 GLU 743 HG3 GLU 743 -2.772 -3.782 -9.435 677 H PHE 744 H PHE 744 -6.194 -1.686 -5.442 678 HA PHE 744 HA PHE 744 -8.579 -0.883 -6.997 679 HB2 PHE 744 HB2 PHE 744 -8.677 -3.130 -5.860 680 HB3 PHE 744 HB3 PHE 744 -8.555 -2.285 -4.316 681 HD1 PHE 744 HD2 PHE 744 -10.658 -2.869 -7.286 682 HD2 PHE 744 HD1 PHE 744 -10.375 -0.884 -3.487 683 HE1 PHE 744 HE2 PHE 744 -13.088 -2.379 -7.360 684 HE2 PHE 744 HE1 PHE 744 -12.805 -0.391 -3.561 685 HZ PHE 744 HZ PHE 744 -14.161 -1.140 -5.499 686 H TYR 745 H TYR 745 -6.807 -0.447 -3.962 687 HA TYR 745 HA TYR 745 -8.465 1.615 -2.936 688 HB2 TYR 745 HB2 TYR 745 -5.677 0.675 -2.356 689 HB3 TYR 745 HB3 TYR 745 -6.249 2.192 -1.661 690 HD1 TYR 745 HD1 TYR 745 -7.709 -1.212 -2.298 691 HD2 TYR 745 HD2 TYR 745 -7.104 1.991 0.514 692 HE1 TYR 745 HE1 TYR 745 -8.988 -2.467 -0.579 693 HE2 TYR 745 HE2 TYR 745 -8.367 0.721 2.216 694 HH TYR 745 HH TYR 745 -9.519 -2.578 1.629 695 H GLN 746 H GLN 746 -6.392 1.561 -5.586 696 HA GLN 746 HA GLN 746 -5.442 4.261 -5.540 697 HB2 GLN 746 HB2 GLN 746 -5.151 3.833 -8.051 698 HB3 GLN 746 HB3 GLN 746 -4.264 2.759 -6.967 699 HG2 GLN 746 HG2 GLN 746 -5.461 0.939 -7.585 700 HG3 GLN 746 HG3 GLN 746 -6.983 1.822 -7.605 701 HE21 GLN 746 HE21 GLN 746 -4.464 0.534 -9.602 702 HE22 GLN 746 HE22 GLN 746 -5.017 1.190 -11.065 703 H GLN 747 H GLN 747 -8.431 2.751 -6.196 704 HA GLN 747 HA GLN 747 -9.510 5.175 -7.504 705 HB2 GLN 747 HB2 GLN 747 -10.995 2.569 -7.291 706 HB3 GLN 747 HB3 GLN 747 -11.144 3.839 -8.507 707 HG2 GLN 747 HG2 GLN 747 -8.451 2.893 -8.580 708 HG3 GLN 747 HG3 GLN 747 -9.505 1.485 -8.588 709 HE21 GLN 747 HE21 GLN 747 -7.850 2.823 -10.795 710 HE22 GLN 747 HE22 GLN 747 -8.976 3.059 -12.054 711 H ASN 748 H ASN 748 -10.054 2.822 -4.909 712 HA ASN 748 HA ASN 748 -12.355 4.153 -3.852 713 HB2 ASN 748 HB2 ASN 748 -11.624 1.701 -3.507 714 HB3 ASN 748 HB3 ASN 748 -10.551 2.339 -2.265 715 HD21 ASN 748 HD21 ASN 748 -12.071 4.275 -0.998 716 HD22 ASN 748 HD22 ASN 748 -13.488 3.589 -0.365 717 H SER 749 H SER 749 -12.307 6.094 -2.921 718 HA SER 749 HA SER 749 -10.095 7.560 -2.158 719 HB2 SER 749 HB2 SER 749 -12.070 8.450 -0.448 720 HB3 SER 749 HB3 SER 749 -11.829 8.996 -2.104 721 HG SER 749 HG SER 749 -13.671 7.146 -1.025 722 H LEU 750 H LEU 750 -8.599 7.181 -0.660 723 HA LEU 750 HA LEU 750 -8.709 5.152 1.235 724 HB2 LEU 750 HB2 LEU 750 -7.078 7.695 1.235 725 HB3 LEU 750 HB3 LEU 750 -6.807 6.353 2.346 726 HG LEU 750 HG LEU 750 -6.692 6.217 -0.676 727 HD11 LEU 750 HD11 LEU 750 -4.266 5.432 0.116 728 HD12 LEU 750 HD12 LEU 750 -4.646 7.135 -0.135 729 HD13 LEU 750 HD13 LEU 750 -4.656 6.460 1.494 730 HD21 LEU 750 HD21 LEU 750 -7.209 4.037 -0.320 731 HD22 LEU 750 HD22 LEU 750 -5.570 3.906 0.316 732 HD23 LEU 750 HD23 LEU 750 -6.923 4.163 1.416 733 H LYS 751 H LYS 751 -9.894 8.425 1.469 734 HA LYS 751 HA LYS 751 -10.115 8.754 4.225 735 HB2 LYS 751 HB2 LYS 751 -11.690 10.446 3.764 736 HB3 LYS 751 HB3 LYS 751 -10.667 10.400 2.330 737 HG2 LYS 751 HG2 LYS 751 -12.432 8.664 1.455 738 HG3 LYS 751 HG3 LYS 751 -13.477 9.392 2.671 739 HD2 LYS 751 HD2 LYS 751 -12.012 10.914 0.490 740 HD3 LYS 751 HD3 LYS 751 -13.729 10.510 0.468 741 HE2 LYS 751 HE2 LYS 751 -12.370 12.190 2.600 742 HE3 LYS 751 HE3 LYS 751 -13.323 12.834 1.261 743 HZ1 LYS 751 HZ1 LYS 751 -14.600 10.749 2.830 744 HZ2 LYS 751 HZ2 LYS 751 -14.354 12.221 3.641 745 HZ3 LYS 751 HZ3 LYS 751 -15.250 12.186 2.202 746 H ASP 752 H ASP 752 -11.771 6.569 2.152 747 HA ASP 752 HA ASP 752 -13.987 6.161 4.022 748 HB2 ASP 752 HB2 ASP 752 -13.361 4.692 1.457 749 HB3 ASP 752 HB3 ASP 752 -14.898 4.725 2.319 750 H CYS 753 H CYS 753 -10.971 4.701 3.092 751 HA CYS 753 HA CYS 753 -11.555 2.292 4.694 752 HB2 CYS 753 HB2 CYS 753 -9.380 2.914 2.688 753 HB3 CYS 753 HB3 CYS 753 -9.468 1.421 3.620 754 HG CYS 753 HG CYS 753 -11.430 0.646 2.253 755 H PHE 754 H PHE 754 -9.162 4.881 4.276 756 HA PHE 754 HA PHE 754 -7.560 3.992 6.517 757 HB2 PHE 754 HB2 PHE 754 -7.529 6.417 4.727 758 HB3 PHE 754 HB3 PHE 754 -6.424 6.247 6.086 759 HD1 PHE 754 HD2 PHE 754 -7.584 3.293 4.162 760 HD2 PHE 754 HD1 PHE 754 -4.443 6.176 4.682 761 HE1 PHE 754 HE2 PHE 754 -6.087 1.914 2.760 762 HE2 PHE 754 HE1 PHE 754 -2.954 4.794 3.281 763 HZ PHE 754 HZ PHE 754 -3.767 2.667 2.312 764 H LYS 755 H LYS 755 -7.947 7.381 6.535 765 HA LYS 755 HA LYS 755 -10.028 7.500 8.558 766 HB2 LYS 755 HB2 LYS 755 -8.150 6.725 9.886 767 HB3 LYS 755 HB3 LYS 755 -7.149 8.039 9.279 768 HG2 LYS 755 HG2 LYS 755 -8.618 9.691 10.340 769 HG3 LYS 755 HG3 LYS 755 -9.717 8.411 10.856 770 HD2 LYS 755 HD2 LYS 755 -8.506 8.269 12.746 771 HD3 LYS 755 HD3 LYS 755 -7.221 7.571 11.768 772 HE2 LYS 755 HE2 LYS 755 -7.571 10.454 12.607 773 HE3 LYS 755 HE3 LYS 755 -6.192 9.393 12.895 774 HZ1 LYS 755 HZ1 LYS 755 -5.339 10.404 11.094 775 HZ2 LYS 755 HZ2 LYS 755 -6.358 9.381 10.209 776 HZ3 LYS 755 HZ3 LYS 755 -6.865 10.974 10.548 777 H SER 756 H SER 756 -7.483 9.774 8.820 778 HA SER 756 HA SER 756 -9.191 11.900 7.902 779 HB2 SER 756 HB2 SER 756 -6.265 12.151 8.596 780 HB3 SER 756 HB3 SER 756 -7.528 13.371 8.735 781 HG SER 756 HG SER 756 -8.289 12.405 10.518 782 H LEU 757 H LEU 757 -8.108 9.774 6.054 783 HA LEU 757 HA LEU 757 -6.308 11.134 4.264 784 HB2 LEU 757 HB2 LEU 757 -7.632 8.482 4.421 785 HB3 LEU 757 HB3 LEU 757 -7.221 9.054 2.808 786 HG LEU 757 HG LEU 757 -5.442 7.685 4.067 787 HD11 LEU 757 HD11 LEU 757 -3.631 9.394 3.324 788 HD12 LEU 757 HD12 LEU 757 -4.706 8.692 2.116 789 HD13 LEU 757 HD13 LEU 757 -5.010 10.316 2.724 790 HD21 LEU 757 HD21 LEU 757 -4.283 8.611 5.833 791 HD22 LEU 757 HD22 LEU 757 -4.659 10.264 5.348 792 HD23 LEU 757 HD23 LEU 757 -5.882 9.275 6.143 793 H ASP 758 H ASP 758 -6.862 11.320 1.945 794 HA ASP 758 HA ASP 758 -9.577 11.615 1.116 795 HB2 ASP 758 HB2 ASP 758 -8.357 13.891 2.375 796 HB3 ASP 758 HB3 ASP 758 -8.607 14.247 0.669 797 H THR 759 H THR 759 -7.819 10.036 0.090 798 HA THR 759 HA THR 759 -7.454 10.954 -2.604 799 HB THR 759 HB THR 759 -5.455 11.969 -1.531 800 HG1 THR 759 HG1 THR 759 -4.586 11.516 -3.371 801 HG21 THR 759 HG21 THR 759 -3.658 10.171 -0.915 802 HG22 THR 759 HG22 THR 759 -4.893 10.576 0.278 803 HG23 THR 759 HG23 THR 759 -5.042 9.107 -0.685 804 H THR 760 H THR 760 -5.443 9.161 -3.332 805 HA THR 760 HA THR 760 -6.141 6.498 -2.389 806 HB THR 760 HB THR 760 -6.881 5.656 -4.556 807 HG1 THR 760 HG1 THR 760 -6.923 6.861 -6.292 808 HG21 THR 760 HG21 THR 760 -8.541 8.081 -3.887 809 HG22 THR 760 HG22 THR 760 -9.088 6.547 -4.560 810 HG23 THR 760 HG23 THR 760 -8.524 6.624 -2.893 811 H LEU 761 H LEU 761 -4.957 4.821 -3.768 812 HA LEU 761 HA LEU 761 -2.195 5.381 -3.833 813 HB2 LEU 761 HB2 LEU 761 -3.835 3.218 -5.200 814 HB3 LEU 761 HB3 LEU 761 -2.082 3.236 -5.185 815 HG LEU 761 HG LEU 761 -3.200 1.758 -3.439 816 HD11 LEU 761 HD11 LEU 761 -1.176 3.862 -2.875 817 HD12 LEU 761 HD12 LEU 761 -1.737 2.858 -1.544 818 HD13 LEU 761 HD13 LEU 761 -0.989 2.107 -2.953 819 HD21 LEU 761 HD21 LEU 761 -5.001 3.334 -2.795 820 HD22 LEU 761 HD22 LEU 761 -4.037 2.826 -1.416 821 HD23 LEU 761 HD23 LEU 761 -3.786 4.420 -2.118 822 H GLN 762 H GLN 762 -2.065 7.370 -4.978 823 HA GLN 762 HA GLN 762 -3.066 7.717 -7.613 824 HB2 GLN 762 HB2 GLN 762 -1.662 9.262 -5.617 825 HB3 GLN 762 HB3 GLN 762 -1.018 9.580 -7.222 826 HG2 GLN 762 HG2 GLN 762 -3.853 9.513 -7.465 827 HG3 GLN 762 HG3 GLN 762 -3.482 10.493 -6.048 828 HE21 GLN 762 HE21 GLN 762 -1.329 11.973 -6.627 829 HE22 GLN 762 HE22 GLN 762 -1.518 12.844 -8.068 830 H PHE 763 H PHE 763 0.356 7.594 -6.527 831 HA PHE 763 HA PHE 763 0.969 6.275 -9.103 832 HB2 PHE 763 HB2 PHE 763 2.381 8.684 -7.946 833 HB3 PHE 763 HB3 PHE 763 2.994 7.735 -9.300 834 HD1 PHE 763 HD1 PHE 763 1.530 7.481 -11.375 835 HD2 PHE 763 HD2 PHE 763 0.718 10.341 -8.277 836 HE1 PHE 763 HE1 PHE 763 0.067 8.745 -12.927 837 HE2 PHE 763 HE2 PHE 763 -0.748 11.606 -9.826 838 HZ PHE 763 HZ PHE 763 -1.073 10.808 -12.153 839 HA PRO 764 HA PRO 764 3.570 3.692 -6.652 840 HB2 PRO 764 HB2 PRO 764 5.192 2.688 -8.589 841 HB3 PRO 764 HB3 PRO 764 3.478 2.257 -8.467 842 HG2 PRO 764 HG2 PRO 764 4.827 4.134 -10.318 843 HG3 PRO 764 HG3 PRO 764 3.452 3.055 -10.596 844 HD2 PRO 764 HD2 PRO 764 3.249 5.788 -10.133 845 HD3 PRO 764 HD3 PRO 764 1.931 4.614 -9.917 846 H PHE 765 H PHE 765 6.264 3.103 -6.932 847 HA PHE 765 HA PHE 765 7.556 5.754 -6.750 848 HB2 PHE 765 HB2 PHE 765 8.711 5.153 -4.805 849 HB3 PHE 765 HB3 PHE 765 7.104 4.483 -4.541 850 HD1 PHE 765 HD1 PHE 765 6.690 2.037 -5.012 851 HD2 PHE 765 HD2 PHE 765 10.626 3.749 -4.957 852 HE1 PHE 765 HE1 PHE 765 7.671 -0.225 -4.771 853 HE2 PHE 765 HE2 PHE 765 11.608 1.490 -4.716 854 HZ PHE 765 HZ PHE 765 10.131 -0.499 -4.623 855 H LYS 766 H LYS 766 7.557 2.710 -8.228 856 HA LYS 766 HA LYS 766 10.424 2.805 -8.855 857 HB2 LYS 766 HB2 LYS 766 8.294 0.807 -9.626 858 HB3 LYS 766 HB3 LYS 766 10.008 0.662 -9.997 859 HG2 LYS 766 HG2 LYS 766 10.143 1.121 -7.327 860 HG3 LYS 766 HG3 LYS 766 8.599 0.281 -7.411 861 HD2 LYS 766 HD2 LYS 766 10.811 -0.897 -8.995 862 HD3 LYS 766 HD3 LYS 766 10.968 -0.999 -7.245 863 HE2 LYS 766 HE2 LYS 766 9.612 -2.803 -7.329 864 HE3 LYS 766 HE3 LYS 766 8.301 -1.692 -7.725 865 HZ1 LYS 766 HZ1 LYS 766 9.783 -3.503 -9.452 866 HZ2 LYS 766 HZ2 LYS 766 8.171 -2.938 -9.592 867 HZ3 LYS 766 HZ3 LYS 766 9.475 -1.966 -10.107 868 H GLU 767 H GLU 767 7.265 3.116 -10.377 869 HA GLU 767 HA GLU 767 6.742 3.460 -12.648 870 HB2 GLU 767 HB2 GLU 767 7.502 5.745 -11.094 871 HB3 GLU 767 HB3 GLU 767 7.913 6.039 -12.782 872 HG2 GLU 767 HG2 GLU 767 5.505 5.025 -13.215 873 HG3 GLU 767 HG3 GLU 767 5.230 5.519 -11.550 874 H1 ASP 338 H1 ASP 338 3.286 7.128 14.455 875 H2 ASP 338 H2 ASP 338 3.302 6.765 14.045 876 H3 ASP 338 H3 ASP 338 1.960 7.432 13.250 877 HA ASP 338 HA ASP 338 3.576 7.878 11.723 878 HB2 ASP 338 HB2 ASP 338 4.327 10.304 12.206 879 HB3 ASP 338 HB3 ASP 338 2.600 9.986 12.111 880 H THR 339 H THR 339 4.702 6.958 14.693 881 HA THR 339 HA THR 339 7.414 7.872 14.628 882 HB THR 339 HB THR 339 7.802 6.002 16.251 883 HG1 THR 339 HG1 THR 339 5.021 5.552 15.859 884 HG21 THR 339 HG21 THR 339 5.292 7.601 16.819 885 HG22 THR 339 HG22 THR 339 6.410 6.930 18.006 886 HG23 THR 339 HG23 THR 339 6.929 8.243 16.949 887 H GLU 340 H GLU 340 9.135 5.912 14.745 888 HA GLU 340 HA GLU 340 9.807 5.189 12.193 889 HB2 GLU 340 HB2 GLU 340 10.283 3.505 14.666 890 HB3 GLU 340 HB3 GLU 340 11.215 3.446 13.169 891 HG2 GLU 340 HG2 GLU 340 12.544 4.886 14.409 892 HG3 GLU 340 HG3 GLU 340 11.484 6.050 13.622 893 H VAL 341 H VAL 341 7.534 3.520 14.300 894 HA VAL 341 HA VAL 341 7.024 1.553 12.148 895 HB VAL 341 HB VAL 341 7.768 0.582 14.299 896 HG11 VAL 341 HG11 VAL 341 6.870 2.329 15.792 897 HG12 VAL 341 HG12 VAL 341 5.227 1.849 15.374 898 HG13 VAL 341 HG13 VAL 341 6.270 0.738 16.260 899 HG21 VAL 341 HG21 VAL 341 6.036 -1.089 14.452 900 HG22 VAL 341 HG22 VAL 341 4.826 0.026 13.818 901 HG23 VAL 341 HG23 VAL 341 6.110 -0.575 12.766 902 H PTR 342 H PTR 342 4.921 1.127 11.517 903 HA PTR 342 HA PTR 342 3.076 3.325 11.637 904 HB2 PTR 342 HB2 PTR 342 1.633 1.207 10.604 905 HB3 PTR 342 HB3 PTR 342 2.639 2.303 9.654 906 HD1 PTR 342 HD1 PTR 342 3.196 -0.622 11.952 907 HD2 PTR 342 HD2 PTR 342 4.118 1.249 8.198 908 HE1 PTR 342 HE1 PTR 342 4.769 -2.458 11.423 909 HE2 PTR 342 HE2 PTR 342 5.679 -0.600 7.666 910 H GLU 343 H GLU 343 2.496 3.616 13.803 911 HA GLU 343 HA GLU 343 1.612 1.556 15.532 912 HB2 GLU 343 HB2 GLU 343 0.705 4.429 15.686 913 HB3 GLU 343 HB3 GLU 343 0.987 3.295 17.009 914 HG2 GLU 343 HG2 GLU 343 2.984 4.430 17.136 915 HG3 GLU 343 HG3 GLU 343 3.444 3.263 15.902 916 H SER 344 H SER 344 0.350 0.788 13.340 917 HA SER 344 HA SER 344 -1.691 0.433 12.278 918 HB2 SER 344 HB2 SER 344 -2.164 -1.075 13.958 919 HB3 SER 344 HB3 SER 344 -2.107 0.149 15.222 920 HG SER 344 HG SER 344 -4.067 1.018 14.097 921 HA PRO 345 HA PRO 345 -2.860 5.019 12.687 922 HB2 PRO 345 HB2 PRO 345 -3.073 4.436 9.757 923 HB3 PRO 345 HB3 PRO 345 -2.450 5.880 10.576 924 HG2 PRO 345 HG2 PRO 345 -0.817 4.077 9.490 925 HG3 PRO 345 HG3 PRO 345 -0.404 4.929 10.986 926 HD2 PRO 345 HD2 PRO 345 -1.231 2.092 10.610 927 HD3 PRO 345 HD3 PRO 345 -0.222 2.817 11.881 928 H PTR 346 H PTR 346 -4.279 2.856 10.218 929 HA PTR 346 HA PTR 346 -6.946 3.347 11.403 930 HB2 PTR 346 HB2 PTR 346 -6.759 3.017 8.452 931 HB3 PTR 346 HB3 PTR 346 -7.859 4.007 9.412 932 HD1 PTR 346 HD1 PTR 346 -5.329 4.276 7.087 933 HD2 PTR 346 HD2 PTR 346 -6.404 5.769 10.968 934 HE1 PTR 346 HE1 PTR 346 -3.877 6.264 6.737 935 HE2 PTR 346 HE2 PTR 346 -4.958 7.743 10.615 936 H ALA 347 H ALA 347 -8.341 1.649 11.462 937 HA ALA 347 HA ALA 347 -8.357 -0.631 9.890 938 HB1 ALA 347 HB1 ALA 347 -6.475 -0.808 12.225 939 HB2 ALA 347 HB2 ALA 347 -6.248 -1.365 10.567 940 HB3 ALA 347 HB3 ALA 347 -7.326 -2.245 11.651 941 H ASP 348 H ASP 348 -8.215 -1.172 13.338 942 HA ASP 348 HA ASP 348 -11.133 -0.908 13.587 943 HB2 ASP 348 HB2 ASP 348 -9.543 -3.440 13.911 944 HB3 ASP 348 HB3 ASP 348 -11.027 -3.195 14.828 945 HA PRO 349 HA PRO 349 -8.620 0.544 17.276 946 HB2 PRO 349 HB2 PRO 349 -9.651 3.088 17.321 947 HB3 PRO 349 HB3 PRO 349 -8.193 2.638 16.419 948 HG2 PRO 349 HG2 PRO 349 -10.975 3.034 15.448 949 HG3 PRO 349 HG3 PRO 349 -9.438 3.471 14.681 950 HD2 PRO 349 HD2 PRO 349 -10.894 1.268 13.950 951 HD3 PRO 349 HD3 PRO 349 -9.125 1.354 13.795 952 H GLU 350 H GLU 350 -10.586 -1.157 17.610 953 HA GLU 350 HA GLU 350 -12.219 -1.789 19.101 954 HB2 GLU 350 HB2 GLU 350 -11.867 1.028 20.168 955 HB3 GLU 350 HB3 GLU 350 -12.809 -0.238 20.948 956 HG2 GLU 350 HG2 GLU 350 -10.322 -1.426 20.400 957 HG3 GLU 350 HG3 GLU 350 -9.933 0.189 20.984 Start of MODEL 3 1 H1 GLY 661 H1 GLY 661 2.242 -14.952 -9.987 2 H2 GLY 661 H2 GLY 661 1.607 -16.444 -9.448 3 H3 GLY 661 H3 GLY 661 0.661 -15.035 -9.361 4 HA2 GLY 661 HA2 GLY 661 1.670 -15.885 -11.986 5 HA3 GLY 661 HA3 GLY 661 0.295 -16.743 -11.289 6 H HIS 662 H HIS 662 1.461 -13.400 -11.777 7 HA HIS 662 HA HIS 662 0.396 -11.496 -12.490 8 HB2 HIS 662 HB2 HIS 662 -0.345 -13.105 -14.328 9 HB3 HIS 662 HB3 HIS 662 -1.860 -13.269 -13.443 10 HD1 HIS 662 HD1 HIS 662 -2.699 -10.640 -12.640 11 HD2 HIS 662 HD2 HIS 662 -0.677 -11.144 -16.254 12 HE1 HIS 662 HE1 HIS 662 -3.286 -8.624 -14.086 13 HE2 HIS 662 HE2 HIS 662 -2.052 -8.917 -16.289 14 H MET 663 H MET 663 0.042 -12.410 -9.803 15 HA MET 663 HA MET 663 -2.370 -10.882 -9.140 16 HB2 MET 663 HB2 MET 663 -2.098 -13.814 -8.741 17 HB3 MET 663 HB3 MET 663 -2.747 -12.899 -7.382 18 HG2 MET 663 HG2 MET 663 -4.492 -11.949 -8.802 19 HG3 MET 663 HG3 MET 663 -3.796 -12.726 -10.222 20 HE1 MET 663 HE1 MET 663 -5.964 -15.224 -10.760 21 HE2 MET 663 HE2 MET 663 -6.995 -14.047 -9.965 22 HE3 MET 663 HE3 MET 663 -5.638 -13.506 -10.952 23 H GLN 664 H GLN 664 -0.702 -13.136 -7.012 24 HA GLN 664 HA GLN 664 -0.073 -11.042 -5.158 25 HB2 GLN 664 HB2 GLN 664 -0.563 -13.552 -4.679 26 HB3 GLN 664 HB3 GLN 664 1.146 -13.782 -5.043 27 HG2 GLN 664 HG2 GLN 664 1.026 -13.440 -2.679 28 HG3 GLN 664 HG3 GLN 664 1.632 -11.933 -3.355 29 HE21 GLN 664 HE21 GLN 664 -0.998 -13.383 -1.577 30 HE22 GLN 664 HE22 GLN 664 -1.904 -11.963 -1.385 31 H ASP 665 H ASP 665 1.334 -11.986 -8.015 32 HA ASP 665 HA ASP 665 4.109 -11.782 -7.378 33 HB2 ASP 665 HB2 ASP 665 3.106 -10.919 -10.053 34 HB3 ASP 665 HB3 ASP 665 4.467 -11.957 -9.646 35 H LEU 666 H LEU 666 4.706 -9.992 -6.274 36 HA LEU 666 HA LEU 666 3.578 -7.402 -6.989 37 HB2 LEU 666 HB2 LEU 666 5.620 -7.803 -4.838 38 HB3 LEU 666 HB3 LEU 666 4.289 -6.650 -4.905 39 HG LEU 666 HG LEU 666 3.952 -9.648 -4.641 40 HD11 LEU 666 HD11 LEU 666 3.151 -8.947 -2.306 41 HD12 LEU 666 HD12 LEU 666 4.890 -8.951 -2.594 42 HD13 LEU 666 HD13 LEU 666 4.000 -7.430 -2.608 43 HD21 LEU 666 HD21 LEU 666 1.610 -8.933 -3.998 44 HD22 LEU 666 HD22 LEU 666 2.033 -7.305 -4.535 45 HD23 LEU 666 HD23 LEU 666 2.022 -8.642 -5.685 46 H SER 667 H SER 667 6.578 -9.154 -7.135 47 HA SER 667 HA SER 667 8.311 -7.018 -7.702 48 HB2 SER 667 HB2 SER 667 8.736 -9.722 -8.889 49 HB3 SER 667 HB3 SER 667 9.890 -8.661 -8.080 50 HG SER 667 HG SER 667 9.454 -10.121 -6.541 51 H VAL 668 H VAL 668 5.687 -7.943 -9.453 52 HA VAL 668 HA VAL 668 6.932 -7.395 -12.065 53 HB VAL 668 HB VAL 668 4.970 -8.321 -13.074 54 HG11 VAL 668 HG11 VAL 668 5.931 -9.882 -10.668 55 HG12 VAL 668 HG12 VAL 668 4.798 -10.563 -11.837 56 HG13 VAL 668 HG13 VAL 668 6.413 -10.072 -12.355 57 HG21 VAL 668 HG21 VAL 668 3.141 -9.186 -11.398 58 HG22 VAL 668 HG22 VAL 668 3.815 -7.966 -10.318 59 HG23 VAL 668 HG23 VAL 668 3.138 -7.489 -11.874 60 H HIS 669 H HIS 669 5.502 -5.830 -9.568 61 HA HIS 669 HA HIS 669 4.083 -3.842 -11.210 62 HB2 HIS 669 HB2 HIS 669 4.338 -4.006 -8.197 63 HB3 HIS 669 HB3 HIS 669 3.254 -2.956 -9.107 64 HD1 HIS 669 HD1 HIS 669 2.072 -4.905 -11.123 65 HD2 HIS 669 HD2 HIS 669 2.613 -5.831 -7.105 66 HE1 HIS 669 HE1 HIS 669 0.421 -6.756 -10.589 67 HE2 HIS 669 HE2 HIS 669 0.674 -7.284 -8.100 68 H LEU 670 H LEU 670 4.391 -1.600 -9.810 69 HA LEU 670 HA LEU 670 7.288 -1.048 -9.798 70 HB2 LEU 670 HB2 LEU 670 6.553 1.323 -10.514 71 HB3 LEU 670 HB3 LEU 670 6.618 0.077 -11.736 72 HG LEU 670 HG LEU 670 4.116 0.951 -10.269 73 HD11 LEU 670 HD11 LEU 670 3.494 1.925 -12.463 74 HD12 LEU 670 HD12 LEU 670 4.953 2.663 -11.810 75 HD13 LEU 670 HD13 LEU 670 5.076 1.470 -13.098 76 HD21 LEU 670 HD21 LEU 670 4.724 -1.351 -11.955 77 HD22 LEU 670 HD22 LEU 670 3.256 -0.997 -11.040 78 HD23 LEU 670 HD23 LEU 670 3.461 -0.353 -12.667 79 H TRP 671 H TRP 671 4.368 -1.038 -8.107 80 HA TRP 671 HA TRP 671 5.297 1.088 -6.331 81 HB2 TRP 671 HB2 TRP 671 3.041 0.680 -5.185 82 HB3 TRP 671 HB3 TRP 671 3.016 1.418 -6.779 83 HD1 TRP 671 HD1 TRP 671 1.556 0.294 -8.532 84 HE1 TRP 671 HE1 TRP 671 0.262 -1.941 -8.710 85 HE3 TRP 671 HE3 TRP 671 3.307 -2.040 -4.334 86 HZ2 TRP 671 HZ2 TRP 671 0.058 -4.402 -7.258 87 HZ3 TRP 671 HZ3 TRP 671 2.546 -4.327 -3.761 88 HH2 TRP 671 HH2 TRP 671 0.922 -5.508 -5.216 89 H TYR 672 H TYR 672 5.808 -2.108 -6.686 90 HA TYR 672 HA TYR 672 5.600 -2.841 -3.868 91 HB2 TYR 672 HB2 TYR 672 4.954 -4.483 -5.566 92 HB3 TYR 672 HB3 TYR 672 6.572 -4.414 -6.264 93 HD1 TYR 672 HD2 TYR 672 5.219 -4.607 -2.762 94 HD2 TYR 672 HD1 TYR 672 7.826 -6.295 -5.733 95 HE1 TYR 672 HE2 TYR 672 6.003 -6.298 -1.125 96 HE2 TYR 672 HE1 TYR 672 8.599 -7.986 -4.095 97 HH TYR 672 HH TYR 672 7.779 -9.045 -2.033 98 H ALA 673 H ALA 673 7.166 -2.325 -2.509 99 HA ALA 673 HA ALA 673 9.908 -1.967 -3.544 100 HB1 ALA 673 HB1 ALA 673 9.009 -0.068 -2.307 101 HB2 ALA 673 HB2 ALA 673 10.313 -0.812 -1.382 102 HB3 ALA 673 HB3 ALA 673 8.633 -1.110 -0.935 103 H GLY 674 H GLY 674 7.945 -4.003 -1.559 104 HA2 GLY 674 HA2 GLY 674 8.379 -5.914 -0.357 105 HA3 GLY 674 HA3 GLY 674 9.779 -6.104 -1.400 106 HA PRO 675 HA PRO 675 12.052 -5.741 2.415 107 HB2 PRO 675 HB2 PRO 675 14.553 -5.463 1.261 108 HB3 PRO 675 HB3 PRO 675 13.729 -7.014 1.510 109 HG2 PRO 675 HG2 PRO 675 13.953 -5.363 -0.954 110 HG3 PRO 675 HG3 PRO 675 13.994 -7.125 -0.764 111 HD2 PRO 675 HD2 PRO 675 11.782 -5.813 -1.664 112 HD3 PRO 675 HD3 PRO 675 11.680 -7.311 -0.707 113 H MET 676 H MET 676 10.861 -3.562 2.511 114 HA MET 676 HA MET 676 12.891 -1.411 2.504 115 HB2 MET 676 HB2 MET 676 11.347 -1.303 0.471 116 HB3 MET 676 HB3 MET 676 10.058 -0.918 1.606 117 HG2 MET 676 HG2 MET 676 10.796 1.203 1.898 118 HG3 MET 676 HG3 MET 676 12.469 0.679 2.068 119 HE1 MET 676 HE1 MET 676 14.146 1.824 -0.842 120 HE2 MET 676 HE2 MET 676 14.021 1.544 0.892 121 HE3 MET 676 HE3 MET 676 14.115 0.175 -0.223 122 H GLU 677 H GLU 677 12.550 0.271 4.016 123 HA GLU 677 HA GLU 677 10.844 -0.488 6.301 124 HB2 GLU 677 HB2 GLU 677 12.338 1.081 7.574 125 HB3 GLU 677 HB3 GLU 677 13.158 -0.331 6.894 126 HG2 GLU 677 HG2 GLU 677 14.447 0.956 5.552 127 HG3 GLU 677 HG3 GLU 677 13.066 1.915 5.025 128 H ARG 678 H ARG 678 10.265 1.500 7.702 129 HA ARG 678 HA ARG 678 8.306 2.997 6.406 130 HB2 ARG 678 HB2 ARG 678 8.652 2.541 8.945 131 HB3 ARG 678 HB3 ARG 678 9.671 3.980 8.917 132 HG2 ARG 678 HG2 ARG 678 7.407 4.760 7.500 133 HG3 ARG 678 HG3 ARG 678 6.751 3.771 8.805 134 HD2 ARG 678 HD2 ARG 678 8.867 5.580 9.702 135 HD3 ARG 678 HD3 ARG 678 7.503 6.438 8.996 136 HE ARG 678 HE ARG 678 6.256 4.720 10.704 137 HH11 ARG 678 HH21 ARG 678 8.944 6.870 11.008 138 HH12 ARG 678 HH22 ARG 678 8.735 7.144 12.718 139 HH21 ARG 678 HH11 ARG 678 5.944 5.077 12.939 140 HH22 ARG 678 HH12 ARG 678 7.025 6.174 13.795 141 H ALA 679 H ALA 679 11.397 4.212 7.661 142 HA ALA 679 HA ALA 679 11.223 6.767 6.473 143 HB1 ALA 679 HB1 ALA 679 13.945 5.790 6.817 144 HB2 ALA 679 HB2 ALA 679 12.940 5.442 8.223 145 HB3 ALA 679 HB3 ALA 679 13.113 7.105 7.652 146 H GLY 680 H GLY 680 12.456 3.693 5.386 147 HA2 GLY 680 HA2 GLY 680 13.842 4.658 3.068 148 HA3 GLY 680 HA3 GLY 680 13.340 2.995 3.355 149 H ALA 681 H ALA 681 10.644 3.229 3.627 150 HA ALA 681 HA ALA 681 9.715 3.266 0.983 151 HB1 ALA 681 HB1 ALA 681 8.592 2.077 2.822 152 HB2 ALA 681 HB2 ALA 681 7.473 3.146 1.978 153 HB3 ALA 681 HB3 ALA 681 8.137 3.619 3.543 154 H GLU 682 H GLU 682 9.313 5.739 3.553 155 HA GLU 682 HA GLU 682 7.964 7.532 1.758 156 HB2 GLU 682 HB2 GLU 682 8.130 9.162 3.608 157 HB3 GLU 682 HB3 GLU 682 7.459 7.618 4.120 158 HG2 GLU 682 HG2 GLU 682 9.916 7.017 4.732 159 HG3 GLU 682 HG3 GLU 682 10.186 8.748 4.661 160 H SER 683 H SER 683 11.207 6.753 2.186 161 HA SER 683 HA SER 683 12.511 9.193 1.845 162 HB2 SER 683 HB2 SER 683 14.393 7.924 1.107 163 HB3 SER 683 HB3 SER 683 13.548 6.900 2.265 164 HG SER 683 HG SER 683 12.798 5.647 0.657 165 H ILE 684 H ILE 684 11.118 6.979 -0.497 166 HA ILE 684 HA ILE 684 11.783 8.695 -2.754 167 HB ILE 684 HB ILE 684 9.855 6.409 -2.955 168 HG12 ILE 684 HG12 ILE 684 12.423 5.314 -3.319 169 HG13 ILE 684 HG13 ILE 684 12.527 6.212 -1.807 170 HG21 ILE 684 HG21 ILE 684 10.621 7.869 -4.895 171 HG22 ILE 684 HG22 ILE 684 12.227 7.177 -4.674 172 HG23 ILE 684 HG23 ILE 684 10.871 6.136 -5.112 173 HD11 ILE 684 HD11 ILE 684 10.068 4.927 -1.612 174 HD12 ILE 684 HD12 ILE 684 11.093 3.729 -2.400 175 HD13 ILE 684 HD13 ILE 684 11.565 4.405 -0.842 176 H LEU 685 H LEU 685 8.841 7.517 -1.162 177 HA LEU 685 HA LEU 685 6.963 8.977 -2.631 178 HB2 LEU 685 HB2 LEU 685 7.037 7.584 -0.013 179 HB3 LEU 685 HB3 LEU 685 5.716 8.719 -0.271 180 HG LEU 685 HG LEU 685 4.946 7.545 -2.196 181 HD11 LEU 685 HD11 LEU 685 6.926 7.065 -3.410 182 HD12 LEU 685 HD12 LEU 685 7.632 6.171 -2.064 183 HD13 LEU 685 HD13 LEU 685 6.286 5.482 -2.973 184 HD21 LEU 685 HD21 LEU 685 4.166 6.338 -0.354 185 HD22 LEU 685 HD22 LEU 685 4.962 5.086 -1.305 186 HD23 LEU 685 HD23 LEU 685 5.779 5.784 0.091 187 H ALA 686 H ALA 686 8.602 9.864 0.442 188 HA ALA 686 HA ALA 686 7.221 12.320 0.751 189 HB1 ALA 686 HB1 ALA 686 8.577 11.206 2.524 190 HB2 ALA 686 HB2 ALA 686 8.939 12.920 2.322 191 HB3 ALA 686 HB3 ALA 686 10.035 11.702 1.663 192 H ASN 687 H ASN 687 10.104 11.392 -1.025 193 HA ASN 687 HA ASN 687 10.825 14.058 -1.819 194 HB2 ASN 687 HB2 ASN 687 12.410 12.110 -1.740 195 HB3 ASN 687 HB3 ASN 687 11.562 11.424 -3.121 196 HD21 ASN 687 HD21 ASN 687 13.711 14.043 -2.105 197 HD22 ASN 687 HD22 ASN 687 14.110 14.553 -3.674 198 H ARG 688 H ARG 688 8.952 11.396 -3.225 199 HA ARG 688 HA ARG 688 8.488 12.602 -5.764 200 HB2 ARG 688 HB2 ARG 688 7.674 10.214 -4.352 201 HB3 ARG 688 HB3 ARG 688 6.324 10.925 -5.231 202 HG2 ARG 688 HG2 ARG 688 7.259 9.681 -6.935 203 HG3 ARG 688 HG3 ARG 688 8.168 11.179 -7.143 204 HD2 ARG 688 HD2 ARG 688 9.562 9.782 -5.167 205 HD3 ARG 688 HD3 ARG 688 9.102 8.561 -6.329 206 HE ARG 688 HE ARG 688 10.451 9.617 -7.946 207 HH11 ARG 688 HH21 ARG 688 10.192 11.448 -5.041 208 HH12 ARG 688 HH22 ARG 688 11.598 12.424 -5.363 209 HH21 ARG 688 HH11 ARG 688 12.249 10.889 -8.381 210 HH22 ARG 688 HH12 ARG 688 12.732 12.112 -7.259 211 H SER 689 H SER 689 6.041 12.841 -6.448 212 HA SER 689 HA SER 689 4.999 15.091 -4.935 213 HB2 SER 689 HB2 SER 689 3.187 14.789 -6.879 214 HB3 SER 689 HB3 SER 689 4.751 15.549 -7.175 215 HG SER 689 HG SER 689 3.750 13.213 -8.138 216 H ASP 690 H ASP 690 2.626 15.217 -4.511 217 HA ASP 690 HA ASP 690 1.791 13.189 -2.756 218 HB2 ASP 690 HB2 ASP 690 0.623 15.642 -3.900 219 HB3 ASP 690 HB3 ASP 690 -0.536 14.427 -3.368 220 H GLY 691 H GLY 691 0.588 11.412 -2.976 221 HA2 GLY 691 HA2 GLY 691 -1.148 10.134 -4.082 222 HA3 GLY 691 HA3 GLY 691 -0.659 10.867 -5.608 223 H THR 692 H THR 692 2.193 10.475 -4.392 224 HA THR 692 HA THR 692 2.768 8.066 -5.837 225 HB THR 692 HB THR 692 4.628 9.414 -3.871 226 HG1 THR 692 HG1 THR 692 4.020 11.101 -5.120 227 HG21 THR 692 HG21 THR 692 6.321 8.403 -5.100 228 HG22 THR 692 HG22 THR 692 5.052 7.182 -5.204 229 HG23 THR 692 HG23 THR 692 5.331 8.281 -6.554 230 H PHE 693 H PHE 693 2.892 6.008 -5.078 231 HA PHE 693 HA PHE 693 2.987 5.609 -2.157 232 HB2 PHE 693 HB2 PHE 693 1.088 4.163 -2.141 233 HB3 PHE 693 HB3 PHE 693 0.599 5.648 -2.952 234 HD1 PHE 693 HD2 PHE 693 1.439 2.089 -3.419 235 HD2 PHE 693 HD1 PHE 693 0.162 5.709 -5.338 236 HE1 PHE 693 HE2 PHE 693 0.784 0.795 -5.429 237 HE2 PHE 693 HE1 PHE 693 -0.496 4.415 -7.348 238 HZ PHE 693 HZ PHE 693 -0.180 1.956 -7.396 239 H LEU 694 H LEU 694 3.233 3.300 -1.583 240 HA LEU 694 HA LEU 694 4.224 1.471 -3.548 241 HB2 LEU 694 HB2 LEU 694 6.532 1.453 -3.049 242 HB3 LEU 694 HB3 LEU 694 6.131 3.158 -3.238 243 HG LEU 694 HG LEU 694 5.691 3.009 -0.631 244 HD11 LEU 694 HD11 LEU 694 6.890 0.446 -1.262 245 HD12 LEU 694 HD12 LEU 694 7.917 1.356 -0.154 246 HD13 LEU 694 HD13 LEU 694 6.239 1.021 0.274 247 HD21 LEU 694 HD21 LEU 694 7.975 3.648 -2.301 248 HD22 LEU 694 HD22 LEU 694 7.401 4.460 -0.845 249 HD23 LEU 694 HD23 LEU 694 8.502 3.091 -0.714 250 H VAL 695 H VAL 695 4.953 -0.546 -2.591 251 HA VAL 695 HA VAL 695 3.973 -0.902 0.182 252 HB VAL 695 HB VAL 695 3.615 -2.875 -2.077 253 HG11 VAL 695 HG11 VAL 695 2.904 -2.771 0.841 254 HG12 VAL 695 HG12 VAL 695 1.887 -3.673 -0.272 255 HG13 VAL 695 HG13 VAL 695 3.585 -4.104 -0.089 256 HG21 VAL 695 HG21 VAL 695 1.200 -1.727 -0.933 257 HG22 VAL 695 HG22 VAL 695 2.219 -0.478 -1.642 258 HG23 VAL 695 HG23 VAL 695 1.689 -1.841 -2.625 259 H ARG 696 H ARG 696 5.186 -2.166 1.514 260 HA ARG 696 HA ARG 696 7.540 -3.490 0.304 261 HB2 ARG 696 HB2 ARG 696 8.846 -2.830 2.302 262 HB3 ARG 696 HB3 ARG 696 8.295 -1.456 1.350 263 HG2 ARG 696 HG2 ARG 696 6.237 -1.539 3.012 264 HG3 ARG 696 HG3 ARG 696 7.397 -2.369 4.056 265 HD2 ARG 696 HD2 ARG 696 9.009 -0.466 3.586 266 HD3 ARG 696 HD3 ARG 696 7.677 0.368 2.802 267 HE ARG 696 HE ARG 696 6.860 0.891 4.891 268 HH11 ARG 696 HH21 ARG 696 9.141 -1.727 5.181 269 HH12 ARG 696 HH22 ARG 696 9.007 -1.777 6.919 270 HH21 ARG 696 HH11 ARG 696 6.815 0.850 7.115 271 HH22 ARG 696 HH12 ARG 696 7.742 -0.318 7.988 272 H GLN 697 H GLN 697 8.580 -5.068 1.786 273 HA GLN 697 HA GLN 697 6.558 -6.615 3.304 274 HB2 GLN 697 HB2 GLN 697 7.077 -7.698 1.177 275 HB3 GLN 697 HB3 GLN 697 8.800 -7.596 1.519 276 HG2 GLN 697 HG2 GLN 697 7.838 -9.859 2.000 277 HG3 GLN 697 HG3 GLN 697 8.567 -9.106 3.414 278 HE21 GLN 697 HE21 GLN 697 5.705 -10.568 2.244 279 HE22 GLN 697 HE22 GLN 697 4.684 -10.130 3.527 280 H ARG 698 H ARG 698 7.194 -7.553 5.203 281 HA ARG 698 HA ARG 698 9.679 -8.125 6.210 282 HB2 ARG 698 HB2 ARG 698 9.348 -5.270 5.965 283 HB3 ARG 698 HB3 ARG 698 9.494 -5.707 7.651 284 HG2 ARG 698 HG2 ARG 698 11.398 -6.805 5.580 285 HG3 ARG 698 HG3 ARG 698 11.676 -5.238 6.330 286 HD2 ARG 698 HD2 ARG 698 12.135 -7.915 7.405 287 HD3 ARG 698 HD3 ARG 698 12.768 -6.370 7.954 288 HE ARG 698 HE ARG 698 10.633 -7.818 9.149 289 HH11 ARG 698 HH21 ARG 698 11.527 -4.602 8.258 290 HH12 ARG 698 HH22 ARG 698 10.580 -3.868 9.509 291 HH21 ARG 698 HH11 ARG 698 9.455 -6.870 10.765 292 HH22 ARG 698 HH12 ARG 698 9.439 -5.130 10.917 293 H VAL 699 H VAL 699 9.056 -9.471 7.786 294 HA VAL 699 HA VAL 699 6.537 -9.191 9.135 295 HB VAL 699 HB VAL 699 7.745 -11.366 8.534 296 HG11 VAL 699 HG11 VAL 699 9.857 -10.370 9.823 297 HG12 VAL 699 HG12 VAL 699 9.091 -11.174 11.197 298 HG13 VAL 699 HG13 VAL 699 9.538 -12.100 9.763 299 HG21 VAL 699 HG21 VAL 699 6.809 -12.521 10.504 300 HG22 VAL 699 HG22 VAL 699 6.768 -11.004 11.401 301 HG23 VAL 699 HG23 VAL 699 5.722 -11.233 9.998 302 H LYS 700 H LYS 700 6.203 -9.006 11.401 303 HA LYS 700 HA LYS 700 8.313 -8.218 13.186 304 HB2 LYS 700 HB2 LYS 700 7.978 -6.130 11.842 305 HB3 LYS 700 HB3 LYS 700 6.319 -6.071 12.421 306 HG2 LYS 700 HG2 LYS 700 7.023 -5.791 14.695 307 HG3 LYS 700 HG3 LYS 700 8.692 -6.203 14.300 308 HD2 LYS 700 HD2 LYS 700 8.545 -3.789 14.547 309 HD3 LYS 700 HD3 LYS 700 8.795 -4.155 12.840 310 HE2 LYS 700 HE2 LYS 700 7.045 -2.458 13.077 311 HE3 LYS 700 HE3 LYS 700 6.346 -3.958 12.464 312 HZ1 LYS 700 HZ1 LYS 700 5.660 -2.545 14.812 313 HZ2 LYS 700 HZ2 LYS 700 4.988 -4.035 14.206 314 HZ3 LYS 700 HZ3 LYS 700 6.336 -4.055 15.259 315 H ASP 701 H ASP 701 5.132 -6.777 13.421 316 HA ASP 701 HA ASP 701 4.588 -8.410 15.777 317 HB2 ASP 701 HB2 ASP 701 2.611 -6.809 15.989 318 HB3 ASP 701 HB3 ASP 701 4.210 -6.087 16.133 319 H ALA 702 H ALA 702 1.863 -7.201 14.087 320 HA ALA 702 HA ALA 702 1.217 -9.916 13.083 321 HB1 ALA 702 HB1 ALA 702 -0.929 -9.828 13.970 322 HB2 ALA 702 HB2 ALA 702 -0.940 -8.066 14.049 323 HB3 ALA 702 HB3 ALA 702 -0.014 -8.996 15.228 324 H ALA 703 H ALA 703 1.836 -9.417 10.994 325 HA ALA 703 HA ALA 703 -0.059 -8.424 9.227 326 HB1 ALA 703 HB1 ALA 703 1.947 -6.344 9.014 327 HB2 ALA 703 HB2 ALA 703 1.146 -6.292 10.583 328 HB3 ALA 703 HB3 ALA 703 0.192 -6.196 9.104 329 H GLU 704 H GLU 704 0.903 -7.945 7.026 330 HA GLU 704 HA GLU 704 3.333 -9.608 6.656 331 HB2 GLU 704 HB2 GLU 704 0.726 -9.698 5.428 332 HB3 GLU 704 HB3 GLU 704 1.944 -9.381 4.198 333 HG2 GLU 704 HG2 GLU 704 3.116 -11.342 5.797 334 HG3 GLU 704 HG3 GLU 704 1.428 -11.832 5.686 335 H PHE 705 H PHE 705 1.993 -7.779 4.031 336 HA PHE 705 HA PHE 705 4.470 -6.325 3.711 337 HB2 PHE 705 HB2 PHE 705 1.877 -6.205 2.145 338 HB3 PHE 705 HB3 PHE 705 3.377 -5.404 1.688 339 HD1 PHE 705 HD1 PHE 705 1.749 -8.701 2.175 340 HD2 PHE 705 HD2 PHE 705 5.212 -6.618 0.733 341 HE1 PHE 705 HE1 PHE 705 2.530 -10.770 1.062 342 HE2 PHE 705 HE2 PHE 705 5.992 -8.693 -0.383 343 HZ PHE 705 HZ PHE 705 4.648 -10.769 -0.218 344 H ALA 706 H ALA 706 4.340 -3.941 3.179 345 HA ALA 706 HA ALA 706 2.386 -2.576 4.927 346 HB1 ALA 706 HB1 ALA 706 4.721 -2.791 5.947 347 HB2 ALA 706 HB2 ALA 706 4.044 -1.164 5.857 348 HB3 ALA 706 HB3 ALA 706 5.254 -1.680 4.687 349 H ILE 707 H ILE 707 1.308 -0.999 3.945 350 HA ILE 707 HA ILE 707 2.165 -0.182 1.250 351 HB ILE 707 HB ILE 707 -0.396 0.632 2.620 352 HG12 ILE 707 HG12 ILE 707 -1.261 -1.441 1.219 353 HG13 ILE 707 HG13 ILE 707 0.388 -2.016 1.439 354 HG21 ILE 707 HG21 ILE 707 -0.920 1.468 0.583 355 HG22 ILE 707 HG22 ILE 707 0.761 1.201 0.123 356 HG23 ILE 707 HG23 ILE 707 -0.455 -0.032 -0.220 357 HD11 ILE 707 HD11 ILE 707 -1.743 -2.146 3.302 358 HD12 ILE 707 HD12 ILE 707 -0.067 -2.625 3.554 359 HD13 ILE 707 HD13 ILE 707 -0.587 -0.987 3.943 360 H SER 708 H SER 708 2.855 1.828 0.746 361 HA SER 708 HA SER 708 2.669 3.919 2.838 362 HB2 SER 708 HB2 SER 708 5.077 3.229 1.147 363 HB3 SER 708 HB3 SER 708 4.951 4.669 2.150 364 HG SER 708 HG SER 708 4.796 1.948 2.999 365 H ILE 709 H ILE 709 1.659 5.715 2.084 366 HA ILE 709 HA ILE 709 1.803 6.287 -0.828 367 HB ILE 709 HB ILE 709 -0.546 7.171 0.803 368 HG12 ILE 709 HG12 ILE 709 -1.519 4.923 -0.364 369 HG13 ILE 709 HG13 ILE 709 0.106 4.379 0.072 370 HG21 ILE 709 HG21 ILE 709 -1.300 7.822 -1.206 371 HG22 ILE 709 HG22 ILE 709 0.248 7.342 -1.902 372 HG23 ILE 709 HG23 ILE 709 -1.092 6.195 -1.859 373 HD11 ILE 709 HD11 ILE 709 -1.510 4.005 1.918 374 HD12 ILE 709 HD12 ILE 709 -0.239 5.142 2.376 375 HD13 ILE 709 HD13 ILE 709 -1.841 5.740 1.949 376 H LYS 710 H LYS 710 2.199 8.348 -1.434 377 HA LYS 710 HA LYS 710 2.907 10.258 0.678 378 HB2 LYS 710 HB2 LYS 710 4.567 10.070 -1.048 379 HB3 LYS 710 HB3 LYS 710 3.350 10.196 -2.314 380 HG2 LYS 710 HG2 LYS 710 4.362 12.340 -2.222 381 HG3 LYS 710 HG3 LYS 710 2.827 12.520 -1.384 382 HD2 LYS 710 HD2 LYS 710 3.815 12.708 0.698 383 HD3 LYS 710 HD3 LYS 710 5.256 11.792 0.230 384 HE2 LYS 710 HE2 LYS 710 4.576 14.528 -0.886 385 HE3 LYS 710 HE3 LYS 710 5.638 14.278 0.503 386 HZ1 LYS 710 HZ1 LYS 710 6.202 13.902 -2.298 387 HZ2 LYS 710 HZ2 LYS 710 7.281 13.991 -0.967 388 HZ3 LYS 710 HZ3 LYS 710 6.548 12.499 -1.380 389 H TYR 711 H TYR 711 1.077 11.194 1.438 390 HA TYR 711 HA TYR 711 -0.571 12.695 -0.490 391 HB2 TYR 711 HB2 TYR 711 -1.709 10.535 -0.040 392 HB3 TYR 711 HB3 TYR 711 -1.699 10.911 1.680 393 HD1 TYR 711 HD1 TYR 711 -2.512 12.824 -1.458 394 HD2 TYR 711 HD2 TYR 711 -3.762 11.601 2.462 395 HE1 TYR 711 HE1 TYR 711 -4.628 14.091 -1.735 396 HE2 TYR 711 HE2 TYR 711 -5.879 12.854 2.185 397 HH TYR 711 HH TYR 711 -7.193 13.673 -0.445 398 H ASN 712 H ASN 712 -0.356 14.730 0.119 399 HA ASN 712 HA ASN 712 -0.675 16.597 1.464 400 HB2 ASN 712 HB2 ASN 712 -2.202 15.170 2.905 401 HB3 ASN 712 HB3 ASN 712 -0.779 14.749 3.854 402 HD21 ASN 712 HD21 ASN 712 -0.486 16.037 5.638 403 HD22 ASN 712 HD22 ASN 712 -0.988 17.665 5.755 404 H VAL 713 H VAL 713 1.703 15.961 0.506 405 HA VAL 713 HA VAL 713 3.992 15.993 0.808 406 HB VAL 713 HB VAL 713 4.796 17.865 2.105 407 HG11 VAL 713 HG11 VAL 713 2.274 19.124 1.323 408 HG12 VAL 713 HG12 VAL 713 3.889 19.341 0.647 409 HG13 VAL 713 HG13 VAL 713 2.872 18.009 0.095 410 HG21 VAL 713 HG21 VAL 713 3.280 17.329 4.116 411 HG22 VAL 713 HG22 VAL 713 3.497 19.034 3.727 412 HG23 VAL 713 HG23 VAL 713 2.016 18.206 3.253 413 H GLU 714 H GLU 714 2.697 13.890 2.184 414 HA GLU 714 HA GLU 714 4.777 13.223 4.093 415 HB2 GLU 714 HB2 GLU 714 3.234 12.667 5.909 416 HB3 GLU 714 HB3 GLU 714 3.067 14.375 5.494 417 HG2 GLU 714 HG2 GLU 714 1.150 13.698 3.972 418 HG3 GLU 714 HG3 GLU 714 1.235 12.097 4.697 419 H VAL 715 H VAL 715 4.757 10.930 4.616 420 HA VAL 715 HA VAL 715 3.317 9.352 2.572 421 HB VAL 715 HB VAL 715 5.832 8.540 4.013 422 HG11 VAL 715 HG11 VAL 715 4.442 6.773 2.918 423 HG12 VAL 715 HG12 VAL 715 4.589 7.647 1.392 424 HG13 VAL 715 HG13 VAL 715 6.022 6.959 2.156 425 HG21 VAL 715 HG21 VAL 715 6.531 10.471 2.859 426 HG22 VAL 715 HG22 VAL 715 6.839 9.189 1.691 427 HG23 VAL 715 HG23 VAL 715 5.404 10.196 1.533 428 H LYS 716 H LYS 716 1.693 8.155 3.323 429 HA LYS 716 HA LYS 716 1.588 7.486 6.187 430 HB2 LYS 716 HB2 LYS 716 -0.555 6.758 4.215 431 HB3 LYS 716 HB3 LYS 716 -0.711 7.206 5.913 432 HG2 LYS 716 HG2 LYS 716 0.453 9.457 4.736 433 HG3 LYS 716 HG3 LYS 716 -0.729 8.915 3.541 434 HD2 LYS 716 HD2 LYS 716 -2.518 9.045 5.099 435 HD3 LYS 716 HD3 LYS 716 -1.418 9.186 6.470 436 HE2 LYS 716 HE2 LYS 716 -0.712 11.310 4.782 437 HE3 LYS 716 HE3 LYS 716 -2.476 11.276 4.745 438 HZ1 LYS 716 HZ1 LYS 716 -2.512 12.148 6.764 439 HZ2 LYS 716 HZ2 LYS 716 -1.647 10.838 7.379 440 HZ3 LYS 716 HZ3 LYS 716 -0.790 12.206 6.809 441 H HIS 717 H HIS 717 2.314 5.578 6.900 442 HA HIS 717 HA HIS 717 2.453 3.317 5.017 443 HB2 HIS 717 HB2 HIS 717 3.922 3.474 7.631 444 HB3 HIS 717 HB3 HIS 717 4.271 2.459 6.233 445 HD1 HIS 717 HD1 HIS 717 5.309 3.659 4.103 446 HD2 HIS 717 HD2 HIS 717 5.011 6.042 7.538 447 HE1 HIS 717 HE1 HIS 717 6.884 5.638 3.777 448 HE2 HIS 717 HE2 HIS 717 6.757 7.079 5.885 449 H ILE 718 H ILE 718 1.476 1.446 5.435 450 HA ILE 718 HA ILE 718 0.304 0.958 8.091 451 HB ILE 718 HB ILE 718 -1.256 0.690 5.514 452 HG12 ILE 718 HG12 ILE 718 -2.247 2.456 7.649 453 HG13 ILE 718 HG13 ILE 718 -0.760 3.023 6.891 454 HG21 ILE 718 HG21 ILE 718 -1.803 -0.998 7.261 455 HG22 ILE 718 HG22 ILE 718 -2.098 0.313 8.406 456 HG23 ILE 718 HG23 ILE 718 -3.129 0.132 6.987 457 HD11 ILE 718 HD11 ILE 718 -3.441 2.519 5.651 458 HD12 ILE 718 HD12 ILE 718 -2.382 3.921 5.486 459 HD13 ILE 718 HD13 ILE 718 -1.981 2.412 4.660 460 H LYS 719 H LYS 719 0.249 -1.157 8.673 461 HA LYS 719 HA LYS 719 1.755 -3.009 7.015 462 HB2 LYS 719 HB2 LYS 719 1.629 -4.475 9.007 463 HB3 LYS 719 HB3 LYS 719 2.287 -2.891 9.385 464 HG2 LYS 719 HG2 LYS 719 0.017 -2.176 10.164 465 HG3 LYS 719 HG3 LYS 719 -0.564 -3.818 9.882 466 HD2 LYS 719 HD2 LYS 719 1.487 -4.491 11.404 467 HD3 LYS 719 HD3 LYS 719 1.368 -2.825 11.965 468 HE2 LYS 719 HE2 LYS 719 -0.458 -3.291 13.207 469 HE3 LYS 719 HE3 LYS 719 -1.259 -4.082 11.847 470 HZ1 LYS 719 HZ1 LYS 719 -0.274 -6.135 12.343 471 HZ2 LYS 719 HZ2 LYS 719 0.942 -5.427 13.347 472 HZ3 LYS 719 HZ3 LYS 719 -0.687 -5.502 13.875 473 H ILE 720 H ILE 720 0.913 -4.598 5.800 474 HA ILE 720 HA ILE 720 -1.990 -4.806 5.618 475 HB ILE 720 HB ILE 720 0.223 -5.206 3.852 476 HG12 ILE 720 HG12 ILE 720 -2.648 -5.651 3.102 477 HG13 ILE 720 HG13 ILE 720 -2.139 -4.060 3.665 478 HG21 ILE 720 HG21 ILE 720 -0.430 -7.298 2.760 479 HG22 ILE 720 HG22 ILE 720 0.005 -7.623 4.437 480 HG23 ILE 720 HG23 ILE 720 -1.693 -7.561 3.961 481 HD11 ILE 720 HD11 ILE 720 -0.138 -4.566 1.914 482 HD12 ILE 720 HD12 ILE 720 -1.441 -5.477 1.149 483 HD13 ILE 720 HD13 ILE 720 -1.632 -3.750 1.452 484 H MET 721 H MET 721 -3.188 -6.713 5.841 485 HA MET 721 HA MET 721 -1.955 -8.756 7.597 486 HB2 MET 721 HB2 MET 721 -4.052 -7.270 8.240 487 HB3 MET 721 HB3 MET 721 -4.913 -8.476 7.287 488 HG2 MET 721 HG2 MET 721 -4.772 -9.040 9.739 489 HG3 MET 721 HG3 MET 721 -4.092 -10.276 8.688 490 HE1 MET 721 HE1 MET 721 -3.857 -10.356 11.351 491 HE2 MET 721 HE2 MET 721 -2.196 -10.930 11.481 492 HE3 MET 721 HE3 MET 721 -2.682 -9.428 12.277 493 H THR 722 H THR 722 -2.915 -10.985 7.335 494 HA THR 722 HA THR 722 -3.501 -11.527 4.480 495 HB THR 722 HB THR 722 -1.337 -12.388 4.767 496 HG1 THR 722 HG1 THR 722 -3.272 -14.374 5.355 497 HG21 THR 722 HG21 THR 722 -0.831 -13.870 6.805 498 HG22 THR 722 HG22 THR 722 -0.965 -12.137 7.101 499 HG23 THR 722 HG23 THR 722 -2.306 -13.210 7.510 500 H ALA 723 H ALA 723 -5.643 -11.069 5.943 501 HA ALA 723 HA ALA 723 -6.752 -13.117 7.494 502 HB1 ALA 723 HB1 ALA 723 -7.665 -10.712 6.196 503 HB2 ALA 723 HB2 ALA 723 -8.322 -11.521 7.618 504 HB3 ALA 723 HB3 ALA 723 -8.864 -11.990 6.005 505 H GLU 724 H GLU 724 -7.180 -15.160 7.005 506 HA GLU 724 HA GLU 724 -7.438 -17.076 5.739 507 HB2 GLU 724 HB2 GLU 724 -9.465 -15.522 4.153 508 HB3 GLU 724 HB3 GLU 724 -9.540 -17.190 4.725 509 HG2 GLU 724 HG2 GLU 724 -9.908 -14.646 6.311 510 HG3 GLU 724 HG3 GLU 724 -11.000 -16.021 6.179 511 H GLY 725 H GLY 725 -5.498 -15.039 4.710 512 HA2 GLY 725 HA2 GLY 725 -3.953 -15.383 2.938 513 HA3 GLY 725 HA3 GLY 725 -5.221 -16.177 2.013 514 H LEU 726 H LEU 726 -6.738 -13.539 3.204 515 HA LEU 726 HA LEU 726 -6.344 -12.061 0.696 516 HB2 LEU 726 HB2 LEU 726 -8.248 -11.345 2.926 517 HB3 LEU 726 HB3 LEU 726 -8.337 -10.889 1.227 518 HG LEU 726 HG LEU 726 -8.516 -13.762 2.163 519 HD11 LEU 726 HD11 LEU 726 -10.625 -11.634 1.819 520 HD12 LEU 726 HD12 LEU 726 -11.018 -13.338 1.581 521 HD13 LEU 726 HD13 LEU 726 -10.422 -12.780 3.146 522 HD21 LEU 726 HD21 LEU 726 -7.988 -12.818 -0.316 523 HD22 LEU 726 HD22 LEU 726 -8.948 -14.271 -0.039 524 HD23 LEU 726 HD23 LEU 726 -9.749 -12.730 -0.347 525 H TYR 727 H TYR 727 -5.546 -9.980 0.559 526 HA TYR 727 HA TYR 727 -4.079 -9.038 2.910 527 HB2 TYR 727 HB2 TYR 727 -3.929 -8.372 -0.021 528 HB3 TYR 727 HB3 TYR 727 -3.098 -7.416 1.201 529 HD1 TYR 727 HD2 TYR 727 -3.306 -10.755 2.381 530 HD2 TYR 727 HD1 TYR 727 -1.162 -8.283 -0.397 531 HE1 TYR 727 HE2 TYR 727 -1.431 -12.374 2.378 532 HE2 TYR 727 HE1 TYR 727 0.708 -9.895 -0.397 533 HH TYR 727 HH TYR 727 1.113 -12.241 1.929 534 H ARG 728 H ARG 728 -4.416 -7.109 3.877 535 HA ARG 728 HA ARG 728 -6.423 -5.259 2.814 536 HB2 ARG 728 HB2 ARG 728 -7.277 -5.345 5.380 537 HB3 ARG 728 HB3 ARG 728 -8.018 -6.275 4.084 538 HG2 ARG 728 HG2 ARG 728 -6.589 -8.208 4.629 539 HG3 ARG 728 HG3 ARG 728 -5.801 -7.272 5.898 540 HD2 ARG 728 HD2 ARG 728 -8.670 -7.160 6.223 541 HD3 ARG 728 HD3 ARG 728 -8.138 -8.837 6.128 542 HE ARG 728 HE ARG 728 -6.524 -7.205 7.906 543 HH11 ARG 728 HH21 ARG 728 -9.356 -9.149 7.593 544 HH12 ARG 728 HH22 ARG 728 -9.431 -9.529 9.275 545 HH21 ARG 728 HH11 ARG 728 -6.616 -7.666 10.072 546 HH22 ARG 728 HH12 ARG 728 -7.895 -8.694 10.678 547 H ILE 729 H ILE 729 -6.128 -3.198 3.444 548 HA ILE 729 HA ILE 729 -3.661 -2.578 4.887 549 HB ILE 729 HB ILE 729 -5.594 -0.617 3.660 550 HG12 ILE 729 HG12 ILE 729 -3.412 -2.246 2.331 551 HG13 ILE 729 HG13 ILE 729 -5.124 -2.230 1.923 552 HG21 ILE 729 HG21 ILE 729 -4.023 0.636 4.785 553 HG22 ILE 729 HG22 ILE 729 -2.776 -0.609 4.649 554 HG23 ILE 729 HG23 ILE 729 -3.160 0.411 3.262 555 HD11 ILE 729 HD11 ILE 729 -4.541 0.416 1.704 556 HD12 ILE 729 HD12 ILE 729 -2.999 -0.298 1.228 557 HD13 ILE 729 HD13 ILE 729 -4.472 -0.717 0.352 558 H THR 730 H THR 730 -7.137 -2.144 5.151 559 HA THR 730 HA THR 730 -6.766 -0.880 7.804 560 HB THR 730 HB THR 730 -7.956 0.498 6.212 561 HG1 THR 730 HG1 THR 730 -9.496 1.038 7.559 562 HG21 THR 730 HG21 THR 730 -9.742 -1.908 5.899 563 HG22 THR 730 HG22 THR 730 -10.221 -0.298 5.389 564 HG23 THR 730 HG23 THR 730 -8.827 -1.079 4.647 565 H GLU 731 H GLU 731 -7.318 -3.767 6.445 566 HA GLU 731 HA GLU 731 -7.944 -5.776 7.314 567 HB2 GLU 731 HB2 GLU 731 -8.749 -4.316 9.826 568 HB3 GLU 731 HB3 GLU 731 -8.325 -6.022 9.656 569 HG2 GLU 731 HG2 GLU 731 -6.120 -4.783 8.568 570 HG3 GLU 731 HG3 GLU 731 -6.562 -3.659 9.851 571 H LYS 732 H LYS 732 -10.002 -3.112 7.119 572 HA LYS 732 HA LYS 732 -12.491 -4.509 7.551 573 HB2 LYS 732 HB2 LYS 732 -12.178 -1.850 6.168 574 HB3 LYS 732 HB3 LYS 732 -13.532 -2.429 7.146 575 HG2 LYS 732 HG2 LYS 732 -10.753 -1.745 8.153 576 HG3 LYS 732 HG3 LYS 732 -12.219 -0.812 8.428 577 HD2 LYS 732 HD2 LYS 732 -12.412 -3.661 9.212 578 HD3 LYS 732 HD3 LYS 732 -11.271 -2.709 10.158 579 HE2 LYS 732 HE2 LYS 732 -13.961 -1.537 9.593 580 HE3 LYS 732 HE3 LYS 732 -13.837 -2.805 10.819 581 HZ1 LYS 732 HZ1 LYS 732 -13.364 -0.185 11.276 582 HZ2 LYS 732 HZ2 LYS 732 -12.706 -1.484 12.224 583 HZ3 LYS 732 HZ3 LYS 732 -11.770 -0.778 10.963 584 H LYS 733 H LYS 733 -10.687 -3.309 4.710 585 HA LYS 733 HA LYS 733 -12.426 -5.026 3.040 586 HB2 LYS 733 HB2 LYS 733 -12.951 -2.772 2.451 587 HB3 LYS 733 HB3 LYS 733 -11.246 -2.321 2.385 588 HG2 LYS 733 HG2 LYS 733 -12.336 -2.733 0.121 589 HG3 LYS 733 HG3 LYS 733 -10.876 -3.675 0.426 590 HD2 LYS 733 HD2 LYS 733 -12.151 -5.654 0.930 591 HD3 LYS 733 HD3 LYS 733 -13.660 -4.744 0.983 592 HE2 LYS 733 HE2 LYS 733 -13.955 -5.111 -1.214 593 HE3 LYS 733 HE3 LYS 733 -12.454 -4.252 -1.554 594 HZ1 LYS 733 HZ1 LYS 733 -11.771 -6.238 -2.314 595 HZ2 LYS 733 HZ2 LYS 733 -11.536 -6.646 -0.671 596 HZ3 LYS 733 HZ3 LYS 733 -12.971 -7.099 -1.477 597 H ALA 734 H ALA 734 -11.235 -6.785 2.763 598 HA ALA 734 HA ALA 734 -8.389 -6.562 2.087 599 HB1 ALA 734 HB1 ALA 734 -8.936 -9.238 2.172 600 HB2 ALA 734 HB2 ALA 734 -10.128 -8.608 3.306 601 HB3 ALA 734 HB3 ALA 734 -8.414 -8.289 3.560 602 H PHE 735 H PHE 735 -7.671 -8.325 0.475 603 HA PHE 735 HA PHE 735 -9.547 -8.697 -1.750 604 HB2 PHE 735 HB2 PHE 735 -7.269 -6.833 -1.751 605 HB3 PHE 735 HB3 PHE 735 -7.314 -7.928 -3.130 606 HD1 PHE 735 HD2 PHE 735 -9.415 -8.070 -4.531 607 HD2 PHE 735 HD1 PHE 735 -8.829 -5.048 -1.539 608 HE1 PHE 735 HE2 PHE 735 -11.234 -6.723 -5.539 609 HE2 PHE 735 HE1 PHE 735 -10.649 -3.699 -2.546 610 HZ PHE 735 HZ PHE 735 -11.854 -4.538 -4.547 611 H ARG 736 H ARG 736 -8.325 -9.950 -3.570 612 HA ARG 736 HA ARG 736 -7.663 -12.480 -2.681 613 HB2 ARG 736 HB2 ARG 736 -7.094 -10.974 -5.206 614 HB3 ARG 736 HB3 ARG 736 -6.370 -12.560 -4.972 615 HG2 ARG 736 HG2 ARG 736 -8.429 -12.965 -6.094 616 HG3 ARG 736 HG3 ARG 736 -8.719 -13.401 -4.411 617 HD2 ARG 736 HD2 ARG 736 -10.036 -11.521 -4.008 618 HD3 ARG 736 HD3 ARG 736 -9.301 -10.595 -5.310 619 HE ARG 736 HE ARG 736 -11.494 -12.490 -5.548 620 HH11 ARG 736 HH21 ARG 736 -9.012 -10.652 -7.178 621 HH12 ARG 736 HH22 ARG 736 -9.772 -10.845 -8.734 622 HH21 ARG 736 HH11 ARG 736 -12.431 -12.679 -7.568 623 HH22 ARG 736 HH12 ARG 736 -11.683 -11.951 -8.944 624 H GLY 737 H GLY 737 -5.395 -9.927 -3.687 625 HA2 GLY 737 HA2 GLY 737 -3.397 -10.993 -1.831 626 HA3 GLY 737 HA3 GLY 737 -2.957 -10.902 -3.535 627 H LEU 738 H LEU 738 -1.289 -9.435 -2.880 628 HA LEU 738 HA LEU 738 -1.923 -6.916 -1.675 629 HB2 LEU 738 HB2 LEU 738 0.414 -8.326 -2.174 630 HB3 LEU 738 HB3 LEU 738 0.522 -6.955 -3.275 631 HG LEU 738 HG LEU 738 0.156 -6.873 -0.270 632 HD11 LEU 738 HD11 LEU 738 2.251 -5.747 -0.268 633 HD12 LEU 738 HD12 LEU 738 2.456 -7.125 -1.336 634 HD13 LEU 738 HD13 LEU 738 2.217 -5.516 -2.014 635 HD21 LEU 738 HD21 LEU 738 0.032 -4.411 -0.541 636 HD22 LEU 738 HD22 LEU 738 -0.004 -4.615 -2.291 637 HD23 LEU 738 HD23 LEU 738 -1.335 -5.210 -1.302 638 H THR 739 H THR 739 -0.960 -7.844 -4.969 639 HA THR 739 HA THR 739 -1.214 -5.428 -6.257 640 HB THR 739 HB THR 739 -2.239 -8.040 -7.384 641 HG1 THR 739 HG1 THR 739 -0.281 -8.740 -7.348 642 HG21 THR 739 HG21 THR 739 -2.716 -6.119 -8.777 643 HG22 THR 739 HG22 THR 739 -1.052 -5.554 -8.631 644 HG23 THR 739 HG23 THR 739 -1.406 -7.041 -9.512 645 H GLU 740 H GLU 740 -3.783 -7.856 -5.848 646 HA GLU 740 HA GLU 740 -5.875 -6.257 -6.873 647 HB2 GLU 740 HB2 GLU 740 -6.139 -8.457 -4.821 648 HB3 GLU 740 HB3 GLU 740 -7.358 -7.911 -5.971 649 HG2 GLU 740 HG2 GLU 740 -5.255 -8.514 -7.642 650 HG3 GLU 740 HG3 GLU 740 -5.061 -9.729 -6.381 651 H LEU 741 H LEU 741 -4.478 -6.513 -3.684 652 HA LEU 741 HA LEU 741 -6.578 -5.063 -2.367 653 HB2 LEU 741 HB2 LEU 741 -5.173 -6.729 -1.216 654 HB3 LEU 741 HB3 LEU 741 -3.755 -5.729 -1.492 655 HG LEU 741 HG LEU 741 -4.920 -5.598 0.809 656 HD11 LEU 741 HD11 LEU 741 -3.479 -3.771 -0.742 657 HD12 LEU 741 HD12 LEU 741 -4.795 -2.836 -0.034 658 HD13 LEU 741 HD13 LEU 741 -3.696 -3.742 1.004 659 HD21 LEU 741 HD21 LEU 741 -6.816 -4.117 0.978 660 HD22 LEU 741 HD22 LEU 741 -6.748 -3.750 -0.742 661 HD23 LEU 741 HD23 LEU 741 -7.218 -5.361 -0.204 662 H VAL 742 H VAL 742 -3.414 -4.260 -3.744 663 HA VAL 742 HA VAL 742 -3.711 -1.459 -2.901 664 HB VAL 742 HB VAL 742 -1.499 -3.034 -4.185 665 HG11 VAL 742 HG11 VAL 742 -1.829 -0.039 -4.029 666 HG12 VAL 742 HG12 VAL 742 -0.236 -0.795 -4.067 667 HG13 VAL 742 HG13 VAL 742 -1.348 -1.018 -5.418 668 HG21 VAL 742 HG21 VAL 742 -1.827 -3.048 -1.716 669 HG22 VAL 742 HG22 VAL 742 -0.304 -2.309 -2.190 670 HG23 VAL 742 HG23 VAL 742 -1.661 -1.293 -1.714 671 H GLU 743 H GLU 743 -3.966 -3.411 -5.822 672 HA GLU 743 HA GLU 743 -4.075 -1.108 -7.555 673 HB2 GLU 743 HB2 GLU 743 -4.800 -4.009 -8.019 674 HB3 GLU 743 HB3 GLU 743 -4.854 -2.768 -9.267 675 HG2 GLU 743 HG2 GLU 743 -2.370 -3.404 -7.643 676 HG3 GLU 743 HG3 GLU 743 -2.703 -4.097 -9.226 677 H PHE 744 H PHE 744 -6.077 -2.012 -5.217 678 HA PHE 744 HA PHE 744 -8.517 -1.264 -6.709 679 HB2 PHE 744 HB2 PHE 744 -8.538 -3.485 -5.515 680 HB3 PHE 744 HB3 PHE 744 -8.391 -2.599 -3.998 681 HD1 PHE 744 HD2 PHE 744 -10.547 -3.229 -6.935 682 HD2 PHE 744 HD1 PHE 744 -10.240 -1.300 -3.105 683 HE1 PHE 744 HE2 PHE 744 -12.990 -2.808 -6.949 684 HE2 PHE 744 HE1 PHE 744 -12.685 -0.880 -3.122 685 HZ PHE 744 HZ PHE 744 -14.059 -1.636 -5.043 686 H TYR 745 H TYR 745 -6.681 -0.723 -3.722 687 HA TYR 745 HA TYR 745 -8.347 1.331 -2.699 688 HB2 TYR 745 HB2 TYR 745 -5.494 0.526 -2.203 689 HB3 TYR 745 HB3 TYR 745 -6.138 2.006 -1.495 690 HD1 TYR 745 HD1 TYR 745 -7.506 -1.452 -2.078 691 HD2 TYR 745 HD2 TYR 745 -6.779 1.716 0.741 692 HE1 TYR 745 HE1 TYR 745 -8.601 -2.780 -0.293 693 HE2 TYR 745 HE2 TYR 745 -7.864 0.372 2.517 694 HH TYR 745 HH TYR 745 -8.965 -2.958 1.934 695 H GLN 746 H GLN 746 -6.283 1.242 -5.384 696 HA GLN 746 HA GLN 746 -5.458 3.979 -5.461 697 HB2 GLN 746 HB2 GLN 746 -5.159 3.482 -7.949 698 HB3 GLN 746 HB3 GLN 746 -4.241 2.454 -6.847 699 HG2 GLN 746 HG2 GLN 746 -5.386 0.594 -7.432 700 HG3 GLN 746 HG3 GLN 746 -6.935 1.428 -7.440 701 HE21 GLN 746 HE21 GLN 746 -4.439 0.156 -9.465 702 HE22 GLN 746 HE22 GLN 746 -5.021 0.792 -10.927 703 H GLN 747 H GLN 747 -8.374 2.310 -6.014 704 HA GLN 747 HA GLN 747 -9.609 4.645 -7.348 705 HB2 GLN 747 HB2 GLN 747 -10.918 1.948 -7.084 706 HB3 GLN 747 HB3 GLN 747 -11.199 3.203 -8.290 707 HG2 GLN 747 HG2 GLN 747 -8.440 2.394 -8.413 708 HG3 GLN 747 HG3 GLN 747 -9.455 0.961 -8.484 709 HE21 GLN 747 HE21 GLN 747 -7.844 2.419 -10.637 710 HE22 GLN 747 HE22 GLN 747 -8.981 2.693 -11.877 711 H ASN 748 H ASN 748 -9.925 2.305 -4.712 712 HA ASN 748 HA ASN 748 -12.291 3.501 -3.609 713 HB2 ASN 748 HB2 ASN 748 -11.388 1.086 -3.293 714 HB3 ASN 748 HB3 ASN 748 -10.375 1.795 -2.038 715 HD21 ASN 748 HD21 ASN 748 -12.056 3.633 -0.811 716 HD22 ASN 748 HD22 ASN 748 -13.423 2.848 -0.186 717 H SER 749 H SER 749 -12.274 5.482 -2.780 718 HA SER 749 HA SER 749 -10.189 7.085 -2.037 719 HB2 SER 749 HB2 SER 749 -12.198 7.754 -0.230 720 HB3 SER 749 HB3 SER 749 -12.003 8.398 -1.857 721 HG SER 749 HG SER 749 -13.571 6.183 -0.964 722 H LEU 750 H LEU 750 -8.601 6.812 -0.602 723 HA LEU 750 HA LEU 750 -8.501 4.794 1.305 724 HB2 LEU 750 HB2 LEU 750 -7.056 7.446 1.238 725 HB3 LEU 750 HB3 LEU 750 -6.661 6.141 2.357 726 HG LEU 750 HG LEU 750 -6.625 5.961 -0.662 727 HD11 LEU 750 HD11 LEU 750 -4.325 5.755 1.291 728 HD12 LEU 750 HD12 LEU 750 -4.235 5.861 -0.468 729 HD13 LEU 750 HD13 LEU 750 -4.761 7.254 0.474 730 HD21 LEU 750 HD21 LEU 750 -6.458 3.947 1.523 731 HD22 LEU 750 HD22 LEU 750 -7.076 3.773 -0.120 732 HD23 LEU 750 HD23 LEU 750 -5.338 3.750 0.175 733 H LYS 751 H LYS 751 -9.926 7.970 1.548 734 HA LYS 751 HA LYS 751 -10.068 8.240 4.328 735 HB2 LYS 751 HB2 LYS 751 -11.683 9.912 3.963 736 HB3 LYS 751 HB3 LYS 751 -10.682 9.941 2.515 737 HG2 LYS 751 HG2 LYS 751 -12.495 8.169 1.672 738 HG3 LYS 751 HG3 LYS 751 -13.502 9.012 2.849 739 HD2 LYS 751 HD2 LYS 751 -11.951 10.332 0.593 740 HD3 LYS 751 HD3 LYS 751 -13.692 10.054 0.611 741 HE2 LYS 751 HE2 LYS 751 -13.956 11.522 2.538 742 HE3 LYS 751 HE3 LYS 751 -12.207 11.717 2.671 743 HZ1 LYS 751 HZ1 LYS 751 -13.094 13.603 1.521 744 HZ2 LYS 751 HZ2 LYS 751 -12.208 12.666 0.395 745 HZ3 LYS 751 HZ3 LYS 751 -13.918 12.609 0.410 746 H ASP 752 H ASP 752 -11.618 5.983 2.270 747 HA ASP 752 HA ASP 752 -13.852 5.477 4.081 748 HB2 ASP 752 HB2 ASP 752 -13.048 3.710 1.780 749 HB3 ASP 752 HB3 ASP 752 -14.649 3.969 2.463 750 H CYS 753 H CYS 753 -10.732 4.089 3.249 751 HA CYS 753 HA CYS 753 -11.162 1.847 5.111 752 HB2 CYS 753 HB2 CYS 753 -9.019 2.381 3.047 753 HB3 CYS 753 HB3 CYS 753 -9.037 0.982 4.117 754 HG CYS 753 HG CYS 753 -11.178 1.521 1.901 755 H PHE 754 H PHE 754 -8.909 4.527 4.447 756 HA PHE 754 HA PHE 754 -7.240 3.916 6.714 757 HB2 PHE 754 HB2 PHE 754 -7.438 6.246 4.812 758 HB3 PHE 754 HB3 PHE 754 -6.303 6.234 6.156 759 HD1 PHE 754 HD2 PHE 754 -7.269 3.135 4.321 760 HD2 PHE 754 HD1 PHE 754 -4.309 6.217 4.786 761 HE1 PHE 754 HE2 PHE 754 -5.681 1.813 2.968 762 HE2 PHE 754 HE1 PHE 754 -2.731 4.891 3.430 763 HZ PHE 754 HZ PHE 754 -3.410 2.693 2.515 764 H LYS 755 H LYS 755 -7.843 7.261 6.689 765 HA LYS 755 HA LYS 755 -10.016 7.256 8.599 766 HB2 LYS 755 HB2 LYS 755 -7.946 6.533 9.888 767 HB3 LYS 755 HB3 LYS 755 -7.331 8.160 9.635 768 HG2 LYS 755 HG2 LYS 755 -10.106 8.108 10.603 769 HG3 LYS 755 HG3 LYS 755 -8.968 7.364 11.725 770 HD2 LYS 755 HD2 LYS 755 -8.730 10.144 10.535 771 HD3 LYS 755 HD3 LYS 755 -9.192 9.769 12.191 772 HE2 LYS 755 HE2 LYS 755 -7.001 9.866 12.729 773 HE3 LYS 755 HE3 LYS 755 -6.781 8.382 11.797 774 HZ1 LYS 755 HZ1 LYS 755 -6.850 11.022 10.442 775 HZ2 LYS 755 HZ2 LYS 755 -5.400 10.444 11.156 776 HZ3 LYS 755 HZ3 LYS 755 -6.143 9.559 9.923 777 H SER 756 H SER 756 -7.390 9.612 8.668 778 HA SER 756 HA SER 756 -9.274 11.688 7.944 779 HB2 SER 756 HB2 SER 756 -6.306 11.975 8.463 780 HB3 SER 756 HB3 SER 756 -7.523 13.247 8.507 781 HG SER 756 HG SER 756 -8.161 12.580 10.430 782 H LEU 757 H LEU 757 -7.796 9.528 6.159 783 HA LEU 757 HA LEU 757 -6.345 10.947 4.200 784 HB2 LEU 757 HB2 LEU 757 -7.598 8.263 4.432 785 HB3 LEU 757 HB3 LEU 757 -7.247 8.835 2.806 786 HG LEU 757 HG LEU 757 -5.408 7.510 4.015 787 HD11 LEU 757 HD11 LEU 757 -5.218 9.988 2.455 788 HD12 LEU 757 HD12 LEU 757 -3.739 9.532 3.304 789 HD13 LEU 757 HD13 LEU 757 -4.486 8.409 2.170 790 HD21 LEU 757 HD21 LEU 757 -4.237 8.443 5.762 791 HD22 LEU 757 HD22 LEU 757 -4.610 10.094 5.267 792 HD23 LEU 757 HD23 LEU 757 -5.824 9.120 6.094 793 H ASP 758 H ASP 758 -7.034 10.976 1.898 794 HA ASP 758 HA ASP 758 -9.761 11.183 1.162 795 HB2 ASP 758 HB2 ASP 758 -9.153 13.377 2.543 796 HB3 ASP 758 HB3 ASP 758 -8.460 13.872 1.004 797 H THR 759 H THR 759 -7.936 9.677 0.123 798 HA THR 759 HA THR 759 -7.659 10.595 -2.589 799 HB THR 759 HB THR 759 -5.666 11.644 -1.504 800 HG1 THR 759 HG1 THR 759 -4.594 11.193 -3.262 801 HG21 THR 759 HG21 THR 759 -3.840 9.711 -1.091 802 HG22 THR 759 HG22 THR 759 -4.879 10.304 0.206 803 HG23 THR 759 HG23 THR 759 -5.284 8.812 -0.635 804 H THR 760 H THR 760 -5.600 8.863 -3.320 805 HA THR 760 HA THR 760 -6.212 6.179 -2.391 806 HB THR 760 HB THR 760 -6.908 5.353 -4.607 807 HG1 THR 760 HG1 THR 760 -7.075 6.655 -6.263 808 HG21 THR 760 HG21 THR 760 -8.563 6.113 -2.830 809 HG22 THR 760 HG22 THR 760 -8.734 7.600 -3.764 810 HG23 THR 760 HG23 THR 760 -9.179 6.053 -4.480 811 H LEU 761 H LEU 761 -4.946 4.549 -3.697 812 HA LEU 761 HA LEU 761 -2.220 5.216 -3.820 813 HB2 LEU 761 HB2 LEU 761 -3.799 2.981 -5.133 814 HB3 LEU 761 HB3 LEU 761 -2.049 3.065 -5.166 815 HG LEU 761 HG LEU 761 -3.065 1.570 -3.375 816 HD11 LEU 761 HD11 LEU 761 -1.599 2.777 -1.529 817 HD12 LEU 761 HD12 LEU 761 -0.861 1.997 -2.930 818 HD13 LEU 761 HD13 LEU 761 -1.096 3.747 -2.911 819 HD21 LEU 761 HD21 LEU 761 -3.723 4.225 -2.076 820 HD22 LEU 761 HD22 LEU 761 -4.909 3.079 -2.704 821 HD23 LEU 761 HD23 LEU 761 -3.889 2.634 -1.342 822 H GLN 762 H GLN 762 -2.106 7.171 -5.002 823 HA GLN 762 HA GLN 762 -3.157 7.457 -7.633 824 HB2 GLN 762 HB2 GLN 762 -1.815 9.078 -5.666 825 HB3 GLN 762 HB3 GLN 762 -1.145 9.378 -7.266 826 HG2 GLN 762 HG2 GLN 762 -3.983 9.233 -7.538 827 HG3 GLN 762 HG3 GLN 762 -3.639 10.278 -6.162 828 HE21 GLN 762 HE21 GLN 762 -1.517 11.776 -6.788 829 HE22 GLN 762 HE22 GLN 762 -1.707 12.577 -8.268 830 H PHE 763 H PHE 763 0.281 7.444 -6.576 831 HA PHE 763 HA PHE 763 0.897 6.104 -9.143 832 HB2 PHE 763 HB2 PHE 763 2.208 8.604 -8.063 833 HB3 PHE 763 HB3 PHE 763 2.890 7.634 -9.368 834 HD1 PHE 763 HD1 PHE 763 1.519 7.258 -11.471 835 HD2 PHE 763 HD2 PHE 763 0.421 10.125 -8.467 836 HE1 PHE 763 HE1 PHE 763 0.018 8.382 -13.093 837 HE2 PHE 763 HE2 PHE 763 -1.081 11.248 -10.088 838 HZ PHE 763 HZ PHE 763 -1.284 10.377 -12.402 839 HA PRO 764 HA PRO 764 3.638 3.652 -6.710 840 HB2 PRO 764 HB2 PRO 764 5.222 2.652 -8.689 841 HB3 PRO 764 HB3 PRO 764 3.528 2.169 -8.484 842 HG2 PRO 764 HG2 PRO 764 4.739 4.030 -10.445 843 HG3 PRO 764 HG3 PRO 764 3.373 2.916 -10.625 844 HD2 PRO 764 HD2 PRO 764 3.149 5.662 -10.217 845 HD3 PRO 764 HD3 PRO 764 1.860 4.471 -9.937 846 H PHE 765 H PHE 765 6.331 3.144 -7.010 847 HA PHE 765 HA PHE 765 7.549 5.832 -6.967 848 HB2 PHE 765 HB2 PHE 765 8.774 5.329 -5.026 849 HB3 PHE 765 HB3 PHE 765 7.173 4.670 -4.700 850 HD1 PHE 765 HD1 PHE 765 6.766 2.182 -5.221 851 HD2 PHE 765 HD2 PHE 765 10.675 3.940 -4.978 852 HE1 PHE 765 HE1 PHE 765 7.758 -0.068 -4.887 853 HE2 PHE 765 HE2 PHE 765 11.666 1.700 -4.647 854 HZ PHE 765 HZ PHE 765 10.210 -0.307 -4.602 855 H LYS 766 H LYS 766 7.531 2.949 -8.544 856 HA LYS 766 HA LYS 766 10.409 3.093 -9.199 857 HB2 LYS 766 HB2 LYS 766 8.419 0.859 -9.640 858 HB3 LYS 766 HB3 LYS 766 10.118 0.818 -10.110 859 HG2 LYS 766 HG2 LYS 766 10.382 1.566 -7.520 860 HG3 LYS 766 HG3 LYS 766 8.903 0.620 -7.402 861 HD2 LYS 766 HD2 LYS 766 11.199 -0.514 -8.947 862 HD3 LYS 766 HD3 LYS 766 11.277 -0.534 -7.188 863 HE2 LYS 766 HE2 LYS 766 8.672 -1.399 -7.808 864 HE3 LYS 766 HE3 LYS 766 9.719 -2.227 -8.962 865 HZ1 LYS 766 HZ1 LYS 766 10.294 -3.602 -7.334 866 HZ2 LYS 766 HZ2 LYS 766 11.008 -2.306 -6.506 867 HZ3 LYS 766 HZ3 LYS 766 9.385 -2.720 -6.182 868 H GLU 767 H GLU 767 7.160 3.039 -10.543 869 HA GLU 767 HA GLU 767 6.453 3.216 -12.776 870 HB2 GLU 767 HB2 GLU 767 7.333 5.648 -11.524 871 HB3 GLU 767 HB3 GLU 767 7.569 5.771 -13.267 872 HG2 GLU 767 HG2 GLU 767 5.117 4.667 -13.273 873 HG3 GLU 767 HG3 GLU 767 5.039 5.474 -11.710 874 H1 ASP 338 H1 ASP 338 4.763 2.551 16.502 875 H2 ASP 338 H2 ASP 338 4.875 2.665 16.709 876 H3 ASP 338 H3 ASP 338 3.511 2.204 17.628 877 HA ASP 338 HA ASP 338 4.898 1.119 18.963 878 HB2 ASP 338 HB2 ASP 338 5.716 -1.106 17.910 879 HB3 ASP 338 HB3 ASP 338 3.979 -0.818 17.960 880 H THR 339 H THR 339 7.000 -0.405 16.821 881 HA THR 339 HA THR 339 9.275 1.073 17.778 882 HB THR 339 HB THR 339 10.587 -0.544 16.661 883 HG1 THR 339 HG1 THR 339 9.481 -0.207 14.623 884 HG21 THR 339 HG21 THR 339 8.959 -1.411 18.464 885 HG22 THR 339 HG22 THR 339 8.023 -2.079 17.126 886 HG23 THR 339 HG23 THR 339 9.681 -2.615 17.396 887 H GLU 340 H GLU 340 7.969 3.051 16.719 888 HA GLU 340 HA GLU 340 7.769 4.602 15.008 889 HB2 GLU 340 HB2 GLU 340 10.562 4.101 15.667 890 HB3 GLU 340 HB3 GLU 340 10.372 4.757 14.043 891 HG2 GLU 340 HG2 GLU 340 9.222 5.959 16.577 892 HG3 GLU 340 HG3 GLU 340 10.614 6.561 15.687 893 H VAL 341 H VAL 341 6.480 3.251 13.594 894 HA VAL 341 HA VAL 341 7.685 3.030 10.989 895 HB VAL 341 HB VAL 341 8.482 0.936 11.902 896 HG11 VAL 341 HG11 VAL 341 6.065 -0.530 12.304 897 HG12 VAL 341 HG12 VAL 341 7.324 -0.161 13.480 898 HG13 VAL 341 HG13 VAL 341 5.967 0.943 13.268 899 HG21 VAL 341 HG21 VAL 341 6.261 0.857 9.887 900 HG22 VAL 341 HG22 VAL 341 7.987 0.599 9.660 901 HG23 VAL 341 HG23 VAL 341 7.004 -0.652 10.412 902 H PTR 342 H PTR 342 5.083 0.838 11.643 903 HA PTR 342 HA PTR 342 3.157 2.874 10.695 904 HB2 PTR 342 HB2 PTR 342 1.948 0.525 9.997 905 HB3 PTR 342 HB3 PTR 342 2.910 1.508 8.902 906 HD1 PTR 342 HD1 PTR 342 3.609 -0.989 11.636 907 HD2 PTR 342 HD2 PTR 342 4.413 0.318 7.627 908 HE1 PTR 342 HE1 PTR 342 5.207 -2.862 11.340 909 HE2 PTR 342 HE2 PTR 342 6.008 -1.557 7.337 910 H GLU 343 H GLU 343 3.104 3.240 13.072 911 HA GLU 343 HA GLU 343 2.127 1.373 14.918 912 HB2 GLU 343 HB2 GLU 343 1.139 3.920 15.687 913 HB3 GLU 343 HB3 GLU 343 2.565 3.090 16.285 914 HG2 GLU 343 HG2 GLU 343 2.623 4.713 13.732 915 HG3 GLU 343 HG3 GLU 343 2.905 5.445 15.303 916 H SER 344 H SER 344 0.607 0.594 12.970 917 HA SER 344 HA SER 344 -1.541 0.509 12.027 918 HB2 SER 344 HB2 SER 344 -1.396 -0.295 14.780 919 HB3 SER 344 HB3 SER 344 -2.999 0.352 14.449 920 HG SER 344 HG SER 344 -3.334 -1.188 12.975 921 HA PRO 345 HA PRO 345 -2.565 4.989 12.898 922 HB2 PRO 345 HB2 PRO 345 -2.738 5.667 10.222 923 HB3 PRO 345 HB3 PRO 345 -1.269 5.816 11.204 924 HG2 PRO 345 HG2 PRO 345 -2.053 3.684 9.281 925 HG3 PRO 345 HG3 PRO 345 -0.465 4.414 9.571 926 HD2 PRO 345 HD2 PRO 345 -1.129 1.969 10.550 927 HD3 PRO 345 HD3 PRO 345 -0.032 3.068 11.416 928 H PTR 346 H PTR 346 -3.904 2.833 10.391 929 HA PTR 346 HA PTR 346 -6.620 3.732 11.164 930 HB2 PTR 346 HB2 PTR 346 -5.932 2.896 8.357 931 HB3 PTR 346 HB3 PTR 346 -7.314 3.830 8.928 932 HD1 PTR 346 HD1 PTR 346 -4.651 4.282 6.951 933 HD2 PTR 346 HD2 PTR 346 -6.177 5.832 10.650 934 HE1 PTR 346 HE1 PTR 346 -3.375 6.389 6.606 935 HE2 PTR 346 HE2 PTR 346 -4.914 7.922 10.305 936 H ALA 347 H ALA 347 -8.295 2.218 10.966 937 HA ALA 347 HA ALA 347 -8.223 -0.358 9.983 938 HB1 ALA 347 HB1 ALA 347 -6.594 -1.263 11.300 939 HB2 ALA 347 HB2 ALA 347 -7.938 -1.454 12.430 940 HB3 ALA 347 HB3 ALA 347 -6.832 -0.088 12.594 941 H ASP 348 H ASP 348 -9.098 1.215 13.080 942 HA ASP 348 HA ASP 348 -11.920 0.627 12.475 943 HB2 ASP 348 HB2 ASP 348 -10.458 -0.023 15.035 944 HB3 ASP 348 HB3 ASP 348 -12.217 0.080 14.938 945 HA PRO 349 HA PRO 349 -11.392 4.965 13.969 946 HB2 PRO 349 HB2 PRO 349 -11.942 6.279 11.671 947 HB3 PRO 349 HB3 PRO 349 -10.330 5.623 12.013 948 HG2 PRO 349 HG2 PRO 349 -12.429 4.617 10.187 949 HG3 PRO 349 HG3 PRO 349 -10.667 4.502 10.062 950 HD2 PRO 349 HD2 PRO 349 -12.424 2.470 10.970 951 HD3 PRO 349 HD3 PRO 349 -10.653 2.463 11.081 952 H GLU 350 H GLU 350 -13.810 2.958 13.160 953 HA GLU 350 HA GLU 350 -15.957 4.963 13.135 954 HB2 GLU 350 HB2 GLU 350 -17.419 2.990 12.648 955 HB3 GLU 350 HB3 GLU 350 -16.162 3.246 11.441 956 HG2 GLU 350 HG2 GLU 350 -15.059 1.577 13.476 957 HG3 GLU 350 HG3 GLU 350 -16.634 0.916 13.053 Start of MODEL 4 1 H1 GLY 661 H1 GLY 661 3.378 -21.786 -8.918 2 H2 GLY 661 H2 GLY 661 4.226 -20.402 -8.410 3 H3 GLY 661 H3 GLY 661 5.049 -21.669 -9.193 4 HA2 GLY 661 HA2 GLY 661 4.777 -20.556 -11.085 5 HA3 GLY 661 HA3 GLY 661 3.067 -20.974 -10.954 6 H HIS 662 H HIS 662 3.108 -18.767 -12.165 7 HA HIS 662 HA HIS 662 3.587 -16.392 -10.655 8 HB2 HIS 662 HB2 HIS 662 2.260 -17.037 -13.268 9 HB3 HIS 662 HB3 HIS 662 2.036 -15.437 -12.557 10 HD1 HIS 662 HD1 HIS 662 4.242 -14.081 -11.985 11 HD2 HIS 662 HD2 HIS 662 4.766 -17.426 -14.446 12 HE1 HIS 662 HE1 HIS 662 6.542 -13.850 -13.073 13 HE2 HIS 662 HE2 HIS 662 6.869 -15.880 -14.570 14 H MET 663 H MET 663 2.248 -15.167 -9.419 15 HA MET 663 HA MET 663 -0.615 -15.607 -9.428 16 HB2 MET 663 HB2 MET 663 0.469 -17.409 -7.902 17 HB3 MET 663 HB3 MET 663 0.753 -16.078 -6.782 18 HG2 MET 663 HG2 MET 663 -1.769 -15.523 -7.173 19 HG3 MET 663 HG3 MET 663 -1.872 -17.171 -7.788 20 HE1 MET 663 HE1 MET 663 -3.727 -17.176 -6.043 21 HE2 MET 663 HE2 MET 663 -3.499 -17.433 -4.314 22 HE3 MET 663 HE3 MET 663 -3.353 -15.809 -4.995 23 H GLN 664 H GLN 664 0.140 -14.560 -6.384 24 HA GLN 664 HA GLN 664 -0.473 -11.833 -7.041 25 HB2 GLN 664 HB2 GLN 664 -1.252 -12.946 -4.951 26 HB3 GLN 664 HB3 GLN 664 0.417 -13.031 -4.398 27 HG2 GLN 664 HG2 GLN 664 -0.948 -11.071 -3.503 28 HG3 GLN 664 HG3 GLN 664 0.590 -10.649 -4.242 29 HE21 GLN 664 HE21 GLN 664 -2.536 -11.443 -5.827 30 HE22 GLN 664 HE22 GLN 664 -2.663 -9.962 -6.644 31 H ASP 665 H ASP 665 1.738 -12.429 -8.473 32 HA ASP 665 HA ASP 665 4.216 -11.888 -7.209 33 HB2 ASP 665 HB2 ASP 665 3.747 -11.105 -10.062 34 HB3 ASP 665 HB3 ASP 665 5.151 -11.872 -9.336 35 H LEU 666 H LEU 666 4.907 -10.018 -6.323 36 HA LEU 666 HA LEU 666 3.520 -7.532 -7.053 37 HB2 LEU 666 HB2 LEU 666 5.439 -7.943 -4.765 38 HB3 LEU 666 HB3 LEU 666 4.261 -6.649 -4.973 39 HG LEU 666 HG LEU 666 3.529 -9.575 -4.685 40 HD11 LEU 666 HD11 LEU 666 3.019 -7.508 -2.582 41 HD12 LEU 666 HD12 LEU 666 3.212 -9.253 -2.413 42 HD13 LEU 666 HD13 LEU 666 4.622 -8.231 -2.684 43 HD21 LEU 666 HD21 LEU 666 1.279 -8.489 -4.159 44 HD22 LEU 666 HD22 LEU 666 1.962 -6.988 -4.782 45 HD23 LEU 666 HD23 LEU 666 1.800 -8.390 -5.839 46 H SER 667 H SER 667 6.737 -8.950 -6.872 47 HA SER 667 HA SER 667 8.302 -6.701 -7.352 48 HB2 SER 667 HB2 SER 667 8.716 -9.551 -8.254 49 HB3 SER 667 HB3 SER 667 9.953 -8.296 -8.312 50 HG SER 667 HG SER 667 10.041 -9.556 -6.373 51 H VAL 668 H VAL 668 5.879 -7.783 -9.316 52 HA VAL 668 HA VAL 668 7.214 -7.076 -11.824 53 HB VAL 668 HB VAL 668 5.228 -7.918 -12.917 54 HG11 VAL 668 HG11 VAL 668 5.101 -10.205 -11.459 55 HG12 VAL 668 HG12 VAL 668 6.429 -9.826 -12.555 56 HG13 VAL 668 HG13 VAL 668 6.596 -9.515 -10.828 57 HG21 VAL 668 HG21 VAL 668 4.098 -7.642 -10.166 58 HG22 VAL 668 HG22 VAL 668 3.338 -7.336 -11.728 59 HG23 VAL 668 HG23 VAL 668 3.516 -8.990 -11.143 60 H HIS 669 H HIS 669 5.535 -5.645 -9.353 61 HA HIS 669 HA HIS 669 4.254 -3.578 -10.994 62 HB2 HIS 669 HB2 HIS 669 4.372 -3.805 -7.978 63 HB3 HIS 669 HB3 HIS 669 3.306 -2.767 -8.923 64 HD1 HIS 669 HD1 HIS 669 2.232 -4.666 -11.010 65 HD2 HIS 669 HD2 HIS 669 2.689 -5.748 -7.019 66 HE1 HIS 669 HE1 HIS 669 0.631 -6.588 -10.602 67 HE2 HIS 669 HE2 HIS 669 0.792 -7.182 -8.125 68 H LEU 670 H LEU 670 4.495 -1.334 -9.721 69 HA LEU 670 HA LEU 670 7.386 -0.807 -9.481 70 HB2 LEU 670 HB2 LEU 670 6.705 1.564 -10.247 71 HB3 LEU 670 HB3 LEU 670 6.837 0.310 -11.456 72 HG LEU 670 HG LEU 670 4.251 1.160 -10.133 73 HD11 LEU 670 HD11 LEU 670 5.330 1.740 -12.907 74 HD12 LEU 670 HD12 LEU 670 3.755 2.234 -12.286 75 HD13 LEU 670 HD13 LEU 670 5.226 2.904 -11.589 76 HD21 LEU 670 HD21 LEU 670 4.984 -1.108 -11.792 77 HD22 LEU 670 HD22 LEU 670 3.433 -0.747 -11.028 78 HD23 LEU 670 HD23 LEU 670 3.805 -0.095 -12.621 79 H TRP 671 H TRP 671 4.439 -0.850 -7.901 80 HA TRP 671 HA TRP 671 5.270 1.301 -6.099 81 HB2 TRP 671 HB2 TRP 671 2.955 0.889 -5.062 82 HB3 TRP 671 HB3 TRP 671 3.019 1.662 -6.638 83 HD1 TRP 671 HD1 TRP 671 1.660 0.586 -8.496 84 HE1 TRP 671 HE1 TRP 671 0.356 -1.632 -8.794 85 HE3 TRP 671 HE3 TRP 671 3.131 -1.844 -4.244 86 HZ2 TRP 671 HZ2 TRP 671 0.027 -4.107 -7.398 87 HZ3 TRP 671 HZ3 TRP 671 2.306 -4.131 -3.757 88 HH2 TRP 671 HH2 TRP 671 0.757 -5.262 -5.329 89 H TYR 672 H TYR 672 5.672 -1.915 -6.470 90 HA TYR 672 HA TYR 672 5.374 -2.685 -3.676 91 HB2 TYR 672 HB2 TYR 672 4.751 -4.299 -5.393 92 HB3 TYR 672 HB3 TYR 672 6.369 -4.211 -6.088 93 HD1 TYR 672 HD2 TYR 672 4.870 -4.652 -2.672 94 HD2 TYR 672 HD1 TYR 672 7.776 -5.973 -5.543 95 HE1 TYR 672 HE2 TYR 672 5.654 -6.385 -1.086 96 HE2 TYR 672 HE1 TYR 672 8.554 -7.710 -3.956 97 HH TYR 672 HH TYR 672 7.418 -8.978 -1.930 98 H ALA 673 H ALA 673 6.909 -2.123 -2.269 99 HA ALA 673 HA ALA 673 9.700 -1.918 -3.201 100 HB1 ALA 673 HB1 ALA 673 8.860 0.027 -1.987 101 HB2 ALA 673 HB2 ALA 673 10.077 -0.794 -1.009 102 HB3 ALA 673 HB3 ALA 673 8.365 -0.998 -0.640 103 H GLY 674 H GLY 674 7.527 -3.776 -1.283 104 HA2 GLY 674 HA2 GLY 674 7.754 -5.647 0.035 105 HA3 GLY 674 HA3 GLY 674 9.019 -6.085 -1.100 106 HA PRO 675 HA PRO 675 11.628 -6.153 2.480 107 HB2 PRO 675 HB2 PRO 675 14.052 -6.054 1.118 108 HB3 PRO 675 HB3 PRO 675 13.106 -7.522 1.415 109 HG2 PRO 675 HG2 PRO 675 13.278 -5.844 -1.031 110 HG3 PRO 675 HG3 PRO 675 13.137 -7.603 -0.871 111 HD2 PRO 675 HD2 PRO 675 11.022 -6.043 -1.553 112 HD3 PRO 675 HD3 PRO 675 10.831 -7.532 -0.595 113 H MET 676 H MET 676 10.571 -3.747 2.356 114 HA MET 676 HA MET 676 12.874 -1.895 2.577 115 HB2 MET 676 HB2 MET 676 11.424 -1.517 0.522 116 HB3 MET 676 HB3 MET 676 10.121 -1.089 1.629 117 HG2 MET 676 HG2 MET 676 11.010 0.952 2.060 118 HG3 MET 676 HG3 MET 676 12.628 0.292 2.269 119 HE1 MET 676 HE1 MET 676 14.059 2.171 0.913 120 HE2 MET 676 HE2 MET 676 14.365 0.435 0.953 121 HE3 MET 676 HE3 MET 676 14.518 1.328 -0.566 122 H GLU 677 H GLU 677 12.354 0.007 3.985 123 HA GLU 677 HA GLU 677 10.730 -0.850 6.298 124 HB2 GLU 677 HB2 GLU 677 12.141 0.888 7.511 125 HB3 GLU 677 HB3 GLU 677 13.018 -0.530 6.927 126 HG2 GLU 677 HG2 GLU 677 14.064 0.644 5.220 127 HG3 GLU 677 HG3 GLU 677 12.768 1.828 5.112 128 H ARG 678 H ARG 678 9.637 0.905 7.507 129 HA ARG 678 HA ARG 678 7.840 2.356 5.982 130 HB2 ARG 678 HB2 ARG 678 7.591 1.894 8.419 131 HB3 ARG 678 HB3 ARG 678 8.827 3.107 8.745 132 HG2 ARG 678 HG2 ARG 678 6.585 3.961 6.992 133 HG3 ARG 678 HG3 ARG 678 6.184 3.690 8.686 134 HD2 ARG 678 HD2 ARG 678 8.672 5.219 8.228 135 HD3 ARG 678 HD3 ARG 678 7.200 6.026 7.702 136 HE ARG 678 HE ARG 678 6.765 4.985 10.296 137 HH11 ARG 678 HH21 ARG 678 8.572 7.435 8.592 138 HH12 ARG 678 HH22 ARG 678 8.786 8.432 10.024 139 HH21 ARG 678 HH11 ARG 678 6.988 6.314 12.079 140 HH22 ARG 678 HH12 ARG 678 7.922 7.786 11.988 141 H ALA 679 H ALA 679 10.594 3.757 7.769 142 HA ALA 679 HA ALA 679 10.453 6.310 6.654 143 HB1 ALA 679 HB1 ALA 679 11.960 6.444 8.336 144 HB2 ALA 679 HB2 ALA 679 13.139 5.978 7.108 145 HB3 ALA 679 HB3 ALA 679 12.433 4.754 8.164 146 H GLY 680 H GLY 680 11.962 3.371 5.526 147 HA2 GLY 680 HA2 GLY 680 13.419 4.519 3.365 148 HA3 GLY 680 HA3 GLY 680 12.976 2.822 3.521 149 H ALA 681 H ALA 681 10.275 2.867 3.590 150 HA ALA 681 HA ALA 681 9.534 3.073 0.900 151 HB1 ALA 681 HB1 ALA 681 7.862 3.078 3.421 152 HB2 ALA 681 HB2 ALA 681 8.242 1.700 2.386 153 HB3 ALA 681 HB3 ALA 681 7.175 2.977 1.798 154 H GLU 682 H GLU 682 8.803 5.354 3.588 155 HA GLU 682 HA GLU 682 7.591 7.241 1.800 156 HB2 GLU 682 HB2 GLU 682 7.611 8.789 3.707 157 HB3 GLU 682 HB3 GLU 682 6.927 7.229 4.127 158 HG2 GLU 682 HG2 GLU 682 9.297 6.602 4.917 159 HG3 GLU 682 HG3 GLU 682 9.642 8.324 4.828 160 H SER 683 H SER 683 10.818 6.602 2.760 161 HA SER 683 HA SER 683 11.999 9.095 2.501 162 HB2 SER 683 HB2 SER 683 12.968 6.320 1.928 163 HB3 SER 683 HB3 SER 683 13.993 7.704 1.570 164 HG SER 683 HG SER 683 12.821 6.959 4.059 165 H ILE 684 H ILE 684 10.683 6.963 0.108 166 HA ILE 684 HA ILE 684 11.711 8.616 -2.094 167 HB ILE 684 HB ILE 684 9.870 6.242 -2.390 168 HG12 ILE 684 HG12 ILE 684 12.638 5.521 -2.750 169 HG13 ILE 684 HG13 ILE 684 12.430 6.187 -1.131 170 HG21 ILE 684 HG21 ILE 684 11.481 7.965 -4.122 171 HG22 ILE 684 HG22 ILE 684 11.842 6.255 -4.360 172 HG23 ILE 684 HG23 ILE 684 10.191 6.840 -4.548 173 HD11 ILE 684 HD11 ILE 684 11.721 4.108 -0.579 174 HD12 ILE 684 HD12 ILE 684 10.213 4.573 -1.362 175 HD13 ILE 684 HD13 ILE 684 11.429 3.660 -2.258 176 H LEU 685 H LEU 685 8.634 7.473 -0.718 177 HA LEU 685 HA LEU 685 6.899 8.972 -2.362 178 HB2 LEU 685 HB2 LEU 685 6.701 7.605 0.276 179 HB3 LEU 685 HB3 LEU 685 5.417 8.715 -0.172 180 HG LEU 685 HG LEU 685 4.877 7.457 -2.121 181 HD11 LEU 685 HD11 LEU 685 7.086 7.003 -2.992 182 HD12 LEU 685 HD12 LEU 685 7.479 5.995 -1.601 183 HD13 LEU 685 HD13 LEU 685 6.271 5.458 -2.766 184 HD21 LEU 685 HD21 LEU 685 4.742 5.063 -1.149 185 HD22 LEU 685 HD22 LEU 685 5.506 5.750 0.284 186 HD23 LEU 685 HD23 LEU 685 3.939 6.353 -0.256 187 H ALA 686 H ALA 686 8.350 9.759 0.819 188 HA ALA 686 HA ALA 686 6.985 12.221 1.146 189 HB1 ALA 686 HB1 ALA 686 9.610 11.193 2.219 190 HB2 ALA 686 HB2 ALA 686 8.060 11.325 3.054 191 HB3 ALA 686 HB3 ALA 686 8.967 12.781 2.643 192 H ASN 687 H ASN 687 9.950 11.324 -0.503 193 HA ASN 687 HA ASN 687 10.748 13.999 -1.163 194 HB2 ASN 687 HB2 ASN 687 12.281 12.006 -1.063 195 HB3 ASN 687 HB3 ASN 687 11.513 11.408 -2.530 196 HD21 ASN 687 HD21 ASN 687 13.519 14.053 -1.241 197 HD22 ASN 687 HD22 ASN 687 14.087 14.572 -2.754 198 H ARG 688 H ARG 688 8.814 11.475 -2.702 199 HA ARG 688 HA ARG 688 8.547 12.794 -5.234 200 HB2 ARG 688 HB2 ARG 688 7.625 10.343 -3.992 201 HB3 ARG 688 HB3 ARG 688 6.356 11.109 -4.942 202 HG2 ARG 688 HG2 ARG 688 7.414 9.922 -6.616 203 HG3 ARG 688 HG3 ARG 688 8.336 11.425 -6.693 204 HD2 ARG 688 HD2 ARG 688 9.617 9.996 -4.697 205 HD3 ARG 688 HD3 ARG 688 9.185 8.764 -5.860 206 HE ARG 688 HE ARG 688 10.588 9.808 -7.456 207 HH11 ARG 688 HH21 ARG 688 10.344 11.579 -4.517 208 HH12 ARG 688 HH22 ARG 688 11.811 12.481 -4.768 209 HH21 ARG 688 HH11 ARG 688 12.456 11.004 -7.817 210 HH22 ARG 688 HH12 ARG 688 12.971 12.169 -6.651 211 H SER 689 H SER 689 6.117 13.097 -6.025 212 HA SER 689 HA SER 689 5.043 15.285 -4.444 213 HB2 SER 689 HB2 SER 689 5.101 15.559 -6.849 214 HB3 SER 689 HB3 SER 689 4.174 14.079 -7.082 215 HG SER 689 HG SER 689 2.386 15.065 -6.354 216 H ASP 690 H ASP 690 2.641 15.431 -4.142 217 HA ASP 690 HA ASP 690 1.732 13.360 -2.468 218 HB2 ASP 690 HB2 ASP 690 0.683 15.894 -3.493 219 HB3 ASP 690 HB3 ASP 690 -0.561 14.681 -3.203 220 H GLY 691 H GLY 691 0.497 11.616 -2.780 221 HA2 GLY 691 HA2 GLY 691 -1.195 10.386 -4.002 222 HA3 GLY 691 HA3 GLY 691 -0.624 11.149 -5.484 223 H THR 692 H THR 692 2.161 10.676 -4.117 224 HA THR 692 HA THR 692 2.772 8.307 -5.610 225 HB THR 692 HB THR 692 4.546 9.550 -3.501 226 HG1 THR 692 HG1 THR 692 4.054 11.293 -4.723 227 HG21 THR 692 HG21 THR 692 6.152 8.272 -4.438 228 HG22 THR 692 HG22 THR 692 4.840 7.390 -5.219 229 HG23 THR 692 HG23 THR 692 5.650 8.703 -6.071 230 H PHE 693 H PHE 693 2.778 6.226 -4.929 231 HA PHE 693 HA PHE 693 2.709 5.735 -2.023 232 HB2 PHE 693 HB2 PHE 693 0.807 4.286 -2.183 233 HB3 PHE 693 HB3 PHE 693 0.374 5.817 -2.937 234 HD1 PHE 693 HD2 PHE 693 1.314 2.296 -3.584 235 HD2 PHE 693 HD1 PHE 693 -0.029 5.991 -5.304 236 HE1 PHE 693 HE2 PHE 693 0.752 1.116 -5.689 237 HE2 PHE 693 HE1 PHE 693 -0.589 4.809 -7.412 238 HZ PHE 693 HZ PHE 693 -0.192 2.371 -7.604 239 H LEU 694 H LEU 694 2.831 3.373 -1.543 240 HA LEU 694 HA LEU 694 3.930 1.581 -3.455 241 HB2 LEU 694 HB2 LEU 694 6.217 1.564 -2.912 242 HB3 LEU 694 HB3 LEU 694 5.827 3.278 -3.038 243 HG LEU 694 HG LEU 694 5.325 3.043 -0.456 244 HD11 LEU 694 HD11 LEU 694 7.437 1.361 0.143 245 HD12 LEU 694 HD12 LEU 694 5.731 0.941 0.293 246 HD13 LEU 694 HD13 LEU 694 6.623 0.504 -1.163 247 HD21 LEU 694 HD21 LEU 694 8.202 2.964 -0.676 248 HD22 LEU 694 HD22 LEU 694 7.524 3.872 -2.024 249 HD23 LEU 694 HD23 LEU 694 7.150 4.344 -0.369 250 H VAL 695 H VAL 695 4.939 -0.357 -2.293 251 HA VAL 695 HA VAL 695 3.682 -0.749 0.353 252 HB VAL 695 HB VAL 695 3.604 -2.702 -1.956 253 HG11 VAL 695 HG11 VAL 695 1.984 -3.780 -0.172 254 HG12 VAL 695 HG12 VAL 695 3.718 -4.064 -0.072 255 HG13 VAL 695 HG13 VAL 695 2.956 -2.862 0.968 256 HG21 VAL 695 HG21 VAL 695 1.935 -0.514 -1.386 257 HG22 VAL 695 HG22 VAL 695 1.557 -1.874 -2.439 258 HG23 VAL 695 HG23 VAL 695 1.075 -1.913 -0.744 259 H ARG 696 H ARG 696 4.894 -1.807 1.813 260 HA ARG 696 HA ARG 696 7.414 -3.068 0.880 261 HB2 ARG 696 HB2 ARG 696 8.462 -2.140 2.974 262 HB3 ARG 696 HB3 ARG 696 8.032 -0.928 1.767 263 HG2 ARG 696 HG2 ARG 696 6.366 -0.026 3.056 264 HG3 ARG 696 HG3 ARG 696 5.919 -1.584 3.748 265 HD2 ARG 696 HD2 ARG 696 8.185 0.237 4.554 266 HD3 ARG 696 HD3 ARG 696 6.867 -0.366 5.555 267 HE ARG 696 HE ARG 696 9.323 -1.778 4.865 268 HH11 ARG 696 HH21 ARG 696 6.035 -2.086 5.899 269 HH12 ARG 696 HH22 ARG 696 6.317 -3.591 6.713 270 HH21 ARG 696 HH11 ARG 696 9.632 -3.707 5.840 271 HH22 ARG 696 HH12 ARG 696 8.336 -4.507 6.664 272 H GLN 697 H GLN 697 8.408 -4.480 2.594 273 HA GLN 697 HA GLN 697 6.515 -5.648 4.508 274 HB2 GLN 697 HB2 GLN 697 6.049 -6.916 2.493 275 HB3 GLN 697 HB3 GLN 697 7.768 -7.197 2.227 276 HG2 GLN 697 HG2 GLN 697 6.609 -9.164 3.246 277 HG3 GLN 697 HG3 GLN 697 7.907 -8.539 4.258 278 HE21 GLN 697 HE21 GLN 697 4.600 -9.408 4.269 279 HE22 GLN 697 HE22 GLN 697 4.198 -8.670 5.744 280 H ARG 698 H ARG 698 7.509 -6.856 6.153 281 HA ARG 698 HA ARG 698 10.175 -7.721 6.231 282 HB2 ARG 698 HB2 ARG 698 10.605 -5.228 6.017 283 HB3 ARG 698 HB3 ARG 698 9.901 -5.054 7.622 284 HG2 ARG 698 HG2 ARG 698 11.981 -7.156 7.356 285 HG3 ARG 698 HG3 ARG 698 12.552 -5.497 7.175 286 HD2 ARG 698 HD2 ARG 698 11.283 -6.815 9.558 287 HD3 ARG 698 HD3 ARG 698 12.724 -5.805 9.487 288 HE ARG 698 HE ARG 698 10.000 -4.902 9.801 289 HH11 ARG 698 HH21 ARG 698 13.141 -4.091 8.637 290 HH12 ARG 698 HH22 ARG 698 12.861 -2.388 8.685 291 HH21 ARG 698 HH11 ARG 698 9.615 -2.719 9.815 292 HH22 ARG 698 HH12 ARG 698 10.860 -1.610 9.350 293 H VAL 699 H VAL 699 7.429 -6.427 8.008 294 HA VAL 699 HA VAL 699 8.040 -7.188 10.602 295 HB VAL 699 HB VAL 699 6.030 -5.887 9.916 296 HG11 VAL 699 HG11 VAL 699 5.345 -7.268 8.004 297 HG12 VAL 699 HG12 VAL 699 5.000 -8.617 9.086 298 HG13 VAL 699 HG13 VAL 699 4.030 -7.147 9.173 299 HG21 VAL 699 HG21 VAL 699 4.785 -6.564 11.761 300 HG22 VAL 699 HG22 VAL 699 5.017 -8.279 11.420 301 HG23 VAL 699 HG23 VAL 699 6.331 -7.333 12.120 302 H LYS 700 H LYS 700 7.687 -9.021 11.844 303 HA LYS 700 HA LYS 700 7.856 -11.546 10.387 304 HB2 LYS 700 HB2 LYS 700 8.454 -12.496 12.569 305 HB3 LYS 700 HB3 LYS 700 9.429 -11.067 12.237 306 HG2 LYS 700 HG2 LYS 700 8.601 -9.977 14.035 307 HG3 LYS 700 HG3 LYS 700 6.941 -10.352 13.576 308 HD2 LYS 700 HD2 LYS 700 7.639 -12.781 14.432 309 HD3 LYS 700 HD3 LYS 700 8.798 -11.857 15.379 310 HE2 LYS 700 HE2 LYS 700 7.188 -11.249 16.826 311 HE3 LYS 700 HE3 LYS 700 6.234 -10.557 15.514 312 HZ1 LYS 700 HZ1 LYS 700 6.211 -13.475 15.630 313 HZ2 LYS 700 HZ2 LYS 700 5.485 -12.684 16.966 314 HZ3 LYS 700 HZ3 LYS 700 4.916 -12.360 15.392 315 H ASP 701 H ASP 701 6.795 -13.218 12.415 316 HA ASP 701 HA ASP 701 4.136 -13.499 11.638 317 HB2 ASP 701 HB2 ASP 701 4.157 -14.657 14.124 318 HB3 ASP 701 HB3 ASP 701 4.740 -15.432 12.655 319 H ALA 702 H ALA 702 3.093 -11.526 11.707 320 HA ALA 702 HA ALA 702 1.620 -10.914 14.046 321 HB1 ALA 702 HB1 ALA 702 2.775 -8.436 13.934 322 HB2 ALA 702 HB2 ALA 702 4.168 -9.482 13.660 323 HB3 ALA 702 HB3 ALA 702 3.192 -9.676 15.116 324 H ALA 703 H ALA 703 2.883 -9.855 10.933 325 HA ALA 703 HA ALA 703 0.245 -9.203 9.988 326 HB1 ALA 703 HB1 ALA 703 0.237 -7.027 10.550 327 HB2 ALA 703 HB2 ALA 703 1.553 -6.798 9.396 328 HB3 ALA 703 HB3 ALA 703 1.913 -7.098 11.098 329 H GLU 704 H GLU 704 0.482 -8.127 7.698 330 HA GLU 704 HA GLU 704 2.669 -9.564 6.317 331 HB2 GLU 704 HB2 GLU 704 -0.187 -9.358 5.838 332 HB3 GLU 704 HB3 GLU 704 0.727 -8.845 4.421 333 HG2 GLU 704 HG2 GLU 704 1.560 -11.347 5.855 334 HG3 GLU 704 HG3 GLU 704 0.165 -11.401 4.782 335 H PHE 705 H PHE 705 2.216 -8.210 3.819 336 HA PHE 705 HA PHE 705 4.104 -6.260 3.750 337 HB2 PHE 705 HB2 PHE 705 1.531 -6.254 2.156 338 HB3 PHE 705 HB3 PHE 705 2.995 -5.372 1.738 339 HD1 PHE 705 HD1 PHE 705 1.435 -8.711 1.966 340 HD2 PHE 705 HD2 PHE 705 4.975 -6.519 0.918 341 HE1 PHE 705 HE1 PHE 705 2.326 -10.704 0.790 342 HE2 PHE 705 HE2 PHE 705 5.866 -8.519 -0.246 343 HZ PHE 705 HZ PHE 705 4.539 -10.610 -0.312 344 H ALA 706 H ALA 706 3.980 -3.918 3.459 345 HA ALA 706 HA ALA 706 1.810 -2.654 5.025 346 HB1 ALA 706 HB1 ALA 706 4.497 -1.394 5.119 347 HB2 ALA 706 HB2 ALA 706 4.287 -2.877 6.052 348 HB3 ALA 706 HB3 ALA 706 3.250 -1.484 6.361 349 H ILE 707 H ILE 707 0.804 -1.069 3.989 350 HA ILE 707 HA ILE 707 1.737 -0.253 1.357 351 HB ILE 707 HB ILE 707 -0.692 0.712 2.896 352 HG12 ILE 707 HG12 ILE 707 -1.780 -1.019 1.239 353 HG13 ILE 707 HG13 ILE 707 -0.178 -1.750 1.247 354 HG21 ILE 707 HG21 ILE 707 -1.475 0.911 0.402 355 HG22 ILE 707 HG22 ILE 707 -0.428 2.165 1.067 356 HG23 ILE 707 HG23 ILE 707 0.250 0.900 0.038 357 HD11 ILE 707 HD11 ILE 707 -0.472 -2.598 3.319 358 HD12 ILE 707 HD12 ILE 707 -1.089 -1.068 3.937 359 HD13 ILE 707 HD13 ILE 707 -2.173 -2.190 3.127 360 H SER 708 H SER 708 1.545 2.167 0.837 361 HA SER 708 HA SER 708 2.063 4.062 2.909 362 HB2 SER 708 HB2 SER 708 4.394 2.975 1.334 363 HB3 SER 708 HB3 SER 708 4.439 4.540 2.138 364 HG SER 708 HG SER 708 3.548 2.284 3.581 365 H ILE 709 H ILE 709 1.056 5.790 2.099 366 HA ILE 709 HA ILE 709 1.418 6.423 -0.778 367 HB ILE 709 HB ILE 709 -1.032 7.267 0.731 368 HG12 ILE 709 HG12 ILE 709 -1.954 5.073 -0.521 369 HG13 ILE 709 HG13 ILE 709 -0.326 4.508 -0.135 370 HG21 ILE 709 HG21 ILE 709 -1.722 7.929 -1.306 371 HG22 ILE 709 HG22 ILE 709 -0.088 7.604 -1.884 372 HG23 ILE 709 HG23 ILE 709 -1.334 6.362 -2.016 373 HD11 ILE 709 HD11 ILE 709 -1.271 5.864 2.167 374 HD12 ILE 709 HD12 ILE 709 -2.584 4.821 1.614 375 HD13 ILE 709 HD13 ILE 709 -1.003 4.130 1.976 376 H LYS 710 H LYS 710 1.986 8.457 -1.285 377 HA LYS 710 HA LYS 710 2.598 10.286 0.903 378 HB2 LYS 710 HB2 LYS 710 4.304 10.130 -0.773 379 HB3 LYS 710 HB3 LYS 710 3.134 10.338 -2.073 380 HG2 LYS 710 HG2 LYS 710 4.194 12.451 -1.850 381 HG3 LYS 710 HG3 LYS 710 2.637 12.635 -1.057 382 HD2 LYS 710 HD2 LYS 710 3.550 12.727 1.055 383 HD3 LYS 710 HD3 LYS 710 4.963 11.755 0.617 384 HE2 LYS 710 HE2 LYS 710 4.464 14.564 -0.412 385 HE3 LYS 710 HE3 LYS 710 5.475 14.197 0.987 386 HZ1 LYS 710 HZ1 LYS 710 6.354 12.458 -0.945 387 HZ2 LYS 710 HZ2 LYS 710 6.084 13.907 -1.817 388 HZ3 LYS 710 HZ3 LYS 710 7.133 13.912 -0.464 389 H TYR 711 H TYR 711 0.755 11.190 1.659 390 HA TYR 711 HA TYR 711 -0.791 12.844 -0.232 391 HB2 TYR 711 HB2 TYR 711 -2.114 10.824 0.015 392 HB3 TYR 711 HB3 TYR 711 -1.972 10.902 1.769 393 HD1 TYR 711 HD1 TYR 711 -2.829 13.370 -0.939 394 HD2 TYR 711 HD2 TYR 711 -3.938 11.570 2.796 395 HE1 TYR 711 HE1 TYR 711 -4.843 14.816 -0.837 396 HE2 TYR 711 HE2 TYR 711 -5.953 13.017 2.897 397 HH TYR 711 HH TYR 711 -7.408 14.268 0.873 398 H ASN 712 H ASN 712 -0.467 14.817 0.446 399 HA ASN 712 HA ASN 712 -0.698 16.664 1.814 400 HB2 ASN 712 HB2 ASN 712 -2.386 15.282 3.150 401 HB3 ASN 712 HB3 ASN 712 -1.037 14.849 4.200 402 HD21 ASN 712 HD21 ASN 712 0.360 16.975 4.770 403 HD22 ASN 712 HD22 ASN 712 -0.578 18.294 5.297 404 H VAL 713 H VAL 713 1.661 15.973 0.973 405 HA VAL 713 HA VAL 713 3.927 15.885 1.370 406 HB VAL 713 HB VAL 713 4.759 17.638 2.817 407 HG11 VAL 713 HG11 VAL 713 2.849 17.970 0.757 408 HG12 VAL 713 HG12 VAL 713 2.444 19.154 1.998 409 HG13 VAL 713 HG13 VAL 713 4.059 19.136 1.292 410 HG21 VAL 713 HG21 VAL 713 3.107 17.087 4.709 411 HG22 VAL 713 HG22 VAL 713 3.415 18.797 4.413 412 HG23 VAL 713 HG23 VAL 713 1.933 18.055 3.817 413 H GLU 714 H GLU 714 2.530 13.744 2.566 414 HA GLU 714 HA GLU 714 4.524 12.885 4.473 415 HB2 GLU 714 HB2 GLU 714 3.058 12.439 6.307 416 HB3 GLU 714 HB3 GLU 714 2.774 14.117 5.845 417 HG2 GLU 714 HG2 GLU 714 0.592 13.607 5.625 418 HG3 GLU 714 HG3 GLU 714 1.016 12.581 4.261 419 H VAL 715 H VAL 715 4.251 10.559 4.991 420 HA VAL 715 HA VAL 715 2.807 9.163 2.818 421 HB VAL 715 HB VAL 715 5.277 8.197 4.250 422 HG11 VAL 715 HG11 VAL 715 5.432 6.712 2.275 423 HG12 VAL 715 HG12 VAL 715 3.920 6.462 3.148 424 HG13 VAL 715 HG13 VAL 715 3.930 7.394 1.651 425 HG21 VAL 715 HG21 VAL 715 6.016 10.150 3.139 426 HG22 VAL 715 HG22 VAL 715 6.334 8.867 1.974 427 HG23 VAL 715 HG23 VAL 715 4.919 9.898 1.783 428 H LYS 716 H LYS 716 1.019 8.209 3.589 429 HA LYS 716 HA LYS 716 0.839 7.363 6.367 430 HB2 LYS 716 HB2 LYS 716 -1.268 6.605 4.391 431 HB3 LYS 716 HB3 LYS 716 -1.435 7.171 6.047 432 HG2 LYS 716 HG2 LYS 716 -0.236 9.287 4.549 433 HG3 LYS 716 HG3 LYS 716 -1.611 8.697 3.622 434 HD2 LYS 716 HD2 LYS 716 -3.121 9.062 5.442 435 HD3 LYS 716 HD3 LYS 716 -1.795 9.318 6.580 436 HE2 LYS 716 HE2 LYS 716 -1.287 11.228 4.645 437 HE3 LYS 716 HE3 LYS 716 -3.050 11.218 4.718 438 HZ1 LYS 716 HZ1 LYS 716 -1.110 11.720 6.917 439 HZ2 LYS 716 HZ2 LYS 716 -2.377 12.724 6.349 440 HZ3 LYS 716 HZ3 LYS 716 -2.753 11.314 7.215 441 H HIS 717 H HIS 717 1.737 5.522 6.999 442 HA HIS 717 HA HIS 717 1.884 3.240 5.150 443 HB2 HIS 717 HB2 HIS 717 3.264 3.472 7.813 444 HB3 HIS 717 HB3 HIS 717 3.670 2.421 6.461 445 HD1 HIS 717 HD1 HIS 717 4.732 3.570 4.323 446 HD2 HIS 717 HD2 HIS 717 4.348 6.054 7.672 447 HE1 HIS 717 HE1 HIS 717 6.333 5.505 3.985 448 HE2 HIS 717 HE2 HIS 717 6.125 7.047 6.021 449 H ILE 718 H ILE 718 0.912 1.366 5.539 450 HA ILE 718 HA ILE 718 -0.302 0.830 8.164 451 HB ILE 718 HB ILE 718 -1.797 0.663 5.538 452 HG12 ILE 718 HG12 ILE 718 -3.043 2.229 7.631 453 HG13 ILE 718 HG13 ILE 718 -1.436 2.854 7.276 454 HG21 ILE 718 HG21 ILE 718 -2.492 -1.156 6.945 455 HG22 ILE 718 HG22 ILE 718 -2.547 -0.111 8.368 456 HG23 ILE 718 HG23 ILE 718 -3.725 0.098 7.073 457 HD11 ILE 718 HD11 ILE 718 -3.642 3.483 5.830 458 HD12 ILE 718 HD12 ILE 718 -2.006 3.499 5.171 459 HD13 ILE 718 HD13 ILE 718 -3.044 2.098 4.918 460 H LYS 719 H LYS 719 -0.186 -1.278 8.735 461 HA LYS 719 HA LYS 719 1.244 -3.092 6.975 462 HB2 LYS 719 HB2 LYS 719 1.128 -4.640 8.944 463 HB3 LYS 719 HB3 LYS 719 1.908 -3.098 9.286 464 HG2 LYS 719 HG2 LYS 719 0.484 -2.966 11.042 465 HG3 LYS 719 HG3 LYS 719 -0.743 -2.551 9.845 466 HD2 LYS 719 HD2 LYS 719 -0.869 -5.214 9.604 467 HD3 LYS 719 HD3 LYS 719 -0.266 -5.139 11.259 468 HE2 LYS 719 HE2 LYS 719 -2.744 -5.174 11.180 469 HE3 LYS 719 HE3 LYS 719 -2.127 -3.689 11.905 470 HZ1 LYS 719 HZ1 LYS 719 -2.466 -3.614 9.011 471 HZ2 LYS 719 HZ2 LYS 719 -3.933 -3.771 9.925 472 HZ3 LYS 719 HZ3 LYS 719 -2.871 -2.429 10.213 473 H ILE 720 H ILE 720 0.319 -4.436 5.623 474 HA ILE 720 HA ILE 720 -2.538 -4.721 5.463 475 HB ILE 720 HB ILE 720 -0.260 -5.189 3.786 476 HG12 ILE 720 HG12 ILE 720 -3.060 -5.606 2.848 477 HG13 ILE 720 HG13 ILE 720 -2.645 -4.027 3.520 478 HG21 ILE 720 HG21 ILE 720 -2.269 -7.439 3.608 479 HG22 ILE 720 HG22 ILE 720 -0.726 -7.279 2.771 480 HG23 ILE 720 HG23 ILE 720 -0.758 -7.618 4.498 481 HD11 ILE 720 HD11 ILE 720 -1.646 -5.342 1.038 482 HD12 ILE 720 HD12 ILE 720 -1.980 -3.640 1.346 483 HD13 ILE 720 HD13 ILE 720 -0.488 -4.367 1.946 484 H MET 721 H MET 721 -3.642 -6.779 5.388 485 HA MET 721 HA MET 721 -2.552 -8.747 7.312 486 HB2 MET 721 HB2 MET 721 -4.818 -7.259 7.600 487 HB3 MET 721 HB3 MET 721 -5.463 -8.715 6.844 488 HG2 MET 721 HG2 MET 721 -5.478 -9.046 9.255 489 HG3 MET 721 HG3 MET 721 -4.201 -10.057 8.584 490 HE1 MET 721 HE1 MET 721 -2.985 -10.244 10.975 491 HE2 MET 721 HE2 MET 721 -2.777 -8.842 12.020 492 HE3 MET 721 HE3 MET 721 -4.401 -9.363 11.552 493 H THR 722 H THR 722 -3.867 -10.942 6.975 494 HA THR 722 HA THR 722 -4.018 -11.506 4.078 495 HB THR 722 HB THR 722 -1.904 -12.381 4.576 496 HG1 THR 722 HG1 THR 722 -3.920 -14.330 4.968 497 HG21 THR 722 HG21 THR 722 -1.645 -13.864 6.682 498 HG22 THR 722 HG22 THR 722 -1.713 -12.117 6.911 499 HG23 THR 722 HG23 THR 722 -3.139 -13.105 7.230 500 H ALA 723 H ALA 723 -6.252 -11.009 5.599 501 HA ALA 723 HA ALA 723 -7.527 -13.050 6.940 502 HB1 ALA 723 HB1 ALA 723 -9.599 -12.073 5.469 503 HB2 ALA 723 HB2 ALA 723 -8.420 -10.774 5.275 504 HB3 ALA 723 HB3 ALA 723 -8.934 -11.266 6.888 505 H GLU 724 H GLU 724 -7.573 -15.139 6.391 506 HA GLU 724 HA GLU 724 -7.684 -17.052 5.105 507 HB2 GLU 724 HB2 GLU 724 -9.755 -15.644 3.443 508 HB3 GLU 724 HB3 GLU 724 -9.729 -17.315 4.008 509 HG2 GLU 724 HG2 GLU 724 -10.339 -14.816 5.593 510 HG3 GLU 724 HG3 GLU 724 -11.349 -16.240 5.377 511 H GLY 725 H GLY 725 -5.905 -14.797 4.187 512 HA2 GLY 725 HA2 GLY 725 -4.251 -15.037 2.467 513 HA3 GLY 725 HA3 GLY 725 -5.459 -15.821 1.453 514 H LEU 726 H LEU 726 -7.171 -13.386 2.722 515 HA LEU 726 HA LEU 726 -6.838 -11.733 0.344 516 HB2 LEU 726 HB2 LEU 726 -8.690 -11.275 2.691 517 HB3 LEU 726 HB3 LEU 726 -8.810 -10.563 1.085 518 HG LEU 726 HG LEU 726 -8.967 -13.544 1.600 519 HD11 LEU 726 HD11 LEU 726 -11.473 -12.736 0.809 520 HD12 LEU 726 HD12 LEU 726 -11.003 -13.066 2.478 521 HD13 LEU 726 HD13 LEU 726 -10.981 -11.412 1.866 522 HD21 LEU 726 HD21 LEU 726 -10.175 -13.248 -0.718 523 HD22 LEU 726 HD22 LEU 726 -9.277 -11.731 -0.775 524 HD23 LEU 726 HD23 LEU 726 -8.412 -13.263 -0.652 525 H TYR 727 H TYR 727 -5.914 -9.758 0.247 526 HA TYR 727 HA TYR 727 -4.508 -8.815 2.638 527 HB2 TYR 727 HB2 TYR 727 -4.273 -8.182 -0.298 528 HB3 TYR 727 HB3 TYR 727 -3.481 -7.204 0.933 529 HD1 TYR 727 HD2 TYR 727 -3.681 -10.489 2.215 530 HD2 TYR 727 HD1 TYR 727 -1.536 -8.123 -0.648 531 HE1 TYR 727 HE2 TYR 727 -1.797 -12.095 2.285 532 HE2 TYR 727 HE1 TYR 727 0.343 -9.717 -0.578 533 HH TYR 727 HH TYR 727 0.920 -11.793 1.759 534 H ARG 728 H ARG 728 -4.912 -6.905 3.604 535 HA ARG 728 HA ARG 728 -6.877 -5.065 2.447 536 HB2 ARG 728 HB2 ARG 728 -7.816 -5.186 4.994 537 HB3 ARG 728 HB3 ARG 728 -8.513 -6.087 3.654 538 HG2 ARG 728 HG2 ARG 728 -7.187 -8.049 4.204 539 HG3 ARG 728 HG3 ARG 728 -6.303 -7.151 5.438 540 HD2 ARG 728 HD2 ARG 728 -9.182 -6.977 5.840 541 HD3 ARG 728 HD3 ARG 728 -8.626 -8.651 5.821 542 HE ARG 728 HE ARG 728 -7.139 -6.744 7.501 543 HH11 ARG 728 HH21 ARG 728 -9.424 -9.325 7.248 544 HH12 ARG 728 HH22 ARG 728 -9.307 -9.754 8.915 545 HH21 ARG 728 HH11 ARG 728 -7.006 -7.254 9.654 546 HH22 ARG 728 HH12 ARG 728 -7.948 -8.593 10.276 547 H ILE 729 H ILE 729 -6.611 -2.986 3.095 548 HA ILE 729 HA ILE 729 -4.249 -2.391 4.730 549 HB ILE 729 HB ILE 729 -5.995 -0.362 3.372 550 HG12 ILE 729 HG12 ILE 729 -3.830 -2.078 2.122 551 HG13 ILE 729 HG13 ILE 729 -5.531 -2.035 1.665 552 HG21 ILE 729 HG21 ILE 729 -4.098 0.207 4.985 553 HG22 ILE 729 HG22 ILE 729 -3.004 -0.410 3.748 554 HG23 ILE 729 HG23 ILE 729 -4.037 0.973 3.401 555 HD11 ILE 729 HD11 ILE 729 -5.349 0.050 0.656 556 HD12 ILE 729 HD12 ILE 729 -3.944 0.505 1.621 557 HD13 ILE 729 HD13 ILE 729 -3.768 -0.645 0.296 558 H THR 730 H THR 730 -7.705 -1.930 4.636 559 HA THR 730 HA THR 730 -7.651 -0.464 7.187 560 HB THR 730 HB THR 730 -8.944 0.449 5.299 561 HG1 THR 730 HG1 THR 730 -10.190 1.188 6.777 562 HG21 THR 730 HG21 THR 730 -10.456 -0.751 4.111 563 HG22 THR 730 HG22 THR 730 -9.634 -2.155 4.791 564 HG23 THR 730 HG23 THR 730 -11.097 -1.531 5.552 565 H GLU 731 H GLU 731 -8.075 -3.539 5.919 566 HA GLU 731 HA GLU 731 -8.497 -5.534 6.930 567 HB2 GLU 731 HB2 GLU 731 -9.076 -4.077 9.495 568 HB3 GLU 731 HB3 GLU 731 -8.420 -5.701 9.274 569 HG2 GLU 731 HG2 GLU 731 -6.646 -4.101 7.848 570 HG3 GLU 731 HG3 GLU 731 -7.027 -3.107 9.246 571 H LYS 732 H LYS 732 -10.620 -3.130 6.444 572 HA LYS 732 HA LYS 732 -12.992 -4.662 7.290 573 HB2 LYS 732 HB2 LYS 732 -13.046 -1.916 6.059 574 HB3 LYS 732 HB3 LYS 732 -14.218 -2.663 7.141 575 HG2 LYS 732 HG2 LYS 732 -11.413 -1.788 7.892 576 HG3 LYS 732 HG3 LYS 732 -12.903 -0.965 8.340 577 HD2 LYS 732 HD2 LYS 732 -12.778 -3.850 9.040 578 HD3 LYS 732 HD3 LYS 732 -11.676 -2.805 9.927 579 HE2 LYS 732 HE2 LYS 732 -14.448 -1.799 9.632 580 HE3 LYS 732 HE3 LYS 732 -14.245 -3.215 10.666 581 HZ1 LYS 732 HZ1 LYS 732 -12.225 -1.194 11.093 582 HZ2 LYS 732 HZ2 LYS 732 -13.809 -0.650 11.433 583 HZ3 LYS 732 HZ3 LYS 732 -13.200 -2.031 12.246 584 H LYS 733 H LYS 733 -11.242 -3.401 4.560 585 HA LYS 733 HA LYS 733 -12.965 -4.940 2.715 586 HB2 LYS 733 HB2 LYS 733 -13.452 -2.620 2.312 587 HB3 LYS 733 HB3 LYS 733 -11.742 -2.199 2.315 588 HG2 LYS 733 HG2 LYS 733 -12.570 -2.322 0.010 589 HG3 LYS 733 HG3 LYS 733 -11.406 -3.614 0.299 590 HD2 LYS 733 HD2 LYS 733 -12.979 -5.259 0.105 591 HD3 LYS 733 HD3 LYS 733 -14.220 -4.306 0.920 592 HE2 LYS 733 HE2 LYS 733 -13.273 -3.837 -1.924 593 HE3 LYS 733 HE3 LYS 733 -14.750 -4.699 -1.485 594 HZ1 LYS 733 HZ1 LYS 733 -15.575 -2.599 -1.740 595 HZ2 LYS 733 HZ2 LYS 733 -15.150 -2.522 -0.095 596 HZ3 LYS 733 HZ3 LYS 733 -14.128 -1.839 -1.265 597 H ALA 734 H ALA 734 -11.743 -6.685 2.283 598 HA ALA 734 HA ALA 734 -8.870 -6.321 1.711 599 HB1 ALA 734 HB1 ALA 734 -10.183 -8.991 2.109 600 HB2 ALA 734 HB2 ALA 734 -9.816 -7.974 3.502 601 HB3 ALA 734 HB3 ALA 734 -8.518 -8.508 2.435 602 H PHE 735 H PHE 735 -7.954 -7.810 0.058 603 HA PHE 735 HA PHE 735 -9.832 -8.325 -2.173 604 HB2 PHE 735 HB2 PHE 735 -7.474 -6.550 -2.120 605 HB3 PHE 735 HB3 PHE 735 -7.574 -7.623 -3.513 606 HD1 PHE 735 HD1 PHE 735 -9.224 -4.885 -1.676 607 HD2 PHE 735 HD2 PHE 735 -9.398 -7.450 -5.117 608 HE1 PHE 735 HE1 PHE 735 -10.979 -3.440 -2.666 609 HE2 PHE 735 HE2 PHE 735 -11.152 -6.007 -6.106 610 HZ PHE 735 HZ PHE 735 -11.945 -4.001 -4.880 611 H ARG 736 H ARG 736 -8.555 -9.581 -3.973 612 HA ARG 736 HA ARG 736 -7.991 -12.142 -3.061 613 HB2 ARG 736 HB2 ARG 736 -7.279 -10.679 -5.586 614 HB3 ARG 736 HB3 ARG 736 -6.731 -12.330 -5.324 615 HG2 ARG 736 HG2 ARG 736 -8.800 -12.503 -6.507 616 HG3 ARG 736 HG3 ARG 736 -9.158 -12.934 -4.837 617 HD2 ARG 736 HD2 ARG 736 -10.263 -10.916 -4.416 618 HD3 ARG 736 HD3 ARG 736 -9.458 -10.078 -5.735 619 HE ARG 736 HE ARG 736 -11.811 -11.787 -5.934 620 HH11 ARG 736 HH21 ARG 736 -9.217 -10.148 -7.602 621 HH12 ARG 736 HH22 ARG 736 -10.060 -10.190 -9.126 622 HH21 ARG 736 HH11 ARG 736 -12.838 -11.806 -7.917 623 HH22 ARG 736 HH12 ARG 736 -12.075 -11.103 -9.297 624 H GLY 737 H GLY 737 -5.677 -9.601 -3.979 625 HA2 GLY 737 HA2 GLY 737 -3.710 -10.729 -2.129 626 HA3 GLY 737 HA3 GLY 737 -3.250 -10.620 -3.827 627 H LEU 738 H LEU 738 -1.573 -9.177 -3.018 628 HA LEU 738 HA LEU 738 -2.241 -6.655 -1.858 629 HB2 LEU 738 HB2 LEU 738 0.110 -8.105 -2.268 630 HB3 LEU 738 HB3 LEU 738 0.290 -6.676 -3.288 631 HG LEU 738 HG LEU 738 -0.463 -6.644 -0.350 632 HD11 LEU 738 HD11 LEU 738 1.917 -7.267 -0.898 633 HD12 LEU 738 HD12 LEU 738 2.080 -5.694 -1.683 634 HD13 LEU 738 HD13 LEU 738 1.739 -5.792 0.043 635 HD21 LEU 738 HD21 LEU 738 -1.450 -4.729 -1.199 636 HD22 LEU 738 HD22 LEU 738 0.166 -4.134 -0.849 637 HD23 LEU 738 HD23 LEU 738 -0.268 -4.570 -2.499 638 H THR 739 H THR 739 -1.111 -7.593 -5.100 639 HA THR 739 HA THR 739 -1.263 -5.158 -6.378 640 HB THR 739 HB THR 739 -2.229 -7.765 -7.565 641 HG1 THR 739 HG1 THR 739 -0.263 -8.202 -6.685 642 HG21 THR 739 HG21 THR 739 -1.335 -6.803 -9.649 643 HG22 THR 739 HG22 THR 739 -2.590 -5.778 -8.956 644 HG23 THR 739 HG23 THR 739 -0.892 -5.335 -8.778 645 H GLU 740 H GLU 740 -3.882 -7.551 -6.074 646 HA GLU 740 HA GLU 740 -5.901 -5.918 -7.203 647 HB2 GLU 740 HB2 GLU 740 -6.238 -8.154 -5.195 648 HB3 GLU 740 HB3 GLU 740 -7.456 -7.546 -6.317 649 HG2 GLU 740 HG2 GLU 740 -5.295 -8.151 -7.973 650 HG3 GLU 740 HG3 GLU 740 -5.285 -9.457 -6.791 651 H LEU 741 H LEU 741 -4.638 -6.214 -3.966 652 HA LEU 741 HA LEU 741 -6.771 -4.742 -2.722 653 HB2 LEU 741 HB2 LEU 741 -5.476 -6.460 -1.531 654 HB3 LEU 741 HB3 LEU 741 -4.010 -5.515 -1.739 655 HG LEU 741 HG LEU 741 -5.256 -5.378 0.520 656 HD11 LEU 741 HD11 LEU 741 -3.649 -3.614 -0.909 657 HD12 LEU 741 HD12 LEU 741 -4.965 -2.608 -0.304 658 HD13 LEU 741 HD13 LEU 741 -3.993 -3.560 0.816 659 HD21 LEU 741 HD21 LEU 741 -6.939 -3.409 -1.048 660 HD22 LEU 741 HD22 LEU 741 -7.499 -5.012 -0.580 661 HD23 LEU 741 HD23 LEU 741 -7.091 -3.825 0.654 662 H VAL 742 H VAL 742 -3.530 -3.986 -3.955 663 HA VAL 742 HA VAL 742 -3.849 -1.183 -3.104 664 HB VAL 742 HB VAL 742 -1.554 -2.825 -4.087 665 HG11 VAL 742 HG11 VAL 742 -1.747 0.194 -4.224 666 HG12 VAL 742 HG12 VAL 742 -0.231 -0.703 -4.292 667 HG13 VAL 742 HG13 VAL 742 -1.433 -0.907 -5.566 668 HG21 VAL 742 HG21 VAL 742 -1.756 -2.660 -1.723 669 HG22 VAL 742 HG22 VAL 742 -0.511 -1.493 -2.159 670 HG23 VAL 742 HG23 VAL 742 -2.145 -0.942 -1.804 671 H GLU 743 H GLU 743 -3.973 -3.133 -6.032 672 HA GLU 743 HA GLU 743 -3.932 -0.798 -7.754 673 HB2 GLU 743 HB2 GLU 743 -4.594 -3.694 -8.329 674 HB3 GLU 743 HB3 GLU 743 -4.558 -2.424 -9.548 675 HG2 GLU 743 HG2 GLU 743 -2.195 -3.002 -7.748 676 HG3 GLU 743 HG3 GLU 743 -2.413 -3.796 -9.302 677 H PHE 744 H PHE 744 -6.100 -1.724 -5.585 678 HA PHE 744 HA PHE 744 -8.412 -0.966 -7.276 679 HB2 PHE 744 HB2 PHE 744 -8.501 -3.240 -6.166 680 HB3 PHE 744 HB3 PHE 744 -8.533 -2.401 -4.615 681 HD1 PHE 744 HD1 PHE 744 -10.452 -1.008 -3.965 682 HD2 PHE 744 HD2 PHE 744 -10.386 -3.119 -7.706 683 HE1 PHE 744 HE1 PHE 744 -12.887 -0.618 -4.228 684 HE2 PHE 744 HE2 PHE 744 -12.820 -2.729 -7.968 685 HZ PHE 744 HZ PHE 744 -14.070 -1.479 -6.229 686 H TYR 745 H TYR 745 -6.831 -0.555 -4.139 687 HA TYR 745 HA TYR 745 -8.566 1.447 -3.139 688 HB2 TYR 745 HB2 TYR 745 -5.778 0.561 -2.493 689 HB3 TYR 745 HB3 TYR 745 -6.389 2.066 -1.804 690 HD1 TYR 745 HD1 TYR 745 -7.825 -1.336 -2.513 691 HD2 TYR 745 HD2 TYR 745 -7.248 1.821 0.351 692 HE1 TYR 745 HE1 TYR 745 -9.124 -2.617 -0.830 693 HE2 TYR 745 HE2 TYR 745 -8.534 0.528 2.020 694 HH TYR 745 HH TYR 745 -9.435 -2.772 1.542 695 H GLN 746 H GLN 746 -6.446 1.494 -5.735 696 HA GLN 746 HA GLN 746 -5.508 4.190 -5.634 697 HB2 GLN 746 HB2 GLN 746 -5.214 3.817 -8.149 698 HB3 GLN 746 HB3 GLN 746 -4.345 2.699 -7.092 699 HG2 GLN 746 HG2 GLN 746 -5.594 0.918 -7.732 700 HG3 GLN 746 HG3 GLN 746 -7.088 1.845 -7.773 701 HE21 GLN 746 HE21 GLN 746 -4.454 0.627 -9.721 702 HE22 GLN 746 HE22 GLN 746 -5.005 1.264 -11.193 703 H GLN 747 H GLN 747 -8.510 2.715 -6.354 704 HA GLN 747 HA GLN 747 -9.549 5.202 -7.579 705 HB2 GLN 747 HB2 GLN 747 -11.033 2.587 -7.560 706 HB3 GLN 747 HB3 GLN 747 -11.140 3.918 -8.715 707 HG2 GLN 747 HG2 GLN 747 -8.488 3.183 -8.918 708 HG3 GLN 747 HG3 GLN 747 -9.281 1.633 -8.651 709 HE21 GLN 747 HE21 GLN 747 -8.062 3.034 -11.157 710 HE22 GLN 747 HE22 GLN 747 -9.288 2.856 -12.326 711 H ASN 748 H ASN 748 -10.055 2.794 -5.051 712 HA ASN 748 HA ASN 748 -12.443 3.986 -4.017 713 HB2 ASN 748 HB2 ASN 748 -12.211 1.734 -3.441 714 HB3 ASN 748 HB3 ASN 748 -10.504 1.906 -3.055 715 HD21 ASN 748 HD21 ASN 748 -13.774 2.687 -1.839 716 HD22 ASN 748 HD22 ASN 748 -13.302 2.826 -0.207 717 H SER 749 H SER 749 -12.561 5.872 -2.974 718 HA SER 749 HA SER 749 -10.403 7.476 -2.237 719 HB2 SER 749 HB2 SER 749 -11.991 8.865 -1.102 720 HB3 SER 749 HB3 SER 749 -12.799 8.201 -2.517 721 HG SER 749 HG SER 749 -12.909 6.736 -0.131 722 H LEU 750 H LEU 750 -8.857 6.889 -0.854 723 HA LEU 750 HA LEU 750 -8.925 4.985 1.122 724 HB2 LEU 750 HB2 LEU 750 -7.366 7.579 1.121 725 HB3 LEU 750 HB3 LEU 750 -7.029 6.207 2.177 726 HG LEU 750 HG LEU 750 -6.939 6.228 -0.847 727 HD11 LEU 750 HD11 LEU 750 -5.027 7.208 0.626 728 HD12 LEU 750 HD12 LEU 750 -4.693 5.523 1.021 729 HD13 LEU 750 HD13 LEU 750 -4.609 6.070 -0.654 730 HD21 LEU 750 HD21 LEU 750 -5.865 3.853 -0.167 731 HD22 LEU 750 HD22 LEU 750 -7.033 4.019 1.142 732 HD23 LEU 750 HD23 LEU 750 -7.579 4.046 -0.536 733 H LYS 751 H LYS 751 -10.218 8.234 1.271 734 HA LYS 751 HA LYS 751 -10.463 8.581 4.036 735 HB2 LYS 751 HB2 LYS 751 -12.052 10.252 3.552 736 HB3 LYS 751 HB3 LYS 751 -10.997 10.225 2.140 737 HG2 LYS 751 HG2 LYS 751 -12.711 8.505 1.185 738 HG3 LYS 751 HG3 LYS 751 -13.797 9.152 2.413 739 HD2 LYS 751 HD2 LYS 751 -12.358 10.773 0.289 740 HD3 LYS 751 HD3 LYS 751 -14.074 10.367 0.283 741 HE2 LYS 751 HE2 LYS 751 -12.652 12.022 2.394 742 HE3 LYS 751 HE3 LYS 751 -13.723 12.652 1.142 743 HZ1 LYS 751 HZ1 LYS 751 -14.817 12.306 3.327 744 HZ2 LYS 751 HZ2 LYS 751 -15.547 11.438 2.059 745 HZ3 LYS 751 HZ3 LYS 751 -14.541 10.637 3.167 746 H ASP 752 H ASP 752 -11.958 6.297 1.987 747 HA ASP 752 HA ASP 752 -14.239 5.870 3.780 748 HB2 ASP 752 HB2 ASP 752 -15.063 5.507 1.693 749 HB3 ASP 752 HB3 ASP 752 -13.484 5.118 1.029 750 H CYS 753 H CYS 753 -11.307 4.208 2.682 751 HA CYS 753 HA CYS 753 -11.776 1.994 4.537 752 HB2 CYS 753 HB2 CYS 753 -9.572 2.507 2.529 753 HB3 CYS 753 HB3 CYS 753 -9.713 1.055 3.518 754 HG CYS 753 HG CYS 753 -11.664 1.840 1.215 755 H PHE 754 H PHE 754 -9.431 4.629 4.025 756 HA PHE 754 HA PHE 754 -7.767 3.825 6.239 757 HB2 PHE 754 HB2 PHE 754 -7.906 6.248 4.463 758 HB3 PHE 754 HB3 PHE 754 -6.848 6.222 5.868 759 HD1 PHE 754 HD2 PHE 754 -7.670 3.222 3.799 760 HD2 PHE 754 HD1 PHE 754 -4.760 6.244 4.718 761 HE1 PHE 754 HE2 PHE 754 -5.965 1.977 2.506 762 HE2 PHE 754 HE1 PHE 754 -3.062 5.001 3.434 763 HZ PHE 754 HZ PHE 754 -3.659 2.869 2.319 764 H LYS 755 H LYS 755 -8.482 7.176 6.263 765 HA LYS 755 HA LYS 755 -10.493 7.159 8.325 766 HB2 LYS 755 HB2 LYS 755 -8.567 6.437 9.638 767 HB3 LYS 755 HB3 LYS 755 -7.647 7.830 9.075 768 HG2 LYS 755 HG2 LYS 755 -9.190 9.360 10.177 769 HG3 LYS 755 HG3 LYS 755 -10.259 8.022 10.605 770 HD2 LYS 755 HD2 LYS 755 -9.113 7.879 12.538 771 HD3 LYS 755 HD3 LYS 755 -7.784 7.222 11.585 772 HE2 LYS 755 HE2 LYS 755 -8.233 10.133 12.312 773 HE3 LYS 755 HE3 LYS 755 -6.934 9.087 12.889 774 HZ1 LYS 755 HZ1 LYS 755 -6.779 8.915 10.162 775 HZ2 LYS 755 HZ2 LYS 755 -7.132 10.563 10.421 776 HZ3 LYS 755 HZ3 LYS 755 -5.765 9.843 11.154 777 H SER 756 H SER 756 -8.042 9.577 8.624 778 HA SER 756 HA SER 756 -9.890 11.577 7.619 779 HB2 SER 756 HB2 SER 756 -7.490 12.876 8.168 780 HB3 SER 756 HB3 SER 756 -8.853 12.712 9.274 781 HG SER 756 HG SER 756 -6.571 11.037 8.992 782 H LEU 757 H LEU 757 -8.723 9.617 5.785 783 HA LEU 757 HA LEU 757 -6.816 11.050 4.147 784 HB2 LEU 757 HB2 LEU 757 -8.148 8.377 4.095 785 HB3 LEU 757 HB3 LEU 757 -7.515 9.011 2.580 786 HG LEU 757 HG LEU 757 -5.950 7.563 4.063 787 HD11 LEU 757 HD11 LEU 757 -4.604 8.389 2.481 788 HD12 LEU 757 HD12 LEU 757 -5.479 9.919 2.440 789 HD13 LEU 757 HD13 LEU 757 -4.194 9.669 3.621 790 HD21 LEU 757 HD21 LEU 757 -5.335 10.161 5.428 791 HD22 LEU 757 HD22 LEU 757 -6.597 9.119 6.082 792 HD23 LEU 757 HD23 LEU 757 -4.952 8.515 5.930 793 H ASP 758 H ASP 758 -7.343 11.119 1.719 794 HA ASP 758 HA ASP 758 -10.045 11.482 0.889 795 HB2 ASP 758 HB2 ASP 758 -8.749 13.753 2.116 796 HB3 ASP 758 HB3 ASP 758 -9.080 14.094 0.418 797 H THR 759 H THR 759 -7.932 9.971 0.008 798 HA THR 759 HA THR 759 -7.726 10.844 -2.745 799 HB THR 759 HB THR 759 -5.783 11.970 -1.659 800 HG1 THR 759 HG1 THR 759 -4.862 11.589 -3.493 801 HG21 THR 759 HG21 THR 759 -5.251 10.448 0.130 802 HG22 THR 759 HG22 THR 759 -5.061 9.100 -0.993 803 HG23 THR 759 HG23 THR 759 -3.888 10.414 -0.990 804 H THR 760 H THR 760 -5.627 9.126 -3.461 805 HA THR 760 HA THR 760 -6.255 6.447 -2.500 806 HB THR 760 HB THR 760 -7.020 5.566 -4.606 807 HG1 THR 760 HG1 THR 760 -6.921 6.652 -6.418 808 HG21 THR 760 HG21 THR 760 -8.703 6.663 -3.097 809 HG22 THR 760 HG22 THR 760 -8.564 8.113 -4.093 810 HG23 THR 760 HG23 THR 760 -9.179 6.617 -4.793 811 H LEU 761 H LEU 761 -5.027 4.791 -3.883 812 HA LEU 761 HA LEU 761 -2.266 5.376 -3.883 813 HB2 LEU 761 HB2 LEU 761 -3.827 3.213 -5.344 814 HB3 LEU 761 HB3 LEU 761 -2.079 3.256 -5.249 815 HG LEU 761 HG LEU 761 -3.214 1.715 -3.592 816 HD11 LEU 761 HD11 LEU 761 -1.527 3.967 -2.495 817 HD12 LEU 761 HD12 LEU 761 -1.814 2.426 -1.684 818 HD13 LEU 761 HD13 LEU 761 -0.949 2.463 -3.215 819 HD21 LEU 761 HD21 LEU 761 -4.242 2.668 -1.617 820 HD22 LEU 761 HD22 LEU 761 -3.979 4.301 -2.218 821 HD23 LEU 761 HD23 LEU 761 -5.114 3.227 -3.038 822 H GLN 762 H GLN 762 -2.123 7.378 -5.004 823 HA GLN 762 HA GLN 762 -3.065 7.732 -7.666 824 HB2 GLN 762 HB2 GLN 762 -1.802 9.297 -5.609 825 HB3 GLN 762 HB3 GLN 762 -1.040 9.619 -7.162 826 HG2 GLN 762 HG2 GLN 762 -3.880 9.514 -7.553 827 HG3 GLN 762 HG3 GLN 762 -3.547 10.573 -6.185 828 HE21 GLN 762 HE21 GLN 762 -1.526 12.117 -6.692 829 HE22 GLN 762 HE22 GLN 762 -1.574 12.848 -8.220 830 H PHE 763 H PHE 763 0.330 7.687 -6.487 831 HA PHE 763 HA PHE 763 1.041 6.399 -9.060 832 HB2 PHE 763 HB2 PHE 763 2.363 8.823 -7.830 833 HB3 PHE 763 HB3 PHE 763 3.062 7.890 -9.153 834 HD1 PHE 763 HD1 PHE 763 1.723 7.624 -11.304 835 HD2 PHE 763 HD2 PHE 763 0.672 10.437 -8.234 836 HE1 PHE 763 HE1 PHE 763 0.319 8.868 -12.926 837 HE2 PHE 763 HE2 PHE 763 -0.733 11.680 -9.855 838 HZ PHE 763 HZ PHE 763 -0.911 10.896 -12.199 839 HA PRO 764 HA PRO 764 3.621 3.827 -6.561 840 HB2 PRO 764 HB2 PRO 764 5.258 2.823 -8.491 841 HB3 PRO 764 HB3 PRO 764 3.545 2.381 -8.372 842 HG2 PRO 764 HG2 PRO 764 4.885 4.260 -10.230 843 HG3 PRO 764 HG3 PRO 764 3.518 3.170 -10.504 844 HD2 PRO 764 HD2 PRO 764 3.297 5.904 -10.052 845 HD3 PRO 764 HD3 PRO 764 1.986 4.722 -9.837 846 H PHE 765 H PHE 765 6.294 3.280 -6.694 847 HA PHE 765 HA PHE 765 7.550 5.949 -6.572 848 HB2 PHE 765 HB2 PHE 765 8.697 5.382 -4.607 849 HB3 PHE 765 HB3 PHE 765 7.088 4.712 -4.360 850 HD1 PHE 765 HD1 PHE 765 6.697 2.250 -4.906 851 HD2 PHE 765 HD2 PHE 765 10.608 3.992 -4.590 852 HE1 PHE 765 HE1 PHE 765 7.676 -0.008 -4.605 853 HE2 PHE 765 HE2 PHE 765 11.591 1.736 -4.295 854 HZ PHE 765 HZ PHE 765 10.124 -0.263 -4.300 855 H LYS 766 H LYS 766 7.609 2.996 -8.127 856 HA LYS 766 HA LYS 766 10.497 3.157 -8.695 857 HB2 LYS 766 HB2 LYS 766 8.483 0.999 -9.340 858 HB3 LYS 766 HB3 LYS 766 10.209 0.930 -9.697 859 HG2 LYS 766 HG2 LYS 766 10.354 1.561 -7.086 860 HG3 LYS 766 HG3 LYS 766 8.812 0.714 -7.071 861 HD2 LYS 766 HD2 LYS 766 11.100 -0.532 -8.528 862 HD3 LYS 766 HD3 LYS 766 11.091 -0.596 -6.769 863 HE2 LYS 766 HE2 LYS 766 8.479 -1.281 -7.461 864 HE3 LYS 766 HE3 LYS 766 9.461 -2.092 -8.682 865 HZ1 LYS 766 HZ1 LYS 766 10.815 -2.497 -6.347 866 HZ2 LYS 766 HZ2 LYS 766 9.180 -2.670 -5.878 867 HZ3 LYS 766 HZ3 LYS 766 9.828 -3.631 -7.131 868 H GLU 767 H GLU 767 7.323 3.248 -10.205 869 HA GLU 767 HA GLU 767 6.746 3.520 -12.469 870 HB2 GLU 767 HB2 GLU 767 7.563 5.871 -11.051 871 HB3 GLU 767 HB3 GLU 767 7.939 6.080 -12.759 872 HG2 GLU 767 HG2 GLU 767 5.479 5.022 -13.015 873 HG3 GLU 767 HG3 GLU 767 5.290 5.753 -11.424 874 H1 ASP 338 H1 ASP 338 13.333 7.886 14.490 875 H2 ASP 338 H2 ASP 338 13.469 7.798 14.167 876 H3 ASP 338 H3 ASP 338 14.945 8.592 14.457 877 HA ASP 338 HA ASP 338 15.849 6.564 14.178 878 HB2 ASP 338 HB2 ASP 338 15.773 5.260 16.381 879 HB3 ASP 338 HB3 ASP 338 16.283 6.945 16.509 880 H THR 339 H THR 339 13.529 5.081 16.291 881 HA THR 339 HA THR 339 12.895 2.976 14.514 882 HB THR 339 HB THR 339 11.028 2.598 16.263 883 HG1 THR 339 HG1 THR 339 12.536 4.665 17.533 884 HG21 THR 339 HG21 THR 339 13.136 1.385 16.337 885 HG22 THR 339 HG22 THR 339 13.951 2.778 17.051 886 HG23 THR 339 HG23 THR 339 12.721 1.910 17.970 887 H GLU 340 H GLU 340 12.434 5.107 12.945 888 HA GLU 340 HA GLU 340 9.752 6.080 12.963 889 HB2 GLU 340 HB2 GLU 340 12.044 6.103 11.046 890 HB3 GLU 340 HB3 GLU 340 10.437 6.476 10.422 891 HG2 GLU 340 HG2 GLU 340 11.405 7.818 12.938 892 HG3 GLU 340 HG3 GLU 340 11.929 8.421 11.367 893 H VAL 341 H VAL 341 8.789 3.872 13.374 894 HA VAL 341 HA VAL 341 8.482 2.294 10.903 895 HB VAL 341 HB VAL 341 9.140 1.245 13.151 896 HG11 VAL 341 HG11 VAL 341 6.341 0.892 13.907 897 HG12 VAL 341 HG12 VAL 341 7.728 1.316 14.908 898 HG13 VAL 341 HG13 VAL 341 6.855 2.573 14.035 899 HG21 VAL 341 HG21 VAL 341 7.452 0.347 11.016 900 HG22 VAL 341 HG22 VAL 341 8.542 -0.606 12.020 901 HG23 VAL 341 HG23 VAL 341 6.869 -0.369 12.519 902 H PTR 342 H PTR 342 5.928 1.193 12.106 903 HA PTR 342 HA PTR 342 4.113 3.459 11.574 904 HB2 PTR 342 HB2 PTR 342 2.690 1.682 10.332 905 HB3 PTR 342 HB3 PTR 342 4.078 2.373 9.495 906 HD1 PTR 342 HD1 PTR 342 3.575 -0.341 12.051 907 HD2 PTR 342 HD2 PTR 342 5.292 0.800 8.280 908 HE1 PTR 342 HE1 PTR 342 4.566 -2.592 11.826 909 HE2 PTR 342 HE2 PTR 342 6.286 -1.461 8.057 910 H GLU 343 H GLU 343 1.723 2.396 11.879 911 HA GLU 343 HA GLU 343 1.605 0.666 14.230 912 HB2 GLU 343 HB2 GLU 343 0.410 2.351 15.573 913 HB3 GLU 343 HB3 GLU 343 2.042 2.891 15.176 914 HG2 GLU 343 HG2 GLU 343 -0.436 3.666 13.600 915 HG3 GLU 343 HG3 GLU 343 0.297 4.672 14.844 916 H SER 344 H SER 344 0.454 1.147 11.311 917 HA SER 344 HA SER 344 -1.555 0.805 10.209 918 HB2 SER 344 HB2 SER 344 -1.148 -1.322 11.765 919 HB3 SER 344 HB3 SER 344 -2.598 -0.719 12.561 920 HG SER 344 HG SER 344 -3.672 -0.799 10.572 921 HA PRO 345 HA PRO 345 -3.280 4.252 12.991 922 HB2 PRO 345 HB2 PRO 345 -3.464 5.392 10.228 923 HB3 PRO 345 HB3 PRO 345 -3.012 6.186 11.750 924 HG2 PRO 345 HG2 PRO 345 -1.163 5.526 9.991 925 HG3 PRO 345 HG3 PRO 345 -0.877 5.298 11.727 926 HD2 PRO 345 HD2 PRO 345 -1.519 3.246 9.638 927 HD3 PRO 345 HD3 PRO 345 -0.450 3.121 11.050 928 H PTR 346 H PTR 346 -4.492 2.633 10.099 929 HA PTR 346 HA PTR 346 -7.245 3.293 10.973 930 HB2 PTR 346 HB2 PTR 346 -6.565 2.553 8.144 931 HB3 PTR 346 HB3 PTR 346 -7.945 3.467 8.756 932 HD1 PTR 346 HD1 PTR 346 -5.343 4.006 6.749 933 HD2 PTR 346 HD2 PTR 346 -6.754 5.398 10.557 934 HE1 PTR 346 HE1 PTR 346 -4.042 6.111 6.477 935 HE2 PTR 346 HE2 PTR 346 -5.473 7.492 10.277 936 H ALA 347 H ALA 347 -8.748 1.742 11.102 937 HA ALA 347 HA ALA 347 -8.781 -0.782 9.973 938 HB1 ALA 347 HB1 ALA 347 -6.814 -1.451 11.084 939 HB2 ALA 347 HB2 ALA 347 -8.118 -2.133 12.060 940 HB3 ALA 347 HB3 ALA 347 -7.291 -0.666 12.589 941 H ASP 348 H ASP 348 -9.223 0.431 13.313 942 HA ASP 348 HA ASP 348 -12.130 0.166 12.991 943 HB2 ASP 348 HB2 ASP 348 -10.477 -1.271 15.067 944 HB3 ASP 348 HB3 ASP 348 -12.195 -0.952 15.293 945 HA PRO 349 HA PRO 349 -10.721 3.921 15.378 946 HB2 PRO 349 HB2 PRO 349 -11.672 5.817 13.693 947 HB3 PRO 349 HB3 PRO 349 -10.090 5.046 13.452 948 HG2 PRO 349 HG2 PRO 349 -12.689 4.497 12.100 949 HG3 PRO 349 HG3 PRO 349 -11.056 4.572 11.416 950 HD2 PRO 349 HD2 PRO 349 -12.343 2.214 12.029 951 HD3 PRO 349 HD3 PRO 349 -10.575 2.390 11.990 952 H GLU 350 H GLU 350 -12.519 2.782 16.645 953 HA GLU 350 HA GLU 350 -14.448 2.953 17.869 954 HB2 GLU 350 HB2 GLU 350 -14.537 5.711 16.615 955 HB3 GLU 350 HB3 GLU 350 -15.592 5.166 17.916 956 HG2 GLU 350 HG2 GLU 350 -13.930 6.115 19.202 957 HG3 GLU 350 HG3 GLU 350 -13.235 4.507 19.023 Start of MODEL 5 1 H1 GLY 661 H1 GLY 661 1.041 -12.245 -11.243 2 H2 GLY 661 H2 GLY 661 -0.081 -11.894 -12.484 3 H3 GLY 661 H3 GLY 661 1.298 -10.923 -12.287 4 HA2 GLY 661 HA2 GLY 661 1.527 -12.451 -14.180 5 HA3 GLY 661 HA3 GLY 661 2.739 -12.733 -12.928 6 H HIS 662 H HIS 662 2.586 -14.572 -11.593 7 HA HIS 662 HA HIS 662 0.847 -16.702 -12.696 8 HB2 HIS 662 HB2 HIS 662 3.384 -16.967 -12.557 9 HB3 HIS 662 HB3 HIS 662 3.172 -17.065 -10.808 10 HD1 HIS 662 HD1 HIS 662 0.518 -18.647 -10.729 11 HD2 HIS 662 HD2 HIS 662 3.764 -19.660 -13.147 12 HE1 HIS 662 HE1 HIS 662 0.328 -21.143 -11.190 13 HE2 HIS 662 HE2 HIS 662 2.302 -21.775 -12.660 14 H MET 663 H MET 663 1.269 -14.646 -9.997 15 HA MET 663 HA MET 663 -1.076 -15.514 -8.686 16 HB2 MET 663 HB2 MET 663 0.409 -17.469 -8.149 17 HB3 MET 663 HB3 MET 663 1.468 -16.363 -7.274 18 HG2 MET 663 HG2 MET 663 -0.966 -15.718 -6.205 19 HG3 MET 663 HG3 MET 663 -1.175 -17.441 -6.520 20 HE1 MET 663 HE1 MET 663 -1.711 -17.543 -4.312 21 HE2 MET 663 HE2 MET 663 -0.653 -18.928 -4.060 22 HE3 MET 663 HE3 MET 663 -0.641 -17.587 -2.911 23 H GLN 664 H GLN 664 1.311 -14.904 -6.362 24 HA GLN 664 HA GLN 664 0.357 -12.169 -6.017 25 HB2 GLN 664 HB2 GLN 664 0.635 -13.853 -4.122 26 HB3 GLN 664 HB3 GLN 664 2.375 -13.648 -4.320 27 HG2 GLN 664 HG2 GLN 664 1.909 -12.051 -2.681 28 HG3 GLN 664 HG3 GLN 664 1.819 -11.083 -4.148 29 HE21 GLN 664 HE21 GLN 664 -0.536 -13.318 -2.565 30 HE22 GLN 664 HE22 GLN 664 -1.794 -12.182 -2.530 31 H ASP 665 H ASP 665 1.741 -12.322 -8.354 32 HA ASP 665 HA ASP 665 4.530 -11.691 -7.978 33 HB2 ASP 665 HB2 ASP 665 3.273 -10.833 -10.497 34 HB3 ASP 665 HB3 ASP 665 4.679 -11.857 -10.232 35 H LEU 666 H LEU 666 5.048 -9.861 -6.958 36 HA LEU 666 HA LEU 666 3.488 -7.431 -7.561 37 HB2 LEU 666 HB2 LEU 666 5.438 -7.708 -5.292 38 HB3 LEU 666 HB3 LEU 666 4.080 -6.594 -5.453 39 HG LEU 666 HG LEU 666 3.846 -9.605 -5.168 40 HD11 LEU 666 HD11 LEU 666 3.273 -9.265 -2.928 41 HD12 LEU 666 HD12 LEU 666 4.607 -8.139 -3.165 42 HD13 LEU 666 HD13 LEU 666 2.948 -7.550 -3.178 43 HD21 LEU 666 HD21 LEU 666 1.949 -7.433 -5.849 44 HD22 LEU 666 HD22 LEU 666 1.839 -9.167 -6.160 45 HD23 LEU 666 HD23 LEU 666 1.403 -8.527 -4.578 46 H SER 667 H SER 667 6.673 -8.838 -7.693 47 HA SER 667 HA SER 667 8.230 -6.530 -8.038 48 HB2 SER 667 HB2 SER 667 8.781 -9.088 -9.504 49 HB3 SER 667 HB3 SER 667 9.920 -7.980 -8.739 50 HG SER 667 HG SER 667 9.761 -9.323 -7.112 51 H VAL 668 H VAL 668 5.724 -7.618 -9.944 52 HA VAL 668 HA VAL 668 6.858 -6.719 -12.482 53 HB VAL 668 HB VAL 668 4.780 -7.522 -13.459 54 HG11 VAL 668 HG11 VAL 668 4.993 -9.873 -12.900 55 HG12 VAL 668 HG12 VAL 668 6.599 -9.148 -12.855 56 HG13 VAL 668 HG13 VAL 668 5.739 -9.480 -11.352 57 HG21 VAL 668 HG21 VAL 668 3.941 -7.895 -10.565 58 HG22 VAL 668 HG22 VAL 668 3.191 -6.834 -11.756 59 HG23 VAL 668 HG23 VAL 668 3.071 -8.583 -11.935 60 H HIS 669 H HIS 669 5.614 -5.257 -9.860 61 HA HIS 669 HA HIS 669 4.124 -3.187 -11.359 62 HB2 HIS 669 HB2 HIS 669 4.329 -3.570 -8.367 63 HB3 HIS 669 HB3 HIS 669 3.225 -2.502 -9.228 64 HD1 HIS 669 HD1 HIS 669 2.087 -4.300 -11.363 65 HD2 HIS 669 HD2 HIS 669 2.724 -5.585 -7.459 66 HE1 HIS 669 HE1 HIS 669 0.480 -6.219 -10.972 67 HE2 HIS 669 HE2 HIS 669 0.774 -6.951 -8.545 68 H LEU 670 H LEU 670 4.365 -1.019 -9.945 69 HA LEU 670 HA LEU 670 7.245 -0.461 -9.684 70 HB2 LEU 670 HB2 LEU 670 6.489 1.969 -10.283 71 HB3 LEU 670 HB3 LEU 670 6.809 0.828 -11.562 72 HG LEU 670 HG LEU 670 4.112 1.575 -10.444 73 HD11 LEU 670 HD11 LEU 670 5.226 1.969 -13.218 74 HD12 LEU 670 HD12 LEU 670 3.764 2.679 -12.533 75 HD13 LEU 670 HD13 LEU 670 5.348 3.181 -11.946 76 HD21 LEU 670 HD21 LEU 670 4.954 -0.738 -12.030 77 HD22 LEU 670 HD22 LEU 670 3.396 -0.423 -11.255 78 HD23 LEU 670 HD23 LEU 670 3.737 0.227 -12.857 79 H TRP 671 H TRP 671 4.343 -0.719 -8.122 80 HA TRP 671 HA TRP 671 5.082 1.374 -6.221 81 HB2 TRP 671 HB2 TRP 671 2.790 0.851 -5.203 82 HB3 TRP 671 HB3 TRP 671 2.825 1.699 -6.741 83 HD1 TRP 671 HD1 TRP 671 1.387 0.721 -8.575 84 HE1 TRP 671 HE1 TRP 671 0.130 -1.509 -8.972 85 HE3 TRP 671 HE3 TRP 671 3.149 -1.971 -4.602 86 HZ2 TRP 671 HZ2 TRP 671 -0.029 -4.099 -7.770 87 HZ3 TRP 671 HZ3 TRP 671 2.429 -4.318 -4.260 88 HH2 TRP 671 HH2 TRP 671 0.839 -5.381 -5.836 89 H TYR 672 H TYR 672 5.619 -1.803 -6.767 90 HA TYR 672 HA TYR 672 5.414 -2.667 -3.973 91 HB2 TYR 672 HB2 TYR 672 4.703 -4.244 -5.710 92 HB3 TYR 672 HB3 TYR 672 6.305 -4.170 -6.448 93 HD1 TYR 672 HD2 TYR 672 4.844 -4.649 -3.016 94 HD2 TYR 672 HD1 TYR 672 7.750 -5.915 -5.918 95 HE1 TYR 672 HE2 TYR 672 5.649 -6.396 -1.452 96 HE2 TYR 672 HE1 TYR 672 8.549 -7.663 -4.351 97 HH TYR 672 HH TYR 672 7.700 -8.926 -2.429 98 H ALA 673 H ALA 673 7.023 -2.222 -2.631 99 HA ALA 673 HA ALA 673 9.757 -1.901 -3.710 100 HB1 ALA 673 HB1 ALA 673 10.250 -0.670 -1.695 101 HB2 ALA 673 HB2 ALA 673 8.710 -1.142 -0.971 102 HB3 ALA 673 HB3 ALA 673 8.738 -0.044 -2.353 103 H GLY 674 H GLY 674 7.757 -3.905 -1.750 104 HA2 GLY 674 HA2 GLY 674 8.135 -5.834 -0.562 105 HA3 GLY 674 HA3 GLY 674 9.486 -6.082 -1.656 106 HA PRO 675 HA PRO 675 11.918 -5.949 2.070 107 HB2 PRO 675 HB2 PRO 675 14.383 -5.744 0.825 108 HB3 PRO 675 HB3 PRO 675 13.494 -7.259 1.058 109 HG2 PRO 675 HG2 PRO 675 13.698 -5.537 -1.359 110 HG3 PRO 675 HG3 PRO 675 13.665 -7.305 -1.227 111 HD2 PRO 675 HD2 PRO 675 11.483 -5.869 -1.994 112 HD3 PRO 675 HD3 PRO 675 11.347 -7.387 -1.074 113 H MET 676 H MET 676 10.706 -3.583 1.776 114 HA MET 676 HA MET 676 12.894 -1.582 1.922 115 HB2 MET 676 HB2 MET 676 11.270 -1.298 0.011 116 HB3 MET 676 HB3 MET 676 10.007 -1.033 1.210 117 HG2 MET 676 HG2 MET 676 10.725 1.071 1.683 118 HG3 MET 676 HG3 MET 676 12.422 0.598 1.659 119 HE1 MET 676 HE1 MET 676 13.734 0.087 -0.837 120 HE2 MET 676 HE2 MET 676 13.811 1.739 -1.452 121 HE3 MET 676 HE3 MET 676 13.911 1.433 0.286 122 H GLU 677 H GLU 677 12.467 0.234 3.399 123 HA GLU 677 HA GLU 677 10.992 -0.644 5.808 124 HB2 GLU 677 HB2 GLU 677 12.546 0.865 7.048 125 HB3 GLU 677 HB3 GLU 677 13.368 -0.474 6.235 126 HG2 GLU 677 HG2 GLU 677 14.499 0.925 4.856 127 HG3 GLU 677 HG3 GLU 677 13.067 1.898 4.535 128 H ARG 678 H ARG 678 10.289 1.193 7.216 129 HA ARG 678 HA ARG 678 8.374 2.781 5.968 130 HB2 ARG 678 HB2 ARG 678 8.237 2.284 8.328 131 HB3 ARG 678 HB3 ARG 678 9.755 3.121 8.638 132 HG2 ARG 678 HG2 ARG 678 8.084 4.969 7.275 133 HG3 ARG 678 HG3 ARG 678 7.084 4.213 8.512 134 HD2 ARG 678 HD2 ARG 678 8.078 5.463 10.092 135 HD3 ARG 678 HD3 ARG 678 9.638 4.763 9.671 136 HE ARG 678 HE ARG 678 8.849 6.845 7.826 137 HH11 ARG 678 HH21 ARG 678 10.134 6.216 11.000 138 HH12 ARG 678 HH22 ARG 678 11.090 7.673 11.016 139 HH21 ARG 678 HH11 ARG 678 10.070 8.725 7.888 140 HH22 ARG 678 HH12 ARG 678 11.054 9.071 9.288 141 H ALA 679 H ALA 679 11.421 3.937 7.411 142 HA ALA 679 HA ALA 679 11.262 6.560 6.410 143 HB1 ALA 679 HB1 ALA 679 13.187 6.830 7.562 144 HB2 ALA 679 HB2 ALA 679 13.979 5.504 6.708 145 HB3 ALA 679 HB3 ALA 679 12.944 5.166 8.097 146 H GLY 680 H GLY 680 12.489 3.586 5.053 147 HA2 GLY 680 HA2 GLY 680 13.826 4.809 2.814 148 HA3 GLY 680 HA3 GLY 680 13.443 3.100 2.987 149 H ALA 681 H ALA 681 10.738 3.096 3.271 150 HA ALA 681 HA ALA 681 9.784 3.245 0.650 151 HB1 ALA 681 HB1 ALA 681 8.209 3.415 3.235 152 HB2 ALA 681 HB2 ALA 681 8.695 1.929 2.420 153 HB3 ALA 681 HB3 ALA 681 7.541 3.019 1.650 154 H GLU 682 H GLU 682 9.331 5.579 3.321 155 HA GLU 682 HA GLU 682 7.868 7.412 1.683 156 HB2 GLU 682 HB2 GLU 682 8.124 8.975 3.581 157 HB3 GLU 682 HB3 GLU 682 7.523 7.396 4.083 158 HG2 GLU 682 HG2 GLU 682 9.964 6.795 4.563 159 HG3 GLU 682 HG3 GLU 682 10.308 8.504 4.400 160 H SER 683 H SER 683 11.193 6.777 2.064 161 HA SER 683 HA SER 683 12.317 9.292 1.620 162 HB2 SER 683 HB2 SER 683 14.295 8.145 0.983 163 HB3 SER 683 HB3 SER 683 13.500 7.083 2.145 164 HG SER 683 HG SER 683 12.803 5.790 0.510 165 H ILE 684 H ILE 684 11.143 6.869 -0.649 166 HA ILE 684 HA ILE 684 11.724 8.527 -2.963 167 HB ILE 684 HB ILE 684 9.956 6.091 -3.000 168 HG12 ILE 684 HG12 ILE 684 12.704 5.405 -3.499 169 HG13 ILE 684 HG13 ILE 684 12.599 6.171 -1.916 170 HG21 ILE 684 HG21 ILE 684 11.193 5.799 -5.186 171 HG22 ILE 684 HG22 ILE 684 10.209 7.256 -5.101 172 HG23 ILE 684 HG23 ILE 684 11.955 7.363 -4.894 173 HD11 ILE 684 HD11 ILE 684 12.234 3.639 -1.967 174 HD12 ILE 684 HD12 ILE 684 10.998 4.586 -1.138 175 HD13 ILE 684 HD13 ILE 684 10.701 3.978 -2.768 176 H LEU 685 H LEU 685 8.818 7.360 -1.277 177 HA LEU 685 HA LEU 685 6.912 8.660 -2.878 178 HB2 LEU 685 HB2 LEU 685 7.003 7.427 -0.184 179 HB3 LEU 685 HB3 LEU 685 5.720 8.606 -0.427 180 HG LEU 685 HG LEU 685 4.787 7.374 -2.234 181 HD11 LEU 685 HD11 LEU 685 6.692 6.756 -3.524 182 HD12 LEU 685 HD12 LEU 685 7.404 5.862 -2.181 183 HD13 LEU 685 HD13 LEU 685 5.975 5.236 -2.999 184 HD21 LEU 685 HD21 LEU 685 4.699 4.990 -1.219 185 HD22 LEU 685 HD22 LEU 685 5.723 5.650 0.056 186 HD23 LEU 685 HD23 LEU 685 4.120 6.327 -0.227 187 H ALA 686 H ALA 686 8.720 9.780 -0.022 188 HA ALA 686 HA ALA 686 7.316 12.248 0.228 189 HB1 ALA 686 HB1 ALA 686 8.662 11.323 2.059 190 HB2 ALA 686 HB2 ALA 686 9.203 12.946 1.632 191 HB3 ALA 686 HB3 ALA 686 10.127 11.540 1.100 192 H ASN 687 H ASN 687 10.206 11.218 -1.515 193 HA ASN 687 HA ASN 687 10.918 13.793 -2.511 194 HB2 ASN 687 HB2 ASN 687 12.733 12.475 -2.848 195 HB3 ASN 687 HB3 ASN 687 11.767 11.005 -2.895 196 HD21 ASN 687 HD21 ASN 687 12.551 13.867 -4.940 197 HD22 ASN 687 HD22 ASN 687 12.442 13.020 -6.405 198 H ARG 688 H ARG 688 8.965 11.109 -3.772 199 HA ARG 688 HA ARG 688 8.394 12.358 -6.289 200 HB2 ARG 688 HB2 ARG 688 7.557 9.935 -4.841 201 HB3 ARG 688 HB3 ARG 688 6.299 10.627 -5.857 202 HG2 ARG 688 HG2 ARG 688 7.319 9.400 -7.495 203 HG3 ARG 688 HG3 ARG 688 8.404 10.787 -7.561 204 HD2 ARG 688 HD2 ARG 688 10.125 9.654 -6.563 205 HD3 ARG 688 HD3 ARG 688 9.054 8.763 -5.502 206 HE ARG 688 HE ARG 688 9.315 7.026 -6.989 207 HH11 ARG 688 HH21 ARG 688 9.443 9.997 -8.770 208 HH12 ARG 688 HH22 ARG 688 9.492 9.199 -10.302 209 HH21 ARG 688 HH11 ARG 688 9.418 6.040 -8.925 210 HH22 ARG 688 HH12 ARG 688 9.440 6.960 -10.421 211 H SER 689 H SER 689 6.049 12.850 -6.917 212 HA SER 689 HA SER 689 5.112 15.018 -5.325 213 HB2 SER 689 HB2 SER 689 4.822 14.974 -7.753 214 HB3 SER 689 HB3 SER 689 3.766 13.569 -7.617 215 HG SER 689 HG SER 689 2.210 14.922 -7.231 216 H ASP 690 H ASP 690 2.622 15.147 -4.910 217 HA ASP 690 HA ASP 690 2.028 13.264 -2.833 218 HB2 ASP 690 HB2 ASP 690 1.041 15.810 -3.714 219 HB3 ASP 690 HB3 ASP 690 -0.311 14.701 -3.510 220 H GLY 691 H GLY 691 0.567 11.603 -2.796 221 HA2 GLY 691 HA2 GLY 691 -1.256 10.323 -3.719 222 HA3 GLY 691 HA3 GLY 691 -0.838 10.940 -5.318 223 H THR 692 H THR 692 2.066 10.539 -4.278 224 HA THR 692 HA THR 692 2.570 8.107 -5.636 225 HB THR 692 HB THR 692 4.431 9.409 -3.632 226 HG1 THR 692 HG1 THR 692 4.064 11.093 -4.913 227 HG21 THR 692 HG21 THR 692 5.204 8.212 -6.257 228 HG22 THR 692 HG22 THR 692 6.119 8.300 -4.756 229 HG23 THR 692 HG23 THR 692 4.814 7.128 -4.921 230 H PHE 693 H PHE 693 2.677 6.042 -4.922 231 HA PHE 693 HA PHE 693 2.682 5.560 -2.016 232 HB2 PHE 693 HB2 PHE 693 0.752 4.147 -2.101 233 HB3 PHE 693 HB3 PHE 693 0.315 5.665 -2.882 234 HD1 PHE 693 HD2 PHE 693 1.161 2.117 -3.453 235 HD2 PHE 693 HD1 PHE 693 -0.078 5.806 -5.262 236 HE1 PHE 693 HE2 PHE 693 0.568 0.903 -5.529 237 HE2 PHE 693 HE1 PHE 693 -0.670 4.589 -7.340 238 HZ PHE 693 HZ PHE 693 -0.343 2.137 -7.474 239 H LEU 694 H LEU 694 3.029 3.276 -1.469 240 HA LEU 694 HA LEU 694 3.943 1.482 -3.515 241 HB2 LEU 694 HB2 LEU 694 6.260 1.422 -3.075 242 HB3 LEU 694 HB3 LEU 694 5.868 3.134 -3.209 243 HG LEU 694 HG LEU 694 5.517 2.969 -0.609 244 HD11 LEU 694 HD11 LEU 694 6.681 0.371 -1.308 245 HD12 LEU 694 HD12 LEU 694 7.607 1.229 -0.080 246 HD13 LEU 694 HD13 LEU 694 5.900 0.884 0.187 247 HD21 LEU 694 HD21 LEU 694 8.384 2.786 -0.991 248 HD22 LEU 694 HD22 LEU 694 7.649 3.716 -2.292 249 HD23 LEU 694 HD23 LEU 694 7.402 4.200 -0.616 250 H VAL 695 H VAL 695 4.813 -0.541 -2.614 251 HA VAL 695 HA VAL 695 3.787 -1.047 0.118 252 HB VAL 695 HB VAL 695 3.586 -2.874 -2.281 253 HG11 VAL 695 HG11 VAL 695 3.227 -3.223 0.643 254 HG12 VAL 695 HG12 VAL 695 1.951 -3.891 -0.366 255 HG13 VAL 695 HG13 VAL 695 3.616 -4.416 -0.594 256 HG21 VAL 695 HG21 VAL 695 1.941 -0.710 -1.386 257 HG22 VAL 695 HG22 VAL 695 1.623 -1.851 -2.691 258 HG23 VAL 695 HG23 VAL 695 1.083 -2.212 -1.053 259 H ARG 696 H ARG 696 5.027 -2.240 1.455 260 HA ARG 696 HA ARG 696 7.542 -3.362 0.353 261 HB2 ARG 696 HB2 ARG 696 8.545 -2.747 2.598 262 HB3 ARG 696 HB3 ARG 696 8.146 -1.393 1.541 263 HG2 ARG 696 HG2 ARG 696 6.108 -0.945 2.758 264 HG3 ARG 696 HG3 ARG 696 6.303 -2.415 3.717 265 HD2 ARG 696 HD2 ARG 696 8.249 -0.088 3.713 266 HD3 ARG 696 HD3 ARG 696 7.028 -0.365 4.952 267 HE ARG 696 HE ARG 696 9.476 -1.934 4.512 268 HH11 ARG 696 HH21 ARG 696 6.471 -1.523 6.181 269 HH12 ARG 696 HH22 ARG 696 6.853 -2.682 7.412 270 HH21 ARG 696 HH11 ARG 696 9.901 -3.469 6.039 271 HH22 ARG 696 HH12 ARG 696 8.760 -3.826 7.303 272 H GLN 697 H GLN 697 8.536 -5.051 1.734 273 HA GLN 697 HA GLN 697 6.503 -6.678 3.156 274 HB2 GLN 697 HB2 GLN 697 6.869 -7.728 1.035 275 HB3 GLN 697 HB3 GLN 697 8.611 -7.554 1.176 276 HG2 GLN 697 HG2 GLN 697 7.529 -9.874 1.714 277 HG3 GLN 697 HG3 GLN 697 8.789 -9.256 2.772 278 HE21 GLN 697 HE21 GLN 697 5.190 -9.210 2.485 279 HE22 GLN 697 HE22 GLN 697 4.927 -9.273 4.161 280 H ARG 698 H ARG 698 7.154 -6.148 5.209 281 HA ARG 698 HA ARG 698 9.131 -7.669 6.427 282 HB2 ARG 698 HB2 ARG 698 10.301 -5.432 5.152 283 HB3 ARG 698 HB3 ARG 698 10.287 -5.062 6.874 284 HG2 ARG 698 HG2 ARG 698 11.093 -7.831 6.216 285 HG3 ARG 698 HG3 ARG 698 12.203 -6.585 5.654 286 HD2 ARG 698 HD2 ARG 698 12.702 -7.441 7.973 287 HD3 ARG 698 HD3 ARG 698 12.467 -5.701 7.881 288 HE ARG 698 HE ARG 698 10.533 -7.647 9.000 289 HH11 ARG 698 HH21 ARG 698 11.580 -4.383 8.490 290 HH12 ARG 698 HH22 ARG 698 10.452 -3.719 9.620 291 HH21 ARG 698 HH11 ARG 698 9.121 -6.767 10.501 292 HH22 ARG 698 HH12 ARG 698 9.111 -5.043 10.764 293 H VAL 699 H VAL 699 7.392 -7.952 7.788 294 HA VAL 699 HA VAL 699 6.766 -5.671 9.566 295 HB VAL 699 HB VAL 699 4.932 -6.693 8.027 296 HG11 VAL 699 HG11 VAL 699 4.421 -8.860 8.287 297 HG12 VAL 699 HG12 VAL 699 5.697 -9.022 9.487 298 HG13 VAL 699 HG13 VAL 699 4.064 -8.588 9.991 299 HG21 VAL 699 HG21 VAL 699 4.848 -5.896 10.879 300 HG22 VAL 699 HG22 VAL 699 3.973 -5.242 9.498 301 HG23 VAL 699 HG23 VAL 699 3.406 -6.716 10.282 302 H LYS 700 H LYS 700 5.281 -7.776 11.241 303 HA LYS 700 HA LYS 700 7.614 -9.156 12.383 304 HB2 LYS 700 HB2 LYS 700 6.225 -8.523 14.650 305 HB3 LYS 700 HB3 LYS 700 7.648 -7.668 14.069 306 HG2 LYS 700 HG2 LYS 700 6.355 -5.814 14.053 307 HG3 LYS 700 HG3 LYS 700 5.568 -6.489 12.635 308 HD2 LYS 700 HD2 LYS 700 3.806 -6.004 14.167 309 HD3 LYS 700 HD3 LYS 700 4.036 -7.750 14.251 310 HE2 LYS 700 HE2 LYS 700 5.838 -6.796 16.130 311 HE3 LYS 700 HE3 LYS 700 4.458 -5.713 16.317 312 HZ1 LYS 700 HZ1 LYS 700 4.262 -7.709 17.698 313 HZ2 LYS 700 HZ2 LYS 700 3.013 -7.624 16.549 314 HZ3 LYS 700 HZ3 LYS 700 4.312 -8.704 16.298 315 H ASP 701 H ASP 701 4.044 -8.880 12.450 316 HA ASP 701 HA ASP 701 3.783 -11.728 12.198 317 HB2 ASP 701 HB2 ASP 701 2.437 -11.860 14.417 318 HB3 ASP 701 HB3 ASP 701 4.196 -11.933 14.486 319 H ALA 702 H ALA 702 1.681 -9.452 13.934 320 HA ALA 702 HA ALA 702 -0.670 -10.225 12.598 321 HB1 ALA 702 HB1 ALA 702 -0.691 -9.110 14.768 322 HB2 ALA 702 HB2 ALA 702 -1.663 -8.201 13.610 323 HB3 ALA 702 HB3 ALA 702 -0.049 -7.638 14.039 324 H ALA 703 H ALA 703 0.805 -10.012 10.429 325 HA ALA 703 HA ALA 703 -0.563 -8.613 8.562 326 HB1 ALA 703 HB1 ALA 703 -0.301 -6.441 9.203 327 HB2 ALA 703 HB2 ALA 703 1.211 -6.602 8.308 328 HB3 ALA 703 HB3 ALA 703 1.204 -6.763 10.063 329 H GLU 704 H GLU 704 0.662 -8.170 6.508 330 HA GLU 704 HA GLU 704 3.066 -9.919 6.380 331 HB2 GLU 704 HB2 GLU 704 0.584 -10.030 4.918 332 HB3 GLU 704 HB3 GLU 704 1.920 -9.747 3.804 333 HG2 GLU 704 HG2 GLU 704 3.140 -11.661 4.799 334 HG3 GLU 704 HG3 GLU 704 1.776 -11.960 5.872 335 H PHE 705 H PHE 705 1.692 -7.826 3.880 336 HA PHE 705 HA PHE 705 4.305 -6.537 3.565 337 HB2 PHE 705 HB2 PHE 705 1.750 -6.344 1.949 338 HB3 PHE 705 HB3 PHE 705 3.258 -5.529 1.543 339 HD1 PHE 705 HD1 PHE 705 1.636 -8.847 1.926 340 HD2 PHE 705 HD2 PHE 705 5.103 -6.706 0.583 341 HE1 PHE 705 HE1 PHE 705 2.448 -10.882 0.775 342 HE2 PHE 705 HE2 PHE 705 5.913 -8.749 -0.572 343 HZ PHE 705 HZ PHE 705 4.584 -10.836 -0.473 344 H ALA 706 H ALA 706 4.130 -4.096 2.979 345 HA ALA 706 HA ALA 706 2.185 -2.752 4.753 346 HB1 ALA 706 HB1 ALA 706 3.741 -1.820 6.080 347 HB2 ALA 706 HB2 ALA 706 4.769 -1.400 4.713 348 HB3 ALA 706 HB3 ALA 706 4.866 -3.012 5.426 349 H ILE 707 H ILE 707 1.163 -1.155 3.807 350 HA ILE 707 HA ILE 707 2.074 -0.254 1.157 351 HB ILE 707 HB ILE 707 -0.522 0.507 2.490 352 HG12 ILE 707 HG12 ILE 707 -1.326 -1.528 0.979 353 HG13 ILE 707 HG13 ILE 707 0.310 -2.108 1.284 354 HG21 ILE 707 HG21 ILE 707 -1.119 1.266 0.425 355 HG22 ILE 707 HG22 ILE 707 0.618 1.294 0.122 356 HG23 ILE 707 HG23 ILE 707 -0.346 -0.089 -0.402 357 HD11 ILE 707 HD11 ILE 707 -1.936 -2.227 3.029 358 HD12 ILE 707 HD12 ILE 707 -0.292 -2.770 3.347 359 HD13 ILE 707 HD13 ILE 707 -0.772 -1.123 3.746 360 H SER 708 H SER 708 2.870 1.716 0.792 361 HA SER 708 HA SER 708 2.653 3.716 2.959 362 HB2 SER 708 HB2 SER 708 5.021 3.123 1.182 363 HB3 SER 708 HB3 SER 708 4.907 4.536 2.225 364 HG SER 708 HG SER 708 4.860 1.787 2.976 365 H ILE 709 H ILE 709 1.801 5.653 2.353 366 HA ILE 709 HA ILE 709 1.635 6.226 -0.556 367 HB ILE 709 HB ILE 709 -0.571 7.270 1.091 368 HG12 ILE 709 HG12 ILE 709 -1.685 4.891 0.728 369 HG13 ILE 709 HG13 ILE 709 -0.019 4.331 0.880 370 HG21 ILE 709 HG21 ILE 709 -0.083 7.077 -1.552 371 HG22 ILE 709 HG22 ILE 709 -0.988 5.581 -1.315 372 HG23 ILE 709 HG23 ILE 709 -1.712 7.128 -0.882 373 HD11 ILE 709 HD11 ILE 709 0.131 5.718 3.004 374 HD12 ILE 709 HD12 ILE 709 -1.609 5.957 2.880 375 HD13 ILE 709 HD13 ILE 709 -0.953 4.333 3.096 376 H LYS 710 H LYS 710 1.939 8.265 -1.224 377 HA LYS 710 HA LYS 710 2.848 10.233 0.761 378 HB2 LYS 710 HB2 LYS 710 4.371 9.920 -1.075 379 HB3 LYS 710 HB3 LYS 710 3.068 10.078 -2.248 380 HG2 LYS 710 HG2 LYS 710 4.137 12.185 -2.278 381 HG3 LYS 710 HG3 LYS 710 2.702 12.433 -1.290 382 HD2 LYS 710 HD2 LYS 710 3.908 12.613 0.672 383 HD3 LYS 710 HD3 LYS 710 5.246 11.620 0.079 384 HE2 LYS 710 HE2 LYS 710 4.586 14.365 -1.015 385 HE3 LYS 710 HE3 LYS 710 5.779 14.083 0.255 386 HZ1 LYS 710 HZ1 LYS 710 5.999 13.606 -2.591 387 HZ2 LYS 710 HZ2 LYS 710 7.230 13.721 -1.410 388 HZ3 LYS 710 HZ3 LYS 710 6.420 12.232 -1.666 389 H TYR 711 H TYR 711 1.120 11.270 1.600 390 HA TYR 711 HA TYR 711 -0.558 12.812 -0.252 391 HB2 TYR 711 HB2 TYR 711 -1.996 10.956 0.095 392 HB3 TYR 711 HB3 TYR 711 -1.594 10.865 1.809 393 HD1 TYR 711 HD1 TYR 711 -2.829 13.472 -0.610 394 HD2 TYR 711 HD2 TYR 711 -3.202 11.670 3.270 395 HE1 TYR 711 HE1 TYR 711 -4.689 15.023 -0.064 396 HE2 TYR 711 HE2 TYR 711 -5.062 13.212 3.813 397 HH TYR 711 HH TYR 711 -6.761 14.568 2.514 398 H ASN 712 H ASN 712 -0.199 14.827 0.339 399 HA ASN 712 HA ASN 712 -0.389 16.713 1.713 400 HB2 ASN 712 HB2 ASN 712 -1.825 15.299 3.271 401 HB3 ASN 712 HB3 ASN 712 -0.341 14.878 4.114 402 HD21 ASN 712 HD21 ASN 712 0.283 16.263 5.761 403 HD22 ASN 712 HD22 ASN 712 -0.304 17.854 5.946 404 H VAL 713 H VAL 713 1.919 15.973 0.585 405 HA VAL 713 HA VAL 713 4.216 15.938 0.744 406 HB VAL 713 HB VAL 713 5.174 17.786 1.974 407 HG11 VAL 713 HG11 VAL 713 2.739 18.048 0.355 408 HG12 VAL 713 HG12 VAL 713 3.049 19.454 1.372 409 HG13 VAL 713 HG13 VAL 713 4.274 18.910 0.227 410 HG21 VAL 713 HG21 VAL 713 3.747 17.325 4.073 411 HG22 VAL 713 HG22 VAL 713 4.033 19.014 3.661 412 HG23 VAL 713 HG23 VAL 713 2.486 18.264 3.277 413 H GLU 714 H GLU 714 2.931 13.901 2.218 414 HA GLU 714 HA GLU 714 5.093 13.174 4.017 415 HB2 GLU 714 HB2 GLU 714 3.599 12.617 5.888 416 HB3 GLU 714 HB3 GLU 714 3.506 14.342 5.512 417 HG2 GLU 714 HG2 GLU 714 1.514 13.683 3.993 418 HG3 GLU 714 HG3 GLU 714 1.508 12.169 4.891 419 H VAL 715 H VAL 715 5.036 10.890 4.548 420 HA VAL 715 HA VAL 715 3.411 9.352 2.621 421 HB VAL 715 HB VAL 715 6.114 8.601 3.711 422 HG11 VAL 715 HG11 VAL 715 4.850 6.667 3.024 423 HG12 VAL 715 HG12 VAL 715 4.298 7.480 1.560 424 HG13 VAL 715 HG13 VAL 715 5.989 7.020 1.728 425 HG21 VAL 715 HG21 VAL 715 5.298 9.883 1.087 426 HG22 VAL 715 HG22 VAL 715 6.341 10.587 2.321 427 HG23 VAL 715 HG23 VAL 715 6.890 9.194 1.392 428 H LYS 716 H LYS 716 1.824 8.318 3.622 429 HA LYS 716 HA LYS 716 2.075 7.476 6.412 430 HB2 LYS 716 HB2 LYS 716 -0.273 6.662 4.754 431 HB3 LYS 716 HB3 LYS 716 -0.238 7.266 6.401 432 HG2 LYS 716 HG2 LYS 716 0.718 9.427 5.007 433 HG3 LYS 716 HG3 LYS 716 -0.451 8.753 3.873 434 HD2 LYS 716 HD2 LYS 716 -2.235 8.989 5.392 435 HD3 LYS 716 HD3 LYS 716 -1.151 9.148 6.775 436 HE2 LYS 716 HE2 LYS 716 -0.452 11.233 4.994 437 HE3 LYS 716 HE3 LYS 716 -2.215 11.223 5.076 438 HZ1 LYS 716 HZ1 LYS 716 -2.203 11.890 7.188 439 HZ2 LYS 716 HZ2 LYS 716 -0.945 10.845 7.622 440 HZ3 LYS 716 HZ3 LYS 716 -0.562 12.359 6.917 441 H HIS 717 H HIS 717 2.107 5.342 7.122 442 HA HIS 717 HA HIS 717 2.568 3.262 5.054 443 HB2 HIS 717 HB2 HIS 717 3.924 3.372 7.750 444 HB3 HIS 717 HB3 HIS 717 4.273 2.276 6.415 445 HD1 HIS 717 HD1 HIS 717 5.280 3.446 4.176 446 HD2 HIS 717 HD2 HIS 717 5.347 5.739 7.686 447 HE1 HIS 717 HE1 HIS 717 6.992 5.305 3.823 448 HE2 HIS 717 HE2 HIS 717 7.089 6.676 5.972 449 H ILE 718 H ILE 718 1.407 1.448 5.262 450 HA ILE 718 HA ILE 718 0.155 0.852 7.874 451 HB ILE 718 HB ILE 718 -1.339 0.715 5.244 452 HG12 ILE 718 HG12 ILE 718 -2.357 2.580 7.252 453 HG13 ILE 718 HG13 ILE 718 -0.741 3.026 6.712 454 HG21 ILE 718 HG21 ILE 718 -3.145 0.753 7.344 455 HG22 ILE 718 HG22 ILE 718 -2.618 -0.690 6.478 456 HG23 ILE 718 HG23 ILE 718 -1.826 -0.227 7.985 457 HD11 ILE 718 HD11 ILE 718 -1.682 2.574 4.319 458 HD12 ILE 718 HD12 ILE 718 -3.257 2.744 5.096 459 HD13 ILE 718 HD13 ILE 718 -2.109 4.080 5.130 460 H LYS 719 H LYS 719 0.285 -1.242 8.414 461 HA LYS 719 HA LYS 719 1.662 -3.064 6.645 462 HB2 LYS 719 HB2 LYS 719 1.615 -4.609 8.536 463 HB3 LYS 719 HB3 LYS 719 2.147 -3.015 9.072 464 HG2 LYS 719 HG2 LYS 719 -0.376 -2.602 9.598 465 HG3 LYS 719 HG3 LYS 719 -0.519 -4.358 9.519 466 HD2 LYS 719 HD2 LYS 719 1.202 -4.609 11.243 467 HD3 LYS 719 HD3 LYS 719 1.436 -2.863 11.287 468 HE2 LYS 719 HE2 LYS 719 -1.334 -3.260 11.627 469 HE3 LYS 719 HE3 LYS 719 -0.547 -4.456 12.659 470 HZ1 LYS 719 HZ1 LYS 719 0.447 -1.669 12.637 471 HZ2 LYS 719 HZ2 LYS 719 -0.968 -2.073 13.553 472 HZ3 LYS 719 HZ3 LYS 719 0.528 -2.844 13.873 473 H ILE 720 H ILE 720 0.791 -4.606 5.401 474 HA ILE 720 HA ILE 720 -2.109 -4.726 5.175 475 HB ILE 720 HB ILE 720 0.091 -5.130 3.432 476 HG12 ILE 720 HG12 ILE 720 -2.734 -5.748 2.643 477 HG13 ILE 720 HG13 ILE 720 -2.343 -4.121 3.198 478 HG21 ILE 720 HG21 ILE 720 -0.373 -7.269 2.404 479 HG22 ILE 720 HG22 ILE 720 -0.078 -7.553 4.118 480 HG23 ILE 720 HG23 ILE 720 -1.727 -7.557 3.493 481 HD11 ILE 720 HD11 ILE 720 -1.498 -5.530 0.725 482 HD12 ILE 720 HD12 ILE 720 -1.809 -3.815 0.991 483 HD13 ILE 720 HD13 ILE 720 -0.276 -4.523 1.504 484 H MET 721 H MET 721 -3.409 -6.471 5.563 485 HA MET 721 HA MET 721 -2.310 -8.522 7.368 486 HB2 MET 721 HB2 MET 721 -4.517 -7.095 7.699 487 HB3 MET 721 HB3 MET 721 -5.211 -8.338 6.661 488 HG2 MET 721 HG2 MET 721 -5.360 -8.818 9.147 489 HG3 MET 721 HG3 MET 721 -4.601 -10.087 8.190 490 HE1 MET 721 HE1 MET 721 -3.025 -7.905 11.724 491 HE2 MET 721 HE2 MET 721 -4.050 -7.036 10.585 492 HE3 MET 721 HE3 MET 721 -4.606 -8.556 11.297 493 H THR 722 H THR 722 -3.104 -10.749 7.078 494 HA THR 722 HA THR 722 -3.306 -11.458 4.212 495 HB THR 722 HB THR 722 -1.051 -11.814 5.242 496 HG1 THR 722 HG1 THR 722 -0.790 -13.640 4.176 497 HG21 THR 722 HG21 THR 722 -0.767 -12.945 7.161 498 HG22 THR 722 HG22 THR 722 -2.501 -12.738 7.399 499 HG23 THR 722 HG23 THR 722 -1.882 -14.223 6.674 500 H ALA 723 H ALA 723 -5.586 -11.104 5.638 501 HA ALA 723 HA ALA 723 -6.627 -13.268 7.076 502 HB1 ALA 723 HB1 ALA 723 -8.426 -11.930 7.148 503 HB2 ALA 723 HB2 ALA 723 -8.643 -12.043 5.401 504 HB3 ALA 723 HB3 ALA 723 -7.572 -10.817 6.079 505 H GLU 724 H GLU 724 -6.853 -15.316 6.467 506 HA GLU 724 HA GLU 724 -7.004 -17.180 5.110 507 HB2 GLU 724 HB2 GLU 724 -9.094 -15.668 3.565 508 HB3 GLU 724 HB3 GLU 724 -9.079 -17.365 4.043 509 HG2 GLU 724 HG2 GLU 724 -9.685 -14.939 5.722 510 HG3 GLU 724 HG3 GLU 724 -10.622 -16.418 5.544 511 H GLY 725 H GLY 725 -5.186 -14.969 4.226 512 HA2 GLY 725 HA2 GLY 725 -3.599 -15.067 2.471 513 HA3 GLY 725 HA3 GLY 725 -4.764 -15.947 1.489 514 H LEU 726 H LEU 726 -6.547 -13.514 2.772 515 HA LEU 726 HA LEU 726 -6.323 -11.935 0.317 516 HB2 LEU 726 HB2 LEU 726 -8.202 -11.462 2.641 517 HB3 LEU 726 HB3 LEU 726 -8.354 -10.863 0.992 518 HG LEU 726 HG LEU 726 -8.367 -13.798 1.723 519 HD11 LEU 726 HD11 LEU 726 -10.874 -13.366 0.924 520 HD12 LEU 726 HD12 LEU 726 -10.399 -13.158 2.609 521 HD13 LEU 726 HD13 LEU 726 -10.536 -11.752 1.552 522 HD21 LEU 726 HD21 LEU 726 -8.785 -12.206 -0.809 523 HD22 LEU 726 HD22 LEU 726 -7.719 -13.587 -0.543 524 HD23 LEU 726 HD23 LEU 726 -9.465 -13.824 -0.634 525 H TYR 727 H TYR 727 -5.544 -9.890 0.179 526 HA TYR 727 HA TYR 727 -4.122 -8.881 2.531 527 HB2 TYR 727 HB2 TYR 727 -3.962 -8.231 -0.409 528 HB3 TYR 727 HB3 TYR 727 -3.108 -7.308 0.823 529 HD1 TYR 727 HD2 TYR 727 -3.247 -10.521 2.161 530 HD2 TYR 727 HD1 TYR 727 -1.322 -8.341 -0.992 531 HE1 TYR 727 HE2 TYR 727 -1.408 -12.179 2.130 532 HE2 TYR 727 HE1 TYR 727 0.514 -9.989 -1.022 533 HH TYR 727 HH TYR 727 1.067 -12.181 1.445 534 H ARG 728 H ARG 728 -4.535 -6.994 3.487 535 HA ARG 728 HA ARG 728 -6.534 -5.164 2.384 536 HB2 ARG 728 HB2 ARG 728 -7.554 -5.217 4.827 537 HB3 ARG 728 HB3 ARG 728 -8.097 -6.361 3.613 538 HG2 ARG 728 HG2 ARG 728 -6.324 -7.965 4.477 539 HG3 ARG 728 HG3 ARG 728 -6.071 -6.834 5.801 540 HD2 ARG 728 HD2 ARG 728 -8.871 -7.250 5.617 541 HD3 ARG 728 HD3 ARG 728 -8.116 -8.839 5.507 542 HE ARG 728 HE ARG 728 -7.050 -7.201 7.657 543 HH11 ARG 728 HH21 ARG 728 -9.520 -9.420 6.701 544 HH12 ARG 728 HH22 ARG 728 -9.859 -9.935 8.312 545 HH21 ARG 728 HH11 ARG 728 -7.491 -7.846 9.744 546 HH22 ARG 728 HH12 ARG 728 -8.726 -9.053 10.030 547 H ILE 729 H ILE 729 -6.274 -3.081 3.081 548 HA ILE 729 HA ILE 729 -3.832 -2.506 4.594 549 HB ILE 729 HB ILE 729 -5.678 -0.468 3.383 550 HG12 ILE 729 HG12 ILE 729 -3.570 -2.135 1.984 551 HG13 ILE 729 HG13 ILE 729 -5.285 -2.029 1.586 552 HG21 ILE 729 HG21 ILE 729 -4.054 0.666 4.564 553 HG22 ILE 729 HG22 ILE 729 -2.847 -0.599 4.330 554 HG23 ILE 729 HG23 ILE 729 -3.234 0.504 3.011 555 HD11 ILE 729 HD11 ILE 729 -4.432 -0.533 0.043 556 HD12 ILE 729 HD12 ILE 729 -4.721 0.560 1.397 557 HD13 ILE 729 HD13 ILE 729 -3.097 -0.055 1.092 558 H THR 730 H THR 730 -7.285 -2.223 4.806 559 HA THR 730 HA THR 730 -7.028 -0.911 7.454 560 HB THR 730 HB THR 730 -8.096 0.410 5.645 561 HG1 THR 730 HG1 THR 730 -9.501 1.216 7.002 562 HG21 THR 730 HG21 THR 730 -10.633 -0.697 5.449 563 HG22 THR 730 HG22 THR 730 -9.389 -0.724 4.201 564 HG23 THR 730 HG23 THR 730 -9.554 -2.083 5.311 565 H GLU 731 H GLU 731 -7.637 -3.779 5.995 566 HA GLU 731 HA GLU 731 -8.402 -5.782 6.794 567 HB2 GLU 731 HB2 GLU 731 -9.292 -4.350 9.294 568 HB3 GLU 731 HB3 GLU 731 -8.908 -6.061 9.100 569 HG2 GLU 731 HG2 GLU 731 -6.585 -4.953 8.231 570 HG3 GLU 731 HG3 GLU 731 -7.084 -3.733 9.401 571 H LYS 732 H LYS 732 -10.360 -2.952 6.842 572 HA LYS 732 HA LYS 732 -12.901 -4.188 7.115 573 HB2 LYS 732 HB2 LYS 732 -12.432 -1.637 5.600 574 HB3 LYS 732 HB3 LYS 732 -13.798 -2.076 6.626 575 HG2 LYS 732 HG2 LYS 732 -10.976 -1.436 7.533 576 HG3 LYS 732 HG3 LYS 732 -12.416 -0.469 7.819 577 HD2 LYS 732 HD2 LYS 732 -12.567 -3.286 8.756 578 HD3 LYS 732 HD3 LYS 732 -11.428 -2.258 9.618 579 HE2 LYS 732 HE2 LYS 732 -14.121 -1.120 9.065 580 HE3 LYS 732 HE3 LYS 732 -14.017 -2.389 10.288 581 HZ1 LYS 732 HZ1 LYS 732 -13.493 0.223 10.730 582 HZ2 LYS 732 HZ2 LYS 732 -12.927 -1.061 11.719 583 HZ3 LYS 732 HZ3 LYS 732 -11.922 -0.402 10.488 584 H LYS 733 H LYS 733 -10.851 -3.424 4.330 585 HA LYS 733 HA LYS 733 -12.594 -5.140 2.678 586 HB2 LYS 733 HB2 LYS 733 -13.259 -2.948 2.025 587 HB3 LYS 733 HB3 LYS 733 -11.590 -2.379 1.976 588 HG2 LYS 733 HG2 LYS 733 -12.594 -2.871 -0.299 589 HG3 LYS 733 HG3 LYS 733 -11.102 -3.748 0.041 590 HD2 LYS 733 HD2 LYS 733 -12.288 -5.780 0.505 591 HD3 LYS 733 HD3 LYS 733 -13.837 -4.941 0.572 592 HE2 LYS 733 HE2 LYS 733 -14.125 -5.332 -1.623 593 HE3 LYS 733 HE3 LYS 733 -12.693 -4.362 -1.967 594 HZ1 LYS 733 HZ1 LYS 733 -11.954 -6.316 -2.797 595 HZ2 LYS 733 HZ2 LYS 733 -11.536 -6.632 -1.170 596 HZ3 LYS 733 HZ3 LYS 733 -12.981 -7.258 -1.827 597 H ALA 734 H ALA 734 -11.287 -6.851 2.398 598 HA ALA 734 HA ALA 734 -8.458 -6.463 1.715 599 HB1 ALA 734 HB1 ALA 734 -9.759 -8.342 3.283 600 HB2 ALA 734 HB2 ALA 734 -8.116 -8.488 2.662 601 HB3 ALA 734 HB3 ALA 734 -9.457 -9.220 1.783 602 H PHE 735 H PHE 735 -7.735 -8.305 0.075 603 HA PHE 735 HA PHE 735 -9.604 -8.603 -2.159 604 HB2 PHE 735 HB2 PHE 735 -7.311 -6.746 -2.144 605 HB3 PHE 735 HB3 PHE 735 -7.396 -7.806 -3.550 606 HD1 PHE 735 HD2 PHE 735 -9.475 -7.860 -4.954 607 HD2 PHE 735 HD1 PHE 735 -8.905 -4.989 -1.811 608 HE1 PHE 735 HE2 PHE 735 -11.307 -6.474 -5.886 609 HE2 PHE 735 HE1 PHE 735 -10.736 -3.605 -2.744 610 HZ PHE 735 HZ PHE 735 -11.939 -4.347 -4.781 611 H ARG 736 H ARG 736 -8.316 -9.775 -4.026 612 HA ARG 736 HA ARG 736 -7.674 -12.338 -3.175 613 HB2 ARG 736 HB2 ARG 736 -7.185 -10.784 -5.675 614 HB3 ARG 736 HB3 ARG 736 -6.360 -12.325 -5.483 615 HG2 ARG 736 HG2 ARG 736 -8.372 -12.917 -6.546 616 HG3 ARG 736 HG3 ARG 736 -8.694 -13.262 -4.847 617 HD2 ARG 736 HD2 ARG 736 -10.113 -11.442 -4.603 618 HD3 ARG 736 HD3 ARG 736 -9.336 -10.525 -5.888 619 HE ARG 736 HE ARG 736 -11.420 -12.546 -6.202 620 HH11 ARG 736 HH21 ARG 736 -9.018 -10.506 -7.702 621 HH12 ARG 736 HH22 ARG 736 -9.719 -10.701 -9.283 622 HH21 ARG 736 HH11 ARG 736 -12.281 -12.739 -8.249 623 HH22 ARG 736 HH12 ARG 736 -11.543 -11.929 -9.584 624 H GLY 737 H GLY 737 -5.410 -9.789 -4.190 625 HA2 GLY 737 HA2 GLY 737 -3.388 -10.890 -2.373 626 HA3 GLY 737 HA3 GLY 737 -2.975 -10.738 -4.081 627 H LEU 738 H LEU 738 -1.299 -9.280 -3.389 628 HA LEU 738 HA LEU 738 -1.964 -6.795 -2.112 629 HB2 LEU 738 HB2 LEU 738 0.407 -8.194 -2.748 630 HB3 LEU 738 HB3 LEU 738 0.500 -6.654 -3.605 631 HG LEU 738 HG LEU 738 -0.162 -6.940 -0.658 632 HD11 LEU 738 HD11 LEU 738 2.384 -5.972 -1.978 633 HD12 LEU 738 HD12 LEU 738 2.071 -6.088 -0.250 634 HD13 LEU 738 HD13 LEU 738 2.189 -7.553 -1.218 635 HD21 LEU 738 HD21 LEU 738 0.028 -4.537 -0.612 636 HD22 LEU 738 HD22 LEU 738 0.533 -4.498 -2.300 637 HD23 LEU 738 HD23 LEU 738 -1.112 -4.965 -1.880 638 H THR 739 H THR 739 -0.967 -7.627 -5.427 639 HA THR 739 HA THR 739 -1.261 -5.172 -6.641 640 HB THR 739 HB THR 739 -2.148 -7.812 -7.832 641 HG1 THR 739 HG1 THR 739 -0.138 -8.334 -7.651 642 HG21 THR 739 HG21 THR 739 -1.136 -5.236 -9.064 643 HG22 THR 739 HG22 THR 739 -1.445 -6.727 -9.953 644 HG23 THR 739 HG23 THR 739 -2.775 -5.874 -9.174 645 H GLU 740 H GLU 740 -3.779 -7.684 -6.320 646 HA GLU 740 HA GLU 740 -5.901 -6.114 -7.322 647 HB2 GLU 740 HB2 GLU 740 -6.146 -8.319 -5.270 648 HB3 GLU 740 HB3 GLU 740 -7.363 -7.789 -6.429 649 HG2 GLU 740 HG2 GLU 740 -5.210 -8.382 -8.064 650 HG3 GLU 740 HG3 GLU 740 -5.078 -9.612 -6.811 651 H LEU 741 H LEU 741 -4.512 -6.399 -4.128 652 HA LEU 741 HA LEU 741 -6.609 -4.941 -2.807 653 HB2 LEU 741 HB2 LEU 741 -5.209 -6.625 -1.663 654 HB3 LEU 741 HB3 LEU 741 -3.791 -5.618 -1.920 655 HG LEU 741 HG LEU 741 -4.965 -5.506 0.374 656 HD11 LEU 741 HD11 LEU 741 -4.872 -2.736 -0.479 657 HD12 LEU 741 HD12 LEU 741 -3.793 -3.617 0.601 658 HD13 LEU 741 HD13 LEU 741 -3.524 -3.661 -1.137 659 HD21 LEU 741 HD21 LEU 741 -6.818 -3.688 -1.186 660 HD22 LEU 741 HD22 LEU 741 -7.262 -5.295 -0.617 661 HD23 LEU 741 HD23 LEU 741 -6.873 -4.026 0.541 662 H VAL 742 H VAL 742 -3.410 -4.181 -4.136 663 HA VAL 742 HA VAL 742 -3.616 -1.388 -3.276 664 HB VAL 742 HB VAL 742 -1.512 -3.101 -4.499 665 HG11 VAL 742 HG11 VAL 742 -1.496 -1.321 -6.120 666 HG12 VAL 742 HG12 VAL 742 -1.684 -0.100 -4.860 667 HG13 VAL 742 HG13 VAL 742 -0.180 -1.008 -4.991 668 HG21 VAL 742 HG21 VAL 742 -1.961 -1.371 -2.142 669 HG22 VAL 742 HG22 VAL 742 -0.984 -2.831 -2.298 670 HG23 VAL 742 HG23 VAL 742 -0.342 -1.279 -2.830 671 H GLU 743 H GLU 743 -4.121 -3.271 -6.200 672 HA GLU 743 HA GLU 743 -4.246 -0.922 -7.887 673 HB2 GLU 743 HB2 GLU 743 -4.999 -3.811 -8.378 674 HB3 GLU 743 HB3 GLU 743 -5.128 -2.545 -9.597 675 HG2 GLU 743 HG2 GLU 743 -2.567 -3.299 -8.150 676 HG3 GLU 743 HG3 GLU 743 -2.989 -3.814 -9.778 677 H PHE 744 H PHE 744 -6.167 -1.800 -5.490 678 HA PHE 744 HA PHE 744 -8.642 -1.013 -6.908 679 HB2 PHE 744 HB2 PHE 744 -8.590 -3.303 -5.775 680 HB3 PHE 744 HB3 PHE 744 -8.545 -2.430 -4.243 681 HD1 PHE 744 HD2 PHE 744 -10.530 -3.040 -7.313 682 HD2 PHE 744 HD1 PHE 744 -10.481 -1.256 -3.404 683 HE1 PHE 744 HE2 PHE 744 -12.980 -2.692 -7.439 684 HE2 PHE 744 HE1 PHE 744 -12.934 -0.911 -3.531 685 HZ PHE 744 HZ PHE 744 -14.182 -1.629 -5.549 686 H TYR 745 H TYR 745 -6.710 -0.582 -3.963 687 HA TYR 745 HA TYR 745 -8.376 1.440 -2.842 688 HB2 TYR 745 HB2 TYR 745 -5.560 0.528 -2.347 689 HB3 TYR 745 HB3 TYR 745 -6.147 2.017 -1.607 690 HD1 TYR 745 HD1 TYR 745 -7.511 -1.427 -2.260 691 HD2 TYR 745 HD2 TYR 745 -6.973 1.770 0.578 692 HE1 TYR 745 HE1 TYR 745 -8.686 -2.758 -0.523 693 HE2 TYR 745 HE2 TYR 745 -8.138 0.423 2.300 694 HH TYR 745 HH TYR 745 -9.201 -2.916 1.665 695 H GLN 746 H GLN 746 -6.469 1.441 -5.584 696 HA GLN 746 HA GLN 746 -5.463 4.125 -5.527 697 HB2 GLN 746 HB2 GLN 746 -5.324 3.743 -8.061 698 HB3 GLN 746 HB3 GLN 746 -4.384 2.648 -7.044 699 HG2 GLN 746 HG2 GLN 746 -5.644 0.844 -7.598 700 HG3 GLN 746 HG3 GLN 746 -7.150 1.753 -7.557 701 HE21 GLN 746 HE21 GLN 746 -4.699 0.466 -9.652 702 HE22 GLN 746 HE22 GLN 746 -5.312 1.121 -11.092 703 H GLN 747 H GLN 747 -8.516 2.705 -6.023 704 HA GLN 747 HA GLN 747 -9.603 5.175 -7.237 705 HB2 GLN 747 HB2 GLN 747 -11.147 2.608 -7.015 706 HB3 GLN 747 HB3 GLN 747 -11.304 3.902 -8.202 707 HG2 GLN 747 HG2 GLN 747 -8.649 2.888 -8.414 708 HG3 GLN 747 HG3 GLN 747 -9.731 1.500 -8.374 709 HE21 GLN 747 HE21 GLN 747 -8.161 2.796 -10.662 710 HE22 GLN 747 HE22 GLN 747 -9.345 3.068 -11.860 711 H ASN 748 H ASN 748 -10.012 2.818 -4.636 712 HA ASN 748 HA ASN 748 -12.281 4.068 -3.454 713 HB2 ASN 748 HB2 ASN 748 -11.958 1.825 -2.828 714 HB3 ASN 748 HB3 ASN 748 -10.245 2.069 -2.502 715 HD21 ASN 748 HD21 ASN 748 -13.501 2.672 -1.206 716 HD22 ASN 748 HD22 ASN 748 -12.986 2.988 0.390 717 H SER 749 H SER 749 -12.387 5.886 -2.286 718 HA SER 749 HA SER 749 -10.160 7.553 -1.818 719 HB2 SER 749 HB2 SER 749 -11.658 9.002 -0.693 720 HB3 SER 749 HB3 SER 749 -12.609 8.221 -1.950 721 HG SER 749 HG SER 749 -12.459 6.912 0.509 722 H LEU 750 H LEU 750 -8.530 6.910 -0.572 723 HA LEU 750 HA LEU 750 -8.435 5.110 1.479 724 HB2 LEU 750 HB2 LEU 750 -6.912 7.717 1.285 725 HB3 LEU 750 HB3 LEU 750 -6.476 6.381 2.351 726 HG LEU 750 HG LEU 750 -6.592 6.353 -0.667 727 HD11 LEU 750 HD11 LEU 750 -4.148 5.373 0.221 728 HD12 LEU 750 HD12 LEU 750 -4.444 6.988 -0.419 729 HD13 LEU 750 HD13 LEU 750 -4.491 6.706 1.321 730 HD21 LEU 750 HD21 LEU 750 -7.335 4.197 -0.182 731 HD22 LEU 750 HD22 LEU 750 -5.588 3.966 -0.195 732 HD23 LEU 750 HD23 LEU 750 -6.442 4.129 1.338 733 H LYS 751 H LYS 751 -9.611 8.419 1.656 734 HA LYS 751 HA LYS 751 -9.679 8.771 4.424 735 HB2 LYS 751 HB2 LYS 751 -11.247 10.507 4.057 736 HB3 LYS 751 HB3 LYS 751 -10.206 10.485 2.637 737 HG2 LYS 751 HG2 LYS 751 -12.081 8.803 1.743 738 HG3 LYS 751 HG3 LYS 751 -13.076 9.694 2.895 739 HD2 LYS 751 HD2 LYS 751 -11.404 10.931 0.679 740 HD3 LYS 751 HD3 LYS 751 -13.159 10.751 0.662 741 HE2 LYS 751 HE2 LYS 751 -13.354 12.209 2.627 742 HE3 LYS 751 HE3 LYS 751 -11.597 12.346 2.722 743 HZ1 LYS 751 HZ1 LYS 751 -11.549 13.371 0.539 744 HZ2 LYS 751 HZ2 LYS 751 -13.254 13.214 0.410 745 HZ3 LYS 751 HZ3 LYS 751 -12.588 14.249 1.582 746 H ASP 752 H ASP 752 -11.400 6.535 2.506 747 HA ASP 752 HA ASP 752 -13.550 6.217 4.487 748 HB2 ASP 752 HB2 ASP 752 -14.644 5.806 2.555 749 HB3 ASP 752 HB3 ASP 752 -13.151 5.531 1.668 750 H CYS 753 H CYS 753 -10.966 4.283 2.978 751 HA CYS 753 HA CYS 753 -11.287 2.113 4.860 752 HB2 CYS 753 HB2 CYS 753 -9.152 2.670 2.790 753 HB3 CYS 753 HB3 CYS 753 -9.292 1.179 3.719 754 HG CYS 753 HG CYS 753 -11.665 2.096 1.902 755 H PHE 754 H PHE 754 -8.935 4.733 4.320 756 HA PHE 754 HA PHE 754 -7.294 3.860 6.555 757 HB2 PHE 754 HB2 PHE 754 -7.186 6.274 4.737 758 HB3 PHE 754 HB3 PHE 754 -6.034 5.991 6.032 759 HD1 PHE 754 HD2 PHE 754 -7.313 2.961 4.489 760 HD2 PHE 754 HD1 PHE 754 -4.297 6.012 4.138 761 HE1 PHE 754 HE2 PHE 754 -6.017 1.510 2.970 762 HE2 PHE 754 HE1 PHE 754 -3.019 4.551 2.611 763 HZ PHE 754 HZ PHE 754 -3.868 2.304 2.028 764 H LYS 755 H LYS 755 -7.612 7.270 6.472 765 HA LYS 755 HA LYS 755 -9.688 7.450 8.497 766 HB2 LYS 755 HB2 LYS 755 -7.776 6.661 9.804 767 HB3 LYS 755 HB3 LYS 755 -6.817 8.019 9.226 768 HG2 LYS 755 HG2 LYS 755 -8.312 9.603 10.331 769 HG3 LYS 755 HG3 LYS 755 -9.410 8.297 10.780 770 HD2 LYS 755 HD2 LYS 755 -8.243 8.119 12.696 771 HD3 LYS 755 HD3 LYS 755 -6.935 7.445 11.731 772 HE2 LYS 755 HE2 LYS 755 -7.309 10.307 12.631 773 HE3 LYS 755 HE3 LYS 755 -5.937 9.240 12.930 774 HZ1 LYS 755 HZ1 LYS 755 -5.042 10.309 11.178 775 HZ2 LYS 755 HZ2 LYS 755 -6.017 9.289 10.243 776 HZ3 LYS 755 HZ3 LYS 755 -6.559 10.868 10.595 777 H SER 756 H SER 756 -7.244 9.748 8.900 778 HA SER 756 HA SER 756 -8.899 11.856 7.903 779 HB2 SER 756 HB2 SER 756 -6.003 12.171 8.661 780 HB3 SER 756 HB3 SER 756 -7.326 13.317 8.861 781 HG SER 756 HG SER 756 -7.927 12.323 10.652 782 H LEU 757 H LEU 757 -7.679 9.759 6.062 783 HA LEU 757 HA LEU 757 -5.848 11.152 4.345 784 HB2 LEU 757 HB2 LEU 757 -7.352 8.561 4.267 785 HB3 LEU 757 HB3 LEU 757 -6.669 9.185 2.771 786 HG LEU 757 HG LEU 757 -5.259 7.591 4.342 787 HD11 LEU 757 HD11 LEU 757 -3.196 8.737 3.515 788 HD12 LEU 757 HD12 LEU 757 -4.416 8.454 2.275 789 HD13 LEU 757 HD13 LEU 757 -4.224 10.060 2.970 790 HD21 LEU 757 HD21 LEU 757 -5.604 9.293 6.263 791 HD22 LEU 757 HD22 LEU 757 -4.002 8.608 6.026 792 HD23 LEU 757 HD23 LEU 757 -4.359 10.234 5.444 793 H ASP 758 H ASP 758 -6.521 11.123 1.896 794 HA ASP 758 HA ASP 758 -9.215 11.665 1.210 795 HB2 ASP 758 HB2 ASP 758 -8.279 13.781 2.547 796 HB3 ASP 758 HB3 ASP 758 -7.636 14.180 0.953 797 H THR 759 H THR 759 -7.390 9.992 0.190 798 HA THR 759 HA THR 759 -7.194 10.879 -2.557 799 HB THR 759 HB THR 759 -5.086 11.759 -1.586 800 HG1 THR 759 HG1 THR 759 -4.385 11.231 -3.484 801 HG21 THR 759 HG21 THR 759 -3.651 9.335 -1.221 802 HG22 THR 759 HG22 THR 759 -4.032 10.551 -0.003 803 HG23 THR 759 HG23 THR 759 -5.125 9.196 -0.265 804 H THR 760 H THR 760 -5.300 8.957 -3.311 805 HA THR 760 HA THR 760 -6.144 6.340 -2.382 806 HB THR 760 HB THR 760 -7.045 5.565 -4.486 807 HG1 THR 760 HG1 THR 760 -6.902 6.680 -6.264 808 HG21 THR 760 HG21 THR 760 -8.544 6.792 -2.833 809 HG22 THR 760 HG22 THR 760 -8.423 8.185 -3.907 810 HG23 THR 760 HG23 THR 760 -9.145 6.684 -4.485 811 H LEU 761 H LEU 761 -5.024 4.615 -3.747 812 HA LEU 761 HA LEU 761 -2.253 5.127 -3.890 813 HB2 LEU 761 HB2 LEU 761 -3.938 2.951 -5.191 814 HB3 LEU 761 HB3 LEU 761 -2.187 2.944 -5.157 815 HG LEU 761 HG LEU 761 -3.509 1.569 -3.362 816 HD11 LEU 761 HD11 LEU 761 -1.741 2.162 -1.660 817 HD12 LEU 761 HD12 LEU 761 -1.143 1.742 -3.265 818 HD13 LEU 761 HD13 LEU 761 -1.228 3.432 -2.768 819 HD21 LEU 761 HD21 LEU 761 -3.885 2.859 -1.272 820 HD22 LEU 761 HD22 LEU 761 -3.595 4.352 -2.156 821 HD23 LEU 761 HD23 LEU 761 -4.985 3.343 -2.555 822 H GLN 762 H GLN 762 -2.343 7.141 -5.023 823 HA GLN 762 HA GLN 762 -3.302 7.381 -7.670 824 HB2 GLN 762 HB2 GLN 762 -1.751 9.019 -5.736 825 HB3 GLN 762 HB3 GLN 762 -1.706 9.491 -7.414 826 HG2 GLN 762 HG2 GLN 762 -4.076 9.324 -5.572 827 HG3 GLN 762 HG3 GLN 762 -3.524 10.704 -6.512 828 HE21 GLN 762 HE21 GLN 762 -5.840 8.243 -6.454 829 HE22 GLN 762 HE22 GLN 762 -6.248 8.268 -8.107 830 H PHE 763 H PHE 763 0.065 7.643 -6.499 831 HA PHE 763 HA PHE 763 0.893 6.458 -9.084 832 HB2 PHE 763 HB2 PHE 763 2.317 8.689 -7.624 833 HB3 PHE 763 HB3 PHE 763 2.726 8.033 -9.211 834 HD1 PHE 763 HD1 PHE 763 1.130 8.329 -11.129 835 HD2 PHE 763 HD2 PHE 763 0.556 10.284 -7.347 836 HE1 PHE 763 HE1 PHE 763 -0.480 9.894 -12.180 837 HE2 PHE 763 HE2 PHE 763 -1.058 11.845 -8.397 838 HZ PHE 763 HZ PHE 763 -1.574 11.652 -10.816 839 HA PRO 764 HA PRO 764 3.390 3.753 -6.628 840 HB2 PRO 764 HB2 PRO 764 5.064 2.839 -8.554 841 HB3 PRO 764 HB3 PRO 764 3.340 2.414 -8.534 842 HG2 PRO 764 HG2 PRO 764 4.771 4.441 -10.169 843 HG3 PRO 764 HG3 PRO 764 3.483 3.329 -10.632 844 HD2 PRO 764 HD2 PRO 764 3.066 5.985 -10.041 845 HD3 PRO 764 HD3 PRO 764 1.821 4.725 -9.882 846 H PHE 765 H PHE 765 6.126 3.234 -6.977 847 HA PHE 765 HA PHE 765 7.317 5.915 -6.594 848 HB2 PHE 765 HB2 PHE 765 8.590 5.173 -4.767 849 HB3 PHE 765 HB3 PHE 765 7.004 4.461 -4.494 850 HD1 PHE 765 HD1 PHE 765 6.596 2.066 -5.116 851 HD2 PHE 765 HD2 PHE 765 10.517 3.809 -5.130 852 HE1 PHE 765 HE1 PHE 765 7.602 -0.196 -5.093 853 HE2 PHE 765 HE2 PHE 765 11.525 1.546 -5.107 854 HZ PHE 765 HZ PHE 765 10.066 -0.457 -5.088 855 H LYS 766 H LYS 766 7.561 2.769 -8.095 856 HA LYS 766 HA LYS 766 10.347 3.115 -8.825 857 HB2 LYS 766 HB2 LYS 766 8.305 1.217 -10.009 858 HB3 LYS 766 HB3 LYS 766 10.053 1.125 -10.193 859 HG2 LYS 766 HG2 LYS 766 9.748 1.257 -7.450 860 HG3 LYS 766 HG3 LYS 766 8.371 0.277 -7.933 861 HD2 LYS 766 HD2 LYS 766 10.864 -0.458 -9.300 862 HD3 LYS 766 HD3 LYS 766 10.926 -0.667 -7.553 863 HE2 LYS 766 HE2 LYS 766 9.993 -2.701 -8.098 864 HE3 LYS 766 HE3 LYS 766 8.508 -1.754 -7.994 865 HZ1 LYS 766 HZ1 LYS 766 9.835 -2.863 -10.323 866 HZ2 LYS 766 HZ2 LYS 766 8.177 -2.512 -10.079 867 HZ3 LYS 766 HZ3 LYS 766 9.267 -1.274 -10.513 868 H GLU 767 H GLU 767 7.209 3.826 -10.174 869 HA GLU 767 HA GLU 767 7.265 4.275 -12.725 870 HB2 GLU 767 HB2 GLU 767 6.097 5.675 -10.562 871 HB3 GLU 767 HB3 GLU 767 6.735 6.897 -11.658 872 HG2 GLU 767 HG2 GLU 767 5.633 5.288 -13.485 873 HG3 GLU 767 HG3 GLU 767 4.594 4.869 -12.134 874 H1 ASP 338 H1 ASP 338 2.567 5.704 17.395 875 H2 ASP 338 H2 ASP 338 1.634 6.345 18.762 876 H3 ASP 338 H3 ASP 338 2.630 5.487 17.671 877 HA ASP 338 HA ASP 338 3.815 7.916 18.699 878 HB2 ASP 338 HB2 ASP 338 3.577 5.573 20.593 879 HB3 ASP 338 HB3 ASP 338 4.098 7.222 20.941 880 H THR 339 H THR 339 3.990 4.334 18.823 881 HA THR 339 HA THR 339 6.794 4.171 18.641 882 HB THR 339 HB THR 339 5.739 1.854 17.446 883 HG1 THR 339 HG1 THR 339 3.912 1.425 18.542 884 HG21 THR 339 HG21 THR 339 6.197 0.882 19.670 885 HG22 THR 339 HG22 THR 339 7.499 1.951 19.155 886 HG23 THR 339 HG23 THR 339 6.323 2.506 20.347 887 H GLU 340 H GLU 340 8.203 4.165 16.992 888 HA GLU 340 HA GLU 340 7.458 5.243 14.473 889 HB2 GLU 340 HB2 GLU 340 9.874 4.708 15.888 890 HB3 GLU 340 HB3 GLU 340 10.017 3.976 14.291 891 HG2 GLU 340 HG2 GLU 340 9.223 6.848 14.860 892 HG3 GLU 340 HG3 GLU 340 10.777 6.311 14.227 893 H VAL 341 H VAL 341 5.739 3.355 14.401 894 HA VAL 341 HA VAL 341 6.537 1.700 12.187 895 HB VAL 341 HB VAL 341 7.438 0.438 14.177 896 HG11 VAL 341 HG11 VAL 341 4.537 0.570 14.914 897 HG12 VAL 341 HG12 VAL 341 5.432 -0.898 15.302 898 HG13 VAL 341 HG13 VAL 341 5.964 0.655 15.942 899 HG21 VAL 341 HG21 VAL 341 5.879 -0.489 11.958 900 HG22 VAL 341 HG22 VAL 341 7.205 -1.308 12.780 901 HG23 VAL 341 HG23 VAL 341 5.547 -1.534 13.337 902 H PTR 342 H PTR 342 4.733 0.602 11.211 903 HA PTR 342 HA PTR 342 2.327 2.066 11.301 904 HB2 PTR 342 HB2 PTR 342 1.603 -0.348 10.169 905 HB3 PTR 342 HB3 PTR 342 2.291 1.024 9.303 906 HD1 PTR 342 HD1 PTR 342 3.180 -2.102 11.127 907 HD2 PTR 342 HD2 PTR 342 4.449 0.912 8.352 908 HE1 PTR 342 HE1 PTR 342 5.200 -3.437 10.605 909 HE2 PTR 342 HE2 PTR 342 6.473 -0.415 7.833 910 H GLU 343 H GLU 343 2.431 1.795 13.822 911 HA GLU 343 HA GLU 343 1.422 -0.540 15.057 912 HB2 GLU 343 HB2 GLU 343 2.418 1.770 15.993 913 HB3 GLU 343 HB3 GLU 343 0.700 2.121 16.187 914 HG2 GLU 343 HG2 GLU 343 1.243 1.083 18.223 915 HG3 GLU 343 HG3 GLU 343 0.582 -0.248 17.278 916 H SER 344 H SER 344 -0.079 -0.010 12.669 917 HA SER 344 HA SER 344 -2.245 -0.078 11.911 918 HB2 SER 344 HB2 SER 344 -3.244 -0.383 14.717 919 HB3 SER 344 HB3 SER 344 -3.776 -1.194 13.245 920 HG SER 344 HG SER 344 -2.365 -2.367 14.881 921 HA PRO 345 HA PRO 345 -2.716 4.347 13.332 922 HB2 PRO 345 HB2 PRO 345 -2.806 5.366 10.749 923 HB3 PRO 345 HB3 PRO 345 -1.334 5.223 11.727 924 HG2 PRO 345 HG2 PRO 345 -2.325 3.501 9.530 925 HG3 PRO 345 HG3 PRO 345 -0.666 3.941 9.967 926 HD2 PRO 345 HD2 PRO 345 -1.773 1.496 10.556 927 HD3 PRO 345 HD3 PRO 345 -0.483 2.241 11.525 928 H PTR 346 H PTR 346 -4.354 2.558 10.741 929 HA PTR 346 HA PTR 346 -6.878 3.932 11.467 930 HB2 PTR 346 HB2 PTR 346 -6.222 2.768 8.753 931 HB3 PTR 346 HB3 PTR 346 -7.573 3.818 9.182 932 HD1 PTR 346 HD1 PTR 346 -5.085 4.139 7.132 933 HD2 PTR 346 HD2 PTR 346 -6.107 5.718 11.000 934 HE1 PTR 346 HE1 PTR 346 -3.670 6.150 6.709 935 HE2 PTR 346 HE2 PTR 346 -4.705 7.706 10.574 936 H ALA 347 H ALA 347 -7.619 1.704 9.205 937 HA ALA 347 HA ALA 347 -8.644 -0.347 9.199 938 HB1 ALA 347 HB1 ALA 347 -6.865 -0.707 11.607 939 HB2 ALA 347 HB2 ALA 347 -6.677 -1.393 9.996 940 HB3 ALA 347 HB3 ALA 347 -7.966 -1.968 11.053 941 H ASP 348 H ASP 348 -8.436 0.579 12.635 942 HA ASP 348 HA ASP 348 -11.356 0.826 12.734 943 HB2 ASP 348 HB2 ASP 348 -9.750 -1.221 14.249 944 HB3 ASP 348 HB3 ASP 348 -11.263 -0.599 14.902 945 HA PRO 349 HA PRO 349 -9.181 3.886 15.402 946 HB2 PRO 349 HB2 PRO 349 -9.825 6.130 14.057 947 HB3 PRO 349 HB3 PRO 349 -8.499 5.077 13.522 948 HG2 PRO 349 HG2 PRO 349 -11.236 5.379 12.420 949 HG3 PRO 349 HG3 PRO 349 -9.712 5.032 11.588 950 HD2 PRO 349 HD2 PRO 349 -11.679 3.137 12.321 951 HD3 PRO 349 HD3 PRO 349 -10.028 2.777 11.771 952 H GLU 350 H GLU 350 -10.129 4.997 17.080 953 HA GLU 350 HA GLU 350 -12.984 4.715 17.418 954 HB2 GLU 350 HB2 GLU 350 -12.472 5.942 19.607 955 HB3 GLU 350 HB3 GLU 350 -11.705 4.372 19.377 956 HG2 GLU 350 HG2 GLU 350 -10.257 6.845 18.477 957 HG3 GLU 350 HG3 GLU 350 -10.272 6.439 20.191 Start of MODEL 6 1 H1 GLY 661 H1 GLY 661 4.914 -15.980 -9.424 2 H2 GLY 661 H2 GLY 661 3.359 -15.370 -9.752 3 H3 GLY 661 H3 GLY 661 4.702 -14.782 -10.620 4 HA2 GLY 661 HA2 GLY 661 4.954 -16.766 -11.829 5 HA3 GLY 661 HA3 GLY 661 3.900 -17.644 -10.719 6 H HIS 662 H HIS 662 3.488 -14.447 -12.251 7 HA HIS 662 HA HIS 662 1.791 -13.565 -13.529 8 HB2 HIS 662 HB2 HIS 662 2.671 -15.403 -15.072 9 HB3 HIS 662 HB3 HIS 662 1.295 -16.369 -14.538 10 HD1 HIS 662 HD1 HIS 662 -0.998 -14.563 -14.507 11 HD2 HIS 662 HD2 HIS 662 1.919 -14.208 -17.469 12 HE1 HIS 662 HE1 HIS 662 -2.096 -13.361 -16.465 13 HE2 HIS 662 HE2 HIS 662 -0.327 -13.135 -18.275 14 H MET 663 H MET 663 1.204 -14.665 -10.825 15 HA MET 663 HA MET 663 -1.714 -15.089 -11.190 16 HB2 MET 663 HB2 MET 663 0.025 -16.884 -10.027 17 HB3 MET 663 HB3 MET 663 -0.602 -16.005 -8.632 18 HG2 MET 663 HG2 MET 663 -2.932 -16.364 -9.815 19 HG3 MET 663 HG3 MET 663 -2.090 -17.675 -10.640 20 HE1 MET 663 HE1 MET 663 -4.105 -19.524 -8.935 21 HE2 MET 663 HE2 MET 663 -2.842 -19.476 -10.167 22 HE3 MET 663 HE3 MET 663 -2.610 -20.432 -8.696 23 H GLN 664 H GLN 664 0.446 -14.295 -8.486 24 HA GLN 664 HA GLN 664 -1.040 -11.774 -8.135 25 HB2 GLN 664 HB2 GLN 664 -1.778 -13.544 -6.485 26 HB3 GLN 664 HB3 GLN 664 -0.138 -13.528 -5.840 27 HG2 GLN 664 HG2 GLN 664 -1.921 -12.002 -4.712 28 HG3 GLN 664 HG3 GLN 664 -0.329 -11.334 -5.040 29 HE21 GLN 664 HE21 GLN 664 -3.523 -11.630 -6.723 30 HE22 GLN 664 HE22 GLN 664 -3.454 -10.078 -7.407 31 H ASP 665 H ASP 665 1.492 -12.560 -9.373 32 HA ASP 665 HA ASP 665 3.779 -12.031 -7.945 33 HB2 ASP 665 HB2 ASP 665 3.209 -10.996 -10.729 34 HB3 ASP 665 HB3 ASP 665 4.772 -11.435 -10.055 35 H LEU 666 H LEU 666 4.423 -10.326 -6.774 36 HA LEU 666 HA LEU 666 3.062 -7.744 -7.156 37 HB2 LEU 666 HB2 LEU 666 4.844 -8.586 -4.864 38 HB3 LEU 666 HB3 LEU 666 3.726 -7.223 -4.908 39 HG LEU 666 HG LEU 666 2.857 -10.117 -5.195 40 HD11 LEU 666 HD11 LEU 666 2.328 -10.165 -2.901 41 HD12 LEU 666 HD12 LEU 666 3.922 -9.411 -2.942 42 HD13 LEU 666 HD13 LEU 666 2.482 -8.418 -2.736 43 HD21 LEU 666 HD21 LEU 666 0.663 -8.916 -4.404 44 HD22 LEU 666 HD22 LEU 666 1.459 -7.459 -4.999 45 HD23 LEU 666 HD23 LEU 666 1.146 -8.804 -6.094 46 H SER 667 H SER 667 6.190 -9.292 -7.260 47 HA SER 667 HA SER 667 7.793 -6.933 -7.336 48 HB2 SER 667 HB2 SER 667 8.363 -9.715 -8.378 49 HB3 SER 667 HB3 SER 667 9.558 -8.433 -8.186 50 HG SER 667 HG SER 667 9.538 -9.787 -6.356 51 H VAL 668 H VAL 668 5.502 -7.916 -9.455 52 HA VAL 668 HA VAL 668 6.974 -7.145 -11.871 53 HB VAL 668 HB VAL 668 5.053 -7.963 -13.092 54 HG11 VAL 668 HG11 VAL 668 5.023 -10.315 -12.259 55 HG12 VAL 668 HG12 VAL 668 6.653 -9.646 -12.343 56 HG13 VAL 668 HG13 VAL 668 5.830 -9.772 -10.789 57 HG21 VAL 668 HG21 VAL 668 2.986 -7.900 -12.186 58 HG22 VAL 668 HG22 VAL 668 3.475 -9.079 -10.973 59 HG23 VAL 668 HG23 VAL 668 3.677 -7.358 -10.657 60 H HIS 669 H HIS 669 5.290 -5.705 -9.455 61 HA HIS 669 HA HIS 669 4.001 -3.644 -11.098 62 HB2 HIS 669 HB2 HIS 669 4.131 -3.880 -8.083 63 HB3 HIS 669 HB3 HIS 669 3.078 -2.822 -9.018 64 HD1 HIS 669 HD1 HIS 669 1.985 -4.696 -11.125 65 HD2 HIS 669 HD2 HIS 669 2.411 -5.808 -7.137 66 HE1 HIS 669 HE1 HIS 669 0.318 -6.562 -10.723 67 HE2 HIS 669 HE2 HIS 669 0.476 -7.183 -8.249 68 H LEU 670 H LEU 670 4.274 -1.393 -9.789 69 HA LEU 670 HA LEU 670 7.177 -0.912 -9.592 70 HB2 LEU 670 HB2 LEU 670 6.550 1.471 -10.344 71 HB3 LEU 670 HB3 LEU 670 6.624 0.220 -11.560 72 HG LEU 670 HG LEU 670 4.094 1.163 -10.195 73 HD11 LEU 670 HD11 LEU 670 5.142 1.670 -12.996 74 HD12 LEU 670 HD12 LEU 670 3.599 2.232 -12.353 75 HD13 LEU 670 HD13 LEU 670 5.109 2.854 -11.691 76 HD21 LEU 670 HD21 LEU 670 4.709 -1.144 -11.860 77 HD22 LEU 670 HD22 LEU 670 3.199 -0.735 -11.038 78 HD23 LEU 670 HD23 LEU 670 3.531 -0.099 -12.648 79 H TRP 671 H TRP 671 4.295 -0.962 -7.927 80 HA TRP 671 HA TRP 671 5.177 1.213 -6.176 81 HB2 TRP 671 HB2 TRP 671 2.894 0.795 -5.050 82 HB3 TRP 671 HB3 TRP 671 2.917 1.593 -6.614 83 HD1 TRP 671 HD1 TRP 671 1.504 0.552 -8.458 84 HE1 TRP 671 HE1 TRP 671 0.170 -1.643 -8.734 85 HE3 TRP 671 HE3 TRP 671 3.047 -1.946 -4.270 86 HZ2 TRP 671 HZ2 TRP 671 -0.152 -4.131 -7.383 87 HZ3 TRP 671 HZ3 TRP 671 2.208 -4.231 -3.798 88 HH2 TRP 671 HH2 TRP 671 0.608 -5.322 -5.347 89 H TYR 672 H TYR 672 5.233 -2.128 -6.490 90 HA TYR 672 HA TYR 672 5.212 -2.752 -3.656 91 HB2 TYR 672 HB2 TYR 672 4.355 -4.390 -5.282 92 HB3 TYR 672 HB3 TYR 672 5.940 -4.461 -6.051 93 HD1 TYR 672 HD2 TYR 672 4.839 -4.414 -2.459 94 HD2 TYR 672 HD1 TYR 672 6.975 -6.490 -5.549 95 HE1 TYR 672 HE2 TYR 672 5.574 -6.112 -0.815 96 HE2 TYR 672 HE1 TYR 672 7.706 -8.193 -3.905 97 HH TYR 672 HH TYR 672 7.076 -9.061 -1.752 98 H ALA 673 H ALA 673 6.896 -2.337 -2.393 99 HA ALA 673 HA ALA 673 9.576 -2.161 -3.610 100 HB1 ALA 673 HB1 ALA 673 10.220 -0.894 -1.670 101 HB2 ALA 673 HB2 ALA 673 8.727 -1.315 -0.830 102 HB3 ALA 673 HB3 ALA 673 8.681 -0.249 -2.236 103 H GLY 674 H GLY 674 7.631 -4.127 -1.586 104 HA2 GLY 674 HA2 GLY 674 8.030 -6.037 -0.369 105 HA3 GLY 674 HA3 GLY 674 9.330 -6.316 -1.515 106 HA PRO 675 HA PRO 675 11.945 -6.140 2.073 107 HB2 PRO 675 HB2 PRO 675 14.353 -6.012 0.733 108 HB3 PRO 675 HB3 PRO 675 13.427 -7.504 0.983 109 HG2 PRO 675 HG2 PRO 675 13.587 -5.756 -1.421 110 HG3 PRO 675 HG3 PRO 675 13.529 -7.524 -1.310 111 HD2 PRO 675 HD2 PRO 675 11.347 -6.039 -1.973 112 HD3 PRO 675 HD3 PRO 675 11.221 -7.572 -1.081 113 H MET 676 H MET 676 10.781 -3.769 1.882 114 HA MET 676 HA MET 676 13.011 -1.801 1.854 115 HB2 MET 676 HB2 MET 676 11.140 -1.536 0.104 116 HB3 MET 676 HB3 MET 676 10.105 -1.091 1.457 117 HG2 MET 676 HG2 MET 676 10.997 0.985 1.548 118 HG3 MET 676 HG3 MET 676 12.640 0.344 1.573 119 HE1 MET 676 HE1 MET 676 14.063 0.743 -1.720 120 HE2 MET 676 HE2 MET 676 14.201 0.634 0.032 121 HE3 MET 676 HE3 MET 676 13.686 -0.775 -0.909 122 H GLU 677 H GLU 677 12.335 0.183 3.280 123 HA GLU 677 HA GLU 677 11.134 -0.778 5.803 124 HB2 GLU 677 HB2 GLU 677 12.816 0.696 6.944 125 HB3 GLU 677 HB3 GLU 677 13.525 -0.689 6.103 126 HG2 GLU 677 HG2 GLU 677 14.540 0.610 4.523 127 HG3 GLU 677 HG3 GLU 677 13.206 1.755 4.465 128 H ARG 678 H ARG 678 10.412 1.049 7.206 129 HA ARG 678 HA ARG 678 8.595 2.716 5.920 130 HB2 ARG 678 HB2 ARG 678 8.894 2.077 8.459 131 HB3 ARG 678 HB3 ARG 678 9.811 3.583 8.521 132 HG2 ARG 678 HG2 ARG 678 7.953 4.883 7.842 133 HG3 ARG 678 HG3 ARG 678 7.072 3.470 7.256 134 HD2 ARG 678 HD2 ARG 678 7.189 2.655 9.723 135 HD3 ARG 678 HD3 ARG 678 7.564 4.339 10.098 136 HE ARG 678 HE ARG 678 5.272 4.192 8.423 137 HH11 ARG 678 HH21 ARG 678 6.332 3.559 11.658 138 HH12 ARG 678 HH22 ARG 678 4.780 3.952 12.378 139 HH21 ARG 678 HH11 ARG 678 3.273 4.646 9.353 140 HH22 ARG 678 HH12 ARG 678 3.055 4.496 11.081 141 H ALA 679 H ALA 679 11.665 3.769 7.426 142 HA ALA 679 HA ALA 679 11.644 6.390 6.470 143 HB1 ALA 679 HB1 ALA 679 14.318 5.210 6.562 144 HB2 ALA 679 HB2 ALA 679 13.365 4.859 8.004 145 HB3 ALA 679 HB3 ALA 679 13.637 6.530 7.511 146 H GLY 680 H GLY 680 12.686 3.402 4.975 147 HA2 GLY 680 HA2 GLY 680 13.896 4.643 2.690 148 HA3 GLY 680 HA3 GLY 680 13.472 2.940 2.842 149 H ALA 681 H ALA 681 10.793 3.033 3.332 150 HA ALA 681 HA ALA 681 9.659 3.247 0.799 151 HB1 ALA 681 HB1 ALA 681 8.800 2.178 3.071 152 HB2 ALA 681 HB2 ALA 681 7.670 2.651 1.804 153 HB3 ALA 681 HB3 ALA 681 7.931 3.706 3.193 154 H GLU 682 H GLU 682 9.346 5.580 3.516 155 HA GLU 682 HA GLU 682 7.956 7.468 1.853 156 HB2 GLU 682 HB2 GLU 682 8.221 9.007 3.795 157 HB3 GLU 682 HB3 GLU 682 7.465 7.473 4.199 158 HG2 GLU 682 HG2 GLU 682 10.027 6.797 4.655 159 HG3 GLU 682 HG3 GLU 682 10.140 8.518 4.955 160 H SER 683 H SER 683 11.254 6.779 2.424 161 HA SER 683 HA SER 683 12.403 9.301 2.056 162 HB2 SER 683 HB2 SER 683 13.318 6.497 1.579 163 HB3 SER 683 HB3 SER 683 14.295 7.824 0.956 164 HG SER 683 HG SER 683 13.527 7.223 3.624 165 H ILE 684 H ILE 684 11.047 7.005 -0.204 166 HA ILE 684 HA ILE 684 11.873 8.595 -2.516 167 HB ILE 684 HB ILE 684 10.025 6.203 -2.532 168 HG12 ILE 684 HG12 ILE 684 12.770 5.553 -3.174 169 HG13 ILE 684 HG13 ILE 684 12.690 6.244 -1.553 170 HG21 ILE 684 HG21 ILE 684 11.826 7.596 -4.518 171 HG22 ILE 684 HG22 ILE 684 11.277 5.942 -4.778 172 HG23 ILE 684 HG23 ILE 684 10.103 7.251 -4.657 173 HD11 ILE 684 HD11 ILE 684 11.117 3.876 -2.603 174 HD12 ILE 684 HD12 ILE 684 12.356 3.862 -1.348 175 HD13 ILE 684 HD13 ILE 684 10.806 4.647 -1.047 176 H LEU 685 H LEU 685 8.864 7.489 -0.968 177 HA LEU 685 HA LEU 685 7.069 8.951 -2.564 178 HB2 LEU 685 HB2 LEU 685 7.001 7.604 0.082 179 HB3 LEU 685 HB3 LEU 685 5.735 8.785 -0.227 180 HG LEU 685 HG LEU 685 4.868 7.574 -2.034 181 HD11 LEU 685 HD11 LEU 685 6.772 7.218 -3.410 182 HD12 LEU 685 HD12 LEU 685 7.594 6.280 -2.164 183 HD13 LEU 685 HD13 LEU 685 6.201 5.602 -3.005 184 HD21 LEU 685 HD21 LEU 685 4.978 5.101 -1.258 185 HD22 LEU 685 HD22 LEU 685 5.958 5.716 0.072 186 HD23 LEU 685 HD23 LEU 685 4.305 6.288 -0.143 187 H ALA 686 H ALA 686 8.703 9.857 0.491 188 HA ALA 686 HA ALA 686 7.354 12.333 0.792 189 HB1 ALA 686 HB1 ALA 686 8.665 11.241 2.582 190 HB2 ALA 686 HB2 ALA 686 9.137 12.920 2.328 191 HB3 ALA 686 HB3 ALA 686 10.147 11.615 1.702 192 H ASN 687 H ASN 687 10.202 11.351 -1.008 193 HA ASN 687 HA ASN 687 11.012 13.985 -1.798 194 HB2 ASN 687 HB2 ASN 687 12.823 12.753 -2.326 195 HB3 ASN 687 HB3 ASN 687 11.909 11.258 -2.179 196 HD21 ASN 687 HD21 ASN 687 12.064 14.006 -4.529 197 HD22 ASN 687 HD22 ASN 687 12.062 13.007 -5.900 198 H ARG 688 H ARG 688 8.971 11.458 -3.173 199 HA ARG 688 HA ARG 688 8.520 12.760 -5.686 200 HB2 ARG 688 HB2 ARG 688 7.608 10.337 -4.305 201 HB3 ARG 688 HB3 ARG 688 6.378 11.074 -5.325 202 HG2 ARG 688 HG2 ARG 688 7.542 9.603 -6.771 203 HG3 ARG 688 HG3 ARG 688 8.192 11.200 -7.145 204 HD2 ARG 688 HD2 ARG 688 10.156 10.805 -5.870 205 HD3 ARG 688 HD3 ARG 688 9.473 9.377 -5.106 206 HE ARG 688 HE ARG 688 9.444 8.679 -7.715 207 HH11 ARG 688 HH21 ARG 688 11.870 10.102 -5.695 208 HH12 ARG 688 HH22 ARG 688 13.182 9.362 -6.561 209 HH21 ARG 688 HH11 ARG 688 11.147 7.711 -8.802 210 HH22 ARG 688 HH12 ARG 688 12.773 8.006 -8.298 211 H SER 689 H SER 689 6.082 13.065 -6.328 212 HA SER 689 HA SER 689 5.091 15.244 -4.691 213 HB2 SER 689 HB2 SER 689 5.034 15.529 -7.089 214 HB3 SER 689 HB3 SER 689 4.111 14.041 -7.290 215 HG SER 689 HG SER 689 2.355 14.998 -6.421 216 H ASP 690 H ASP 690 2.699 15.384 -4.294 217 HA ASP 690 HA ASP 690 1.867 13.347 -2.544 218 HB2 ASP 690 HB2 ASP 690 0.780 15.848 -3.596 219 HB3 ASP 690 HB3 ASP 690 -0.457 14.641 -3.257 220 H GLY 691 H GLY 691 0.629 11.578 -2.769 221 HA2 GLY 691 HA2 GLY 691 -1.114 10.322 -3.894 222 HA3 GLY 691 HA3 GLY 691 -0.594 11.042 -5.416 223 H THR 692 H THR 692 2.246 10.618 -4.239 224 HA THR 692 HA THR 692 2.797 8.198 -5.656 225 HB THR 692 HB THR 692 4.662 9.474 -3.651 226 HG1 THR 692 HG1 THR 692 4.063 11.217 -4.845 227 HG21 THR 692 HG21 THR 692 6.345 8.514 -4.950 228 HG22 THR 692 HG22 THR 692 5.078 7.291 -5.034 229 HG23 THR 692 HG23 THR 692 5.318 8.407 -6.378 230 H PHE 693 H PHE 693 2.905 6.123 -4.906 231 HA PHE 693 HA PHE 693 2.947 5.707 -1.992 232 HB2 PHE 693 HB2 PHE 693 1.005 4.310 -2.006 233 HB3 PHE 693 HB3 PHE 693 0.572 5.821 -2.801 234 HD1 PHE 693 HD2 PHE 693 1.345 2.249 -3.327 235 HD2 PHE 693 HD1 PHE 693 0.128 5.926 -5.179 236 HE1 PHE 693 HE2 PHE 693 0.680 1.007 -5.364 237 HE2 PHE 693 HE1 PHE 693 -0.539 4.679 -7.217 238 HZ PHE 693 HZ PHE 693 -0.258 2.217 -7.309 239 H LEU 694 H LEU 694 3.126 3.391 -1.408 240 HA LEU 694 HA LEU 694 4.045 1.506 -3.354 241 HB2 LEU 694 HB2 LEU 694 6.350 1.464 -2.966 242 HB3 LEU 694 HB3 LEU 694 5.999 3.190 -3.017 243 HG LEU 694 HG LEU 694 5.611 2.768 -0.388 244 HD11 LEU 694 HD11 LEU 694 7.976 1.220 -0.243 245 HD12 LEU 694 HD12 LEU 694 6.363 0.761 0.302 246 HD13 LEU 694 HD13 LEU 694 6.890 0.359 -1.332 247 HD21 LEU 694 HD21 LEU 694 7.175 4.364 -1.544 248 HD22 LEU 694 HD22 LEU 694 7.822 3.682 -0.059 249 HD23 LEU 694 HD23 LEU 694 8.363 3.066 -1.619 250 H VAL 695 H VAL 695 4.952 -0.486 -2.256 251 HA VAL 695 HA VAL 695 4.012 -0.746 0.523 252 HB VAL 695 HB VAL 695 3.375 -2.835 -1.560 253 HG11 VAL 695 HG11 VAL 695 2.113 -3.843 0.171 254 HG12 VAL 695 HG12 VAL 695 3.578 -3.314 0.987 255 HG13 VAL 695 HG13 VAL 695 2.096 -2.373 1.137 256 HG21 VAL 695 HG21 VAL 695 1.614 -0.638 -0.425 257 HG22 VAL 695 HG22 VAL 695 2.137 -0.779 -2.101 258 HG23 VAL 695 HG23 VAL 695 1.046 -1.979 -1.414 259 H ARG 696 H ARG 696 5.156 -2.106 1.779 260 HA ARG 696 HA ARG 696 7.497 -3.415 0.519 261 HB2 ARG 696 HB2 ARG 696 8.621 -3.031 2.729 262 HB3 ARG 696 HB3 ARG 696 8.225 -1.555 1.846 263 HG2 ARG 696 HG2 ARG 696 6.186 -1.272 3.195 264 HG3 ARG 696 HG3 ARG 696 6.556 -2.759 4.074 265 HD2 ARG 696 HD2 ARG 696 8.224 -0.229 4.013 266 HD3 ARG 696 HD3 ARG 696 7.315 -0.852 5.389 267 HE ARG 696 HE ARG 696 9.795 -2.010 4.272 268 HH11 ARG 696 HH21 ARG 696 7.271 -2.069 6.630 269 HH12 ARG 696 HH22 ARG 696 8.143 -3.104 7.707 270 HH21 ARG 696 HH11 ARG 696 10.884 -3.319 5.604 271 HH22 ARG 696 HH12 ARG 696 10.211 -3.801 7.132 272 H GLN 697 H GLN 697 8.384 -5.242 1.769 273 HA GLN 697 HA GLN 697 6.227 -6.869 2.999 274 HB2 GLN 697 HB2 GLN 697 6.688 -7.960 0.990 275 HB3 GLN 697 HB3 GLN 697 8.395 -7.540 1.035 276 HG2 GLN 697 HG2 GLN 697 8.273 -9.879 1.530 277 HG3 GLN 697 HG3 GLN 697 8.605 -9.080 3.059 278 HE21 GLN 697 HE21 GLN 697 7.023 -11.661 2.199 279 HE22 GLN 697 HE22 GLN 697 5.589 -11.533 3.117 280 H ARG 698 H ARG 698 6.562 -7.497 5.037 281 HA ARG 698 HA ARG 698 8.953 -8.483 6.078 282 HB2 ARG 698 HB2 ARG 698 9.153 -5.718 5.834 283 HB3 ARG 698 HB3 ARG 698 8.731 -5.963 7.529 284 HG2 ARG 698 HG2 ARG 698 10.998 -7.348 6.055 285 HG3 ARG 698 HG3 ARG 698 11.182 -6.031 7.210 286 HD2 ARG 698 HD2 ARG 698 10.258 -8.862 7.730 287 HD3 ARG 698 HD3 ARG 698 11.597 -8.000 8.479 288 HE ARG 698 HE ARG 698 8.891 -7.999 9.392 289 HH11 ARG 698 HH21 ARG 698 11.641 -5.954 8.942 290 HH12 ARG 698 HH22 ARG 698 11.139 -4.806 10.135 291 HH21 ARG 698 HH11 ARG 698 8.289 -6.542 10.956 292 HH22 ARG 698 HH12 ARG 698 9.266 -5.145 11.284 293 H VAL 699 H VAL 699 7.783 -9.941 7.152 294 HA VAL 699 HA VAL 699 5.375 -9.628 8.478 295 HB VAL 699 HB VAL 699 6.575 -11.784 7.941 296 HG11 VAL 699 HG11 VAL 699 8.335 -12.562 9.265 297 HG12 VAL 699 HG12 VAL 699 8.708 -10.842 9.162 298 HG13 VAL 699 HG13 VAL 699 7.934 -11.491 10.608 299 HG21 VAL 699 HG21 VAL 699 4.584 -11.476 9.568 300 HG22 VAL 699 HG22 VAL 699 5.507 -12.973 9.689 301 HG23 VAL 699 HG23 VAL 699 5.775 -11.676 10.854 302 H LYS 700 H LYS 700 5.000 -9.844 10.838 303 HA LYS 700 HA LYS 700 6.924 -8.816 12.706 304 HB2 LYS 700 HB2 LYS 700 6.213 -6.723 11.542 305 HB3 LYS 700 HB3 LYS 700 4.557 -7.043 12.056 306 HG2 LYS 700 HG2 LYS 700 5.180 -6.910 14.385 307 HG3 LYS 700 HG3 LYS 700 6.890 -6.832 13.977 308 HD2 LYS 700 HD2 LYS 700 6.011 -4.594 14.537 309 HD3 LYS 700 HD3 LYS 700 6.541 -4.667 12.857 310 HE2 LYS 700 HE2 LYS 700 4.406 -3.534 12.914 311 HE3 LYS 700 HE3 LYS 700 4.152 -5.124 12.198 312 HZ1 LYS 700 HZ1 LYS 700 2.647 -5.518 13.772 313 HZ2 LYS 700 HZ2 LYS 700 3.872 -5.447 14.951 314 HZ3 LYS 700 HZ3 LYS 700 3.009 -4.036 14.543 315 H ASP 701 H ASP 701 3.379 -8.439 12.552 316 HA ASP 701 HA ASP 701 3.000 -10.651 14.424 317 HB2 ASP 701 HB2 ASP 701 1.485 -8.962 15.776 318 HB3 ASP 701 HB3 ASP 701 3.208 -9.087 16.114 319 H ALA 702 H ALA 702 0.942 -7.869 13.661 320 HA ALA 702 HA ALA 702 -1.053 -9.741 12.528 321 HB1 ALA 702 HB1 ALA 702 -1.858 -8.406 14.399 322 HB2 ALA 702 HB2 ALA 702 -2.667 -7.888 12.920 323 HB3 ALA 702 HB3 ALA 702 -1.355 -6.920 13.594 324 H ALA 703 H ALA 703 0.903 -9.375 10.764 325 HA ALA 703 HA ALA 703 -0.312 -8.427 8.464 326 HB1 ALA 703 HB1 ALA 703 -0.290 -6.188 9.029 327 HB2 ALA 703 HB2 ALA 703 1.261 -6.331 8.202 328 HB3 ALA 703 HB3 ALA 703 1.199 -6.333 9.965 329 H GLU 704 H GLU 704 1.176 -8.148 6.626 330 HA GLU 704 HA GLU 704 3.753 -9.563 7.041 331 HB2 GLU 704 HB2 GLU 704 1.483 -10.363 5.466 332 HB3 GLU 704 HB3 GLU 704 2.842 -10.024 4.394 333 HG2 GLU 704 HG2 GLU 704 3.301 -11.642 6.883 334 HG3 GLU 704 HG3 GLU 704 2.599 -12.415 5.463 335 H PHE 705 H PHE 705 1.949 -7.659 4.631 336 HA PHE 705 HA PHE 705 4.458 -6.315 3.859 337 HB2 PHE 705 HB2 PHE 705 1.778 -6.216 2.455 338 HB3 PHE 705 HB3 PHE 705 3.325 -5.655 1.832 339 HD1 PHE 705 HD1 PHE 705 1.487 -8.706 2.943 340 HD2 PHE 705 HD2 PHE 705 4.812 -7.128 0.741 341 HE1 PHE 705 HE1 PHE 705 1.956 -10.963 2.035 342 HE2 PHE 705 HE2 PHE 705 5.282 -9.384 -0.172 343 HZ PHE 705 HZ PHE 705 3.852 -11.303 0.477 344 H ALA 706 H ALA 706 4.281 -3.948 3.409 345 HA ALA 706 HA ALA 706 2.223 -2.641 5.072 346 HB1 ALA 706 HB1 ALA 706 5.141 -1.851 5.151 347 HB2 ALA 706 HB2 ALA 706 4.350 -2.829 6.386 348 HB3 ALA 706 HB3 ALA 706 3.827 -1.166 6.107 349 H ILE 707 H ILE 707 1.275 -0.974 4.133 350 HA ILE 707 HA ILE 707 2.147 -0.179 1.473 351 HB ILE 707 HB ILE 707 -0.195 0.881 3.071 352 HG12 ILE 707 HG12 ILE 707 -1.358 -0.902 1.464 353 HG13 ILE 707 HG13 ILE 707 0.206 -1.698 1.601 354 HG21 ILE 707 HG21 ILE 707 -1.049 0.956 0.574 355 HG22 ILE 707 HG22 ILE 707 -0.018 2.245 1.192 356 HG23 ILE 707 HG23 ILE 707 0.670 0.962 0.196 357 HD11 ILE 707 HD11 ILE 707 -1.911 -1.765 3.465 358 HD12 ILE 707 HD12 ILE 707 -0.289 -2.418 3.674 359 HD13 ILE 707 HD13 ILE 707 -0.655 -0.778 4.201 360 H SER 708 H SER 708 1.964 2.219 0.971 361 HA SER 708 HA SER 708 2.576 4.129 2.995 362 HB2 SER 708 HB2 SER 708 4.835 3.002 1.354 363 HB3 SER 708 HB3 SER 708 4.919 4.594 2.103 364 HG SER 708 HG SER 708 4.062 2.410 3.667 365 H ILE 709 H ILE 709 1.511 5.835 2.203 366 HA ILE 709 HA ILE 709 1.735 6.427 -0.696 367 HB ILE 709 HB ILE 709 -0.647 7.290 0.904 368 HG12 ILE 709 HG12 ILE 709 -1.627 5.053 -0.204 369 HG13 ILE 709 HG13 ILE 709 0.027 4.504 0.084 370 HG21 ILE 709 HG21 ILE 709 -1.098 6.292 -1.786 371 HG22 ILE 709 HG22 ILE 709 -1.424 7.892 -1.119 372 HG23 ILE 709 HG23 ILE 709 0.171 7.520 -1.773 373 HD11 ILE 709 HD11 ILE 709 -1.633 4.150 2.001 374 HD12 ILE 709 HD12 ILE 709 -0.121 4.956 2.409 375 HD13 ILE 709 HD13 ILE 709 -1.590 5.905 2.213 376 H LYS 710 H LYS 710 2.202 8.470 -1.277 377 HA LYS 710 HA LYS 710 2.918 10.348 0.845 378 HB2 LYS 710 HB2 LYS 710 4.543 10.164 -0.912 379 HB3 LYS 710 HB3 LYS 710 3.308 10.335 -2.156 380 HG2 LYS 710 HG2 LYS 710 4.342 12.461 -2.052 381 HG3 LYS 710 HG3 LYS 710 2.848 12.654 -1.143 382 HD2 LYS 710 HD2 LYS 710 3.923 12.796 0.887 383 HD3 LYS 710 HD3 LYS 710 5.306 11.820 0.366 384 HE2 LYS 710 HE2 LYS 710 4.721 14.585 -0.730 385 HE3 LYS 710 HE3 LYS 710 5.783 14.303 0.650 386 HZ1 LYS 710 HZ1 LYS 710 6.304 13.887 -2.157 387 HZ2 LYS 710 HZ2 LYS 710 7.402 13.965 -0.842 388 HZ3 LYS 710 HZ3 LYS 710 6.628 12.485 -1.228 389 H TYR 711 H TYR 711 1.143 11.305 1.670 390 HA TYR 711 HA TYR 711 -0.578 12.827 -0.183 391 HB2 TYR 711 HB2 TYR 711 -1.703 10.674 0.356 392 HB3 TYR 711 HB3 TYR 711 -1.625 11.091 2.065 393 HD1 TYR 711 HD1 TYR 711 -2.477 13.051 -1.030 394 HD2 TYR 711 HD2 TYR 711 -3.713 11.704 2.851 395 HE1 TYR 711 HE1 TYR 711 -4.592 14.327 -1.258 396 HE2 TYR 711 HE2 TYR 711 -5.831 12.972 2.624 397 HH TYR 711 HH TYR 711 -7.161 13.851 0.056 398 H ASN 712 H ASN 712 -0.258 14.849 0.390 399 HA ASN 712 HA ASN 712 -0.436 16.745 1.694 400 HB2 ASN 712 HB2 ASN 712 -2.051 15.340 3.137 401 HB3 ASN 712 HB3 ASN 712 -0.652 15.046 4.173 402 HD21 ASN 712 HD21 ASN 712 0.443 17.006 5.103 403 HD22 ASN 712 HD22 ASN 712 -0.470 18.419 5.347 404 H VAL 713 H VAL 713 1.889 16.109 0.795 405 HA VAL 713 HA VAL 713 4.169 16.026 1.110 406 HB VAL 713 HB VAL 713 5.030 17.813 2.539 407 HG11 VAL 713 HG11 VAL 713 2.452 18.655 1.190 408 HG12 VAL 713 HG12 VAL 713 3.883 19.652 1.456 409 HG13 VAL 713 HG13 VAL 713 3.947 18.301 0.324 410 HG21 VAL 713 HG21 VAL 713 2.174 18.231 3.467 411 HG22 VAL 713 HG22 VAL 713 3.375 17.371 4.431 412 HG23 VAL 713 HG23 VAL 713 3.620 19.070 4.027 413 H GLU 714 H GLU 714 2.879 13.886 2.369 414 HA GLU 714 HA GLU 714 4.925 13.114 4.258 415 HB2 GLU 714 HB2 GLU 714 3.521 12.703 6.146 416 HB3 GLU 714 HB3 GLU 714 3.193 14.359 5.637 417 HG2 GLU 714 HG2 GLU 714 1.017 13.811 5.491 418 HG3 GLU 714 HG3 GLU 714 1.424 12.743 4.153 419 H VAL 715 H VAL 715 4.816 10.821 4.780 420 HA VAL 715 HA VAL 715 3.326 9.307 2.721 421 HB VAL 715 HB VAL 715 5.821 8.430 4.167 422 HG11 VAL 715 HG11 VAL 715 4.486 7.536 1.591 423 HG12 VAL 715 HG12 VAL 715 5.986 6.881 2.249 424 HG13 VAL 715 HG13 VAL 715 4.469 6.650 3.118 425 HG21 VAL 715 HG21 VAL 715 6.787 9.040 1.786 426 HG22 VAL 715 HG22 VAL 715 5.411 10.136 1.729 427 HG23 VAL 715 HG23 VAL 715 6.612 10.297 3.007 428 H LYS 716 H LYS 716 1.608 8.257 3.496 429 HA LYS 716 HA LYS 716 1.467 7.520 6.325 430 HB2 LYS 716 HB2 LYS 716 -0.669 6.735 4.387 431 HB3 LYS 716 HB3 LYS 716 -0.815 7.329 6.038 432 HG2 LYS 716 HG2 LYS 716 0.365 9.431 4.546 433 HG3 LYS 716 HG3 LYS 716 -0.960 8.813 3.565 434 HD2 LYS 716 HD2 LYS 716 -2.541 9.135 5.344 435 HD3 LYS 716 HD3 LYS 716 -1.257 9.478 6.503 436 HE2 LYS 716 HE2 LYS 716 -0.761 11.350 4.550 437 HE3 LYS 716 HE3 LYS 716 -2.522 11.261 4.529 438 HZ1 LYS 716 HZ1 LYS 716 -0.716 11.934 6.789 439 HZ2 LYS 716 HZ2 LYS 716 -2.043 12.825 6.168 440 HZ3 LYS 716 HZ3 LYS 716 -2.331 11.407 7.059 441 H HIS 717 H HIS 717 2.321 5.648 6.975 442 HA HIS 717 HA HIS 717 2.413 3.368 5.117 443 HB2 HIS 717 HB2 HIS 717 3.818 3.502 7.767 444 HB3 HIS 717 HB3 HIS 717 4.202 2.509 6.366 445 HD1 HIS 717 HD1 HIS 717 5.299 3.710 4.292 446 HD2 HIS 717 HD2 HIS 717 4.913 6.106 7.708 447 HE1 HIS 717 HE1 HIS 717 6.913 5.653 4.016 448 HE2 HIS 717 HE2 HIS 717 6.721 7.120 6.101 449 H ILE 718 H ILE 718 1.417 1.509 5.516 450 HA ILE 718 HA ILE 718 0.165 1.039 8.138 451 HB ILE 718 HB ILE 718 -1.300 0.819 5.500 452 HG12 ILE 718 HG12 ILE 718 -2.436 2.450 7.656 453 HG13 ILE 718 HG13 ILE 718 -0.894 3.069 7.071 454 HG21 ILE 718 HG21 ILE 718 -1.944 -0.018 8.323 455 HG22 ILE 718 HG22 ILE 718 -3.231 0.417 7.199 456 HG23 ILE 718 HG23 ILE 718 -2.154 -0.926 6.823 457 HD11 ILE 718 HD11 ILE 718 -2.340 4.064 5.567 458 HD12 ILE 718 HD12 ILE 718 -1.956 2.572 4.705 459 HD13 ILE 718 HD13 ILE 718 -3.470 2.709 5.602 460 H LYS 719 H LYS 719 -0.032 -1.078 8.710 461 HA LYS 719 HA LYS 719 1.624 -2.973 7.260 462 HB2 LYS 719 HB2 LYS 719 1.068 -4.416 9.282 463 HB3 LYS 719 HB3 LYS 719 1.956 -2.936 9.606 464 HG2 LYS 719 HG2 LYS 719 0.196 -1.945 10.693 465 HG3 LYS 719 HG3 LYS 719 -1.012 -2.716 9.665 466 HD2 LYS 719 HD2 LYS 719 0.145 -4.856 11.026 467 HD3 LYS 719 HD3 LYS 719 0.060 -3.587 12.246 468 HE2 LYS 719 HE2 LYS 719 -2.041 -4.610 12.442 469 HE3 LYS 719 HE3 LYS 719 -2.381 -3.250 11.371 470 HZ1 LYS 719 HZ1 LYS 719 -1.870 -6.082 10.569 471 HZ2 LYS 719 HZ2 LYS 719 -3.373 -5.226 10.459 472 HZ3 LYS 719 HZ3 LYS 719 -2.042 -4.773 9.469 473 H ILE 720 H ILE 720 0.767 -4.064 5.616 474 HA ILE 720 HA ILE 720 -2.046 -4.584 5.334 475 HB ILE 720 HB ILE 720 0.284 -4.685 3.677 476 HG12 ILE 720 HG12 ILE 720 -2.531 -5.328 2.814 477 HG13 ILE 720 HG13 ILE 720 -2.093 -3.706 3.343 478 HG21 ILE 720 HG21 ILE 720 -1.375 -7.226 3.634 479 HG22 ILE 720 HG22 ILE 720 -0.190 -6.767 2.415 480 HG23 ILE 720 HG23 ILE 720 0.331 -7.115 4.062 481 HD11 ILE 720 HD11 ILE 720 -1.303 -5.168 0.883 482 HD12 ILE 720 HD12 ILE 720 -1.553 -3.440 1.131 483 HD13 ILE 720 HD13 ILE 720 -0.043 -4.195 1.643 484 H MET 721 H MET 721 -3.174 -6.424 5.739 485 HA MET 721 HA MET 721 -1.880 -8.446 7.405 486 HB2 MET 721 HB2 MET 721 -4.254 -7.278 7.698 487 HB3 MET 721 HB3 MET 721 -4.763 -8.605 6.657 488 HG2 MET 721 HG2 MET 721 -2.977 -9.573 8.731 489 HG3 MET 721 HG3 MET 721 -4.342 -8.712 9.440 490 HE1 MET 721 HE1 MET 721 -4.891 -12.700 9.446 491 HE2 MET 721 HE2 MET 721 -3.303 -12.006 9.127 492 HE3 MET 721 HE3 MET 721 -4.332 -11.330 10.401 493 H THR 722 H THR 722 -3.042 -10.754 6.944 494 HA THR 722 HA THR 722 -2.972 -11.340 4.065 495 HB THR 722 HB THR 722 -0.685 -11.743 4.649 496 HG1 THR 722 HG1 THR 722 -2.295 -14.073 4.675 497 HG21 THR 722 HG21 THR 722 -1.139 -11.799 7.146 498 HG22 THR 722 HG22 THR 722 -1.654 -13.473 6.939 499 HG23 THR 722 HG23 THR 722 0.008 -13.008 6.574 500 H ALA 723 H ALA 723 -5.168 -11.266 5.805 501 HA ALA 723 HA ALA 723 -5.951 -13.603 7.056 502 HB1 ALA 723 HB1 ALA 723 -8.311 -12.904 6.237 503 HB2 ALA 723 HB2 ALA 723 -7.489 -11.508 5.538 504 HB3 ALA 723 HB3 ALA 723 -7.423 -11.791 7.278 505 H GLU 724 H GLU 724 -5.918 -15.614 6.323 506 HA GLU 724 HA GLU 724 -5.933 -17.406 4.876 507 HB2 GLU 724 HB2 GLU 724 -8.189 -16.082 3.407 508 HB3 GLU 724 HB3 GLU 724 -8.004 -17.771 3.886 509 HG2 GLU 724 HG2 GLU 724 -8.736 -15.406 5.622 510 HG3 GLU 724 HG3 GLU 724 -9.639 -16.898 5.376 511 H GLY 725 H GLY 725 -4.454 -14.875 4.088 512 HA2 GLY 725 HA2 GLY 725 -2.854 -14.773 2.311 513 HA3 GLY 725 HA3 GLY 725 -3.982 -15.644 1.279 514 H LEU 726 H LEU 726 -5.972 -13.548 2.739 515 HA LEU 726 HA LEU 726 -5.932 -11.740 0.460 516 HB2 LEU 726 HB2 LEU 726 -7.720 -11.567 2.890 517 HB3 LEU 726 HB3 LEU 726 -7.997 -10.876 1.294 518 HG LEU 726 HG LEU 726 -7.754 -13.855 1.783 519 HD11 LEU 726 HD11 LEU 726 -10.368 -13.471 1.198 520 HD12 LEU 726 HD12 LEU 726 -9.757 -13.547 2.850 521 HD13 LEU 726 HD13 LEU 726 -10.042 -11.984 2.086 522 HD21 LEU 726 HD21 LEU 726 -9.103 -13.727 -0.457 523 HD22 LEU 726 HD22 LEU 726 -8.473 -12.083 -0.543 524 HD23 LEU 726 HD23 LEU 726 -7.362 -13.451 -0.497 525 H TYR 727 H TYR 727 -5.201 -9.698 0.427 526 HA TYR 727 HA TYR 727 -3.823 -8.731 2.828 527 HB2 TYR 727 HB2 TYR 727 -3.719 -7.810 -0.051 528 HB3 TYR 727 HB3 TYR 727 -2.799 -7.088 1.266 529 HD1 TYR 727 HD2 TYR 727 -2.961 -10.398 2.238 530 HD2 TYR 727 HD1 TYR 727 -1.161 -7.958 -0.796 531 HE1 TYR 727 HE2 TYR 727 -1.197 -12.102 1.905 532 HE2 TYR 727 HE1 TYR 727 0.602 -9.655 -1.128 533 HH TYR 727 HH TYR 727 0.619 -12.666 0.787 534 H ARG 728 H ARG 728 -4.235 -6.777 3.759 535 HA ARG 728 HA ARG 728 -6.389 -5.085 2.749 536 HB2 ARG 728 HB2 ARG 728 -7.329 -5.252 5.229 537 HB3 ARG 728 HB3 ARG 728 -7.853 -6.375 3.985 538 HG2 ARG 728 HG2 ARG 728 -6.017 -7.944 4.726 539 HG3 ARG 728 HG3 ARG 728 -5.704 -6.846 6.066 540 HD2 ARG 728 HD2 ARG 728 -8.507 -7.345 6.021 541 HD3 ARG 728 HD3 ARG 728 -7.694 -8.903 5.867 542 HE ARG 728 HE ARG 728 -6.616 -7.187 7.960 543 HH11 ARG 728 HH21 ARG 728 -8.909 -9.629 7.130 544 HH12 ARG 728 HH22 ARG 728 -9.093 -10.188 8.752 545 HH21 ARG 728 HH11 ARG 728 -6.857 -7.878 10.056 546 HH22 ARG 728 HH12 ARG 728 -7.954 -9.194 10.409 547 H ILE 729 H ILE 729 -6.014 -3.004 3.225 548 HA ILE 729 HA ILE 729 -3.663 -2.298 4.788 549 HB ILE 729 HB ILE 729 -5.622 -0.362 3.573 550 HG12 ILE 729 HG12 ILE 729 -3.431 -1.931 2.188 551 HG13 ILE 729 HG13 ILE 729 -5.155 -1.968 1.820 552 HG21 ILE 729 HG21 ILE 729 -3.146 0.634 3.147 553 HG22 ILE 729 HG22 ILE 729 -4.066 0.937 4.619 554 HG23 ILE 729 HG23 ILE 729 -2.837 -0.323 4.593 555 HD11 ILE 729 HD11 ILE 729 -4.536 -0.441 0.234 556 HD12 ILE 729 HD12 ILE 729 -4.710 0.680 1.583 557 HD13 ILE 729 HD13 ILE 729 -3.115 0.077 1.139 558 H THR 730 H THR 730 -7.119 -2.227 5.093 559 HA THR 730 HA THR 730 -6.860 -0.866 7.715 560 HB THR 730 HB THR 730 -8.119 0.364 5.975 561 HG1 THR 730 HG1 THR 730 -9.418 1.067 7.456 562 HG21 THR 730 HG21 THR 730 -10.280 -0.474 5.217 563 HG22 THR 730 HG22 THR 730 -9.008 -1.619 4.789 564 HG23 THR 730 HG23 THR 730 -10.060 -1.940 6.165 565 H GLU 731 H GLU 731 -7.312 -3.742 6.241 566 HA GLU 731 HA GLU 731 -7.857 -5.809 7.003 567 HB2 GLU 731 HB2 GLU 731 -8.491 -4.517 9.650 568 HB3 GLU 731 HB3 GLU 731 -8.038 -6.198 9.345 569 HG2 GLU 731 HG2 GLU 731 -5.971 -4.854 8.135 570 HG3 GLU 731 HG3 GLU 731 -6.331 -3.776 9.479 571 H LYS 732 H LYS 732 -10.051 -3.183 7.448 572 HA LYS 732 HA LYS 732 -12.435 -4.633 7.935 573 HB2 LYS 732 HB2 LYS 732 -12.258 -2.042 6.393 574 HB3 LYS 732 HB3 LYS 732 -13.573 -2.606 7.426 575 HG2 LYS 732 HG2 LYS 732 -10.788 -1.841 8.364 576 HG3 LYS 732 HG3 LYS 732 -12.244 -0.876 8.570 577 HD2 LYS 732 HD2 LYS 732 -12.447 -3.664 9.557 578 HD3 LYS 732 HD3 LYS 732 -11.321 -2.636 10.439 579 HE2 LYS 732 HE2 LYS 732 -13.987 -1.485 9.764 580 HE3 LYS 732 HE3 LYS 732 -13.924 -2.708 11.038 581 HZ1 LYS 732 HZ1 LYS 732 -12.796 -1.369 12.429 582 HZ2 LYS 732 HZ2 LYS 732 -11.839 -0.684 11.166 583 HZ3 LYS 732 HZ3 LYS 732 -13.425 -0.111 11.444 584 H LYS 733 H LYS 733 -10.684 -3.804 5.002 585 HA LYS 733 HA LYS 733 -12.443 -5.620 3.483 586 HB2 LYS 733 HB2 LYS 733 -13.302 -3.537 2.785 587 HB3 LYS 733 HB3 LYS 733 -11.709 -2.784 2.767 588 HG2 LYS 733 HG2 LYS 733 -12.551 -3.278 0.471 589 HG3 LYS 733 HG3 LYS 733 -11.052 -4.132 0.827 590 HD2 LYS 733 HD2 LYS 733 -12.163 -6.210 1.100 591 HD3 LYS 733 HD3 LYS 733 -13.734 -5.441 1.305 592 HE2 LYS 733 HE2 LYS 733 -14.106 -5.738 -0.896 593 HE3 LYS 733 HE3 LYS 733 -12.802 -4.597 -1.224 594 HZ1 LYS 733 HZ1 LYS 733 -11.477 -6.914 -0.618 595 HZ2 LYS 733 HZ2 LYS 733 -12.837 -7.458 -1.500 596 HZ3 LYS 733 HZ3 LYS 733 -11.784 -6.319 -2.190 597 H ALA 734 H ALA 734 -11.171 -7.226 2.858 598 HA ALA 734 HA ALA 734 -8.358 -6.686 2.187 599 HB1 ALA 734 HB1 ALA 734 -7.903 -8.918 2.702 600 HB2 ALA 734 HB2 ALA 734 -9.561 -9.432 2.392 601 HB3 ALA 734 HB3 ALA 734 -9.178 -8.527 3.855 602 H PHE 735 H PHE 735 -7.539 -8.302 0.446 603 HA PHE 735 HA PHE 735 -9.450 -8.640 -1.755 604 HB2 PHE 735 HB2 PHE 735 -7.232 -6.683 -1.687 605 HB3 PHE 735 HB3 PHE 735 -7.354 -7.643 -3.160 606 HD1 PHE 735 HD2 PHE 735 -9.503 -7.671 -4.458 607 HD2 PHE 735 HD1 PHE 735 -8.862 -5.003 -1.153 608 HE1 PHE 735 HE2 PHE 735 -11.418 -6.286 -5.202 609 HE2 PHE 735 HE1 PHE 735 -10.775 -3.619 -1.898 610 HZ PHE 735 HZ PHE 735 -12.055 -4.259 -3.922 611 H ARG 736 H ARG 736 -8.312 -9.780 -3.643 612 HA ARG 736 HA ARG 736 -7.469 -12.292 -2.925 613 HB2 ARG 736 HB2 ARG 736 -7.364 -10.672 -5.372 614 HB3 ARG 736 HB3 ARG 736 -6.164 -11.956 -5.309 615 HG2 ARG 736 HG2 ARG 736 -7.938 -13.141 -6.190 616 HG3 ARG 736 HG3 ARG 736 -8.251 -13.387 -4.475 617 HD2 ARG 736 HD2 ARG 736 -10.103 -12.052 -4.484 618 HD3 ARG 736 HD3 ARG 736 -9.410 -10.915 -5.633 619 HE ARG 736 HE ARG 736 -10.820 -13.413 -6.290 620 HH11 ARG 736 HH21 ARG 736 -9.165 -10.522 -7.339 621 HH12 ARG 736 HH22 ARG 736 -9.718 -10.698 -8.977 622 HH21 ARG 736 HH11 ARG 736 -11.517 -13.567 -8.401 623 HH22 ARG 736 HH12 ARG 736 -11.050 -12.379 -9.563 624 H GLY 737 H GLY 737 -5.373 -9.533 -3.726 625 HA2 GLY 737 HA2 GLY 737 -3.262 -10.626 -2.047 626 HA3 GLY 737 HA3 GLY 737 -2.884 -10.515 -3.762 627 H LEU 738 H LEU 738 -1.217 -9.012 -3.165 628 HA LEU 738 HA LEU 738 -1.846 -6.506 -1.929 629 HB2 LEU 738 HB2 LEU 738 0.505 -7.890 -2.595 630 HB3 LEU 738 HB3 LEU 738 0.544 -6.422 -3.568 631 HG LEU 738 HG LEU 738 0.187 -6.583 -0.560 632 HD11 LEU 738 HD11 LEU 738 2.319 -4.917 -1.676 633 HD12 LEU 738 HD12 LEU 738 2.395 -6.132 -0.400 634 HD13 LEU 738 HD13 LEU 738 2.502 -6.618 -2.090 635 HD21 LEU 738 HD21 LEU 738 -1.178 -4.776 -1.345 636 HD22 LEU 738 HD22 LEU 738 0.319 -4.055 -0.772 637 HD23 LEU 738 HD23 LEU 738 0.055 -4.267 -2.500 638 H THR 739 H THR 739 -1.205 -7.561 -5.253 639 HA THR 739 HA THR 739 -1.497 -5.107 -6.539 640 HB THR 739 HB THR 739 -2.580 -7.668 -7.695 641 HG1 THR 739 HG1 THR 739 -0.693 -8.460 -7.186 642 HG21 THR 739 HG21 THR 739 -2.830 -5.633 -9.023 643 HG22 THR 739 HG22 THR 739 -1.107 -5.295 -8.860 644 HG23 THR 739 HG23 THR 739 -1.647 -6.705 -9.771 645 H GLU 740 H GLU 740 -3.981 -7.597 -5.964 646 HA GLU 740 HA GLU 740 -6.142 -6.024 -6.907 647 HB2 GLU 740 HB2 GLU 740 -6.241 -8.271 -4.883 648 HB3 GLU 740 HB3 GLU 740 -7.578 -7.681 -5.870 649 HG2 GLU 740 HG2 GLU 740 -5.589 -8.214 -7.744 650 HG3 GLU 740 HG3 GLU 740 -5.406 -9.524 -6.584 651 H LEU 741 H LEU 741 -4.565 -6.243 -3.805 652 HA LEU 741 HA LEU 741 -6.602 -4.783 -2.389 653 HB2 LEU 741 HB2 LEU 741 -5.110 -6.438 -1.303 654 HB3 LEU 741 HB3 LEU 741 -3.731 -5.402 -1.639 655 HG LEU 741 HG LEU 741 -4.827 -5.300 0.707 656 HD11 LEU 741 HD11 LEU 741 -3.630 -3.420 0.875 657 HD12 LEU 741 HD12 LEU 741 -3.438 -3.464 -0.874 658 HD13 LEU 741 HD13 LEU 741 -4.753 -2.535 -0.156 659 HD21 LEU 741 HD21 LEU 741 -6.720 -3.468 -0.788 660 HD22 LEU 741 HD22 LEU 741 -7.155 -5.080 -0.220 661 HD23 LEU 741 HD23 LEU 741 -6.723 -3.824 0.936 662 H VAL 742 H VAL 742 -3.488 -4.008 -3.919 663 HA VAL 742 HA VAL 742 -3.675 -1.203 -3.097 664 HB VAL 742 HB VAL 742 -1.648 -2.884 -4.497 665 HG11 VAL 742 HG11 VAL 742 -1.761 -1.089 -6.078 666 HG12 VAL 742 HG12 VAL 742 -1.916 0.113 -4.795 667 HG13 VAL 742 HG13 VAL 742 -0.391 -0.742 -5.026 668 HG21 VAL 742 HG21 VAL 742 -1.534 -0.753 -2.349 669 HG22 VAL 742 HG22 VAL 742 -1.516 -2.496 -2.077 670 HG23 VAL 742 HG23 VAL 742 -0.167 -1.719 -2.903 671 H GLU 743 H GLU 743 -4.196 -3.130 -6.022 672 HA GLU 743 HA GLU 743 -4.512 -0.819 -7.709 673 HB2 GLU 743 HB2 GLU 743 -5.235 -3.724 -8.142 674 HB3 GLU 743 HB3 GLU 743 -5.388 -2.468 -9.369 675 HG2 GLU 743 HG2 GLU 743 -2.822 -3.329 -7.992 676 HG3 GLU 743 HG3 GLU 743 -3.258 -3.636 -9.667 677 H PHE 744 H PHE 744 -6.295 -1.719 -5.226 678 HA PHE 744 HA PHE 744 -8.868 -1.058 -6.515 679 HB2 PHE 744 HB2 PHE 744 -8.741 -3.252 -5.293 680 HB3 PHE 744 HB3 PHE 744 -8.456 -2.346 -3.807 681 HD1 PHE 744 HD2 PHE 744 -10.883 -2.988 -6.531 682 HD2 PHE 744 HD1 PHE 744 -10.232 -1.124 -2.714 683 HE1 PHE 744 HE2 PHE 744 -13.322 -2.602 -6.300 684 HE2 PHE 744 HE1 PHE 744 -12.671 -0.739 -2.485 685 HZ PHE 744 HZ PHE 744 -14.215 -1.479 -4.278 686 H TYR 745 H TYR 745 -6.780 -0.410 -3.728 687 HA TYR 745 HA TYR 745 -8.421 1.664 -2.657 688 HB2 TYR 745 HB2 TYR 745 -5.583 0.786 -2.183 689 HB3 TYR 745 HB3 TYR 745 -6.202 2.269 -1.455 690 HD1 TYR 745 HD1 TYR 745 -7.547 -1.181 -2.091 691 HD2 TYR 745 HD2 TYR 745 -6.959 1.995 0.756 692 HE1 TYR 745 HE1 TYR 745 -8.728 -2.504 -0.359 693 HE2 TYR 745 HE2 TYR 745 -8.123 0.650 2.477 694 HH TYR 745 HH TYR 745 -9.019 -2.683 1.936 695 H GLN 746 H GLN 746 -6.437 1.531 -5.397 696 HA GLN 746 HA GLN 746 -5.546 4.257 -5.449 697 HB2 GLN 746 HB2 GLN 746 -5.319 3.796 -7.954 698 HB3 GLN 746 HB3 GLN 746 -4.374 2.757 -6.889 699 HG2 GLN 746 HG2 GLN 746 -5.534 0.901 -7.476 700 HG3 GLN 746 HG3 GLN 746 -7.082 1.734 -7.420 701 HE21 GLN 746 HE21 GLN 746 -4.645 0.508 -9.550 702 HE22 GLN 746 HE22 GLN 746 -5.279 1.174 -10.978 703 H GLN 747 H GLN 747 -8.512 2.675 -5.886 704 HA GLN 747 HA GLN 747 -9.727 5.037 -7.188 705 HB2 GLN 747 HB2 GLN 747 -11.079 2.359 -6.939 706 HB3 GLN 747 HB3 GLN 747 -11.373 3.642 -8.111 707 HG2 GLN 747 HG2 GLN 747 -8.630 2.795 -8.325 708 HG3 GLN 747 HG3 GLN 747 -9.670 1.379 -8.401 709 HE21 GLN 747 HE21 GLN 747 -8.096 2.858 -10.564 710 HE22 GLN 747 HE22 GLN 747 -9.263 3.179 -11.766 711 H ASN 748 H ASN 748 -10.134 2.611 -4.618 712 HA ASN 748 HA ASN 748 -12.412 3.883 -3.443 713 HB2 ASN 748 HB2 ASN 748 -11.616 1.443 -3.163 714 HB3 ASN 748 HB3 ASN 748 -10.497 2.084 -1.964 715 HD21 ASN 748 HD21 ASN 748 -11.990 3.959 -0.578 716 HD22 ASN 748 HD22 ASN 748 -13.366 3.234 0.100 717 H SER 749 H SER 749 -12.347 5.832 -2.534 718 HA SER 749 HA SER 749 -10.157 7.341 -1.828 719 HB2 SER 749 HB2 SER 749 -12.099 8.129 -0.013 720 HB3 SER 749 HB3 SER 749 -11.914 8.734 -1.656 721 HG SER 749 HG SER 749 -13.587 6.645 -0.666 722 H LEU 750 H LEU 750 -8.576 6.950 -0.429 723 HA LEU 750 HA LEU 750 -8.500 4.910 1.427 724 HB2 LEU 750 HB2 LEU 750 -7.056 7.565 1.498 725 HB3 LEU 750 HB3 LEU 750 -6.642 6.182 2.513 726 HG LEU 750 HG LEU 750 -6.557 6.337 -0.506 727 HD11 LEU 750 HD11 LEU 750 -4.617 7.288 0.710 728 HD12 LEU 750 HD12 LEU 750 -4.407 5.749 1.543 729 HD13 LEU 750 HD13 LEU 750 -4.179 5.847 -0.202 730 HD21 LEU 750 HD21 LEU 750 -6.534 3.995 1.362 731 HD22 LEU 750 HD22 LEU 750 -7.285 4.146 -0.227 732 HD23 LEU 750 HD23 LEU 750 -5.540 3.934 -0.092 733 H LYS 751 H LYS 751 -9.791 8.139 1.824 734 HA LYS 751 HA LYS 751 -9.991 8.370 4.577 735 HB2 LYS 751 HB2 LYS 751 -11.622 10.018 4.191 736 HB3 LYS 751 HB3 LYS 751 -10.656 10.023 2.717 737 HG2 LYS 751 HG2 LYS 751 -12.422 8.213 1.928 738 HG3 LYS 751 HG3 LYS 751 -13.432 8.980 3.153 739 HD2 LYS 751 HD2 LYS 751 -12.000 10.494 0.944 740 HD3 LYS 751 HD3 LYS 751 -13.690 9.992 0.863 741 HE2 LYS 751 HE2 LYS 751 -12.521 11.751 3.038 742 HE3 LYS 751 HE3 LYS 751 -13.426 12.349 1.645 743 HZ1 LYS 751 HZ1 LYS 751 -14.450 11.407 4.051 744 HZ2 LYS 751 HZ2 LYS 751 -15.323 11.859 2.665 745 HZ3 LYS 751 HZ3 LYS 751 -14.848 10.242 2.877 746 H ASP 752 H ASP 752 -11.647 6.189 2.481 747 HA ASP 752 HA ASP 752 -13.820 5.675 4.352 748 HB2 ASP 752 HB2 ASP 752 -13.116 4.072 1.893 749 HB3 ASP 752 HB3 ASP 752 -14.678 4.199 2.694 750 H CYS 753 H CYS 753 -10.737 4.276 3.471 751 HA CYS 753 HA CYS 753 -11.234 1.967 5.244 752 HB2 CYS 753 HB2 CYS 753 -9.138 2.475 3.130 753 HB3 CYS 753 HB3 CYS 753 -9.146 1.063 4.185 754 HG CYS 753 HG CYS 753 -10.463 0.494 1.955 755 H PHE 754 H PHE 754 -9.019 4.664 4.651 756 HA PHE 754 HA PHE 754 -7.260 3.924 6.825 757 HB2 PHE 754 HB2 PHE 754 -7.465 6.320 5.006 758 HB3 PHE 754 HB3 PHE 754 -6.288 6.235 6.312 759 HD1 PHE 754 HD2 PHE 754 -7.389 3.251 4.367 760 HD2 PHE 754 HD1 PHE 754 -4.330 6.217 4.912 761 HE1 PHE 754 HE2 PHE 754 -5.873 1.952 2.913 762 HE2 PHE 754 HE1 PHE 754 -2.820 4.917 3.456 763 HZ PHE 754 HZ PHE 754 -3.583 2.786 2.450 764 H LYS 755 H LYS 755 -7.767 7.261 6.890 765 HA LYS 755 HA LYS 755 -9.805 7.286 8.971 766 HB2 LYS 755 HB2 LYS 755 -7.841 6.604 10.225 767 HB3 LYS 755 HB3 LYS 755 -6.929 7.959 9.572 768 HG2 LYS 755 HG2 LYS 755 -8.446 9.545 10.680 769 HG3 LYS 755 HG3 LYS 755 -9.429 8.205 11.274 770 HD2 LYS 755 HD2 LYS 755 -8.098 8.133 13.083 771 HD3 LYS 755 HD3 LYS 755 -6.812 7.558 12.026 772 HE2 LYS 755 HE2 LYS 755 -7.395 10.422 12.828 773 HE3 LYS 755 HE3 LYS 755 -5.944 9.483 13.179 774 HZ1 LYS 755 HZ1 LYS 755 -6.154 9.370 10.460 775 HZ2 LYS 755 HZ2 LYS 755 -6.641 10.973 10.809 776 HZ3 LYS 755 HZ3 LYS 755 -5.113 10.393 11.322 777 H SER 756 H SER 756 -7.350 9.669 9.117 778 HA SER 756 HA SER 756 -9.181 11.717 8.252 779 HB2 SER 756 HB2 SER 756 -6.243 12.093 8.829 780 HB3 SER 756 HB3 SER 756 -7.549 13.261 9.014 781 HG SER 756 HG SER 756 -8.281 12.163 10.782 782 H LEU 757 H LEU 757 -8.122 9.627 6.377 783 HA LEU 757 HA LEU 757 -6.410 11.014 4.525 784 HB2 LEU 757 HB2 LEU 757 -7.646 8.332 4.748 785 HB3 LEU 757 HB3 LEU 757 -7.338 8.903 3.112 786 HG LEU 757 HG LEU 757 -5.454 7.603 4.293 787 HD11 LEU 757 HD11 LEU 757 -4.777 8.573 2.324 788 HD12 LEU 757 HD12 LEU 757 -5.235 10.193 2.840 789 HD13 LEU 757 HD13 LEU 757 -3.764 9.451 3.467 790 HD21 LEU 757 HD21 LEU 757 -5.859 9.261 6.350 791 HD22 LEU 757 HD22 LEU 757 -4.279 8.566 6.013 792 HD23 LEU 757 HD23 LEU 757 -4.648 10.207 5.487 793 H ASP 758 H ASP 758 -7.035 11.095 2.218 794 HA ASP 758 HA ASP 758 -9.739 11.309 1.406 795 HB2 ASP 758 HB2 ASP 758 -8.690 13.621 2.721 796 HB3 ASP 758 HB3 ASP 758 -8.858 14.004 1.010 797 H THR 759 H THR 759 -7.991 9.821 0.331 798 HA THR 759 HA THR 759 -7.557 10.844 -2.318 799 HB THR 759 HB THR 759 -5.604 11.813 -1.107 800 HG1 THR 759 HG1 THR 759 -4.499 11.430 -2.851 801 HG21 THR 759 HG21 THR 759 -5.518 9.132 -0.028 802 HG22 THR 759 HG22 THR 759 -3.992 9.507 -0.829 803 HG23 THR 759 HG23 THR 759 -4.593 10.546 0.459 804 H THR 760 H THR 760 -5.524 9.095 -3.079 805 HA THR 760 HA THR 760 -6.196 6.386 -2.262 806 HB THR 760 HB THR 760 -6.856 5.692 -4.570 807 HG1 THR 760 HG1 THR 760 -7.182 7.169 -6.075 808 HG21 THR 760 HG21 THR 760 -8.770 7.784 -3.572 809 HG22 THR 760 HG22 THR 760 -9.128 6.210 -4.278 810 HG23 THR 760 HG23 THR 760 -8.470 6.314 -2.647 811 H LEU 761 H LEU 761 -4.972 4.770 -3.606 812 HA LEU 761 HA LEU 761 -2.225 5.357 -3.723 813 HB2 LEU 761 HB2 LEU 761 -3.870 3.201 -5.096 814 HB3 LEU 761 HB3 LEU 761 -2.117 3.235 -5.115 815 HG LEU 761 HG LEU 761 -3.207 1.726 -3.368 816 HD11 LEU 761 HD11 LEU 761 -1.675 2.779 -1.501 817 HD12 LEU 761 HD12 LEU 761 -0.978 2.044 -2.946 818 HD13 LEU 761 HD13 LEU 761 -1.143 3.798 -2.834 819 HD21 LEU 761 HD21 LEU 761 -3.956 2.772 -1.296 820 HD22 LEU 761 HD22 LEU 761 -3.730 4.372 -1.995 821 HD23 LEU 761 HD23 LEU 761 -4.971 3.295 -2.634 822 H GLN 762 H GLN 762 -2.078 7.348 -4.869 823 HA GLN 762 HA GLN 762 -3.109 7.686 -7.505 824 HB2 GLN 762 HB2 GLN 762 -1.806 9.268 -5.500 825 HB3 GLN 762 HB3 GLN 762 -1.034 9.551 -7.058 826 HG2 GLN 762 HG2 GLN 762 -3.862 9.490 -7.485 827 HG3 GLN 762 HG3 GLN 762 -3.548 10.541 -6.104 828 HE21 GLN 762 HE21 GLN 762 -1.500 12.069 -6.565 829 HE22 GLN 762 HE22 GLN 762 -1.514 12.808 -8.091 830 H PHE 763 H PHE 763 0.320 7.617 -6.427 831 HA PHE 763 HA PHE 763 0.945 6.281 -8.996 832 HB2 PHE 763 HB2 PHE 763 2.310 8.729 -7.863 833 HB3 PHE 763 HB3 PHE 763 2.978 7.757 -9.174 834 HD1 PHE 763 HD1 PHE 763 1.618 7.459 -11.302 835 HD2 PHE 763 HD2 PHE 763 0.600 10.326 -8.270 836 HE1 PHE 763 HE1 PHE 763 0.197 8.677 -12.929 837 HE2 PHE 763 HE2 PHE 763 -0.821 11.542 -9.897 838 HZ PHE 763 HZ PHE 763 -1.024 10.718 -12.226 839 HA PRO 764 HA PRO 764 3.592 3.751 -6.519 840 HB2 PRO 764 HB2 PRO 764 5.162 2.690 -8.460 841 HB3 PRO 764 HB3 PRO 764 3.440 2.288 -8.317 842 HG2 PRO 764 HG2 PRO 764 4.797 4.146 -10.184 843 HG3 PRO 764 HG3 PRO 764 3.437 3.052 -10.469 844 HD2 PRO 764 HD2 PRO 764 3.183 5.777 -10.037 845 HD3 PRO 764 HD3 PRO 764 1.890 4.585 -9.775 846 H PHE 765 H PHE 765 6.273 3.177 -6.781 847 HA PHE 765 HA PHE 765 7.553 5.841 -6.729 848 HB2 PHE 765 HB2 PHE 765 8.757 5.308 -4.793 849 HB3 PHE 765 HB3 PHE 765 7.161 4.636 -4.474 850 HD1 PHE 765 HD1 PHE 765 6.759 2.163 -4.982 851 HD2 PHE 765 HD2 PHE 765 10.672 3.923 -4.814 852 HE1 PHE 765 HE1 PHE 765 7.759 -0.086 -4.685 853 HE2 PHE 765 HE2 PHE 765 11.672 1.675 -4.525 854 HZ PHE 765 HZ PHE 765 10.216 -0.329 -4.458 855 H LYS 766 H LYS 766 7.541 2.802 -8.177 856 HA LYS 766 HA LYS 766 10.403 2.903 -8.822 857 HB2 LYS 766 HB2 LYS 766 8.297 0.847 -9.506 858 HB3 LYS 766 HB3 LYS 766 10.013 0.718 -9.889 859 HG2 LYS 766 HG2 LYS 766 10.188 1.283 -7.250 860 HG3 LYS 766 HG3 LYS 766 8.639 0.450 -7.260 861 HD2 LYS 766 HD2 LYS 766 10.937 -0.760 -8.745 862 HD3 LYS 766 HD3 LYS 766 10.887 -0.903 -6.991 863 HE2 LYS 766 HE2 LYS 766 8.277 -1.515 -7.842 864 HE3 LYS 766 HE3 LYS 766 9.337 -2.341 -8.987 865 HZ1 LYS 766 HZ1 LYS 766 10.519 -2.787 -6.583 866 HZ2 LYS 766 HZ2 LYS 766 8.856 -2.893 -6.193 867 HZ3 LYS 766 HZ3 LYS 766 9.529 -3.888 -7.408 868 H GLU 767 H GLU 767 7.225 3.169 -10.341 869 HA GLU 767 HA GLU 767 6.730 3.464 -12.639 870 HB2 GLU 767 HB2 GLU 767 7.424 5.782 -11.076 871 HB3 GLU 767 HB3 GLU 767 7.778 6.081 -12.778 872 HG2 GLU 767 HG2 GLU 767 5.449 5.084 -13.249 873 HG3 GLU 767 HG3 GLU 767 5.148 5.285 -11.534 874 H1 ASP 338 H1 ASP 338 3.039 9.179 16.851 875 H2 ASP 338 H2 ASP 338 1.976 9.256 15.600 876 H3 ASP 338 H3 ASP 338 3.009 10.554 16.007 877 HA ASP 338 HA ASP 338 3.397 8.513 14.099 878 HB2 ASP 338 HB2 ASP 338 5.642 10.010 14.013 879 HB3 ASP 338 HB3 ASP 338 4.102 10.577 13.371 880 H THR 339 H THR 339 5.031 7.004 13.883 881 HA THR 339 HA THR 339 7.055 6.654 15.946 882 HB THR 339 HB THR 339 6.070 4.097 15.919 883 HG1 THR 339 HG1 THR 339 4.183 4.671 14.871 884 HG21 THR 339 HG21 THR 339 5.176 4.645 18.186 885 HG22 THR 339 HG22 THR 339 6.803 5.268 17.915 886 HG23 THR 339 HG23 THR 339 5.416 6.354 17.828 887 H GLU 340 H GLU 340 8.265 4.486 15.449 888 HA GLU 340 HA GLU 340 8.995 4.612 12.645 889 HB2 GLU 340 HB2 GLU 340 10.342 2.426 13.694 890 HB3 GLU 340 HB3 GLU 340 10.965 4.070 13.596 891 HG2 GLU 340 HG2 GLU 340 11.154 3.088 15.883 892 HG3 GLU 340 HG3 GLU 340 10.182 4.557 15.847 893 H VAL 341 H VAL 341 8.435 1.673 14.599 894 HA VAL 341 HA VAL 341 7.673 0.010 12.530 895 HB VAL 341 HB VAL 341 8.050 -0.555 15.000 896 HG11 VAL 341 HG11 VAL 341 6.136 -0.538 16.457 897 HG12 VAL 341 HG12 VAL 341 6.281 1.084 15.778 898 HG13 VAL 341 HG13 VAL 341 5.068 -0.033 15.149 899 HG21 VAL 341 HG21 VAL 341 6.114 -1.746 13.091 900 HG22 VAL 341 HG22 VAL 341 7.498 -2.480 13.901 901 HG23 VAL 341 HG23 VAL 341 5.969 -2.295 14.760 902 H PTR 342 H PTR 342 5.739 -0.576 11.577 903 HA PTR 342 HA PTR 342 3.912 1.453 10.946 904 HB2 PTR 342 HB2 PTR 342 2.791 -1.231 10.637 905 HB3 PTR 342 HB3 PTR 342 3.203 -0.038 9.405 906 HD1 PTR 342 HD1 PTR 342 4.013 -3.227 10.613 907 HD2 PTR 342 HD2 PTR 342 5.852 0.376 9.182 908 HE1 PTR 342 HE1 PTR 342 6.088 -4.491 10.094 909 HE2 PTR 342 HE2 PTR 342 7.918 -0.879 8.665 910 H GLU 343 H GLU 343 3.428 2.223 13.171 911 HA GLU 343 HA GLU 343 1.893 0.711 15.003 912 HB2 GLU 343 HB2 GLU 343 1.403 2.830 16.089 913 HB3 GLU 343 HB3 GLU 343 3.092 2.801 15.592 914 HG2 GLU 343 HG2 GLU 343 0.848 4.149 14.044 915 HG3 GLU 343 HG3 GLU 343 2.001 4.977 15.082 916 H SER 344 H SER 344 0.763 0.009 12.693 917 HA SER 344 HA SER 344 -1.127 0.431 11.237 918 HB2 SER 344 HB2 SER 344 -2.743 -1.002 12.135 919 HB3 SER 344 HB3 SER 344 -1.261 -1.507 12.941 920 HG SER 344 HG SER 344 -2.910 0.506 14.049 921 HA PRO 345 HA PRO 345 -2.403 4.541 12.983 922 HB2 PRO 345 HB2 PRO 345 -2.708 5.627 10.434 923 HB3 PRO 345 HB3 PRO 345 -1.241 5.730 11.424 924 HG2 PRO 345 HG2 PRO 345 -1.893 3.875 9.194 925 HG3 PRO 345 HG3 PRO 345 -0.355 4.655 9.605 926 HD2 PRO 345 HD2 PRO 345 -0.812 2.057 10.173 927 HD3 PRO 345 HD3 PRO 345 0.157 3.089 11.252 928 H PTR 346 H PTR 346 -3.824 2.639 10.331 929 HA PTR 346 HA PTR 346 -6.502 3.533 11.229 930 HB2 PTR 346 HB2 PTR 346 -5.887 2.815 8.373 931 HB3 PTR 346 HB3 PTR 346 -7.259 3.721 9.015 932 HD1 PTR 346 HD1 PTR 346 -4.668 4.285 6.993 933 HD2 PTR 346 HD2 PTR 346 -6.053 5.621 10.830 934 HE1 PTR 346 HE1 PTR 346 -3.393 6.409 6.727 935 HE2 PTR 346 HE2 PTR 346 -4.794 7.729 10.563 936 H ALA 347 H ALA 347 -8.230 2.108 10.922 937 HA ALA 347 HA ALA 347 -8.406 -0.384 9.873 938 HB1 ALA 347 HB1 ALA 347 -6.664 -1.448 10.936 939 HB2 ALA 347 HB2 ALA 347 -7.927 -1.720 12.137 940 HB3 ALA 347 HB3 ALA 347 -6.760 -0.417 12.363 941 H ASP 348 H ASP 348 -8.770 0.975 13.152 942 HA ASP 348 HA ASP 348 -11.686 0.764 12.880 943 HB2 ASP 348 HB2 ASP 348 -10.023 -0.534 15.041 944 HB3 ASP 348 HB3 ASP 348 -11.731 -0.161 15.268 945 HA PRO 349 HA PRO 349 -10.325 4.693 14.876 946 HB2 PRO 349 HB2 PRO 349 -11.713 6.337 13.116 947 HB3 PRO 349 HB3 PRO 349 -10.009 5.884 12.961 948 HG2 PRO 349 HG2 PRO 349 -12.278 5.055 11.370 949 HG3 PRO 349 HG3 PRO 349 -10.552 4.837 11.061 950 HD2 PRO 349 HD2 PRO 349 -12.458 2.880 12.009 951 HD3 PRO 349 HD3 PRO 349 -10.741 2.646 11.624 952 H GLU 350 H GLU 350 -11.897 3.531 16.395 953 HA GLU 350 HA GLU 350 -13.672 3.666 17.832 954 HB2 GLU 350 HB2 GLU 350 -13.804 6.393 16.551 955 HB3 GLU 350 HB3 GLU 350 -14.999 5.876 17.739 956 HG2 GLU 350 HG2 GLU 350 -13.517 6.638 19.286 957 HG3 GLU 350 HG3 GLU 350 -12.637 5.148 18.961 Start of MODEL 7 1 H1 GLY 661 H1 GLY 661 5.984 -13.958 -11.354 2 H2 GLY 661 H2 GLY 661 6.977 -13.627 -12.706 3 H3 GLY 661 H3 GLY 661 7.388 -14.884 -11.637 4 HA2 GLY 661 HA2 GLY 661 6.458 -15.951 -13.507 5 HA3 GLY 661 HA3 GLY 661 5.208 -15.965 -12.262 6 H HIS 662 H HIS 662 3.253 -15.272 -12.884 7 HA HIS 662 HA HIS 662 2.760 -12.917 -14.353 8 HB2 HIS 662 HB2 HIS 662 1.771 -14.084 -16.418 9 HB3 HIS 662 HB3 HIS 662 3.525 -13.939 -16.343 10 HD1 HIS 662 HD1 HIS 662 4.254 -16.060 -17.514 11 HD2 HIS 662 HD2 HIS 662 1.401 -16.791 -14.569 12 HE1 HIS 662 HE1 HIS 662 4.055 -18.580 -17.318 13 HE2 HIS 662 HE2 HIS 662 2.319 -19.040 -15.528 14 H MET 663 H MET 663 1.747 -13.833 -12.023 15 HA MET 663 HA MET 663 -1.097 -14.270 -12.723 16 HB2 MET 663 HB2 MET 663 0.558 -15.874 -10.774 17 HB3 MET 663 HB3 MET 663 -1.193 -15.731 -10.591 18 HG2 MET 663 HG2 MET 663 -1.487 -17.317 -12.157 19 HG3 MET 663 HG3 MET 663 -0.638 -16.314 -13.335 20 HE1 MET 663 HE1 MET 663 -0.380 -19.652 -11.175 21 HE2 MET 663 HE2 MET 663 -1.026 -19.368 -12.788 22 HE3 MET 663 HE3 MET 663 0.478 -20.278 -12.582 23 H GLN 664 H GLN 664 0.183 -14.366 -9.470 24 HA GLN 664 HA GLN 664 -1.077 -11.744 -8.950 25 HB2 GLN 664 HB2 GLN 664 -1.580 -14.119 -7.724 26 HB3 GLN 664 HB3 GLN 664 -0.319 -13.478 -6.672 27 HG2 GLN 664 HG2 GLN 664 -2.295 -12.610 -5.734 28 HG3 GLN 664 HG3 GLN 664 -1.696 -11.273 -6.711 29 HE21 GLN 664 HE21 GLN 664 -2.760 -11.007 -8.913 30 HE22 GLN 664 HE22 GLN 664 -4.355 -11.547 -9.110 31 H ASP 665 H ASP 665 1.668 -12.425 -9.985 32 HA ASP 665 HA ASP 665 3.704 -12.077 -8.160 33 HB2 ASP 665 HB2 ASP 665 3.581 -10.825 -10.910 34 HB3 ASP 665 HB3 ASP 665 5.026 -11.288 -10.011 35 H LEU 666 H LEU 666 4.590 -10.415 -7.058 36 HA LEU 666 HA LEU 666 3.159 -7.834 -7.165 37 HB2 LEU 666 HB2 LEU 666 4.871 -8.884 -4.903 38 HB3 LEU 666 HB3 LEU 666 3.743 -7.527 -4.863 39 HG LEU 666 HG LEU 666 2.972 -10.419 -5.376 40 HD11 LEU 666 HD11 LEU 666 3.079 -10.621 -3.134 41 HD12 LEU 666 HD12 LEU 666 3.373 -8.896 -2.922 42 HD13 LEU 666 HD13 LEU 666 1.721 -9.500 -3.056 43 HD21 LEU 666 HD21 LEU 666 1.294 -9.226 -6.427 44 HD22 LEU 666 HD22 LEU 666 0.669 -9.221 -4.780 45 HD23 LEU 666 HD23 LEU 666 1.514 -7.805 -5.407 46 H SER 667 H SER 667 6.322 -9.345 -7.214 47 HA SER 667 HA SER 667 7.905 -6.995 -7.078 48 HB2 SER 667 HB2 SER 667 8.708 -9.475 -8.567 49 HB3 SER 667 HB3 SER 667 9.706 -8.400 -7.583 50 HG SER 667 HG SER 667 9.321 -9.912 -6.131 51 H VAL 668 H VAL 668 5.852 -8.125 -9.519 52 HA VAL 668 HA VAL 668 7.397 -7.089 -11.747 53 HB VAL 668 HB VAL 668 5.472 -7.768 -13.098 54 HG11 VAL 668 HG11 VAL 668 7.113 -9.484 -12.486 55 HG12 VAL 668 HG12 VAL 668 6.256 -9.789 -10.975 56 HG13 VAL 668 HG13 VAL 668 5.495 -10.186 -12.516 57 HG21 VAL 668 HG21 VAL 668 3.813 -7.111 -11.228 58 HG22 VAL 668 HG22 VAL 668 3.444 -8.569 -12.148 59 HG23 VAL 668 HG23 VAL 668 4.153 -8.698 -10.540 60 H HIS 669 H HIS 669 5.807 -5.571 -9.367 61 HA HIS 669 HA HIS 669 4.590 -3.515 -11.100 62 HB2 HIS 669 HB2 HIS 669 4.363 -3.785 -8.101 63 HB3 HIS 669 HB3 HIS 669 3.393 -2.763 -9.159 64 HD1 HIS 669 HD1 HIS 669 2.416 -4.543 -11.305 65 HD2 HIS 669 HD2 HIS 669 2.779 -5.881 -7.383 66 HE1 HIS 669 HE1 HIS 669 0.797 -6.479 -11.056 67 HE2 HIS 669 HE2 HIS 669 0.910 -7.225 -8.619 68 H LEU 670 H LEU 670 4.658 -1.325 -9.561 69 HA LEU 670 HA LEU 670 7.516 -0.795 -9.078 70 HB2 LEU 670 HB2 LEU 670 6.817 1.635 -9.792 71 HB3 LEU 670 HB3 LEU 670 7.269 0.457 -10.999 72 HG LEU 670 HG LEU 670 4.448 1.141 -10.164 73 HD11 LEU 670 HD11 LEU 670 5.773 1.616 -12.827 74 HD12 LEU 670 HD12 LEU 670 4.280 2.321 -12.210 75 HD13 LEU 670 HD13 LEU 670 5.831 2.805 -11.527 76 HD21 LEU 670 HD21 LEU 670 5.562 -1.104 -11.662 77 HD22 LEU 670 HD22 LEU 670 3.915 -0.861 -11.075 78 HD23 LEU 670 HD23 LEU 670 4.412 -0.181 -12.623 79 H TRP 671 H TRP 671 4.570 -1.037 -7.675 80 HA TRP 671 HA TRP 671 5.153 1.154 -5.820 81 HB2 TRP 671 HB2 TRP 671 2.787 0.579 -4.935 82 HB3 TRP 671 HB3 TRP 671 2.928 1.446 -6.458 83 HD1 TRP 671 HD1 TRP 671 1.777 0.413 -8.479 84 HE1 TRP 671 HE1 TRP 671 0.641 -1.851 -8.982 85 HE3 TRP 671 HE3 TRP 671 3.029 -2.156 -4.242 86 HZ2 TRP 671 HZ2 TRP 671 0.345 -4.406 -7.757 87 HZ3 TRP 671 HZ3 TRP 671 2.306 -4.505 -3.940 88 HH2 TRP 671 HH2 TRP 671 0.960 -5.634 -5.691 89 H TYR 672 H TYR 672 5.396 -2.165 -6.244 90 HA TYR 672 HA TYR 672 5.174 -2.878 -3.429 91 HB2 TYR 672 HB2 TYR 672 4.436 -4.476 -5.143 92 HB3 TYR 672 HB3 TYR 672 6.059 -4.508 -5.826 93 HD1 TYR 672 HD2 TYR 672 4.961 -4.481 -2.239 94 HD2 TYR 672 HD1 TYR 672 6.876 -6.662 -5.402 95 HE1 TYR 672 HE2 TYR 672 5.622 -6.244 -0.628 96 HE2 TYR 672 HE1 TYR 672 7.528 -8.427 -3.794 97 HH TYR 672 HH TYR 672 7.317 -9.175 -1.710 98 H ALA 673 H ALA 673 6.759 -2.360 -2.086 99 HA ALA 673 HA ALA 673 9.519 -2.178 -3.104 100 HB1 ALA 673 HB1 ALA 673 8.601 -0.244 -1.851 101 HB2 ALA 673 HB2 ALA 673 9.995 -0.958 -1.039 102 HB3 ALA 673 HB3 ALA 673 8.364 -1.287 -0.447 103 H GLY 674 H GLY 674 7.455 -4.101 -1.123 104 HA2 GLY 674 HA2 GLY 674 7.797 -5.996 0.140 105 HA3 GLY 674 HA3 GLY 674 9.151 -6.297 -0.936 106 HA PRO 675 HA PRO 675 11.582 -6.120 2.784 107 HB2 PRO 675 HB2 PRO 675 14.050 -5.898 1.535 108 HB3 PRO 675 HB3 PRO 675 13.177 -7.420 1.791 109 HG2 PRO 675 HG2 PRO 675 13.344 -5.722 -0.647 110 HG3 PRO 675 HG3 PRO 675 13.345 -7.488 -0.497 111 HD2 PRO 675 HD2 PRO 675 11.136 -6.123 -1.273 112 HD3 PRO 675 HD3 PRO 675 11.028 -7.609 -0.299 113 H MET 676 H MET 676 10.384 -3.790 2.617 114 HA MET 676 HA MET 676 12.565 -1.780 2.744 115 HB2 MET 676 HB2 MET 676 10.907 -1.529 0.813 116 HB3 MET 676 HB3 MET 676 9.696 -1.145 2.037 117 HG2 MET 676 HG2 MET 676 10.541 0.938 2.367 118 HG3 MET 676 HG3 MET 676 12.205 0.354 2.385 119 HE1 MET 676 HE1 MET 676 13.781 1.052 0.906 120 HE2 MET 676 HE2 MET 676 13.448 -0.450 0.044 121 HE3 MET 676 HE3 MET 676 13.664 1.056 -0.851 122 H GLU 677 H GLU 677 11.882 0.157 4.099 123 HA GLU 677 HA GLU 677 10.474 -0.722 6.550 124 HB2 GLU 677 HB2 GLU 677 12.045 0.919 7.692 125 HB3 GLU 677 HB3 GLU 677 12.810 -0.533 7.040 126 HG2 GLU 677 HG2 GLU 677 13.881 0.610 5.360 127 HG3 GLU 677 HG3 GLU 677 12.583 1.787 5.205 128 H ARG 678 H ARG 678 9.735 1.217 7.882 129 HA ARG 678 HA ARG 678 7.850 2.721 6.478 130 HB2 ARG 678 HB2 ARG 678 7.676 2.363 8.887 131 HB3 ARG 678 HB3 ARG 678 9.142 3.304 9.160 132 HG2 ARG 678 HG2 ARG 678 8.098 5.336 8.489 133 HG3 ARG 678 HG3 ARG 678 6.744 4.485 7.749 134 HD2 ARG 678 HD2 ARG 678 6.903 3.716 10.514 135 HD3 ARG 678 HD3 ARG 678 6.942 5.475 10.413 136 HE ARG 678 HE ARG 678 4.910 4.374 8.722 137 HH11 ARG 678 HH21 ARG 678 5.671 5.175 12.028 138 HH12 ARG 678 HH22 ARG 678 3.976 5.389 12.470 139 HH21 ARG 678 HH11 ARG 678 2.763 4.629 9.349 140 HH22 ARG 678 HH12 ARG 678 2.371 5.046 11.000 141 H ALA 679 H ALA 679 10.861 3.956 7.926 142 HA ALA 679 HA ALA 679 10.750 6.496 6.714 143 HB1 ALA 679 HB1 ALA 679 12.517 6.813 8.056 144 HB2 ALA 679 HB2 ALA 679 13.467 5.649 7.127 145 HB3 ALA 679 HB3 ALA 679 12.469 5.098 8.473 146 H GLY 680 H GLY 680 12.033 3.418 5.670 147 HA2 GLY 680 HA2 GLY 680 13.491 4.393 3.404 148 HA3 GLY 680 HA3 GLY 680 12.988 2.727 3.664 149 H ALA 681 H ALA 681 10.241 3.040 3.865 150 HA ALA 681 HA ALA 681 9.435 3.043 1.171 151 HB1 ALA 681 HB1 ALA 681 7.116 3.133 2.133 152 HB2 ALA 681 HB2 ALA 681 7.840 3.385 3.723 153 HB3 ALA 681 HB3 ALA 681 8.136 1.883 2.846 154 H GLU 682 H GLU 682 8.962 5.536 3.698 155 HA GLU 682 HA GLU 682 7.773 7.376 1.849 156 HB2 GLU 682 HB2 GLU 682 7.925 9.011 3.691 157 HB3 GLU 682 HB3 GLU 682 7.185 7.497 4.194 158 HG2 GLU 682 HG2 GLU 682 9.473 6.779 5.015 159 HG3 GLU 682 HG3 GLU 682 10.005 8.429 4.737 160 H SER 683 H SER 683 10.972 6.489 2.449 161 HA SER 683 HA SER 683 12.355 8.888 2.125 162 HB2 SER 683 HB2 SER 683 14.235 7.566 1.498 163 HB3 SER 683 HB3 SER 683 13.309 6.576 2.625 164 HG SER 683 HG SER 683 12.597 5.330 0.986 165 H ILE 684 H ILE 684 10.979 6.683 -0.229 166 HA ILE 684 HA ILE 684 11.766 8.344 -2.492 167 HB ILE 684 HB ILE 684 9.834 6.043 -2.654 168 HG12 ILE 684 HG12 ILE 684 12.487 5.084 -3.062 169 HG13 ILE 684 HG13 ILE 684 12.474 5.906 -1.505 170 HG21 ILE 684 HG21 ILE 684 10.405 6.033 -4.864 171 HG22 ILE 684 HG22 ILE 684 10.913 7.691 -4.541 172 HG23 ILE 684 HG23 ILE 684 12.100 6.386 -4.531 173 HD11 ILE 684 HD11 ILE 684 11.774 3.361 -1.671 174 HD12 ILE 684 HD12 ILE 684 10.904 4.451 -0.592 175 HD13 ILE 684 HD13 ILE 684 10.223 4.035 -2.165 176 H LEU 685 H LEU 685 8.756 7.258 -0.951 177 HA LEU 685 HA LEU 685 6.952 8.724 -2.524 178 HB2 LEU 685 HB2 LEU 685 6.907 7.363 0.110 179 HB3 LEU 685 HB3 LEU 685 5.641 8.553 -0.169 180 HG LEU 685 HG LEU 685 4.859 7.395 -2.109 181 HD11 LEU 685 HD11 LEU 685 6.061 5.309 -2.885 182 HD12 LEU 685 HD12 LEU 685 6.943 6.811 -3.178 183 HD13 LEU 685 HD13 LEU 685 7.400 5.770 -1.827 184 HD21 LEU 685 HD21 LEU 685 4.719 4.960 -1.145 185 HD22 LEU 685 HD22 LEU 685 5.532 5.664 0.253 186 HD23 LEU 685 HD23 LEU 685 3.962 6.282 -0.258 187 H ALA 686 H ALA 686 8.522 9.626 0.582 188 HA ALA 686 HA ALA 686 7.160 12.095 0.840 189 HB1 ALA 686 HB1 ALA 686 8.449 11.021 2.673 190 HB2 ALA 686 HB2 ALA 686 8.900 12.706 2.419 191 HB3 ALA 686 HB3 ALA 686 9.942 11.415 1.817 192 H ASN 687 H ASN 687 10.066 11.116 -0.876 193 HA ASN 687 HA ASN 687 10.838 13.765 -1.665 194 HB2 ASN 687 HB2 ASN 687 12.392 11.798 -1.581 195 HB3 ASN 687 HB3 ASN 687 11.541 11.120 -2.964 196 HD21 ASN 687 HD21 ASN 687 12.676 14.464 -2.225 197 HD22 ASN 687 HD22 ASN 687 13.531 14.634 -3.679 198 H ARG 688 H ARG 688 9.051 11.091 -3.176 199 HA ARG 688 HA ARG 688 8.599 12.318 -5.681 200 HB2 ARG 688 HB2 ARG 688 8.098 9.867 -4.608 201 HB3 ARG 688 HB3 ARG 688 6.477 10.554 -4.651 202 HG2 ARG 688 HG2 ARG 688 6.399 10.034 -6.841 203 HG3 ARG 688 HG3 ARG 688 7.628 11.271 -7.113 204 HD2 ARG 688 HD2 ARG 688 9.398 9.624 -6.697 205 HD3 ARG 688 HD3 ARG 688 8.184 8.393 -6.387 206 HE ARG 688 HE ARG 688 7.884 9.649 -8.978 207 HH11 ARG 688 HH21 ARG 688 9.472 7.151 -7.200 208 HH12 ARG 688 HH22 ARG 688 9.809 6.191 -8.598 209 HH21 ARG 688 HH11 ARG 688 8.329 8.404 -10.783 210 HH22 ARG 688 HH12 ARG 688 9.198 6.896 -10.634 211 H SER 689 H SER 689 6.210 12.722 -6.423 212 HA SER 689 HA SER 689 5.214 14.945 -4.856 213 HB2 SER 689 HB2 SER 689 5.244 15.107 -7.290 214 HB3 SER 689 HB3 SER 689 4.200 13.692 -7.418 215 HG SER 689 HG SER 689 2.528 14.870 -6.833 216 H ASP 690 H ASP 690 2.803 15.128 -4.518 217 HA ASP 690 HA ASP 690 1.927 13.131 -2.744 218 HB2 ASP 690 HB2 ASP 690 0.886 15.628 -3.835 219 HB3 ASP 690 HB3 ASP 690 -0.374 14.434 -3.534 220 H GLY 691 H GLY 691 0.538 11.447 -2.926 221 HA2 GLY 691 HA2 GLY 691 -1.147 10.170 -4.076 222 HA3 GLY 691 HA3 GLY 691 -0.573 10.842 -5.601 223 H THR 692 H THR 692 2.213 10.401 -4.272 224 HA THR 692 HA THR 692 2.788 7.953 -5.631 225 HB THR 692 HB THR 692 4.563 9.309 -3.585 226 HG1 THR 692 HG1 THR 692 4.140 10.941 -4.971 227 HG21 THR 692 HG21 THR 692 5.428 8.005 -6.133 228 HG22 THR 692 HG22 THR 692 6.294 8.157 -4.607 229 HG23 THR 692 HG23 THR 692 4.985 6.986 -4.763 230 H PHE 693 H PHE 693 2.793 5.901 -4.854 231 HA PHE 693 HA PHE 693 2.707 5.527 -1.932 232 HB2 PHE 693 HB2 PHE 693 0.773 4.100 -2.050 233 HB3 PHE 693 HB3 PHE 693 0.370 5.630 -2.827 234 HD1 PHE 693 HD2 PHE 693 1.241 2.080 -3.431 235 HD2 PHE 693 HD1 PHE 693 -0.032 5.778 -5.197 236 HE1 PHE 693 HE2 PHE 693 0.676 0.886 -5.528 237 HE2 PHE 693 HE1 PHE 693 -0.597 4.581 -7.294 238 HZ PHE 693 HZ PHE 693 -0.239 2.136 -7.461 239 H LEU 694 H LEU 694 2.906 3.240 -1.306 240 HA LEU 694 HA LEU 694 3.887 1.350 -3.218 241 HB2 LEU 694 HB2 LEU 694 6.172 1.237 -2.654 242 HB3 LEU 694 HB3 LEU 694 5.850 2.957 -2.853 243 HG LEU 694 HG LEU 694 5.368 2.890 -0.278 244 HD11 LEU 694 HD11 LEU 694 5.589 0.789 0.570 245 HD12 LEU 694 HD12 LEU 694 6.490 0.223 -0.837 246 HD13 LEU 694 HD13 LEU 694 7.322 1.091 0.453 247 HD21 LEU 694 HD21 LEU 694 8.256 2.494 -0.986 248 HD22 LEU 694 HD22 LEU 694 7.375 3.852 -1.682 249 HD23 LEU 694 HD23 LEU 694 7.519 3.701 0.065 250 H VAL 695 H VAL 695 4.636 -0.653 -2.179 251 HA VAL 695 HA VAL 695 3.471 -1.008 0.519 252 HB VAL 695 HB VAL 695 3.262 -2.978 -1.768 253 HG11 VAL 695 HG11 VAL 695 2.075 -2.897 1.024 254 HG12 VAL 695 HG12 VAL 695 1.655 -4.079 -0.213 255 HG13 VAL 695 HG13 VAL 695 3.292 -4.033 0.442 256 HG21 VAL 695 HG21 VAL 695 1.713 -0.623 -1.126 257 HG22 VAL 695 HG22 VAL 695 1.493 -1.761 -2.455 258 HG23 VAL 695 HG23 VAL 695 0.726 -2.067 -0.897 259 H ARG 696 H ARG 696 4.693 -2.106 1.941 260 HA ARG 696 HA ARG 696 7.171 -3.369 0.904 261 HB2 ARG 696 HB2 ARG 696 8.275 -2.669 2.977 262 HB3 ARG 696 HB3 ARG 696 7.636 -1.280 2.099 263 HG2 ARG 696 HG2 ARG 696 5.807 -1.038 3.590 264 HG3 ARG 696 HG3 ARG 696 6.054 -2.643 4.282 265 HD2 ARG 696 HD2 ARG 696 8.135 -0.455 4.475 266 HD3 ARG 696 HD3 ARG 696 6.882 -0.676 5.695 267 HE ARG 696 HE ARG 696 9.190 -2.408 5.222 268 HH11 ARG 696 HH21 ARG 696 6.055 -2.038 6.632 269 HH12 ARG 696 HH22 ARG 696 6.279 -3.318 7.777 270 HH21 ARG 696 HH11 ARG 696 9.432 -4.091 6.664 271 HH22 ARG 696 HH12 ARG 696 8.147 -4.523 7.757 272 H GLN 697 H GLN 697 8.144 -4.941 2.406 273 HA GLN 697 HA GLN 697 6.078 -6.585 3.753 274 HB2 GLN 697 HB2 GLN 697 6.704 -7.743 1.758 275 HB3 GLN 697 HB3 GLN 697 8.410 -7.391 2.005 276 HG2 GLN 697 HG2 GLN 697 7.953 -9.722 2.607 277 HG3 GLN 697 HG3 GLN 697 8.394 -8.815 4.046 278 HE21 GLN 697 HE21 GLN 697 5.974 -10.801 2.663 279 HE22 GLN 697 HE22 GLN 697 4.799 -10.614 3.882 280 H ARG 698 H ARG 698 6.809 -7.897 5.458 281 HA ARG 698 HA ARG 698 8.389 -8.628 7.078 282 HB2 ARG 698 HB2 ARG 698 10.260 -7.404 5.903 283 HB3 ARG 698 HB3 ARG 698 9.773 -5.957 6.781 284 HG2 ARG 698 HG2 ARG 698 9.928 -7.588 8.879 285 HG3 ARG 698 HG3 ARG 698 11.033 -8.468 7.819 286 HD2 ARG 698 HD2 ARG 698 12.312 -6.860 9.127 287 HD3 ARG 698 HD3 ARG 698 12.287 -6.345 7.439 288 HE ARG 698 HE ARG 698 10.178 -5.217 9.115 289 HH11 ARG 698 HH21 ARG 698 13.366 -4.884 7.830 290 HH12 ARG 698 HH22 ARG 698 13.389 -3.165 7.992 291 HH21 ARG 698 HH11 ARG 698 10.210 -3.011 9.323 292 HH22 ARG 698 HH12 ARG 698 11.600 -2.103 8.837 293 H VAL 699 H VAL 699 7.211 -8.686 8.811 294 HA VAL 699 HA VAL 699 6.575 -6.189 10.220 295 HB VAL 699 HB VAL 699 4.672 -6.981 8.693 296 HG11 VAL 699 HG11 VAL 699 4.888 -9.383 9.144 297 HG12 VAL 699 HG12 VAL 699 4.509 -9.114 10.845 298 HG13 VAL 699 HG13 VAL 699 3.293 -8.807 9.612 299 HG21 VAL 699 HG21 VAL 699 4.668 -5.712 11.144 300 HG22 VAL 699 HG22 VAL 699 3.263 -5.884 10.089 301 HG23 VAL 699 HG23 VAL 699 3.521 -7.032 11.402 302 H LYS 700 H LYS 700 4.972 -7.389 12.199 303 HA LYS 700 HA LYS 700 6.122 -9.716 13.351 304 HB2 LYS 700 HB2 LYS 700 7.562 -8.840 15.005 305 HB3 LYS 700 HB3 LYS 700 8.014 -7.979 13.536 306 HG2 LYS 700 HG2 LYS 700 5.897 -6.504 14.769 307 HG3 LYS 700 HG3 LYS 700 7.071 -6.886 16.021 308 HD2 LYS 700 HD2 LYS 700 7.857 -4.858 15.114 309 HD3 LYS 700 HD3 LYS 700 8.848 -6.078 14.311 310 HE2 LYS 700 HE2 LYS 700 8.169 -4.854 12.473 311 HE3 LYS 700 HE3 LYS 700 6.852 -6.021 12.552 312 HZ1 LYS 700 HZ1 LYS 700 6.576 -3.619 14.172 313 HZ2 LYS 700 HZ2 LYS 700 6.446 -3.417 12.486 314 HZ3 LYS 700 HZ3 LYS 700 5.369 -4.486 13.302 315 H ASP 701 H ASP 701 4.272 -6.807 13.570 316 HA ASP 701 HA ASP 701 3.065 -7.398 16.124 317 HB2 ASP 701 HB2 ASP 701 1.519 -5.445 15.203 318 HB3 ASP 701 HB3 ASP 701 3.147 -5.121 15.788 319 H ALA 702 H ALA 702 0.890 -6.357 13.655 320 HA ALA 702 HA ALA 702 -0.320 -9.047 13.454 321 HB1 ALA 702 HB1 ALA 702 -1.575 -8.091 15.241 322 HB2 ALA 702 HB2 ALA 702 -2.582 -7.922 13.803 323 HB3 ALA 702 HB3 ALA 702 -1.687 -6.532 14.423 324 H ALA 703 H ALA 703 0.567 -8.961 11.320 325 HA ALA 703 HA ALA 703 -1.204 -8.266 9.296 326 HB1 ALA 703 HB1 ALA 703 -0.973 -6.041 9.096 327 HB2 ALA 703 HB2 ALA 703 0.696 -6.320 8.600 328 HB3 ALA 703 HB3 ALA 703 0.320 -6.020 10.294 329 H GLU 704 H GLU 704 0.456 -7.591 7.212 330 HA GLU 704 HA GLU 704 2.636 -9.592 7.235 331 HB2 GLU 704 HB2 GLU 704 0.171 -9.840 5.816 332 HB3 GLU 704 HB3 GLU 704 1.432 -9.513 4.630 333 HG2 GLU 704 HG2 GLU 704 2.339 -11.425 6.633 334 HG3 GLU 704 HG3 GLU 704 0.881 -11.985 5.819 335 H PHE 705 H PHE 705 1.375 -7.714 4.519 336 HA PHE 705 HA PHE 705 3.976 -6.424 4.209 337 HB2 PHE 705 HB2 PHE 705 1.466 -6.242 2.522 338 HB3 PHE 705 HB3 PHE 705 3.028 -5.543 2.110 339 HD1 PHE 705 HD1 PHE 705 1.249 -8.745 2.734 340 HD2 PHE 705 HD2 PHE 705 4.795 -6.868 1.217 341 HE1 PHE 705 HE1 PHE 705 1.986 -10.903 1.777 342 HE2 PHE 705 HE2 PHE 705 5.525 -9.033 0.253 343 HZ PHE 705 HZ PHE 705 4.119 -11.051 0.533 344 H ALA 706 H ALA 706 3.796 -4.015 3.496 345 HA ALA 706 HA ALA 706 1.853 -2.592 5.204 346 HB1 ALA 706 HB1 ALA 706 4.401 -1.225 5.190 347 HB2 ALA 706 HB2 ALA 706 4.583 -2.871 5.815 348 HB3 ALA 706 HB3 ALA 706 3.431 -1.758 6.562 349 H ILE 707 H ILE 707 0.878 -0.961 4.207 350 HA ILE 707 HA ILE 707 1.847 -0.181 1.534 351 HB ILE 707 HB ILE 707 -0.766 0.622 2.821 352 HG12 ILE 707 HG12 ILE 707 -1.575 -1.340 1.249 353 HG13 ILE 707 HG13 ILE 707 0.063 -1.942 1.494 354 HG21 ILE 707 HG21 ILE 707 0.421 0.659 0.058 355 HG22 ILE 707 HG22 ILE 707 -1.326 0.518 0.248 356 HG23 ILE 707 HG23 ILE 707 -0.479 1.920 0.902 357 HD11 ILE 707 HD11 ILE 707 -2.156 -2.135 3.270 358 HD12 ILE 707 HD12 ILE 707 -0.514 -2.719 3.522 359 HD13 ILE 707 HD13 ILE 707 -0.962 -1.091 4.028 360 H SER 708 H SER 708 2.543 1.806 1.038 361 HA SER 708 HA SER 708 2.367 3.917 3.111 362 HB2 SER 708 HB2 SER 708 4.774 3.125 1.468 363 HB3 SER 708 HB3 SER 708 4.670 4.627 2.376 364 HG SER 708 HG SER 708 4.528 1.955 3.369 365 H ILE 709 H ILE 709 1.372 5.711 2.325 366 HA ILE 709 HA ILE 709 1.522 6.228 -0.599 367 HB ILE 709 HB ILE 709 -0.823 7.141 1.034 368 HG12 ILE 709 HG12 ILE 709 -1.923 4.976 0.024 369 HG13 ILE 709 HG13 ILE 709 -0.270 4.351 0.070 370 HG21 ILE 709 HG21 ILE 709 -0.028 7.351 -1.660 371 HG22 ILE 709 HG22 ILE 709 -1.339 6.165 -1.648 372 HG23 ILE 709 HG23 ILE 709 -1.603 7.779 -0.976 373 HD11 ILE 709 HD11 ILE 709 -0.151 4.465 2.382 374 HD12 ILE 709 HD12 ILE 709 -1.354 5.750 2.488 375 HD13 ILE 709 HD13 ILE 709 -1.856 4.086 2.169 376 H LYS 710 H LYS 710 1.992 8.251 -1.247 377 HA LYS 710 HA LYS 710 2.706 10.206 0.819 378 HB2 LYS 710 HB2 LYS 710 4.397 9.907 -0.861 379 HB3 LYS 710 HB3 LYS 710 3.215 10.050 -2.159 380 HG2 LYS 710 HG2 LYS 710 4.275 12.162 -2.109 381 HG3 LYS 710 HG3 LYS 710 2.756 12.416 -1.257 382 HD2 LYS 710 HD2 LYS 710 3.774 12.602 0.809 383 HD3 LYS 710 HD3 LYS 710 5.173 11.621 0.346 384 HE2 LYS 710 HE2 LYS 710 4.593 14.363 -0.812 385 HE3 LYS 710 HE3 LYS 710 5.651 14.096 0.576 386 HZ1 LYS 710 HZ1 LYS 710 6.486 12.256 -1.296 387 HZ2 LYS 710 HZ2 LYS 710 6.196 13.669 -2.219 388 HZ3 LYS 710 HZ3 LYS 710 7.276 13.727 -0.892 389 H TYR 711 H TYR 711 0.935 11.266 1.510 390 HA TYR 711 HA TYR 711 -0.599 12.800 -0.469 391 HB2 TYR 711 HB2 TYR 711 -1.998 10.878 -0.242 392 HB3 TYR 711 HB3 TYR 711 -1.781 10.841 1.505 393 HD1 TYR 711 HD1 TYR 711 -2.774 13.417 -1.052 394 HD2 TYR 711 HD2 TYR 711 -3.628 11.527 2.705 395 HE1 TYR 711 HE1 TYR 711 -4.761 14.878 -0.770 396 HE2 TYR 711 HE2 TYR 711 -5.616 12.993 2.991 397 HH TYR 711 HH TYR 711 -7.185 14.277 1.404 398 H ASN 712 H ASN 712 -0.290 14.803 0.157 399 HA ASN 712 HA ASN 712 -0.592 16.687 1.504 400 HB2 ASN 712 HB2 ASN 712 -2.170 15.308 2.944 401 HB3 ASN 712 HB3 ASN 712 -0.765 14.850 3.902 402 HD21 ASN 712 HD21 ASN 712 -0.320 16.189 5.635 403 HD22 ASN 712 HD22 ASN 712 -0.839 17.811 5.756 404 H VAL 713 H VAL 713 1.776 15.931 0.560 405 HA VAL 713 HA VAL 713 4.055 15.861 0.887 406 HB VAL 713 HB VAL 713 4.943 17.704 2.191 407 HG11 VAL 713 HG11 VAL 713 3.709 19.529 1.138 408 HG12 VAL 713 HG12 VAL 713 3.792 18.164 0.023 409 HG13 VAL 713 HG13 VAL 713 2.304 18.485 0.916 410 HG21 VAL 713 HG21 VAL 713 3.364 17.319 4.169 411 HG22 VAL 713 HG22 VAL 713 3.635 19.003 3.719 412 HG23 VAL 713 HG23 VAL 713 2.144 18.193 3.242 413 H GLU 714 H GLU 714 2.652 13.840 2.260 414 HA GLU 714 HA GLU 714 4.668 13.088 4.205 415 HB2 GLU 714 HB2 GLU 714 3.067 12.595 5.999 416 HB3 GLU 714 HB3 GLU 714 3.022 14.315 5.597 417 HG2 GLU 714 HG2 GLU 714 1.091 13.707 4.006 418 HG3 GLU 714 HG3 GLU 714 1.033 12.164 4.851 419 H VAL 715 H VAL 715 4.597 10.818 4.698 420 HA VAL 715 HA VAL 715 3.116 9.285 2.656 421 HB VAL 715 HB VAL 715 5.582 8.438 4.160 422 HG11 VAL 715 HG11 VAL 715 4.244 6.609 3.196 423 HG12 VAL 715 HG12 VAL 715 4.234 7.429 1.633 424 HG13 VAL 715 HG13 VAL 715 5.747 6.809 2.295 425 HG21 VAL 715 HG21 VAL 715 5.195 9.986 1.607 426 HG22 VAL 715 HG22 VAL 715 6.339 10.283 2.914 427 HG23 VAL 715 HG23 VAL 715 6.600 8.944 1.801 428 H LYS 716 H LYS 716 1.390 8.243 3.395 429 HA LYS 716 HA LYS 716 1.175 7.576 6.239 430 HB2 LYS 716 HB2 LYS 716 -0.878 6.877 4.152 431 HB3 LYS 716 HB3 LYS 716 -1.121 7.281 5.851 432 HG2 LYS 716 HG2 LYS 716 0.137 9.543 4.769 433 HG3 LYS 716 HG3 LYS 716 -1.027 9.050 3.536 434 HD2 LYS 716 HD2 LYS 716 -2.852 9.188 5.059 435 HD3 LYS 716 HD3 LYS 716 -1.779 9.267 6.454 436 HE2 LYS 716 HE2 LYS 716 -1.017 11.418 4.789 437 HE3 LYS 716 HE3 LYS 716 -2.782 11.434 4.823 438 HZ1 LYS 716 HZ1 LYS 716 -1.108 12.411 6.779 439 HZ2 LYS 716 HZ2 LYS 716 -2.796 12.079 6.933 440 HZ3 LYS 716 HZ3 LYS 716 -1.663 10.906 7.393 441 H HIS 717 H HIS 717 1.957 5.718 6.975 442 HA HIS 717 HA HIS 717 2.196 3.396 5.180 443 HB2 HIS 717 HB2 HIS 717 3.430 3.702 7.904 444 HB3 HIS 717 HB3 HIS 717 3.881 2.580 6.624 445 HD1 HIS 717 HD1 HIS 717 5.035 3.625 4.461 446 HD2 HIS 717 HD2 HIS 717 4.604 6.241 7.710 447 HE1 HIS 717 HE1 HIS 717 6.678 5.534 4.102 448 HE2 HIS 717 HE2 HIS 717 6.473 7.120 6.099 449 H ILE 718 H ILE 718 1.020 1.626 5.463 450 HA ILE 718 HA ILE 718 -0.313 1.185 8.070 451 HB ILE 718 HB ILE 718 -1.645 0.881 5.372 452 HG12 ILE 718 HG12 ILE 718 -2.773 2.668 7.442 453 HG13 ILE 718 HG13 ILE 718 -1.256 3.222 6.732 454 HG21 ILE 718 HG21 ILE 718 -2.708 -0.733 6.638 455 HG22 ILE 718 HG22 ILE 718 -2.345 0.073 8.165 456 HG23 ILE 718 HG23 ILE 718 -3.643 0.678 7.135 457 HD11 ILE 718 HD11 ILE 718 -2.392 2.572 4.464 458 HD12 ILE 718 HD12 ILE 718 -3.890 2.700 5.396 459 HD13 ILE 718 HD13 ILE 718 -2.821 4.098 5.246 460 H LYS 719 H LYS 719 -0.413 -0.875 8.738 461 HA LYS 719 HA LYS 719 1.200 -2.851 7.350 462 HB2 LYS 719 HB2 LYS 719 0.519 -4.214 9.443 463 HB3 LYS 719 HB3 LYS 719 1.576 -2.827 9.669 464 HG2 LYS 719 HG2 LYS 719 -0.054 -1.567 10.706 465 HG3 LYS 719 HG3 LYS 719 -1.365 -2.317 9.795 466 HD2 LYS 719 HD2 LYS 719 -0.224 -4.389 11.348 467 HD3 LYS 719 HD3 LYS 719 -0.354 -2.999 12.423 468 HE2 LYS 719 HE2 LYS 719 -2.477 -3.890 12.677 469 HE3 LYS 719 HE3 LYS 719 -2.771 -2.808 11.314 470 HZ1 LYS 719 HZ1 LYS 719 -2.144 -5.726 11.170 471 HZ2 LYS 719 HZ2 LYS 719 -3.676 -4.988 10.836 472 HZ3 LYS 719 HZ3 LYS 719 -2.327 -4.689 9.817 473 H ILE 720 H ILE 720 0.373 -4.219 5.889 474 HA ILE 720 HA ILE 720 -2.497 -4.556 5.628 475 HB ILE 720 HB ILE 720 -0.252 -4.794 3.921 476 HG12 ILE 720 HG12 ILE 720 -3.056 -5.602 3.186 477 HG13 ILE 720 HG13 ILE 720 -2.687 -3.932 3.615 478 HG21 ILE 720 HG21 ILE 720 -0.541 -6.973 2.899 479 HG22 ILE 720 HG22 ILE 720 -0.223 -7.214 4.615 480 HG23 ILE 720 HG23 ILE 720 -1.866 -7.361 3.993 481 HD11 ILE 720 HD11 ILE 720 -0.632 -4.705 1.855 482 HD12 ILE 720 HD12 ILE 720 -2.122 -5.334 1.143 483 HD13 ILE 720 HD13 ILE 720 -1.973 -3.614 1.502 484 H MET 721 H MET 721 -3.649 -6.481 5.873 485 HA MET 721 HA MET 721 -2.365 -8.472 7.641 486 HB2 MET 721 HB2 MET 721 -4.491 -7.226 8.326 487 HB3 MET 721 HB3 MET 721 -5.313 -8.189 7.105 488 HG2 MET 721 HG2 MET 721 -5.379 -9.155 9.454 489 HG3 MET 721 HG3 MET 721 -4.771 -10.246 8.213 490 HE1 MET 721 HE1 MET 721 -4.685 -9.800 11.384 491 HE2 MET 721 HE2 MET 721 -3.834 -11.304 11.045 492 HE3 MET 721 HE3 MET 721 -3.060 -10.044 12.014 493 H THR 722 H THR 722 -2.957 -10.756 7.287 494 HA THR 722 HA THR 722 -3.317 -11.332 4.403 495 HB THR 722 HB THR 722 -1.097 -11.950 4.979 496 HG1 THR 722 HG1 THR 722 -2.880 -14.146 5.137 497 HG21 THR 722 HG21 THR 722 -1.046 -11.901 7.338 498 HG22 THR 722 HG22 THR 722 -2.380 -13.047 7.480 499 HG23 THR 722 HG23 THR 722 -0.792 -13.600 6.948 500 H ALA 723 H ALA 723 -5.616 -11.072 5.755 501 HA ALA 723 HA ALA 723 -6.642 -13.308 7.111 502 HB1 ALA 723 HB1 ALA 723 -8.043 -11.280 5.352 503 HB2 ALA 723 HB2 ALA 723 -7.802 -11.173 7.096 504 HB3 ALA 723 HB3 ALA 723 -8.865 -12.413 6.428 505 H GLU 724 H GLU 724 -6.967 -15.334 6.422 506 HA GLU 724 HA GLU 724 -7.135 -17.152 5.002 507 HB2 GLU 724 HB2 GLU 724 -8.929 -15.403 3.318 508 HB3 GLU 724 HB3 GLU 724 -9.038 -17.140 3.594 509 HG2 GLU 724 HG2 GLU 724 -9.794 -16.838 5.838 510 HG3 GLU 724 HG3 GLU 724 -9.354 -15.132 5.832 511 H GLY 725 H GLY 725 -5.191 -14.861 4.341 512 HA2 GLY 725 HA2 GLY 725 -3.395 -14.997 2.790 513 HA3 GLY 725 HA3 GLY 725 -4.440 -15.889 1.690 514 H LEU 726 H LEU 726 -6.339 -13.458 2.788 515 HA LEU 726 HA LEU 726 -5.946 -11.881 0.358 516 HB2 LEU 726 HB2 LEU 726 -7.930 -11.376 2.586 517 HB3 LEU 726 HB3 LEU 726 -8.003 -10.788 0.927 518 HG LEU 726 HG LEU 726 -8.144 -13.713 1.718 519 HD11 LEU 726 HD11 LEU 726 -10.529 -13.535 1.227 520 HD12 LEU 726 HD12 LEU 726 -10.105 -12.362 2.474 521 HD13 LEU 726 HD13 LEU 726 -10.344 -11.831 0.810 522 HD21 LEU 726 HD21 LEU 726 -8.903 -13.972 -0.639 523 HD22 LEU 726 HD22 LEU 726 -8.610 -12.252 -0.905 524 HD23 LEU 726 HD23 LEU 726 -7.261 -13.331 -0.545 525 H TYR 727 H TYR 727 -5.404 -9.690 0.324 526 HA TYR 727 HA TYR 727 -4.061 -8.756 2.773 527 HB2 TYR 727 HB2 TYR 727 -3.675 -7.955 -0.114 528 HB3 TYR 727 HB3 TYR 727 -2.842 -7.210 1.247 529 HD1 TYR 727 HD2 TYR 727 -3.045 -10.246 2.602 530 HD2 TYR 727 HD1 TYR 727 -1.248 -8.473 -0.872 531 HE1 TYR 727 HE2 TYR 727 -1.360 -12.048 2.556 532 HE2 TYR 727 HE1 TYR 727 0.447 -10.288 -0.909 533 HH TYR 727 HH TYR 727 0.790 -12.525 1.732 534 H ARG 728 H ARG 728 -4.651 -6.980 3.802 535 HA ARG 728 HA ARG 728 -6.621 -5.149 2.608 536 HB2 ARG 728 HB2 ARG 728 -7.581 -5.336 5.145 537 HB3 ARG 728 HB3 ARG 728 -8.232 -6.244 3.787 538 HG2 ARG 728 HG2 ARG 728 -6.786 -8.151 4.325 539 HG3 ARG 728 HG3 ARG 728 -6.036 -7.234 5.630 540 HD2 ARG 728 HD2 ARG 728 -8.912 -7.199 5.925 541 HD3 ARG 728 HD3 ARG 728 -8.342 -8.862 5.781 542 HE ARG 728 HE ARG 728 -6.835 -7.203 7.653 543 HH11 ARG 728 HH21 ARG 728 -9.480 -9.366 7.191 544 HH12 ARG 728 HH22 ARG 728 -9.510 -9.877 8.839 545 HH21 ARG 728 HH11 ARG 728 -6.888 -7.808 9.787 546 HH22 ARG 728 HH12 ARG 728 -8.055 -9.003 10.307 547 H ILE 729 H ILE 729 -6.360 -3.084 3.197 548 HA ILE 729 HA ILE 729 -4.011 -2.370 4.758 549 HB ILE 729 HB ILE 729 -6.027 -0.487 3.542 550 HG12 ILE 729 HG12 ILE 729 -3.758 -1.996 2.226 551 HG13 ILE 729 HG13 ILE 729 -5.463 -2.023 1.780 552 HG21 ILE 729 HG21 ILE 729 -3.764 0.774 3.224 553 HG22 ILE 729 HG22 ILE 729 -4.487 0.724 4.831 554 HG23 ILE 729 HG23 ILE 729 -3.153 -0.357 4.429 555 HD11 ILE 729 HD11 ILE 729 -4.768 -0.472 0.249 556 HD12 ILE 729 HD12 ILE 729 -5.002 0.626 1.609 557 HD13 ILE 729 HD13 ILE 729 -3.388 0.025 1.230 558 H THR 730 H THR 730 -7.514 -2.109 4.978 559 HA THR 730 HA THR 730 -7.237 -0.845 7.640 560 HB THR 730 HB THR 730 -8.685 0.457 6.327 561 HG1 THR 730 HG1 THR 730 -9.741 -1.168 8.248 562 HG21 THR 730 HG21 THR 730 -9.761 -2.181 5.362 563 HG22 THR 730 HG22 THR 730 -10.704 -0.702 5.192 564 HG23 THR 730 HG23 THR 730 -9.128 -0.839 4.413 565 H GLU 731 H GLU 731 -7.558 -3.767 6.243 566 HA GLU 731 HA GLU 731 -7.989 -5.826 7.081 567 HB2 GLU 731 HB2 GLU 731 -8.738 -4.499 9.680 568 HB3 GLU 731 HB3 GLU 731 -8.184 -6.156 9.434 569 HG2 GLU 731 HG2 GLU 731 -6.195 -4.641 8.222 570 HG3 GLU 731 HG3 GLU 731 -6.619 -3.677 9.631 571 H LYS 732 H LYS 732 -10.141 -3.500 6.519 572 HA LYS 732 HA LYS 732 -12.523 -5.083 7.215 573 HB2 LYS 732 HB2 LYS 732 -12.553 -2.363 5.913 574 HB3 LYS 732 HB3 LYS 732 -13.800 -3.125 6.905 575 HG2 LYS 732 HG2 LYS 732 -11.071 -2.324 7.936 576 HG3 LYS 732 HG3 LYS 732 -12.513 -1.332 8.105 577 HD2 LYS 732 HD2 LYS 732 -12.846 -4.133 8.987 578 HD3 LYS 732 HD3 LYS 732 -11.696 -3.198 9.942 579 HE2 LYS 732 HE2 LYS 732 -14.474 -2.218 9.256 580 HE3 LYS 732 HE3 LYS 732 -14.086 -3.068 10.756 581 HZ1 LYS 732 HZ1 LYS 732 -13.526 -1.086 11.581 582 HZ2 LYS 732 HZ2 LYS 732 -12.140 -1.139 10.548 583 HZ3 LYS 732 HZ3 LYS 732 -13.565 -0.353 10.031 584 H LYS 733 H LYS 733 -11.021 -3.465 4.406 585 HA LYS 733 HA LYS 733 -12.509 -5.329 2.651 586 HB2 LYS 733 HB2 LYS 733 -13.204 -3.097 2.130 587 HB3 LYS 733 HB3 LYS 733 -11.540 -2.509 2.134 588 HG2 LYS 733 HG2 LYS 733 -12.573 -2.932 -0.178 589 HG3 LYS 733 HG3 LYS 733 -11.012 -3.696 0.121 590 HD2 LYS 733 HD2 LYS 733 -12.036 -5.840 0.513 591 HD3 LYS 733 HD3 LYS 733 -13.647 -5.130 0.573 592 HE2 LYS 733 HE2 LYS 733 -13.869 -5.357 -1.654 593 HE3 LYS 733 HE3 LYS 733 -12.394 -4.431 -1.927 594 HZ1 LYS 733 HZ1 LYS 733 -12.769 -7.335 -1.772 595 HZ2 LYS 733 HZ2 LYS 733 -11.754 -6.429 -2.787 596 HZ3 LYS 733 HZ3 LYS 733 -11.295 -6.712 -1.168 597 H ALA 734 H ALA 734 -11.168 -6.970 2.280 598 HA ALA 734 HA ALA 734 -8.331 -6.444 1.710 599 HB1 ALA 734 HB1 ALA 734 -9.230 -8.203 3.424 600 HB2 ALA 734 HB2 ALA 734 -7.893 -8.642 2.362 601 HB3 ALA 734 HB3 ALA 734 -9.531 -9.186 1.990 602 H PHE 735 H PHE 735 -7.463 -8.292 0.182 603 HA PHE 735 HA PHE 735 -9.168 -8.817 -2.121 604 HB2 PHE 735 HB2 PHE 735 -7.070 -6.733 -2.086 605 HB3 PHE 735 HB3 PHE 735 -7.033 -7.824 -3.469 606 HD1 PHE 735 HD2 PHE 735 -9.170 -8.167 -4.818 607 HD2 PHE 735 HD1 PHE 735 -8.721 -5.051 -1.899 608 HE1 PHE 735 HE2 PHE 735 -11.095 -6.960 -5.812 609 HE2 PHE 735 HE1 PHE 735 -10.642 -3.842 -2.893 610 HZ PHE 735 HZ PHE 735 -11.833 -4.797 -4.850 611 H ARG 736 H ARG 736 -7.890 -10.058 -3.815 612 HA ARG 736 HA ARG 736 -6.949 -12.440 -2.873 613 HB2 ARG 736 HB2 ARG 736 -6.735 -10.997 -5.428 614 HB3 ARG 736 HB3 ARG 736 -5.516 -12.245 -5.178 615 HG2 ARG 736 HG2 ARG 736 -7.115 -13.677 -5.906 616 HG3 ARG 736 HG3 ARG 736 -7.793 -13.507 -4.286 617 HD2 ARG 736 HD2 ARG 736 -9.544 -13.059 -5.897 618 HD3 ARG 736 HD3 ARG 736 -9.114 -11.550 -5.102 619 HE ARG 736 HE ARG 736 -8.327 -10.729 -7.124 620 HH11 ARG 736 HH21 ARG 736 -8.783 -14.161 -7.299 621 HH12 ARG 736 HH22 ARG 736 -8.287 -14.272 -8.950 622 HH21 ARG 736 HH11 ARG 736 -7.620 -10.882 -9.240 623 HH22 ARG 736 HH12 ARG 736 -7.652 -12.429 -10.049 624 H GLY 737 H GLY 737 -4.841 -9.769 -3.977 625 HA2 GLY 737 HA2 GLY 737 -2.778 -10.696 -2.088 626 HA3 GLY 737 HA3 GLY 737 -2.353 -10.550 -3.791 627 H LEU 738 H LEU 738 -0.839 -8.905 -3.469 628 HA LEU 738 HA LEU 738 -1.576 -6.484 -2.077 629 HB2 LEU 738 HB2 LEU 738 0.852 -7.470 -3.515 630 HB3 LEU 738 HB3 LEU 738 0.679 -5.748 -3.228 631 HG LEU 738 HG LEU 738 0.773 -7.967 -1.173 632 HD11 LEU 738 HD11 LEU 738 2.549 -5.739 -2.056 633 HD12 LEU 738 HD12 LEU 738 2.533 -6.143 -0.339 634 HD13 LEU 738 HD13 LEU 738 2.966 -7.371 -1.529 635 HD21 LEU 738 HD21 LEU 738 0.609 -5.866 0.406 636 HD22 LEU 738 HD22 LEU 738 -0.222 -5.134 -0.967 637 HD23 LEU 738 HD23 LEU 738 -0.866 -6.595 -0.218 638 H THR 739 H THR 739 -0.767 -7.357 -5.414 639 HA THR 739 HA THR 739 -1.246 -4.963 -6.684 640 HB THR 739 HB THR 739 -2.188 -7.599 -7.833 641 HG1 THR 739 HG1 THR 739 -0.228 -8.242 -7.406 642 HG21 THR 739 HG21 THR 739 -1.044 -5.036 -8.957 643 HG22 THR 739 HG22 THR 739 -1.155 -6.525 -9.899 644 HG23 THR 739 HG23 THR 739 -2.621 -5.757 -9.286 645 H GLU 740 H GLU 740 -3.636 -7.563 -6.213 646 HA GLU 740 HA GLU 740 -5.868 -6.113 -7.118 647 HB2 GLU 740 HB2 GLU 740 -5.754 -8.368 -5.104 648 HB3 GLU 740 HB3 GLU 740 -7.208 -7.805 -5.923 649 HG2 GLU 740 HG2 GLU 740 -5.246 -8.276 -7.936 650 HG3 GLU 740 HG3 GLU 740 -5.235 -9.673 -6.864 651 H LEU 741 H LEU 741 -4.343 -6.250 -3.972 652 HA LEU 741 HA LEU 741 -6.496 -4.873 -2.630 653 HB2 LEU 741 HB2 LEU 741 -4.983 -6.517 -1.519 654 HB3 LEU 741 HB3 LEU 741 -3.651 -5.384 -1.722 655 HG LEU 741 HG LEU 741 -4.870 -5.408 0.550 656 HD11 LEU 741 HD11 LEU 741 -3.603 -3.398 -0.911 657 HD12 LEU 741 HD12 LEU 741 -5.048 -2.631 -0.252 658 HD13 LEU 741 HD13 LEU 741 -3.896 -3.419 0.824 659 HD21 LEU 741 HD21 LEU 741 -6.921 -4.146 0.708 660 HD22 LEU 741 HD22 LEU 741 -6.863 -3.743 -1.005 661 HD23 LEU 741 HD23 LEU 741 -7.160 -5.406 -0.502 662 H VAL 742 H VAL 742 -3.366 -4.017 -4.008 663 HA VAL 742 HA VAL 742 -3.589 -1.238 -3.115 664 HB VAL 742 HB VAL 742 -1.552 -2.684 -4.812 665 HG11 VAL 742 HG11 VAL 742 -0.726 -0.699 -5.413 666 HG12 VAL 742 HG12 VAL 742 -2.044 0.118 -4.575 667 HG13 VAL 742 HG13 VAL 742 -0.551 -0.255 -3.712 668 HG21 VAL 742 HG21 VAL 742 -1.022 -1.500 -2.124 669 HG22 VAL 742 HG22 VAL 742 -1.928 -3.011 -2.197 670 HG23 VAL 742 HG23 VAL 742 -0.309 -2.921 -2.886 671 H GLU 743 H GLU 743 -4.093 -3.105 -6.050 672 HA GLU 743 HA GLU 743 -4.329 -0.733 -7.697 673 HB2 GLU 743 HB2 GLU 743 -4.929 -3.639 -8.267 674 HB3 GLU 743 HB3 GLU 743 -4.989 -2.344 -9.462 675 HG2 GLU 743 HG2 GLU 743 -2.521 -2.863 -7.784 676 HG3 GLU 743 HG3 GLU 743 -2.788 -3.672 -9.325 677 H PHE 744 H PHE 744 -6.220 -1.709 -5.347 678 HA PHE 744 HA PHE 744 -8.734 -1.112 -6.787 679 HB2 PHE 744 HB2 PHE 744 -8.522 -3.355 -5.565 680 HB3 PHE 744 HB3 PHE 744 -8.557 -2.419 -4.072 681 HD1 PHE 744 HD2 PHE 744 -10.460 -3.327 -7.114 682 HD2 PHE 744 HD1 PHE 744 -10.585 -1.342 -3.307 683 HE1 PHE 744 HE2 PHE 744 -12.932 -3.189 -7.266 684 HE2 PHE 744 HE1 PHE 744 -13.056 -1.207 -3.458 685 HZ PHE 744 HZ PHE 744 -14.228 -2.130 -5.437 686 H TYR 745 H TYR 745 -6.861 -0.513 -3.837 687 HA TYR 745 HA TYR 745 -8.610 1.478 -2.791 688 HB2 TYR 745 HB2 TYR 745 -5.756 0.702 -2.254 689 HB3 TYR 745 HB3 TYR 745 -6.432 2.160 -1.532 690 HD1 TYR 745 HD1 TYR 745 -7.564 -1.371 -2.162 691 HD2 TYR 745 HD2 TYR 745 -7.297 1.887 0.643 692 HE1 TYR 745 HE1 TYR 745 -8.678 -2.758 -0.432 693 HE2 TYR 745 HE2 TYR 745 -8.400 0.486 2.361 694 HH TYR 745 HH TYR 745 -9.195 -2.929 1.765 695 H GLN 746 H GLN 746 -6.486 1.477 -5.441 696 HA GLN 746 HA GLN 746 -5.621 4.183 -5.442 697 HB2 GLN 746 HB2 GLN 746 -5.420 3.794 -7.963 698 HB3 GLN 746 HB3 GLN 746 -4.492 2.707 -6.929 699 HG2 GLN 746 HG2 GLN 746 -5.721 0.890 -7.512 700 HG3 GLN 746 HG3 GLN 746 -7.236 1.784 -7.525 701 HE21 GLN 746 HE21 GLN 746 -4.635 0.590 -9.531 702 HE22 GLN 746 HE22 GLN 746 -5.226 1.216 -10.993 703 H GLN 747 H GLN 747 -8.625 2.662 -6.052 704 HA GLN 747 HA GLN 747 -9.758 5.134 -7.218 705 HB2 GLN 747 HB2 GLN 747 -11.240 2.526 -7.137 706 HB3 GLN 747 HB3 GLN 747 -11.365 3.844 -8.300 707 HG2 GLN 747 HG2 GLN 747 -8.692 2.933 -8.453 708 HG3 GLN 747 HG3 GLN 747 -9.692 1.485 -8.408 709 HE21 GLN 747 HE21 GLN 747 -8.162 2.773 -10.697 710 HE22 GLN 747 HE22 GLN 747 -9.336 2.982 -11.916 711 H ASN 748 H ASN 748 -10.155 2.670 -4.716 712 HA ASN 748 HA ASN 748 -12.490 3.811 -3.547 713 HB2 ASN 748 HB2 ASN 748 -11.700 1.443 -3.237 714 HB3 ASN 748 HB3 ASN 748 -10.416 2.067 -2.208 715 HD21 ASN 748 HD21 ASN 748 -11.244 3.473 -0.298 716 HD22 ASN 748 HD22 ASN 748 -12.692 2.965 0.452 717 H SER 749 H SER 749 -12.459 5.848 -2.829 718 HA SER 749 HA SER 749 -10.361 7.432 -2.045 719 HB2 SER 749 HB2 SER 749 -11.940 8.862 -0.987 720 HB3 SER 749 HB3 SER 749 -12.798 8.095 -2.318 721 HG SER 749 HG SER 749 -12.817 6.712 0.091 722 H LEU 750 H LEU 750 -8.814 6.939 -0.648 723 HA LEU 750 HA LEU 750 -8.881 5.070 1.371 724 HB2 LEU 750 HB2 LEU 750 -7.266 7.623 1.255 725 HB3 LEU 750 HB3 LEU 750 -6.939 6.277 2.348 726 HG LEU 750 HG LEU 750 -6.977 6.128 -0.679 727 HD11 LEU 750 HD11 LEU 750 -4.814 6.724 -0.578 728 HD12 LEU 750 HD12 LEU 750 -4.938 6.911 1.170 729 HD13 LEU 750 HD13 LEU 750 -4.490 5.352 0.480 730 HD21 LEU 750 HD21 LEU 750 -5.753 3.854 0.214 731 HD22 LEU 750 HD22 LEU 750 -6.972 4.098 1.468 732 HD23 LEU 750 HD23 LEU 750 -7.462 3.952 -0.222 733 H LYS 751 H LYS 751 -10.051 8.377 1.490 734 HA LYS 751 HA LYS 751 -10.205 8.831 4.222 735 HB2 LYS 751 HB2 LYS 751 -11.867 10.448 3.747 736 HB3 LYS 751 HB3 LYS 751 -10.854 10.390 2.309 737 HG2 LYS 751 HG2 LYS 751 -12.603 8.560 1.530 738 HG3 LYS 751 HG3 LYS 751 -13.648 9.373 2.694 739 HD2 LYS 751 HD2 LYS 751 -12.155 10.763 0.444 740 HD3 LYS 751 HD3 LYS 751 -13.863 10.331 0.398 741 HE2 LYS 751 HE2 LYS 751 -12.615 12.138 2.493 742 HE3 LYS 751 HE3 LYS 751 -13.469 12.716 1.061 743 HZ1 LYS 751 HZ1 LYS 751 -14.532 11.289 3.405 744 HZ2 LYS 751 HZ2 LYS 751 -15.133 12.676 2.629 745 HZ3 LYS 751 HZ3 LYS 751 -15.328 11.152 1.911 746 H ASP 752 H ASP 752 -11.873 6.477 2.352 747 HA ASP 752 HA ASP 752 -13.967 6.109 4.368 748 HB2 ASP 752 HB2 ASP 752 -15.087 5.520 2.516 749 HB3 ASP 752 HB3 ASP 752 -13.609 5.458 1.569 750 H CYS 753 H CYS 753 -11.310 4.215 2.927 751 HA CYS 753 HA CYS 753 -11.569 2.111 4.896 752 HB2 CYS 753 HB2 CYS 753 -9.471 2.645 2.782 753 HB3 CYS 753 HB3 CYS 753 -9.495 1.222 3.821 754 HG CYS 753 HG CYS 753 -11.458 1.780 1.501 755 H PHE 754 H PHE 754 -9.394 4.853 4.317 756 HA PHE 754 HA PHE 754 -7.682 4.108 6.545 757 HB2 PHE 754 HB2 PHE 754 -7.751 6.471 4.671 758 HB3 PHE 754 HB3 PHE 754 -6.603 6.350 5.997 759 HD1 PHE 754 HD2 PHE 754 -7.711 3.270 4.284 760 HD2 PHE 754 HD1 PHE 754 -4.709 6.341 4.414 761 HE1 PHE 754 HE2 PHE 754 -6.240 1.894 2.858 762 HE2 PHE 754 HE1 PHE 754 -3.255 4.970 2.984 763 HZ PHE 754 HZ PHE 754 -4.005 2.742 2.200 764 H LYS 755 H LYS 755 -8.042 7.466 6.546 765 HA LYS 755 HA LYS 755 -10.177 7.591 8.532 766 HB2 LYS 755 HB2 LYS 755 -8.286 6.908 9.892 767 HB3 LYS 755 HB3 LYS 755 -7.313 8.220 9.239 768 HG2 LYS 755 HG2 LYS 755 -8.830 9.878 10.233 769 HG3 LYS 755 HG3 LYS 755 -9.883 8.586 10.811 770 HD2 LYS 755 HD2 LYS 755 -8.651 8.508 12.686 771 HD3 LYS 755 HD3 LYS 755 -7.315 7.900 11.713 772 HE2 LYS 755 HE2 LYS 755 -7.904 10.778 12.450 773 HE3 LYS 755 HE3 LYS 755 -6.476 9.830 12.864 774 HZ1 LYS 755 HZ1 LYS 755 -5.559 10.708 11.036 775 HZ2 LYS 755 HZ2 LYS 755 -6.587 9.707 10.138 776 HZ3 LYS 755 HZ3 LYS 755 -7.063 11.314 10.459 777 H SER 756 H SER 756 -7.705 9.945 8.732 778 HA SER 756 HA SER 756 -9.463 11.995 7.739 779 HB2 SER 756 HB2 SER 756 -6.546 12.339 8.439 780 HB3 SER 756 HB3 SER 756 -7.833 13.540 8.517 781 HG SER 756 HG SER 756 -8.647 12.562 10.303 782 H LEU 757 H LEU 757 -8.445 9.883 5.905 783 HA LEU 757 HA LEU 757 -6.606 11.212 4.112 784 HB2 LEU 757 HB2 LEU 757 -8.011 8.575 4.203 785 HB3 LEU 757 HB3 LEU 757 -7.399 9.144 2.655 786 HG LEU 757 HG LEU 757 -5.855 7.697 4.178 787 HD11 LEU 757 HD11 LEU 757 -4.047 9.737 3.542 788 HD12 LEU 757 HD12 LEU 757 -4.486 8.359 2.537 789 HD13 LEU 757 HD13 LEU 757 -5.350 9.886 2.363 790 HD21 LEU 757 HD21 LEU 757 -5.177 10.378 5.367 791 HD22 LEU 757 HD22 LEU 757 -6.330 9.299 6.151 792 HD23 LEU 757 HD23 LEU 757 -4.669 8.775 5.896 793 H ASP 758 H ASP 758 -7.244 11.125 1.715 794 HA ASP 758 HA ASP 758 -9.928 11.517 0.909 795 HB2 ASP 758 HB2 ASP 758 -8.701 13.794 2.138 796 HB3 ASP 758 HB3 ASP 758 -8.900 14.131 0.417 797 H THR 759 H THR 759 -7.781 10.015 0.085 798 HA THR 759 HA THR 759 -7.543 10.841 -2.694 799 HB THR 759 HB THR 759 -5.585 11.920 -1.595 800 HG1 THR 759 HG1 THR 759 -4.263 11.249 -3.166 801 HG21 THR 759 HG21 THR 759 -5.087 10.508 0.246 802 HG22 THR 759 HG22 THR 759 -5.069 9.060 -0.758 803 HG23 THR 759 HG23 THR 759 -3.764 10.234 -0.884 804 H THR 760 H THR 760 -5.472 9.056 -3.332 805 HA THR 760 HA THR 760 -6.131 6.418 -2.320 806 HB THR 760 HB THR 760 -6.863 5.507 -4.487 807 HG1 THR 760 HG1 THR 760 -7.086 6.736 -6.203 808 HG21 THR 760 HG21 THR 760 -8.510 6.354 -2.753 809 HG22 THR 760 HG22 THR 760 -8.644 7.820 -3.725 810 HG23 THR 760 HG23 THR 760 -9.124 6.264 -4.401 811 H LEU 761 H LEU 761 -5.008 4.713 -3.752 812 HA LEU 761 HA LEU 761 -2.235 5.222 -3.837 813 HB2 LEU 761 HB2 LEU 761 -3.925 3.075 -5.163 814 HB3 LEU 761 HB3 LEU 761 -2.171 3.065 -5.175 815 HG LEU 761 HG LEU 761 -3.210 1.612 -3.399 816 HD11 LEU 761 HD11 LEU 761 -1.016 2.101 -2.897 817 HD12 LEU 761 HD12 LEU 761 -1.315 3.838 -2.797 818 HD13 LEU 761 HD13 LEU 761 -1.834 2.779 -1.489 819 HD21 LEU 761 HD21 LEU 761 -5.095 3.152 -2.845 820 HD22 LEU 761 HD22 LEU 761 -4.181 2.631 -1.435 821 HD23 LEU 761 HD23 LEU 761 -3.932 4.244 -2.092 822 H GLN 762 H GLN 762 -2.133 7.220 -5.008 823 HA GLN 762 HA GLN 762 -3.077 7.493 -7.677 824 HB2 GLN 762 HB2 GLN 762 -1.836 9.119 -5.669 825 HB3 GLN 762 HB3 GLN 762 -1.012 9.367 -7.205 826 HG2 GLN 762 HG2 GLN 762 -3.815 9.308 -7.739 827 HG3 GLN 762 HG3 GLN 762 -3.563 10.368 -6.354 828 HE21 GLN 762 HE21 GLN 762 -1.475 11.879 -6.744 829 HE22 GLN 762 HE22 GLN 762 -1.435 12.616 -8.271 830 H PHE 763 H PHE 763 0.315 7.472 -6.500 831 HA PHE 763 HA PHE 763 1.027 6.078 -9.021 832 HB2 PHE 763 HB2 PHE 763 2.368 8.519 -7.849 833 HB3 PHE 763 HB3 PHE 763 3.094 7.522 -9.109 834 HD1 PHE 763 HD1 PHE 763 1.907 7.251 -11.317 835 HD2 PHE 763 HD2 PHE 763 0.638 10.082 -8.348 836 HE1 PHE 763 HE1 PHE 763 0.581 8.454 -13.030 837 HE2 PHE 763 HE2 PHE 763 -0.690 11.283 -10.061 838 HZ PHE 763 HZ PHE 763 -0.717 10.471 -12.402 839 HA PRO 764 HA PRO 764 3.520 3.497 -6.439 840 HB2 PRO 764 HB2 PRO 764 5.274 2.530 -8.268 841 HB3 PRO 764 HB3 PRO 764 3.555 2.087 -8.285 842 HG2 PRO 764 HG2 PRO 764 5.016 4.074 -9.946 843 HG3 PRO 764 HG3 PRO 764 3.765 2.918 -10.412 844 HD2 PRO 764 HD2 PRO 764 3.270 5.580 -9.956 845 HD3 PRO 764 HD3 PRO 764 2.047 4.304 -9.755 846 H PHE 765 H PHE 765 6.249 2.939 -6.643 847 HA PHE 765 HA PHE 765 7.488 5.606 -6.321 848 HB2 PHE 765 HB2 PHE 765 8.546 4.997 -4.346 849 HB3 PHE 765 HB3 PHE 765 6.966 4.242 -4.180 850 HD1 PHE 765 HD1 PHE 765 6.686 1.811 -4.639 851 HD2 PHE 765 HD2 PHE 765 10.543 3.687 -4.521 852 HE1 PHE 765 HE1 PHE 765 7.759 -0.409 -4.386 853 HE2 PHE 765 HE2 PHE 765 11.618 1.473 -4.268 854 HZ PHE 765 HZ PHE 765 10.226 -0.578 -4.197 855 H LYS 766 H LYS 766 7.722 2.424 -7.699 856 HA LYS 766 HA LYS 766 10.578 2.694 -8.232 857 HB2 LYS 766 HB2 LYS 766 8.645 0.711 -9.439 858 HB3 LYS 766 HB3 LYS 766 10.399 0.609 -9.425 859 HG2 LYS 766 HG2 LYS 766 9.842 0.927 -6.753 860 HG3 LYS 766 HG3 LYS 766 8.472 -0.036 -7.286 861 HD2 LYS 766 HD2 LYS 766 11.008 -0.976 -8.401 862 HD3 LYS 766 HD3 LYS 766 10.977 -1.016 -6.642 863 HE2 LYS 766 HE2 LYS 766 8.453 -1.987 -7.566 864 HE3 LYS 766 HE3 LYS 766 9.714 -2.821 -8.476 865 HZ1 LYS 766 HZ1 LYS 766 8.980 -3.082 -5.710 866 HZ2 LYS 766 HZ2 LYS 766 9.958 -4.095 -6.683 867 HZ3 LYS 766 HZ3 LYS 766 10.645 -2.754 -5.907 868 H GLU 767 H GLU 767 7.545 3.452 -9.730 869 HA GLU 767 HA GLU 767 7.676 3.694 -12.328 870 HB2 GLU 767 HB2 GLU 767 6.555 5.296 -10.280 871 HB3 GLU 767 HB3 GLU 767 7.303 6.402 -11.427 872 HG2 GLU 767 HG2 GLU 767 6.118 4.767 -13.177 873 HG3 GLU 767 HG3 GLU 767 5.021 4.531 -11.826 874 H1 ASP 338 H1 ASP 338 13.314 6.175 15.728 875 H2 ASP 338 H2 ASP 338 14.718 6.713 14.883 876 H3 ASP 338 H3 ASP 338 14.567 6.381 16.547 877 HA ASP 338 HA ASP 338 15.318 4.633 14.392 878 HB2 ASP 338 HB2 ASP 338 16.088 3.337 16.478 879 HB3 ASP 338 HB3 ASP 338 16.782 4.944 16.252 880 H THR 339 H THR 339 14.076 3.386 17.375 881 HA THR 339 HA THR 339 12.695 1.225 16.290 882 HB THR 339 HB THR 339 11.894 2.416 18.926 883 HG1 THR 339 HG1 THR 339 14.152 2.681 18.808 884 HG21 THR 339 HG21 THR 339 10.940 0.365 18.932 885 HG22 THR 339 HG22 THR 339 11.949 -0.213 17.607 886 HG23 THR 339 HG23 THR 339 12.571 -0.219 19.257 887 H GLU 340 H GLU 340 11.590 2.794 14.579 888 HA GLU 340 HA GLU 340 8.945 3.675 15.581 889 HB2 GLU 340 HB2 GLU 340 10.716 4.956 13.915 890 HB3 GLU 340 HB3 GLU 340 9.601 4.223 12.764 891 HG2 GLU 340 HG2 GLU 340 8.771 5.930 15.136 892 HG3 GLU 340 HG3 GLU 340 8.856 6.493 13.469 893 H VAL 341 H VAL 341 7.012 3.119 14.386 894 HA VAL 341 HA VAL 341 7.132 0.999 12.391 895 HB VAL 341 HB VAL 341 7.395 -0.224 14.562 896 HG11 VAL 341 HG11 VAL 341 4.533 0.591 15.091 897 HG12 VAL 341 HG12 VAL 341 5.651 -0.230 16.179 898 HG13 VAL 341 HG13 VAL 341 5.898 1.471 15.786 899 HG21 VAL 341 HG21 VAL 341 5.461 -1.797 14.137 900 HG22 VAL 341 HG22 VAL 341 4.846 -0.631 12.966 901 HG23 VAL 341 HG23 VAL 341 6.412 -1.406 12.697 902 H PTR 342 H PTR 342 5.081 0.532 11.435 903 HA PTR 342 HA PTR 342 3.372 2.769 11.160 904 HB2 PTR 342 HB2 PTR 342 1.883 0.527 10.344 905 HB3 PTR 342 HB3 PTR 342 2.857 1.579 9.319 906 HD1 PTR 342 HD1 PTR 342 2.742 -1.617 11.132 907 HD2 PTR 342 HD2 PTR 342 5.130 0.974 8.685 908 HE1 PTR 342 HE1 PTR 342 4.365 -3.456 10.771 909 HE2 PTR 342 HE2 PTR 342 6.754 -0.855 8.325 910 H GLU 343 H GLU 343 2.719 3.391 13.186 911 HA GLU 343 HA GLU 343 1.577 1.846 15.199 912 HB2 GLU 343 HB2 GLU 343 0.740 3.966 16.082 913 HB3 GLU 343 HB3 GLU 343 2.380 4.162 15.468 914 HG2 GLU 343 HG2 GLU 343 -0.109 4.839 13.861 915 HG3 GLU 343 HG3 GLU 343 0.801 6.018 14.797 916 H SER 344 H SER 344 0.371 0.794 12.918 917 HA SER 344 HA SER 344 -1.687 0.497 11.818 918 HB2 SER 344 HB2 SER 344 -1.615 -0.804 14.029 919 HB3 SER 344 HB3 SER 344 -2.698 0.436 14.659 920 HG SER 344 HG SER 344 -4.235 -0.173 13.248 921 HA PRO 345 HA PRO 345 -2.848 5.045 12.560 922 HB2 PRO 345 HB2 PRO 345 -3.168 4.983 9.646 923 HB3 PRO 345 HB3 PRO 345 -2.222 6.086 10.656 924 HG2 PRO 345 HG2 PRO 345 -1.249 3.994 9.075 925 HG3 PRO 345 HG3 PRO 345 -0.350 4.943 10.262 926 HD2 PRO 345 HD2 PRO 345 -1.101 2.175 10.421 927 HD3 PRO 345 HD3 PRO 345 -0.198 3.132 11.611 928 H PTR 346 H PTR 346 -4.299 2.880 10.078 929 HA PTR 346 HA PTR 346 -6.961 3.663 11.123 930 HB2 PTR 346 HB2 PTR 346 -6.520 3.040 8.218 931 HB3 PTR 346 HB3 PTR 346 -7.806 3.981 8.975 932 HD1 PTR 346 HD1 PTR 346 -5.227 4.442 6.842 933 HD2 PTR 346 HD2 PTR 346 -6.513 5.854 10.686 934 HE1 PTR 346 HE1 PTR 346 -3.897 6.521 6.532 935 HE2 PTR 346 HE2 PTR 346 -5.197 7.921 10.375 936 H ALA 347 H ALA 347 -8.714 2.192 10.572 937 HA ALA 347 HA ALA 347 -8.628 -0.339 9.538 938 HB1 ALA 347 HB1 ALA 347 -7.073 -1.358 10.850 939 HB2 ALA 347 HB2 ALA 347 -8.429 -1.521 11.969 940 HB3 ALA 347 HB3 ALA 347 -7.274 -0.202 12.167 941 H ASP 348 H ASP 348 -9.684 1.645 12.223 942 HA ASP 348 HA ASP 348 -12.444 0.882 11.730 943 HB2 ASP 348 HB2 ASP 348 -10.928 0.029 14.119 944 HB3 ASP 348 HB3 ASP 348 -12.490 0.769 14.459 945 HA PRO 349 HA PRO 349 -13.129 5.108 12.737 946 HB2 PRO 349 HB2 PRO 349 -15.644 5.109 13.750 947 HB3 PRO 349 HB3 PRO 349 -15.304 4.719 12.051 948 HG2 PRO 349 HG2 PRO 349 -15.881 2.894 14.334 949 HG3 PRO 349 HG3 PRO 349 -16.426 2.806 12.649 950 HD2 PRO 349 HD2 PRO 349 -14.337 1.313 13.670 951 HD3 PRO 349 HD3 PRO 349 -14.512 1.734 11.952 952 H GLU 350 H GLU 350 -11.425 5.096 14.452 953 HA GLU 350 HA GLU 350 -12.618 5.579 17.116 954 HB2 GLU 350 HB2 GLU 350 -10.229 3.943 16.356 955 HB3 GLU 350 HB3 GLU 350 -10.182 4.840 17.874 956 HG2 GLU 350 HG2 GLU 350 -12.615 3.782 18.172 957 HG3 GLU 350 HG3 GLU 350 -11.967 2.571 17.071 Start of MODEL 8 1 H1 GLY 661 H1 GLY 661 0.659 -16.391 -11.105 2 H2 GLY 661 H2 GLY 661 -0.321 -15.066 -10.680 3 H3 GLY 661 H3 GLY 661 1.376 -14.905 -10.688 4 HA2 GLY 661 HA2 GLY 661 1.517 -14.845 -12.974 5 HA3 GLY 661 HA3 GLY 661 -0.037 -15.658 -13.168 6 H HIS 662 H HIS 662 1.536 -12.630 -12.347 7 HA HIS 662 HA HIS 662 0.850 -10.455 -12.461 8 HB2 HIS 662 HB2 HIS 662 -0.395 -11.735 -14.626 9 HB3 HIS 662 HB3 HIS 662 -1.664 -10.776 -13.862 10 HD1 HIS 662 HD1 HIS 662 -1.463 -8.247 -13.962 11 HD2 HIS 662 HD2 HIS 662 1.871 -10.189 -15.498 12 HE1 HIS 662 HE1 HIS 662 -0.068 -6.460 -15.089 13 HE2 HIS 662 HE2 HIS 662 1.968 -7.627 -16.053 14 H MET 663 H MET 663 0.237 -11.923 -10.235 15 HA MET 663 HA MET 663 -2.145 -10.474 -9.300 16 HB2 MET 663 HB2 MET 663 -1.866 -13.395 -9.597 17 HB3 MET 663 HB3 MET 663 -2.451 -12.863 -8.019 18 HG2 MET 663 HG2 MET 663 -4.409 -12.026 -8.879 19 HG3 MET 663 HG3 MET 663 -3.658 -11.560 -10.407 20 HE1 MET 663 HE1 MET 663 -6.602 -13.319 -9.937 21 HE2 MET 663 HE2 MET 663 -5.926 -12.262 -11.172 22 HE3 MET 663 HE3 MET 663 -6.407 -13.912 -11.587 23 H GLN 664 H GLN 664 -0.513 -13.108 -7.646 24 HA GLN 664 HA GLN 664 0.115 -11.469 -5.385 25 HB2 GLN 664 HB2 GLN 664 0.209 -14.288 -6.058 26 HB3 GLN 664 HB3 GLN 664 1.695 -13.786 -5.254 27 HG2 GLN 664 HG2 GLN 664 0.055 -14.489 -3.583 28 HG3 GLN 664 HG3 GLN 664 0.362 -12.764 -3.433 29 HE21 GLN 664 HE21 GLN 664 -1.993 -13.660 -2.341 30 HE22 GLN 664 HE22 GLN 664 -3.317 -13.214 -3.304 31 H ASP 665 H ASP 665 1.616 -12.122 -8.370 32 HA ASP 665 HA ASP 665 4.349 -11.814 -7.669 33 HB2 ASP 665 HB2 ASP 665 3.539 -10.767 -10.306 34 HB3 ASP 665 HB3 ASP 665 4.711 -12.015 -9.902 35 H LEU 666 H LEU 666 5.051 -10.064 -6.567 36 HA LEU 666 HA LEU 666 3.810 -7.463 -7.109 37 HB2 LEU 666 HB2 LEU 666 5.788 -7.963 -4.916 38 HB3 LEU 666 HB3 LEU 666 4.477 -6.789 -4.984 39 HG LEU 666 HG LEU 666 4.102 -9.789 -4.830 40 HD11 LEU 666 HD11 LEU 666 4.141 -7.610 -2.765 41 HD12 LEU 666 HD12 LEU 666 3.171 -9.065 -2.521 42 HD13 LEU 666 HD13 LEU 666 4.918 -9.193 -2.724 43 HD21 LEU 666 HD21 LEU 666 1.738 -9.080 -4.287 44 HD22 LEU 666 HD22 LEU 666 2.192 -7.436 -4.743 45 HD23 LEU 666 HD23 LEU 666 2.231 -8.729 -5.941 46 H SER 667 H SER 667 6.889 -9.110 -7.307 47 HA SER 667 HA SER 667 8.535 -6.840 -7.640 48 HB2 SER 667 HB2 SER 667 9.393 -9.137 -7.215 49 HB3 SER 667 HB3 SER 667 8.910 -9.588 -8.852 50 HG SER 667 HG SER 667 10.232 -7.601 -9.419 51 H VAL 668 H VAL 668 6.006 -7.785 -9.522 52 HA VAL 668 HA VAL 668 7.236 -6.944 -12.051 53 HB VAL 668 HB VAL 668 5.331 -7.894 -13.134 54 HG11 VAL 668 HG11 VAL 668 7.068 -9.439 -12.007 55 HG12 VAL 668 HG12 VAL 668 5.807 -9.767 -10.818 56 HG13 VAL 668 HG13 VAL 668 5.544 -10.167 -12.516 57 HG21 VAL 668 HG21 VAL 668 3.771 -6.970 -11.218 58 HG22 VAL 668 HG22 VAL 668 3.294 -8.417 -12.104 59 HG23 VAL 668 HG23 VAL 668 4.028 -8.562 -10.510 60 H HIS 669 H HIS 669 5.915 -5.513 -9.471 61 HA HIS 669 HA HIS 669 4.412 -3.478 -11.000 62 HB2 HIS 669 HB2 HIS 669 4.548 -3.868 -8.001 63 HB3 HIS 669 HB3 HIS 669 3.464 -2.793 -8.878 64 HD1 HIS 669 HD1 HIS 669 2.381 -4.613 -11.055 65 HD2 HIS 669 HD2 HIS 669 2.892 -5.852 -7.119 66 HE1 HIS 669 HE1 HIS 669 0.753 -6.523 -10.689 67 HE2 HIS 669 HE2 HIS 669 0.971 -7.234 -8.244 68 H LEU 670 H LEU 670 4.621 -1.279 -9.600 69 HA LEU 670 HA LEU 670 7.502 -0.729 -9.294 70 HB2 LEU 670 HB2 LEU 670 6.732 1.701 -9.936 71 HB3 LEU 670 HB3 LEU 670 7.129 0.545 -11.180 72 HG LEU 670 HG LEU 670 4.374 1.260 -10.194 73 HD11 LEU 670 HD11 LEU 670 5.541 1.597 -12.949 74 HD12 LEU 670 HD12 LEU 670 4.096 2.354 -12.279 75 HD13 LEU 670 HD13 LEU 670 5.692 2.835 -11.704 76 HD21 LEU 670 HD21 LEU 670 4.121 -0.150 -12.583 77 HD22 LEU 670 HD22 LEU 670 5.326 -1.069 -11.686 78 HD23 LEU 670 HD23 LEU 670 3.734 -0.770 -10.979 79 H TRP 671 H TRP 671 4.670 -1.043 -7.721 80 HA TRP 671 HA TRP 671 5.335 1.117 -5.865 81 HB2 TRP 671 HB2 TRP 671 3.039 0.563 -4.857 82 HB3 TRP 671 HB3 TRP 671 3.077 1.404 -6.398 83 HD1 TRP 671 HD1 TRP 671 1.781 0.349 -8.317 84 HE1 TRP 671 HE1 TRP 671 0.566 -1.906 -8.697 85 HE3 TRP 671 HE3 TRP 671 3.297 -2.176 -4.134 86 HZ2 TRP 671 HZ2 TRP 671 0.320 -4.432 -7.413 87 HZ3 TRP 671 HZ3 TRP 671 2.551 -4.510 -3.742 88 HH2 TRP 671 HH2 TRP 671 1.060 -5.637 -5.374 89 H TYR 672 H TYR 672 5.777 -2.118 -6.388 90 HA TYR 672 HA TYR 672 5.602 -2.948 -3.599 91 HB2 TYR 672 HB2 TYR 672 4.936 -4.536 -5.333 92 HB3 TYR 672 HB3 TYR 672 6.536 -4.427 -6.069 93 HD1 TYR 672 HD2 TYR 672 5.214 -4.816 -2.566 94 HD2 TYR 672 HD1 TYR 672 7.884 -6.260 -5.615 95 HE1 TYR 672 HE2 TYR 672 6.065 -6.549 -1.014 96 HE2 TYR 672 HE1 TYR 672 8.725 -7.994 -4.055 97 HH TYR 672 HH TYR 672 7.772 -9.196 -1.967 98 H ALA 673 H ALA 673 7.166 -2.350 -2.263 99 HA ALA 673 HA ALA 673 9.909 -2.029 -3.294 100 HB1 ALA 673 HB1 ALA 673 8.830 -0.185 -1.964 101 HB2 ALA 673 HB2 ALA 673 10.348 -0.772 -1.287 102 HB3 ALA 673 HB3 ALA 673 8.814 -1.273 -0.576 103 H GLY 674 H GLY 674 7.925 -4.105 -1.421 104 HA2 GLY 674 HA2 GLY 674 8.331 -6.005 -0.185 105 HA3 GLY 674 HA3 GLY 674 9.702 -6.225 -1.262 106 HA PRO 675 HA PRO 675 12.099 -5.881 2.468 107 HB2 PRO 675 HB2 PRO 675 14.572 -5.710 1.272 108 HB3 PRO 675 HB3 PRO 675 13.679 -7.226 1.485 109 HG2 PRO 675 HG2 PRO 675 13.938 -5.504 -0.930 110 HG3 PRO 675 HG3 PRO 675 13.925 -7.273 -0.797 111 HD2 PRO 675 HD2 PRO 675 11.744 -5.846 -1.611 112 HD3 PRO 675 HD3 PRO 675 11.611 -7.387 -0.731 113 H MET 676 H MET 676 10.905 -3.613 2.360 114 HA MET 676 HA MET 676 13.018 -1.530 2.265 115 HB2 MET 676 HB2 MET 676 11.297 -1.391 0.410 116 HB3 MET 676 HB3 MET 676 10.097 -1.054 1.656 117 HG2 MET 676 HG2 MET 676 10.878 1.067 2.013 118 HG3 MET 676 HG3 MET 676 12.562 0.585 1.819 119 HE1 MET 676 HE1 MET 676 13.639 -0.039 -0.386 120 HE2 MET 676 HE2 MET 676 13.520 1.179 -1.654 121 HE3 MET 676 HE3 MET 676 13.876 1.661 0.013 122 H GLU 677 H GLU 677 12.544 0.363 3.661 123 HA GLU 677 HA GLU 677 11.117 -0.438 6.127 124 HB2 GLU 677 HB2 GLU 677 12.716 1.031 7.336 125 HB3 GLU 677 HB3 GLU 677 13.505 -0.331 6.533 126 HG2 GLU 677 HG2 GLU 677 14.731 1.055 5.260 127 HG3 GLU 677 HG3 GLU 677 13.297 1.923 4.729 128 H ARG 678 H ARG 678 10.557 1.565 7.491 129 HA ARG 678 HA ARG 678 8.668 3.109 6.123 130 HB2 ARG 678 HB2 ARG 678 8.569 2.764 8.539 131 HB3 ARG 678 HB3 ARG 678 10.056 3.686 8.750 132 HG2 ARG 678 HG2 ARG 678 8.783 5.587 7.503 133 HG3 ARG 678 HG3 ARG 678 7.335 4.671 7.906 134 HD2 ARG 678 HD2 ARG 678 9.198 5.017 10.158 135 HD3 ARG 678 HD3 ARG 678 8.525 6.527 9.551 136 HE ARG 678 HE ARG 678 7.057 4.357 10.850 137 HH11 ARG 678 HH21 ARG 678 6.949 7.284 9.003 138 HH12 ARG 678 HH22 ARG 678 5.284 7.619 9.404 139 HH21 ARG 678 HH11 ARG 678 4.959 4.703 11.270 140 HH22 ARG 678 HH12 ARG 678 4.121 6.103 10.627 141 H ALA 679 H ALA 679 11.783 4.212 7.474 142 HA ALA 679 HA ALA 679 11.770 6.776 6.355 143 HB1 ALA 679 HB1 ALA 679 13.444 5.436 8.016 144 HB2 ALA 679 HB2 ALA 679 13.868 6.954 7.221 145 HB3 ALA 679 HB3 ALA 679 14.393 5.419 6.529 146 H GLY 680 H GLY 680 12.748 3.681 5.066 147 HA2 GLY 680 HA2 GLY 680 13.910 4.740 2.653 148 HA3 GLY 680 HA3 GLY 680 13.514 3.052 2.963 149 H ALA 681 H ALA 681 10.830 3.219 3.542 150 HA ALA 681 HA ALA 681 9.656 3.244 0.981 151 HB1 ALA 681 HB1 ALA 681 8.653 1.905 2.694 152 HB2 ALA 681 HB2 ALA 681 7.483 3.160 2.284 153 HB3 ALA 681 HB3 ALA 681 8.450 3.302 3.752 154 H GLU 682 H GLU 682 9.421 5.656 3.648 155 HA GLU 682 HA GLU 682 7.860 7.411 1.967 156 HB2 GLU 682 HB2 GLU 682 8.017 8.995 3.842 157 HB3 GLU 682 HB3 GLU 682 7.488 7.402 4.369 158 HG2 GLU 682 HG2 GLU 682 10.114 7.051 4.697 159 HG3 GLU 682 HG3 GLU 682 10.076 8.788 4.851 160 H SER 683 H SER 683 11.190 6.832 2.417 161 HA SER 683 HA SER 683 12.267 9.375 1.939 162 HB2 SER 683 HB2 SER 683 13.215 6.581 1.521 163 HB3 SER 683 HB3 SER 683 14.107 7.878 0.729 164 HG SER 683 HG SER 683 13.590 7.443 3.482 165 H ILE 684 H ILE 684 11.212 6.846 -0.288 166 HA ILE 684 HA ILE 684 11.806 8.444 -2.629 167 HB ILE 684 HB ILE 684 10.015 6.022 -2.621 168 HG12 ILE 684 HG12 ILE 684 12.769 5.310 -3.078 169 HG13 ILE 684 HG13 ILE 684 12.642 6.096 -1.507 170 HG21 ILE 684 HG21 ILE 684 10.329 7.193 -4.734 171 HG22 ILE 684 HG22 ILE 684 12.080 7.161 -4.530 172 HG23 ILE 684 HG23 ILE 684 11.193 5.660 -4.794 173 HD11 ILE 684 HD11 ILE 684 11.075 3.693 -2.478 174 HD12 ILE 684 HD12 ILE 684 12.252 3.742 -1.165 175 HD13 ILE 684 HD13 ILE 684 10.701 4.564 -0.991 176 H LEU 685 H LEU 685 8.868 7.282 -1.006 177 HA LEU 685 HA LEU 685 6.982 8.587 -2.608 178 HB2 LEU 685 HB2 LEU 685 7.045 7.391 0.108 179 HB3 LEU 685 HB3 LEU 685 5.738 8.524 -0.203 180 HG LEU 685 HG LEU 685 4.923 7.226 -2.038 181 HD11 LEU 685 HD11 LEU 685 6.898 6.597 -3.203 182 HD12 LEU 685 HD12 LEU 685 7.562 5.778 -1.791 183 HD13 LEU 685 HD13 LEU 685 6.192 5.081 -2.653 184 HD21 LEU 685 HD21 LEU 685 4.898 4.846 -0.925 185 HD22 LEU 685 HD22 LEU 685 5.723 5.663 0.402 186 HD23 LEU 685 HD23 LEU 685 4.118 6.194 -0.101 187 H ALA 686 H ALA 686 8.594 9.718 0.392 188 HA ALA 686 HA ALA 686 7.190 12.172 0.551 189 HB1 ALA 686 HB1 ALA 686 8.543 11.227 2.398 190 HB2 ALA 686 HB2 ALA 686 8.966 12.900 2.038 191 HB3 ALA 686 HB3 ALA 686 10.008 11.589 1.483 192 H ASN 687 H ASN 687 10.168 11.217 -1.094 193 HA ASN 687 HA ASN 687 10.817 13.826 -2.060 194 HB2 ASN 687 HB2 ASN 687 12.416 11.878 -1.890 195 HB3 ASN 687 HB3 ASN 687 11.599 11.171 -3.279 196 HD21 ASN 687 HD21 ASN 687 11.267 14.288 -4.053 197 HD22 ASN 687 HD22 ASN 687 12.742 14.574 -4.843 198 H ARG 688 H ARG 688 8.976 11.082 -3.318 199 HA ARG 688 HA ARG 688 8.502 12.182 -5.915 200 HB2 ARG 688 HB2 ARG 688 7.689 9.830 -4.395 201 HB3 ARG 688 HB3 ARG 688 6.366 10.483 -5.350 202 HG2 ARG 688 HG2 ARG 688 7.310 9.193 -6.992 203 HG3 ARG 688 HG3 ARG 688 8.328 10.620 -7.196 204 HD2 ARG 688 HD2 ARG 688 10.161 9.601 -6.289 205 HD3 ARG 688 HD3 ARG 688 9.210 8.733 -5.102 206 HE ARG 688 HE ARG 688 9.449 6.917 -6.504 207 HH11 ARG 688 HH21 ARG 688 9.180 9.767 -8.441 208 HH12 ARG 688 HH22 ARG 688 9.230 8.898 -9.933 209 HH21 ARG 688 HH11 ARG 688 9.556 5.818 -8.413 210 HH22 ARG 688 HH12 ARG 688 9.430 6.665 -9.949 211 H SER 689 H SER 689 6.143 12.529 -6.645 212 HA SER 689 HA SER 689 5.115 14.797 -5.229 213 HB2 SER 689 HB2 SER 689 4.987 14.577 -7.691 214 HB3 SER 689 HB3 SER 689 3.874 13.223 -7.498 215 HG SER 689 HG SER 689 2.374 14.677 -7.333 216 H ASP 690 H ASP 690 2.625 14.874 -4.886 217 HA ASP 690 HA ASP 690 2.006 13.016 -2.804 218 HB2 ASP 690 HB2 ASP 690 0.948 15.496 -3.801 219 HB3 ASP 690 HB3 ASP 690 -0.357 14.334 -3.582 220 H GLY 691 H GLY 691 0.569 11.337 -2.754 221 HA2 GLY 691 HA2 GLY 691 -1.174 9.971 -3.674 222 HA3 GLY 691 HA3 GLY 691 -0.778 10.594 -5.275 223 H THR 692 H THR 692 2.123 10.216 -4.070 224 HA THR 692 HA THR 692 2.687 7.809 -5.493 225 HB THR 692 HB THR 692 4.501 9.178 -3.490 226 HG1 THR 692 HG1 THR 692 4.117 10.832 -4.799 227 HG21 THR 692 HG21 THR 692 6.209 8.048 -4.529 228 HG22 THR 692 HG22 THR 692 4.914 6.881 -4.792 229 HG23 THR 692 HG23 THR 692 5.375 7.997 -6.078 230 H PHE 693 H PHE 693 2.714 5.741 -4.768 231 HA PHE 693 HA PHE 693 2.729 5.308 -1.844 232 HB2 PHE 693 HB2 PHE 693 0.870 3.781 -1.976 233 HB3 PHE 693 HB3 PHE 693 0.386 5.307 -2.712 234 HD1 PHE 693 HD2 PHE 693 1.351 1.804 -3.395 235 HD2 PHE 693 HD1 PHE 693 -0.008 5.507 -5.087 236 HE1 PHE 693 HE2 PHE 693 0.792 0.638 -5.507 237 HE2 PHE 693 HE1 PHE 693 -0.566 4.336 -7.201 238 HZ PHE 693 HZ PHE 693 -0.162 1.901 -7.412 239 H LEU 694 H LEU 694 3.077 3.034 -1.250 240 HA LEU 694 HA LEU 694 4.120 1.197 -3.178 241 HB2 LEU 694 HB2 LEU 694 6.421 1.252 -2.729 242 HB3 LEU 694 HB3 LEU 694 5.986 2.954 -2.854 243 HG LEU 694 HG LEU 694 5.592 2.730 -0.257 244 HD11 LEU 694 HD11 LEU 694 7.767 1.095 0.265 245 HD12 LEU 694 HD12 LEU 694 6.076 0.663 0.520 246 HD13 LEU 694 HD13 LEU 694 6.888 0.207 -0.979 247 HD21 LEU 694 HD21 LEU 694 7.440 4.010 -0.155 248 HD22 LEU 694 HD22 LEU 694 8.475 2.683 -0.679 249 HD23 LEU 694 HD23 LEU 694 7.649 3.681 -1.872 250 H VAL 695 H VAL 695 4.973 -0.779 -2.158 251 HA VAL 695 HA VAL 695 4.045 -1.086 0.629 252 HB VAL 695 HB VAL 695 3.654 -3.209 -1.478 253 HG11 VAL 695 HG11 VAL 695 2.475 -4.348 0.192 254 HG12 VAL 695 HG12 VAL 695 3.788 -3.621 1.106 255 HG13 VAL 695 HG13 VAL 695 2.187 -2.886 1.128 256 HG21 VAL 695 HG21 VAL 695 1.395 -2.513 -1.718 257 HG22 VAL 695 HG22 VAL 695 1.501 -1.414 -0.343 258 HG23 VAL 695 HG23 VAL 695 2.331 -1.027 -1.850 259 H ARG 696 H ARG 696 5.249 -2.355 1.939 260 HA ARG 696 HA ARG 696 7.719 -3.510 0.781 261 HB2 ARG 696 HB2 ARG 696 8.794 -3.001 2.953 262 HB3 ARG 696 HB3 ARG 696 8.192 -1.544 2.156 263 HG2 ARG 696 HG2 ARG 696 6.172 -1.592 3.546 264 HG3 ARG 696 HG3 ARG 696 6.734 -3.070 4.332 265 HD2 ARG 696 HD2 ARG 696 8.350 -0.519 4.326 266 HD3 ARG 696 HD3 ARG 696 7.169 -0.878 5.582 267 HE ARG 696 HE ARG 696 9.768 -2.168 5.190 268 HH11 ARG 696 HH21 ARG 696 6.601 -2.460 6.553 269 HH12 ARG 696 HH22 ARG 696 7.128 -3.368 7.932 270 HH21 ARG 696 HH11 ARG 696 10.435 -3.334 6.988 271 HH22 ARG 696 HH12 ARG 696 9.288 -3.850 8.182 272 H GLN 697 H GLN 697 8.632 -5.309 2.071 273 HA GLN 697 HA GLN 697 6.479 -7.034 3.175 274 HB2 GLN 697 HB2 GLN 697 7.257 -7.974 1.126 275 HB3 GLN 697 HB3 GLN 697 8.939 -7.685 1.549 276 HG2 GLN 697 HG2 GLN 697 8.417 -10.056 1.861 277 HG3 GLN 697 HG3 GLN 697 8.726 -9.313 3.426 278 HE21 GLN 697 HE21 GLN 697 6.507 -11.254 1.736 279 HE22 GLN 697 HE22 GLN 697 5.187 -11.102 2.805 280 H ARG 698 H ARG 698 6.645 -6.957 5.336 281 HA ARG 698 HA ARG 698 8.578 -8.260 6.795 282 HB2 ARG 698 HB2 ARG 698 9.521 -5.671 5.934 283 HB3 ARG 698 HB3 ARG 698 9.374 -5.696 7.686 284 HG2 ARG 698 HG2 ARG 698 10.520 -8.191 6.915 285 HG3 ARG 698 HG3 ARG 698 11.389 -6.929 6.044 286 HD2 ARG 698 HD2 ARG 698 12.184 -7.585 8.456 287 HD3 ARG 698 HD3 ARG 698 12.119 -5.885 8.001 288 HE ARG 698 HE ARG 698 10.454 -5.595 9.591 289 HH11 ARG 698 HH21 ARG 698 10.689 -8.926 8.727 290 HH12 ARG 698 HH22 ARG 698 9.477 -9.428 9.854 291 HH21 ARG 698 HH11 ARG 698 8.886 -6.249 11.025 292 HH22 ARG 698 HH12 ARG 698 8.461 -7.935 11.139 293 H VAL 699 H VAL 699 7.173 -8.841 8.350 294 HA VAL 699 HA VAL 699 5.662 -6.705 9.744 295 HB VAL 699 HB VAL 699 4.256 -8.281 8.365 296 HG11 VAL 699 HG11 VAL 699 5.649 -10.302 8.758 297 HG12 VAL 699 HG12 VAL 699 5.167 -10.286 10.456 298 HG13 VAL 699 HG13 VAL 699 3.965 -10.571 9.199 299 HG21 VAL 699 HG21 VAL 699 3.637 -7.097 10.646 300 HG22 VAL 699 HG22 VAL 699 2.552 -8.299 9.957 301 HG23 VAL 699 HG23 VAL 699 3.637 -8.750 11.268 302 H LYS 700 H LYS 700 5.008 -7.384 12.002 303 HA LYS 700 HA LYS 700 7.091 -9.054 13.276 304 HB2 LYS 700 HB2 LYS 700 7.433 -7.474 15.008 305 HB3 LYS 700 HB3 LYS 700 7.462 -6.534 13.517 306 HG2 LYS 700 HG2 LYS 700 5.100 -5.897 13.861 307 HG3 LYS 700 HG3 LYS 700 5.054 -6.853 15.343 308 HD2 LYS 700 HD2 LYS 700 5.665 -4.935 16.389 309 HD3 LYS 700 HD3 LYS 700 7.275 -5.270 15.753 310 HE2 LYS 700 HE2 LYS 700 5.155 -3.627 14.327 311 HE3 LYS 700 HE3 LYS 700 6.517 -2.955 15.226 312 HZ1 LYS 700 HZ1 LYS 700 7.962 -4.360 13.723 313 HZ2 LYS 700 HZ2 LYS 700 6.592 -4.598 12.756 314 HZ3 LYS 700 HZ3 LYS 700 7.203 -3.031 12.989 315 H ASP 701 H ASP 701 3.826 -7.820 13.275 316 HA ASP 701 HA ASP 701 3.025 -9.345 15.616 317 HB2 ASP 701 HB2 ASP 701 0.752 -8.389 14.946 318 HB3 ASP 701 HB3 ASP 701 1.996 -7.210 15.362 319 H ALA 702 H ALA 702 0.751 -9.192 13.056 320 HA ALA 702 HA ALA 702 1.173 -12.036 12.352 321 HB1 ALA 702 HB1 ALA 702 -1.290 -12.356 12.459 322 HB2 ALA 702 HB2 ALA 702 -1.446 -10.733 13.133 323 HB3 ALA 702 HB3 ALA 702 -0.584 -11.982 14.032 324 H ALA 703 H ALA 703 0.689 -8.854 11.341 325 HA ALA 703 HA ALA 703 -0.809 -9.300 8.946 326 HB1 ALA 703 HB1 ALA 703 1.018 -7.058 8.754 327 HB2 ALA 703 HB2 ALA 703 0.234 -7.087 10.332 328 HB3 ALA 703 HB3 ALA 703 -0.742 -7.054 8.866 329 H GLU 704 H GLU 704 0.842 -8.024 6.991 330 HA GLU 704 HA GLU 704 3.126 -9.875 6.714 331 HB2 GLU 704 HB2 GLU 704 0.676 -10.142 5.293 332 HB3 GLU 704 HB3 GLU 704 1.891 -9.596 4.143 333 HG2 GLU 704 HG2 GLU 704 3.214 -11.522 5.688 334 HG3 GLU 704 HG3 GLU 704 1.610 -12.196 5.411 335 H PHE 705 H PHE 705 1.929 -7.985 4.036 336 HA PHE 705 HA PHE 705 4.414 -6.521 3.917 337 HB2 PHE 705 HB2 PHE 705 1.897 -6.304 2.244 338 HB3 PHE 705 HB3 PHE 705 3.422 -5.502 1.891 339 HD1 PHE 705 HD1 PHE 705 1.753 -8.805 2.178 340 HD2 PHE 705 HD2 PHE 705 5.264 -6.680 0.919 341 HE1 PHE 705 HE1 PHE 705 2.545 -10.821 0.980 342 HE2 PHE 705 HE2 PHE 705 6.050 -8.706 -0.285 343 HZ PHE 705 HZ PHE 705 4.688 -10.773 -0.252 344 H ALA 706 H ALA 706 4.193 -4.076 3.392 345 HA ALA 706 HA ALA 706 2.180 -2.801 5.131 346 HB1 ALA 706 HB1 ALA 706 4.077 -1.162 5.789 347 HB2 ALA 706 HB2 ALA 706 5.161 -2.460 5.292 348 HB3 ALA 706 HB3 ALA 706 4.010 -2.728 6.598 349 H ILE 707 H ILE 707 1.160 -1.217 4.146 350 HA ILE 707 HA ILE 707 2.134 -0.317 1.531 351 HB ILE 707 HB ILE 707 -0.480 0.465 2.808 352 HG12 ILE 707 HG12 ILE 707 -1.262 -1.598 1.320 353 HG13 ILE 707 HG13 ILE 707 0.364 -2.178 1.672 354 HG21 ILE 707 HG21 ILE 707 -0.964 0.095 0.179 355 HG22 ILE 707 HG22 ILE 707 -0.381 1.627 0.832 356 HG23 ILE 707 HG23 ILE 707 0.753 0.493 0.097 357 HD11 ILE 707 HD11 ILE 707 -0.752 -1.141 4.094 358 HD12 ILE 707 HD12 ILE 707 -1.923 -2.238 3.374 359 HD13 ILE 707 HD13 ILE 707 -0.293 -2.803 3.729 360 H SER 708 H SER 708 2.929 1.627 1.133 361 HA SER 708 HA SER 708 2.685 3.698 3.232 362 HB2 SER 708 HB2 SER 708 5.035 3.065 1.450 363 HB3 SER 708 HB3 SER 708 4.916 4.531 2.416 364 HG SER 708 HG SER 708 4.886 1.828 3.336 365 H ILE 709 H ILE 709 1.642 5.518 2.559 366 HA ILE 709 HA ILE 709 1.501 6.018 -0.374 367 HB ILE 709 HB ILE 709 -0.674 6.940 1.468 368 HG12 ILE 709 HG12 ILE 709 -1.819 4.705 0.640 369 HG13 ILE 709 HG13 ILE 709 -0.152 4.118 0.608 370 HG21 ILE 709 HG21 ILE 709 -0.277 6.446 -1.443 371 HG22 ILE 709 HG22 ILE 709 -1.892 6.159 -0.791 372 HG23 ILE 709 HG23 ILE 709 -1.141 7.750 -0.628 373 HD11 ILE 709 HD11 ILE 709 -1.268 5.583 2.999 374 HD12 ILE 709 HD12 ILE 709 -1.452 3.835 2.818 375 HD13 ILE 709 HD13 ILE 709 0.152 4.543 2.917 376 H LYS 710 H LYS 710 2.040 7.988 -1.082 377 HA LYS 710 HA LYS 710 2.796 10.034 0.877 378 HB2 LYS 710 HB2 LYS 710 4.386 9.729 -0.911 379 HB3 LYS 710 HB3 LYS 710 3.115 9.820 -2.126 380 HG2 LYS 710 HG2 LYS 710 4.136 11.953 -2.177 381 HG3 LYS 710 HG3 LYS 710 2.659 12.187 -1.251 382 HD2 LYS 710 HD2 LYS 710 3.787 12.422 0.760 383 HD3 LYS 710 HD3 LYS 710 5.191 11.493 0.215 384 HE2 LYS 710 HE2 LYS 710 4.431 14.179 -0.955 385 HE3 LYS 710 HE3 LYS 710 5.558 14.001 0.393 386 HZ1 LYS 710 HZ1 LYS 710 6.393 12.144 -1.478 387 HZ2 LYS 710 HZ2 LYS 710 6.007 13.522 -2.412 388 HZ3 LYS 710 HZ3 LYS 710 7.141 13.654 -1.142 389 H TYR 711 H TYR 711 1.012 11.045 1.641 390 HA TYR 711 HA TYR 711 -0.676 12.438 -0.316 391 HB2 TYR 711 HB2 TYR 711 -1.807 10.297 0.173 392 HB3 TYR 711 HB3 TYR 711 -1.786 10.693 1.891 393 HD1 TYR 711 HD1 TYR 711 -2.571 12.633 -1.230 394 HD2 TYR 711 HD2 TYR 711 -3.864 11.327 2.646 395 HE1 TYR 711 HE1 TYR 711 -4.675 13.922 -1.501 396 HE2 TYR 711 HE2 TYR 711 -5.973 12.610 2.378 397 HH TYR 711 HH TYR 711 -7.247 13.505 -0.253 398 H ASN 712 H ASN 712 -0.399 14.470 0.229 399 HA ASN 712 HA ASN 712 -0.784 16.387 1.519 400 HB2 ASN 712 HB2 ASN 712 -2.262 14.967 3.026 401 HB3 ASN 712 HB3 ASN 712 -0.816 14.613 3.968 402 HD21 ASN 712 HD21 ASN 712 -0.433 15.996 5.664 403 HD22 ASN 712 HD22 ASN 712 -1.020 17.598 5.758 404 H VAL 713 H VAL 713 1.611 15.746 0.553 405 HA VAL 713 HA VAL 713 3.896 15.812 0.847 406 HB VAL 713 HB VAL 713 4.700 17.720 2.105 407 HG11 VAL 713 HG11 VAL 713 2.010 18.548 1.026 408 HG12 VAL 713 HG12 VAL 713 3.551 19.401 0.914 409 HG13 VAL 713 HG13 VAL 713 3.274 17.947 -0.048 410 HG21 VAL 713 HG21 VAL 713 3.163 17.269 4.114 411 HG22 VAL 713 HG22 VAL 713 3.370 18.957 3.657 412 HG23 VAL 713 HG23 VAL 713 1.902 18.095 3.201 413 H GLU 714 H GLU 714 2.656 13.727 2.223 414 HA GLU 714 HA GLU 714 4.708 13.110 4.169 415 HB2 GLU 714 HB2 GLU 714 3.161 12.594 5.997 416 HB3 GLU 714 HB3 GLU 714 3.026 14.296 5.543 417 HG2 GLU 714 HG2 GLU 714 1.085 13.614 4.047 418 HG3 GLU 714 HG3 GLU 714 1.145 12.034 4.824 419 H VAL 715 H VAL 715 4.741 10.847 4.710 420 HA VAL 715 HA VAL 715 3.275 9.210 2.737 421 HB VAL 715 HB VAL 715 5.834 8.453 4.131 422 HG11 VAL 715 HG11 VAL 715 5.989 6.822 2.343 423 HG12 VAL 715 HG12 VAL 715 4.391 6.678 3.069 424 HG13 VAL 715 HG13 VAL 715 4.588 7.516 1.528 425 HG21 VAL 715 HG21 VAL 715 5.321 10.094 1.660 426 HG22 VAL 715 HG22 VAL 715 6.505 10.362 2.937 427 HG23 VAL 715 HG23 VAL 715 6.757 9.081 1.755 428 H LYS 716 H LYS 716 1.607 8.190 3.603 429 HA LYS 716 HA LYS 716 1.556 7.463 6.434 430 HB2 LYS 716 HB2 LYS 716 -0.520 6.646 4.417 431 HB3 LYS 716 HB3 LYS 716 -0.738 7.044 6.118 432 HG2 LYS 716 HG2 LYS 716 0.348 9.367 4.952 433 HG3 LYS 716 HG3 LYS 716 -0.862 8.790 3.803 434 HD2 LYS 716 HD2 LYS 716 -2.593 8.850 5.424 435 HD3 LYS 716 HD3 LYS 716 -1.446 8.974 6.759 436 HE2 LYS 716 HE2 LYS 716 -0.910 11.168 5.044 437 HE3 LYS 716 HE3 LYS 716 -2.664 11.095 5.236 438 HZ1 LYS 716 HZ1 LYS 716 -2.503 11.787 7.320 439 HZ2 LYS 716 HZ2 LYS 716 -1.350 10.608 7.704 440 HZ3 LYS 716 HZ3 LYS 716 -0.828 12.104 7.054 441 H HIS 717 H HIS 717 2.006 5.442 7.224 442 HA HIS 717 HA HIS 717 2.447 3.275 5.250 443 HB2 HIS 717 HB2 HIS 717 3.782 3.499 7.942 444 HB3 HIS 717 HB3 HIS 717 4.194 2.412 6.620 445 HD1 HIS 717 HD1 HIS 717 5.287 3.533 4.442 446 HD2 HIS 717 HD2 HIS 717 4.929 6.026 7.793 447 HE1 HIS 717 HE1 HIS 717 6.890 5.485 4.094 448 HE2 HIS 717 HE2 HIS 717 6.721 6.994 6.146 449 H ILE 718 H ILE 718 1.350 1.428 5.489 450 HA ILE 718 HA ILE 718 0.106 0.835 8.108 451 HB ILE 718 HB ILE 718 -1.336 0.615 5.457 452 HG12 ILE 718 HG12 ILE 718 -2.382 2.429 7.535 453 HG13 ILE 718 HG13 ILE 718 -0.853 2.953 6.834 454 HG21 ILE 718 HG21 ILE 718 -2.360 -0.978 6.778 455 HG22 ILE 718 HG22 ILE 718 -1.944 -0.154 8.282 456 HG23 ILE 718 HG23 ILE 718 -3.266 0.449 7.283 457 HD11 ILE 718 HD11 ILE 718 -3.496 2.513 5.485 458 HD12 ILE 718 HD12 ILE 718 -2.393 3.883 5.352 459 HD13 ILE 718 HD13 ILE 718 -2.003 2.358 4.555 460 H LYS 719 H LYS 719 0.150 -1.274 8.681 461 HA LYS 719 HA LYS 719 1.652 -3.117 7.017 462 HB2 LYS 719 HB2 LYS 719 1.355 -4.664 8.982 463 HB3 LYS 719 HB3 LYS 719 2.172 -3.150 9.355 464 HG2 LYS 719 HG2 LYS 719 0.645 -2.861 10.994 465 HG3 LYS 719 HG3 LYS 719 -0.535 -2.555 9.720 466 HD2 LYS 719 HD2 LYS 719 -0.845 -5.096 9.598 467 HD3 LYS 719 HD3 LYS 719 0.064 -5.175 11.108 468 HE2 LYS 719 HE2 LYS 719 -2.320 -5.122 11.608 469 HE3 LYS 719 HE3 LYS 719 -1.581 -3.608 12.135 470 HZ1 LYS 719 HZ1 LYS 719 -2.430 -3.504 9.404 471 HZ2 LYS 719 HZ2 LYS 719 -3.741 -3.879 10.461 472 HZ3 LYS 719 HZ3 LYS 719 -2.807 -2.436 10.704 473 H ILE 720 H ILE 720 0.816 -4.512 5.649 474 HA ILE 720 HA ILE 720 -2.048 -4.831 5.383 475 HB ILE 720 HB ILE 720 0.231 -5.120 3.707 476 HG12 ILE 720 HG12 ILE 720 -2.584 -5.828 2.911 477 HG13 ILE 720 HG13 ILE 720 -2.167 -4.173 3.347 478 HG21 ILE 720 HG21 ILE 720 -1.458 -7.641 3.803 479 HG22 ILE 720 HG22 ILE 720 -0.178 -7.288 2.646 480 HG23 ILE 720 HG23 ILE 720 0.215 -7.530 4.347 481 HD11 ILE 720 HD11 ILE 720 -0.102 -4.939 1.643 482 HD12 ILE 720 HD12 ILE 720 -1.541 -5.654 0.912 483 HD13 ILE 720 HD13 ILE 720 -1.474 -3.917 1.212 484 H MET 721 H MET 721 -3.247 -6.666 5.777 485 HA MET 721 HA MET 721 -2.015 -8.639 7.574 486 HB2 MET 721 HB2 MET 721 -4.286 -7.341 7.947 487 HB3 MET 721 HB3 MET 721 -4.936 -8.616 6.919 488 HG2 MET 721 HG2 MET 721 -3.164 -9.739 8.921 489 HG3 MET 721 HG3 MET 721 -4.433 -8.779 9.679 490 HE1 MET 721 HE1 MET 721 -3.629 -12.034 9.417 491 HE2 MET 721 HE2 MET 721 -4.730 -11.430 10.655 492 HE3 MET 721 HE3 MET 721 -5.228 -12.756 9.597 493 H THR 722 H THR 722 -3.227 -10.904 7.285 494 HA THR 722 HA THR 722 -3.257 -11.623 4.423 495 HB THR 722 HB THR 722 -1.071 -12.297 5.007 496 HG1 THR 722 HG1 THR 722 -2.940 -14.393 5.364 497 HG21 THR 722 HG21 THR 722 -2.323 -13.114 7.630 498 HG22 THR 722 HG22 THR 722 -0.750 -13.734 7.128 499 HG23 THR 722 HG23 THR 722 -0.983 -12.001 7.353 500 H ALA 723 H ALA 723 -5.495 -11.188 5.970 501 HA ALA 723 HA ALA 723 -6.633 -13.265 7.392 502 HB1 ALA 723 HB1 ALA 723 -8.186 -11.631 7.377 503 HB2 ALA 723 HB2 ALA 723 -8.747 -12.345 5.864 504 HB3 ALA 723 HB3 ALA 723 -7.617 -10.990 5.835 505 H GLU 724 H GLU 724 -6.695 -15.359 6.879 506 HA GLU 724 HA GLU 724 -6.785 -17.292 5.621 507 HB2 GLU 724 HB2 GLU 724 -8.894 -15.937 3.960 508 HB3 GLU 724 HB3 GLU 724 -8.837 -17.600 4.543 509 HG2 GLU 724 HG2 GLU 724 -9.445 -15.096 6.127 510 HG3 GLU 724 HG3 GLU 724 -10.465 -16.513 5.905 511 H GLY 725 H GLY 725 -5.077 -14.998 4.660 512 HA2 GLY 725 HA2 GLY 725 -3.425 -15.203 2.939 513 HA3 GLY 725 HA3 GLY 725 -4.601 -16.058 1.947 514 H LEU 726 H LEU 726 -6.419 -13.658 3.148 515 HA LEU 726 HA LEU 726 -6.139 -12.066 0.724 516 HB2 LEU 726 HB2 LEU 726 -7.996 -11.556 3.057 517 HB3 LEU 726 HB3 LEU 726 -8.143 -10.945 1.412 518 HG LEU 726 HG LEU 726 -8.228 -13.889 2.136 519 HD11 LEU 726 HD11 LEU 726 -10.618 -13.759 1.889 520 HD12 LEU 726 HD12 LEU 726 -10.146 -12.505 3.038 521 HD13 LEU 726 HD13 LEU 726 -10.529 -12.075 1.370 522 HD21 LEU 726 HD21 LEU 726 -8.494 -12.279 -0.388 523 HD22 LEU 726 HD22 LEU 726 -7.618 -13.786 -0.118 524 HD23 LEU 726 HD23 LEU 726 -9.379 -13.798 -0.234 525 H TYR 727 H TYR 727 -5.326 -10.038 0.561 526 HA TYR 727 HA TYR 727 -3.873 -9.018 2.894 527 HB2 TYR 727 HB2 TYR 727 -3.756 -8.374 -0.049 528 HB3 TYR 727 HB3 TYR 727 -2.882 -7.452 1.169 529 HD1 TYR 727 HD2 TYR 727 -3.009 -10.669 2.505 530 HD2 TYR 727 HD1 TYR 727 -1.130 -8.473 -0.667 531 HE1 TYR 727 HE2 TYR 727 -1.168 -12.328 2.434 532 HE2 TYR 727 HE1 TYR 727 0.706 -10.122 -0.734 533 HH TYR 727 HH TYR 727 1.306 -12.315 1.707 534 H ARG 728 H ARG 728 -4.240 -7.045 3.783 535 HA ARG 728 HA ARG 728 -6.282 -5.282 2.662 536 HB2 ARG 728 HB2 ARG 728 -7.203 -5.371 5.207 537 HB3 ARG 728 HB3 ARG 728 -7.881 -6.333 3.901 538 HG2 ARG 728 HG2 ARG 728 -6.417 -8.219 4.500 539 HG3 ARG 728 HG3 ARG 728 -5.673 -7.247 5.767 540 HD2 ARG 728 HD2 ARG 728 -8.556 -7.230 6.035 541 HD3 ARG 728 HD3 ARG 728 -7.943 -8.884 6.005 542 HE ARG 728 HE ARG 728 -6.559 -6.996 7.777 543 HH11 ARG 728 HH21 ARG 728 -8.869 -9.542 7.408 544 HH12 ARG 728 HH22 ARG 728 -8.840 -9.969 9.079 545 HH21 ARG 728 HH11 ARG 728 -6.525 -7.514 9.914 546 HH22 ARG 728 HH12 ARG 728 -7.513 -8.834 10.501 547 H ILE 729 H ILE 729 -6.018 -3.201 3.241 548 HA ILE 729 HA ILE 729 -3.625 -2.499 4.764 549 HB ILE 729 HB ILE 729 -5.541 -0.557 3.508 550 HG12 ILE 729 HG12 ILE 729 -3.434 -2.237 2.128 551 HG13 ILE 729 HG13 ILE 729 -5.157 -2.168 1.759 552 HG21 ILE 729 HG21 ILE 729 -2.995 0.313 3.043 553 HG22 ILE 729 HG22 ILE 729 -3.956 0.758 4.454 554 HG23 ILE 729 HG23 ILE 729 -2.787 -0.555 4.562 555 HD11 ILE 729 HD11 ILE 729 -4.328 -0.737 0.137 556 HD12 ILE 729 HD12 ILE 729 -4.649 0.409 1.438 557 HD13 ILE 729 HD13 ILE 729 -3.008 -0.176 1.164 558 H THR 730 H THR 730 -7.106 -2.170 4.911 559 HA THR 730 HA THR 730 -6.889 -0.756 7.500 560 HB THR 730 HB THR 730 -8.185 0.360 5.740 561 HG1 THR 730 HG1 THR 730 -9.614 0.970 7.152 562 HG21 THR 730 HG21 THR 730 -10.509 -1.277 5.681 563 HG22 THR 730 HG22 THR 730 -9.450 -0.855 4.339 564 HG23 THR 730 HG23 THR 730 -9.130 -2.301 5.291 565 H GLU 731 H GLU 731 -7.402 -3.747 6.149 566 HA GLU 731 HA GLU 731 -7.901 -5.758 7.106 567 HB2 GLU 731 HB2 GLU 731 -8.631 -4.371 9.667 568 HB3 GLU 731 HB3 GLU 731 -7.934 -5.976 9.436 569 HG2 GLU 731 HG2 GLU 731 -6.106 -4.279 8.183 570 HG3 GLU 731 HG3 GLU 731 -6.588 -3.374 9.610 571 H LYS 732 H LYS 732 -9.976 -3.210 6.725 572 HA LYS 732 HA LYS 732 -12.418 -4.658 7.434 573 HB2 LYS 732 HB2 LYS 732 -12.326 -2.017 5.998 574 HB3 LYS 732 HB3 LYS 732 -13.550 -2.632 7.103 575 HG2 LYS 732 HG2 LYS 732 -10.719 -1.905 7.915 576 HG3 LYS 732 HG3 LYS 732 -12.115 -0.858 8.129 577 HD2 LYS 732 HD2 LYS 732 -12.393 -3.623 9.189 578 HD3 LYS 732 HD3 LYS 732 -11.260 -2.577 10.041 579 HE2 LYS 732 HE2 LYS 732 -13.875 -1.363 9.341 580 HE3 LYS 732 HE3 LYS 732 -13.906 -2.622 10.575 581 HZ1 LYS 732 HZ1 LYS 732 -13.251 -0.014 10.989 582 HZ2 LYS 732 HZ2 LYS 732 -12.909 -1.311 12.060 583 HZ3 LYS 732 HZ3 LYS 732 -11.724 -0.780 10.934 584 H LYS 733 H LYS 733 -10.589 -3.588 4.635 585 HA LYS 733 HA LYS 733 -12.327 -5.230 2.896 586 HB2 LYS 733 HB2 LYS 733 -12.781 -2.901 2.411 587 HB3 LYS 733 HB3 LYS 733 -11.061 -2.546 2.294 588 HG2 LYS 733 HG2 LYS 733 -11.869 -2.770 0.045 589 HG3 LYS 733 HG3 LYS 733 -10.950 -4.234 0.393 590 HD2 LYS 733 HD2 LYS 733 -12.838 -5.569 0.497 591 HD3 LYS 733 HD3 LYS 733 -13.877 -4.240 1.016 592 HE2 LYS 733 HE2 LYS 733 -12.656 -4.287 -1.742 593 HE3 LYS 733 HE3 LYS 733 -14.179 -5.112 -1.399 594 HZ1 LYS 733 HZ1 LYS 733 -13.591 -2.221 -1.001 595 HZ2 LYS 733 HZ2 LYS 733 -14.648 -2.893 -2.153 596 HZ3 LYS 733 HZ3 LYS 733 -15.022 -2.984 -0.498 597 H ALA 734 H ALA 734 -11.131 -7.004 2.511 598 HA ALA 734 HA ALA 734 -8.252 -6.707 1.948 599 HB1 ALA 734 HB1 ALA 734 -7.938 -8.829 2.785 600 HB2 ALA 734 HB2 ALA 734 -9.539 -9.379 2.289 601 HB3 ALA 734 HB3 ALA 734 -9.360 -8.357 3.716 602 H PHE 735 H PHE 735 -7.393 -8.360 0.338 603 HA PHE 735 HA PHE 735 -9.276 -8.848 -1.878 604 HB2 PHE 735 HB2 PHE 735 -6.998 -6.984 -1.886 605 HB3 PHE 735 HB3 PHE 735 -7.045 -8.091 -3.257 606 HD1 PHE 735 HD2 PHE 735 -9.013 -8.155 -4.760 607 HD2 PHE 735 HD1 PHE 735 -8.699 -5.299 -1.570 608 HE1 PHE 735 HE2 PHE 735 -10.850 -6.831 -5.767 609 HE2 PHE 735 HE1 PHE 735 -10.538 -3.975 -2.577 610 HZ PHE 735 HZ PHE 735 -11.615 -4.743 -4.673 611 H ARG 736 H ARG 736 -8.054 -10.089 -3.687 612 HA ARG 736 HA ARG 736 -7.399 -12.631 -2.801 613 HB2 ARG 736 HB2 ARG 736 -6.889 -11.134 -5.345 614 HB3 ARG 736 HB3 ARG 736 -6.187 -12.731 -5.130 615 HG2 ARG 736 HG2 ARG 736 -8.282 -13.095 -6.199 616 HG3 ARG 736 HG3 ARG 736 -8.532 -13.535 -4.511 617 HD2 ARG 736 HD2 ARG 736 -9.808 -11.637 -4.066 618 HD3 ARG 736 HD3 ARG 736 -9.094 -10.716 -5.382 619 HE ARG 736 HE ARG 736 -11.309 -12.601 -5.577 620 HH11 ARG 736 HH21 ARG 736 -8.891 -10.712 -7.242 621 HH12 ARG 736 HH22 ARG 736 -9.731 -10.829 -8.764 622 HH21 ARG 736 HH11 ARG 736 -12.342 -12.698 -7.553 623 HH22 ARG 736 HH12 ARG 736 -11.651 -11.922 -8.932 624 H GLY 737 H GLY 737 -5.186 -10.033 -3.776 625 HA2 GLY 737 HA2 GLY 737 -3.099 -11.190 -2.068 626 HA3 GLY 737 HA3 GLY 737 -2.733 -10.984 -3.780 627 H LEU 738 H LEU 738 -1.079 -9.491 -3.257 628 HA LEU 738 HA LEU 738 -1.722 -7.045 -1.851 629 HB2 LEU 738 HB2 LEU 738 0.634 -8.430 -2.473 630 HB3 LEU 738 HB3 LEU 738 0.721 -6.941 -3.413 631 HG LEU 738 HG LEU 738 0.121 -7.081 -0.444 632 HD11 LEU 738 HD11 LEU 738 2.339 -6.336 -0.072 633 HD12 LEU 738 HD12 LEU 738 2.484 -7.671 -1.208 634 HD13 LEU 738 HD13 LEU 738 2.603 -6.009 -1.782 635 HD21 LEU 738 HD21 LEU 738 0.346 -4.858 -2.461 636 HD22 LEU 738 HD22 LEU 738 -0.914 -5.136 -1.257 637 HD23 LEU 738 HD23 LEU 738 0.673 -4.567 -0.753 638 H THR 739 H THR 739 -0.791 -7.886 -5.178 639 HA THR 739 HA THR 739 -1.073 -5.426 -6.394 640 HB THR 739 HB THR 739 -2.028 -8.039 -7.586 641 HG1 THR 739 HG1 THR 739 -0.051 -8.680 -7.480 642 HG21 THR 739 HG21 THR 739 -0.915 -5.492 -8.778 643 HG22 THR 739 HG22 THR 739 -1.196 -6.976 -9.688 644 HG23 THR 739 HG23 THR 739 -2.553 -6.119 -8.959 645 H GLU 740 H GLU 740 -3.611 -7.918 -6.091 646 HA GLU 740 HA GLU 740 -5.747 -6.353 -7.020 647 HB2 GLU 740 HB2 GLU 740 -5.939 -8.527 -4.932 648 HB3 GLU 740 HB3 GLU 740 -7.191 -8.008 -6.060 649 HG2 GLU 740 HG2 GLU 740 -5.096 -8.634 -7.754 650 HG3 GLU 740 HG3 GLU 740 -4.924 -9.843 -6.485 651 H LEU 741 H LEU 741 -4.283 -6.580 -3.856 652 HA LEU 741 HA LEU 741 -6.374 -5.147 -2.506 653 HB2 LEU 741 HB2 LEU 741 -4.923 -6.791 -1.377 654 HB3 LEU 741 HB3 LEU 741 -3.529 -5.757 -1.660 655 HG LEU 741 HG LEU 741 -4.706 -5.663 0.650 656 HD11 LEU 741 HD11 LEU 741 -3.264 -3.820 -0.879 657 HD12 LEU 741 HD12 LEU 741 -4.592 -2.896 -0.181 658 HD13 LEU 741 HD13 LEU 741 -3.499 -3.799 0.866 659 HD21 LEU 741 HD21 LEU 741 -6.608 -4.186 0.817 660 HD22 LEU 741 HD22 LEU 741 -6.534 -3.814 -0.902 661 HD23 LEU 741 HD23 LEU 741 -7.000 -5.428 -0.370 662 H VAL 742 H VAL 742 -3.229 -4.307 -3.923 663 HA VAL 742 HA VAL 742 -3.552 -1.508 -3.079 664 HB VAL 742 HB VAL 742 -1.333 -3.110 -4.274 665 HG11 VAL 742 HG11 VAL 742 -1.624 -0.107 -4.486 666 HG12 VAL 742 HG12 VAL 742 -0.088 -0.957 -4.647 667 HG13 VAL 742 HG13 VAL 742 -1.381 -1.250 -5.809 668 HG21 VAL 742 HG21 VAL 742 -0.229 -1.417 -2.505 669 HG22 VAL 742 HG22 VAL 742 -1.880 -1.421 -1.886 670 HG23 VAL 742 HG23 VAL 742 -0.981 -2.933 -2.012 671 H GLU 743 H GLU 743 -3.900 -3.473 -5.970 672 HA GLU 743 HA GLU 743 -4.052 -1.190 -7.734 673 HB2 GLU 743 HB2 GLU 743 -4.786 -4.097 -8.151 674 HB3 GLU 743 HB3 GLU 743 -4.832 -2.869 -9.414 675 HG2 GLU 743 HG2 GLU 743 -2.359 -3.604 -7.811 676 HG3 GLU 743 HG3 GLU 743 -2.706 -4.177 -9.436 677 H PHE 744 H PHE 744 -6.037 -2.139 -5.363 678 HA PHE 744 HA PHE 744 -8.482 -1.381 -6.844 679 HB2 PHE 744 HB2 PHE 744 -8.463 -3.638 -5.691 680 HB3 PHE 744 HB3 PHE 744 -8.379 -2.769 -4.159 681 HD1 PHE 744 HD2 PHE 744 -10.457 -3.521 -7.104 682 HD2 PHE 744 HD1 PHE 744 -10.263 -1.414 -3.366 683 HE1 PHE 744 HE2 PHE 744 -12.906 -3.154 -7.183 684 HE2 PHE 744 HE1 PHE 744 -12.713 -1.044 -3.447 685 HZ PHE 744 HZ PHE 744 -14.034 -1.916 -5.355 686 H TYR 745 H TYR 745 -6.622 -0.871 -3.871 687 HA TYR 745 HA TYR 745 -8.331 1.127 -2.793 688 HB2 TYR 745 HB2 TYR 745 -5.484 0.320 -2.297 689 HB3 TYR 745 HB3 TYR 745 -6.113 1.806 -1.589 690 HD1 TYR 745 HD1 TYR 745 -7.429 -1.672 -2.152 691 HD2 TYR 745 HD2 TYR 745 -6.850 1.568 0.625 692 HE1 TYR 745 HE1 TYR 745 -8.533 -2.997 -0.365 693 HE2 TYR 745 HE2 TYR 745 -7.944 0.231 2.397 694 HH TYR 745 HH TYR 745 -8.898 -3.141 1.886 695 H GLN 746 H GLN 746 -6.263 1.143 -5.479 696 HA GLN 746 HA GLN 746 -5.460 3.889 -5.474 697 HB2 GLN 746 HB2 GLN 746 -5.191 3.473 -7.983 698 HB3 GLN 746 HB3 GLN 746 -4.246 2.430 -6.919 699 HG2 GLN 746 HG2 GLN 746 -5.400 0.566 -7.510 700 HG3 GLN 746 HG3 GLN 746 -6.946 1.405 -7.532 701 HE21 GLN 746 HE21 GLN 746 -4.373 0.207 -9.524 702 HE22 GLN 746 HE22 GLN 746 -4.951 0.832 -10.991 703 H GLN 747 H GLN 747 -8.357 2.203 -6.127 704 HA GLN 747 HA GLN 747 -9.617 4.578 -7.362 705 HB2 GLN 747 HB2 GLN 747 -10.943 1.887 -7.175 706 HB3 GLN 747 HB3 GLN 747 -11.171 3.160 -8.373 707 HG2 GLN 747 HG2 GLN 747 -8.437 2.373 -8.502 708 HG3 GLN 747 HG3 GLN 747 -9.397 0.899 -8.480 709 HE21 GLN 747 HE21 GLN 747 -7.879 2.355 -10.722 710 HE22 GLN 747 HE22 GLN 747 -9.042 2.498 -11.959 711 H ASN 748 H ASN 748 -9.860 2.189 -4.775 712 HA ASN 748 HA ASN 748 -12.250 3.274 -3.630 713 HB2 ASN 748 HB2 ASN 748 -11.138 0.910 -3.341 714 HB3 ASN 748 HB3 ASN 748 -10.251 1.700 -2.041 715 HD21 ASN 748 HD21 ASN 748 -12.082 3.333 -0.830 716 HD22 ASN 748 HD22 ASN 748 -13.418 2.439 -0.285 717 H SER 749 H SER 749 -12.333 5.246 -2.757 718 HA SER 749 HA SER 749 -10.234 6.896 -2.047 719 HB2 SER 749 HB2 SER 749 -12.295 7.635 -0.340 720 HB3 SER 749 HB3 SER 749 -12.048 8.215 -1.984 721 HG SER 749 HG SER 749 -13.820 6.292 -0.961 722 H LEU 750 H LEU 750 -8.707 6.688 -0.548 723 HA LEU 750 HA LEU 750 -8.646 4.710 1.412 724 HB2 LEU 750 HB2 LEU 750 -7.224 7.378 1.336 725 HB3 LEU 750 HB3 LEU 750 -6.829 6.081 2.463 726 HG LEU 750 HG LEU 750 -6.656 6.010 -0.555 727 HD11 LEU 750 HD11 LEU 750 -4.719 6.182 1.701 728 HD12 LEU 750 HD12 LEU 750 -4.257 5.205 0.308 729 HD13 LEU 750 HD13 LEU 750 -4.644 6.912 0.097 730 HD21 LEU 750 HD21 LEU 750 -5.601 3.662 0.112 731 HD22 LEU 750 HD22 LEU 750 -6.699 3.820 1.482 732 HD23 LEU 750 HD23 LEU 750 -7.334 3.831 -0.164 733 H LYS 751 H LYS 751 -10.017 7.929 1.554 734 HA LYS 751 HA LYS 751 -10.250 8.292 4.307 735 HB2 LYS 751 HB2 LYS 751 -11.874 9.928 3.825 736 HB3 LYS 751 HB3 LYS 751 -10.851 9.897 2.392 737 HG2 LYS 751 HG2 LYS 751 -12.574 8.099 1.539 738 HG3 LYS 751 HG3 LYS 751 -13.637 8.825 2.742 739 HD2 LYS 751 HD2 LYS 751 -12.201 10.340 0.536 740 HD3 LYS 751 HD3 LYS 751 -13.910 9.903 0.526 741 HE2 LYS 751 HE2 LYS 751 -12.558 11.670 2.591 742 HE3 LYS 751 HE3 LYS 751 -13.597 12.236 1.280 743 HZ1 LYS 751 HZ1 LYS 751 -14.918 12.055 3.235 744 HZ2 LYS 751 HZ2 LYS 751 -15.364 10.773 2.210 745 HZ3 LYS 751 HZ3 LYS 751 -14.360 10.477 3.548 746 H ASP 752 H ASP 752 -11.783 5.977 2.299 747 HA ASP 752 HA ASP 752 -13.996 5.531 4.170 748 HB2 ASP 752 HB2 ASP 752 -13.320 4.034 1.631 749 HB3 ASP 752 HB3 ASP 752 -14.852 4.017 2.503 750 H CYS 753 H CYS 753 -10.962 4.129 3.169 751 HA CYS 753 HA CYS 753 -11.415 1.744 4.838 752 HB2 CYS 753 HB2 CYS 753 -9.302 2.440 2.791 753 HB3 CYS 753 HB3 CYS 753 -9.265 0.977 3.772 754 HG CYS 753 HG CYS 753 -10.585 0.762 1.351 755 H PHE 754 H PHE 754 -9.084 4.374 4.334 756 HA PHE 754 HA PHE 754 -7.440 3.579 6.557 757 HB2 PHE 754 HB2 PHE 754 -7.519 5.994 4.756 758 HB3 PHE 754 HB3 PHE 754 -6.345 5.825 6.054 759 HD1 PHE 754 HD2 PHE 754 -7.475 2.728 4.457 760 HD2 PHE 754 HD1 PHE 754 -4.557 5.874 4.274 761 HE1 PHE 754 HE2 PHE 754 -6.075 1.343 2.974 762 HE2 PHE 754 HE1 PHE 754 -3.172 4.487 2.785 763 HZ PHE 754 HZ PHE 754 -3.916 2.218 2.133 764 H LYS 755 H LYS 755 -8.000 6.965 6.534 765 HA LYS 755 HA LYS 755 -9.982 7.009 8.652 766 HB2 LYS 755 HB2 LYS 755 -7.986 6.320 9.887 767 HB3 LYS 755 HB3 LYS 755 -7.114 7.719 9.269 768 HG2 LYS 755 HG2 LYS 755 -8.667 9.234 10.409 769 HG3 LYS 755 HG3 LYS 755 -9.645 7.865 10.939 770 HD2 LYS 755 HD2 LYS 755 -8.360 7.752 12.778 771 HD3 LYS 755 HD3 LYS 755 -7.036 7.233 11.739 772 HE2 LYS 755 HE2 LYS 755 -7.684 10.042 12.660 773 HE3 LYS 755 HE3 LYS 755 -6.203 9.126 12.936 774 HZ1 LYS 755 HZ1 LYS 755 -5.434 10.194 11.137 775 HZ2 LYS 755 HZ2 LYS 755 -6.411 9.154 10.229 776 HZ3 LYS 755 HZ3 LYS 755 -7.000 10.702 10.639 777 H SER 756 H SER 756 -7.591 9.418 8.898 778 HA SER 756 HA SER 756 -9.410 11.439 7.967 779 HB2 SER 756 HB2 SER 756 -6.503 11.856 8.666 780 HB3 SER 756 HB3 SER 756 -7.831 13.005 8.795 781 HG SER 756 HG SER 756 -8.540 12.014 10.585 782 H LEU 757 H LEU 757 -8.202 9.379 6.117 783 HA LEU 757 HA LEU 757 -6.485 10.851 4.327 784 HB2 LEU 757 HB2 LEU 757 -7.741 8.133 4.365 785 HB3 LEU 757 HB3 LEU 757 -7.141 8.768 2.839 786 HG LEU 757 HG LEU 757 -5.562 7.367 4.411 787 HD11 LEU 757 HD11 LEU 757 -5.156 9.299 2.405 788 HD12 LEU 757 HD12 LEU 757 -3.950 9.611 3.654 789 HD13 LEU 757 HD13 LEU 757 -4.053 8.019 2.908 790 HD21 LEU 757 HD21 LEU 757 -6.065 8.983 6.335 791 HD22 LEU 757 HD22 LEU 757 -4.378 8.564 6.056 792 HD23 LEU 757 HD23 LEU 757 -5.004 10.114 5.498 793 H ASP 758 H ASP 758 -7.067 10.939 1.997 794 HA ASP 758 HA ASP 758 -9.800 11.100 1.192 795 HB2 ASP 758 HB2 ASP 758 -8.702 13.437 2.416 796 HB3 ASP 758 HB3 ASP 758 -8.891 13.764 0.696 797 H THR 759 H THR 759 -8.002 9.568 0.186 798 HA THR 759 HA THR 759 -7.632 10.496 -2.520 799 HB THR 759 HB THR 759 -5.648 11.476 -1.387 800 HG1 THR 759 HG1 THR 759 -4.609 10.999 -3.143 801 HG21 THR 759 HG21 THR 759 -4.870 10.210 0.342 802 HG22 THR 759 HG22 THR 759 -5.501 8.716 -0.337 803 HG23 THR 759 HG23 THR 759 -3.962 9.363 -0.908 804 H THR 760 H THR 760 -5.594 8.714 -3.189 805 HA THR 760 HA THR 760 -6.279 6.036 -2.308 806 HB THR 760 HB THR 760 -6.939 5.234 -4.543 807 HG1 THR 760 HG1 THR 760 -7.095 6.552 -6.193 808 HG21 THR 760 HG21 THR 760 -8.765 7.494 -3.759 809 HG22 THR 760 HG22 THR 760 -9.197 5.923 -4.429 810 HG23 THR 760 HG23 THR 760 -8.601 6.040 -2.775 811 H LEU 761 H LEU 761 -5.018 4.402 -3.646 812 HA LEU 761 HA LEU 761 -2.280 5.059 -3.684 813 HB2 LEU 761 HB2 LEU 761 -3.837 2.814 -5.017 814 HB3 LEU 761 HB3 LEU 761 -2.083 2.895 -5.007 815 HG LEU 761 HG LEU 761 -3.170 1.433 -3.206 816 HD11 LEU 761 HD11 LEU 761 -1.208 3.619 -2.670 817 HD12 LEU 761 HD12 LEU 761 -1.667 2.508 -1.384 818 HD13 LEU 761 HD13 LEU 761 -0.924 1.885 -2.856 819 HD21 LEU 761 HD21 LEU 761 -4.973 3.009 -2.570 820 HD22 LEU 761 HD22 LEU 761 -3.969 2.561 -1.198 821 HD23 LEU 761 HD23 LEU 761 -3.755 4.131 -1.962 822 H GLN 762 H GLN 762 -2.242 7.047 -4.850 823 HA GLN 762 HA GLN 762 -3.196 7.336 -7.499 824 HB2 GLN 762 HB2 GLN 762 -1.838 8.932 -5.504 825 HB3 GLN 762 HB3 GLN 762 -1.193 9.247 -7.111 826 HG2 GLN 762 HG2 GLN 762 -4.022 9.123 -7.371 827 HG3 GLN 762 HG3 GLN 762 -3.683 10.116 -5.956 828 HE21 GLN 762 HE21 GLN 762 -1.513 11.597 -6.551 829 HE22 GLN 762 HE22 GLN 762 -1.726 12.476 -7.984 830 H PHE 763 H PHE 763 0.204 7.332 -6.371 831 HA PHE 763 HA PHE 763 0.889 5.979 -8.913 832 HB2 PHE 763 HB2 PHE 763 2.236 8.430 -7.763 833 HB3 PHE 763 HB3 PHE 763 2.883 7.481 -9.102 834 HD1 PHE 763 HD1 PHE 763 1.434 7.179 -11.193 835 HD2 PHE 763 HD2 PHE 763 0.559 10.061 -8.129 836 HE1 PHE 763 HE1 PHE 763 -0.030 8.412 -12.767 837 HE2 PHE 763 HE2 PHE 763 -0.909 11.290 -9.704 838 HZ PHE 763 HZ PHE 763 -1.203 10.467 -12.024 839 HA PRO 764 HA PRO 764 3.491 3.439 -6.414 840 HB2 PRO 764 HB2 PRO 764 5.224 2.537 -8.300 841 HB3 PRO 764 HB3 PRO 764 3.518 2.048 -8.276 842 HG2 PRO 764 HG2 PRO 764 4.880 4.082 -9.960 843 HG3 PRO 764 HG3 PRO 764 3.640 2.907 -10.399 844 HD2 PRO 764 HD2 PRO 764 3.106 5.551 -9.903 845 HD3 PRO 764 HD3 PRO 764 1.918 4.247 -9.680 846 H PHE 765 H PHE 765 6.225 2.963 -6.639 847 HA PHE 765 HA PHE 765 7.361 5.670 -6.283 848 HB2 PHE 765 HB2 PHE 765 8.566 4.992 -4.404 849 HB3 PHE 765 HB3 PHE 765 7.006 4.207 -4.190 850 HD1 PHE 765 HD1 PHE 765 6.735 1.796 -4.695 851 HD2 PHE 765 HD2 PHE 765 10.569 3.718 -4.787 852 HE1 PHE 765 HE1 PHE 765 7.847 -0.416 -4.593 853 HE2 PHE 765 HE2 PHE 765 11.685 1.508 -4.687 854 HZ PHE 765 HZ PHE 765 10.322 -0.559 -4.588 855 H LYS 766 H LYS 766 7.701 2.549 -7.794 856 HA LYS 766 HA LYS 766 10.504 2.974 -8.438 857 HB2 LYS 766 HB2 LYS 766 8.581 0.989 -9.668 858 HB3 LYS 766 HB3 LYS 766 10.337 0.957 -9.763 859 HG2 LYS 766 HG2 LYS 766 9.894 1.112 -7.042 860 HG3 LYS 766 HG3 LYS 766 8.575 0.082 -7.579 861 HD2 LYS 766 HD2 LYS 766 11.019 -0.683 -8.908 862 HD3 LYS 766 HD3 LYS 766 11.257 -0.661 -7.164 863 HE2 LYS 766 HE2 LYS 766 8.701 -1.860 -7.774 864 HE3 LYS 766 HE3 LYS 766 9.970 -2.666 -8.696 865 HZ1 LYS 766 HZ1 LYS 766 10.540 -3.722 -6.849 866 HZ2 LYS 766 HZ2 LYS 766 10.975 -2.237 -6.149 867 HZ3 LYS 766 HZ3 LYS 766 9.399 -2.845 -5.920 868 H GLU 767 H GLU 767 7.371 3.577 -9.850 869 HA GLU 767 HA GLU 767 7.513 3.994 -12.429 870 HB2 GLU 767 HB2 GLU 767 6.192 5.364 -10.319 871 HB3 GLU 767 HB3 GLU 767 6.809 6.587 -11.424 872 HG2 GLU 767 HG2 GLU 767 5.831 4.822 -13.220 873 HG3 GLU 767 HG3 GLU 767 4.735 4.511 -11.884 874 H1 ASP 338 H1 ASP 338 3.018 7.756 15.151 875 H2 ASP 338 H2 ASP 338 2.621 6.739 14.706 876 H3 ASP 338 H3 ASP 338 1.847 7.901 13.721 877 HA ASP 338 HA ASP 338 3.665 6.523 12.676 878 HB2 ASP 338 HB2 ASP 338 2.763 9.138 12.258 879 HB3 ASP 338 HB3 ASP 338 4.518 9.278 12.218 880 H THR 339 H THR 339 5.019 5.541 14.218 881 HA THR 339 HA THR 339 7.238 7.174 15.286 882 HB THR 339 HB THR 339 7.763 5.040 16.547 883 HG1 THR 339 HG1 THR 339 5.213 4.128 16.090 884 HG21 THR 339 HG21 THR 339 6.644 6.205 18.100 885 HG22 THR 339 HG22 THR 339 5.522 6.863 16.899 886 HG23 THR 339 HG23 THR 339 5.211 5.286 17.644 887 H GLU 340 H GLU 340 9.255 5.275 15.391 888 HA GLU 340 HA GLU 340 10.306 5.353 12.775 889 HB2 GLU 340 HB2 GLU 340 11.107 3.368 14.914 890 HB3 GLU 340 HB3 GLU 340 12.108 4.020 13.615 891 HG2 GLU 340 HG2 GLU 340 12.797 5.387 15.354 892 HG3 GLU 340 HG3 GLU 340 11.449 6.343 14.744 893 H VAL 341 H VAL 341 7.674 3.705 13.610 894 HA VAL 341 HA VAL 341 8.129 1.587 11.609 895 HB VAL 341 HB VAL 341 8.259 0.808 14.066 896 HG11 VAL 341 HG11 VAL 341 6.534 1.295 15.416 897 HG12 VAL 341 HG12 VAL 341 5.702 2.103 14.089 898 HG13 VAL 341 HG13 VAL 341 5.455 0.378 14.364 899 HG21 VAL 341 HG21 VAL 341 7.107 -0.357 11.723 900 HG22 VAL 341 HG22 VAL 341 7.903 -1.170 13.068 901 HG23 VAL 341 HG23 VAL 341 6.164 -0.890 13.114 902 H PTR 342 H PTR 342 5.500 0.493 11.846 903 HA PTR 342 HA PTR 342 3.823 2.788 11.006 904 HB2 PTR 342 HB2 PTR 342 2.701 0.824 9.578 905 HB3 PTR 342 HB3 PTR 342 4.050 1.773 8.961 906 HD1 PTR 342 HD1 PTR 342 2.975 -1.491 10.196 907 HD2 PTR 342 HD2 PTR 342 6.360 0.870 9.022 908 HE1 PTR 342 HE1 PTR 342 4.352 -3.547 10.035 909 HE2 PTR 342 HE2 PTR 342 7.736 -1.183 8.866 910 H GLU 343 H GLU 343 3.040 2.858 13.193 911 HA GLU 343 HA GLU 343 1.816 0.669 14.500 912 HB2 GLU 343 HB2 GLU 343 0.906 3.505 14.907 913 HB3 GLU 343 HB3 GLU 343 1.092 2.219 16.095 914 HG2 GLU 343 HG2 GLU 343 3.017 3.378 16.573 915 HG3 GLU 343 HG3 GLU 343 3.650 2.384 15.264 916 H SER 344 H SER 344 0.885 0.305 11.999 917 HA SER 344 HA SER 344 -1.010 0.481 10.569 918 HB2 SER 344 HB2 SER 344 -1.068 -1.507 12.275 919 HB3 SER 344 HB3 SER 344 -2.403 -0.616 12.996 920 HG SER 344 HG SER 344 -3.510 -0.734 11.060 921 HA PRO 345 HA PRO 345 -2.398 4.542 12.661 922 HB2 PRO 345 HB2 PRO 345 -2.695 4.941 9.705 923 HB3 PRO 345 HB3 PRO 345 -2.152 6.086 10.947 924 HG2 PRO 345 HG2 PRO 345 -0.450 4.787 9.316 925 HG3 PRO 345 HG3 PRO 345 -0.030 5.268 10.967 926 HD2 PRO 345 HD2 PRO 345 -0.457 2.569 9.886 927 HD3 PRO 345 HD3 PRO 345 0.296 3.057 11.419 928 H PTR 346 H PTR 346 -3.850 2.659 10.009 929 HA PTR 346 HA PTR 346 -6.523 3.352 11.082 930 HB2 PTR 346 HB2 PTR 346 -6.019 2.653 8.201 931 HB3 PTR 346 HB3 PTR 346 -7.378 3.529 8.911 932 HD1 PTR 346 HD1 PTR 346 -4.915 4.175 6.760 933 HD2 PTR 346 HD2 PTR 346 -6.111 5.431 10.686 934 HE1 PTR 346 HE1 PTR 346 -3.694 6.325 6.455 935 HE2 PTR 346 HE2 PTR 346 -4.904 7.563 10.384 936 H ALA 347 H ALA 347 -8.172 1.823 10.919 937 HA ALA 347 HA ALA 347 -8.259 -0.690 9.894 938 HB1 ALA 347 HB1 ALA 347 -7.575 -2.023 12.054 939 HB2 ALA 347 HB2 ALA 347 -6.557 -0.616 12.363 940 HB3 ALA 347 HB3 ALA 347 -6.341 -1.553 10.886 941 H ASP 348 H ASP 348 -8.427 0.184 13.339 942 HA ASP 348 HA ASP 348 -11.330 0.395 13.257 943 HB2 ASP 348 HB2 ASP 348 -9.874 -1.908 14.521 944 HB3 ASP 348 HB3 ASP 348 -11.362 -1.313 15.253 945 HA PRO 349 HA PRO 349 -9.220 2.874 16.552 946 HB2 PRO 349 HB2 PRO 349 -9.451 5.351 15.472 947 HB3 PRO 349 HB3 PRO 349 -8.129 4.245 15.055 948 HG2 PRO 349 HG2 PRO 349 -10.487 5.032 13.475 949 HG3 PRO 349 HG3 PRO 349 -8.900 4.469 12.936 950 HD2 PRO 349 HD2 PRO 349 -11.304 2.931 13.122 951 HD3 PRO 349 HD3 PRO 349 -9.680 2.346 12.703 952 H GLU 350 H GLU 350 -11.537 4.989 14.935 953 HA GLU 350 HA GLU 350 -13.344 4.776 17.266 954 HB2 GLU 350 HB2 GLU 350 -12.898 7.299 15.668 955 HB3 GLU 350 HB3 GLU 350 -13.723 7.119 17.216 956 HG2 GLU 350 HG2 GLU 350 -11.793 7.232 18.377 957 HG3 GLU 350 HG3 GLU 350 -10.989 6.092 17.303 Start of MODEL 9 1 H1 GLY 661 H1 GLY 661 2.123 -14.537 -11.127 2 H2 GLY 661 H2 GLY 661 0.958 -15.517 -11.905 3 H3 GLY 661 H3 GLY 661 0.473 -14.132 -11.046 4 HA2 GLY 661 HA2 GLY 661 2.385 -13.427 -13.014 5 HA3 GLY 661 HA3 GLY 661 1.037 -14.297 -13.747 6 H HIS 662 H HIS 662 2.070 -11.377 -12.247 7 HA HIS 662 HA HIS 662 1.101 -9.313 -11.993 8 HB2 HIS 662 HB2 HIS 662 0.487 -9.907 -14.424 9 HB3 HIS 662 HB3 HIS 662 -1.122 -10.255 -13.793 10 HD1 HIS 662 HD1 HIS 662 -1.626 -8.105 -11.826 11 HD2 HIS 662 HD2 HIS 662 0.334 -7.332 -15.428 12 HE1 HIS 662 HE1 HIS 662 -1.950 -5.625 -12.311 13 HE2 HIS 662 HE2 HIS 662 -0.760 -5.143 -14.505 14 H MET 663 H MET 663 0.042 -11.869 -10.497 15 HA MET 663 HA MET 663 -2.417 -10.587 -9.446 16 HB2 MET 663 HB2 MET 663 -2.479 -12.940 -10.569 17 HB3 MET 663 HB3 MET 663 -1.761 -13.505 -9.067 18 HG2 MET 663 HG2 MET 663 -3.650 -12.330 -7.842 19 HG3 MET 663 HG3 MET 663 -4.398 -12.061 -9.418 20 HE1 MET 663 HE1 MET 663 -6.589 -13.358 -8.866 21 HE2 MET 663 HE2 MET 663 -5.883 -13.455 -10.475 22 HE3 MET 663 HE3 MET 663 -6.582 -14.902 -9.727 23 H GLN 664 H GLN 664 -0.829 -13.207 -7.804 24 HA GLN 664 HA GLN 664 -0.461 -11.604 -5.443 25 HB2 GLN 664 HB2 GLN 664 -0.572 -14.379 -6.058 26 HB3 GLN 664 HB3 GLN 664 1.000 -14.066 -5.323 27 HG2 GLN 664 HG2 GLN 664 -0.552 -14.547 -3.538 28 HG3 GLN 664 HG3 GLN 664 -0.180 -12.828 -3.481 29 HE21 GLN 664 HE21 GLN 664 -2.621 -14.158 -2.459 30 HE22 GLN 664 HE22 GLN 664 -3.925 -13.450 -3.289 31 H ASP 665 H ASP 665 1.275 -12.223 -8.282 32 HA ASP 665 HA ASP 665 3.953 -12.010 -7.319 33 HB2 ASP 665 HB2 ASP 665 3.393 -10.969 -10.025 34 HB3 ASP 665 HB3 ASP 665 4.532 -12.209 -9.513 35 H LEU 666 H LEU 666 4.649 -10.254 -6.235 36 HA LEU 666 HA LEU 666 3.466 -7.648 -6.856 37 HB2 LEU 666 HB2 LEU 666 5.373 -8.147 -4.598 38 HB3 LEU 666 HB3 LEU 666 4.052 -6.984 -4.704 39 HG LEU 666 HG LEU 666 3.725 -9.997 -4.548 40 HD11 LEU 666 HD11 LEU 666 4.290 -9.454 -2.378 41 HD12 LEU 666 HD12 LEU 666 3.683 -7.805 -2.514 42 HD13 LEU 666 HD13 LEU 666 2.554 -9.148 -2.328 43 HD21 LEU 666 HD21 LEU 666 1.822 -9.283 -5.688 44 HD22 LEU 666 HD22 LEU 666 1.295 -9.116 -4.017 45 HD23 LEU 666 HD23 LEU 666 1.828 -7.694 -4.919 46 H SER 667 H SER 667 6.553 -9.317 -6.803 47 HA SER 667 HA SER 667 8.233 -7.099 -7.244 48 HB2 SER 667 HB2 SER 667 8.590 -9.985 -8.066 49 HB3 SER 667 HB3 SER 667 9.865 -8.766 -8.066 50 HG SER 667 HG SER 667 9.767 -10.046 -6.117 51 H VAL 668 H VAL 668 5.774 -8.050 -9.177 52 HA VAL 668 HA VAL 668 7.193 -7.461 -11.691 53 HB VAL 668 HB VAL 668 5.294 -8.377 -12.839 54 HG11 VAL 668 HG11 VAL 668 6.761 -9.841 -10.842 55 HG12 VAL 668 HG12 VAL 668 5.138 -10.511 -10.980 56 HG13 VAL 668 HG13 VAL 668 6.170 -10.401 -12.405 57 HG21 VAL 668 HG21 VAL 668 4.004 -8.211 -10.113 58 HG22 VAL 668 HG22 VAL 668 3.415 -7.570 -11.645 59 HG23 VAL 668 HG23 VAL 668 3.382 -9.307 -11.345 60 H HIS 669 H HIS 669 5.572 -5.930 -9.293 61 HA HIS 669 HA HIS 669 4.235 -3.950 -11.005 62 HB2 HIS 669 HB2 HIS 669 4.354 -4.108 -7.984 63 HB3 HIS 669 HB3 HIS 669 3.310 -3.063 -8.944 64 HD1 HIS 669 HD1 HIS 669 2.239 -5.002 -11.023 65 HD2 HIS 669 HD2 HIS 669 2.593 -5.977 -6.994 66 HE1 HIS 669 HE1 HIS 669 0.573 -6.864 -10.589 67 HE2 HIS 669 HE2 HIS 669 0.702 -7.416 -8.098 68 H LEU 670 H LEU 670 4.474 -1.684 -9.628 69 HA LEU 670 HA LEU 670 7.368 -1.133 -9.501 70 HB2 LEU 670 HB2 LEU 670 6.691 1.221 -10.284 71 HB3 LEU 670 HB3 LEU 670 6.759 -0.045 -11.484 72 HG LEU 670 HG LEU 670 4.240 0.886 -10.085 73 HD11 LEU 670 HD11 LEU 670 5.276 1.383 -12.894 74 HD12 LEU 670 HD12 LEU 670 3.692 1.872 -12.293 75 HD13 LEU 670 HD13 LEU 670 5.151 2.583 -11.610 76 HD21 LEU 670 HD21 LEU 670 3.374 -1.052 -10.871 77 HD22 LEU 670 HD22 LEU 670 3.623 -0.414 -12.494 78 HD23 LEU 670 HD23 LEU 670 4.858 -1.428 -11.751 79 H TRP 671 H TRP 671 4.471 -1.193 -7.848 80 HA TRP 671 HA TRP 671 5.312 0.998 -6.097 81 HB2 TRP 671 HB2 TRP 671 3.018 0.593 -5.016 82 HB3 TRP 671 HB3 TRP 671 3.051 1.340 -6.604 83 HD1 TRP 671 HD1 TRP 671 1.657 0.226 -8.421 84 HE1 TRP 671 HE1 TRP 671 0.352 -1.995 -8.644 85 HE3 TRP 671 HE3 TRP 671 3.226 -2.119 -4.161 86 HZ2 TRP 671 HZ2 TRP 671 0.068 -4.462 -7.204 87 HZ3 TRP 671 HZ3 TRP 671 2.428 -4.400 -3.616 88 HH2 TRP 671 HH2 TRP 671 0.850 -5.570 -5.128 89 H TYR 672 H TYR 672 5.648 -2.262 -6.410 90 HA TYR 672 HA TYR 672 5.460 -2.910 -3.573 91 HB2 TYR 672 HB2 TYR 672 4.683 -4.577 -5.170 92 HB3 TYR 672 HB3 TYR 672 6.255 -4.576 -5.973 93 HD1 TYR 672 HD2 TYR 672 5.115 -4.685 -2.393 94 HD2 TYR 672 HD1 TYR 672 7.492 -6.477 -5.490 95 HE1 TYR 672 HE2 TYR 672 5.961 -6.367 -0.781 96 HE2 TYR 672 HE1 TYR 672 8.331 -8.161 -3.875 97 HH TYR 672 HH TYR 672 7.156 -9.104 -1.427 98 H ALA 673 H ALA 673 7.081 -2.500 -2.245 99 HA ALA 673 HA ALA 673 9.823 -2.337 -3.335 100 HB1 ALA 673 HB1 ALA 673 9.018 -1.428 -0.583 101 HB2 ALA 673 HB2 ALA 673 8.691 -0.416 -1.991 102 HB3 ALA 673 HB3 ALA 673 10.349 -0.863 -1.594 103 H GLY 674 H GLY 674 7.739 -4.149 -1.290 104 HA2 GLY 674 HA2 GLY 674 8.036 -6.009 0.036 105 HA3 GLY 674 HA3 GLY 674 9.380 -6.379 -1.033 106 HA PRO 675 HA PRO 675 11.848 -6.004 2.644 107 HB2 PRO 675 HB2 PRO 675 14.315 -5.994 1.420 108 HB3 PRO 675 HB3 PRO 675 13.349 -7.458 1.687 109 HG2 PRO 675 HG2 PRO 675 13.672 -5.827 -0.780 110 HG3 PRO 675 HG3 PRO 675 13.571 -7.586 -0.593 111 HD2 PRO 675 HD2 PRO 675 11.457 -6.075 -1.433 112 HD3 PRO 675 HD3 PRO 675 11.255 -7.581 -0.509 113 H MET 676 H MET 676 10.781 -3.701 2.516 114 HA MET 676 HA MET 676 12.971 -1.711 2.303 115 HB2 MET 676 HB2 MET 676 11.227 -1.506 0.494 116 HB3 MET 676 HB3 MET 676 10.042 -1.181 1.758 117 HG2 MET 676 HG2 MET 676 10.790 0.944 2.084 118 HG3 MET 676 HG3 MET 676 12.482 0.476 1.951 119 HE1 MET 676 HE1 MET 676 13.811 0.514 0.424 120 HE2 MET 676 HE2 MET 676 13.453 -0.017 -1.216 121 HE3 MET 676 HE3 MET 676 13.741 1.697 -0.875 122 H GLU 677 H GLU 677 12.584 0.231 3.686 123 HA GLU 677 HA GLU 677 11.285 -0.516 6.238 124 HB2 GLU 677 HB2 GLU 677 12.972 1.126 7.215 125 HB3 GLU 677 HB3 GLU 677 13.645 -0.376 6.575 126 HG2 GLU 677 HG2 GLU 677 14.475 0.666 4.638 127 HG3 GLU 677 HG3 GLU 677 13.395 2.043 4.810 128 H ARG 678 H ARG 678 10.460 1.323 7.515 129 HA ARG 678 HA ARG 678 8.633 2.910 6.148 130 HB2 ARG 678 HB2 ARG 678 8.758 2.384 8.660 131 HB3 ARG 678 HB3 ARG 678 9.878 3.740 8.770 132 HG2 ARG 678 HG2 ARG 678 7.885 4.884 7.313 133 HG3 ARG 678 HG3 ARG 678 6.951 3.740 8.278 134 HD2 ARG 678 HD2 ARG 678 8.949 5.117 9.889 135 HD3 ARG 678 HD3 ARG 678 7.863 6.256 9.101 136 HE ARG 678 HE ARG 678 6.319 4.147 10.235 137 HH11 ARG 678 HH21 ARG 678 8.373 6.780 11.265 138 HH12 ARG 678 HH22 ARG 678 7.404 7.093 12.667 139 HH21 ARG 678 HH11 ARG 678 5.128 4.584 12.059 140 HH22 ARG 678 HH12 ARG 678 5.596 5.874 13.120 141 H ALA 679 H ALA 679 11.655 4.076 7.660 142 HA ALA 679 HA ALA 679 11.621 6.653 6.592 143 HB1 ALA 679 HB1 ALA 679 14.230 6.338 6.883 144 HB2 ALA 679 HB2 ALA 679 13.734 4.860 7.707 145 HB3 ALA 679 HB3 ALA 679 13.168 6.425 8.288 146 H GLY 680 H GLY 680 12.702 3.623 5.232 147 HA2 GLY 680 HA2 GLY 680 14.014 4.818 2.958 148 HA3 GLY 680 HA3 GLY 680 13.637 3.111 3.161 149 H ALA 681 H ALA 681 10.931 3.186 3.584 150 HA ALA 681 HA ALA 681 9.875 3.267 0.994 151 HB1 ALA 681 HB1 ALA 681 7.652 3.136 2.149 152 HB2 ALA 681 HB2 ALA 681 8.491 3.371 3.682 153 HB3 ALA 681 HB3 ALA 681 8.818 1.937 2.710 154 H GLU 682 H GLU 682 9.514 5.673 3.650 155 HA GLU 682 HA GLU 682 8.019 7.429 1.922 156 HB2 GLU 682 HB2 GLU 682 8.217 9.061 3.799 157 HB3 GLU 682 HB3 GLU 682 7.514 7.517 4.261 158 HG2 GLU 682 HG2 GLU 682 10.102 6.966 4.766 159 HG3 GLU 682 HG3 GLU 682 10.135 8.702 5.008 160 H SER 683 H SER 683 11.294 6.758 2.227 161 HA SER 683 HA SER 683 12.468 9.283 1.885 162 HB2 SER 683 HB2 SER 683 14.413 8.128 1.133 163 HB3 SER 683 HB3 SER 683 13.649 7.060 2.306 164 HG SER 683 HG SER 683 12.903 5.782 0.689 165 H ILE 684 H ILE 684 11.234 6.951 -0.445 166 HA ILE 684 HA ILE 684 11.778 8.659 -2.722 167 HB ILE 684 HB ILE 684 9.960 6.255 -2.769 168 HG12 ILE 684 HG12 ILE 684 12.638 5.455 -3.334 169 HG13 ILE 684 HG13 ILE 684 12.668 6.291 -1.783 170 HG21 ILE 684 HG21 ILE 684 10.091 7.075 -4.924 171 HG22 ILE 684 HG22 ILE 684 11.687 7.782 -4.673 172 HG23 ILE 684 HG23 ILE 684 11.521 6.045 -4.931 173 HD11 ILE 684 HD11 ILE 684 10.469 4.782 -1.397 174 HD12 ILE 684 HD12 ILE 684 11.325 3.741 -2.533 175 HD13 ILE 684 HD13 ILE 684 12.091 4.206 -1.014 176 H LEU 685 H LEU 685 8.885 7.436 -1.067 177 HA LEU 685 HA LEU 685 6.960 8.812 -2.553 178 HB2 LEU 685 HB2 LEU 685 7.086 7.518 0.118 179 HB3 LEU 685 HB3 LEU 685 5.753 8.632 -0.157 180 HG LEU 685 HG LEU 685 4.979 7.384 -2.051 181 HD11 LEU 685 HD11 LEU 685 7.008 6.834 -3.188 182 HD12 LEU 685 HD12 LEU 685 7.622 5.934 -1.802 183 HD13 LEU 685 HD13 LEU 685 6.276 5.293 -2.742 184 HD21 LEU 685 HD21 LEU 685 4.942 4.984 -1.022 185 HD22 LEU 685 HD22 LEU 685 5.784 5.734 0.332 186 HD23 LEU 685 HD23 LEU 685 4.181 6.300 -0.132 187 H ALA 686 H ALA 686 8.656 9.830 0.443 188 HA ALA 686 HA ALA 686 7.247 12.276 0.707 189 HB1 ALA 686 HB1 ALA 686 8.601 11.285 2.513 190 HB2 ALA 686 HB2 ALA 686 9.045 12.960 2.192 191 HB3 ALA 686 HB3 ALA 686 10.068 11.648 1.601 192 H ASN 687 H ASN 687 10.142 11.363 -1.082 193 HA ASN 687 HA ASN 687 10.818 14.014 -1.930 194 HB2 ASN 687 HB2 ASN 687 12.683 12.885 -2.486 195 HB3 ASN 687 HB3 ASN 687 11.870 11.350 -2.223 196 HD21 ASN 687 HD21 ASN 687 11.875 13.949 -4.730 197 HD22 ASN 687 HD22 ASN 687 11.868 12.873 -6.041 198 H ARG 688 H ARG 688 8.905 11.361 -3.245 199 HA ARG 688 HA ARG 688 8.395 12.553 -5.784 200 HB2 ARG 688 HB2 ARG 688 7.564 10.165 -4.315 201 HB3 ARG 688 HB3 ARG 688 6.280 10.845 -5.306 202 HG2 ARG 688 HG2 ARG 688 7.435 9.348 -6.744 203 HG3 ARG 688 HG3 ARG 688 8.001 10.956 -7.202 204 HD2 ARG 688 HD2 ARG 688 10.003 10.688 -5.873 205 HD3 ARG 688 HD3 ARG 688 9.427 9.153 -5.233 206 HE ARG 688 HE ARG 688 9.418 8.704 -7.903 207 HH11 ARG 688 HH21 ARG 688 11.768 10.042 -5.734 208 HH12 ARG 688 HH22 ARG 688 13.116 9.459 -6.664 209 HH21 ARG 688 HH11 ARG 688 11.166 7.959 -9.082 210 HH22 ARG 688 HH12 ARG 688 12.775 8.284 -8.544 211 H SER 689 H SER 689 6.007 12.840 -6.475 212 HA SER 689 HA SER 689 4.942 15.050 -4.950 213 HB2 SER 689 HB2 SER 689 4.892 15.081 -7.404 214 HB3 SER 689 HB3 SER 689 3.888 13.634 -7.419 215 HG SER 689 HG SER 689 2.207 14.829 -6.971 216 H ASP 690 H ASP 690 2.512 15.104 -4.559 217 HA ASP 690 HA ASP 690 1.834 13.101 -2.685 218 HB2 ASP 690 HB2 ASP 690 0.576 15.528 -3.764 219 HB3 ASP 690 HB3 ASP 690 -0.552 14.292 -3.215 220 H GLY 691 H GLY 691 0.547 11.344 -2.777 221 HA2 GLY 691 HA2 GLY 691 -1.187 10.008 -3.808 222 HA3 GLY 691 HA3 GLY 691 -0.739 10.699 -5.367 223 H THR 692 H THR 692 2.146 10.364 -4.183 224 HA THR 692 HA THR 692 2.745 7.952 -5.600 225 HB THR 692 HB THR 692 4.565 9.314 -3.605 226 HG1 THR 692 HG1 THR 692 4.021 11.000 -4.864 227 HG21 THR 692 HG21 THR 692 5.403 8.244 -6.254 228 HG22 THR 692 HG22 THR 692 6.260 8.231 -4.713 229 HG23 THR 692 HG23 THR 692 4.966 7.071 -5.011 230 H PHE 693 H PHE 693 2.855 5.885 -4.848 231 HA PHE 693 HA PHE 693 2.903 5.482 -1.925 232 HB2 PHE 693 HB2 PHE 693 0.997 4.023 -1.963 233 HB3 PHE 693 HB3 PHE 693 0.532 5.537 -2.735 234 HD1 PHE 693 HD2 PHE 693 1.431 1.999 -3.334 235 HD2 PHE 693 HD1 PHE 693 0.049 5.658 -5.100 236 HE1 PHE 693 HE2 PHE 693 0.802 0.771 -5.392 237 HE2 PHE 693 HE1 PHE 693 -0.581 4.427 -7.160 238 HZ PHE 693 HZ PHE 693 -0.199 1.982 -7.306 239 H LEU 694 H LEU 694 3.232 3.214 -1.305 240 HA LEU 694 HA LEU 694 4.204 1.357 -3.275 241 HB2 LEU 694 HB2 LEU 694 6.508 1.343 -2.770 242 HB3 LEU 694 HB3 LEU 694 6.103 3.050 -2.938 243 HG LEU 694 HG LEU 694 5.641 2.806 -0.316 244 HD11 LEU 694 HD11 LEU 694 6.902 0.324 -1.024 245 HD12 LEU 694 HD12 LEU 694 7.989 1.245 0.015 246 HD13 LEU 694 HD13 LEU 694 6.356 0.866 0.562 247 HD21 LEU 694 HD21 LEU 694 8.492 2.996 -0.574 248 HD22 LEU 694 HD22 LEU 694 7.748 3.775 -1.968 249 HD23 LEU 694 HD23 LEU 694 7.326 4.295 -0.338 250 H VAL 695 H VAL 695 4.929 -0.681 -2.306 251 HA VAL 695 HA VAL 695 3.926 -1.030 0.459 252 HB VAL 695 HB VAL 695 3.549 -2.960 -1.838 253 HG11 VAL 695 HG11 VAL 695 1.999 -3.261 0.653 254 HG12 VAL 695 HG12 VAL 695 2.820 -4.480 -0.318 255 HG13 VAL 695 HG13 VAL 695 3.727 -3.532 0.853 256 HG21 VAL 695 HG21 VAL 695 1.988 -0.694 -0.835 257 HG22 VAL 695 HG22 VAL 695 1.788 -1.623 -2.321 258 HG23 VAL 695 HG23 VAL 695 1.076 -2.201 -0.815 259 H ARG 696 H ARG 696 5.045 -2.322 1.791 260 HA ARG 696 HA ARG 696 7.496 -3.617 0.748 261 HB2 ARG 696 HB2 ARG 696 8.544 -3.025 2.940 262 HB3 ARG 696 HB3 ARG 696 8.118 -1.613 1.968 263 HG2 ARG 696 HG2 ARG 696 6.019 -1.366 3.245 264 HG3 ARG 696 HG3 ARG 696 6.459 -2.760 4.232 265 HD2 ARG 696 HD2 ARG 696 8.059 -0.196 4.000 266 HD3 ARG 696 HD3 ARG 696 7.030 -0.630 5.363 267 HE ARG 696 HE ARG 696 9.662 -1.727 4.744 268 HH11 ARG 696 HH21 ARG 696 6.685 -2.159 6.443 269 HH12 ARG 696 HH22 ARG 696 7.387 -3.163 7.665 270 HH21 ARG 696 HH11 ARG 696 10.540 -3.038 6.251 271 HH22 ARG 696 HH12 ARG 696 9.581 -3.690 7.539 272 H GLN 697 H GLN 697 8.321 -5.285 2.424 273 HA GLN 697 HA GLN 697 5.973 -6.828 3.379 274 HB2 GLN 697 HB2 GLN 697 6.992 -8.088 1.679 275 HB3 GLN 697 HB3 GLN 697 8.617 -7.689 2.232 276 HG2 GLN 697 HG2 GLN 697 8.556 -9.216 3.975 277 HG3 GLN 697 HG3 GLN 697 6.803 -9.131 4.128 278 HE21 GLN 697 HE21 GLN 697 7.701 -11.684 4.107 279 HE22 GLN 697 HE22 GLN 697 7.464 -12.424 2.603 280 H ARG 698 H ARG 698 5.805 -7.371 5.475 281 HA ARG 698 HA ARG 698 7.487 -8.191 7.366 282 HB2 ARG 698 HB2 ARG 698 8.138 -5.356 6.804 283 HB3 ARG 698 HB3 ARG 698 7.968 -5.765 8.506 284 HG2 ARG 698 HG2 ARG 698 9.588 -7.608 6.781 285 HG3 ARG 698 HG3 ARG 698 10.301 -6.063 7.238 286 HD2 ARG 698 HD2 ARG 698 9.323 -8.256 9.075 287 HD3 ARG 698 HD3 ARG 698 10.960 -7.631 8.922 288 HE ARG 698 HE ARG 698 10.086 -5.497 9.869 289 HH11 ARG 698 HH21 ARG 698 8.469 -8.482 10.486 290 HH12 ARG 698 HH22 ARG 698 7.487 -7.834 11.764 291 HH21 ARG 698 HH11 ARG 698 8.855 -4.672 11.537 292 HH22 ARG 698 HH12 ARG 698 7.738 -5.701 12.374 293 H VAL 699 H VAL 699 6.818 -7.650 9.670 294 HA VAL 699 HA VAL 699 4.277 -6.260 9.981 295 HB VAL 699 HB VAL 699 3.354 -8.305 9.262 296 HG11 VAL 699 HG11 VAL 699 4.127 -10.492 10.015 297 HG12 VAL 699 HG12 VAL 699 5.490 -9.585 9.363 298 HG13 VAL 699 HG13 VAL 699 5.285 -9.737 11.110 299 HG21 VAL 699 HG21 VAL 699 2.305 -7.555 11.347 300 HG22 VAL 699 HG22 VAL 699 2.383 -9.315 11.332 301 HG23 VAL 699 HG23 VAL 699 3.532 -8.393 12.297 302 H LYS 700 H LYS 700 3.877 -5.603 12.068 303 HA LYS 700 HA LYS 700 6.014 -6.178 14.016 304 HB2 LYS 700 HB2 LYS 700 5.250 -4.136 15.171 305 HB3 LYS 700 HB3 LYS 700 5.686 -3.819 13.494 306 HG2 LYS 700 HG2 LYS 700 3.556 -3.278 12.904 307 HG3 LYS 700 HG3 LYS 700 2.847 -4.538 13.915 308 HD2 LYS 700 HD2 LYS 700 2.959 -3.207 15.867 309 HD3 LYS 700 HD3 LYS 700 4.123 -2.098 15.143 310 HE2 LYS 700 HE2 LYS 700 2.411 -0.771 14.529 311 HE3 LYS 700 HE3 LYS 700 1.842 -2.058 13.467 312 HZ1 LYS 700 HZ1 LYS 700 0.791 -3.060 15.530 313 HZ2 LYS 700 HZ2 LYS 700 1.069 -1.537 16.278 314 HZ3 LYS 700 HZ3 LYS 700 0.048 -1.629 14.901 315 H ASP 701 H ASP 701 2.593 -6.585 13.496 316 HA ASP 701 HA ASP 701 2.444 -8.116 16.001 317 HB2 ASP 701 HB2 ASP 701 0.033 -7.073 16.184 318 HB3 ASP 701 HB3 ASP 701 1.423 -6.212 16.838 319 H ALA 702 H ALA 702 0.107 -7.049 13.541 320 HA ALA 702 HA ALA 702 -0.240 -9.871 12.707 321 HB1 ALA 702 HB1 ALA 702 -2.538 -9.867 13.030 322 HB2 ALA 702 HB2 ALA 702 -2.648 -8.107 12.951 323 HB3 ALA 702 HB3 ALA 702 -2.013 -8.885 14.401 324 H ALA 703 H ALA 703 0.707 -9.617 10.717 325 HA ALA 703 HA ALA 703 -0.776 -8.598 8.594 326 HB1 ALA 703 HB1 ALA 703 -0.426 -6.390 8.680 327 HB2 ALA 703 HB2 ALA 703 1.276 -6.707 8.347 328 HB3 ALA 703 HB3 ALA 703 0.714 -6.573 10.012 329 H GLU 704 H GLU 704 0.861 -8.021 6.649 330 HA GLU 704 HA GLU 704 3.089 -9.979 6.706 331 HB2 GLU 704 HB2 GLU 704 0.665 -10.382 5.386 332 HB3 GLU 704 HB3 GLU 704 1.754 -9.827 4.120 333 HG2 GLU 704 HG2 GLU 704 3.381 -11.553 4.714 334 HG3 GLU 704 HG3 GLU 704 2.362 -12.082 6.051 335 H PHE 705 H PHE 705 1.544 -7.490 4.684 336 HA PHE 705 HA PHE 705 4.222 -6.475 3.941 337 HB2 PHE 705 HB2 PHE 705 1.565 -6.304 2.504 338 HB3 PHE 705 HB3 PHE 705 3.004 -5.427 2.003 339 HD1 PHE 705 HD1 PHE 705 1.583 -8.820 2.514 340 HD2 PHE 705 HD2 PHE 705 4.775 -6.497 0.843 341 HE1 PHE 705 HE1 PHE 705 2.387 -10.810 1.279 342 HE2 PHE 705 HE2 PHE 705 5.574 -8.489 -0.398 343 HZ PHE 705 HZ PHE 705 4.378 -10.648 -0.180 344 H ALA 706 H ALA 706 4.020 -4.041 3.279 345 HA ALA 706 HA ALA 706 2.210 -2.610 5.107 346 HB1 ALA 706 HB1 ALA 706 3.808 -1.612 6.350 347 HB2 ALA 706 HB2 ALA 706 4.882 -1.402 4.970 348 HB3 ALA 706 HB3 ALA 706 4.835 -2.949 5.821 349 H ILE 707 H ILE 707 1.202 -1.010 4.110 350 HA ILE 707 HA ILE 707 2.163 -0.185 1.447 351 HB ILE 707 HB ILE 707 -0.480 0.578 2.673 352 HG12 ILE 707 HG12 ILE 707 -1.215 -1.526 1.232 353 HG13 ILE 707 HG13 ILE 707 0.424 -2.068 1.590 354 HG21 ILE 707 HG21 ILE 707 0.796 1.139 0.237 355 HG22 ILE 707 HG22 ILE 707 -0.389 -0.107 -0.155 356 HG23 ILE 707 HG23 ILE 707 -0.908 1.393 0.613 357 HD11 ILE 707 HD11 ILE 707 -1.858 -2.136 3.299 358 HD12 ILE 707 HD12 ILE 707 -0.219 -2.668 3.659 359 HD13 ILE 707 HD13 ILE 707 -0.706 -1.008 3.994 360 H SER 708 H SER 708 3.042 1.726 1.095 361 HA SER 708 HA SER 708 2.721 3.827 3.156 362 HB2 SER 708 HB2 SER 708 5.107 3.184 1.426 363 HB3 SER 708 HB3 SER 708 4.970 4.643 2.399 364 HG SER 708 HG SER 708 4.858 1.947 3.330 365 H ILE 709 H ILE 709 1.624 5.599 2.447 366 HA ILE 709 HA ILE 709 1.653 6.155 -0.474 367 HB ILE 709 HB ILE 709 -0.630 7.120 1.178 368 HG12 ILE 709 HG12 ILE 709 -1.666 4.763 0.396 369 HG13 ILE 709 HG13 ILE 709 -0.006 4.244 0.704 370 HG21 ILE 709 HG21 ILE 709 -1.643 7.310 -0.846 371 HG22 ILE 709 HG22 ILE 709 -0.005 7.179 -1.485 372 HG23 ILE 709 HG23 ILE 709 -1.039 5.751 -1.406 373 HD11 ILE 709 HD11 ILE 709 -1.887 5.630 2.634 374 HD12 ILE 709 HD12 ILE 709 -1.220 4.001 2.774 375 HD13 ILE 709 HD13 ILE 709 -0.172 5.405 2.947 376 H LYS 710 H LYS 710 2.134 8.163 -1.137 377 HA LYS 710 HA LYS 710 2.887 10.164 0.873 378 HB2 LYS 710 HB2 LYS 710 4.483 9.888 -0.906 379 HB3 LYS 710 HB3 LYS 710 3.223 10.006 -2.129 380 HG2 LYS 710 HG2 LYS 710 4.290 12.132 -2.121 381 HG3 LYS 710 HG3 LYS 710 2.778 12.363 -1.253 382 HD2 LYS 710 HD2 LYS 710 3.824 12.558 0.810 383 HD3 LYS 710 HD3 LYS 710 5.253 11.648 0.303 384 HE2 LYS 710 HE2 LYS 710 4.515 14.368 -0.815 385 HE3 LYS 710 HE3 LYS 710 5.625 14.140 0.539 386 HZ1 LYS 710 HZ1 LYS 710 6.089 13.738 -2.278 387 HZ2 LYS 710 HZ2 LYS 710 7.218 13.862 -0.993 388 HZ3 LYS 710 HZ3 LYS 710 6.492 12.352 -1.356 389 H TYR 711 H TYR 711 1.092 11.125 1.667 390 HA TYR 711 HA TYR 711 -0.631 12.579 -0.232 391 HB2 TYR 711 HB2 TYR 711 -1.748 10.432 0.318 392 HB3 TYR 711 HB3 TYR 711 -1.663 10.849 2.027 393 HD1 TYR 711 HD1 TYR 711 -2.608 12.684 -1.116 394 HD2 TYR 711 HD2 TYR 711 -3.683 11.563 2.886 395 HE1 TYR 711 HE1 TYR 711 -4.730 13.950 -1.327 396 HE2 TYR 711 HE2 TYR 711 -5.810 12.818 2.677 397 HH TYR 711 HH TYR 711 -7.196 13.598 0.010 398 H ASN 712 H ASN 712 -0.317 14.625 0.324 399 HA ASN 712 HA ASN 712 -0.632 16.526 1.642 400 HB2 ASN 712 HB2 ASN 712 -2.068 15.112 3.199 401 HB3 ASN 712 HB3 ASN 712 -0.589 14.743 4.084 402 HD21 ASN 712 HD21 ASN 712 -0.042 16.166 5.724 403 HD22 ASN 712 HD22 ASN 712 -0.648 17.755 5.855 404 H VAL 713 H VAL 713 1.710 15.858 0.578 405 HA VAL 713 HA VAL 713 4.009 15.900 0.779 406 HB VAL 713 HB VAL 713 4.882 17.791 2.026 407 HG11 VAL 713 HG11 VAL 713 3.080 19.527 1.230 408 HG12 VAL 713 HG12 VAL 713 3.922 18.544 0.034 409 HG13 VAL 713 HG13 VAL 713 2.289 18.111 0.540 410 HG21 VAL 713 HG21 VAL 713 3.402 17.343 4.074 411 HG22 VAL 713 HG22 VAL 713 3.606 19.033 3.619 412 HG23 VAL 713 HG23 VAL 713 2.120 18.184 3.203 413 H GLU 714 H GLU 714 2.700 13.874 2.312 414 HA GLU 714 HA GLU 714 4.865 13.215 4.139 415 HB2 GLU 714 HB2 GLU 714 3.367 12.692 6.009 416 HB3 GLU 714 HB3 GLU 714 3.229 14.399 5.582 417 HG2 GLU 714 HG2 GLU 714 1.286 13.604 4.035 418 HG3 GLU 714 HG3 GLU 714 1.294 12.156 5.036 419 H VAL 715 H VAL 715 4.830 10.934 4.729 420 HA VAL 715 HA VAL 715 3.361 9.316 2.737 421 HB VAL 715 HB VAL 715 5.901 8.567 4.184 422 HG11 VAL 715 HG11 VAL 715 4.490 7.481 1.723 423 HG12 VAL 715 HG12 VAL 715 6.060 6.933 2.308 424 HG13 VAL 715 HG13 VAL 715 4.617 6.679 3.288 425 HG21 VAL 715 HG21 VAL 715 6.566 10.418 2.890 426 HG22 VAL 715 HG22 VAL 715 6.845 9.066 1.796 427 HG23 VAL 715 HG23 VAL 715 5.404 10.062 1.614 428 H LYS 716 H LYS 716 1.739 8.149 3.505 429 HA LYS 716 HA LYS 716 1.629 7.469 6.369 430 HB2 LYS 716 HB2 LYS 716 -0.490 6.787 4.335 431 HB3 LYS 716 HB3 LYS 716 -0.683 7.103 6.058 432 HG2 LYS 716 HG2 LYS 716 0.483 9.438 4.985 433 HG3 LYS 716 HG3 LYS 716 -0.780 8.969 3.845 434 HD2 LYS 716 HD2 LYS 716 -2.435 8.918 5.601 435 HD3 LYS 716 HD3 LYS 716 -1.199 9.164 6.836 436 HE2 LYS 716 HE2 LYS 716 -0.837 11.286 5.038 437 HE3 LYS 716 HE3 LYS 716 -2.587 11.138 5.214 438 HZ1 LYS 716 HZ1 LYS 716 -2.517 11.783 7.341 439 HZ2 LYS 716 HZ2 LYS 716 -1.108 10.909 7.691 440 HZ3 LYS 716 HZ3 LYS 716 -0.971 12.446 6.941 441 H HIS 717 H HIS 717 2.241 5.507 7.094 442 HA HIS 717 HA HIS 717 2.572 3.298 5.150 443 HB2 HIS 717 HB2 HIS 717 3.840 3.492 7.880 444 HB3 HIS 717 HB3 HIS 717 4.291 2.435 6.544 445 HD1 HIS 717 HD1 HIS 717 5.412 3.597 4.422 446 HD2 HIS 717 HD2 HIS 717 4.989 6.039 7.801 447 HE1 HIS 717 HE1 HIS 717 6.993 5.570 4.114 448 HE2 HIS 717 HE2 HIS 717 6.760 7.074 6.168 449 H ILE 718 H ILE 718 1.293 1.567 5.308 450 HA ILE 718 HA ILE 718 0.046 0.966 7.932 451 HB ILE 718 HB ILE 718 -1.396 0.743 5.281 452 HG12 ILE 718 HG12 ILE 718 -2.303 2.700 7.313 453 HG13 ILE 718 HG13 ILE 718 -0.793 3.117 6.507 454 HG21 ILE 718 HG21 ILE 718 -3.368 0.601 6.912 455 HG22 ILE 718 HG22 ILE 718 -2.303 -0.803 6.857 456 HG23 ILE 718 HG23 ILE 718 -2.169 0.355 8.181 457 HD11 ILE 718 HD11 ILE 718 -2.253 4.009 4.974 458 HD12 ILE 718 HD12 ILE 718 -2.192 2.358 4.352 459 HD13 ILE 718 HD13 ILE 718 -3.537 2.866 5.377 460 H LYS 719 H LYS 719 -0.049 -1.147 8.496 461 HA LYS 719 HA LYS 719 1.518 -3.036 6.960 462 HB2 LYS 719 HB2 LYS 719 0.929 -4.551 8.934 463 HB3 LYS 719 HB3 LYS 719 1.885 -3.116 9.295 464 HG2 LYS 719 HG2 LYS 719 0.057 -1.981 10.254 465 HG3 LYS 719 HG3 LYS 719 -1.126 -3.022 9.464 466 HD2 LYS 719 HD2 LYS 719 0.383 -4.804 10.977 467 HD3 LYS 719 HD3 LYS 719 0.262 -3.390 12.019 468 HE2 LYS 719 HE2 LYS 719 -1.657 -4.727 12.511 469 HE3 LYS 719 HE3 LYS 719 -2.243 -3.395 11.511 470 HZ1 LYS 719 HZ1 LYS 719 -1.824 -4.975 9.568 471 HZ2 LYS 719 HZ2 LYS 719 -1.762 -6.220 10.740 472 HZ3 LYS 719 HZ3 LYS 719 -3.199 -5.284 10.553 473 H ILE 720 H ILE 720 0.758 -4.474 5.543 474 HA ILE 720 HA ILE 720 -2.127 -4.801 5.223 475 HB ILE 720 HB ILE 720 0.166 -5.029 3.512 476 HG12 ILE 720 HG12 ILE 720 -2.684 -5.572 2.710 477 HG13 ILE 720 HG13 ILE 720 -2.199 -3.964 3.234 478 HG21 ILE 720 HG21 ILE 720 -0.316 -7.118 2.355 479 HG22 ILE 720 HG22 ILE 720 0.000 -7.482 4.049 480 HG23 ILE 720 HG23 ILE 720 -1.656 -7.457 3.448 481 HD11 ILE 720 HD11 ILE 720 -1.654 -3.684 1.036 482 HD12 ILE 720 HD12 ILE 720 -0.187 -4.549 1.489 483 HD13 ILE 720 HD13 ILE 720 -1.530 -5.418 0.749 484 H MET 721 H MET 721 -3.279 -6.654 5.606 485 HA MET 721 HA MET 721 -2.025 -8.601 7.380 486 HB2 MET 721 HB2 MET 721 -4.398 -7.479 7.605 487 HB3 MET 721 HB3 MET 721 -4.877 -8.809 6.546 488 HG2 MET 721 HG2 MET 721 -3.163 -9.905 8.537 489 HG3 MET 721 HG3 MET 721 -4.350 -8.897 9.363 490 HE1 MET 721 HE1 MET 721 -4.001 -11.428 10.027 491 HE2 MET 721 HE2 MET 721 -5.587 -12.200 10.080 492 HE3 MET 721 HE3 MET 721 -4.366 -12.760 8.930 493 H THR 722 H THR 722 -3.544 -10.828 6.884 494 HA THR 722 HA THR 722 -3.163 -11.640 4.117 495 HB THR 722 HB THR 722 -0.920 -11.813 5.298 496 HG1 THR 722 HG1 THR 722 -0.462 -13.695 4.292 497 HG21 THR 722 HG21 THR 722 -0.565 -13.482 6.928 498 HG22 THR 722 HG22 THR 722 -2.036 -12.655 7.445 499 HG23 THR 722 HG23 THR 722 -2.137 -14.220 6.634 500 H ALA 723 H ALA 723 -5.429 -11.409 5.836 501 HA ALA 723 HA ALA 723 -6.316 -13.673 7.142 502 HB1 ALA 723 HB1 ALA 723 -8.496 -12.830 6.897 503 HB2 ALA 723 HB2 ALA 723 -8.137 -12.105 5.328 504 HB3 ALA 723 HB3 ALA 723 -7.480 -11.390 6.800 505 H GLU 724 H GLU 724 -6.429 -15.723 6.500 506 HA GLU 724 HA GLU 724 -6.476 -17.562 5.106 507 HB2 GLU 724 HB2 GLU 724 -8.644 -16.176 3.560 508 HB3 GLU 724 HB3 GLU 724 -8.542 -17.861 4.073 509 HG2 GLU 724 HG2 GLU 724 -9.182 -15.437 5.764 510 HG3 GLU 724 HG3 GLU 724 -10.171 -16.869 5.505 511 H GLY 725 H GLY 725 -4.829 -15.163 4.249 512 HA2 GLY 725 HA2 GLY 725 -3.218 -15.192 2.494 513 HA3 GLY 725 HA3 GLY 725 -4.358 -16.078 1.488 514 H LEU 726 H LEU 726 -6.244 -13.782 2.838 515 HA LEU 726 HA LEU 726 -6.075 -12.097 0.453 516 HB2 LEU 726 HB2 LEU 726 -7.965 -11.722 2.782 517 HB3 LEU 726 HB3 LEU 726 -8.152 -11.161 1.123 518 HG LEU 726 HG LEU 726 -8.023 -14.096 1.853 519 HD11 LEU 726 HD11 LEU 726 -10.214 -14.077 2.408 520 HD12 LEU 726 HD12 LEU 726 -10.057 -12.326 2.555 521 HD13 LEU 726 HD13 LEU 726 -10.623 -13.037 1.043 522 HD21 LEU 726 HD21 LEU 726 -7.735 -12.839 -0.577 523 HD22 LEU 726 HD22 LEU 726 -8.343 -14.481 -0.371 524 HD23 LEU 726 HD23 LEU 726 -9.473 -13.137 -0.538 525 H TYR 727 H TYR 727 -5.365 -10.013 0.406 526 HA TYR 727 HA TYR 727 -4.000 -9.063 2.825 527 HB2 TYR 727 HB2 TYR 727 -3.792 -8.284 -0.084 528 HB3 TYR 727 HB3 TYR 727 -2.962 -7.426 1.211 529 HD1 TYR 727 HD2 TYR 727 -3.113 -10.692 2.387 530 HD2 TYR 727 HD1 TYR 727 -1.158 -8.373 -0.630 531 HE1 TYR 727 HE2 TYR 727 -1.274 -12.345 2.306 532 HE2 TYR 727 HE1 TYR 727 0.681 -10.009 -0.718 533 HH TYR 727 HH TYR 727 1.187 -12.329 1.669 534 H ARG 728 H ARG 728 -4.324 -7.048 3.673 535 HA ARG 728 HA ARG 728 -6.421 -5.317 2.622 536 HB2 ARG 728 HB2 ARG 728 -7.294 -5.447 5.185 537 HB3 ARG 728 HB3 ARG 728 -7.989 -6.400 3.882 538 HG2 ARG 728 HG2 ARG 728 -6.478 -8.271 4.422 539 HG3 ARG 728 HG3 ARG 728 -5.742 -7.309 5.700 540 HD2 ARG 728 HD2 ARG 728 -8.600 -7.324 6.049 541 HD3 ARG 728 HD3 ARG 728 -8.020 -8.983 5.891 542 HE ARG 728 HE ARG 728 -6.488 -7.291 7.716 543 HH11 ARG 728 HH21 ARG 728 -9.088 -9.536 7.349 544 HH12 ARG 728 HH22 ARG 728 -9.013 -10.071 8.987 545 HH21 ARG 728 HH11 ARG 728 -6.391 -7.946 9.807 546 HH22 ARG 728 HH12 ARG 728 -7.492 -9.178 10.385 547 H ILE 729 H ILE 729 -6.109 -3.233 3.193 548 HA ILE 729 HA ILE 729 -3.681 -2.579 4.671 549 HB ILE 729 HB ILE 729 -5.653 -0.662 3.442 550 HG12 ILE 729 HG12 ILE 729 -3.368 -2.163 2.132 551 HG13 ILE 729 HG13 ILE 729 -5.076 -2.280 1.722 552 HG21 ILE 729 HG21 ILE 729 -4.162 0.679 4.545 553 HG22 ILE 729 HG22 ILE 729 -2.901 -0.553 4.550 554 HG23 ILE 729 HG23 ILE 729 -3.191 0.399 3.098 555 HD11 ILE 729 HD11 ILE 729 -4.309 -0.791 0.104 556 HD12 ILE 729 HD12 ILE 729 -4.881 0.309 1.357 557 HD13 ILE 729 HD13 ILE 729 -3.158 -0.034 1.204 558 H THR 730 H THR 730 -7.159 -2.271 4.989 559 HA THR 730 HA THR 730 -6.801 -0.940 7.608 560 HB THR 730 HB THR 730 -8.153 0.314 6.043 561 HG1 THR 730 HG1 THR 730 -9.629 0.770 7.472 562 HG21 THR 730 HG21 THR 730 -8.896 -1.696 4.700 563 HG22 THR 730 HG22 THR 730 -10.073 -2.009 5.972 564 HG23 THR 730 HG23 THR 730 -10.165 -0.523 5.042 565 H GLU 731 H GLU 731 -7.321 -3.856 6.202 566 HA GLU 731 HA GLU 731 -7.778 -5.909 7.055 567 HB2 GLU 731 HB2 GLU 731 -8.236 -4.577 9.717 568 HB3 GLU 731 HB3 GLU 731 -7.751 -6.247 9.407 569 HG2 GLU 731 HG2 GLU 731 -5.847 -4.791 8.013 570 HG3 GLU 731 HG3 GLU 731 -6.109 -3.799 9.444 571 H LYS 732 H LYS 732 -9.910 -3.404 6.955 572 HA LYS 732 HA LYS 732 -12.278 -4.872 7.806 573 HB2 LYS 732 HB2 LYS 732 -12.243 -2.217 6.365 574 HB3 LYS 732 HB3 LYS 732 -13.467 -2.848 7.467 575 HG2 LYS 732 HG2 LYS 732 -10.635 -2.077 8.243 576 HG3 LYS 732 HG3 LYS 732 -12.076 -1.118 8.562 577 HD2 LYS 732 HD2 LYS 732 -12.196 -3.935 9.491 578 HD3 LYS 732 HD3 LYS 732 -11.044 -2.906 10.335 579 HE2 LYS 732 HE2 LYS 732 -13.735 -1.748 9.842 580 HE3 LYS 732 HE3 LYS 732 -13.637 -3.048 11.033 581 HZ1 LYS 732 HZ1 LYS 732 -11.768 -0.736 11.055 582 HZ2 LYS 732 HZ2 LYS 732 -13.284 -0.707 11.902 583 HZ3 LYS 732 HZ3 LYS 732 -12.073 -1.875 12.317 584 H LYS 733 H LYS 733 -10.682 -3.837 4.839 585 HA LYS 733 HA LYS 733 -12.509 -5.579 3.300 586 HB2 LYS 733 HB2 LYS 733 -13.226 -3.426 2.660 587 HB3 LYS 733 HB3 LYS 733 -11.584 -2.782 2.656 588 HG2 LYS 733 HG2 LYS 733 -12.496 -3.176 0.352 589 HG3 LYS 733 HG3 LYS 733 -11.020 -4.084 0.675 590 HD2 LYS 733 HD2 LYS 733 -12.212 -6.128 0.964 591 HD3 LYS 733 HD3 LYS 733 -13.759 -5.296 1.114 592 HE2 LYS 733 HE2 LYS 733 -14.074 -5.484 -1.104 593 HE3 LYS 733 HE3 LYS 733 -12.614 -4.536 -1.388 594 HZ1 LYS 733 HZ1 LYS 733 -11.600 -6.963 -0.711 595 HZ2 LYS 733 HZ2 LYS 733 -13.016 -7.389 -1.568 596 HZ3 LYS 733 HZ3 LYS 733 -11.845 -6.413 -2.310 597 H ALA 734 H ALA 734 -11.283 -7.285 2.792 598 HA ALA 734 HA ALA 734 -8.465 -6.902 2.065 599 HB1 ALA 734 HB1 ALA 734 -10.098 -9.140 3.131 600 HB2 ALA 734 HB2 ALA 734 -8.436 -8.681 3.496 601 HB3 ALA 734 HB3 ALA 734 -8.797 -9.579 2.026 602 H PHE 735 H PHE 735 -7.702 -8.532 0.346 603 HA PHE 735 HA PHE 735 -9.600 -8.812 -1.881 604 HB2 PHE 735 HB2 PHE 735 -7.317 -6.948 -1.777 605 HB3 PHE 735 HB3 PHE 735 -7.389 -7.944 -3.228 606 HD1 PHE 735 HD2 PHE 735 -9.495 -7.972 -4.614 607 HD2 PHE 735 HD1 PHE 735 -8.892 -5.189 -1.398 608 HE1 PHE 735 HE2 PHE 735 -11.331 -6.557 -5.493 609 HE2 PHE 735 HE1 PHE 735 -10.726 -3.775 -2.279 610 HZ PHE 735 HZ PHE 735 -11.947 -4.459 -4.325 611 H ARG 736 H ARG 736 -8.429 -9.986 -3.768 612 HA ARG 736 HA ARG 736 -7.757 -12.558 -3.045 613 HB2 ARG 736 HB2 ARG 736 -7.426 -10.908 -5.466 614 HB3 ARG 736 HB3 ARG 736 -6.369 -12.309 -5.371 615 HG2 ARG 736 HG2 ARG 736 -8.204 -13.315 -6.327 616 HG3 ARG 736 HG3 ARG 736 -8.638 -13.512 -4.631 617 HD2 ARG 736 HD2 ARG 736 -10.319 -11.966 -4.738 618 HD3 ARG 736 HD3 ARG 736 -9.456 -10.946 -5.886 619 HE ARG 736 HE ARG 736 -11.176 -13.226 -6.530 620 HH11 ARG 736 HH21 ARG 736 -8.936 -10.777 -7.610 621 HH12 ARG 736 HH22 ARG 736 -9.318 -11.044 -9.286 622 HH21 ARG 736 HH11 ARG 736 -11.637 -13.510 -8.691 623 HH22 ARG 736 HH12 ARG 736 -10.834 -12.559 -9.888 624 H GLY 737 H GLY 737 -5.521 -9.890 -3.707 625 HA2 GLY 737 HA2 GLY 737 -3.502 -11.095 -1.993 626 HA3 GLY 737 HA3 GLY 737 -3.068 -10.972 -3.697 627 H LEU 738 H LEU 738 -1.379 -9.514 -3.065 628 HA LEU 738 HA LEU 738 -2.007 -7.008 -1.809 629 HB2 LEU 738 HB2 LEU 738 0.320 -8.437 -2.266 630 HB3 LEU 738 HB3 LEU 738 0.467 -7.065 -3.364 631 HG LEU 738 HG LEU 738 -0.320 -6.757 -0.457 632 HD11 LEU 738 HD11 LEU 738 1.924 -6.315 0.098 633 HD12 LEU 738 HD12 LEU 738 1.996 -7.787 -0.875 634 HD13 LEU 738 HD13 LEU 738 2.420 -6.227 -1.592 635 HD21 LEU 738 HD21 LEU 738 0.947 -4.481 -1.410 636 HD22 LEU 738 HD22 LEU 738 -0.025 -5.017 -2.776 637 HD23 LEU 738 HD23 LEU 738 -0.793 -4.698 -1.221 638 H THR 739 H THR 739 -1.044 -7.941 -5.104 639 HA THR 739 HA THR 739 -1.259 -5.505 -6.373 640 HB THR 739 HB THR 739 -2.299 -8.088 -7.540 641 HG1 THR 739 HG1 THR 739 -0.365 -8.835 -7.400 642 HG21 THR 739 HG21 THR 739 -0.993 -5.639 -8.746 643 HG22 THR 739 HG22 THR 739 -1.396 -7.107 -9.637 644 HG23 THR 739 HG23 THR 739 -2.677 -6.127 -8.929 645 H GLU 740 H GLU 740 -3.854 -7.915 -5.984 646 HA GLU 740 HA GLU 740 -5.928 -6.286 -7.003 647 HB2 GLU 740 HB2 GLU 740 -6.216 -8.507 -4.971 648 HB3 GLU 740 HB3 GLU 740 -7.435 -7.929 -6.108 649 HG2 GLU 740 HG2 GLU 740 -5.296 -8.535 -7.766 650 HG3 GLU 740 HG3 GLU 740 -5.207 -9.801 -6.548 651 H LEU 741 H LEU 741 -4.484 -6.529 -3.844 652 HA LEU 741 HA LEU 741 -6.568 -5.065 -2.495 653 HB2 LEU 741 HB2 LEU 741 -5.164 -6.740 -1.356 654 HB3 LEU 741 HB3 LEU 741 -3.740 -5.753 -1.652 655 HG LEU 741 HG LEU 741 -4.878 -5.608 0.659 656 HD11 LEU 741 HD11 LEU 741 -4.737 -2.847 -0.238 657 HD12 LEU 741 HD12 LEU 741 -3.680 -3.730 0.863 658 HD13 LEU 741 HD13 LEU 741 -3.408 -3.815 -0.874 659 HD21 LEU 741 HD21 LEU 741 -7.184 -5.342 -0.340 660 HD22 LEU 741 HD22 LEU 741 -6.760 -4.123 0.859 661 HD23 LEU 741 HD23 LEU 741 -6.701 -3.727 -0.855 662 H VAL 742 H VAL 742 -3.399 -4.322 -3.907 663 HA VAL 742 HA VAL 742 -3.616 -1.507 -3.097 664 HB VAL 742 HB VAL 742 -1.480 -3.217 -4.281 665 HG11 VAL 742 HG11 VAL 742 -1.691 -0.222 -4.647 666 HG12 VAL 742 HG12 VAL 742 -0.167 -1.099 -4.746 667 HG13 VAL 742 HG13 VAL 742 -1.455 -1.442 -5.900 668 HG21 VAL 742 HG21 VAL 742 -0.815 -1.010 -2.472 669 HG22 VAL 742 HG22 VAL 742 -2.016 -2.111 -1.801 670 HG23 VAL 742 HG23 VAL 742 -0.450 -2.727 -2.326 671 H GLU 743 H GLU 743 -4.000 -3.474 -6.004 672 HA GLU 743 HA GLU 743 -4.143 -1.174 -7.741 673 HB2 GLU 743 HB2 GLU 743 -4.862 -4.079 -8.178 674 HB3 GLU 743 HB3 GLU 743 -4.972 -2.844 -9.429 675 HG2 GLU 743 HG2 GLU 743 -2.447 -3.596 -7.916 676 HG3 GLU 743 HG3 GLU 743 -2.821 -4.059 -9.569 677 H PHE 744 H PHE 744 -6.113 -2.083 -5.371 678 HA PHE 744 HA PHE 744 -8.572 -1.333 -6.829 679 HB2 PHE 744 HB2 PHE 744 -8.528 -3.554 -5.583 680 HB3 PHE 744 HB3 PHE 744 -8.450 -2.614 -4.094 681 HD1 PHE 744 HD2 PHE 744 -10.496 -3.381 -7.080 682 HD2 PHE 744 HD1 PHE 744 -10.367 -1.372 -3.285 683 HE1 PHE 744 HE2 PHE 744 -12.948 -3.038 -7.176 684 HE2 PHE 744 HE1 PHE 744 -12.822 -1.030 -3.383 685 HZ PHE 744 HZ PHE 744 -14.111 -1.863 -5.330 686 H TYR 745 H TYR 745 -6.687 -0.777 -3.877 687 HA TYR 745 HA TYR 745 -8.341 1.289 -2.850 688 HB2 TYR 745 HB2 TYR 745 -5.497 0.454 -2.344 689 HB3 TYR 745 HB3 TYR 745 -6.142 1.930 -1.627 690 HD1 TYR 745 HD1 TYR 745 -7.537 -1.503 -2.267 691 HD2 TYR 745 HD2 TYR 745 -6.789 1.618 0.597 692 HE1 TYR 745 HE1 TYR 745 -8.672 -2.833 -0.512 693 HE2 TYR 745 HE2 TYR 745 -7.914 0.275 2.349 694 HH TYR 745 HH TYR 745 -8.885 -3.051 1.773 695 H GLN 746 H GLN 746 -6.290 1.192 -5.538 696 HA GLN 746 HA GLN 746 -5.422 3.920 -5.583 697 HB2 GLN 746 HB2 GLN 746 -5.149 3.455 -8.081 698 HB3 GLN 746 HB3 GLN 746 -4.232 2.405 -6.999 699 HG2 GLN 746 HG2 GLN 746 -5.422 0.561 -7.571 700 HG3 GLN 746 HG3 GLN 746 -6.950 1.432 -7.611 701 HE21 GLN 746 HE21 GLN 746 -4.405 0.141 -9.586 702 HE22 GLN 746 HE22 GLN 746 -4.963 0.776 -11.058 703 H GLN 747 H GLN 747 -8.365 2.297 -6.149 704 HA GLN 747 HA GLN 747 -9.568 4.698 -7.395 705 HB2 GLN 747 HB2 GLN 747 -10.972 2.050 -7.272 706 HB3 GLN 747 HB3 GLN 747 -11.123 3.340 -8.464 707 HG2 GLN 747 HG2 GLN 747 -8.422 2.475 -8.561 708 HG3 GLN 747 HG3 GLN 747 -9.408 1.018 -8.527 709 HE21 GLN 747 HE21 GLN 747 -7.846 2.426 -10.783 710 HE22 GLN 747 HE22 GLN 747 -8.998 2.569 -12.032 711 H ASN 748 H ASN 748 -9.838 2.309 -4.811 712 HA ASN 748 HA ASN 748 -12.233 3.423 -3.680 713 HB2 ASN 748 HB2 ASN 748 -11.180 1.032 -3.385 714 HB3 ASN 748 HB3 ASN 748 -10.282 1.802 -2.079 715 HD21 ASN 748 HD21 ASN 748 -11.973 3.371 -0.738 716 HD22 ASN 748 HD22 ASN 748 -13.386 2.559 -0.272 717 H SER 749 H SER 749 -12.318 5.343 -2.729 718 HA SER 749 HA SER 749 -10.237 7.010 -2.042 719 HB2 SER 749 HB2 SER 749 -12.292 7.553 -0.200 720 HB3 SER 749 HB3 SER 749 -12.030 8.322 -1.763 721 HG SER 749 HG SER 749 -13.617 6.038 -1.114 722 H LEU 750 H LEU 750 -8.625 6.734 -0.647 723 HA LEU 750 HA LEU 750 -8.407 4.730 1.239 724 HB2 LEU 750 HB2 LEU 750 -7.146 7.477 1.218 725 HB3 LEU 750 HB3 LEU 750 -6.665 6.196 2.331 726 HG LEU 750 HG LEU 750 -6.498 6.183 -0.684 727 HD11 LEU 750 HD11 LEU 750 -4.556 7.192 0.121 728 HD12 LEU 750 HD12 LEU 750 -4.529 6.199 1.575 729 HD13 LEU 750 HD13 LEU 750 -4.079 5.499 0.022 730 HD21 LEU 750 HD21 LEU 750 -7.137 3.976 -0.337 731 HD22 LEU 750 HD22 LEU 750 -5.392 3.849 -0.119 732 HD23 LEU 750 HD23 LEU 750 -6.451 3.930 1.287 733 H LYS 751 H LYS 751 -9.991 7.830 1.555 734 HA LYS 751 HA LYS 751 -10.208 7.963 4.351 735 HB2 LYS 751 HB2 LYS 751 -11.847 9.624 4.011 736 HB3 LYS 751 HB3 LYS 751 -10.800 9.742 2.599 737 HG2 LYS 751 HG2 LYS 751 -12.559 7.945 1.653 738 HG3 LYS 751 HG3 LYS 751 -13.613 8.780 2.793 739 HD2 LYS 751 HD2 LYS 751 -11.935 10.173 0.679 740 HD3 LYS 751 HD3 LYS 751 -13.648 9.794 0.498 741 HE2 LYS 751 HE2 LYS 751 -14.246 11.233 2.333 742 HE3 LYS 751 HE3 LYS 751 -12.554 11.449 2.790 743 HZ1 LYS 751 HZ1 LYS 751 -13.934 12.475 0.376 744 HZ2 LYS 751 HZ2 LYS 751 -13.111 13.362 1.576 745 HZ3 LYS 751 HZ3 LYS 751 -12.222 12.402 0.478 746 H ASP 752 H ASP 752 -11.611 5.753 2.155 747 HA ASP 752 HA ASP 752 -13.935 5.144 3.818 748 HB2 ASP 752 HB2 ASP 752 -12.931 3.496 1.501 749 HB3 ASP 752 HB3 ASP 752 -14.573 3.624 2.122 750 H CYS 753 H CYS 753 -10.715 3.939 3.213 751 HA CYS 753 HA CYS 753 -11.174 1.652 5.038 752 HB2 CYS 753 HB2 CYS 753 -9.087 2.152 2.908 753 HB3 CYS 753 HB3 CYS 753 -9.012 0.807 4.044 754 HG CYS 753 HG CYS 753 -11.620 1.056 2.382 755 H PHE 754 H PHE 754 -8.992 4.332 4.279 756 HA PHE 754 HA PHE 754 -7.374 3.861 6.649 757 HB2 PHE 754 HB2 PHE 754 -7.351 6.070 4.575 758 HB3 PHE 754 HB3 PHE 754 -6.158 5.888 5.848 759 HD1 PHE 754 HD2 PHE 754 -7.317 2.685 4.694 760 HD2 PHE 754 HD1 PHE 754 -4.610 5.876 3.738 761 HE1 PHE 754 HE2 PHE 754 -6.050 1.173 3.223 762 HE2 PHE 754 HE1 PHE 754 -3.346 4.348 2.264 763 HZ PHE 754 HZ PHE 754 -4.061 2.000 2.005 764 H LYS 755 H LYS 755 -6.882 6.312 7.724 765 HA LYS 755 HA LYS 755 -9.538 7.347 8.524 766 HB2 LYS 755 HB2 LYS 755 -8.979 6.293 10.473 767 HB3 LYS 755 HB3 LYS 755 -7.255 6.417 10.176 768 HG2 LYS 755 HG2 LYS 755 -8.545 9.032 10.563 769 HG3 LYS 755 HG3 LYS 755 -8.676 7.969 11.964 770 HD2 LYS 755 HD2 LYS 755 -6.265 7.587 11.946 771 HD3 LYS 755 HD3 LYS 755 -6.103 8.566 10.491 772 HE2 LYS 755 HE2 LYS 755 -7.511 10.129 12.418 773 HE3 LYS 755 HE3 LYS 755 -6.097 9.439 13.221 774 HZ1 LYS 755 HZ1 LYS 755 -4.707 10.246 11.430 775 HZ2 LYS 755 HZ2 LYS 755 -6.069 10.863 10.603 776 HZ3 LYS 755 HZ3 LYS 755 -5.586 11.545 12.095 777 H SER 756 H SER 756 -9.814 9.510 8.561 778 HA SER 756 HA SER 756 -9.458 11.720 8.067 779 HB2 SER 756 HB2 SER 756 -7.027 12.549 8.670 780 HB3 SER 756 HB3 SER 756 -8.183 12.151 9.938 781 HG SER 756 HG SER 756 -6.480 10.156 8.862 782 H LEU 757 H LEU 757 -8.369 9.370 6.278 783 HA LEU 757 HA LEU 757 -6.497 10.774 4.571 784 HB2 LEU 757 HB2 LEU 757 -7.526 8.042 4.850 785 HB3 LEU 757 HB3 LEU 757 -7.389 8.553 3.171 786 HG LEU 757 HG LEU 757 -5.322 7.451 4.273 787 HD11 LEU 757 HD11 LEU 757 -5.074 8.458 2.137 788 HD12 LEU 757 HD12 LEU 757 -5.220 10.081 2.810 789 HD13 LEU 757 HD13 LEU 757 -3.779 9.116 3.138 790 HD21 LEU 757 HD21 LEU 757 -4.232 8.488 5.934 791 HD22 LEU 757 HD22 LEU 757 -4.441 10.077 5.201 792 HD23 LEU 757 HD23 LEU 757 -5.729 9.376 6.175 793 H ASP 758 H ASP 758 -7.017 10.813 2.197 794 HA ASP 758 HA ASP 758 -9.709 10.941 1.317 795 HB2 ASP 758 HB2 ASP 758 -9.227 13.112 2.791 796 HB3 ASP 758 HB3 ASP 758 -8.514 13.678 1.286 797 H THR 759 H THR 759 -8.025 9.492 0.193 798 HA THR 759 HA THR 759 -7.588 10.556 -2.426 799 HB THR 759 HB THR 759 -5.622 11.524 -1.279 800 HG1 THR 759 HG1 THR 759 -4.373 10.985 -2.915 801 HG21 THR 759 HG21 THR 759 -4.618 10.320 0.339 802 HG22 THR 759 HG22 THR 759 -5.550 8.891 -0.093 803 HG23 THR 759 HG23 THR 759 -4.019 9.224 -0.904 804 H THR 760 H THR 760 -5.583 8.801 -3.238 805 HA THR 760 HA THR 760 -6.287 6.088 -2.442 806 HB THR 760 HB THR 760 -6.999 5.381 -4.676 807 HG1 THR 760 HG1 THR 760 -7.016 6.717 -6.307 808 HG21 THR 760 HG21 THR 760 -8.700 7.723 -3.823 809 HG22 THR 760 HG22 THR 760 -9.225 6.219 -4.579 810 HG23 THR 760 HG23 THR 760 -8.639 6.211 -2.916 811 H LEU 761 H LEU 761 -5.023 4.471 -3.726 812 HA LEU 761 HA LEU 761 -2.284 5.075 -3.794 813 HB2 LEU 761 HB2 LEU 761 -3.884 2.888 -5.171 814 HB3 LEU 761 HB3 LEU 761 -2.133 2.936 -5.158 815 HG LEU 761 HG LEU 761 -3.313 1.461 -3.398 816 HD11 LEU 761 HD11 LEU 761 -1.016 1.768 -3.138 817 HD12 LEU 761 HD12 LEU 761 -1.194 3.497 -2.823 818 HD13 LEU 761 HD13 LEU 761 -1.677 2.324 -1.601 819 HD21 LEU 761 HD21 LEU 761 -4.981 3.106 -2.643 820 HD22 LEU 761 HD22 LEU 761 -3.935 2.614 -1.319 821 HD23 LEU 761 HD23 LEU 761 -3.687 4.173 -2.096 822 H GLN 762 H GLN 762 -2.152 7.062 -4.944 823 HA GLN 762 HA GLN 762 -3.117 7.382 -7.600 824 HB2 GLN 762 HB2 GLN 762 -1.799 8.965 -5.583 825 HB3 GLN 762 HB3 GLN 762 -1.083 9.267 -7.162 826 HG2 GLN 762 HG2 GLN 762 -3.910 9.173 -7.520 827 HG3 GLN 762 HG3 GLN 762 -3.596 10.191 -6.117 828 HE21 GLN 762 HE21 GLN 762 -1.398 11.635 -6.669 829 HE22 GLN 762 HE22 GLN 762 -1.545 12.478 -8.132 830 H PHE 763 H PHE 763 0.285 7.340 -6.452 831 HA PHE 763 HA PHE 763 0.969 5.995 -8.997 832 HB2 PHE 763 HB2 PHE 763 2.292 8.462 -7.857 833 HB3 PHE 763 HB3 PHE 763 2.972 7.500 -9.168 834 HD1 PHE 763 HD1 PHE 763 1.569 7.154 -11.280 835 HD2 PHE 763 HD2 PHE 763 0.603 10.070 -8.280 836 HE1 PHE 763 HE1 PHE 763 0.125 8.345 -12.904 837 HE2 PHE 763 HE2 PHE 763 -0.844 11.260 -9.903 838 HZ PHE 763 HZ PHE 763 -1.082 10.398 -12.216 839 HA PRO 764 HA PRO 764 3.620 3.518 -6.480 840 HB2 PRO 764 HB2 PRO 764 5.258 2.506 -8.394 841 HB3 PRO 764 HB3 PRO 764 3.547 2.057 -8.283 842 HG2 PRO 764 HG2 PRO 764 4.890 3.931 -10.143 843 HG3 PRO 764 HG3 PRO 764 3.537 2.827 -10.425 844 HD2 PRO 764 HD2 PRO 764 3.281 5.562 -9.988 845 HD3 PRO 764 HD3 PRO 764 1.982 4.366 -9.781 846 H PHE 765 H PHE 765 6.338 2.999 -6.775 847 HA PHE 765 HA PHE 765 7.543 5.689 -6.654 848 HB2 PHE 765 HB2 PHE 765 8.721 5.181 -4.695 849 HB3 PHE 765 HB3 PHE 765 7.131 4.481 -4.410 850 HD1 PHE 765 HD1 PHE 765 6.783 2.002 -4.834 851 HD2 PHE 765 HD2 PHE 765 10.666 3.831 -4.759 852 HE1 PHE 765 HE1 PHE 765 7.825 -0.222 -4.499 853 HE2 PHE 765 HE2 PHE 765 11.708 1.612 -4.427 854 HZ PHE 765 HZ PHE 765 10.288 -0.417 -4.295 855 H LYS 766 H LYS 766 7.632 2.659 -8.105 856 HA LYS 766 HA LYS 766 10.499 2.865 -8.733 857 HB2 LYS 766 HB2 LYS 766 8.497 0.694 -9.383 858 HB3 LYS 766 HB3 LYS 766 10.224 0.640 -9.735 859 HG2 LYS 766 HG2 LYS 766 10.318 1.272 -7.104 860 HG3 LYS 766 HG3 LYS 766 8.818 0.352 -7.129 861 HD2 LYS 766 HD2 LYS 766 11.174 -0.771 -8.577 862 HD3 LYS 766 HD3 LYS 766 11.168 -0.845 -6.817 863 HE2 LYS 766 HE2 LYS 766 8.581 -1.638 -7.580 864 HE3 LYS 766 HE3 LYS 766 9.659 -2.446 -8.719 865 HZ1 LYS 766 HZ1 LYS 766 10.080 -3.901 -7.112 866 HZ2 LYS 766 HZ2 LYS 766 10.874 -2.670 -6.258 867 HZ3 LYS 766 HZ3 LYS 766 9.227 -2.985 -5.944 868 H GLU 767 H GLU 767 7.307 2.908 -10.225 869 HA GLU 767 HA GLU 767 6.713 3.186 -12.480 870 HB2 GLU 767 HB2 GLU 767 7.520 5.551 -11.067 871 HB3 GLU 767 HB3 GLU 767 7.864 5.759 -12.783 872 HG2 GLU 767 HG2 GLU 767 5.440 4.710 -13.057 873 HG3 GLU 767 HG3 GLU 767 5.233 5.317 -11.418 874 H1 ASP 338 H1 ASP 338 11.483 7.668 14.409 875 H2 ASP 338 H2 ASP 338 11.621 7.454 14.290 876 H3 ASP 338 H3 ASP 338 13.075 8.180 14.816 877 HA ASP 338 HA ASP 338 13.501 6.282 15.882 878 HB2 ASP 338 HB2 ASP 338 12.124 6.065 18.055 879 HB3 ASP 338 HB3 ASP 338 13.011 7.571 17.820 880 H THR 339 H THR 339 10.066 6.182 16.673 881 HA THR 339 HA THR 339 9.763 3.436 16.067 882 HB THR 339 HB THR 339 7.476 5.397 16.113 883 HG1 THR 339 HG1 THR 339 8.922 5.922 17.833 884 HG21 THR 339 HG21 THR 339 6.747 3.177 15.771 885 HG22 THR 339 HG22 THR 339 7.935 2.522 16.900 886 HG23 THR 339 HG23 THR 339 6.553 3.434 17.505 887 H GLU 340 H GLU 340 10.973 4.267 13.863 888 HA GLU 340 HA GLU 340 9.299 5.113 11.739 889 HB2 GLU 340 HB2 GLU 340 12.027 3.895 11.958 890 HB3 GLU 340 HB3 GLU 340 11.259 3.985 10.378 891 HG2 GLU 340 HG2 GLU 340 12.715 6.018 11.633 892 HG3 GLU 340 HG3 GLU 340 11.707 6.186 10.203 893 H VAL 341 H VAL 341 7.560 3.486 12.558 894 HA VAL 341 HA VAL 341 7.722 1.141 10.764 895 HB VAL 341 HB VAL 341 8.146 0.666 13.291 896 HG11 VAL 341 HG11 VAL 341 6.476 0.992 14.771 897 HG12 VAL 341 HG12 VAL 341 5.691 1.969 13.535 898 HG13 VAL 341 HG13 VAL 341 5.283 0.262 13.700 899 HG21 VAL 341 HG21 VAL 341 5.996 -1.153 12.570 900 HG22 VAL 341 HG22 VAL 341 7.021 -0.806 11.178 901 HG23 VAL 341 HG23 VAL 341 7.731 -1.453 12.655 902 H PTR 342 H PTR 342 5.134 0.220 11.808 903 HA PTR 342 HA PTR 342 3.309 2.265 10.685 904 HB2 PTR 342 HB2 PTR 342 2.174 -0.279 10.213 905 HB3 PTR 342 HB3 PTR 342 2.856 0.817 9.010 906 HD1 PTR 342 HD1 PTR 342 3.264 -2.322 10.733 907 HD2 PTR 342 HD2 PTR 342 5.375 0.740 8.588 908 HE1 PTR 342 HE1 PTR 342 5.166 -3.876 10.385 909 HE2 PTR 342 HE2 PTR 342 7.274 -0.810 8.240 910 H GLU 343 H GLU 343 3.205 2.786 12.994 911 HA GLU 343 HA GLU 343 2.293 1.113 15.028 912 HB2 GLU 343 HB2 GLU 343 1.451 3.326 16.025 913 HB3 GLU 343 HB3 GLU 343 3.170 3.208 15.645 914 HG2 GLU 343 HG2 GLU 343 1.318 4.229 13.519 915 HG3 GLU 343 HG3 GLU 343 1.731 5.305 14.849 916 H SER 344 H SER 344 0.725 0.243 12.955 917 HA SER 344 HA SER 344 -1.475 -0.003 12.199 918 HB2 SER 344 HB2 SER 344 -1.958 0.097 15.183 919 HB3 SER 344 HB3 SER 344 -2.910 -0.773 13.981 920 HG SER 344 HG SER 344 -1.505 -2.340 14.072 921 HA PRO 345 HA PRO 345 -2.504 4.505 12.936 922 HB2 PRO 345 HB2 PRO 345 -2.635 5.065 10.183 923 HB3 PRO 345 HB3 PRO 345 -1.314 5.474 11.287 924 HG2 PRO 345 HG2 PRO 345 -1.447 3.420 9.237 925 HG3 PRO 345 HG3 PRO 345 -0.044 4.086 10.079 926 HD2 PRO 345 HD2 PRO 345 -1.208 1.541 10.502 927 HD3 PRO 345 HD3 PRO 345 0.035 2.318 11.503 928 H PTR 346 H PTR 346 -3.807 2.841 10.020 929 HA PTR 346 HA PTR 346 -6.511 3.572 10.988 930 HB2 PTR 346 HB2 PTR 346 -5.967 3.023 8.098 931 HB3 PTR 346 HB3 PTR 346 -7.199 4.049 8.832 932 HD1 PTR 346 HD1 PTR 346 -4.856 4.532 6.640 933 HD2 PTR 346 HD2 PTR 346 -5.484 5.602 10.750 934 HE1 PTR 346 HE1 PTR 346 -3.370 6.505 6.363 935 HE2 PTR 346 HE2 PTR 346 -4.003 7.557 10.477 936 H ALA 347 H ALA 347 -8.123 2.114 10.966 937 HA ALA 347 HA ALA 347 -8.322 -0.295 9.611 938 HB1 ALA 347 HB1 ALA 347 -7.782 -1.838 11.638 939 HB2 ALA 347 HB2 ALA 347 -6.778 -0.495 12.183 940 HB3 ALA 347 HB3 ALA 347 -6.453 -1.265 10.631 941 H ASP 348 H ASP 348 -8.687 0.676 13.042 942 HA ASP 348 HA ASP 348 -11.591 0.197 12.758 943 HB2 ASP 348 HB2 ASP 348 -9.852 -0.414 15.153 944 HB3 ASP 348 HB3 ASP 348 -11.603 -0.611 15.085 945 HA PRO 349 HA PRO 349 -10.701 4.443 14.642 946 HB2 PRO 349 HB2 PRO 349 -11.159 6.045 12.502 947 HB3 PRO 349 HB3 PRO 349 -9.566 5.321 12.807 948 HG2 PRO 349 HG2 PRO 349 -11.712 4.443 10.924 949 HG3 PRO 349 HG3 PRO 349 -9.961 4.548 10.662 950 HD2 PRO 349 HD2 PRO 349 -11.234 2.197 11.248 951 HD3 PRO 349 HD3 PRO 349 -9.551 2.526 11.699 952 H GLU 350 H GLU 350 -12.988 2.646 14.516 953 HA GLU 350 HA GLU 350 -15.281 4.277 13.757 954 HB2 GLU 350 HB2 GLU 350 -14.956 1.467 14.814 955 HB3 GLU 350 HB3 GLU 350 -16.538 2.230 14.650 956 HG2 GLU 350 HG2 GLU 350 -16.395 1.247 12.564 957 HG3 GLU 350 HG3 GLU 350 -15.608 2.779 12.202 Start of MODEL 10 1 H1 GLY 661 H1 GLY 661 3.430 -16.065 -9.054 2 H2 GLY 661 H2 GLY 661 4.661 -15.108 -9.751 3 H3 GLY 661 H3 GLY 661 5.056 -16.520 -8.872 4 HA2 GLY 661 HA2 GLY 661 5.198 -16.797 -11.327 5 HA3 GLY 661 HA3 GLY 661 4.110 -17.932 -10.526 6 H HIS 662 H HIS 662 3.928 -14.556 -11.745 7 HA HIS 662 HA HIS 662 2.335 -13.487 -13.016 8 HB2 HIS 662 HB2 HIS 662 3.007 -15.376 -14.582 9 HB3 HIS 662 HB3 HIS 662 1.561 -16.226 -14.033 10 HD1 HIS 662 HD1 HIS 662 -0.623 -14.361 -14.019 11 HD2 HIS 662 HD2 HIS 662 2.387 -13.972 -16.881 12 HE1 HIS 662 HE1 HIS 662 -1.624 -13.026 -15.947 13 HE2 HIS 662 HE2 HIS 662 0.208 -12.773 -17.693 14 H MET 663 H MET 663 1.668 -14.186 -10.368 15 HA MET 663 HA MET 663 -1.281 -14.340 -10.631 16 HB2 MET 663 HB2 MET 663 0.518 -15.964 -8.850 17 HB3 MET 663 HB3 MET 663 -1.089 -15.517 -8.271 18 HG2 MET 663 HG2 MET 663 -1.734 -16.398 -10.752 19 HG3 MET 663 HG3 MET 663 -0.306 -17.394 -10.451 20 HE1 MET 663 HE1 MET 663 -1.562 -20.225 -9.278 21 HE2 MET 663 HE2 MET 663 -2.916 -19.704 -10.267 22 HE3 MET 663 HE3 MET 663 -1.269 -19.260 -10.715 23 H GLN 664 H GLN 664 0.256 -14.232 -7.527 24 HA GLN 664 HA GLN 664 -0.648 -11.461 -7.241 25 HB2 GLN 664 HB2 GLN 664 -1.268 -13.259 -5.548 26 HB3 GLN 664 HB3 GLN 664 0.425 -13.240 -5.053 27 HG2 GLN 664 HG2 GLN 664 -1.201 -11.712 -3.749 28 HG3 GLN 664 HG3 GLN 664 0.310 -11.003 -4.302 29 HE21 GLN 664 HE21 GLN 664 -3.009 -11.507 -5.672 30 HE22 GLN 664 HE22 GLN 664 -3.113 -9.948 -6.332 31 H ASP 665 H ASP 665 1.921 -12.577 -8.575 32 HA ASP 665 HA ASP 665 4.224 -11.938 -7.224 33 HB2 ASP 665 HB2 ASP 665 3.736 -11.073 -10.073 34 HB3 ASP 665 HB3 ASP 665 5.249 -11.596 -9.347 35 H LEU 666 H LEU 666 4.950 -10.160 -6.236 36 HA LEU 666 HA LEU 666 3.591 -7.617 -6.765 37 HB2 LEU 666 HB2 LEU 666 5.491 -8.300 -4.518 38 HB3 LEU 666 HB3 LEU 666 4.409 -6.912 -4.618 39 HG LEU 666 HG LEU 666 3.457 -9.789 -4.601 40 HD11 LEU 666 HD11 LEU 666 4.434 -9.407 -2.455 41 HD12 LEU 666 HD12 LEU 666 3.785 -7.768 -2.375 42 HD13 LEU 666 HD13 LEU 666 2.701 -9.155 -2.248 43 HD21 LEU 666 HD21 LEU 666 2.079 -7.100 -4.366 44 HD22 LEU 666 HD22 LEU 666 1.861 -8.305 -5.639 45 HD23 LEU 666 HD23 LEU 666 1.289 -8.637 -4.004 46 H SER 667 H SER 667 6.760 -9.114 -6.746 47 HA SER 667 HA SER 667 8.334 -6.817 -7.121 48 HB2 SER 667 HB2 SER 667 8.824 -9.639 -8.085 49 HB3 SER 667 HB3 SER 667 10.038 -8.364 -7.996 50 HG SER 667 HG SER 667 10.205 -9.464 -6.096 51 H VAL 668 H VAL 668 5.925 -7.888 -9.108 52 HA VAL 668 HA VAL 668 7.296 -7.132 -11.594 53 HB VAL 668 HB VAL 668 5.383 -8.042 -12.746 54 HG11 VAL 668 HG11 VAL 668 6.269 -9.755 -10.411 55 HG12 VAL 668 HG12 VAL 668 5.368 -10.371 -11.796 56 HG13 VAL 668 HG13 VAL 668 6.986 -9.705 -12.021 57 HG21 VAL 668 HG21 VAL 668 3.336 -8.547 -11.757 58 HG22 VAL 668 HG22 VAL 668 4.055 -8.808 -10.171 59 HG23 VAL 668 HG23 VAL 668 3.823 -7.169 -10.771 60 H HIS 669 H HIS 669 5.576 -5.777 -9.135 61 HA HIS 669 HA HIS 669 4.193 -3.754 -10.745 62 HB2 HIS 669 HB2 HIS 669 4.379 -4.045 -7.740 63 HB3 HIS 669 HB3 HIS 669 3.295 -2.976 -8.628 64 HD1 HIS 669 HD1 HIS 669 2.288 -4.858 -10.808 65 HD2 HIS 669 HD2 HIS 669 2.649 -5.974 -6.820 66 HE1 HIS 669 HE1 HIS 669 0.657 -6.763 -10.449 67 HE2 HIS 669 HE2 HIS 669 0.762 -7.379 -7.972 68 H LEU 670 H LEU 670 4.364 -1.508 -9.559 69 HA LEU 670 HA LEU 670 7.229 -0.870 -9.342 70 HB2 LEU 670 HB2 LEU 670 6.503 1.442 -10.151 71 HB3 LEU 670 HB3 LEU 670 6.564 0.167 -11.338 72 HG LEU 670 HG LEU 670 4.058 1.070 -9.905 73 HD11 LEU 670 HD11 LEU 670 4.993 1.569 -12.748 74 HD12 LEU 670 HD12 LEU 670 3.469 2.115 -12.047 75 HD13 LEU 670 HD13 LEU 670 4.996 2.767 -11.456 76 HD21 LEU 670 HD21 LEU 670 4.677 -1.239 -11.562 77 HD22 LEU 670 HD22 LEU 670 3.178 -0.852 -10.710 78 HD23 LEU 670 HD23 LEU 670 3.459 -0.229 -12.334 79 H TRP 671 H TRP 671 4.349 -1.061 -7.686 80 HA TRP 671 HA TRP 671 5.146 1.134 -5.923 81 HB2 TRP 671 HB2 TRP 671 2.858 0.687 -4.838 82 HB3 TRP 671 HB3 TRP 671 2.889 1.475 -6.407 83 HD1 TRP 671 HD1 TRP 671 1.476 0.421 -8.236 84 HE1 TRP 671 HE1 TRP 671 0.154 -1.781 -8.517 85 HE3 TRP 671 HE3 TRP 671 3.093 -2.073 -4.077 86 HZ2 TRP 671 HZ2 TRP 671 -0.112 -4.292 -7.162 87 HZ3 TRP 671 HZ3 TRP 671 2.293 -4.372 -3.605 88 HH2 TRP 671 HH2 TRP 671 0.691 -5.481 -5.140 89 H TYR 672 H TYR 672 5.550 -2.113 -6.260 90 HA TYR 672 HA TYR 672 5.369 -2.785 -3.422 91 HB2 TYR 672 HB2 TYR 672 4.646 -4.469 -5.036 92 HB3 TYR 672 HB3 TYR 672 6.231 -4.432 -5.814 93 HD1 TYR 672 HD2 TYR 672 4.971 -4.615 -2.276 94 HD2 TYR 672 HD1 TYR 672 7.578 -6.252 -5.271 95 HE1 TYR 672 HE2 TYR 672 5.826 -6.263 -0.638 96 HE2 TYR 672 HE1 TYR 672 8.424 -7.906 -3.629 97 HH TYR 672 HH TYR 672 7.789 -8.934 -1.565 98 H ALA 673 H ALA 673 6.980 -2.317 -2.090 99 HA ALA 673 HA ALA 673 9.717 -2.082 -3.184 100 HB1 ALA 673 HB1 ALA 673 8.657 -0.148 -1.923 101 HB2 ALA 673 HB2 ALA 673 10.222 -0.686 -1.314 102 HB3 ALA 673 HB3 ALA 673 8.740 -1.156 -0.478 103 H GLY 674 H GLY 674 7.697 -3.979 -1.162 104 HA2 GLY 674 HA2 GLY 674 8.057 -5.817 0.168 105 HA3 GLY 674 HA3 GLY 674 9.408 -6.142 -0.904 106 HA PRO 675 HA PRO 675 11.834 -5.814 2.816 107 HB2 PRO 675 HB2 PRO 675 14.303 -5.687 1.555 108 HB3 PRO 675 HB3 PRO 675 13.415 -7.185 1.888 109 HG2 PRO 675 HG2 PRO 675 13.610 -5.623 -0.636 110 HG3 PRO 675 HG3 PRO 675 13.580 -7.379 -0.390 111 HD2 PRO 675 HD2 PRO 675 11.395 -6.006 -1.243 112 HD3 PRO 675 HD3 PRO 675 11.261 -7.450 -0.210 113 H MET 676 H MET 676 10.635 -3.478 2.447 114 HA MET 676 HA MET 676 12.813 -1.462 2.368 115 HB2 MET 676 HB2 MET 676 11.145 -1.257 0.530 116 HB3 MET 676 HB3 MET 676 9.885 -1.021 1.740 117 HG2 MET 676 HG2 MET 676 10.478 1.140 2.079 118 HG3 MET 676 HG3 MET 676 12.190 0.736 2.179 119 HE1 MET 676 HE1 MET 676 13.700 1.754 0.845 120 HE2 MET 676 HE2 MET 676 13.705 0.235 -0.048 121 HE3 MET 676 HE3 MET 676 13.719 1.777 -0.915 122 H GLU 677 H GLU 677 12.746 0.247 3.854 123 HA GLU 677 HA GLU 677 11.361 -0.387 6.376 124 HB2 GLU 677 HB2 GLU 677 12.963 1.283 7.338 125 HB3 GLU 677 HB3 GLU 677 13.761 -0.097 6.579 126 HG2 GLU 677 HG2 GLU 677 14.596 1.158 4.849 127 HG3 GLU 677 HG3 GLU 677 13.193 2.215 4.805 128 H ARG 678 H ARG 678 10.552 1.536 7.644 129 HA ARG 678 HA ARG 678 8.640 2.964 6.165 130 HB2 ARG 678 HB2 ARG 678 8.726 2.470 8.713 131 HB3 ARG 678 HB3 ARG 678 9.677 3.954 8.805 132 HG2 ARG 678 HG2 ARG 678 7.637 4.761 7.187 133 HG3 ARG 678 HG3 ARG 678 6.798 3.593 8.205 134 HD2 ARG 678 HD2 ARG 678 8.548 5.288 9.785 135 HD3 ARG 678 HD3 ARG 678 7.417 6.255 8.844 136 HE ARG 678 HE ARG 678 6.020 4.092 10.083 137 HH11 ARG 678 HH21 ARG 678 7.664 7.037 10.809 138 HH12 ARG 678 HH22 ARG 678 6.738 7.374 12.248 139 HH21 ARG 678 HH11 ARG 678 4.733 4.571 11.895 140 HH22 ARG 678 HH12 ARG 678 5.059 6.005 12.813 141 H ALA 679 H ALA 679 11.577 4.219 7.744 142 HA ALA 679 HA ALA 679 11.503 6.808 6.744 143 HB1 ALA 679 HB1 ALA 679 13.939 6.843 7.146 144 HB2 ALA 679 HB2 ALA 679 13.930 5.086 7.309 145 HB3 ALA 679 HB3 ALA 679 13.077 6.086 8.486 146 H GLY 680 H GLY 680 12.738 3.855 5.345 147 HA2 GLY 680 HA2 GLY 680 13.827 5.065 2.987 148 HA3 GLY 680 HA3 GLY 680 13.541 3.345 3.232 149 H ALA 681 H ALA 681 10.860 3.269 3.759 150 HA ALA 681 HA ALA 681 9.680 3.265 1.234 151 HB1 ALA 681 HB1 ALA 681 8.713 3.054 4.038 152 HB2 ALA 681 HB2 ALA 681 8.417 1.989 2.666 153 HB3 ALA 681 HB3 ALA 681 7.503 3.487 2.832 154 H GLU 682 H GLU 682 9.423 5.722 3.840 155 HA GLU 682 HA GLU 682 7.882 7.456 2.110 156 HB2 GLU 682 HB2 GLU 682 8.030 9.076 3.976 157 HB3 GLU 682 HB3 GLU 682 7.400 7.510 4.468 158 HG2 GLU 682 HG2 GLU 682 10.014 7.073 4.936 159 HG3 GLU 682 HG3 GLU 682 9.983 8.810 5.151 160 H SER 683 H SER 683 11.192 6.850 2.555 161 HA SER 683 HA SER 683 12.335 9.364 2.163 162 HB2 SER 683 HB2 SER 683 14.293 8.233 1.398 163 HB3 SER 683 HB3 SER 683 13.555 7.163 2.582 164 HG SER 683 HG SER 683 12.722 5.916 0.932 165 H ILE 684 H ILE 684 11.144 7.011 -0.165 166 HA ILE 684 HA ILE 684 11.682 8.712 -2.443 167 HB ILE 684 HB ILE 684 9.803 6.365 -2.518 168 HG12 ILE 684 HG12 ILE 684 12.469 5.473 -3.023 169 HG13 ILE 684 HG13 ILE 684 12.469 6.269 -1.451 170 HG21 ILE 684 HG21 ILE 684 11.806 6.388 -4.554 171 HG22 ILE 684 HG22 ILE 684 10.078 6.685 -4.728 172 HG23 ILE 684 HG23 ILE 684 11.175 8.029 -4.407 173 HD11 ILE 684 HD11 ILE 684 10.414 4.192 -2.251 174 HD12 ILE 684 HD12 ILE 684 11.902 3.796 -1.390 175 HD13 ILE 684 HD13 ILE 684 10.701 4.852 -0.641 176 H LEU 685 H LEU 685 8.791 7.531 -0.774 177 HA LEU 685 HA LEU 685 6.876 8.956 -2.248 178 HB2 LEU 685 HB2 LEU 685 6.969 7.586 0.386 179 HB3 LEU 685 HB3 LEU 685 5.626 8.687 0.098 180 HG LEU 685 HG LEU 685 4.902 7.468 -1.816 181 HD11 LEU 685 HD11 LEU 685 6.917 7.021 -2.994 182 HD12 LEU 685 HD12 LEU 685 7.612 6.145 -1.631 183 HD13 LEU 685 HD13 LEU 685 6.292 5.432 -2.557 184 HD21 LEU 685 HD21 LEU 685 4.854 5.062 -0.905 185 HD22 LEU 685 HD22 LEU 685 5.800 5.683 0.447 186 HD23 LEU 685 HD23 LEU 685 4.188 6.322 0.133 187 H ALA 686 H ALA 686 8.502 9.863 0.824 188 HA ALA 686 HA ALA 686 7.083 12.298 1.132 189 HB1 ALA 686 HB1 ALA 686 8.395 11.224 2.934 190 HB2 ALA 686 HB2 ALA 686 8.823 12.919 2.704 191 HB3 ALA 686 HB3 ALA 686 9.880 11.648 2.082 192 H ASN 687 H ASN 687 10.048 11.449 -0.574 193 HA ASN 687 HA ASN 687 10.703 14.140 -1.325 194 HB2 ASN 687 HB2 ASN 687 12.334 12.222 -1.215 195 HB3 ASN 687 HB3 ASN 687 11.575 11.569 -2.662 196 HD21 ASN 687 HD21 ASN 687 13.401 14.381 -1.435 197 HD22 ASN 687 HD22 ASN 687 13.940 14.892 -2.962 198 H ARG 688 H ARG 688 8.914 11.464 -2.819 199 HA ARG 688 HA ARG 688 8.536 12.732 -5.353 200 HB2 ARG 688 HB2 ARG 688 7.694 10.274 -4.054 201 HB3 ARG 688 HB3 ARG 688 6.399 10.988 -5.011 202 HG2 ARG 688 HG2 ARG 688 7.493 9.779 -6.657 203 HG3 ARG 688 HG3 ARG 688 8.342 11.321 -6.790 204 HD2 ARG 688 HD2 ARG 688 9.698 9.976 -4.764 205 HD3 ARG 688 HD3 ARG 688 9.337 8.728 -5.933 206 HE ARG 688 HE ARG 688 10.680 9.856 -7.522 207 HH11 ARG 688 HH21 ARG 688 10.375 11.573 -4.554 208 HH12 ARG 688 HH22 ARG 688 11.773 12.574 -4.825 209 HH21 ARG 688 HH11 ARG 688 12.468 11.178 -7.893 210 HH22 ARG 688 HH12 ARG 688 12.922 12.358 -6.716 211 H SER 689 H SER 689 6.129 13.022 -6.133 212 HA SER 689 HA SER 689 5.038 15.213 -4.612 213 HB2 SER 689 HB2 SER 689 4.988 15.238 -7.066 214 HB3 SER 689 HB3 SER 689 3.960 13.806 -7.069 215 HG SER 689 HG SER 689 2.301 15.024 -6.589 216 H ASP 690 H ASP 690 2.600 15.290 -4.262 217 HA ASP 690 HA ASP 690 1.876 13.305 -2.367 218 HB2 ASP 690 HB2 ASP 690 0.900 15.840 -3.216 219 HB3 ASP 690 HB3 ASP 690 -0.435 14.692 -3.283 220 H GLY 691 H GLY 691 0.548 11.567 -2.500 221 HA2 GLY 691 HA2 GLY 691 -1.176 10.258 -3.562 222 HA3 GLY 691 HA3 GLY 691 -0.723 10.974 -5.106 223 H THR 692 H THR 692 2.151 10.557 -3.885 224 HA THR 692 HA THR 692 2.713 8.175 -5.369 225 HB THR 692 HB THR 692 4.555 9.448 -3.339 226 HG1 THR 692 HG1 THR 692 4.081 11.187 -4.533 227 HG21 THR 692 HG21 THR 692 5.455 8.506 -5.995 228 HG22 THR 692 HG22 THR 692 6.205 8.298 -4.415 229 HG23 THR 692 HG23 THR 692 4.877 7.248 -4.904 230 H PHE 693 H PHE 693 2.816 6.088 -4.657 231 HA PHE 693 HA PHE 693 2.805 5.628 -1.742 232 HB2 PHE 693 HB2 PHE 693 0.891 4.189 -1.836 233 HB3 PHE 693 HB3 PHE 693 0.446 5.706 -2.616 234 HD1 PHE 693 HD1 PHE 693 0.155 5.850 -5.040 235 HD2 PHE 693 HD2 PHE 693 1.223 2.149 -3.146 236 HE1 PHE 693 HE1 PHE 693 -0.419 4.622 -7.118 237 HE2 PHE 693 HE2 PHE 693 0.647 0.922 -5.220 238 HZ PHE 693 HZ PHE 693 -0.170 2.156 -7.208 239 H LEU 694 H LEU 694 3.077 3.322 -1.180 240 HA LEU 694 HA LEU 694 4.092 1.500 -3.155 241 HB2 LEU 694 HB2 LEU 694 6.383 1.487 -2.646 242 HB3 LEU 694 HB3 LEU 694 5.994 3.204 -2.709 243 HG LEU 694 HG LEU 694 5.476 2.785 -0.119 244 HD11 LEU 694 HD11 LEU 694 6.226 0.820 0.679 245 HD12 LEU 694 HD12 LEU 694 6.721 0.346 -0.945 246 HD13 LEU 694 HD13 LEU 694 7.848 1.206 0.105 247 HD21 LEU 694 HD21 LEU 694 7.964 3.357 0.262 248 HD22 LEU 694 HD22 LEU 694 8.107 3.306 -1.494 249 HD23 LEU 694 HD23 LEU 694 7.019 4.461 -0.727 250 H VAL 695 H VAL 695 4.860 -0.536 -2.164 251 HA VAL 695 HA VAL 695 3.791 -0.906 0.574 252 HB VAL 695 HB VAL 695 3.513 -2.865 -1.711 253 HG11 VAL 695 HG11 VAL 695 3.740 -3.885 0.541 254 HG12 VAL 695 HG12 VAL 695 2.418 -2.867 1.120 255 HG13 VAL 695 HG13 VAL 695 2.115 -4.092 -0.105 256 HG21 VAL 695 HG21 VAL 695 2.049 -0.569 -1.373 257 HG22 VAL 695 HG22 VAL 695 1.420 -2.042 -2.104 258 HG23 VAL 695 HG23 VAL 695 1.123 -1.710 -0.400 259 H ARG 696 H ARG 696 5.001 -2.066 1.958 260 HA ARG 696 HA ARG 696 7.549 -3.177 0.923 261 HB2 ARG 696 HB2 ARG 696 8.408 -2.833 3.237 262 HB3 ARG 696 HB3 ARG 696 7.912 -1.330 2.457 263 HG2 ARG 696 HG2 ARG 696 5.791 -1.352 3.635 264 HG3 ARG 696 HG3 ARG 696 6.154 -2.932 4.332 265 HD2 ARG 696 HD2 ARG 696 7.583 -0.319 4.866 266 HD3 ARG 696 HD3 ARG 696 6.618 -1.248 6.006 267 HE ARG 696 HE ARG 696 9.369 -1.801 5.171 268 HH11 ARG 696 HH21 ARG 696 6.482 -3.139 6.545 269 HH12 ARG 696 HH22 ARG 696 7.330 -4.235 7.589 270 HH21 ARG 696 HH11 ARG 696 10.436 -3.164 6.559 271 HH22 ARG 696 HH12 ARG 696 9.557 -4.194 7.643 272 H GLN 697 H GLN 697 8.452 -4.960 2.319 273 HA GLN 697 HA GLN 697 6.346 -6.773 3.332 274 HB2 GLN 697 HB2 GLN 697 6.820 -7.562 1.110 275 HB3 GLN 697 HB3 GLN 697 8.553 -7.420 1.367 276 HG2 GLN 697 HG2 GLN 697 7.356 -9.776 1.592 277 HG3 GLN 697 HG3 GLN 697 8.663 -9.328 2.683 278 HE21 GLN 697 HE21 GLN 697 5.067 -9.198 2.474 279 HE22 GLN 697 HE22 GLN 697 4.830 -9.375 4.147 280 H ARG 698 H ARG 698 6.849 -6.692 5.452 281 HA ARG 698 HA ARG 698 8.776 -8.259 6.583 282 HB2 ARG 698 HB2 ARG 698 9.997 -5.857 5.606 283 HB3 ARG 698 HB3 ARG 698 10.030 -5.826 7.362 284 HG2 ARG 698 HG2 ARG 698 10.683 -8.485 6.487 285 HG3 ARG 698 HG3 ARG 698 11.698 -7.336 5.618 286 HD2 ARG 698 HD2 ARG 698 12.454 -8.232 7.987 287 HD3 ARG 698 HD3 ARG 698 12.713 -6.546 7.553 288 HE ARG 698 HE ARG 698 11.073 -5.917 9.110 289 HH11 ARG 698 HH21 ARG 698 11.007 -9.339 8.590 290 HH12 ARG 698 HH22 ARG 698 10.021 -9.646 9.977 291 HH21 ARG 698 HH11 ARG 698 9.811 -6.338 10.877 292 HH22 ARG 698 HH12 ARG 698 9.315 -7.966 11.240 293 H VAL 699 H VAL 699 8.158 -8.589 8.594 294 HA VAL 699 HA VAL 699 7.400 -6.589 10.452 295 HB VAL 699 HB VAL 699 5.402 -6.394 9.080 296 HG11 VAL 699 HG11 VAL 699 5.775 -9.190 8.728 297 HG12 VAL 699 HG12 VAL 699 4.202 -8.970 9.491 298 HG13 VAL 699 HG13 VAL 699 4.567 -8.156 7.971 299 HG21 VAL 699 HG21 VAL 699 4.129 -6.210 10.931 300 HG22 VAL 699 HG22 VAL 699 4.076 -7.958 11.139 301 HG23 VAL 699 HG23 VAL 699 5.409 -7.027 11.824 302 H LYS 700 H LYS 700 5.299 -9.146 10.879 303 HA LYS 700 HA LYS 700 6.878 -11.284 11.725 304 HB2 LYS 700 HB2 LYS 700 6.862 -10.960 14.185 305 HB3 LYS 700 HB3 LYS 700 7.836 -9.738 13.375 306 HG2 LYS 700 HG2 LYS 700 6.117 -8.085 13.589 307 HG3 LYS 700 HG3 LYS 700 4.930 -9.286 14.093 308 HD2 LYS 700 HD2 LYS 700 7.320 -9.282 15.793 309 HD3 LYS 700 HD3 LYS 700 6.484 -7.730 15.795 310 HE2 LYS 700 HE2 LYS 700 5.190 -8.718 17.396 311 HE3 LYS 700 HE3 LYS 700 4.364 -9.436 16.011 312 HZ1 LYS 700 HZ1 LYS 700 4.876 -11.313 17.203 313 HZ2 LYS 700 HZ2 LYS 700 6.269 -11.193 16.223 314 HZ3 LYS 700 HZ3 LYS 700 6.325 -10.646 17.833 315 H ASP 701 H ASP 701 5.483 -12.140 13.975 316 HA ASP 701 HA ASP 701 3.118 -13.201 12.889 317 HB2 ASP 701 HB2 ASP 701 2.694 -13.664 15.440 318 HB3 ASP 701 HB3 ASP 701 4.056 -14.438 14.629 319 H ALA 702 H ALA 702 2.753 -10.577 12.316 320 HA ALA 702 HA ALA 702 0.322 -9.963 13.813 321 HB1 ALA 702 HB1 ALA 702 2.765 -8.210 13.868 322 HB2 ALA 702 HB2 ALA 702 1.752 -8.742 15.211 323 HB3 ALA 702 HB3 ALA 702 1.148 -7.534 14.077 324 H ALA 703 H ALA 703 2.216 -9.790 10.960 325 HA ALA 703 HA ALA 703 -0.024 -8.900 9.417 326 HB1 ALA 703 HB1 ALA 703 0.953 -6.758 10.486 327 HB2 ALA 703 HB2 ALA 703 0.655 -6.752 8.747 328 HB3 ALA 703 HB3 ALA 703 2.293 -6.978 9.361 329 H GLU 704 H GLU 704 1.003 -8.120 7.105 330 HA GLU 704 HA GLU 704 3.027 -10.167 6.395 331 HB2 GLU 704 HB2 GLU 704 0.321 -9.899 5.490 332 HB3 GLU 704 HB3 GLU 704 1.399 -9.580 4.135 333 HG2 GLU 704 HG2 GLU 704 2.423 -11.823 5.610 334 HG3 GLU 704 HG3 GLU 704 0.721 -12.104 5.260 335 H PHE 705 H PHE 705 1.419 -7.453 4.730 336 HA PHE 705 HA PHE 705 4.101 -6.397 4.023 337 HB2 PHE 705 HB2 PHE 705 1.488 -6.211 2.497 338 HB3 PHE 705 HB3 PHE 705 2.969 -5.377 2.046 339 HD1 PHE 705 HD1 PHE 705 1.336 -8.676 2.354 340 HD2 PHE 705 HD2 PHE 705 4.845 -6.557 1.085 341 HE1 PHE 705 HE1 PHE 705 2.105 -10.686 1.128 342 HE2 PHE 705 HE2 PHE 705 5.615 -8.574 -0.144 343 HZ PHE 705 HZ PHE 705 4.243 -10.637 -0.119 344 H ALA 706 H ALA 706 3.849 -3.958 3.387 345 HA ALA 706 HA ALA 706 1.943 -2.586 5.147 346 HB1 ALA 706 HB1 ALA 706 3.499 -1.985 6.641 347 HB2 ALA 706 HB2 ALA 706 4.346 -1.111 5.364 348 HB3 ALA 706 HB3 ALA 706 4.754 -2.795 5.706 349 H ILE 707 H ILE 707 1.005 -0.946 4.164 350 HA ILE 707 HA ILE 707 2.042 -0.097 1.541 351 HB ILE 707 HB ILE 707 -0.622 0.622 2.766 352 HG12 ILE 707 HG12 ILE 707 -1.331 -1.369 1.168 353 HG13 ILE 707 HG13 ILE 707 0.312 -1.925 1.480 354 HG21 ILE 707 HG21 ILE 707 -0.562 1.875 0.859 355 HG22 ILE 707 HG22 ILE 707 0.708 0.893 0.130 356 HG23 ILE 707 HG23 ILE 707 -0.969 0.348 0.076 357 HD11 ILE 707 HD11 ILE 707 -0.912 -1.060 3.948 358 HD12 ILE 707 HD12 ILE 707 -1.936 -2.244 3.151 359 HD13 ILE 707 HD13 ILE 707 -0.266 -2.647 3.531 360 H SER 708 H SER 708 2.884 1.852 1.189 361 HA SER 708 HA SER 708 2.561 3.906 3.297 362 HB2 SER 708 HB2 SER 708 4.972 3.315 1.583 363 HB3 SER 708 HB3 SER 708 4.814 4.744 2.597 364 HG SER 708 HG SER 708 4.707 2.021 3.438 365 H ILE 709 H ILE 709 1.428 5.648 2.609 366 HA ILE 709 HA ILE 709 1.489 6.270 -0.297 367 HB ILE 709 HB ILE 709 -0.788 7.196 1.388 368 HG12 ILE 709 HG12 ILE 709 -1.838 4.877 0.545 369 HG13 ILE 709 HG13 ILE 709 -0.175 4.339 0.796 370 HG21 ILE 709 HG21 ILE 709 -1.344 5.940 -1.185 371 HG22 ILE 709 HG22 ILE 709 -1.716 7.570 -0.627 372 HG23 ILE 709 HG23 ILE 709 -0.134 7.217 -1.322 373 HD11 ILE 709 HD11 ILE 709 -1.730 4.156 2.823 374 HD12 ILE 709 HD12 ILE 709 -0.211 4.998 3.089 375 HD13 ILE 709 HD13 ILE 709 -1.696 5.921 2.880 376 H LYS 710 H LYS 710 2.011 8.286 -0.913 377 HA LYS 710 HA LYS 710 2.745 10.230 1.154 378 HB2 LYS 710 HB2 LYS 710 4.357 10.019 -0.620 379 HB3 LYS 710 HB3 LYS 710 3.104 10.160 -1.851 380 HG2 LYS 710 HG2 LYS 710 4.115 12.298 -1.795 381 HG3 LYS 710 HG3 LYS 710 2.629 12.487 -0.873 382 HD2 LYS 710 HD2 LYS 710 3.736 12.650 1.153 383 HD3 LYS 710 HD3 LYS 710 5.142 11.734 0.595 384 HE2 LYS 710 HE2 LYS 710 4.422 14.460 -0.508 385 HE3 LYS 710 HE3 LYS 710 5.498 14.246 0.875 386 HZ1 LYS 710 HZ1 LYS 710 6.392 12.445 -1.014 387 HZ2 LYS 710 HZ2 LYS 710 6.059 13.860 -1.915 388 HZ3 LYS 710 HZ3 LYS 710 7.136 13.932 -0.586 389 H TYR 711 H TYR 711 0.984 11.231 1.960 390 HA TYR 711 HA TYR 711 -0.740 12.678 0.062 391 HB2 TYR 711 HB2 TYR 711 -1.858 10.542 0.706 392 HB3 TYR 711 HB3 TYR 711 -1.800 11.063 2.388 393 HD1 TYR 711 HD1 TYR 711 -2.628 12.777 -0.856 394 HD2 TYR 711 HD2 TYR 711 -3.863 11.783 3.133 395 HE1 TYR 711 HE1 TYR 711 -4.728 14.060 -1.185 396 HE2 TYR 711 HE2 TYR 711 -5.964 13.064 2.803 397 HH TYR 711 HH TYR 711 -7.227 13.796 0.030 398 H ASN 712 H ASN 712 -0.530 14.733 0.552 399 HA ASN 712 HA ASN 712 -0.700 16.683 1.791 400 HB2 ASN 712 HB2 ASN 712 -2.233 15.331 3.341 401 HB3 ASN 712 HB3 ASN 712 -0.800 15.045 4.327 402 HD21 ASN 712 HD21 ASN 712 0.227 16.929 5.357 403 HD22 ASN 712 HD22 ASN 712 -0.634 18.382 5.541 404 H VAL 713 H VAL 713 1.645 15.980 0.850 405 HA VAL 713 HA VAL 713 3.934 16.006 1.121 406 HB VAL 713 HB VAL 713 4.789 17.875 2.418 407 HG11 VAL 713 HG11 VAL 713 3.943 18.714 0.429 408 HG12 VAL 713 HG12 VAL 713 2.294 18.204 0.792 409 HG13 VAL 713 HG13 VAL 713 2.974 19.623 1.590 410 HG21 VAL 713 HG21 VAL 713 3.475 19.117 3.977 411 HG22 VAL 713 HG22 VAL 713 1.992 18.296 3.497 412 HG23 VAL 713 HG23 VAL 713 3.226 17.425 4.406 413 H GLU 714 H GLU 714 2.596 13.957 2.609 414 HA GLU 714 HA GLU 714 4.750 13.268 4.424 415 HB2 GLU 714 HB2 GLU 714 3.285 12.761 6.322 416 HB3 GLU 714 HB3 GLU 714 3.194 14.474 5.917 417 HG2 GLU 714 HG2 GLU 714 1.147 13.898 4.514 418 HG3 GLU 714 HG3 GLU 714 1.179 12.309 5.267 419 H VAL 715 H VAL 715 4.715 10.996 4.995 420 HA VAL 715 HA VAL 715 3.227 9.404 2.999 421 HB VAL 715 HB VAL 715 5.763 8.629 4.438 422 HG11 VAL 715 HG11 VAL 715 5.911 7.069 2.450 423 HG12 VAL 715 HG12 VAL 715 4.575 6.722 3.546 424 HG13 VAL 715 HG13 VAL 715 4.271 7.559 2.023 425 HG21 VAL 715 HG21 VAL 715 5.270 10.140 1.876 426 HG22 VAL 715 HG22 VAL 715 6.411 10.509 3.167 427 HG23 VAL 715 HG23 VAL 715 6.721 9.162 2.074 428 H LYS 716 H LYS 716 1.592 8.281 3.736 429 HA LYS 716 HA LYS 716 1.408 7.553 6.575 430 HB2 LYS 716 HB2 LYS 716 -0.628 6.889 4.448 431 HB3 LYS 716 HB3 LYS 716 -0.898 7.196 6.162 432 HG2 LYS 716 HG2 LYS 716 0.336 9.531 5.104 433 HG3 LYS 716 HG3 LYS 716 -0.940 9.072 3.974 434 HD2 LYS 716 HD2 LYS 716 -2.577 9.023 5.767 435 HD3 LYS 716 HD3 LYS 716 -1.322 9.326 6.970 436 HE2 LYS 716 HE2 LYS 716 -0.968 11.401 5.158 437 HE3 LYS 716 HE3 LYS 716 -2.722 11.223 5.227 438 HZ1 LYS 716 HZ1 LYS 716 -1.300 12.642 6.995 439 HZ2 LYS 716 HZ2 LYS 716 -2.803 11.869 7.368 440 HZ3 LYS 716 HZ3 LYS 716 -1.337 11.112 7.779 441 H HIS 717 H HIS 717 1.946 5.551 7.308 442 HA HIS 717 HA HIS 717 2.343 3.391 5.317 443 HB2 HIS 717 HB2 HIS 717 3.587 3.549 8.061 444 HB3 HIS 717 HB3 HIS 717 4.039 2.488 6.727 445 HD1 HIS 717 HD1 HIS 717 5.177 3.649 4.605 446 HD2 HIS 717 HD2 HIS 717 4.765 6.081 7.993 447 HE1 HIS 717 HE1 HIS 717 6.770 5.610 4.306 448 HE2 HIS 717 HE2 HIS 717 6.556 7.101 6.369 449 H ILE 718 H ILE 718 1.104 1.626 5.445 450 HA ILE 718 HA ILE 718 -0.195 0.987 8.032 451 HB ILE 718 HB ILE 718 -1.629 0.781 5.379 452 HG12 ILE 718 HG12 ILE 718 -2.481 2.816 7.358 453 HG13 ILE 718 HG13 ILE 718 -0.972 3.173 6.525 454 HG21 ILE 718 HG21 ILE 718 -2.448 -0.708 7.151 455 HG22 ILE 718 HG22 ILE 718 -2.544 0.654 8.271 456 HG23 ILE 718 HG23 ILE 718 -3.610 0.589 6.868 457 HD11 ILE 718 HD11 ILE 718 -3.714 2.767 5.359 458 HD12 ILE 718 HD12 ILE 718 -2.586 4.094 5.091 459 HD13 ILE 718 HD13 ILE 718 -2.275 2.514 4.369 460 H LYS 719 H LYS 719 -0.429 -1.167 8.491 461 HA LYS 719 HA LYS 719 1.201 -3.001 6.922 462 HB2 LYS 719 HB2 LYS 719 0.827 -4.554 8.805 463 HB3 LYS 719 HB3 LYS 719 1.435 -2.993 9.351 464 HG2 LYS 719 HG2 LYS 719 -0.337 -2.840 10.727 465 HG3 LYS 719 HG3 LYS 719 -1.381 -2.739 9.309 466 HD2 LYS 719 HD2 LYS 719 -1.565 -5.188 9.238 467 HD3 LYS 719 HD3 LYS 719 -0.462 -5.323 10.609 468 HE2 LYS 719 HE2 LYS 719 -2.834 -5.520 11.315 469 HE3 LYS 719 HE3 LYS 719 -2.046 -4.118 12.042 470 HZ1 LYS 719 HZ1 LYS 719 -3.311 -3.658 9.470 471 HZ2 LYS 719 HZ2 LYS 719 -4.394 -4.010 10.761 472 HZ3 LYS 719 HZ3 LYS 719 -3.301 -2.671 10.876 473 H ILE 720 H ILE 720 0.516 -4.752 5.784 474 HA ILE 720 HA ILE 720 -2.383 -4.907 5.285 475 HB ILE 720 HB ILE 720 -0.079 -5.154 3.618 476 HG12 ILE 720 HG12 ILE 720 -2.912 -5.707 2.774 477 HG13 ILE 720 HG13 ILE 720 -2.455 -4.102 3.343 478 HG21 ILE 720 HG21 ILE 720 -0.546 -7.246 2.449 479 HG22 ILE 720 HG22 ILE 720 -0.238 -7.612 4.146 480 HG23 ILE 720 HG23 ILE 720 -1.891 -7.592 3.533 481 HD11 ILE 720 HD11 ILE 720 -1.979 -3.847 1.089 482 HD12 ILE 720 HD12 ILE 720 -0.427 -4.463 1.640 483 HD13 ILE 720 HD13 ILE 720 -1.586 -5.545 0.873 484 H MET 721 H MET 721 -3.568 -6.741 5.523 485 HA MET 721 HA MET 721 -2.398 -8.841 7.235 486 HB2 MET 721 HB2 MET 721 -4.654 -7.355 7.605 487 HB3 MET 721 HB3 MET 721 -5.319 -8.763 6.786 488 HG2 MET 721 HG2 MET 721 -5.280 -9.015 9.276 489 HG3 MET 721 HG3 MET 721 -4.327 -10.254 8.454 490 HE1 MET 721 HE1 MET 721 -3.483 -10.463 11.114 491 HE2 MET 721 HE2 MET 721 -2.609 -9.168 11.925 492 HE3 MET 721 HE3 MET 721 -4.322 -8.973 11.530 493 H THR 722 H THR 722 -3.905 -10.975 6.855 494 HA THR 722 HA THR 722 -4.113 -11.503 3.965 495 HB THR 722 HB THR 722 -1.951 -12.358 4.309 496 HG1 THR 722 HG1 THR 722 -3.899 -14.363 4.793 497 HG21 THR 722 HG21 THR 722 -1.683 -12.140 6.663 498 HG22 THR 722 HG22 THR 722 -3.017 -13.246 6.994 499 HG23 THR 722 HG23 THR 722 -1.502 -13.864 6.335 500 H ALA 723 H ALA 723 -6.290 -11.074 5.454 501 HA ALA 723 HA ALA 723 -7.438 -13.142 6.914 502 HB1 ALA 723 HB1 ALA 723 -8.933 -11.387 4.957 503 HB2 ALA 723 HB2 ALA 723 -8.387 -10.835 6.541 504 HB3 ALA 723 HB3 ALA 723 -9.564 -12.143 6.421 505 H GLU 724 H GLU 724 -7.660 -15.216 6.375 506 HA GLU 724 HA GLU 724 -7.864 -17.121 5.086 507 HB2 GLU 724 HB2 GLU 724 -9.915 -15.621 3.478 508 HB3 GLU 724 HB3 GLU 724 -9.942 -17.297 4.028 509 HG2 GLU 724 HG2 GLU 724 -10.407 -14.792 5.654 510 HG3 GLU 724 HG3 GLU 724 -11.483 -16.170 5.447 511 H GLY 725 H GLY 725 -6.027 -14.934 4.134 512 HA2 GLY 725 HA2 GLY 725 -4.412 -15.230 2.390 513 HA3 GLY 725 HA3 GLY 725 -5.663 -15.965 1.394 514 H LEU 726 H LEU 726 -7.299 -13.486 2.649 515 HA LEU 726 HA LEU 726 -6.858 -11.831 0.287 516 HB2 LEU 726 HB2 LEU 726 -8.793 -11.362 2.562 517 HB3 LEU 726 HB3 LEU 726 -8.842 -10.641 0.955 518 HG LEU 726 HG LEU 726 -9.100 -13.613 1.510 519 HD11 LEU 726 HD11 LEU 726 -11.115 -11.404 1.157 520 HD12 LEU 726 HD12 LEU 726 -11.502 -13.046 0.642 521 HD13 LEU 726 HD13 LEU 726 -11.107 -12.721 2.330 522 HD21 LEU 726 HD21 LEU 726 -10.042 -13.429 -0.912 523 HD22 LEU 726 HD22 LEU 726 -9.195 -11.884 -0.961 524 HD23 LEU 726 HD23 LEU 726 -8.293 -13.377 -0.693 525 H TYR 727 H TYR 727 -5.940 -9.831 0.247 526 HA TYR 727 HA TYR 727 -4.529 -8.986 2.674 527 HB2 TYR 727 HB2 TYR 727 -4.305 -8.209 -0.231 528 HB3 TYR 727 HB3 TYR 727 -3.462 -7.342 1.048 529 HD1 TYR 727 HD2 TYR 727 -3.834 -10.782 1.960 530 HD2 TYR 727 HD1 TYR 727 -1.495 -8.133 -0.467 531 HE1 TYR 727 HE2 TYR 727 -2.005 -12.456 1.881 532 HE2 TYR 727 HE1 TYR 727 0.329 -9.796 -0.544 533 HH TYR 727 HH TYR 727 0.643 -12.268 1.536 534 H ARG 728 H ARG 728 -4.781 -6.997 3.612 535 HA ARG 728 HA ARG 728 -6.783 -5.131 2.570 536 HB2 ARG 728 HB2 ARG 728 -7.635 -5.189 5.126 537 HB3 ARG 728 HB3 ARG 728 -8.366 -6.168 3.860 538 HG2 ARG 728 HG2 ARG 728 -6.868 -8.051 4.454 539 HG3 ARG 728 HG3 ARG 728 -6.148 -7.067 5.727 540 HD2 ARG 728 HD2 ARG 728 -9.029 -7.050 5.967 541 HD3 ARG 728 HD3 ARG 728 -8.431 -8.709 5.920 542 HE ARG 728 HE ARG 728 -6.986 -6.935 7.732 543 HH11 ARG 728 HH21 ARG 728 -9.572 -9.178 7.309 544 HH12 ARG 728 HH22 ARG 728 -9.663 -9.585 8.983 545 HH21 ARG 728 HH11 ARG 728 -7.119 -7.422 9.924 546 HH22 ARG 728 HH12 ARG 728 -8.288 -8.610 10.449 547 H ILE 729 H ILE 729 -6.516 -3.053 3.302 548 HA ILE 729 HA ILE 729 -4.006 -2.518 4.742 549 HB ILE 729 HB ILE 729 -5.817 -0.516 3.410 550 HG12 ILE 729 HG12 ILE 729 -3.575 -2.159 2.207 551 HG13 ILE 729 HG13 ILE 729 -5.273 -2.187 1.736 552 HG21 ILE 729 HG21 ILE 729 -3.071 -0.552 4.568 553 HG22 ILE 729 HG22 ILE 729 -3.330 0.441 3.135 554 HG23 ILE 729 HG23 ILE 729 -4.287 0.728 4.590 555 HD11 ILE 729 HD11 ILE 729 -4.345 -0.763 0.132 556 HD12 ILE 729 HD12 ILE 729 -4.936 0.375 1.343 557 HD13 ILE 729 HD13 ILE 729 -3.223 -0.041 1.286 558 H THR 730 H THR 730 -7.455 -2.045 4.929 559 HA THR 730 HA THR 730 -7.136 -0.649 7.520 560 HB THR 730 HB THR 730 -8.335 0.572 5.736 561 HG1 THR 730 HG1 THR 730 -9.672 1.348 7.155 562 HG21 THR 730 HG21 THR 730 -9.298 -1.666 4.809 563 HG22 THR 730 HG22 THR 730 -10.575 -1.397 5.993 564 HG23 THR 730 HG23 THR 730 -10.291 -0.212 4.729 565 H GLU 731 H GLU 731 -7.725 -3.603 6.221 566 HA GLU 731 HA GLU 731 -8.409 -5.582 7.123 567 HB2 GLU 731 HB2 GLU 731 -8.941 -4.107 9.697 568 HB3 GLU 731 HB3 GLU 731 -8.527 -5.809 9.482 569 HG2 GLU 731 HG2 GLU 731 -6.403 -4.708 8.242 570 HG3 GLU 731 HG3 GLU 731 -6.768 -3.398 9.360 571 H LYS 732 H LYS 732 -10.279 -3.150 6.357 572 HA LYS 732 HA LYS 732 -12.820 -4.345 7.266 573 HB2 LYS 732 HB2 LYS 732 -12.555 -1.727 5.790 574 HB3 LYS 732 HB3 LYS 732 -13.865 -2.272 6.836 575 HG2 LYS 732 HG2 LYS 732 -11.046 -1.747 7.819 576 HG3 LYS 732 HG3 LYS 732 -12.343 -0.563 7.897 577 HD2 LYS 732 HD2 LYS 732 -12.992 -3.246 8.989 578 HD3 LYS 732 HD3 LYS 732 -11.805 -2.317 9.899 579 HE2 LYS 732 HE2 LYS 732 -14.178 -0.796 9.003 580 HE3 LYS 732 HE3 LYS 732 -14.486 -2.042 10.215 581 HZ1 LYS 732 HZ1 LYS 732 -13.730 0.350 10.917 582 HZ2 LYS 732 HZ2 LYS 732 -13.174 -1.032 11.772 583 HZ3 LYS 732 HZ3 LYS 732 -12.166 -0.269 10.602 584 H LYS 733 H LYS 733 -11.081 -3.254 4.370 585 HA LYS 733 HA LYS 733 -12.832 -5.005 2.753 586 HB2 LYS 733 HB2 LYS 733 -13.415 -2.789 2.099 587 HB3 LYS 733 HB3 LYS 733 -11.728 -2.275 2.069 588 HG2 LYS 733 HG2 LYS 733 -12.721 -2.725 -0.217 589 HG3 LYS 733 HG3 LYS 733 -11.264 -3.653 0.137 590 HD2 LYS 733 HD2 LYS 733 -12.528 -5.642 0.593 591 HD3 LYS 733 HD3 LYS 733 -14.047 -4.751 0.624 592 HE2 LYS 733 HE2 LYS 733 -14.294 -5.181 -1.569 593 HE3 LYS 733 HE3 LYS 733 -12.865 -4.198 -1.888 594 HZ1 LYS 733 HZ1 LYS 733 -13.160 -7.065 -1.901 595 HZ2 LYS 733 HZ2 LYS 733 -11.978 -6.095 -2.639 596 HZ3 LYS 733 HZ3 LYS 733 -11.797 -6.549 -1.005 597 H ALA 734 H ALA 734 -11.603 -6.746 2.498 598 HA ALA 734 HA ALA 734 -8.757 -6.476 1.876 599 HB1 ALA 734 HB1 ALA 734 -10.316 -9.039 2.213 600 HB2 ALA 734 HB2 ALA 734 -9.688 -8.130 3.586 601 HB3 ALA 734 HB3 ALA 734 -8.577 -8.790 2.385 602 H PHE 735 H PHE 735 -7.969 -8.199 0.243 603 HA PHE 735 HA PHE 735 -9.778 -8.534 -2.043 604 HB2 PHE 735 HB2 PHE 735 -7.503 -6.659 -1.945 605 HB3 PHE 735 HB3 PHE 735 -7.555 -7.698 -3.368 606 HD1 PHE 735 HD2 PHE 735 -9.654 -7.780 -4.767 607 HD2 PHE 735 HD1 PHE 735 -9.059 -4.873 -1.662 608 HE1 PHE 735 HE2 PHE 735 -11.470 -6.388 -5.722 609 HE2 PHE 735 HE1 PHE 735 -10.873 -3.483 -2.617 610 HZ PHE 735 HZ PHE 735 -12.081 -4.241 -4.645 611 H ARG 736 H ARG 736 -8.658 -9.804 -3.815 612 HA ARG 736 HA ARG 736 -7.923 -12.314 -2.994 613 HB2 ARG 736 HB2 ARG 736 -7.717 -10.777 -5.486 614 HB3 ARG 736 HB3 ARG 736 -6.556 -12.092 -5.362 615 HG2 ARG 736 HG2 ARG 736 -8.244 -13.414 -6.090 616 HG3 ARG 736 HG3 ARG 736 -8.866 -13.287 -4.446 617 HD2 ARG 736 HD2 ARG 736 -10.620 -12.023 -5.102 618 HD3 ARG 736 HD3 ARG 736 -9.607 -10.983 -6.094 619 HE ARG 736 HE ARG 736 -10.927 -13.466 -6.959 620 HH11 ARG 736 HH21 ARG 736 -8.974 -10.673 -7.704 621 HH12 ARG 736 HH22 ARG 736 -9.026 -10.979 -9.413 622 HH21 ARG 736 HH11 ARG 736 -10.985 -13.790 -9.167 623 HH22 ARG 736 HH12 ARG 736 -10.168 -12.701 -10.230 624 H GLY 737 H GLY 737 -5.765 -9.574 -3.601 625 HA2 GLY 737 HA2 GLY 737 -3.741 -10.710 -1.907 626 HA3 GLY 737 HA3 GLY 737 -3.295 -10.708 -3.610 627 H LEU 738 H LEU 738 -1.593 -9.285 -2.703 628 HA LEU 738 HA LEU 738 -2.134 -6.695 -1.724 629 HB2 LEU 738 HB2 LEU 738 0.149 -8.249 -2.218 630 HB3 LEU 738 HB3 LEU 738 0.330 -6.832 -3.247 631 HG LEU 738 HG LEU 738 -0.256 -6.773 -0.272 632 HD11 LEU 738 HD11 LEU 738 2.072 -7.484 -1.059 633 HD12 LEU 738 HD12 LEU 738 2.235 -5.851 -1.707 634 HD13 LEU 738 HD13 LEU 738 1.998 -6.098 0.023 635 HD21 LEU 738 HD21 LEU 738 -1.267 -4.883 -1.446 636 HD22 LEU 738 HD22 LEU 738 0.146 -4.331 -0.555 637 HD23 LEU 738 HD23 LEU 738 0.247 -4.575 -2.298 638 H THR 739 H THR 739 -1.222 -7.831 -4.967 639 HA THR 739 HA THR 739 -1.367 -5.384 -6.277 640 HB THR 739 HB THR 739 -2.231 -8.021 -7.458 641 HG1 THR 739 HG1 THR 739 -0.288 -8.435 -6.560 642 HG21 THR 739 HG21 THR 739 -1.311 -7.043 -9.527 643 HG22 THR 739 HG22 THR 739 -2.603 -6.042 -8.867 644 HG23 THR 739 HG23 THR 739 -0.921 -5.563 -8.649 645 H GLU 740 H GLU 740 -3.936 -7.798 -5.782 646 HA GLU 740 HA GLU 740 -5.964 -6.235 -7.044 647 HB2 GLU 740 HB2 GLU 740 -6.238 -8.438 -4.988 648 HB3 GLU 740 HB3 GLU 740 -7.528 -7.816 -6.017 649 HG2 GLU 740 HG2 GLU 740 -5.401 -8.439 -7.768 650 HG3 GLU 740 HG3 GLU 740 -5.489 -9.787 -6.640 651 H LEU 741 H LEU 741 -4.717 -6.468 -3.800 652 HA LEU 741 HA LEU 741 -6.794 -4.917 -2.570 653 HB2 LEU 741 HB2 LEU 741 -5.431 -6.594 -1.367 654 HB3 LEU 741 HB3 LEU 741 -3.997 -5.616 -1.634 655 HG LEU 741 HG LEU 741 -5.223 -5.451 0.644 656 HD11 LEU 741 HD11 LEU 741 -3.965 -3.619 0.872 657 HD12 LEU 741 HD12 LEU 741 -3.651 -3.708 -0.858 658 HD13 LEU 741 HD13 LEU 741 -4.967 -2.703 -0.252 659 HD21 LEU 741 HD21 LEU 741 -7.048 -3.851 0.735 660 HD22 LEU 741 HD22 LEU 741 -6.945 -3.575 -1.001 661 HD23 LEU 741 HD23 LEU 741 -7.485 -5.137 -0.389 662 H VAL 742 H VAL 742 -3.556 -4.240 -3.865 663 HA VAL 742 HA VAL 742 -3.737 -1.421 -3.103 664 HB VAL 742 HB VAL 742 -1.649 -3.154 -4.367 665 HG11 VAL 742 HG11 VAL 742 -0.289 -1.004 -4.631 666 HG12 VAL 742 HG12 VAL 742 -1.529 -1.290 -5.852 667 HG13 VAL 742 HG13 VAL 742 -1.825 -0.141 -4.545 668 HG21 VAL 742 HG21 VAL 742 -2.067 -2.517 -1.825 669 HG22 VAL 742 HG22 VAL 742 -0.430 -2.607 -2.471 670 HG23 VAL 742 HG23 VAL 742 -1.219 -1.041 -2.288 671 H GLU 743 H GLU 743 -4.120 -3.368 -6.041 672 HA GLU 743 HA GLU 743 -4.227 -1.046 -7.745 673 HB2 GLU 743 HB2 GLU 743 -4.957 -3.938 -8.230 674 HB3 GLU 743 HB3 GLU 743 -5.068 -2.683 -9.461 675 HG2 GLU 743 HG2 GLU 743 -2.546 -3.475 -7.965 676 HG3 GLU 743 HG3 GLU 743 -2.914 -3.869 -9.639 677 H PHE 744 H PHE 744 -6.217 -1.873 -5.396 678 HA PHE 744 HA PHE 744 -8.650 -1.102 -6.888 679 HB2 PHE 744 HB2 PHE 744 -8.662 -3.332 -5.651 680 HB3 PHE 744 HB3 PHE 744 -8.598 -2.396 -4.157 681 HD1 PHE 744 HD2 PHE 744 -10.598 -3.140 -7.178 682 HD2 PHE 744 HD1 PHE 744 -10.501 -1.094 -3.400 683 HE1 PHE 744 HE2 PHE 744 -13.040 -2.742 -7.331 684 HE2 PHE 744 HE1 PHE 744 -12.946 -0.696 -3.553 685 HZ PHE 744 HZ PHE 744 -14.214 -1.522 -5.518 686 H TYR 745 H TYR 745 -6.777 -0.601 -3.925 687 HA TYR 745 HA TYR 745 -8.380 1.511 -2.904 688 HB2 TYR 745 HB2 TYR 745 -5.568 0.584 -2.380 689 HB3 TYR 745 HB3 TYR 745 -6.177 2.069 -1.651 690 HD1 TYR 745 HD1 TYR 745 -7.674 -1.308 -2.349 691 HD2 TYR 745 HD2 TYR 745 -6.843 1.741 0.567 692 HE1 TYR 745 HE1 TYR 745 -8.852 -2.639 -0.619 693 HE2 TYR 745 HE2 TYR 745 -8.011 0.396 2.294 694 HH TYR 745 HH TYR 745 -9.268 -2.861 1.584 695 H GLN 746 H GLN 746 -6.313 1.345 -5.578 696 HA GLN 746 HA GLN 746 -5.386 4.062 -5.610 697 HB2 GLN 746 HB2 GLN 746 -5.042 3.569 -8.095 698 HB3 GLN 746 HB3 GLN 746 -4.163 2.528 -6.976 699 HG2 GLN 746 HG2 GLN 746 -5.302 0.684 -7.618 700 HG3 GLN 746 HG3 GLN 746 -6.849 1.523 -7.609 701 HE21 GLN 746 HE21 GLN 746 -4.397 0.242 -9.667 702 HE22 GLN 746 HE22 GLN 746 -4.972 0.923 -11.112 703 H GLN 747 H GLN 747 -8.332 2.483 -6.182 704 HA GLN 747 HA GLN 747 -9.484 4.845 -7.544 705 HB2 GLN 747 HB2 GLN 747 -10.848 2.169 -7.329 706 HB3 GLN 747 HB3 GLN 747 -11.101 3.447 -8.517 707 HG2 GLN 747 HG2 GLN 747 -8.350 2.582 -8.615 708 HG3 GLN 747 HG3 GLN 747 -9.406 1.182 -8.751 709 HE21 GLN 747 HE21 GLN 747 -7.713 2.678 -10.824 710 HE22 GLN 747 HE22 GLN 747 -8.819 3.018 -12.076 711 H ASN 748 H ASN 748 -9.896 2.508 -4.911 712 HA ASN 748 HA ASN 748 -12.269 3.730 -3.862 713 HB2 ASN 748 HB2 ASN 748 -11.351 1.319 -3.489 714 HB3 ASN 748 HB3 ASN 748 -10.397 2.061 -2.207 715 HD21 ASN 748 HD21 ASN 748 -12.059 3.830 -0.974 716 HD22 ASN 748 HD22 ASN 748 -13.481 3.076 -0.437 717 H SER 749 H SER 749 -12.377 5.608 -2.842 718 HA SER 749 HA SER 749 -10.252 7.251 -2.148 719 HB2 SER 749 HB2 SER 749 -12.307 7.964 -0.418 720 HB3 SER 749 HB3 SER 749 -12.058 8.578 -2.047 721 HG SER 749 HG SER 749 -13.678 6.395 -1.166 722 H LEU 750 H LEU 750 -8.693 6.904 -0.714 723 HA LEU 750 HA LEU 750 -8.631 4.959 1.252 724 HB2 LEU 750 HB2 LEU 750 -7.214 7.628 1.154 725 HB3 LEU 750 HB3 LEU 750 -6.806 6.340 2.289 726 HG LEU 750 HG LEU 750 -6.693 6.226 -0.730 727 HD11 LEU 750 HD11 LEU 750 -4.270 5.407 0.188 728 HD12 LEU 750 HD12 LEU 750 -4.640 7.073 -0.252 729 HD13 LEU 750 HD13 LEU 750 -4.717 6.567 1.436 730 HD21 LEU 750 HD21 LEU 750 -7.323 4.047 -0.324 731 HD22 LEU 750 HD22 LEU 750 -5.594 3.893 -0.018 732 HD23 LEU 750 HD23 LEU 750 -6.715 4.070 1.331 733 H LYS 751 H LYS 751 -10.159 8.076 1.354 734 HA LYS 751 HA LYS 751 -10.370 8.442 4.135 735 HB2 LYS 751 HB2 LYS 751 -12.042 10.042 3.652 736 HB3 LYS 751 HB3 LYS 751 -10.998 10.060 2.233 737 HG2 LYS 751 HG2 LYS 751 -12.700 8.162 1.425 738 HG3 LYS 751 HG3 LYS 751 -13.780 9.024 2.518 739 HD2 LYS 751 HD2 LYS 751 -12.160 10.383 0.342 740 HD3 LYS 751 HD3 LYS 751 -13.835 9.870 0.138 741 HE2 LYS 751 HE2 LYS 751 -12.914 11.730 2.346 742 HE3 LYS 751 HE3 LYS 751 -13.559 12.294 0.803 743 HZ1 LYS 751 HZ1 LYS 751 -14.932 10.810 2.951 744 HZ2 LYS 751 HZ2 LYS 751 -15.435 12.211 2.133 745 HZ3 LYS 751 HZ3 LYS 751 -15.499 10.705 1.352 746 H ASP 752 H ASP 752 -11.779 6.112 2.067 747 HA ASP 752 HA ASP 752 -14.047 5.561 3.827 748 HB2 ASP 752 HB2 ASP 752 -13.162 3.897 1.471 749 HB3 ASP 752 HB3 ASP 752 -14.772 4.034 2.168 750 H CYS 753 H CYS 753 -10.943 4.150 2.921 751 HA CYS 753 HA CYS 753 -11.345 1.921 4.803 752 HB2 CYS 753 HB2 CYS 753 -9.253 2.469 2.691 753 HB3 CYS 753 HB3 CYS 753 -9.188 1.097 3.792 754 HG CYS 753 HG CYS 753 -10.590 0.840 1.332 755 H PHE 754 H PHE 754 -9.093 4.578 4.109 756 HA PHE 754 HA PHE 754 -7.514 4.030 6.493 757 HB2 PHE 754 HB2 PHE 754 -7.426 6.267 4.451 758 HB3 PHE 754 HB3 PHE 754 -6.256 6.054 5.741 759 HD1 PHE 754 HD2 PHE 754 -7.387 2.854 4.621 760 HD2 PHE 754 HD1 PHE 754 -4.738 6.068 3.581 761 HE1 PHE 754 HE2 PHE 754 -6.108 1.333 3.160 762 HE2 PHE 754 HE1 PHE 754 -3.470 4.541 2.115 763 HZ PHE 754 HZ PHE 754 -4.146 2.172 1.904 764 H LYS 755 H LYS 755 -6.951 6.402 7.616 765 HA LYS 755 HA LYS 755 -9.561 7.472 8.534 766 HB2 LYS 755 HB2 LYS 755 -8.328 6.163 10.237 767 HB3 LYS 755 HB3 LYS 755 -6.998 7.311 10.097 768 HG2 LYS 755 HG2 LYS 755 -8.855 9.117 10.521 769 HG3 LYS 755 HG3 LYS 755 -9.765 7.756 11.182 770 HD2 LYS 755 HD2 LYS 755 -8.652 8.173 13.097 771 HD3 LYS 755 HD3 LYS 755 -7.286 7.397 12.300 772 HE2 LYS 755 HE2 LYS 755 -7.889 10.373 12.265 773 HE3 LYS 755 HE3 LYS 755 -6.621 9.593 13.213 774 HZ1 LYS 755 HZ1 LYS 755 -6.206 8.676 10.682 775 HZ2 LYS 755 HZ2 LYS 755 -6.635 10.303 10.413 776 HZ3 LYS 755 HZ3 LYS 755 -5.327 9.907 11.432 777 H SER 756 H SER 756 -9.813 9.680 8.660 778 HA SER 756 HA SER 756 -9.518 11.857 7.978 779 HB2 SER 756 HB2 SER 756 -7.175 12.784 8.619 780 HB3 SER 756 HB3 SER 756 -8.250 12.233 9.899 781 HG SER 756 HG SER 756 -6.004 10.919 8.736 782 H LEU 757 H LEU 757 -8.552 9.545 6.163 783 HA LEU 757 HA LEU 757 -6.617 10.929 4.470 784 HB2 LEU 757 HB2 LEU 757 -7.565 8.186 4.811 785 HB3 LEU 757 HB3 LEU 757 -7.480 8.655 3.116 786 HG LEU 757 HG LEU 757 -5.355 7.646 4.171 787 HD11 LEU 757 HD11 LEU 757 -5.190 8.676 2.030 788 HD12 LEU 757 HD12 LEU 757 -5.359 10.287 2.721 789 HD13 LEU 757 HD13 LEU 757 -3.889 9.355 3.008 790 HD21 LEU 757 HD21 LEU 757 -4.388 10.194 5.071 791 HD22 LEU 757 HD22 LEU 757 -5.806 9.722 5.999 792 HD23 LEU 757 HD23 LEU 757 -4.415 8.649 5.918 793 H ASP 758 H ASP 758 -7.052 11.164 2.169 794 HA ASP 758 HA ASP 758 -9.749 11.144 1.209 795 HB2 ASP 758 HB2 ASP 758 -8.960 13.451 2.603 796 HB3 ASP 758 HB3 ASP 758 -8.856 13.881 0.897 797 H THR 759 H THR 759 -8.128 9.697 0.099 798 HA THR 759 HA THR 759 -7.597 10.738 -2.498 799 HB THR 759 HB THR 759 -5.642 11.686 -1.312 800 HG1 THR 759 HG1 THR 759 -4.345 11.106 -2.911 801 HG21 THR 759 HG21 THR 759 -4.058 9.391 -0.903 802 HG22 THR 759 HG22 THR 759 -4.704 10.468 0.336 803 HG23 THR 759 HG23 THR 759 -5.609 9.034 -0.144 804 H THR 760 H THR 760 -5.596 8.967 -3.250 805 HA THR 760 HA THR 760 -6.340 6.259 -2.474 806 HB THR 760 HB THR 760 -6.958 5.573 -4.759 807 HG1 THR 760 HG1 THR 760 -6.979 6.961 -6.355 808 HG21 THR 760 HG21 THR 760 -8.643 6.398 -3.003 809 HG22 THR 760 HG22 THR 760 -8.733 7.870 -3.969 810 HG23 THR 760 HG23 THR 760 -9.192 6.323 -4.676 811 H LEU 761 H LEU 761 -5.024 4.646 -3.770 812 HA LEU 761 HA LEU 761 -2.292 5.293 -3.713 813 HB2 LEU 761 HB2 LEU 761 -3.774 3.110 -5.221 814 HB3 LEU 761 HB3 LEU 761 -2.034 3.167 -5.035 815 HG LEU 761 HG LEU 761 -3.517 1.704 -3.404 816 HD11 LEU 761 HD11 LEU 761 -1.186 3.448 -2.717 817 HD12 LEU 761 HD12 LEU 761 -1.833 2.288 -1.561 818 HD13 LEU 761 HD13 LEU 761 -1.200 1.726 -3.109 819 HD21 LEU 761 HD21 LEU 761 -3.917 2.945 -1.263 820 HD22 LEU 761 HD22 LEU 761 -3.648 4.451 -2.131 821 HD23 LEU 761 HD23 LEU 761 -5.008 3.412 -2.559 822 H GLN 762 H GLN 762 -2.205 7.316 -4.821 823 HA GLN 762 HA GLN 762 -3.078 7.696 -7.484 824 HB2 GLN 762 HB2 GLN 762 -1.754 9.215 -5.409 825 HB3 GLN 762 HB3 GLN 762 -1.052 9.563 -6.985 826 HG2 GLN 762 HG2 GLN 762 -3.894 9.483 -7.294 827 HG3 GLN 762 HG3 GLN 762 -3.534 10.482 -5.889 828 HE21 GLN 762 HE21 GLN 762 -1.247 11.833 -6.542 829 HE22 GLN 762 HE22 GLN 762 -1.466 12.732 -7.962 830 H PHE 763 H PHE 763 0.294 7.614 -6.277 831 HA PHE 763 HA PHE 763 1.022 6.330 -8.839 832 HB2 PHE 763 HB2 PHE 763 2.328 8.755 -7.600 833 HB3 PHE 763 HB3 PHE 763 3.051 7.817 -8.908 834 HD1 PHE 763 HD1 PHE 763 1.767 7.549 -11.086 835 HD2 PHE 763 HD2 PHE 763 0.614 10.344 -8.034 836 HE1 PHE 763 HE1 PHE 763 0.378 8.774 -12.734 837 HE2 PHE 763 HE2 PHE 763 -0.780 11.567 -9.680 838 HZ PHE 763 HZ PHE 763 -0.896 10.784 -12.032 839 HA PRO 764 HA PRO 764 3.519 3.722 -6.304 840 HB2 PRO 764 HB2 PRO 764 5.129 2.666 -8.233 841 HB3 PRO 764 HB3 PRO 764 3.415 2.241 -8.084 842 HG2 PRO 764 HG2 PRO 764 4.749 4.072 -9.995 843 HG3 PRO 764 HG3 PRO 764 3.366 2.990 -10.229 844 HD2 PRO 764 HD2 PRO 764 3.171 5.730 -9.839 845 HD3 PRO 764 HD3 PRO 764 1.857 4.565 -9.559 846 H PHE 765 H PHE 765 6.222 3.117 -6.590 847 HA PHE 765 HA PHE 765 7.492 5.781 -6.480 848 HB2 PHE 765 HB2 PHE 765 8.623 5.268 -4.512 849 HB3 PHE 765 HB3 PHE 765 7.047 4.530 -4.246 850 HD1 PHE 765 HD1 PHE 765 6.750 2.060 -4.675 851 HD2 PHE 765 HD2 PHE 765 10.599 3.960 -4.620 852 HE1 PHE 765 HE1 PHE 765 7.837 -0.149 -4.377 853 HE2 PHE 765 HE2 PHE 765 11.688 1.759 -4.322 854 HZ PHE 765 HZ PHE 765 10.308 -0.300 -4.199 855 H LYS 766 H LYS 766 7.501 2.730 -7.918 856 HA LYS 766 HA LYS 766 10.368 2.834 -8.567 857 HB2 LYS 766 HB2 LYS 766 8.261 0.791 -9.288 858 HB3 LYS 766 HB3 LYS 766 9.980 0.663 -9.650 859 HG2 LYS 766 HG2 LYS 766 10.102 1.170 -6.989 860 HG3 LYS 766 HG3 LYS 766 8.566 0.314 -7.060 861 HD2 LYS 766 HD2 LYS 766 10.819 -0.856 -8.606 862 HD3 LYS 766 HD3 LYS 766 10.923 -0.958 -6.851 863 HE2 LYS 766 HE2 LYS 766 9.595 -2.783 -6.999 864 HE3 LYS 766 HE3 LYS 766 8.282 -1.671 -7.386 865 HZ1 LYS 766 HZ1 LYS 766 9.449 -1.881 -9.763 866 HZ2 LYS 766 HZ2 LYS 766 9.808 -3.421 -9.145 867 HZ3 LYS 766 HZ3 LYS 766 8.181 -2.914 -9.264 868 H GLU 767 H GLU 767 7.183 3.051 -10.044 869 HA GLU 767 HA GLU 767 6.597 3.357 -12.300 870 HB2 GLU 767 HB2 GLU 767 7.448 5.691 -10.846 871 HB3 GLU 767 HB3 GLU 767 7.741 5.923 -12.568 872 HG2 GLU 767 HG2 GLU 767 5.254 4.781 -12.615 873 HG3 GLU 767 HG3 GLU 767 5.184 5.681 -11.103 874 H1 ASP 338 H1 ASP 338 11.546 8.036 11.815 875 H2 ASP 338 H2 ASP 338 11.452 7.953 11.924 876 H3 ASP 338 H3 ASP 338 12.865 8.851 12.238 877 HA ASP 338 HA ASP 338 12.479 8.787 14.409 878 HB2 ASP 338 HB2 ASP 338 10.266 9.827 15.204 879 HB3 ASP 338 HB3 ASP 338 11.303 10.859 14.217 880 H THR 339 H THR 339 9.057 8.405 13.942 881 HA THR 339 HA THR 339 8.884 5.975 15.403 882 HB THR 339 HB THR 339 6.490 6.040 14.448 883 HG1 THR 339 HG1 THR 339 7.429 8.599 13.572 884 HG21 THR 339 HG21 THR 339 7.682 8.382 15.959 885 HG22 THR 339 HG22 THR 339 5.948 8.100 15.797 886 HG23 THR 339 HG23 THR 339 6.955 6.927 16.646 887 H GLU 340 H GLU 340 10.721 5.607 13.263 888 HA GLU 340 HA GLU 340 9.926 4.527 10.901 889 HB2 GLU 340 HB2 GLU 340 12.156 3.910 12.767 890 HB3 GLU 340 HB3 GLU 340 11.880 2.796 11.427 891 HG2 GLU 340 HG2 GLU 340 13.442 4.515 10.695 892 HG3 GLU 340 HG3 GLU 340 11.911 4.752 9.858 893 H VAL 341 H VAL 341 7.886 3.533 11.021 894 HA VAL 341 HA VAL 341 7.865 0.734 11.159 895 HB VAL 341 HB VAL 341 8.060 1.422 13.667 896 HG11 VAL 341 HG11 VAL 341 6.404 2.638 14.566 897 HG12 VAL 341 HG12 VAL 341 5.671 2.790 12.973 898 HG13 VAL 341 HG13 VAL 341 5.211 1.457 14.032 899 HG21 VAL 341 HG21 VAL 341 5.709 -0.360 13.327 900 HG22 VAL 341 HG22 VAL 341 7.156 -0.809 12.421 901 HG23 VAL 341 HG23 VAL 341 7.226 -0.646 14.176 902 H PTR 342 H PTR 342 5.304 0.080 11.656 903 HA PTR 342 HA PTR 342 3.605 1.990 10.177 904 HB2 PTR 342 HB2 PTR 342 2.659 -0.301 9.150 905 HB3 PTR 342 HB3 PTR 342 3.967 0.599 8.382 906 HD1 PTR 342 HD1 PTR 342 3.126 -2.319 10.469 907 HD2 PTR 342 HD2 PTR 342 6.270 -0.189 8.470 908 HE1 PTR 342 HE1 PTR 342 4.632 -4.255 10.781 909 HE2 PTR 342 HE2 PTR 342 7.785 -2.124 8.782 910 H GLU 343 H GLU 343 3.129 2.277 12.514 911 HA GLU 343 HA GLU 343 1.875 0.375 14.144 912 HB2 GLU 343 HB2 GLU 343 0.951 2.429 15.303 913 HB3 GLU 343 HB3 GLU 343 2.701 2.413 15.077 914 HG2 GLU 343 HG2 GLU 343 1.030 3.640 12.915 915 HG3 GLU 343 HG3 GLU 343 1.227 4.546 14.409 916 H SER 344 H SER 344 0.685 -0.037 11.605 917 HA SER 344 HA SER 344 -1.384 0.138 10.440 918 HB2 SER 344 HB2 SER 344 -1.290 -1.813 12.181 919 HB3 SER 344 HB3 SER 344 -2.472 -0.853 13.062 920 HG SER 344 HG SER 344 -3.793 -0.881 11.211 921 HA PRO 345 HA PRO 345 -2.474 4.184 12.744 922 HB2 PRO 345 HB2 PRO 345 -2.673 4.905 9.847 923 HB3 PRO 345 HB3 PRO 345 -2.048 5.857 11.209 924 HG2 PRO 345 HG2 PRO 345 -0.414 4.668 9.479 925 HG3 PRO 345 HG3 PRO 345 -0.019 4.780 11.203 926 HD2 PRO 345 HD2 PRO 345 -0.877 2.408 9.622 927 HD3 PRO 345 HD3 PRO 345 0.127 2.490 11.084 928 H PTR 346 H PTR 346 -4.008 2.827 9.795 929 HA PTR 346 HA PTR 346 -6.629 3.620 10.930 930 HB2 PTR 346 HB2 PTR 346 -6.183 3.092 8.007 931 HB3 PTR 346 HB3 PTR 346 -7.411 4.093 8.784 932 HD1 PTR 346 HD1 PTR 346 -5.054 4.642 6.590 933 HD2 PTR 346 HD2 PTR 346 -5.719 5.605 10.719 934 HE1 PTR 346 HE1 PTR 346 -3.577 6.630 6.373 935 HE2 PTR 346 HE2 PTR 346 -4.246 7.573 10.507 936 H ALA 347 H ALA 347 -8.391 2.258 10.776 937 HA ALA 347 HA ALA 347 -8.666 -0.161 9.485 938 HB1 ALA 347 HB1 ALA 347 -8.202 -1.392 11.966 939 HB2 ALA 347 HB2 ALA 347 -6.799 -0.359 11.692 940 HB3 ALA 347 HB3 ALA 347 -7.245 -1.576 10.496 941 H ASP 348 H ASP 348 -8.992 0.573 12.961 942 HA ASP 348 HA ASP 348 -11.918 0.727 12.632 943 HB2 ASP 348 HB2 ASP 348 -10.376 -1.100 14.462 944 HB3 ASP 348 HB3 ASP 348 -12.003 -0.569 14.880 945 HA PRO 349 HA PRO 349 -10.362 4.163 15.259 946 HB2 PRO 349 HB2 PRO 349 -11.664 6.175 13.976 947 HB3 PRO 349 HB3 PRO 349 -10.123 5.515 13.396 948 HG2 PRO 349 HG2 PRO 349 -12.872 5.070 12.381 949 HG3 PRO 349 HG3 PRO 349 -11.338 5.133 11.500 950 HD2 PRO 349 HD2 PRO 349 -12.701 2.788 12.233 951 HD3 PRO 349 HD3 PRO 349 -11.000 2.878 11.725 952 H GLU 350 H GLU 350 -11.734 3.009 16.847 953 HA GLU 350 HA GLU 350 -13.387 3.007 18.440 954 HB2 GLU 350 HB2 GLU 350 -13.912 5.724 17.218 955 HB3 GLU 350 HB3 GLU 350 -14.787 5.112 18.619 956 HG2 GLU 350 HG2 GLU 350 -13.041 6.287 19.637 957 HG3 GLU 350 HG3 GLU 350 -12.386 4.654 19.584 Start of MODEL 11 1 H1 GLY 661 H1 GLY 661 3.792 -17.209 -10.553 2 H2 GLY 661 H2 GLY 661 2.254 -16.532 -10.303 3 H3 GLY 661 H3 GLY 661 3.627 -15.518 -10.391 4 HA2 GLY 661 HA2 GLY 661 3.797 -15.684 -12.656 5 HA3 GLY 661 HA3 GLY 661 2.989 -17.253 -12.686 6 H HIS 662 H HIS 662 2.510 -13.776 -12.406 7 HA HIS 662 HA HIS 662 0.670 -12.433 -12.736 8 HB2 HIS 662 HB2 HIS 662 0.790 -13.754 -14.929 9 HB3 HIS 662 HB3 HIS 662 -0.512 -14.746 -14.276 10 HD1 HIS 662 HD1 HIS 662 -2.454 -12.981 -13.086 11 HD2 HIS 662 HD2 HIS 662 -0.347 -11.762 -16.478 12 HE1 HIS 662 HE1 HIS 662 -3.833 -11.137 -14.175 13 HE2 HIS 662 HE2 HIS 662 -2.557 -10.384 -16.238 14 H MET 663 H MET 663 0.748 -14.129 -10.390 15 HA MET 663 HA MET 663 -2.172 -14.406 -9.895 16 HB2 MET 663 HB2 MET 663 0.107 -16.107 -8.847 17 HB3 MET 663 HB3 MET 663 -1.551 -16.198 -8.250 18 HG2 MET 663 HG2 MET 663 -2.235 -17.401 -10.042 19 HG3 MET 663 HG3 MET 663 -1.399 -16.336 -11.176 20 HE1 MET 663 HE1 MET 663 -1.520 -19.981 -10.209 21 HE2 MET 663 HE2 MET 663 -1.808 -19.109 -11.714 22 HE3 MET 663 HE3 MET 663 -0.445 -20.226 -11.580 23 H GLN 664 H GLN 664 0.500 -14.735 -7.623 24 HA GLN 664 HA GLN 664 -0.533 -12.377 -6.170 25 HB2 GLN 664 HB2 GLN 664 -0.092 -14.964 -5.261 26 HB3 GLN 664 HB3 GLN 664 1.334 -14.088 -4.708 27 HG2 GLN 664 HG2 GLN 664 -1.075 -12.510 -4.306 28 HG3 GLN 664 HG3 GLN 664 -1.204 -14.073 -3.510 29 HE21 GLN 664 HE21 GLN 664 1.680 -11.961 -4.025 30 HE22 GLN 664 HE22 GLN 664 2.048 -11.849 -2.367 31 H ASP 665 H ASP 665 1.598 -12.885 -8.403 32 HA ASP 665 HA ASP 665 4.121 -12.139 -7.375 33 HB2 ASP 665 HB2 ASP 665 3.246 -11.389 -10.141 34 HB3 ASP 665 HB3 ASP 665 4.794 -12.027 -9.596 35 H LEU 666 H LEU 666 4.565 -10.293 -6.362 36 HA LEU 666 HA LEU 666 3.114 -7.846 -7.134 37 HB2 LEU 666 HB2 LEU 666 4.858 -8.143 -4.699 38 HB3 LEU 666 HB3 LEU 666 3.525 -7.021 -4.970 39 HG LEU 666 HG LEU 666 3.239 -10.032 -4.738 40 HD11 LEU 666 HD11 LEU 666 2.039 -9.355 -2.591 41 HD12 LEU 666 HD12 LEU 666 3.794 -9.208 -2.580 42 HD13 LEU 666 HD13 LEU 666 2.795 -7.776 -2.793 43 HD21 LEU 666 HD21 LEU 666 1.329 -7.755 -5.242 44 HD22 LEU 666 HD22 LEU 666 1.421 -9.326 -6.039 45 HD23 LEU 666 HD23 LEU 666 0.773 -9.207 -4.406 46 H SER 667 H SER 667 6.254 -9.318 -6.954 47 HA SER 667 HA SER 667 7.883 -7.028 -7.236 48 HB2 SER 667 HB2 SER 667 8.503 -9.752 -8.361 49 HB3 SER 667 HB3 SER 667 9.631 -8.538 -7.759 50 HG SER 667 HG SER 667 9.354 -10.020 -6.128 51 H VAL 668 H VAL 668 5.592 -8.227 -9.344 52 HA VAL 668 HA VAL 668 7.052 -7.513 -11.778 53 HB VAL 668 HB VAL 668 5.109 -8.344 -12.967 54 HG11 VAL 668 HG11 VAL 668 5.823 -10.453 -12.634 55 HG12 VAL 668 HG12 VAL 668 6.741 -9.861 -11.250 56 HG13 VAL 668 HG13 VAL 668 5.112 -10.492 -11.023 57 HG21 VAL 668 HG21 VAL 668 3.188 -9.288 -11.613 58 HG22 VAL 668 HG22 VAL 668 3.874 -8.489 -10.200 59 HG23 VAL 668 HG23 VAL 668 3.311 -7.531 -11.568 60 H HIS 669 H HIS 669 5.507 -5.905 -9.423 61 HA HIS 669 HA HIS 669 4.213 -3.913 -11.164 62 HB2 HIS 669 HB2 HIS 669 4.241 -4.099 -8.144 63 HB3 HIS 669 HB3 HIS 669 3.241 -3.029 -9.126 64 HD1 HIS 669 HD1 HIS 669 2.212 -4.922 -11.259 65 HD2 HIS 669 HD2 HIS 669 2.441 -5.968 -7.241 66 HE1 HIS 669 HE1 HIS 669 0.500 -6.753 -10.901 67 HE2 HIS 669 HE2 HIS 669 0.545 -7.337 -8.419 68 H LEU 670 H LEU 670 4.446 -1.640 -9.920 69 HA LEU 670 HA LEU 670 7.338 -1.148 -9.652 70 HB2 LEU 670 HB2 LEU 670 6.724 1.206 -10.474 71 HB3 LEU 670 HB3 LEU 670 6.811 -0.074 -11.658 72 HG LEU 670 HG LEU 670 4.262 0.889 -10.345 73 HD11 LEU 670 HD11 LEU 670 5.318 2.569 -11.836 74 HD12 LEU 670 HD12 LEU 670 5.342 1.381 -13.136 75 HD13 LEU 670 HD13 LEU 670 3.804 1.962 -12.501 76 HD21 LEU 670 HD21 LEU 670 4.913 -1.428 -11.973 77 HD22 LEU 670 HD22 LEU 670 3.381 -1.007 -11.201 78 HD23 LEU 670 HD23 LEU 670 3.760 -0.391 -12.807 79 H TRP 671 H TRP 671 4.447 -1.203 -8.038 80 HA TRP 671 HA TRP 671 5.278 1.003 -6.302 81 HB2 TRP 671 HB2 TRP 671 2.962 0.613 -5.236 82 HB3 TRP 671 HB3 TRP 671 3.031 1.386 -6.812 83 HD1 TRP 671 HD1 TRP 671 1.645 0.327 -8.667 84 HE1 TRP 671 HE1 TRP 671 0.306 -1.865 -8.946 85 HE3 TRP 671 HE3 TRP 671 3.107 -2.125 -4.426 86 HZ2 TRP 671 HZ2 TRP 671 -0.041 -4.347 -7.564 87 HZ3 TRP 671 HZ3 TRP 671 2.258 -4.402 -3.939 88 HH2 TRP 671 HH2 TRP 671 0.683 -5.511 -5.501 89 H TYR 672 H TYR 672 5.314 -2.348 -6.567 90 HA TYR 672 HA TYR 672 5.227 -2.919 -3.713 91 HB2 TYR 672 HB2 TYR 672 4.332 -4.550 -5.329 92 HB3 TYR 672 HB3 TYR 672 5.928 -4.699 -6.062 93 HD1 TYR 672 HD2 TYR 672 4.305 -4.889 -2.674 94 HD2 TYR 672 HD1 TYR 672 7.321 -6.411 -5.326 95 HE1 TYR 672 HE2 TYR 672 4.927 -6.602 -0.991 96 HE2 TYR 672 HE1 TYR 672 7.938 -8.123 -3.642 97 HH TYR 672 HH TYR 672 6.771 -9.287 -1.700 98 H ALA 673 H ALA 673 6.921 -2.489 -2.450 99 HA ALA 673 HA ALA 673 9.618 -2.516 -3.648 100 HB1 ALA 673 HB1 ALA 673 10.305 -1.189 -1.741 101 HB2 ALA 673 HB2 ALA 673 8.746 -1.439 -0.953 102 HB3 ALA 673 HB3 ALA 673 8.846 -0.471 -2.424 103 H GLY 674 H GLY 674 7.542 -4.390 -1.765 104 HA2 GLY 674 HA2 GLY 674 7.821 -6.178 -0.324 105 HA3 GLY 674 HA3 GLY 674 9.074 -6.622 -1.472 106 HA PRO 675 HA PRO 675 11.814 -6.424 2.017 107 HB2 PRO 675 HB2 PRO 675 14.193 -6.335 0.616 108 HB3 PRO 675 HB3 PRO 675 13.266 -7.815 0.920 109 HG2 PRO 675 HG2 PRO 675 13.386 -6.124 -1.523 110 HG3 PRO 675 HG3 PRO 675 13.297 -7.887 -1.370 111 HD2 PRO 675 HD2 PRO 675 11.130 -6.368 -2.016 112 HD3 PRO 675 HD3 PRO 675 10.993 -7.885 -1.097 113 H MET 676 H MET 676 10.682 -4.097 1.912 114 HA MET 676 HA MET 676 12.888 -2.113 1.852 115 HB2 MET 676 HB2 MET 676 11.272 -1.865 -0.064 116 HB3 MET 676 HB3 MET 676 10.005 -1.560 1.119 117 HG2 MET 676 HG2 MET 676 10.672 0.579 1.421 118 HG3 MET 676 HG3 MET 676 12.356 0.102 1.623 119 HE1 MET 676 HE1 MET 676 13.961 0.193 0.397 120 HE2 MET 676 HE2 MET 676 14.127 0.308 -1.351 121 HE3 MET 676 HE3 MET 676 13.922 1.771 -0.382 122 H GLU 677 H GLU 677 12.576 -0.293 3.310 123 HA GLU 677 HA GLU 677 11.087 -1.044 5.736 124 HB2 GLU 677 HB2 GLU 677 12.636 0.518 6.892 125 HB3 GLU 677 HB3 GLU 677 13.469 -0.830 6.112 126 HG2 GLU 677 HG2 GLU 677 14.463 0.512 4.546 127 HG3 GLU 677 HG3 GLU 677 13.063 1.572 4.423 128 H ARG 678 H ARG 678 10.293 0.831 7.039 129 HA ARG 678 HA ARG 678 8.441 2.364 5.607 130 HB2 ARG 678 HB2 ARG 678 8.475 1.761 8.111 131 HB3 ARG 678 HB3 ARG 678 9.524 3.167 8.303 132 HG2 ARG 678 HG2 ARG 678 7.544 4.229 6.759 133 HG3 ARG 678 HG3 ARG 678 6.630 3.042 7.692 134 HD2 ARG 678 HD2 ARG 678 6.549 4.786 9.187 135 HD3 ARG 678 HD3 ARG 678 8.079 4.068 9.690 136 HE ARG 678 HE ARG 678 8.300 6.112 7.599 137 HH11 ARG 678 HH21 ARG 678 8.236 5.418 10.991 138 HH12 ARG 678 HH22 ARG 678 9.152 6.836 11.437 139 HH21 ARG 678 HH11 ARG 678 9.510 7.917 8.170 140 HH22 ARG 678 HH12 ARG 678 9.863 8.205 9.859 141 H ALA 679 H ALA 679 11.366 3.547 7.285 142 HA ALA 679 HA ALA 679 11.274 6.165 6.287 143 HB1 ALA 679 HB1 ALA 679 13.977 5.584 6.645 144 HB2 ALA 679 HB2 ALA 679 13.149 4.503 7.762 145 HB3 ALA 679 HB3 ALA 679 12.880 6.242 7.858 146 H GLY 680 H GLY 680 12.585 3.203 4.966 147 HA2 GLY 680 HA2 GLY 680 13.999 4.440 2.793 148 HA3 GLY 680 HA3 GLY 680 13.576 2.733 2.917 149 H ALA 681 H ALA 681 10.869 2.829 3.194 150 HA ALA 681 HA ALA 681 9.923 3.034 0.568 151 HB1 ALA 681 HB1 ALA 681 8.512 3.018 3.240 152 HB2 ALA 681 HB2 ALA 681 8.715 1.678 2.111 153 HB3 ALA 681 HB3 ALA 681 7.639 3.016 1.706 154 H GLU 682 H GLU 682 9.400 5.290 3.311 155 HA GLU 682 HA GLU 682 8.039 7.190 1.665 156 HB2 GLU 682 HB2 GLU 682 8.220 8.700 3.609 157 HB3 GLU 682 HB3 GLU 682 7.610 7.113 4.061 158 HG2 GLU 682 HG2 GLU 682 10.081 6.536 4.559 159 HG3 GLU 682 HG3 GLU 682 10.340 8.266 4.521 160 H SER 683 H SER 683 11.332 6.466 2.086 161 HA SER 683 HA SER 683 12.538 8.967 1.777 162 HB2 SER 683 HB2 SER 683 14.489 7.806 1.142 163 HB3 SER 683 HB3 SER 683 13.628 6.650 2.154 164 HG SER 683 HG SER 683 13.018 5.523 0.387 165 H ILE 684 H ILE 684 11.310 6.694 -0.604 166 HA ILE 684 HA ILE 684 11.951 8.394 -2.854 167 HB ILE 684 HB ILE 684 10.034 6.068 -2.915 168 HG12 ILE 684 HG12 ILE 684 12.707 5.219 -3.507 169 HG13 ILE 684 HG13 ILE 684 12.725 5.993 -1.922 170 HG21 ILE 684 HG21 ILE 684 12.105 7.146 -4.854 171 HG22 ILE 684 HG22 ILE 684 11.056 5.760 -5.151 172 HG23 ILE 684 HG23 ILE 684 10.361 7.372 -4.977 173 HD11 ILE 684 HD11 ILE 684 10.992 4.533 -1.105 174 HD12 ILE 684 HD12 ILE 684 10.706 3.877 -2.715 175 HD13 ILE 684 HD13 ILE 684 12.213 3.518 -1.872 176 H LEU 685 H LEU 685 8.988 7.298 -1.244 177 HA LEU 685 HA LEU 685 7.155 8.820 -2.730 178 HB2 LEU 685 HB2 LEU 685 7.173 7.375 -0.149 179 HB3 LEU 685 HB3 LEU 685 5.910 8.586 -0.351 180 HG LEU 685 HG LEU 685 5.012 7.501 -2.247 181 HD11 LEU 685 HD11 LEU 685 7.661 6.052 -2.346 182 HD12 LEU 685 HD12 LEU 685 6.250 5.479 -3.236 183 HD13 LEU 685 HD13 LEU 685 6.929 7.066 -3.588 184 HD21 LEU 685 HD21 LEU 685 5.915 5.630 -0.086 185 HD22 LEU 685 HD22 LEU 685 4.288 6.185 -0.475 186 HD23 LEU 685 HD23 LEU 685 5.072 4.977 -1.490 187 H ALA 686 H ALA 686 8.797 9.614 0.364 188 HA ALA 686 HA ALA 686 7.506 12.107 0.715 189 HB1 ALA 686 HB1 ALA 686 8.800 10.956 2.479 190 HB2 ALA 686 HB2 ALA 686 9.300 12.633 2.263 191 HB3 ALA 686 HB3 ALA 686 10.288 11.326 1.607 192 H ASN 687 H ASN 687 10.374 11.142 -1.081 193 HA ASN 687 HA ASN 687 11.153 13.808 -1.811 194 HB2 ASN 687 HB2 ASN 687 12.700 11.829 -1.771 195 HB3 ASN 687 HB3 ASN 687 11.849 11.196 -3.176 196 HD21 ASN 687 HD21 ASN 687 13.967 13.823 -2.069 197 HD22 ASN 687 HD22 ASN 687 14.413 14.338 -3.623 198 H ARG 688 H ARG 688 9.246 11.215 -3.304 199 HA ARG 688 HA ARG 688 8.826 12.506 -5.807 200 HB2 ARG 688 HB2 ARG 688 7.953 10.094 -4.476 201 HB3 ARG 688 HB3 ARG 688 6.622 10.861 -5.335 202 HG2 ARG 688 HG2 ARG 688 7.538 9.641 -7.068 203 HG3 ARG 688 HG3 ARG 688 8.466 11.133 -7.237 204 HD2 ARG 688 HD2 ARG 688 9.846 9.665 -5.304 205 HD3 ARG 688 HD3 ARG 688 9.367 8.482 -6.498 206 HE ARG 688 HE ARG 688 10.707 9.581 -8.100 207 HH11 ARG 688 HH21 ARG 688 10.548 11.269 -5.106 208 HH12 ARG 688 HH22 ARG 688 11.971 12.225 -5.406 209 HH21 ARG 688 HH11 ARG 688 12.531 10.841 -8.507 210 HH22 ARG 688 HH12 ARG 688 13.060 11.990 -7.331 211 H SER 689 H SER 689 6.441 12.899 -6.529 212 HA SER 689 HA SER 689 5.427 15.095 -4.937 213 HB2 SER 689 HB2 SER 689 5.459 15.254 -7.386 214 HB3 SER 689 HB3 SER 689 4.380 13.865 -7.500 215 HG SER 689 HG SER 689 2.845 15.297 -7.318 216 H ASP 690 H ASP 690 3.019 15.254 -4.565 217 HA ASP 690 HA ASP 690 2.180 13.191 -2.836 218 HB2 ASP 690 HB2 ASP 690 1.068 15.716 -3.841 219 HB3 ASP 690 HB3 ASP 690 -0.137 14.502 -3.418 220 H GLY 691 H GLY 691 0.877 11.487 -3.065 221 HA2 GLY 691 HA2 GLY 691 -0.885 10.275 -4.206 222 HA3 GLY 691 HA3 GLY 691 -0.340 10.991 -5.722 223 H THR 692 H THR 692 2.476 10.503 -4.489 224 HA THR 692 HA THR 692 2.996 8.072 -5.914 225 HB THR 692 HB THR 692 4.863 9.347 -3.912 226 HG1 THR 692 HG1 THR 692 4.359 11.075 -5.136 227 HG21 THR 692 HG21 THR 692 6.561 8.409 -5.294 228 HG22 THR 692 HG22 THR 692 5.353 7.139 -5.111 229 HG23 THR 692 HG23 THR 692 5.421 8.085 -6.597 230 H PHE 693 H PHE 693 3.066 6.001 -5.152 231 HA PHE 693 HA PHE 693 3.083 5.601 -2.234 232 HB2 PHE 693 HB2 PHE 693 1.135 4.200 -2.269 233 HB3 PHE 693 HB3 PHE 693 0.713 5.724 -3.043 234 HD1 PHE 693 HD2 PHE 693 1.419 2.150 -3.597 235 HD2 PHE 693 HD1 PHE 693 0.331 5.869 -5.442 236 HE1 PHE 693 HE2 PHE 693 0.763 0.940 -5.657 237 HE2 PHE 693 HE1 PHE 693 -0.325 4.656 -7.503 238 HZ PHE 693 HZ PHE 693 -0.105 2.190 -7.611 239 H LEU 694 H LEU 694 3.238 3.287 -1.650 240 HA LEU 694 HA LEU 694 4.183 1.405 -3.592 241 HB2 LEU 694 HB2 LEU 694 6.478 1.260 -3.002 242 HB3 LEU 694 HB3 LEU 694 6.168 2.974 -3.264 243 HG LEU 694 HG LEU 694 5.616 2.835 -0.626 244 HD11 LEU 694 HD11 LEU 694 7.704 0.704 -1.167 245 HD12 LEU 694 HD12 LEU 694 7.377 1.394 0.419 246 HD13 LEU 694 HD13 LEU 694 6.134 0.459 -0.405 247 HD21 LEU 694 HD21 LEU 694 8.518 2.936 -1.277 248 HD22 LEU 694 HD22 LEU 694 7.473 4.049 -2.156 249 HD23 LEU 694 HD23 LEU 694 7.520 4.091 -0.397 250 H VAL 695 H VAL 695 5.020 -0.612 -2.472 251 HA VAL 695 HA VAL 695 3.845 -0.909 0.230 252 HB VAL 695 HB VAL 695 3.520 -2.886 -2.039 253 HG11 VAL 695 HG11 VAL 695 1.809 -3.748 -0.239 254 HG12 VAL 695 HG12 VAL 695 3.511 -4.175 -0.092 255 HG13 VAL 695 HG13 VAL 695 2.837 -2.874 0.886 256 HG21 VAL 695 HG21 VAL 695 2.111 -0.528 -1.635 257 HG22 VAL 695 HG22 VAL 695 1.516 -1.936 -2.508 258 HG23 VAL 695 HG23 VAL 695 1.122 -1.726 -0.802 259 H ARG 696 H ARG 696 4.931 -2.283 1.619 260 HA ARG 696 HA ARG 696 7.400 -3.541 0.557 261 HB2 ARG 696 HB2 ARG 696 8.503 -2.906 2.698 262 HB3 ARG 696 HB3 ARG 696 8.029 -1.513 1.724 263 HG2 ARG 696 HG2 ARG 696 5.996 -1.230 3.075 264 HG3 ARG 696 HG3 ARG 696 6.420 -2.649 4.033 265 HD2 ARG 696 HD2 ARG 696 8.097 -0.130 3.814 266 HD3 ARG 696 HD3 ARG 696 7.045 -0.536 5.168 267 HE ARG 696 HE ARG 696 9.331 -2.274 4.376 268 HH11 ARG 696 HH21 ARG 696 7.610 -0.425 6.757 269 HH12 ARG 696 HH22 ARG 696 8.475 -1.125 8.082 270 HH21 ARG 696 HH11 ARG 696 10.430 -3.120 6.078 271 HH22 ARG 696 HH12 ARG 696 10.046 -2.650 7.705 272 H GLN 697 H GLN 697 8.303 -5.217 1.975 273 HA GLN 697 HA GLN 697 6.159 -6.792 3.279 274 HB2 GLN 697 HB2 GLN 697 6.958 -8.021 1.426 275 HB3 GLN 697 HB3 GLN 697 8.632 -7.578 1.744 276 HG2 GLN 697 HG2 GLN 697 8.407 -9.848 2.466 277 HG3 GLN 697 HG3 GLN 697 8.431 -8.882 3.935 278 HE21 GLN 697 HE21 GLN 697 7.153 -11.568 3.449 279 HE22 GLN 697 HE22 GLN 697 5.512 -11.363 3.869 280 H ARG 698 H ARG 698 6.263 -6.384 5.405 281 HA ARG 698 HA ARG 698 8.262 -7.396 7.054 282 HB2 ARG 698 HB2 ARG 698 9.003 -4.866 5.939 283 HB3 ARG 698 HB3 ARG 698 8.676 -4.632 7.654 284 HG2 ARG 698 HG2 ARG 698 10.115 -7.032 7.554 285 HG3 ARG 698 HG3 ARG 698 10.908 -6.005 6.366 286 HD2 ARG 698 HD2 ARG 698 11.782 -5.830 8.768 287 HD3 ARG 698 HD3 ARG 698 11.379 -4.316 7.969 288 HE ARG 698 HE ARG 698 9.797 -3.977 9.627 289 HH11 ARG 698 HH21 ARG 698 10.400 -7.353 9.262 290 HH12 ARG 698 HH22 ARG 698 9.360 -7.809 10.566 291 HH21 ARG 698 HH11 ARG 698 8.491 -4.580 11.346 292 HH22 ARG 698 HH12 ARG 698 8.262 -6.270 11.714 293 H VAL 699 H VAL 699 7.587 -7.386 9.177 294 HA VAL 699 HA VAL 699 5.759 -5.488 10.264 295 HB VAL 699 HB VAL 699 4.374 -6.915 8.590 296 HG11 VAL 699 HG11 VAL 699 4.085 -9.116 8.995 297 HG12 VAL 699 HG12 VAL 699 5.454 -8.995 10.092 298 HG13 VAL 699 HG13 VAL 699 3.810 -8.846 10.714 299 HG21 VAL 699 HG21 VAL 699 2.721 -7.181 10.842 300 HG22 VAL 699 HG22 VAL 699 3.802 -5.843 11.235 301 HG23 VAL 699 HG23 VAL 699 2.824 -5.785 9.771 302 H LYS 700 H LYS 700 4.418 -7.328 12.036 303 HA LYS 700 HA LYS 700 6.627 -8.619 13.485 304 HB2 LYS 700 HB2 LYS 700 5.676 -7.615 15.623 305 HB3 LYS 700 HB3 LYS 700 6.560 -6.509 14.571 306 HG2 LYS 700 HG2 LYS 700 4.496 -5.612 13.672 307 HG3 LYS 700 HG3 LYS 700 3.545 -6.829 14.525 308 HD2 LYS 700 HD2 LYS 700 4.933 -5.752 16.604 309 HD3 LYS 700 HD3 LYS 700 4.789 -4.343 15.556 310 HE2 LYS 700 HE2 LYS 700 2.809 -4.186 16.760 311 HE3 LYS 700 HE3 LYS 700 2.273 -5.126 15.365 312 HZ1 LYS 700 HZ1 LYS 700 2.780 -6.019 18.120 313 HZ2 LYS 700 HZ2 LYS 700 1.500 -6.410 17.069 314 HZ3 LYS 700 HZ3 LYS 700 3.027 -7.141 16.839 315 H ASP 701 H ASP 701 3.157 -8.268 12.944 316 HA ASP 701 HA ASP 701 2.687 -11.034 13.447 317 HB2 ASP 701 HB2 ASP 701 1.073 -10.465 15.433 318 HB3 ASP 701 HB3 ASP 701 2.795 -10.690 15.741 319 H ALA 702 H ALA 702 0.531 -8.370 14.346 320 HA ALA 702 HA ALA 702 -1.649 -9.357 12.846 321 HB1 ALA 702 HB1 ALA 702 -1.037 -6.822 14.296 322 HB2 ALA 702 HB2 ALA 702 -2.317 -8.002 14.580 323 HB3 ALA 702 HB3 ALA 702 -2.447 -6.866 13.238 324 H ALA 703 H ALA 703 0.336 -9.369 10.955 325 HA ALA 703 HA ALA 703 -0.819 -8.280 8.713 326 HB1 ALA 703 HB1 ALA 703 1.088 -6.334 8.534 327 HB2 ALA 703 HB2 ALA 703 0.671 -6.260 10.245 328 HB3 ALA 703 HB3 ALA 703 -0.582 -6.055 9.024 329 H GLU 704 H GLU 704 0.905 -7.758 6.917 330 HA GLU 704 HA GLU 704 3.286 -9.479 7.229 331 HB2 GLU 704 HB2 GLU 704 0.953 -10.113 5.660 332 HB3 GLU 704 HB3 GLU 704 2.335 -9.871 4.591 333 HG2 GLU 704 HG2 GLU 704 2.452 -11.611 7.066 334 HG3 GLU 704 HG3 GLU 704 2.058 -12.239 5.467 335 H PHE 705 H PHE 705 1.757 -7.828 4.479 336 HA PHE 705 HA PHE 705 4.276 -6.448 3.920 337 HB2 PHE 705 HB2 PHE 705 1.673 -6.346 2.371 338 HB3 PHE 705 HB3 PHE 705 3.260 -5.817 1.815 339 HD1 PHE 705 HD1 PHE 705 1.248 -8.785 2.783 340 HD2 PHE 705 HD2 PHE 705 4.878 -7.370 0.984 341 HE1 PHE 705 HE1 PHE 705 1.745 -11.076 1.985 342 HE2 PHE 705 HE2 PHE 705 5.372 -9.661 0.178 343 HZ PHE 705 HZ PHE 705 3.805 -11.515 0.679 344 H ALA 706 H ALA 706 4.108 -4.083 3.319 345 HA ALA 706 HA ALA 706 2.037 -2.701 4.901 346 HB1 ALA 706 HB1 ALA 706 4.881 -1.739 4.977 347 HB2 ALA 706 HB2 ALA 706 4.308 -2.948 6.124 348 HB3 ALA 706 HB3 ALA 706 3.552 -1.355 6.067 349 H ILE 707 H ILE 707 1.132 -1.049 3.892 350 HA ILE 707 HA ILE 707 2.076 -0.342 1.225 351 HB ILE 707 HB ILE 707 -0.301 0.809 2.702 352 HG12 ILE 707 HG12 ILE 707 -1.444 -1.058 1.183 353 HG13 ILE 707 HG13 ILE 707 0.115 -1.854 1.393 354 HG21 ILE 707 HG21 ILE 707 -0.074 2.056 0.751 355 HG22 ILE 707 HG22 ILE 707 0.674 0.726 -0.137 356 HG23 ILE 707 HG23 ILE 707 -1.064 0.722 0.160 357 HD11 ILE 707 HD11 ILE 707 -2.036 -1.790 3.230 358 HD12 ILE 707 HD12 ILE 707 -0.430 -2.462 3.489 359 HD13 ILE 707 HD13 ILE 707 -0.769 -0.788 3.924 360 H SER 708 H SER 708 1.896 2.095 0.684 361 HA SER 708 HA SER 708 2.501 3.985 2.731 362 HB2 SER 708 HB2 SER 708 4.778 2.848 1.115 363 HB3 SER 708 HB3 SER 708 4.869 4.405 1.931 364 HG SER 708 HG SER 708 3.921 2.206 3.405 365 H ILE 709 H ILE 709 1.461 5.693 1.915 366 HA ILE 709 HA ILE 709 1.769 6.303 -0.972 367 HB ILE 709 HB ILE 709 -0.583 7.280 0.603 368 HG12 ILE 709 HG12 ILE 709 -1.636 5.076 -0.552 369 HG13 ILE 709 HG13 ILE 709 -0.031 4.460 -0.144 370 HG21 ILE 709 HG21 ILE 709 -1.334 7.890 -1.427 371 HG22 ILE 709 HG22 ILE 709 0.268 7.496 -2.049 372 HG23 ILE 709 HG23 ILE 709 -1.021 6.291 -2.102 373 HD11 ILE 709 HD11 ILE 709 -0.377 5.415 2.182 374 HD12 ILE 709 HD12 ILE 709 -2.053 5.712 1.724 375 HD13 ILE 709 HD13 ILE 709 -1.432 4.061 1.770 376 H LYS 710 H LYS 710 2.316 8.332 -1.542 377 HA LYS 710 HA LYS 710 3.074 10.179 0.597 378 HB2 LYS 710 HB2 LYS 710 4.746 9.925 -1.098 379 HB3 LYS 710 HB3 LYS 710 3.561 10.126 -2.386 380 HG2 LYS 710 HG2 LYS 710 4.689 12.211 -2.253 381 HG3 LYS 710 HG3 LYS 710 3.147 12.469 -1.449 382 HD2 LYS 710 HD2 LYS 710 4.096 12.548 0.669 383 HD3 LYS 710 HD3 LYS 710 5.519 11.608 0.193 384 HE2 LYS 710 HE2 LYS 710 4.920 14.394 -0.843 385 HE3 LYS 710 HE3 LYS 710 5.980 14.066 0.530 386 HZ1 LYS 710 HZ1 LYS 710 6.508 13.751 -2.293 387 HZ2 LYS 710 HZ2 LYS 710 7.602 13.799 -0.970 388 HZ3 LYS 710 HZ3 LYS 710 6.842 12.326 -1.403 389 H TYR 711 H TYR 711 1.265 11.144 1.356 390 HA TYR 711 HA TYR 711 -0.218 12.863 -0.520 391 HB2 TYR 711 HB2 TYR 711 -1.654 10.933 -0.342 392 HB3 TYR 711 HB3 TYR 711 -1.466 10.892 1.410 393 HD1 TYR 711 HD1 TYR 711 -2.396 13.425 -1.217 394 HD2 TYR 711 HD2 TYR 711 -3.246 11.728 2.634 395 HE1 TYR 711 HE1 TYR 711 -4.330 14.957 -0.965 396 HE2 TYR 711 HE2 TYR 711 -5.182 13.257 2.882 397 HH TYR 711 HH TYR 711 -5.652 15.947 0.869 398 H ASN 712 H ASN 712 0.045 14.841 0.212 399 HA ASN 712 HA ASN 712 -0.157 16.640 1.672 400 HB2 ASN 712 HB2 ASN 712 -1.758 15.275 3.053 401 HB3 ASN 712 HB3 ASN 712 -0.371 14.635 3.927 402 HD21 ASN 712 HD21 ASN 712 -0.012 15.703 5.840 403 HD22 ASN 712 HD22 ASN 712 -0.313 17.364 6.094 404 H VAL 713 H VAL 713 2.164 15.938 0.648 405 HA VAL 713 HA VAL 713 4.451 15.809 0.918 406 HB VAL 713 HB VAL 713 5.370 17.577 2.312 407 HG11 VAL 713 HG11 VAL 713 2.727 18.370 1.051 408 HG12 VAL 713 HG12 VAL 713 4.062 19.466 1.409 409 HG13 VAL 713 HG13 VAL 713 4.260 18.200 0.196 410 HG21 VAL 713 HG21 VAL 713 3.808 17.089 4.279 411 HG22 VAL 713 HG22 VAL 713 4.071 18.794 3.918 412 HG23 VAL 713 HG23 VAL 713 2.579 18.007 3.409 413 H GLU 714 H GLU 714 3.055 13.729 2.231 414 HA GLU 714 HA GLU 714 5.104 12.878 4.106 415 HB2 GLU 714 HB2 GLU 714 3.553 12.365 5.910 416 HB3 GLU 714 HB3 GLU 714 3.423 14.083 5.522 417 HG2 GLU 714 HG2 GLU 714 1.475 13.559 4.056 418 HG3 GLU 714 HG3 GLU 714 1.566 11.880 4.571 419 H VAL 715 H VAL 715 4.987 10.596 4.540 420 HA VAL 715 HA VAL 715 3.460 9.126 2.480 421 HB VAL 715 HB VAL 715 5.915 8.133 3.916 422 HG11 VAL 715 HG11 VAL 715 6.065 6.641 2.011 423 HG12 VAL 715 HG12 VAL 715 4.431 6.536 2.664 424 HG13 VAL 715 HG13 VAL 715 4.736 7.473 1.201 425 HG21 VAL 715 HG21 VAL 715 6.800 10.044 2.900 426 HG22 VAL 715 HG22 VAL 715 6.967 8.861 1.606 427 HG23 VAL 715 HG23 VAL 715 5.630 10.006 1.583 428 H LYS 716 H LYS 716 1.704 8.168 3.292 429 HA LYS 716 HA LYS 716 1.599 7.410 6.118 430 HB2 LYS 716 HB2 LYS 716 -0.614 6.904 4.148 431 HB3 LYS 716 HB3 LYS 716 -0.724 7.276 5.869 432 HG2 LYS 716 HG2 LYS 716 0.553 9.508 4.914 433 HG3 LYS 716 HG3 LYS 716 -0.505 9.102 3.560 434 HD2 LYS 716 HD2 LYS 716 -2.451 9.112 5.013 435 HD3 LYS 716 HD3 LYS 716 -1.433 9.362 6.433 436 HE2 LYS 716 HE2 LYS 716 -0.764 11.391 4.544 437 HE3 LYS 716 HE3 LYS 716 -2.523 11.337 4.660 438 HZ1 LYS 716 HZ1 LYS 716 -2.077 12.655 6.428 439 HZ2 LYS 716 HZ2 LYS 716 -1.940 11.158 7.210 440 HZ3 LYS 716 HZ3 LYS 716 -0.524 11.987 6.720 441 H HIS 717 H HIS 717 2.251 5.486 6.769 442 HA HIS 717 HA HIS 717 2.196 3.201 4.914 443 HB2 HIS 717 HB2 HIS 717 3.661 3.253 7.537 444 HB3 HIS 717 HB3 HIS 717 3.984 2.269 6.112 445 HD1 HIS 717 HD1 HIS 717 5.105 3.483 4.045 446 HD2 HIS 717 HD2 HIS 717 4.898 5.769 7.541 447 HE1 HIS 717 HE1 HIS 717 6.769 5.386 3.777 448 HE2 HIS 717 HE2 HIS 717 6.704 6.756 5.920 449 H ILE 718 H ILE 718 1.287 1.285 5.505 450 HA ILE 718 HA ILE 718 -0.067 1.063 8.098 451 HB ILE 718 HB ILE 718 -1.448 0.771 5.421 452 HG12 ILE 718 HG12 ILE 718 -2.774 2.369 7.443 453 HG13 ILE 718 HG13 ILE 718 -1.145 2.975 7.159 454 HG21 ILE 718 HG21 ILE 718 -2.321 -1.003 6.723 455 HG22 ILE 718 HG22 ILE 718 -2.244 -0.059 8.213 456 HG23 ILE 718 HG23 ILE 718 -3.453 0.321 6.988 457 HD11 ILE 718 HD11 ILE 718 -3.446 2.772 5.265 458 HD12 ILE 718 HD12 ILE 718 -2.296 4.088 5.495 459 HD13 ILE 718 HD13 ILE 718 -1.809 2.635 4.622 460 H LYS 719 H LYS 719 -0.325 -1.034 8.810 461 HA LYS 719 HA LYS 719 1.361 -3.025 7.528 462 HB2 LYS 719 HB2 LYS 719 0.652 -4.342 9.633 463 HB3 LYS 719 HB3 LYS 719 1.670 -2.924 9.850 464 HG2 LYS 719 HG2 LYS 719 0.058 -1.799 10.982 465 HG3 LYS 719 HG3 LYS 719 -1.198 -2.280 9.842 466 HD2 LYS 719 HD2 LYS 719 -0.361 -4.596 11.334 467 HD3 LYS 719 HD3 LYS 719 -0.742 -3.297 12.461 468 HE2 LYS 719 HE2 LYS 719 -2.848 -4.233 12.159 469 HE3 LYS 719 HE3 LYS 719 -2.863 -2.991 10.905 470 HZ1 LYS 719 HZ1 LYS 719 -3.614 -5.153 10.052 471 HZ2 LYS 719 HZ2 LYS 719 -2.148 -4.642 9.281 472 HZ3 LYS 719 HZ3 LYS 719 -2.095 -5.851 10.510 473 H ILE 720 H ILE 720 0.393 -3.921 5.769 474 HA ILE 720 HA ILE 720 -2.345 -4.513 5.449 475 HB ILE 720 HB ILE 720 0.044 -4.799 3.922 476 HG12 ILE 720 HG12 ILE 720 -2.758 -5.449 3.008 477 HG13 ILE 720 HG13 ILE 720 -2.268 -3.798 3.377 478 HG21 ILE 720 HG21 ILE 720 -0.355 -6.966 2.826 479 HG22 ILE 720 HG22 ILE 720 0.001 -7.198 4.536 480 HG23 ILE 720 HG23 ILE 720 -1.662 -7.310 3.957 481 HD11 ILE 720 HD11 ILE 720 -0.308 -5.163 1.697 482 HD12 ILE 720 HD12 ILE 720 -1.901 -5.101 0.941 483 HD13 ILE 720 HD13 ILE 720 -1.106 -3.610 1.448 484 H MET 721 H MET 721 -3.557 -6.332 5.785 485 HA MET 721 HA MET 721 -2.444 -8.341 7.626 486 HB2 MET 721 HB2 MET 721 -4.699 -7.045 7.945 487 HB3 MET 721 HB3 MET 721 -5.322 -8.215 6.786 488 HG2 MET 721 HG2 MET 721 -5.616 -8.957 9.154 489 HG3 MET 721 HG3 MET 721 -4.635 -10.070 8.201 490 HE1 MET 721 HE1 MET 721 -4.712 -10.198 11.257 491 HE2 MET 721 HE2 MET 721 -3.690 -11.215 10.250 492 HE3 MET 721 HE3 MET 721 -3.006 -10.391 11.656 493 H THR 722 H THR 722 -2.928 -10.634 7.226 494 HA THR 722 HA THR 722 -3.153 -11.231 4.333 495 HB THR 722 HB THR 722 -0.913 -11.736 4.911 496 HG1 THR 722 HG1 THR 722 -2.579 -14.016 5.133 497 HG21 THR 722 HG21 THR 722 -0.714 -11.673 7.218 498 HG22 THR 722 HG22 THR 722 -2.154 -12.658 7.475 499 HG23 THR 722 HG23 THR 722 -0.649 -13.413 6.951 500 H ALA 723 H ALA 723 -5.468 -11.094 5.741 501 HA ALA 723 HA ALA 723 -6.354 -13.390 7.072 502 HB1 ALA 723 HB1 ALA 723 -7.710 -11.388 7.054 503 HB2 ALA 723 HB2 ALA 723 -8.638 -12.686 6.307 504 HB3 ALA 723 HB3 ALA 723 -7.872 -11.459 5.301 505 H GLU 724 H GLU 724 -6.222 -15.405 6.363 506 HA GLU 724 HA GLU 724 -6.154 -17.215 4.938 507 HB2 GLU 724 HB2 GLU 724 -8.335 -15.952 3.321 508 HB3 GLU 724 HB3 GLU 724 -8.171 -17.620 3.868 509 HG2 GLU 724 HG2 GLU 724 -8.982 -15.203 5.501 510 HG3 GLU 724 HG3 GLU 724 -9.912 -16.669 5.204 511 H GLY 725 H GLY 725 -4.621 -14.720 4.212 512 HA2 GLY 725 HA2 GLY 725 -2.954 -14.586 2.515 513 HA3 GLY 725 HA3 GLY 725 -3.998 -15.517 1.447 514 H LEU 726 H LEU 726 -6.134 -13.449 2.710 515 HA LEU 726 HA LEU 726 -6.012 -11.699 0.393 516 HB2 LEU 726 HB2 LEU 726 -7.909 -11.440 2.730 517 HB3 LEU 726 HB3 LEU 726 -8.127 -10.860 1.082 518 HG LEU 726 HG LEU 726 -7.833 -13.802 1.727 519 HD11 LEU 726 HD11 LEU 726 -9.886 -12.334 2.710 520 HD12 LEU 726 HD12 LEU 726 -10.505 -12.673 1.094 521 HD13 LEU 726 HD13 LEU 726 -10.068 -14.001 2.169 522 HD21 LEU 726 HD21 LEU 726 -8.702 -14.122 -0.478 523 HD22 LEU 726 HD22 LEU 726 -9.175 -12.428 -0.613 524 HD23 LEU 726 HD23 LEU 726 -7.469 -12.871 -0.627 525 H TYR 727 H TYR 727 -5.274 -9.667 0.337 526 HA TYR 727 HA TYR 727 -4.053 -8.623 2.782 527 HB2 TYR 727 HB2 TYR 727 -3.790 -7.704 -0.081 528 HB3 TYR 727 HB3 TYR 727 -2.910 -7.039 1.292 529 HD1 TYR 727 HD2 TYR 727 -2.930 -10.135 2.487 530 HD2 TYR 727 HD1 TYR 727 -1.486 -8.139 -1.014 531 HE1 TYR 727 HE2 TYR 727 -1.190 -11.881 2.198 532 HE2 TYR 727 HE1 TYR 727 0.251 -9.864 -1.303 533 HH TYR 727 HH TYR 727 0.365 -12.497 -0.506 534 H ARG 728 H ARG 728 -4.502 -6.658 3.646 535 HA ARG 728 HA ARG 728 -6.591 -4.971 2.509 536 HB2 ARG 728 HB2 ARG 728 -7.675 -5.104 4.926 537 HB3 ARG 728 HB3 ARG 728 -8.132 -6.243 3.671 538 HG2 ARG 728 HG2 ARG 728 -6.365 -7.815 4.530 539 HG3 ARG 728 HG3 ARG 728 -6.088 -6.695 5.860 540 HD2 ARG 728 HD2 ARG 728 -8.898 -7.172 5.706 541 HD3 ARG 728 HD3 ARG 728 -8.083 -8.736 5.640 542 HE ARG 728 HE ARG 728 -7.126 -6.917 7.718 543 HH11 ARG 728 HH21 ARG 728 -9.264 -9.496 6.879 544 HH12 ARG 728 HH22 ARG 728 -9.448 -10.039 8.506 545 HH21 ARG 728 HH11 ARG 728 -7.372 -7.589 9.822 546 HH22 ARG 728 HH12 ARG 728 -8.406 -8.956 10.169 547 H ILE 729 H ILE 729 -6.215 -2.887 2.990 548 HA ILE 729 HA ILE 729 -3.951 -2.213 4.690 549 HB ILE 729 HB ILE 729 -5.785 -0.251 3.335 550 HG12 ILE 729 HG12 ILE 729 -3.576 -1.928 2.120 551 HG13 ILE 729 HG13 ILE 729 -5.260 -1.850 1.609 552 HG21 ILE 729 HG21 ILE 729 -4.248 0.943 4.589 553 HG22 ILE 729 HG22 ILE 729 -2.993 -0.285 4.415 554 HG23 ILE 729 HG23 ILE 729 -3.367 0.790 3.069 555 HD11 ILE 729 HD11 ILE 729 -4.306 -0.409 0.070 556 HD12 ILE 729 HD12 ILE 729 -4.701 0.733 1.356 557 HD13 ILE 729 HD13 ILE 729 -3.054 0.125 1.194 558 H THR 730 H THR 730 -7.425 -2.078 4.790 559 HA THR 730 HA THR 730 -7.281 -0.691 7.410 560 HB THR 730 HB THR 730 -8.521 0.558 5.743 561 HG1 THR 730 HG1 THR 730 -9.946 1.037 7.182 562 HG21 THR 730 HG21 THR 730 -10.082 -2.002 5.441 563 HG22 THR 730 HG22 THR 730 -10.693 -0.445 4.888 564 HG23 THR 730 HG23 THR 730 -9.218 -1.111 4.190 565 H GLU 731 H GLU 731 -7.692 -3.594 5.931 566 HA GLU 731 HA GLU 731 -8.258 -5.647 6.715 567 HB2 GLU 731 HB2 GLU 731 -8.889 -4.321 9.345 568 HB3 GLU 731 HB3 GLU 731 -8.447 -6.006 9.061 569 HG2 GLU 731 HG2 GLU 731 -6.373 -4.630 7.844 570 HG3 GLU 731 HG3 GLU 731 -6.721 -3.616 9.239 571 H LYS 732 H LYS 732 -10.427 -2.996 6.968 572 HA LYS 732 HA LYS 732 -12.817 -4.447 7.531 573 HB2 LYS 732 HB2 LYS 732 -12.583 -1.866 5.969 574 HB3 LYS 732 HB3 LYS 732 -13.965 -2.436 6.904 575 HG2 LYS 732 HG2 LYS 732 -11.260 -1.881 8.145 576 HG3 LYS 732 HG3 LYS 732 -12.534 -0.671 8.048 577 HD2 LYS 732 HD2 LYS 732 -13.400 -3.287 9.121 578 HD3 LYS 732 HD3 LYS 732 -12.245 -2.420 10.132 579 HE2 LYS 732 HE2 LYS 732 -14.611 -0.979 8.965 580 HE3 LYS 732 HE3 LYS 732 -14.793 -1.939 10.437 581 HZ1 LYS 732 HZ1 LYS 732 -13.919 0.624 10.347 582 HZ2 LYS 732 HZ2 LYS 732 -13.664 -0.458 11.657 583 HZ3 LYS 732 HZ3 LYS 732 -12.450 -0.249 10.458 584 H LYS 733 H LYS 733 -10.962 -3.778 4.668 585 HA LYS 733 HA LYS 733 -12.704 -5.565 3.106 586 HB2 LYS 733 HB2 LYS 733 -13.497 -3.492 2.325 587 HB3 LYS 733 HB3 LYS 733 -11.901 -2.747 2.403 588 HG2 LYS 733 HG2 LYS 733 -12.588 -3.233 0.061 589 HG3 LYS 733 HG3 LYS 733 -11.136 -4.121 0.513 590 HD2 LYS 733 HD2 LYS 733 -12.304 -6.172 0.695 591 HD3 LYS 733 HD3 LYS 733 -13.868 -5.373 0.826 592 HE2 LYS 733 HE2 LYS 733 -14.130 -5.664 -1.391 593 HE3 LYS 733 HE3 LYS 733 -12.812 -4.521 -1.642 594 HZ1 LYS 733 HZ1 LYS 733 -12.846 -7.333 -2.058 595 HZ2 LYS 733 HZ2 LYS 733 -11.661 -6.201 -2.505 596 HZ3 LYS 733 HZ3 LYS 733 -11.598 -6.925 -0.962 597 H ALA 734 H ALA 734 -11.451 -7.191 2.450 598 HA ALA 734 HA ALA 734 -8.597 -6.685 1.911 599 HB1 ALA 734 HB1 ALA 734 -8.139 -8.811 2.634 600 HB2 ALA 734 HB2 ALA 734 -9.668 -9.459 2.039 601 HB3 ALA 734 HB3 ALA 734 -9.623 -8.546 3.547 602 H PHE 735 H PHE 735 -7.682 -8.208 0.196 603 HA PHE 735 HA PHE 735 -9.552 -8.561 -2.054 604 HB2 PHE 735 HB2 PHE 735 -7.222 -6.741 -1.918 605 HB3 PHE 735 HB3 PHE 735 -7.369 -7.694 -3.393 606 HD1 PHE 735 HD2 PHE 735 -9.396 -7.524 -4.810 607 HD2 PHE 735 HD1 PHE 735 -8.850 -5.033 -1.353 608 HE1 PHE 735 HE2 PHE 735 -11.208 -6.028 -5.598 609 HE2 PHE 735 HE1 PHE 735 -10.660 -3.539 -2.142 610 HZ PHE 735 HZ PHE 735 -11.841 -4.037 -4.265 611 H ARG 736 H ARG 736 -8.281 -9.682 -3.934 612 HA ARG 736 HA ARG 736 -7.645 -12.273 -3.146 613 HB2 ARG 736 HB2 ARG 736 -7.267 -10.684 -5.643 614 HB3 ARG 736 HB3 ARG 736 -6.433 -12.228 -5.513 615 HG2 ARG 736 HG2 ARG 736 -8.479 -12.846 -6.466 616 HG3 ARG 736 HG3 ARG 736 -8.758 -13.144 -4.750 617 HD2 ARG 736 HD2 ARG 736 -10.657 -11.932 -5.609 618 HD3 ARG 736 HD3 ARG 736 -9.735 -10.839 -4.581 619 HE ARG 736 HE ARG 736 -8.724 -10.452 -7.141 620 HH11 ARG 736 HH21 ARG 736 -11.858 -10.336 -5.673 621 HH12 ARG 736 HH22 ARG 736 -12.406 -9.013 -6.639 622 HH21 ARG 736 HH11 ARG 736 -9.401 -8.695 -8.346 623 HH22 ARG 736 HH12 ARG 736 -11.026 -8.090 -8.153 624 H GLY 737 H GLY 737 -5.406 -9.668 -4.078 625 HA2 GLY 737 HA2 GLY 737 -3.326 -10.884 -2.399 626 HA3 GLY 737 HA3 GLY 737 -2.959 -10.655 -4.110 627 H LEU 738 H LEU 738 -1.279 -9.157 -3.541 628 HA LEU 738 HA LEU 738 -2.014 -6.722 -2.139 629 HB2 LEU 738 HB2 LEU 738 0.405 -8.065 -2.662 630 HB3 LEU 738 HB3 LEU 738 0.510 -6.538 -3.538 631 HG LEU 738 HG LEU 738 -0.306 -6.768 -0.625 632 HD11 LEU 738 HD11 LEU 738 2.029 -7.444 -0.905 633 HD12 LEU 738 HD12 LEU 738 2.346 -5.992 -1.858 634 HD13 LEU 738 HD13 LEU 738 1.938 -5.860 -0.147 635 HD21 LEU 738 HD21 LEU 738 -0.213 -4.409 -0.594 636 HD22 LEU 738 HD22 LEU 738 0.645 -4.345 -2.135 637 HD23 LEU 738 HD23 LEU 738 -1.058 -4.796 -2.091 638 H THR 739 H THR 739 -1.299 -7.767 -5.420 639 HA THR 739 HA THR 739 -1.397 -5.289 -6.697 640 HB THR 739 HB THR 739 -2.513 -7.861 -7.829 641 HG1 THR 739 HG1 THR 739 -0.584 -8.609 -7.548 642 HG21 THR 739 HG21 THR 739 -1.599 -6.891 -9.946 643 HG22 THR 739 HG22 THR 739 -2.893 -5.928 -9.235 644 HG23 THR 739 HG23 THR 739 -1.215 -5.419 -9.056 645 H GLU 740 H GLU 740 -4.038 -7.652 -6.239 646 HA GLU 740 HA GLU 740 -6.098 -5.967 -7.188 647 HB2 GLU 740 HB2 GLU 740 -6.373 -8.170 -5.129 648 HB3 GLU 740 HB3 GLU 740 -7.640 -7.538 -6.179 649 HG2 GLU 740 HG2 GLU 740 -5.474 -8.305 -7.863 650 HG3 GLU 740 HG3 GLU 740 -5.737 -9.624 -6.725 651 H LEU 741 H LEU 741 -4.571 -6.283 -4.070 652 HA LEU 741 HA LEU 741 -6.529 -4.735 -2.653 653 HB2 LEU 741 HB2 LEU 741 -5.085 -6.467 -1.599 654 HB3 LEU 741 HB3 LEU 741 -3.685 -5.440 -1.883 655 HG LEU 741 HG LEU 741 -4.801 -5.367 0.448 656 HD11 LEU 741 HD11 LEU 741 -3.393 -3.504 -1.057 657 HD12 LEU 741 HD12 LEU 741 -4.751 -2.586 -0.410 658 HD13 LEU 741 HD13 LEU 741 -3.668 -3.445 0.681 659 HD21 LEU 741 HD21 LEU 741 -6.709 -3.880 0.670 660 HD22 LEU 741 HD22 LEU 741 -6.711 -3.563 -1.062 661 HD23 LEU 741 HD23 LEU 741 -7.122 -5.167 -0.458 662 H VAL 742 H VAL 742 -3.370 -4.056 -4.150 663 HA VAL 742 HA VAL 742 -3.516 -1.248 -3.303 664 HB VAL 742 HB VAL 742 -1.447 -2.886 -4.739 665 HG11 VAL 742 HG11 VAL 742 -1.646 0.122 -4.548 666 HG12 VAL 742 HG12 VAL 742 -0.111 -0.712 -4.779 667 HG13 VAL 742 HG13 VAL 742 -1.382 -0.857 -5.993 668 HG21 VAL 742 HG21 VAL 742 -0.770 -1.058 -2.530 669 HG22 VAL 742 HG22 VAL 742 -1.896 -2.343 -2.092 670 HG23 VAL 742 HG23 VAL 742 -0.324 -2.742 -2.776 671 H GLU 743 H GLU 743 -4.091 -3.167 -6.189 672 HA GLU 743 HA GLU 743 -4.214 -0.838 -7.904 673 HB2 GLU 743 HB2 GLU 743 -5.048 -3.713 -8.357 674 HB3 GLU 743 HB3 GLU 743 -5.113 -2.454 -9.589 675 HG2 GLU 743 HG2 GLU 743 -2.600 -3.307 -8.111 676 HG3 GLU 743 HG3 GLU 743 -3.025 -3.801 -9.745 677 H PHE 744 H PHE 744 -6.105 -1.696 -5.469 678 HA PHE 744 HA PHE 744 -8.628 -0.954 -6.820 679 HB2 PHE 744 HB2 PHE 744 -8.658 -3.119 -5.627 680 HB3 PHE 744 HB3 PHE 744 -8.213 -2.295 -4.135 681 HD1 PHE 744 HD2 PHE 744 -10.843 -2.575 -6.745 682 HD2 PHE 744 HD1 PHE 744 -9.830 -1.066 -2.849 683 HE1 PHE 744 HE2 PHE 744 -13.225 -2.022 -6.337 684 HE2 PHE 744 HE1 PHE 744 -12.215 -0.514 -2.445 685 HZ PHE 744 HZ PHE 744 -13.910 -0.991 -4.187 686 H TYR 745 H TYR 745 -6.631 -0.360 -3.947 687 HA TYR 745 HA TYR 745 -8.238 1.729 -2.894 688 HB2 TYR 745 HB2 TYR 745 -5.380 0.898 -2.478 689 HB3 TYR 745 HB3 TYR 745 -5.994 2.387 -1.766 690 HD1 TYR 745 HD1 TYR 745 -7.287 -1.107 -2.250 691 HD2 TYR 745 HD2 TYR 745 -6.686 2.178 0.462 692 HE1 TYR 745 HE1 TYR 745 -8.322 -2.418 -0.419 693 HE2 TYR 745 HE2 TYR 745 -7.713 0.854 2.281 694 HH TYR 745 HH TYR 745 -9.082 -2.362 1.685 695 H GLN 746 H GLN 746 -6.190 1.596 -5.611 696 HA GLN 746 HA GLN 746 -5.299 4.293 -5.712 697 HB2 GLN 746 HB2 GLN 746 -5.111 3.810 -8.210 698 HB3 GLN 746 HB3 GLN 746 -4.207 2.730 -7.147 699 HG2 GLN 746 HG2 GLN 746 -5.483 0.928 -7.674 700 HG3 GLN 746 HG3 GLN 746 -6.975 1.860 -7.702 701 HE21 GLN 746 HE21 GLN 746 -4.465 0.499 -9.694 702 HE22 GLN 746 HE22 GLN 746 -5.034 1.119 -11.167 703 H GLN 747 H GLN 747 -8.326 2.780 -6.227 704 HA GLN 747 HA GLN 747 -9.447 5.234 -7.445 705 HB2 GLN 747 HB2 GLN 747 -10.930 2.626 -7.320 706 HB3 GLN 747 HB3 GLN 747 -11.073 3.936 -8.492 707 HG2 GLN 747 HG2 GLN 747 -8.397 3.021 -8.652 708 HG3 GLN 747 HG3 GLN 747 -9.405 1.579 -8.610 709 HE21 GLN 747 HE21 GLN 747 -7.872 2.806 -10.903 710 HE22 GLN 747 HE22 GLN 747 -9.043 3.049 -12.119 711 H ASN 748 H ASN 748 -9.877 2.796 -4.914 712 HA ASN 748 HA ASN 748 -12.199 3.977 -3.761 713 HB2 ASN 748 HB2 ASN 748 -11.362 1.603 -3.434 714 HB3 ASN 748 HB3 ASN 748 -10.161 2.269 -2.332 715 HD21 ASN 748 HD21 ASN 748 -11.095 3.589 -0.452 716 HD22 ASN 748 HD22 ASN 748 -12.601 3.095 0.188 717 H SER 749 H SER 749 -12.186 6.005 -3.005 718 HA SER 749 HA SER 749 -10.066 7.590 -2.250 719 HB2 SER 749 HB2 SER 749 -11.643 9.024 -1.173 720 HB3 SER 749 HB3 SER 749 -12.482 8.286 -2.532 721 HG SER 749 HG SER 749 -12.544 6.897 -0.117 722 H LEU 750 H LEU 750 -8.516 7.073 -0.855 723 HA LEU 750 HA LEU 750 -8.579 5.215 1.169 724 HB2 LEU 750 HB2 LEU 750 -6.986 7.788 1.089 725 HB3 LEU 750 HB3 LEU 750 -6.653 6.432 2.166 726 HG LEU 750 HG LEU 750 -6.600 6.383 -0.861 727 HD11 LEU 750 HD11 LEU 750 -4.496 7.130 -0.468 728 HD12 LEU 750 HD12 LEU 750 -4.586 6.746 1.250 729 HD13 LEU 750 HD13 LEU 750 -4.177 5.489 0.085 730 HD21 LEU 750 HD21 LEU 750 -6.610 4.235 1.209 731 HD22 LEU 750 HD22 LEU 750 -7.271 4.220 -0.426 732 HD23 LEU 750 HD23 LEU 750 -5.536 4.028 -0.173 733 H LYS 751 H LYS 751 -9.781 8.503 1.263 734 HA LYS 751 HA LYS 751 -9.968 8.969 3.994 735 HB2 LYS 751 HB2 LYS 751 -11.621 10.589 3.493 736 HB3 LYS 751 HB3 LYS 751 -10.563 10.538 2.087 737 HG2 LYS 751 HG2 LYS 751 -12.257 8.757 1.186 738 HG3 LYS 751 HG3 LYS 751 -13.353 9.449 2.380 739 HD2 LYS 751 HD2 LYS 751 -11.942 10.940 0.143 740 HD3 LYS 751 HD3 LYS 751 -13.670 10.604 0.254 741 HE2 LYS 751 HE2 LYS 751 -12.104 12.277 2.245 742 HE3 LYS 751 HE3 LYS 751 -13.106 12.932 0.950 743 HZ1 LYS 751 HZ1 LYS 751 -15.038 11.999 1.902 744 HZ2 LYS 751 HZ2 LYS 751 -14.144 11.057 2.999 745 HZ3 LYS 751 HZ3 LYS 751 -14.202 12.741 3.184 746 H ASP 752 H ASP 752 -11.579 6.578 2.149 747 HA ASP 752 HA ASP 752 -13.717 6.259 4.145 748 HB2 ASP 752 HB2 ASP 752 -14.842 5.736 2.269 749 HB3 ASP 752 HB3 ASP 752 -13.360 5.607 1.334 750 H CYS 753 H CYS 753 -11.115 4.349 2.640 751 HA CYS 753 HA CYS 753 -11.372 2.210 4.554 752 HB2 CYS 753 HB2 CYS 753 -9.227 2.805 2.501 753 HB3 CYS 753 HB3 CYS 753 -9.315 1.332 3.468 754 HG CYS 753 HG CYS 753 -11.892 1.902 1.907 755 H PHE 754 H PHE 754 -9.135 4.952 4.061 756 HA PHE 754 HA PHE 754 -7.530 4.187 6.369 757 HB2 PHE 754 HB2 PHE 754 -7.513 6.558 4.501 758 HB3 PHE 754 HB3 PHE 754 -6.466 6.475 5.912 759 HD1 PHE 754 HD2 PHE 754 -7.443 3.494 3.897 760 HD2 PHE 754 HD1 PHE 754 -4.378 6.388 4.726 761 HE1 PHE 754 HE2 PHE 754 -5.823 2.146 2.610 762 HE2 PHE 754 HE1 PHE 754 -2.762 5.037 3.435 763 HZ PHE 754 HZ PHE 754 -3.480 2.918 2.371 764 H LYS 755 H LYS 755 -7.959 7.554 6.357 765 HA LYS 755 HA LYS 755 -10.255 7.687 8.101 766 HB2 LYS 755 HB2 LYS 755 -8.411 6.763 9.557 767 HB3 LYS 755 HB3 LYS 755 -7.570 8.293 9.348 768 HG2 LYS 755 HG2 LYS 755 -10.395 8.595 10.126 769 HG3 LYS 755 HG3 LYS 755 -9.425 7.744 11.326 770 HD2 LYS 755 HD2 LYS 755 -8.797 10.459 10.130 771 HD3 LYS 755 HD3 LYS 755 -9.386 10.162 11.759 772 HE2 LYS 755 HE2 LYS 755 -7.265 9.900 12.467 773 HE3 LYS 755 HE3 LYS 755 -7.085 8.518 11.385 774 HZ1 LYS 755 HZ1 LYS 755 -6.221 9.830 9.711 775 HZ2 LYS 755 HZ2 LYS 755 -6.882 11.282 10.324 776 HZ3 LYS 755 HZ3 LYS 755 -5.531 10.543 11.076 777 H SER 756 H SER 756 -7.434 9.779 8.416 778 HA SER 756 HA SER 756 -9.048 12.052 7.644 779 HB2 SER 756 HB2 SER 756 -6.109 11.935 8.383 780 HB3 SER 756 HB3 SER 756 -7.082 13.396 8.238 781 HG SER 756 HG SER 756 -8.300 12.736 9.990 782 H LEU 757 H LEU 757 -7.922 9.823 5.783 783 HA LEU 757 HA LEU 757 -6.208 11.203 3.946 784 HB2 LEU 757 HB2 LEU 757 -7.575 8.561 4.073 785 HB3 LEU 757 HB3 LEU 757 -7.099 9.147 2.485 786 HG LEU 757 HG LEU 757 -5.383 7.726 3.773 787 HD11 LEU 757 HD11 LEU 757 -3.508 9.270 3.059 788 HD12 LEU 757 HD12 LEU 757 -4.705 8.888 1.820 789 HD13 LEU 757 HD13 LEU 757 -4.759 10.443 2.645 790 HD21 LEU 757 HD21 LEU 757 -4.648 10.284 5.147 791 HD22 LEU 757 HD22 LEU 757 -5.863 9.240 5.880 792 HD23 LEU 757 HD23 LEU 757 -4.240 8.625 5.581 793 H ASP 758 H ASP 758 -6.859 11.237 1.574 794 HA ASP 758 HA ASP 758 -9.575 11.637 0.829 795 HB2 ASP 758 HB2 ASP 758 -8.353 13.861 2.085 796 HB3 ASP 758 HB3 ASP 758 -8.423 14.234 0.364 797 H THR 759 H THR 759 -7.433 10.120 -0.054 798 HA THR 759 HA THR 759 -7.286 10.971 -2.834 799 HB THR 759 HB THR 759 -5.289 12.023 -1.802 800 HG1 THR 759 HG1 THR 759 -4.708 11.537 -3.768 801 HG21 THR 759 HG21 THR 759 -3.483 10.162 -1.224 802 HG22 THR 759 HG22 THR 759 -4.607 10.738 0.005 803 HG23 THR 759 HG23 THR 759 -4.911 9.214 -0.826 804 H THR 760 H THR 760 -5.235 9.177 -3.535 805 HA THR 760 HA THR 760 -5.923 6.526 -2.570 806 HB THR 760 HB THR 760 -6.675 5.669 -4.744 807 HG1 THR 760 HG1 THR 760 -6.789 6.892 -6.456 808 HG21 THR 760 HG21 THR 760 -8.406 8.025 -4.014 809 HG22 THR 760 HG22 THR 760 -8.911 6.461 -4.648 810 HG23 THR 760 HG23 THR 760 -8.298 6.585 -3.001 811 H LEU 761 H LEU 761 -4.770 4.832 -3.947 812 HA LEU 761 HA LEU 761 -2.007 5.345 -4.040 813 HB2 LEU 761 HB2 LEU 761 -3.682 3.207 -5.402 814 HB3 LEU 761 HB3 LEU 761 -1.931 3.192 -5.365 815 HG LEU 761 HG LEU 761 -3.176 1.761 -3.619 816 HD11 LEU 761 HD11 LEU 761 -1.009 3.733 -3.010 817 HD12 LEU 761 HD12 LEU 761 -1.557 2.591 -1.788 818 HD13 LEU 761 HD13 LEU 761 -0.884 1.996 -3.304 819 HD21 LEU 761 HD21 LEU 761 -3.802 2.931 -1.550 820 HD22 LEU 761 HD22 LEU 761 -3.506 4.482 -2.326 821 HD23 LEU 761 HD23 LEU 761 -4.816 3.445 -2.892 822 H GLN 762 H GLN 762 -1.874 7.335 -5.209 823 HA GLN 762 HA GLN 762 -2.841 7.641 -7.864 824 HB2 GLN 762 HB2 GLN 762 -1.545 9.234 -5.866 825 HB3 GLN 762 HB3 GLN 762 -0.735 9.475 -7.410 826 HG2 GLN 762 HG2 GLN 762 -3.558 9.465 -7.885 827 HG3 GLN 762 HG3 GLN 762 -3.240 10.539 -6.523 828 HE21 GLN 762 HE21 GLN 762 -1.129 11.991 -6.991 829 HE22 GLN 762 HE22 GLN 762 -1.114 12.705 -8.529 830 H PHE 763 H PHE 763 0.567 7.525 -6.729 831 HA PHE 763 HA PHE 763 1.214 6.170 -9.281 832 HB2 PHE 763 HB2 PHE 763 2.567 8.607 -8.119 833 HB3 PHE 763 HB3 PHE 763 3.300 7.609 -9.373 834 HD1 PHE 763 HD1 PHE 763 2.117 7.312 -11.577 835 HD2 PHE 763 HD2 PHE 763 0.816 10.153 -8.631 836 HE1 PHE 763 HE1 PHE 763 0.774 8.482 -13.299 837 HE2 PHE 763 HE2 PHE 763 -0.529 11.323 -10.355 838 HZ PHE 763 HZ PHE 763 -0.552 10.487 -12.688 839 HA PRO 764 HA PRO 764 3.735 3.571 -6.749 840 HB2 PRO 764 HB2 PRO 764 5.321 2.471 -8.663 841 HB3 PRO 764 HB3 PRO 764 3.594 2.091 -8.532 842 HG2 PRO 764 HG2 PRO 764 4.995 3.893 -10.424 843 HG3 PRO 764 HG3 PRO 764 3.597 2.835 -10.680 844 HD2 PRO 764 HD2 PRO 764 3.446 5.583 -10.283 845 HD3 PRO 764 HD3 PRO 764 2.106 4.441 -10.034 846 H PHE 765 H PHE 765 6.407 2.928 -6.962 847 HA PHE 765 HA PHE 765 7.745 5.565 -6.899 848 HB2 PHE 765 HB2 PHE 765 8.889 5.019 -4.937 849 HB3 PHE 765 HB3 PHE 765 7.282 4.357 -4.651 850 HD1 PHE 765 HD1 PHE 765 6.867 1.894 -5.070 851 HD2 PHE 765 HD2 PHE 765 10.800 3.614 -5.043 852 HE1 PHE 765 HE1 PHE 765 7.852 -0.362 -4.772 853 HE2 PHE 765 HE2 PHE 765 11.785 1.365 -4.745 854 HZ PHE 765 HZ PHE 765 10.312 -0.626 -4.607 855 H LYS 766 H LYS 766 7.694 2.484 -8.287 856 HA LYS 766 HA LYS 766 10.560 2.498 -8.916 857 HB2 LYS 766 HB2 LYS 766 8.381 0.539 -9.649 858 HB3 LYS 766 HB3 LYS 766 10.091 0.345 -10.019 859 HG2 LYS 766 HG2 LYS 766 10.257 0.844 -7.365 860 HG3 LYS 766 HG3 LYS 766 8.678 0.068 -7.417 861 HD2 LYS 766 HD2 LYS 766 10.865 -1.217 -8.969 862 HD3 LYS 766 HD3 LYS 766 10.953 -1.328 -7.214 863 HE2 LYS 766 HE2 LYS 766 9.506 -3.056 -7.338 864 HE3 LYS 766 HE3 LYS 766 8.272 -1.888 -7.812 865 HZ1 LYS 766 HZ1 LYS 766 9.798 -3.754 -9.460 866 HZ2 LYS 766 HZ2 LYS 766 8.184 -3.210 -9.643 867 HZ3 LYS 766 HZ3 LYS 766 9.489 -2.227 -10.135 868 H GLU 767 H GLU 767 7.412 2.840 -10.458 869 HA GLU 767 HA GLU 767 6.889 3.189 -12.716 870 HB2 GLU 767 HB2 GLU 767 7.717 5.444 -11.181 871 HB3 GLU 767 HB3 GLU 767 8.189 5.721 -12.857 872 HG2 GLU 767 HG2 GLU 767 5.763 4.824 -13.373 873 HG3 GLU 767 HG3 GLU 767 5.450 5.288 -11.706 874 H1 ASP 338 H1 ASP 338 8.418 9.344 15.159 875 H2 ASP 338 H2 ASP 338 9.394 10.464 16.073 876 H3 ASP 338 H3 ASP 338 7.730 10.528 15.717 877 HA ASP 338 HA ASP 338 9.111 9.285 17.928 878 HB2 ASP 338 HB2 ASP 338 6.173 9.559 17.924 879 HB3 ASP 338 HB3 ASP 338 7.361 10.196 19.059 880 H THR 339 H THR 339 5.864 8.372 16.804 881 HA THR 339 HA THR 339 6.417 5.595 17.349 882 HB THR 339 HB THR 339 4.077 5.284 16.383 883 HG1 THR 339 HG1 THR 339 2.960 7.032 15.790 884 HG21 THR 339 HG21 THR 339 4.897 6.778 18.791 885 HG22 THR 339 HG22 THR 339 3.212 7.005 18.329 886 HG23 THR 339 HG23 THR 339 3.828 5.383 18.639 887 H GLU 340 H GLU 340 8.320 5.853 15.767 888 HA GLU 340 HA GLU 340 7.946 5.943 12.990 889 HB2 GLU 340 HB2 GLU 340 10.079 4.456 14.540 890 HB3 GLU 340 HB3 GLU 340 10.157 4.874 12.831 891 HG2 GLU 340 HG2 GLU 340 10.295 6.691 15.228 892 HG3 GLU 340 HG3 GLU 340 11.377 6.605 13.841 893 H VAL 341 H VAL 341 5.810 4.433 13.622 894 HA VAL 341 HA VAL 341 6.296 2.037 12.079 895 HB VAL 341 HB VAL 341 6.966 1.446 14.483 896 HG11 VAL 341 HG11 VAL 341 3.978 1.311 14.904 897 HG12 VAL 341 HG12 VAL 341 5.260 1.147 16.101 898 HG13 VAL 341 HG13 VAL 341 4.916 2.723 15.390 899 HG21 VAL 341 HG21 VAL 341 6.323 -0.184 12.647 900 HG22 VAL 341 HG22 VAL 341 6.007 -0.762 14.283 901 HG23 VAL 341 HG23 VAL 341 4.681 -0.157 13.294 902 H PTR 342 H PTR 342 4.430 1.178 11.207 903 HA PTR 342 HA PTR 342 2.179 2.898 11.009 904 HB2 PTR 342 HB2 PTR 342 1.235 0.472 10.129 905 HB3 PTR 342 HB3 PTR 342 2.151 1.607 9.140 906 HD1 PTR 342 HD1 PTR 342 2.746 -1.077 11.695 907 HD2 PTR 342 HD2 PTR 342 4.077 0.832 8.083 908 HE1 PTR 342 HE1 PTR 342 4.609 -2.702 11.519 909 HE2 PTR 342 HE2 PTR 342 5.929 -0.799 7.909 910 H GLU 343 H GLU 343 2.017 3.051 13.477 911 HA GLU 343 HA GLU 343 0.966 0.953 15.036 912 HB2 GLU 343 HB2 GLU 343 0.166 2.781 16.551 913 HB3 GLU 343 HB3 GLU 343 1.866 2.913 16.109 914 HG2 GLU 343 HG2 GLU 343 1.036 4.460 14.193 915 HG3 GLU 343 HG3 GLU 343 -0.463 4.555 15.113 916 H SER 344 H SER 344 -0.382 0.398 12.915 917 HA SER 344 HA SER 344 -2.437 0.244 11.857 918 HB2 SER 344 HB2 SER 344 -2.584 -0.505 14.611 919 HB3 SER 344 HB3 SER 344 -4.123 0.208 14.143 920 HG SER 344 HG SER 344 -4.495 -1.571 13.102 921 HA PRO 345 HA PRO 345 -3.235 4.893 12.517 922 HB2 PRO 345 HB2 PRO 345 -3.441 4.543 9.558 923 HB3 PRO 345 HB3 PRO 345 -2.689 5.850 10.489 924 HG2 PRO 345 HG2 PRO 345 -1.280 3.908 9.247 925 HG3 PRO 345 HG3 PRO 345 -0.721 4.741 10.705 926 HD2 PRO 345 HD2 PRO 345 -1.644 1.955 10.404 927 HD3 PRO 345 HD3 PRO 345 -0.702 2.692 11.716 928 H PTR 346 H PTR 346 -4.721 2.719 10.094 929 HA PTR 346 HA PTR 346 -7.382 3.386 11.180 930 HB2 PTR 346 HB2 PTR 346 -7.177 3.134 8.233 931 HB3 PTR 346 HB3 PTR 346 -8.207 4.179 9.210 932 HD1 PTR 346 HD1 PTR 346 -5.419 4.154 7.054 933 HD2 PTR 346 HD2 PTR 346 -6.857 5.958 10.677 934 HE1 PTR 346 HE1 PTR 346 -3.835 6.045 6.749 935 HE2 PTR 346 HE2 PTR 346 -5.281 7.838 10.368 936 H ALA 347 H ALA 347 -8.913 1.820 11.030 937 HA ALA 347 HA ALA 347 -9.055 -0.410 9.433 938 HB1 ALA 347 HB1 ALA 347 -7.070 -1.409 10.099 939 HB2 ALA 347 HB2 ALA 347 -8.195 -2.122 11.255 940 HB3 ALA 347 HB3 ALA 347 -7.172 -0.766 11.738 941 H ASP 348 H ASP 348 -8.975 -0.827 12.915 942 HA ASP 348 HA ASP 348 -11.692 -0.116 13.414 943 HB2 ASP 348 HB2 ASP 348 -11.283 -2.677 12.276 944 HB3 ASP 348 HB3 ASP 348 -11.607 -2.947 13.982 945 HA PRO 349 HA PRO 349 -10.246 -0.156 17.563 946 HB2 PRO 349 HB2 PRO 349 -12.665 -1.431 18.616 947 HB3 PRO 349 HB3 PRO 349 -12.111 0.241 18.799 948 HG2 PRO 349 HG2 PRO 349 -14.258 -0.463 17.310 949 HG3 PRO 349 HG3 PRO 349 -13.257 0.960 16.974 950 HD2 PRO 349 HD2 PRO 349 -13.291 -1.692 15.588 951 HD3 PRO 349 HD3 PRO 349 -13.028 -0.065 14.919 952 H GLU 350 H GLU 350 -8.859 -1.441 18.645 953 HA GLU 350 HA GLU 350 -8.751 -4.267 18.181 954 HB2 GLU 350 HB2 GLU 350 -7.287 -2.850 20.400 955 HB3 GLU 350 HB3 GLU 350 -6.758 -4.220 19.424 956 HG2 GLU 350 HG2 GLU 350 -5.577 -2.588 18.323 957 HG3 GLU 350 HG3 GLU 350 -7.101 -2.392 17.463 Start of MODEL 12 1 H1 GLY 661 H1 GLY 661 2.366 -14.507 -10.821 2 H2 GLY 661 H2 GLY 661 1.692 -15.673 -11.876 3 H3 GLY 661 H3 GLY 661 0.690 -14.515 -11.134 4 HA2 GLY 661 HA2 GLY 661 2.829 -13.324 -12.637 5 HA3 GLY 661 HA3 GLY 661 1.749 -14.305 -13.628 6 H HIS 662 H HIS 662 2.188 -11.268 -12.278 7 HA HIS 662 HA HIS 662 0.898 -9.371 -12.189 8 HB2 HIS 662 HB2 HIS 662 0.286 -10.317 -14.523 9 HB3 HIS 662 HB3 HIS 662 -1.228 -10.803 -13.764 10 HD1 HIS 662 HD1 HIS 662 -1.911 -8.529 -11.986 11 HD2 HIS 662 HD2 HIS 662 -0.301 -7.920 -15.787 12 HE1 HIS 662 HE1 HIS 662 -2.614 -6.187 -12.705 13 HE2 HIS 662 HE2 HIS 662 -1.641 -5.808 -15.023 14 H MET 663 H MET 663 0.290 -11.972 -10.477 15 HA MET 663 HA MET 663 -2.282 -10.991 -9.370 16 HB2 MET 663 HB2 MET 663 -0.980 -13.723 -9.277 17 HB3 MET 663 HB3 MET 663 -2.405 -13.287 -8.334 18 HG2 MET 663 HG2 MET 663 -3.167 -12.438 -10.805 19 HG3 MET 663 HG3 MET 663 -2.148 -13.808 -11.236 20 HE1 MET 663 HE1 MET 663 -6.330 -13.732 -9.854 21 HE2 MET 663 HE2 MET 663 -5.213 -12.406 -10.157 22 HE3 MET 663 HE3 MET 663 -5.658 -13.508 -11.466 23 H GLN 664 H GLN 664 -0.553 -13.193 -7.440 24 HA GLN 664 HA GLN 664 -0.152 -11.189 -5.415 25 HB2 GLN 664 HB2 GLN 664 -0.296 -14.026 -5.484 26 HB3 GLN 664 HB3 GLN 664 1.272 -13.594 -4.798 27 HG2 GLN 664 HG2 GLN 664 -1.452 -12.647 -3.863 28 HG3 GLN 664 HG3 GLN 664 -0.340 -13.689 -2.985 29 HE21 GLN 664 HE21 GLN 664 1.912 -12.576 -2.565 30 HE22 GLN 664 HE22 GLN 664 1.854 -10.936 -2.142 31 H ASP 665 H ASP 665 1.506 -11.987 -8.161 32 HA ASP 665 HA ASP 665 4.216 -11.850 -7.269 33 HB2 ASP 665 HB2 ASP 665 3.546 -10.797 -9.960 34 HB3 ASP 665 HB3 ASP 665 4.749 -11.991 -9.488 35 H LEU 666 H LEU 666 4.893 -10.115 -6.125 36 HA LEU 666 HA LEU 666 3.742 -7.501 -6.716 37 HB2 LEU 666 HB2 LEU 666 5.675 -8.097 -4.500 38 HB3 LEU 666 HB3 LEU 666 4.427 -6.852 -4.574 39 HG LEU 666 HG LEU 666 3.892 -9.833 -4.493 40 HD11 LEU 666 HD11 LEU 666 3.985 -7.715 -2.367 41 HD12 LEU 666 HD12 LEU 666 2.922 -9.111 -2.193 42 HD13 LEU 666 HD13 LEU 666 4.663 -9.341 -2.343 43 HD21 LEU 666 HD21 LEU 666 1.548 -8.990 -3.974 44 HD22 LEU 666 HD22 LEU 666 2.110 -7.383 -4.449 45 HD23 LEU 666 HD23 LEU 666 2.098 -8.699 -5.623 46 H SER 667 H SER 667 6.829 -9.163 -6.783 47 HA SER 667 HA SER 667 8.458 -6.900 -7.194 48 HB2 SER 667 HB2 SER 667 8.783 -9.816 -7.822 49 HB3 SER 667 HB3 SER 667 10.002 -8.640 -8.311 50 HG SER 667 HG SER 667 10.550 -9.337 -6.268 51 H VAL 668 H VAL 668 6.008 -7.923 -9.120 52 HA VAL 668 HA VAL 668 7.366 -7.226 -11.638 53 HB VAL 668 HB VAL 668 5.488 -8.180 -12.771 54 HG11 VAL 668 HG11 VAL 668 5.487 -10.210 -10.666 55 HG12 VAL 668 HG12 VAL 668 6.108 -10.308 -12.312 56 HG13 VAL 668 HG13 VAL 668 7.109 -9.628 -11.030 57 HG21 VAL 668 HG21 VAL 668 3.642 -7.326 -11.493 58 HG22 VAL 668 HG22 VAL 668 3.547 -9.084 -11.377 59 HG23 VAL 668 HG23 VAL 668 4.194 -8.145 -10.033 60 H HIS 669 H HIS 669 5.836 -5.748 -9.176 61 HA HIS 669 HA HIS 669 4.404 -3.769 -10.823 62 HB2 HIS 669 HB2 HIS 669 4.519 -4.046 -7.812 63 HB3 HIS 669 HB3 HIS 669 3.454 -2.985 -8.728 64 HD1 HIS 669 HD1 HIS 669 2.448 -4.893 -10.893 65 HD2 HIS 669 HD2 HIS 669 2.772 -5.951 -6.886 66 HE1 HIS 669 HE1 HIS 669 0.799 -6.784 -10.517 67 HE2 HIS 669 HE2 HIS 669 0.905 -7.383 -8.035 68 H LEU 670 H LEU 670 4.567 -1.521 -9.506 69 HA LEU 670 HA LEU 670 7.436 -0.923 -9.220 70 HB2 LEU 670 HB2 LEU 670 6.670 1.458 -9.987 71 HB3 LEU 670 HB3 LEU 670 7.025 0.233 -11.179 72 HG LEU 670 HG LEU 670 4.283 0.978 -10.154 73 HD11 LEU 670 HD11 LEU 670 5.401 1.298 -12.937 74 HD12 LEU 670 HD12 LEU 670 3.964 2.051 -12.247 75 HD13 LEU 670 HD13 LEU 670 5.566 2.551 -11.710 76 HD21 LEU 670 HD21 LEU 670 5.247 -1.363 -11.612 77 HD22 LEU 670 HD22 LEU 670 3.648 -1.059 -10.925 78 HD23 LEU 670 HD23 LEU 670 4.047 -0.470 -12.539 79 H TRP 671 H TRP 671 4.536 -1.134 -7.675 80 HA TRP 671 HA TRP 671 5.222 1.085 -5.900 81 HB2 TRP 671 HB2 TRP 671 2.926 0.553 -4.859 82 HB3 TRP 671 HB3 TRP 671 2.962 1.354 -6.421 83 HD1 TRP 671 HD1 TRP 671 1.628 0.267 -8.290 84 HE1 TRP 671 HE1 TRP 671 0.393 -1.987 -8.614 85 HE3 TRP 671 HE3 TRP 671 3.215 -2.191 -4.096 86 HZ2 TRP 671 HZ2 TRP 671 0.173 -4.501 -7.275 87 HZ3 TRP 671 HZ3 TRP 671 2.472 -4.515 -3.649 88 HH2 TRP 671 HH2 TRP 671 0.950 -5.668 -5.231 89 H TYR 672 H TYR 672 5.672 -2.161 -6.285 90 HA TYR 672 HA TYR 672 5.511 -2.899 -3.472 91 HB2 TYR 672 HB2 TYR 672 4.877 -4.543 -5.186 92 HB3 TYR 672 HB3 TYR 672 6.498 -4.450 -5.879 93 HD1 TYR 672 HD2 TYR 672 5.138 -4.680 -2.382 94 HD2 TYR 672 HD1 TYR 672 7.775 -6.319 -5.353 95 HE1 TYR 672 HE2 TYR 672 5.942 -6.363 -0.749 96 HE2 TYR 672 HE1 TYR 672 8.570 -8.003 -3.718 97 HH TYR 672 HH TYR 672 7.722 -9.083 -1.645 98 H ALA 673 H ALA 673 7.095 -2.400 -2.114 99 HA ALA 673 HA ALA 673 9.824 -2.038 -3.192 100 HB1 ALA 673 HB1 ALA 673 8.670 -1.133 -0.542 101 HB2 ALA 673 HB2 ALA 673 8.826 -0.117 -1.977 102 HB3 ALA 673 HB3 ALA 673 10.269 -0.738 -1.176 103 H GLY 674 H GLY 674 7.867 -4.049 -1.217 104 HA2 GLY 674 HA2 GLY 674 8.310 -5.867 0.129 105 HA3 GLY 674 HA3 GLY 674 9.635 -6.155 -0.989 106 HA PRO 675 HA PRO 675 12.181 -5.744 2.626 107 HB2 PRO 675 HB2 PRO 675 14.605 -5.556 1.303 108 HB3 PRO 675 HB3 PRO 675 13.756 -7.076 1.635 109 HG2 PRO 675 HG2 PRO 675 13.851 -5.467 -0.866 110 HG3 PRO 675 HG3 PRO 675 13.871 -7.227 -0.651 111 HD2 PRO 675 HD2 PRO 675 11.631 -5.889 -1.420 112 HD3 PRO 675 HD3 PRO 675 11.562 -7.362 -0.424 113 H MET 676 H MET 676 10.973 -3.471 2.526 114 HA MET 676 HA MET 676 13.097 -1.395 2.374 115 HB2 MET 676 HB2 MET 676 11.245 -1.247 0.609 116 HB3 MET 676 HB3 MET 676 10.160 -0.838 1.936 117 HG2 MET 676 HG2 MET 676 10.965 1.274 2.070 118 HG3 MET 676 HG3 MET 676 12.641 0.723 2.019 119 HE1 MET 676 HE1 MET 676 13.881 1.082 -1.353 120 HE2 MET 676 HE2 MET 676 14.111 0.897 0.383 121 HE3 MET 676 HE3 MET 676 13.503 -0.453 -0.583 122 H GLU 677 H GLU 677 12.220 0.644 3.701 123 HA GLU 677 HA GLU 677 11.125 -0.298 6.275 124 HB2 GLU 677 HB2 GLU 677 12.742 1.285 7.365 125 HB3 GLU 677 HB3 GLU 677 13.506 -0.086 6.550 126 HG2 GLU 677 HG2 GLU 677 14.528 1.239 5.025 127 HG3 GLU 677 HG3 GLU 677 13.088 2.223 4.794 128 H ARG 678 H ARG 678 10.418 1.578 7.669 129 HA ARG 678 HA ARG 678 8.429 3.074 6.424 130 HB2 ARG 678 HB2 ARG 678 8.828 2.556 8.956 131 HB3 ARG 678 HB3 ARG 678 9.758 4.052 8.945 132 HG2 ARG 678 HG2 ARG 678 7.690 5.132 7.846 133 HG3 ARG 678 HG3 ARG 678 6.824 3.674 8.323 134 HD2 ARG 678 HD2 ARG 678 6.813 4.242 10.527 135 HD3 ARG 678 HD3 ARG 678 8.457 4.866 10.482 136 HE ARG 678 HE ARG 678 6.122 6.428 10.401 137 HH11 ARG 678 HH21 ARG 678 9.132 6.060 8.787 138 HH12 ARG 678 HH22 ARG 678 9.180 7.698 8.184 139 HH21 ARG 678 HH11 ARG 678 6.203 8.561 9.704 140 HH22 ARG 678 HH12 ARG 678 7.538 9.102 8.745 141 H ALA 679 H ALA 679 11.539 4.305 7.653 142 HA ALA 679 HA ALA 679 11.271 6.881 6.519 143 HB1 ALA 679 HB1 ALA 679 13.010 5.645 8.265 144 HB2 ALA 679 HB2 ALA 679 13.203 7.276 7.617 145 HB3 ALA 679 HB3 ALA 679 14.014 5.914 6.841 146 H GLY 680 H GLY 680 12.520 3.851 5.308 147 HA2 GLY 680 HA2 GLY 680 13.855 4.969 3.016 148 HA3 GLY 680 HA3 GLY 680 13.470 3.270 3.262 149 H ALA 681 H ALA 681 10.739 3.345 3.559 150 HA ALA 681 HA ALA 681 9.836 3.374 0.904 151 HB1 ALA 681 HB1 ALA 681 7.536 3.308 1.982 152 HB2 ALA 681 HB2 ALA 681 8.355 3.456 3.537 153 HB3 ALA 681 HB3 ALA 681 8.658 2.053 2.512 154 H GLU 682 H GLU 682 9.291 5.780 3.508 155 HA GLU 682 HA GLU 682 7.876 7.543 1.749 156 HB2 GLU 682 HB2 GLU 682 8.037 9.186 3.596 157 HB3 GLU 682 HB3 GLU 682 7.398 7.631 4.110 158 HG2 GLU 682 HG2 GLU 682 9.845 7.067 4.744 159 HG3 GLU 682 HG3 GLU 682 10.126 8.791 4.628 160 H SER 683 H SER 683 11.160 6.879 2.143 161 HA SER 683 HA SER 683 12.314 9.404 1.700 162 HB2 SER 683 HB2 SER 683 14.302 8.243 1.144 163 HB3 SER 683 HB3 SER 683 13.479 7.192 2.293 164 HG SER 683 HG SER 683 12.850 5.868 0.656 165 H ILE 684 H ILE 684 11.244 6.897 -0.548 166 HA ILE 684 HA ILE 684 11.847 8.478 -2.894 167 HB ILE 684 HB ILE 684 10.035 6.070 -2.848 168 HG12 ILE 684 HG12 ILE 684 12.797 5.372 -3.330 169 HG13 ILE 684 HG13 ILE 684 12.655 6.138 -1.750 170 HG21 ILE 684 HG21 ILE 684 10.404 6.052 -5.083 171 HG22 ILE 684 HG22 ILE 684 11.022 7.689 -4.875 172 HG23 ILE 684 HG23 ILE 684 12.133 6.319 -4.881 173 HD11 ILE 684 HD11 ILE 684 12.243 3.535 -2.025 174 HD12 ILE 684 HD12 ILE 684 11.255 4.486 -0.917 175 HD13 ILE 684 HD13 ILE 684 10.634 4.061 -2.512 176 H LEU 685 H LEU 685 8.906 7.384 -1.243 177 HA LEU 685 HA LEU 685 7.027 8.665 -2.881 178 HB2 LEU 685 HB2 LEU 685 7.069 7.554 -0.118 179 HB3 LEU 685 HB3 LEU 685 5.733 8.618 -0.535 180 HG LEU 685 HG LEU 685 5.111 7.219 -2.404 181 HD11 LEU 685 HD11 LEU 685 7.682 5.766 -1.746 182 HD12 LEU 685 HD12 LEU 685 6.417 5.056 -2.745 183 HD13 LEU 685 HD13 LEU 685 7.231 6.526 -3.271 184 HD21 LEU 685 HD21 LEU 685 4.124 6.378 -0.445 185 HD22 LEU 685 HD22 LEU 685 4.906 4.956 -1.132 186 HD23 LEU 685 HD23 LEU 685 5.666 5.820 0.202 187 H ALA 686 H ALA 686 8.664 9.838 0.083 188 HA ALA 686 HA ALA 686 7.255 12.289 0.212 189 HB1 ALA 686 HB1 ALA 686 8.581 11.438 2.094 190 HB2 ALA 686 HB2 ALA 686 9.087 13.066 1.643 191 HB3 ALA 686 HB3 ALA 686 10.062 11.676 1.165 192 H ASN 687 H ASN 687 10.195 11.286 -1.457 193 HA ASN 687 HA ASN 687 10.869 13.855 -2.496 194 HB2 ASN 687 HB2 ASN 687 12.696 12.528 -2.795 195 HB3 ASN 687 HB3 ASN 687 11.733 11.058 -2.892 196 HD21 ASN 687 HD21 ASN 687 12.831 13.861 -4.820 197 HD22 ASN 687 HD22 ASN 687 12.616 13.102 -6.322 198 H ARG 688 H ARG 688 9.066 11.070 -3.777 199 HA ARG 688 HA ARG 688 8.441 12.171 -6.298 200 HB2 ARG 688 HB2 ARG 688 8.094 9.762 -5.095 201 HB3 ARG 688 HB3 ARG 688 6.446 10.384 -5.066 202 HG2 ARG 688 HG2 ARG 688 6.288 9.690 -7.209 203 HG3 ARG 688 HG3 ARG 688 7.345 11.044 -7.617 204 HD2 ARG 688 HD2 ARG 688 9.314 9.580 -7.165 205 HD3 ARG 688 HD3 ARG 688 8.208 8.239 -6.910 206 HE ARG 688 HE ARG 688 7.941 9.641 -9.466 207 HH11 ARG 688 HH21 ARG 688 9.272 6.951 -7.740 208 HH12 ARG 688 HH22 ARG 688 9.532 6.010 -9.166 209 HH21 ARG 688 HH11 ARG 688 8.278 8.404 -11.293 210 HH22 ARG 688 HH12 ARG 688 8.997 6.817 -11.175 211 H SER 689 H SER 689 6.185 12.655 -7.022 212 HA SER 689 HA SER 689 5.125 14.868 -5.561 213 HB2 SER 689 HB2 SER 689 3.655 13.450 -7.770 214 HB3 SER 689 HB3 SER 689 3.677 15.168 -7.382 215 HG SER 689 HG SER 689 5.071 14.141 -9.210 216 H ASP 690 H ASP 690 2.793 15.024 -4.973 217 HA ASP 690 HA ASP 690 2.088 13.101 -3.055 218 HB2 ASP 690 HB2 ASP 690 0.988 15.567 -4.104 219 HB3 ASP 690 HB3 ASP 690 -0.281 14.388 -3.785 220 H GLY 691 H GLY 691 0.561 11.464 -3.032 221 HA2 GLY 691 HA2 GLY 691 -1.158 10.122 -4.020 222 HA3 GLY 691 HA3 GLY 691 -0.657 10.696 -5.610 223 H THR 692 H THR 692 2.197 10.320 -4.453 224 HA THR 692 HA THR 692 2.704 7.820 -5.693 225 HB THR 692 HB THR 692 4.517 9.270 -3.740 226 HG1 THR 692 HG1 THR 692 4.135 10.785 -5.254 227 HG21 THR 692 HG21 THR 692 5.500 7.863 -6.150 228 HG22 THR 692 HG22 THR 692 6.183 7.933 -4.530 229 HG23 THR 692 HG23 THR 692 4.849 6.835 -4.876 230 H PHE 693 H PHE 693 2.848 5.783 -4.863 231 HA PHE 693 HA PHE 693 2.780 5.457 -1.942 232 HB2 PHE 693 HB2 PHE 693 0.857 4.016 -1.988 233 HB3 PHE 693 HB3 PHE 693 0.421 5.515 -2.806 234 HD1 PHE 693 HD2 PHE 693 1.268 1.951 -3.283 235 HD2 PHE 693 HD1 PHE 693 0.032 5.589 -5.196 236 HE1 PHE 693 HE2 PHE 693 0.686 0.681 -5.329 237 HE2 PHE 693 HE1 PHE 693 -0.550 4.318 -7.243 238 HZ PHE 693 HZ PHE 693 -0.219 1.861 -7.310 239 H LEU 694 H LEU 694 3.182 3.248 -1.254 240 HA LEU 694 HA LEU 694 4.137 1.351 -3.211 241 HB2 LEU 694 HB2 LEU 694 6.431 1.316 -2.661 242 HB3 LEU 694 HB3 LEU 694 6.045 3.023 -2.859 243 HG LEU 694 HG LEU 694 5.554 2.909 -0.274 244 HD11 LEU 694 HD11 LEU 694 6.826 0.322 -0.854 245 HD12 LEU 694 HD12 LEU 694 7.637 1.227 0.422 246 HD13 LEU 694 HD13 LEU 694 5.926 0.833 0.573 247 HD21 LEU 694 HD21 LEU 694 7.367 4.232 -0.304 248 HD22 LEU 694 HD22 LEU 694 8.408 2.814 -0.391 249 HD23 LEU 694 HD23 LEU 694 7.823 3.568 -1.872 250 H VAL 695 H VAL 695 4.834 -0.664 -2.251 251 HA VAL 695 HA VAL 695 3.831 -1.026 0.510 252 HB VAL 695 HB VAL 695 3.519 -3.019 -1.742 253 HG11 VAL 695 HG11 VAL 695 1.974 -4.069 -0.067 254 HG12 VAL 695 HG12 VAL 695 3.659 -4.058 0.448 255 HG13 VAL 695 HG13 VAL 695 2.521 -2.889 1.119 256 HG21 VAL 695 HG21 VAL 695 1.061 -1.956 -0.624 257 HG22 VAL 695 HG22 VAL 695 2.048 -0.653 -1.284 258 HG23 VAL 695 HG23 VAL 695 1.581 -2.008 -2.306 259 H ARG 696 H ARG 696 5.149 -2.127 1.871 260 HA ARG 696 HA ARG 696 7.555 -3.376 0.665 261 HB2 ARG 696 HB2 ARG 696 8.903 -2.502 2.354 262 HB3 ARG 696 HB3 ARG 696 7.814 -1.173 1.971 263 HG2 ARG 696 HG2 ARG 696 6.832 -1.229 4.017 264 HG3 ARG 696 HG3 ARG 696 6.793 -2.990 4.064 265 HD2 ARG 696 HD2 ARG 696 9.361 -2.815 4.359 266 HD3 ARG 696 HD3 ARG 696 9.046 -1.138 4.793 267 HE ARG 696 HE ARG 696 7.323 -2.758 6.315 268 HH11 ARG 696 HH21 ARG 696 10.718 -2.258 5.890 269 HH12 ARG 696 HH22 ARG 696 11.082 -2.526 7.567 270 HH21 ARG 696 HH11 ARG 696 7.822 -3.157 8.470 271 HH22 ARG 696 HH12 ARG 696 9.465 -3.044 9.014 272 H GLN 697 H GLN 697 8.664 -4.897 2.193 273 HA GLN 697 HA GLN 697 6.722 -6.538 3.703 274 HB2 GLN 697 HB2 GLN 697 7.072 -7.652 1.589 275 HB3 GLN 697 HB3 GLN 697 8.817 -7.458 1.724 276 HG2 GLN 697 HG2 GLN 697 7.811 -9.765 2.353 277 HG3 GLN 697 HG3 GLN 697 8.987 -9.056 3.453 278 HE21 GLN 697 HE21 GLN 697 5.439 -9.393 2.972 279 HE22 GLN 697 HE22 GLN 697 5.066 -9.293 4.626 280 H ARG 698 H ARG 698 7.322 -6.634 5.712 281 HA ARG 698 HA ARG 698 9.601 -7.705 6.765 282 HB2 ARG 698 HB2 ARG 698 10.172 -5.049 5.824 283 HB3 ARG 698 HB3 ARG 698 10.248 -5.052 7.583 284 HG2 ARG 698 HG2 ARG 698 11.541 -7.329 6.131 285 HG3 ARG 698 HG3 ARG 698 12.352 -5.767 6.095 286 HD2 ARG 698 HD2 ARG 698 12.955 -7.400 8.017 287 HD3 ARG 698 HD3 ARG 698 12.645 -5.722 8.432 288 HE ARG 698 HE ARG 698 10.797 -7.986 8.908 289 HH11 ARG 698 HH21 ARG 698 11.746 -4.699 9.420 290 HH12 ARG 698 HH22 ARG 698 10.552 -4.412 10.634 291 HH21 ARG 698 HH11 ARG 698 9.275 -7.613 10.517 292 HH22 ARG 698 HH12 ARG 698 9.153 -6.027 11.226 293 H VAL 699 H VAL 699 7.667 -8.410 7.828 294 HA VAL 699 HA VAL 699 6.651 -6.538 9.868 295 HB VAL 699 HB VAL 699 5.110 -7.664 8.133 296 HG11 VAL 699 HG11 VAL 699 4.817 -9.909 8.160 297 HG12 VAL 699 HG12 VAL 699 6.345 -9.964 9.033 298 HG13 VAL 699 HG13 VAL 699 4.820 -9.981 9.919 299 HG21 VAL 699 HG21 VAL 699 3.608 -6.906 9.621 300 HG22 VAL 699 HG22 VAL 699 3.760 -8.413 10.522 301 HG23 VAL 699 HG23 VAL 699 4.786 -7.034 10.923 302 H LYS 700 H LYS 700 5.459 -8.643 11.404 303 HA LYS 700 HA LYS 700 7.774 -10.088 12.516 304 HB2 LYS 700 HB2 LYS 700 5.770 -9.010 14.441 305 HB3 LYS 700 HB3 LYS 700 7.504 -9.256 14.641 306 HG2 LYS 700 HG2 LYS 700 7.980 -7.293 13.256 307 HG3 LYS 700 HG3 LYS 700 6.258 -7.064 12.952 308 HD2 LYS 700 HD2 LYS 700 5.842 -6.630 15.310 309 HD3 LYS 700 HD3 LYS 700 7.517 -7.008 15.710 310 HE2 LYS 700 HE2 LYS 700 7.167 -4.560 15.590 311 HE3 LYS 700 HE3 LYS 700 8.287 -5.111 14.341 312 HZ1 LYS 700 HZ1 LYS 700 6.549 -3.547 13.531 313 HZ2 LYS 700 HZ2 LYS 700 6.575 -5.037 12.717 314 HZ3 LYS 700 HZ3 LYS 700 5.379 -4.736 13.884 315 H ASP 701 H ASP 701 4.249 -9.634 12.837 316 HA ASP 701 HA ASP 701 3.741 -12.419 12.285 317 HB2 ASP 701 HB2 ASP 701 2.491 -12.609 14.569 318 HB3 ASP 701 HB3 ASP 701 4.232 -12.870 14.518 319 H ALA 702 H ALA 702 1.936 -10.141 14.329 320 HA ALA 702 HA ALA 702 -0.529 -10.536 13.004 321 HB1 ALA 702 HB1 ALA 702 -0.300 -9.705 15.317 322 HB2 ALA 702 HB2 ALA 702 -1.320 -8.648 14.340 323 HB3 ALA 702 HB3 ALA 702 0.345 -8.185 14.697 324 H ALA 703 H ALA 703 1.049 -10.106 10.855 325 HA ALA 703 HA ALA 703 -0.285 -8.336 9.248 326 HB1 ALA 703 HB1 ALA 703 1.617 -6.476 9.172 327 HB2 ALA 703 HB2 ALA 703 1.801 -6.938 10.865 328 HB3 ALA 703 HB3 ALA 703 0.248 -6.347 10.277 329 H GLU 704 H GLU 704 0.720 -8.004 7.144 330 HA GLU 704 HA GLU 704 3.031 -9.824 6.752 331 HB2 GLU 704 HB2 GLU 704 0.450 -9.758 5.518 332 HB3 GLU 704 HB3 GLU 704 1.668 -9.411 4.292 333 HG2 GLU 704 HG2 GLU 704 2.663 -11.524 5.950 334 HG3 GLU 704 HG3 GLU 704 1.022 -11.935 5.463 335 H PHE 705 H PHE 705 1.656 -7.548 4.414 336 HA PHE 705 HA PHE 705 4.335 -6.373 4.102 337 HB2 PHE 705 HB2 PHE 705 1.838 -6.126 2.405 338 HB3 PHE 705 HB3 PHE 705 3.385 -5.374 2.036 339 HD1 PHE 705 HD1 PHE 705 1.593 -8.593 2.354 340 HD2 PHE 705 HD2 PHE 705 5.252 -6.663 1.217 341 HE1 PHE 705 HE1 PHE 705 2.353 -10.681 1.263 342 HE2 PHE 705 HE2 PHE 705 6.013 -8.757 0.123 343 HZ PHE 705 HZ PHE 705 4.561 -10.765 0.147 344 H ALA 706 H ALA 706 4.219 -3.946 3.438 345 HA ALA 706 HA ALA 706 2.335 -2.511 5.207 346 HB1 ALA 706 HB1 ALA 706 5.082 -1.399 4.909 347 HB2 ALA 706 HB2 ALA 706 4.879 -2.774 5.995 348 HB3 ALA 706 HB3 ALA 706 3.964 -1.287 6.267 349 H ILE 707 H ILE 707 1.280 -0.938 4.210 350 HA ILE 707 HA ILE 707 2.169 -0.161 1.504 351 HB ILE 707 HB ILE 707 -0.479 0.490 2.809 352 HG12 ILE 707 HG12 ILE 707 -1.159 -1.533 1.236 353 HG13 ILE 707 HG13 ILE 707 0.509 -2.031 1.515 354 HG21 ILE 707 HG21 ILE 707 0.261 0.150 -0.110 355 HG22 ILE 707 HG22 ILE 707 -1.225 0.828 0.548 356 HG23 ILE 707 HG23 ILE 707 0.293 1.708 0.715 357 HD11 ILE 707 HD11 ILE 707 -1.751 -2.252 3.281 358 HD12 ILE 707 HD12 ILE 707 -0.117 -2.873 3.505 359 HD13 ILE 707 HD13 ILE 707 -0.525 -1.241 4.032 360 H SER 708 H SER 708 2.947 1.790 1.079 361 HA SER 708 HA SER 708 2.615 3.905 3.123 362 HB2 SER 708 HB2 SER 708 5.039 3.280 1.439 363 HB3 SER 708 HB3 SER 708 4.870 4.728 2.424 364 HG SER 708 HG SER 708 4.885 2.006 3.269 365 H ILE 709 H ILE 709 1.530 5.657 2.376 366 HA ILE 709 HA ILE 709 1.533 6.147 -0.557 367 HB ILE 709 HB ILE 709 -0.696 7.232 1.075 368 HG12 ILE 709 HG12 ILE 709 -1.811 4.863 0.527 369 HG13 ILE 709 HG13 ILE 709 -0.153 4.312 0.783 370 HG21 ILE 709 HG21 ILE 709 -1.789 7.242 -0.925 371 HG22 ILE 709 HG22 ILE 709 -0.155 7.130 -1.581 372 HG23 ILE 709 HG23 ILE 709 -1.139 5.675 -1.407 373 HD11 ILE 709 HD11 ILE 709 -1.220 4.244 2.932 374 HD12 ILE 709 HD12 ILE 709 -0.177 5.661 2.941 375 HD13 ILE 709 HD13 ILE 709 -1.909 5.855 2.707 376 H LYS 710 H LYS 710 1.941 8.151 -1.289 377 HA LYS 710 HA LYS 710 2.770 10.190 0.658 378 HB2 LYS 710 HB2 LYS 710 4.366 9.817 -1.096 379 HB3 LYS 710 HB3 LYS 710 3.117 9.907 -2.331 380 HG2 LYS 710 HG2 LYS 710 4.164 12.019 -2.426 381 HG3 LYS 710 HG3 LYS 710 2.701 12.305 -1.491 382 HD2 LYS 710 HD2 LYS 710 3.851 12.528 0.512 383 HD3 LYS 710 HD3 LYS 710 5.237 11.582 -0.044 384 HE2 LYS 710 HE2 LYS 710 4.486 14.274 -1.210 385 HE3 LYS 710 HE3 LYS 710 5.647 14.080 0.107 386 HZ1 LYS 710 HZ1 LYS 710 5.992 13.562 -2.716 387 HZ2 LYS 710 HZ2 LYS 710 7.174 13.738 -1.491 388 HZ3 LYS 710 HZ3 LYS 710 6.432 12.217 -1.758 389 H TYR 711 H TYR 711 1.006 11.263 1.392 390 HA TYR 711 HA TYR 711 -0.622 12.708 -0.580 391 HB2 TYR 711 HB2 TYR 711 -1.903 10.677 -0.188 392 HB3 TYR 711 HB3 TYR 711 -1.765 10.888 1.554 393 HD1 TYR 711 HD1 TYR 711 -2.774 12.994 -1.404 394 HD2 TYR 711 HD2 TYR 711 -3.648 11.718 2.602 395 HE1 TYR 711 HE1 TYR 711 -4.832 14.384 -1.404 396 HE2 TYR 711 HE2 TYR 711 -5.705 13.098 2.601 397 HH TYR 711 HH TYR 711 -7.285 14.028 0.378 398 H ASN 712 H ASN 712 -0.233 14.727 -0.016 399 HA ASN 712 HA ASN 712 -0.585 16.651 1.284 400 HB2 ASN 712 HB2 ASN 712 -2.080 15.270 2.808 401 HB3 ASN 712 HB3 ASN 712 -0.635 14.884 3.734 402 HD21 ASN 712 HD21 ASN 712 -0.199 16.269 5.420 403 HD22 ASN 712 HD22 ASN 712 -0.761 17.879 5.517 404 H VAL 713 H VAL 713 1.778 15.959 0.295 405 HA VAL 713 HA VAL 713 4.069 15.982 0.558 406 HB VAL 713 HB VAL 713 4.912 17.882 1.800 407 HG11 VAL 713 HG11 VAL 713 4.079 19.093 0.094 408 HG12 VAL 713 HG12 VAL 713 2.710 17.994 -0.061 409 HG13 VAL 713 HG13 VAL 713 2.619 19.363 1.044 410 HG21 VAL 713 HG21 VAL 713 3.616 19.127 3.376 411 HG22 VAL 713 HG22 VAL 713 2.137 18.267 2.951 412 HG23 VAL 713 HG23 VAL 713 3.417 17.438 3.836 413 H GLU 714 H GLU 714 2.780 13.935 2.000 414 HA GLU 714 HA GLU 714 4.858 13.295 3.919 415 HB2 GLU 714 HB2 GLU 714 3.336 12.850 5.766 416 HB3 GLU 714 HB3 GLU 714 3.143 14.529 5.254 417 HG2 GLU 714 HG2 GLU 714 1.236 13.698 3.762 418 HG3 GLU 714 HG3 GLU 714 1.326 12.186 4.658 419 H VAL 715 H VAL 715 4.750 11.009 4.550 420 HA VAL 715 HA VAL 715 3.257 9.409 2.563 421 HB VAL 715 HB VAL 715 5.866 8.676 3.883 422 HG11 VAL 715 HG11 VAL 715 4.479 7.558 1.427 423 HG12 VAL 715 HG12 VAL 715 5.936 6.930 2.197 424 HG13 VAL 715 HG13 VAL 715 4.386 6.825 3.029 425 HG21 VAL 715 HG21 VAL 715 6.827 9.218 1.618 426 HG22 VAL 715 HG22 VAL 715 5.271 9.915 1.178 427 HG23 VAL 715 HG23 VAL 715 6.221 10.631 2.477 428 H LYS 716 H LYS 716 1.615 8.349 3.440 429 HA LYS 716 HA LYS 716 1.614 7.665 6.293 430 HB2 LYS 716 HB2 LYS 716 -0.596 6.848 4.446 431 HB3 LYS 716 HB3 LYS 716 -0.695 7.446 6.095 432 HG2 LYS 716 HG2 LYS 716 0.427 9.585 4.711 433 HG3 LYS 716 HG3 LYS 716 -0.759 8.939 3.575 434 HD2 LYS 716 HD2 LYS 716 -2.532 9.152 5.177 435 HD3 LYS 716 HD3 LYS 716 -1.394 9.506 6.479 436 HE2 LYS 716 HE2 LYS 716 -0.787 11.437 4.580 437 HE3 LYS 716 HE3 LYS 716 -2.544 11.308 4.476 438 HZ1 LYS 716 HZ1 LYS 716 -0.938 12.474 6.535 439 HZ2 LYS 716 HZ2 LYS 716 -2.641 12.522 6.311 440 HZ3 LYS 716 HZ3 LYS 716 -1.955 11.235 7.165 441 H HIS 717 H HIS 717 2.104 5.692 7.085 442 HA HIS 717 HA HIS 717 2.476 3.453 5.179 443 HB2 HIS 717 HB2 HIS 717 3.748 3.731 7.899 444 HB3 HIS 717 HB3 HIS 717 4.188 2.621 6.605 445 HD1 HIS 717 HD1 HIS 717 5.220 3.744 4.384 446 HD2 HIS 717 HD2 HIS 717 4.982 6.223 7.754 447 HE1 HIS 717 HE1 HIS 717 6.802 5.696 3.982 448 HE2 HIS 717 HE2 HIS 717 6.692 7.216 6.032 449 H ILE 718 H ILE 718 1.309 1.665 5.395 450 HA ILE 718 HA ILE 718 0.018 1.096 8.001 451 HB ILE 718 HB ILE 718 -1.379 0.758 5.344 452 HG12 ILE 718 HG12 ILE 718 -2.312 2.797 7.295 453 HG13 ILE 718 HG13 ILE 718 -0.842 3.200 6.409 454 HG21 ILE 718 HG21 ILE 718 -2.306 -0.729 6.937 455 HG22 ILE 718 HG22 ILE 718 -2.148 0.444 8.245 456 HG23 ILE 718 HG23 ILE 718 -3.363 0.683 6.992 457 HD11 ILE 718 HD11 ILE 718 -2.578 3.999 5.024 458 HD12 ILE 718 HD12 ILE 718 -2.133 2.450 4.304 459 HD13 ILE 718 HD13 ILE 718 -3.576 2.574 5.312 460 H LYS 719 H LYS 719 -0.344 -1.089 8.458 461 HA LYS 719 HA LYS 719 1.394 -2.940 7.011 462 HB2 LYS 719 HB2 LYS 719 1.249 -4.337 8.921 463 HB3 LYS 719 HB3 LYS 719 1.331 -2.693 9.554 464 HG2 LYS 719 HG2 LYS 719 -1.293 -2.805 9.443 465 HG3 LYS 719 HG3 LYS 719 -1.034 -4.550 9.419 466 HD2 LYS 719 HD2 LYS 719 0.526 -4.107 11.467 467 HD3 LYS 719 HD3 LYS 719 -0.326 -2.568 11.578 468 HE2 LYS 719 HE2 LYS 719 -2.451 -4.210 11.314 469 HE3 LYS 719 HE3 LYS 719 -1.324 -5.329 12.086 470 HZ1 LYS 719 HZ1 LYS 719 -2.520 -4.184 13.779 471 HZ2 LYS 719 HZ2 LYS 719 -0.935 -3.578 13.791 472 HZ3 LYS 719 HZ3 LYS 719 -2.192 -2.648 13.097 473 H ILE 720 H ILE 720 0.737 -4.815 5.989 474 HA ILE 720 HA ILE 720 -2.150 -4.948 5.378 475 HB ILE 720 HB ILE 720 0.226 -5.336 3.808 476 HG12 ILE 720 HG12 ILE 720 -2.624 -5.721 2.910 477 HG13 ILE 720 HG13 ILE 720 -2.039 -4.132 3.403 478 HG21 ILE 720 HG21 ILE 720 -0.344 -7.425 2.669 479 HG22 ILE 720 HG22 ILE 720 -0.092 -7.764 4.380 480 HG23 ILE 720 HG23 ILE 720 -1.729 -7.665 3.729 481 HD11 ILE 720 HD11 ILE 720 -1.551 -5.565 0.923 482 HD12 ILE 720 HD12 ILE 720 -1.220 -3.878 1.319 483 HD13 ILE 720 HD13 ILE 720 -0.035 -5.123 1.713 484 H MET 721 H MET 721 -3.352 -6.786 5.653 485 HA MET 721 HA MET 721 -2.197 -8.837 7.448 486 HB2 MET 721 HB2 MET 721 -4.328 -7.314 7.943 487 HB3 MET 721 HB3 MET 721 -5.134 -8.559 6.998 488 HG2 MET 721 HG2 MET 721 -5.074 -8.966 9.511 489 HG3 MET 721 HG3 MET 721 -4.438 -10.283 8.527 490 HE1 MET 721 HE1 MET 721 -4.376 -8.744 11.366 491 HE2 MET 721 HE2 MET 721 -2.798 -9.007 12.097 492 HE3 MET 721 HE3 MET 721 -3.180 -7.457 11.340 493 H THR 722 H THR 722 -3.433 -11.034 7.170 494 HA THR 722 HA THR 722 -3.820 -11.584 4.287 495 HB THR 722 HB THR 722 -1.679 -12.476 4.620 496 HG1 THR 722 HG1 THR 722 -3.656 -14.436 5.165 497 HG21 THR 722 HG21 THR 722 -1.272 -13.992 6.675 498 HG22 THR 722 HG22 THR 722 -1.317 -12.250 6.943 499 HG23 THR 722 HG23 THR 722 -2.719 -13.242 7.346 500 H ALA 723 H ALA 723 -5.991 -11.097 5.733 501 HA ALA 723 HA ALA 723 -7.172 -13.110 7.249 502 HB1 ALA 723 HB1 ALA 723 -9.329 -12.159 6.558 503 HB2 ALA 723 HB2 ALA 723 -8.532 -11.282 5.252 504 HB3 ALA 723 HB3 ALA 723 -8.173 -10.882 6.931 505 H GLU 724 H GLU 724 -7.408 -15.198 6.773 506 HA GLU 724 HA GLU 724 -7.614 -17.142 5.545 507 HB2 GLU 724 HB2 GLU 724 -9.645 -15.652 3.895 508 HB3 GLU 724 HB3 GLU 724 -9.677 -17.331 4.436 509 HG2 GLU 724 HG2 GLU 724 -10.153 -14.834 6.070 510 HG3 GLU 724 HG3 GLU 724 -11.228 -16.212 5.848 511 H GLY 725 H GLY 725 -5.758 -14.992 4.529 512 HA2 GLY 725 HA2 GLY 725 -4.135 -15.363 2.807 513 HA3 GLY 725 HA3 GLY 725 -5.380 -16.138 1.836 514 H LEU 726 H LEU 726 -6.999 -13.585 2.991 515 HA LEU 726 HA LEU 726 -6.545 -12.039 0.551 516 HB2 LEU 726 HB2 LEU 726 -8.496 -11.442 2.783 517 HB3 LEU 726 HB3 LEU 726 -8.543 -10.842 1.126 518 HG LEU 726 HG LEU 726 -8.744 -13.783 1.836 519 HD11 LEU 726 HD11 LEU 726 -11.212 -13.277 1.090 520 HD12 LEU 726 HD12 LEU 726 -10.722 -12.956 2.753 521 HD13 LEU 726 HD13 LEU 726 -10.826 -11.632 1.594 522 HD21 LEU 726 HD21 LEU 726 -9.718 -12.426 -0.671 523 HD22 LEU 726 HD22 LEU 726 -8.016 -12.862 -0.512 524 HD23 LEU 726 HD23 LEU 726 -9.256 -14.111 -0.432 525 H TYR 727 H TYR 727 -5.644 -10.031 0.432 526 HA TYR 727 HA TYR 727 -4.228 -9.096 2.810 527 HB2 TYR 727 HB2 TYR 727 -4.037 -8.425 -0.116 528 HB3 TYR 727 HB3 TYR 727 -3.212 -7.476 1.115 529 HD1 TYR 727 HD2 TYR 727 -3.444 -10.812 2.300 530 HD2 TYR 727 HD1 TYR 727 -1.281 -8.357 -0.476 531 HE1 TYR 727 HE2 TYR 727 -1.569 -12.436 2.310 532 HE2 TYR 727 HE1 TYR 727 0.587 -9.970 -0.463 533 HH TYR 727 HH TYR 727 1.042 -12.243 1.848 534 H ARG 728 H ARG 728 -4.486 -7.115 3.730 535 HA ARG 728 HA ARG 728 -6.475 -5.252 2.672 536 HB2 ARG 728 HB2 ARG 728 -7.363 -5.268 5.205 537 HB3 ARG 728 HB3 ARG 728 -8.072 -6.280 3.954 538 HG2 ARG 728 HG2 ARG 728 -6.556 -8.136 4.617 539 HG3 ARG 728 HG3 ARG 728 -5.899 -7.115 5.894 540 HD2 ARG 728 HD2 ARG 728 -8.770 -7.110 6.060 541 HD3 ARG 728 HD3 ARG 728 -8.193 -8.776 6.011 542 HE ARG 728 HE ARG 728 -6.704 -7.127 7.864 543 HH11 ARG 728 HH21 ARG 728 -9.559 -9.004 7.403 544 HH12 ARG 728 HH22 ARG 728 -9.770 -9.332 9.084 545 HH21 ARG 728 HH11 ARG 728 -6.982 -7.506 10.051 546 HH22 ARG 728 HH12 ARG 728 -8.318 -8.506 10.574 547 H ILE 729 H ILE 729 -6.098 -3.187 3.250 548 HA ILE 729 HA ILE 729 -3.632 -2.614 4.719 549 HB ILE 729 HB ILE 729 -5.480 -0.608 3.448 550 HG12 ILE 729 HG12 ILE 729 -3.369 -2.316 2.106 551 HG13 ILE 729 HG13 ILE 729 -5.097 -2.307 1.757 552 HG21 ILE 729 HG21 ILE 729 -3.837 0.593 4.524 553 HG22 ILE 729 HG22 ILE 729 -2.650 -0.706 4.393 554 HG23 ILE 729 HG23 ILE 729 -3.012 0.302 2.993 555 HD11 ILE 729 HD11 ILE 729 -3.026 -0.244 1.116 556 HD12 ILE 729 HD12 ILE 729 -4.296 -0.903 0.085 557 HD13 ILE 729 HD13 ILE 729 -4.699 0.261 1.349 558 H THR 730 H THR 730 -7.088 -2.130 4.946 559 HA THR 730 HA THR 730 -6.756 -0.699 7.518 560 HB THR 730 HB THR 730 -7.968 0.492 5.771 561 HG1 THR 730 HG1 THR 730 -9.457 1.175 7.096 562 HG21 THR 730 HG21 THR 730 -9.275 -0.621 4.332 563 HG22 THR 730 HG22 THR 730 -9.094 -2.089 5.283 564 HG23 THR 730 HG23 THR 730 -10.399 -0.961 5.643 565 H GLU 731 H GLU 731 -7.362 -3.681 6.280 566 HA GLU 731 HA GLU 731 -8.011 -5.643 7.239 567 HB2 GLU 731 HB2 GLU 731 -8.577 -4.075 9.753 568 HB3 GLU 731 HB3 GLU 731 -8.240 -5.800 9.612 569 HG2 GLU 731 HG2 GLU 731 -6.052 -4.771 8.357 570 HG3 GLU 731 HG3 GLU 731 -6.369 -3.494 9.529 571 H LYS 732 H LYS 732 -9.928 -3.121 6.565 572 HA LYS 732 HA LYS 732 -12.444 -4.380 7.412 573 HB2 LYS 732 HB2 LYS 732 -12.208 -1.784 5.899 574 HB3 LYS 732 HB3 LYS 732 -13.503 -2.320 6.970 575 HG2 LYS 732 HG2 LYS 732 -10.672 -1.693 7.867 576 HG3 LYS 732 HG3 LYS 732 -12.037 -0.593 8.021 577 HD2 LYS 732 HD2 LYS 732 -12.435 -3.332 9.121 578 HD3 LYS 732 HD3 LYS 732 -11.300 -2.302 9.988 579 HE2 LYS 732 HE2 LYS 732 -13.827 -0.987 9.199 580 HE3 LYS 732 HE3 LYS 732 -13.988 -2.269 10.400 581 HZ1 LYS 732 HZ1 LYS 732 -13.539 -0.012 11.335 582 HZ2 LYS 732 HZ2 LYS 732 -12.413 -1.211 11.829 583 HZ3 LYS 732 HZ3 LYS 732 -11.991 -0.069 10.615 584 H LYS 733 H LYS 733 -10.751 -3.299 4.471 585 HA LYS 733 HA LYS 733 -12.502 -5.105 2.911 586 HB2 LYS 733 HB2 LYS 733 -13.113 -2.912 2.225 587 HB3 LYS 733 HB3 LYS 733 -11.435 -2.375 2.179 588 HG2 LYS 733 HG2 LYS 733 -12.449 -2.867 -0.095 589 HG3 LYS 733 HG3 LYS 733 -10.964 -3.753 0.253 590 HD2 LYS 733 HD2 LYS 733 -12.163 -5.772 0.724 591 HD3 LYS 733 HD3 LYS 733 -13.706 -4.924 0.792 592 HE2 LYS 733 HE2 LYS 733 -14.001 -5.302 -1.404 593 HE3 LYS 733 HE3 LYS 733 -12.544 -4.371 -1.752 594 HZ1 LYS 733 HZ1 LYS 733 -11.805 -6.330 -2.543 595 HZ2 LYS 733 HZ2 LYS 733 -11.486 -6.701 -0.905 596 HZ3 LYS 733 HZ3 LYS 733 -12.922 -7.247 -1.649 597 H ALA 734 H ALA 734 -11.264 -6.848 2.649 598 HA ALA 734 HA ALA 734 -8.430 -6.559 1.966 599 HB1 ALA 734 HB1 ALA 734 -8.172 -8.800 2.604 600 HB2 ALA 734 HB2 ALA 734 -9.868 -9.180 2.306 601 HB3 ALA 734 HB3 ALA 734 -9.415 -8.217 3.712 602 H PHE 735 H PHE 735 -7.703 -8.402 0.375 603 HA PHE 735 HA PHE 735 -9.542 -8.760 -1.876 604 HB2 PHE 735 HB2 PHE 735 -7.253 -6.895 -1.872 605 HB3 PHE 735 HB3 PHE 735 -7.341 -7.970 -3.265 606 HD1 PHE 735 HD2 PHE 735 -9.479 -8.071 -4.618 607 HD2 PHE 735 HD1 PHE 735 -8.774 -5.088 -1.611 608 HE1 PHE 735 HE2 PHE 735 -11.297 -6.682 -5.572 609 HE2 PHE 735 HE1 PHE 735 -10.591 -3.697 -2.566 610 HZ PHE 735 HZ PHE 735 -11.855 -4.494 -4.545 611 H ARG 736 H ARG 736 -8.316 -10.007 -3.686 612 HA ARG 736 HA ARG 736 -7.625 -12.527 -2.803 613 HB2 ARG 736 HB2 ARG 736 -7.219 -11.011 -5.320 614 HB3 ARG 736 HB3 ARG 736 -6.246 -12.461 -5.115 615 HG2 ARG 736 HG2 ARG 736 -8.149 -13.357 -6.099 616 HG3 ARG 736 HG3 ARG 736 -8.547 -13.540 -4.393 617 HD2 ARG 736 HD2 ARG 736 -10.145 -11.889 -4.444 618 HD3 ARG 736 HD3 ARG 736 -9.306 -10.959 -5.678 619 HE ARG 736 HE ARG 736 -11.146 -13.193 -6.130 620 HH11 ARG 736 HH21 ARG 736 -8.890 -10.871 -7.445 621 HH12 ARG 736 HH22 ARG 736 -9.432 -11.146 -9.077 622 HH21 ARG 736 HH11 ARG 736 -11.807 -13.480 -8.235 623 HH22 ARG 736 HH12 ARG 736 -11.065 -12.586 -9.513 624 H GLY 737 H GLY 737 -5.344 -9.990 -3.844 625 HA2 GLY 737 HA2 GLY 737 -3.361 -11.029 -1.957 626 HA3 GLY 737 HA3 GLY 737 -2.917 -10.963 -3.662 627 H LEU 738 H LEU 738 -1.242 -9.503 -2.861 628 HA LEU 738 HA LEU 738 -1.910 -6.956 -1.769 629 HB2 LEU 738 HB2 LEU 738 0.441 -8.400 -2.229 630 HB3 LEU 738 HB3 LEU 738 0.584 -6.973 -3.252 631 HG LEU 738 HG LEU 738 -0.091 -6.937 -0.296 632 HD11 LEU 738 HD11 LEU 738 2.418 -5.959 -1.668 633 HD12 LEU 738 HD12 LEU 738 2.125 -6.129 0.062 634 HD13 LEU 738 HD13 LEU 738 2.284 -7.562 -0.946 635 HD21 LEU 738 HD21 LEU 738 -1.115 -5.108 -1.607 636 HD22 LEU 738 HD22 LEU 738 0.143 -4.509 -0.537 637 HD23 LEU 738 HD23 LEU 738 0.474 -4.700 -2.257 638 H THR 739 H THR 739 -0.954 -7.990 -5.039 639 HA THR 739 HA THR 739 -1.169 -5.541 -6.330 640 HB THR 739 HB THR 739 -2.079 -8.170 -7.510 641 HG1 THR 739 HG1 THR 739 -0.108 -8.826 -7.417 642 HG21 THR 739 HG21 THR 739 -2.524 -6.237 -8.912 643 HG22 THR 739 HG22 THR 739 -0.871 -5.662 -8.697 644 HG23 THR 739 HG23 THR 739 -1.178 -7.149 -9.594 645 H GLU 740 H GLU 740 -3.691 -8.025 -5.895 646 HA GLU 740 HA GLU 740 -5.794 -6.491 -7.017 647 HB2 GLU 740 HB2 GLU 740 -6.011 -8.662 -4.921 648 HB3 GLU 740 HB3 GLU 740 -7.280 -8.121 -6.019 649 HG2 GLU 740 HG2 GLU 740 -5.159 -8.728 -7.727 650 HG3 GLU 740 HG3 GLU 740 -5.075 -9.993 -6.506 651 H LEU 741 H LEU 741 -4.436 -6.676 -3.809 652 HA LEU 741 HA LEU 741 -6.532 -5.178 -2.539 653 HB2 LEU 741 HB2 LEU 741 -5.130 -6.826 -1.352 654 HB3 LEU 741 HB3 LEU 741 -3.712 -5.830 -1.640 655 HG LEU 741 HG LEU 741 -4.897 -5.665 0.653 656 HD11 LEU 741 HD11 LEU 741 -3.632 -3.834 0.815 657 HD12 LEU 741 HD12 LEU 741 -3.452 -3.853 -0.937 658 HD13 LEU 741 HD13 LEU 741 -4.749 -2.917 -0.197 659 HD21 LEU 741 HD21 LEU 741 -6.776 -4.149 0.777 660 HD22 LEU 741 HD22 LEU 741 -6.700 -3.840 -0.954 661 HD23 LEU 741 HD23 LEU 741 -7.183 -5.428 -0.364 662 H VAL 742 H VAL 742 -3.342 -4.433 -3.903 663 HA VAL 742 HA VAL 742 -3.589 -1.614 -3.140 664 HB VAL 742 HB VAL 742 -1.439 -3.331 -4.298 665 HG11 VAL 742 HG11 VAL 742 -1.355 -1.538 -5.882 666 HG12 VAL 742 HG12 VAL 742 -1.662 -0.333 -4.631 667 HG13 VAL 742 HG13 VAL 742 -0.120 -1.185 -4.676 668 HG21 VAL 742 HG21 VAL 742 -0.882 -1.130 -2.409 669 HG22 VAL 742 HG22 VAL 742 -2.005 -2.346 -1.804 670 HG23 VAL 742 HG23 VAL 742 -0.396 -2.822 -2.339 671 H GLU 743 H GLU 743 -3.961 -3.608 -6.032 672 HA GLU 743 HA GLU 743 -4.063 -1.318 -7.792 673 HB2 GLU 743 HB2 GLU 743 -4.816 -4.216 -8.218 674 HB3 GLU 743 HB3 GLU 743 -4.902 -2.984 -9.476 675 HG2 GLU 743 HG2 GLU 743 -2.398 -3.771 -7.949 676 HG3 GLU 743 HG3 GLU 743 -2.770 -4.222 -9.606 677 H PHE 744 H PHE 744 -6.079 -2.211 -5.434 678 HA PHE 744 HA PHE 744 -8.498 -1.417 -6.939 679 HB2 PHE 744 HB2 PHE 744 -8.546 -3.649 -5.747 680 HB3 PHE 744 HB3 PHE 744 -8.430 -2.757 -4.229 681 HD1 PHE 744 HD2 PHE 744 -10.535 -3.457 -7.175 682 HD2 PHE 744 HD1 PHE 744 -10.276 -1.366 -3.429 683 HE1 PHE 744 HE2 PHE 744 -12.973 -3.017 -7.248 684 HE2 PHE 744 HE1 PHE 744 -12.714 -0.925 -3.506 685 HZ PHE 744 HZ PHE 744 -14.062 -1.752 -5.416 686 H TYR 745 H TYR 745 -6.638 -0.915 -3.971 687 HA TYR 745 HA TYR 745 -8.275 1.156 -2.921 688 HB2 TYR 745 HB2 TYR 745 -5.459 0.244 -2.426 689 HB3 TYR 745 HB3 TYR 745 -6.027 1.760 -1.729 690 HD1 TYR 745 HD1 TYR 745 -7.500 -1.656 -2.272 691 HD2 TYR 745 HD2 TYR 745 -6.749 1.561 0.487 692 HE1 TYR 745 HE1 TYR 745 -8.655 -2.921 -0.475 693 HE2 TYR 745 HE2 TYR 745 -7.893 0.281 2.272 694 HH TYR 745 HH TYR 745 -9.051 -3.037 1.756 695 H GLN 746 H GLN 746 -6.328 1.071 -5.654 696 HA GLN 746 HA GLN 746 -5.383 3.785 -5.660 697 HB2 GLN 746 HB2 GLN 746 -5.126 3.316 -8.170 698 HB3 GLN 746 HB3 GLN 746 -4.197 2.287 -7.079 699 HG2 GLN 746 HG2 GLN 746 -5.368 0.425 -7.633 700 HG3 GLN 746 HG3 GLN 746 -6.907 1.279 -7.665 701 HE21 GLN 746 HE21 GLN 746 -4.377 -0.014 -9.649 702 HE22 GLN 746 HE22 GLN 746 -4.949 0.599 -11.123 703 H GLN 747 H GLN 747 -8.361 2.241 -6.194 704 HA GLN 747 HA GLN 747 -9.505 4.633 -7.513 705 HB2 GLN 747 HB2 GLN 747 -10.927 1.993 -7.278 706 HB3 GLN 747 HB3 GLN 747 -11.146 3.267 -8.477 707 HG2 GLN 747 HG2 GLN 747 -8.423 2.343 -8.594 708 HG3 GLN 747 HG3 GLN 747 -9.497 0.952 -8.672 709 HE21 GLN 747 HE21 GLN 747 -7.827 2.248 -10.838 710 HE22 GLN 747 HE22 GLN 747 -8.944 2.614 -12.073 711 H ASN 748 H ASN 748 -9.909 2.300 -4.891 712 HA ASN 748 HA ASN 748 -12.252 3.492 -3.788 713 HB2 ASN 748 HB2 ASN 748 -11.220 1.122 -3.395 714 HB3 ASN 748 HB3 ASN 748 -10.273 1.931 -2.150 715 HD21 ASN 748 HD21 ASN 748 -11.955 3.616 -0.872 716 HD22 ASN 748 HD22 ASN 748 -13.336 2.811 -0.301 717 H SER 749 H SER 749 -12.413 5.362 -2.725 718 HA SER 749 HA SER 749 -10.262 7.061 -2.161 719 HB2 SER 749 HB2 SER 749 -12.290 7.826 -0.421 720 HB3 SER 749 HB3 SER 749 -12.058 8.400 -2.069 721 HG SER 749 HG SER 749 -13.814 6.461 -1.026 722 H LEU 750 H LEU 750 -8.674 6.683 -0.784 723 HA LEU 750 HA LEU 750 -8.557 4.813 1.230 724 HB2 LEU 750 HB2 LEU 750 -7.157 7.482 1.019 725 HB3 LEU 750 HB3 LEU 750 -6.709 6.227 2.178 726 HG LEU 750 HG LEU 750 -6.793 5.901 -0.830 727 HD11 LEU 750 HD11 LEU 750 -4.254 5.534 0.606 728 HD12 LEU 750 HD12 LEU 750 -4.581 6.386 -0.904 729 HD13 LEU 750 HD13 LEU 750 -4.867 7.188 0.641 730 HD21 LEU 750 HD21 LEU 750 -5.362 3.798 0.098 731 HD22 LEU 750 HD22 LEU 750 -6.490 4.014 1.434 732 HD23 LEU 750 HD23 LEU 750 -7.099 3.730 -0.197 733 H LYS 751 H LYS 751 -9.971 8.020 1.379 734 HA LYS 751 HA LYS 751 -10.119 8.371 4.154 735 HB2 LYS 751 HB2 LYS 751 -11.718 10.036 3.721 736 HB3 LYS 751 HB3 LYS 751 -10.760 9.987 2.243 737 HG2 LYS 751 HG2 LYS 751 -12.538 8.216 1.467 738 HG3 LYS 751 HG3 LYS 751 -13.538 8.942 2.724 739 HD2 LYS 751 HD2 LYS 751 -12.198 10.462 0.462 740 HD3 LYS 751 HD3 LYS 751 -13.907 10.032 0.525 741 HE2 LYS 751 HE2 LYS 751 -12.465 11.776 2.547 742 HE3 LYS 751 HE3 LYS 751 -13.537 12.362 1.273 743 HZ1 LYS 751 HZ1 LYS 751 -14.833 12.192 3.225 744 HZ2 LYS 751 HZ2 LYS 751 -15.275 10.869 2.257 745 HZ3 LYS 751 HZ3 LYS 751 -14.241 10.640 3.583 746 H ASP 752 H ASP 752 -11.668 6.072 2.148 747 HA ASP 752 HA ASP 752 -13.849 5.601 4.059 748 HB2 ASP 752 HB2 ASP 752 -13.212 4.143 1.489 749 HB3 ASP 752 HB3 ASP 752 -14.724 4.093 2.393 750 H CYS 753 H CYS 753 -10.809 4.256 3.012 751 HA CYS 753 HA CYS 753 -11.191 1.847 4.673 752 HB2 CYS 753 HB2 CYS 753 -9.161 2.594 2.563 753 HB3 CYS 753 HB3 CYS 753 -9.019 1.156 3.568 754 HG CYS 753 HG CYS 753 -11.668 0.824 2.507 755 H PHE 754 H PHE 754 -8.906 4.497 4.080 756 HA PHE 754 HA PHE 754 -7.230 3.758 6.295 757 HB2 PHE 754 HB2 PHE 754 -7.331 6.120 4.421 758 HB3 PHE 754 HB3 PHE 754 -6.132 5.981 5.699 759 HD1 PHE 754 HD2 PHE 754 -7.185 2.766 4.478 760 HD2 PHE 754 HD1 PHE 754 -4.519 6.029 3.635 761 HE1 PHE 754 HE2 PHE 754 -5.840 1.290 3.035 762 HE2 PHE 754 HE1 PHE 754 -3.187 4.537 2.179 763 HZ PHE 754 HZ PHE 754 -3.837 2.173 1.881 764 H LYS 755 H LYS 755 -7.492 7.085 6.427 765 HA LYS 755 HA LYS 755 -9.622 7.155 8.436 766 HB2 LYS 755 HB2 LYS 755 -7.598 6.473 9.666 767 HB3 LYS 755 HB3 LYS 755 -6.778 7.922 9.094 768 HG2 LYS 755 HG2 LYS 755 -8.416 9.341 10.245 769 HG3 LYS 755 HG3 LYS 755 -9.334 7.916 10.730 770 HD2 LYS 755 HD2 LYS 755 -8.083 7.888 12.599 771 HD3 LYS 755 HD3 LYS 755 -6.749 7.352 11.582 772 HE2 LYS 755 HE2 LYS 755 -7.407 10.174 12.455 773 HE3 LYS 755 HE3 LYS 755 -5.927 9.264 12.756 774 HZ1 LYS 755 HZ1 LYS 755 -6.708 10.811 10.433 775 HZ2 LYS 755 HZ2 LYS 755 -5.147 10.315 10.948 776 HZ3 LYS 755 HZ3 LYS 755 -6.115 9.256 10.045 777 H SER 756 H SER 756 -7.365 9.617 8.826 778 HA SER 756 HA SER 756 -9.143 11.594 7.775 779 HB2 SER 756 HB2 SER 756 -6.258 12.103 8.478 780 HB3 SER 756 HB3 SER 756 -7.645 13.175 8.667 781 HG SER 756 HG SER 756 -8.207 12.155 10.471 782 H LEU 757 H LEU 757 -8.410 9.712 5.815 783 HA LEU 757 HA LEU 757 -6.491 11.071 4.059 784 HB2 LEU 757 HB2 LEU 757 -7.675 8.342 4.234 785 HB3 LEU 757 HB3 LEU 757 -7.224 8.923 2.636 786 HG LEU 757 HG LEU 757 -5.443 7.641 4.019 787 HD11 LEU 757 HD11 LEU 757 -3.676 9.385 3.262 788 HD12 LEU 757 HD12 LEU 757 -4.686 8.602 2.049 789 HD13 LEU 757 HD13 LEU 757 -5.065 10.237 2.584 790 HD21 LEU 757 HD21 LEU 757 -4.872 10.326 5.219 791 HD22 LEU 757 HD22 LEU 757 -5.978 9.223 6.034 792 HD23 LEU 757 HD23 LEU 757 -4.315 8.732 5.729 793 H ASP 758 H ASP 758 -7.131 10.978 1.679 794 HA ASP 758 HA ASP 758 -9.878 11.202 0.953 795 HB2 ASP 758 HB2 ASP 758 -8.619 13.570 1.996 796 HB3 ASP 758 HB3 ASP 758 -8.976 13.804 0.286 797 H THR 759 H THR 759 -7.862 9.646 0.025 798 HA THR 759 HA THR 759 -7.756 10.436 -2.759 799 HB THR 759 HB THR 759 -5.731 11.533 -1.749 800 HG1 THR 759 HG1 THR 759 -4.355 10.573 -3.374 801 HG21 THR 759 HG21 THR 759 -5.403 9.494 -0.142 802 HG22 THR 759 HG22 THR 759 -4.593 8.746 -1.518 803 HG23 THR 759 HG23 THR 759 -3.976 10.251 -0.841 804 H THR 760 H THR 760 -5.719 8.712 -3.536 805 HA THR 760 HA THR 760 -6.332 6.034 -2.554 806 HB THR 760 HB THR 760 -7.123 5.164 -4.642 807 HG1 THR 760 HG1 THR 760 -6.931 6.193 -6.468 808 HG21 THR 760 HG21 THR 760 -8.743 6.381 -3.128 809 HG22 THR 760 HG22 THR 760 -8.609 7.754 -4.225 810 HG23 THR 760 HG23 THR 760 -9.255 6.219 -4.807 811 H LEU 761 H LEU 761 -5.048 4.387 -3.890 812 HA LEU 761 HA LEU 761 -2.316 5.055 -3.861 813 HB2 LEU 761 HB2 LEU 761 -3.785 2.812 -5.290 814 HB3 LEU 761 HB3 LEU 761 -2.045 2.894 -5.114 815 HG LEU 761 HG LEU 761 -3.525 1.477 -3.424 816 HD11 LEU 761 HD11 LEU 761 -1.805 2.048 -1.640 817 HD12 LEU 761 HD12 LEU 761 -1.175 1.542 -3.208 818 HD13 LEU 761 HD13 LEU 761 -1.194 3.250 -2.772 819 HD21 LEU 761 HD21 LEU 761 -3.868 2.803 -1.314 820 HD22 LEU 761 HD22 LEU 761 -3.617 4.272 -2.247 821 HD23 LEU 761 HD23 LEU 761 -4.988 3.220 -2.602 822 H GLN 762 H GLN 762 -2.237 7.047 -5.042 823 HA GLN 762 HA GLN 762 -3.105 7.343 -7.702 824 HB2 GLN 762 HB2 GLN 762 -1.718 8.876 -5.665 825 HB3 GLN 762 HB3 GLN 762 -1.111 9.224 -7.281 826 HG2 GLN 762 HG2 GLN 762 -2.872 10.615 -7.446 827 HG3 GLN 762 HG3 GLN 762 -3.850 9.165 -7.646 828 HE21 GLN 762 HE21 GLN 762 -5.671 9.399 -6.336 829 HE22 GLN 762 HE22 GLN 762 -5.637 9.978 -4.731 830 H PHE 763 H PHE 763 0.268 7.282 -6.493 831 HA PHE 763 HA PHE 763 0.994 5.934 -9.026 832 HB2 PHE 763 HB2 PHE 763 2.329 8.375 -7.843 833 HB3 PHE 763 HB3 PHE 763 3.007 7.420 -9.163 834 HD1 PHE 763 HD1 PHE 763 1.563 7.088 -11.274 835 HD2 PHE 763 HD2 PHE 763 0.723 10.048 -8.274 836 HE1 PHE 763 HE1 PHE 763 0.152 8.328 -12.890 837 HE2 PHE 763 HE2 PHE 763 -0.690 11.287 -9.892 838 HZ PHE 763 HZ PHE 763 -0.975 10.427 -12.201 839 HA PRO 764 HA PRO 764 3.559 3.414 -6.464 840 HB2 PRO 764 HB2 PRO 764 5.224 2.396 -8.342 841 HB3 PRO 764 HB3 PRO 764 3.501 1.972 -8.287 842 HG2 PRO 764 HG2 PRO 764 4.925 3.890 -10.056 843 HG3 PRO 764 HG3 PRO 764 3.617 2.764 -10.433 844 HD2 PRO 764 HD2 PRO 764 3.248 5.464 -9.988 845 HD3 PRO 764 HD3 PRO 764 1.983 4.231 -9.774 846 H PHE 765 H PHE 765 6.271 2.862 -6.725 847 HA PHE 765 HA PHE 765 7.504 5.542 -6.514 848 HB2 PHE 765 HB2 PHE 765 8.659 4.952 -4.583 849 HB3 PHE 765 HB3 PHE 765 7.093 4.189 -4.341 850 HD1 PHE 765 HD1 PHE 765 6.803 1.756 -4.743 851 HD2 PHE 765 HD2 PHE 765 10.652 3.651 -4.882 852 HE1 PHE 765 HE1 PHE 765 7.902 -0.455 -4.538 853 HE2 PHE 765 HE2 PHE 765 11.752 1.444 -4.677 854 HZ PHE 765 HZ PHE 765 10.378 -0.614 -4.504 855 H LYS 766 H LYS 766 7.675 2.369 -7.895 856 HA LYS 766 HA LYS 766 10.503 2.634 -8.573 857 HB2 LYS 766 HB2 LYS 766 8.503 0.621 -9.615 858 HB3 LYS 766 HB3 LYS 766 10.253 0.531 -9.746 859 HG2 LYS 766 HG2 LYS 766 9.877 0.886 -7.033 860 HG3 LYS 766 HG3 LYS 766 8.518 -0.142 -7.470 861 HD2 LYS 766 HD2 LYS 766 11.042 -0.969 -8.718 862 HD3 LYS 766 HD3 LYS 766 11.079 -1.024 -6.959 863 HE2 LYS 766 HE2 LYS 766 10.155 -3.095 -7.299 864 HE3 LYS 766 HE3 LYS 766 8.662 -2.161 -7.377 865 HZ1 LYS 766 HZ1 LYS 766 10.036 -3.582 -9.464 866 HZ2 LYS 766 HZ2 LYS 766 8.410 -3.044 -9.407 867 HZ3 LYS 766 HZ3 LYS 766 9.654 -1.987 -9.900 868 H GLU 767 H GLU 767 7.374 3.260 -9.985 869 HA GLU 767 HA GLU 767 7.404 3.433 -12.579 870 HB2 GLU 767 HB2 GLU 767 6.349 5.129 -10.561 871 HB3 GLU 767 HB3 GLU 767 7.025 6.175 -11.806 872 HG2 GLU 767 HG2 GLU 767 5.778 4.390 -13.386 873 HG3 GLU 767 HG3 GLU 767 4.740 4.280 -11.973 874 H1 ASP 338 H1 ASP 338 7.553 5.580 18.694 875 H2 ASP 338 H2 ASP 338 7.799 5.807 18.307 876 H3 ASP 338 H3 ASP 338 8.810 6.692 19.358 877 HA ASP 338 HA ASP 338 10.381 5.399 18.356 878 HB2 ASP 338 HB2 ASP 338 10.709 3.342 19.865 879 HB3 ASP 338 HB3 ASP 338 10.648 4.905 20.671 880 H THR 339 H THR 339 7.476 3.441 18.960 881 HA THR 339 HA THR 339 8.036 1.280 17.276 882 HB THR 339 HB THR 339 5.712 0.765 17.388 883 HG1 THR 339 HG1 THR 339 4.540 2.428 16.814 884 HG21 THR 339 HG21 THR 339 5.962 2.404 19.878 885 HG22 THR 339 HG22 THR 339 5.402 0.745 19.683 886 HG23 THR 339 HG23 THR 339 7.126 1.109 19.606 887 H GLU 340 H GLU 340 7.202 4.532 16.492 888 HA GLU 340 HA GLU 340 5.916 4.893 14.280 889 HB2 GLU 340 HB2 GLU 340 8.814 5.610 14.694 890 HB3 GLU 340 HB3 GLU 340 7.917 6.162 13.282 891 HG2 GLU 340 HG2 GLU 340 7.601 7.921 14.792 892 HG3 GLU 340 HG3 GLU 340 6.143 6.960 15.025 893 H VAL 341 H VAL 341 5.400 3.098 12.991 894 HA VAL 341 HA VAL 341 7.373 2.507 10.944 895 HB VAL 341 HB VAL 341 7.815 0.875 12.794 896 HG11 VAL 341 HG11 VAL 341 5.383 0.575 13.406 897 HG12 VAL 341 HG12 VAL 341 5.196 -0.366 11.926 898 HG13 VAL 341 HG13 VAL 341 6.280 -0.924 13.195 899 HG21 VAL 341 HG21 VAL 341 7.558 0.490 9.981 900 HG22 VAL 341 HG22 VAL 341 8.651 -0.330 11.097 901 HG23 VAL 341 HG23 VAL 341 7.053 -0.999 10.777 902 H PTR 342 H PTR 342 4.205 1.322 12.147 903 HA PTR 342 HA PTR 342 2.519 2.346 10.271 904 HB2 PTR 342 HB2 PTR 342 2.286 0.387 8.617 905 HB3 PTR 342 HB3 PTR 342 3.641 1.482 8.374 906 HD1 PTR 342 HD1 PTR 342 2.906 -1.571 10.462 907 HD2 PTR 342 HD2 PTR 342 5.658 0.462 7.870 908 HE1 PTR 342 HE1 PTR 342 4.484 -3.456 10.668 909 HE2 PTR 342 HE2 PTR 342 7.239 -1.426 8.075 910 H GLU 343 H GLU 343 2.580 1.293 12.914 911 HA GLU 343 HA GLU 343 1.334 -1.178 13.288 912 HB2 GLU 343 HB2 GLU 343 0.399 0.119 15.413 913 HB3 GLU 343 HB3 GLU 343 2.102 -0.306 15.265 914 HG2 GLU 343 HG2 GLU 343 1.176 2.313 14.129 915 HG3 GLU 343 HG3 GLU 343 1.387 2.174 15.872 916 H SER 344 H SER 344 0.001 -0.296 11.086 917 HA SER 344 HA SER 344 -2.085 0.019 10.173 918 HB2 SER 344 HB2 SER 344 -3.982 -0.950 11.661 919 HB3 SER 344 HB3 SER 344 -2.739 -2.035 11.046 920 HG SER 344 HG SER 344 -2.279 -0.727 13.494 921 HA PRO 345 HA PRO 345 -2.603 3.938 12.841 922 HB2 PRO 345 HB2 PRO 345 -2.579 5.449 10.439 923 HB3 PRO 345 HB3 PRO 345 -1.256 5.318 11.612 924 HG2 PRO 345 HG2 PRO 345 -1.669 3.877 9.055 925 HG3 PRO 345 HG3 PRO 345 -0.164 4.402 9.830 926 HD2 PRO 345 HD2 PRO 345 -0.897 1.816 9.853 927 HD3 PRO 345 HD3 PRO 345 -0.102 2.552 11.265 928 H PTR 346 H PTR 346 -3.920 2.660 9.865 929 HA PTR 346 HA PTR 346 -6.557 3.838 10.496 930 HB2 PTR 346 HB2 PTR 346 -5.564 2.919 7.796 931 HB3 PTR 346 HB3 PTR 346 -7.039 3.813 8.154 932 HD1 PTR 346 HD1 PTR 346 -4.631 4.599 6.295 933 HD2 PTR 346 HD2 PTR 346 -5.726 5.591 10.328 934 HE1 PTR 346 HE1 PTR 346 -3.400 6.760 6.115 935 HE2 PTR 346 HE2 PTR 346 -4.504 7.724 10.148 936 H ALA 347 H ALA 347 -8.290 2.563 10.616 937 HA ALA 347 HA ALA 347 -8.710 0.055 9.516 938 HB1 ALA 347 HB1 ALA 347 -6.851 -0.046 11.700 939 HB2 ALA 347 HB2 ALA 347 -7.479 -1.375 10.727 940 HB3 ALA 347 HB3 ALA 347 -8.339 -0.862 12.178 941 H ASP 348 H ASP 348 -9.045 1.145 12.890 942 HA ASP 348 HA ASP 348 -11.962 1.375 12.466 943 HB2 ASP 348 HB2 ASP 348 -10.796 0.360 15.051 944 HB3 ASP 348 HB3 ASP 348 -12.439 0.187 14.436 945 HA PRO 349 HA PRO 349 -10.306 5.162 14.562 946 HB2 PRO 349 HB2 PRO 349 -10.782 6.982 12.636 947 HB3 PRO 349 HB3 PRO 349 -9.360 5.921 12.578 948 HG2 PRO 349 HG2 PRO 349 -11.900 5.765 11.049 949 HG3 PRO 349 HG3 PRO 349 -10.250 5.363 10.546 950 HD2 PRO 349 HD2 PRO 349 -12.207 3.519 11.387 951 HD3 PRO 349 HD3 PRO 349 -10.468 3.195 11.234 952 H GLU 350 H GLU 350 -11.744 5.756 16.083 953 HA GLU 350 HA GLU 350 -13.683 6.430 17.115 954 HB2 GLU 350 HB2 GLU 350 -13.738 7.996 14.530 955 HB3 GLU 350 HB3 GLU 350 -14.895 8.268 15.834 956 HG2 GLU 350 HG2 GLU 350 -12.954 9.822 15.966 957 HG3 GLU 350 HG3 GLU 350 -13.072 8.790 17.386 Start of MODEL 13 1 H1 GLY 661 H1 GLY 661 4.289 -16.940 -10.281 2 H2 GLY 661 H2 GLY 661 2.685 -16.788 -9.740 3 H3 GLY 661 H3 GLY 661 3.731 -15.438 -9.701 4 HA2 GLY 661 HA2 GLY 661 3.395 -14.937 -11.834 5 HA3 GLY 661 HA3 GLY 661 3.444 -16.636 -12.314 6 H HIS 662 H HIS 662 1.492 -14.149 -12.524 7 HA HIS 662 HA HIS 662 -0.776 -13.859 -12.758 8 HB2 HIS 662 HB2 HIS 662 -0.329 -15.987 -14.131 9 HB3 HIS 662 HB3 HIS 662 -1.001 -16.862 -12.753 10 HD1 HIS 662 HD1 HIS 662 -3.307 -15.352 -11.859 11 HD2 HIS 662 HD2 HIS 662 -2.399 -15.580 -15.921 12 HE1 HIS 662 HE1 HIS 662 -5.480 -14.902 -13.109 13 HE2 HIS 662 HE2 HIS 662 -4.940 -15.041 -15.593 14 H MET 663 H MET 663 0.464 -14.361 -10.022 15 HA MET 663 HA MET 663 -2.110 -14.720 -8.634 16 HB2 MET 663 HB2 MET 663 -0.639 -16.879 -8.706 17 HB3 MET 663 HB3 MET 663 0.345 -16.044 -7.505 18 HG2 MET 663 HG2 MET 663 -2.465 -15.790 -6.846 19 HG3 MET 663 HG3 MET 663 -2.031 -17.490 -7.041 20 HE1 MET 663 HE1 MET 663 -1.787 -17.469 -3.290 21 HE2 MET 663 HE2 MET 663 -2.995 -17.194 -4.545 22 HE3 MET 663 HE3 MET 663 -1.869 -18.551 -4.679 23 H GLN 664 H GLN 664 -0.082 -14.833 -6.185 24 HA GLN 664 HA GLN 664 -0.341 -12.051 -5.576 25 HB2 GLN 664 HB2 GLN 664 -0.272 -14.071 -3.945 26 HB3 GLN 664 HB3 GLN 664 1.481 -13.927 -4.084 27 HG2 GLN 664 HG2 GLN 664 0.914 -12.569 -2.213 28 HG3 GLN 664 HG3 GLN 664 1.152 -11.430 -3.536 29 HE21 GLN 664 HE21 GLN 664 -1.569 -13.434 -2.262 30 HE22 GLN 664 HE22 GLN 664 -2.718 -12.193 -2.374 31 H ASP 665 H ASP 665 1.067 -12.275 -7.983 32 HA ASP 665 HA ASP 665 3.893 -11.899 -7.403 33 HB2 ASP 665 HB2 ASP 665 2.519 -11.370 -10.033 34 HB3 ASP 665 HB3 ASP 665 4.211 -11.754 -9.745 35 H LEU 666 H LEU 666 4.283 -10.079 -6.316 36 HA LEU 666 HA LEU 666 2.940 -7.603 -7.122 37 HB2 LEU 666 HB2 LEU 666 4.852 -7.869 -4.821 38 HB3 LEU 666 HB3 LEU 666 3.505 -6.748 -5.019 39 HG LEU 666 HG LEU 666 3.238 -9.753 -4.679 40 HD11 LEU 666 HD11 LEU 666 3.516 -7.571 -2.776 41 HD12 LEU 666 HD12 LEU 666 1.990 -8.428 -2.566 42 HD13 LEU 666 HD13 LEU 666 3.513 -9.312 -2.495 43 HD21 LEU 666 HD21 LEU 666 0.795 -8.874 -4.192 44 HD22 LEU 666 HD22 LEU 666 1.308 -7.505 -5.181 45 HD23 LEU 666 HD23 LEU 666 1.323 -9.137 -5.851 46 H SER 667 H SER 667 5.986 -9.211 -7.363 47 HA SER 667 HA SER 667 7.653 -6.933 -7.727 48 HB2 SER 667 HB2 SER 667 7.942 -9.805 -8.594 49 HB3 SER 667 HB3 SER 667 9.190 -8.582 -8.847 50 HG SER 667 HG SER 667 9.524 -9.686 -6.896 51 H VAL 668 H VAL 668 5.146 -8.064 -9.606 52 HA VAL 668 HA VAL 668 6.379 -7.375 -12.166 53 HB VAL 668 HB VAL 668 4.278 -8.126 -13.140 54 HG11 VAL 668 HG11 VAL 668 5.769 -9.926 -12.705 55 HG12 VAL 668 HG12 VAL 668 5.453 -9.867 -10.969 56 HG13 VAL 668 HG13 VAL 668 4.212 -10.462 -12.071 57 HG21 VAL 668 HG21 VAL 668 2.696 -9.184 -11.226 58 HG22 VAL 668 HG22 VAL 668 3.366 -7.828 -10.319 59 HG23 VAL 668 HG23 VAL 668 2.487 -7.536 -11.819 60 H HIS 669 H HIS 669 5.256 -5.664 -9.689 61 HA HIS 669 HA HIS 669 3.904 -3.610 -11.327 62 HB2 HIS 669 HB2 HIS 669 4.014 -3.776 -8.315 63 HB3 HIS 669 HB3 HIS 669 2.946 -2.780 -9.303 64 HD1 HIS 669 HD1 HIS 669 1.903 -4.786 -11.320 65 HD2 HIS 669 HD2 HIS 669 2.314 -5.651 -7.271 66 HE1 HIS 669 HE1 HIS 669 0.270 -6.662 -10.820 67 HE2 HIS 669 HE2 HIS 669 0.445 -7.150 -8.318 68 H LEU 670 H LEU 670 4.260 -1.423 -9.849 69 HA LEU 670 HA LEU 670 7.176 -1.013 -9.727 70 HB2 LEU 670 HB2 LEU 670 6.587 1.393 -10.442 71 HB3 LEU 670 HB3 LEU 670 6.612 0.156 -11.674 72 HG LEU 670 HG LEU 670 4.126 1.140 -10.252 73 HD11 LEU 670 HD11 LEU 670 5.173 1.660 -13.051 74 HD12 LEU 670 HD12 LEU 670 3.609 2.191 -12.435 75 HD13 LEU 670 HD13 LEU 670 5.093 2.834 -11.741 76 HD21 LEU 670 HD21 LEU 670 3.468 -0.089 -12.691 77 HD22 LEU 670 HD22 LEU 670 4.657 -1.163 -11.960 78 HD23 LEU 670 HD23 LEU 670 3.183 -0.744 -11.081 79 H TRP 671 H TRP 671 4.277 -0.975 -8.064 80 HA TRP 671 HA TRP 671 5.205 1.148 -6.274 81 HB2 TRP 671 HB2 TRP 671 2.919 0.773 -5.170 82 HB3 TRP 671 HB3 TRP 671 2.947 1.542 -6.748 83 HD1 TRP 671 HD1 TRP 671 1.461 0.518 -8.526 84 HE1 TRP 671 HE1 TRP 671 0.104 -1.666 -8.782 85 HE3 TRP 671 HE3 TRP 671 3.133 -1.999 -4.404 86 HZ2 TRP 671 HZ2 TRP 671 -0.170 -4.182 -7.410 87 HZ3 TRP 671 HZ3 TRP 671 2.315 -4.283 -3.910 88 HH2 TRP 671 HH2 TRP 671 0.663 -5.373 -5.404 89 H TYR 672 H TYR 672 5.356 -2.148 -6.638 90 HA TYR 672 HA TYR 672 5.243 -2.826 -3.811 91 HB2 TYR 672 HB2 TYR 672 4.397 -4.441 -5.442 92 HB3 TYR 672 HB3 TYR 672 5.972 -4.490 -6.233 93 HD1 TYR 672 HD2 TYR 672 4.677 -4.671 -2.713 94 HD2 TYR 672 HD1 TYR 672 7.271 -6.350 -5.700 95 HE1 TYR 672 HE2 TYR 672 5.444 -6.380 -1.092 96 HE2 TYR 672 HE1 TYR 672 8.039 -8.055 -4.070 97 HH TYR 672 HH TYR 672 7.141 -9.132 -1.986 98 H ALA 673 H ALA 673 6.902 -2.430 -2.519 99 HA ALA 673 HA ALA 673 9.621 -2.350 -3.670 100 HB1 ALA 673 HB1 ALA 673 8.708 -0.371 -2.371 101 HB2 ALA 673 HB2 ALA 673 10.243 -1.012 -1.788 102 HB3 ALA 673 HB3 ALA 673 8.746 -1.398 -0.937 103 H GLY 674 H GLY 674 7.524 -4.246 -1.810 104 HA2 GLY 674 HA2 GLY 674 7.812 -6.016 -0.335 105 HA3 GLY 674 HA3 GLY 674 8.959 -6.522 -1.565 106 HA PRO 675 HA PRO 675 11.989 -6.447 1.648 107 HB2 PRO 675 HB2 PRO 675 14.250 -6.301 0.064 108 HB3 PRO 675 HB3 PRO 675 13.335 -7.791 0.363 109 HG2 PRO 675 HG2 PRO 675 13.262 -5.963 -1.985 110 HG3 PRO 675 HG3 PRO 675 13.186 -7.733 -1.927 111 HD2 PRO 675 HD2 PRO 675 10.973 -6.198 -2.304 112 HD3 PRO 675 HD3 PRO 675 10.913 -7.757 -1.447 113 H MET 676 H MET 676 10.849 -4.120 1.699 114 HA MET 676 HA MET 676 13.048 -2.125 1.666 115 HB2 MET 676 HB2 MET 676 11.424 -1.798 -0.231 116 HB3 MET 676 HB3 MET 676 10.163 -1.548 0.969 117 HG2 MET 676 HG2 MET 676 10.824 0.576 1.346 118 HG3 MET 676 HG3 MET 676 12.508 0.095 1.548 119 HE1 MET 676 HE1 MET 676 13.980 -0.617 -0.261 120 HE2 MET 676 HE2 MET 676 14.197 0.396 -1.688 121 HE3 MET 676 HE3 MET 676 14.286 1.109 -0.070 122 H GLU 677 H GLU 677 12.770 -0.410 3.220 123 HA GLU 677 HA GLU 677 11.270 -1.290 5.592 124 HB2 GLU 677 HB2 GLU 677 12.766 0.290 6.813 125 HB3 GLU 677 HB3 GLU 677 13.646 -1.003 5.991 126 HG2 GLU 677 HG2 GLU 677 14.587 0.426 4.464 127 HG3 GLU 677 HG3 GLU 677 13.168 1.468 4.414 128 H ARG 678 H ARG 678 10.202 0.376 6.864 129 HA ARG 678 HA ARG 678 8.417 1.911 5.382 130 HB2 ARG 678 HB2 ARG 678 8.144 1.183 7.774 131 HB3 ARG 678 HB3 ARG 678 9.245 2.485 8.229 132 HG2 ARG 678 HG2 ARG 678 7.086 3.299 6.400 133 HG3 ARG 678 HG3 ARG 678 6.530 2.776 7.989 134 HD2 ARG 678 HD2 ARG 678 8.846 4.452 8.295 135 HD3 ARG 678 HD3 ARG 678 7.672 5.264 7.265 136 HE ARG 678 HE ARG 678 6.375 4.151 9.537 137 HH11 ARG 678 HH21 ARG 678 8.402 6.767 8.479 138 HH12 ARG 678 HH22 ARG 678 7.954 7.771 9.837 139 HH21 ARG 678 HH11 ARG 678 5.827 5.473 11.245 140 HH22 ARG 678 HH12 ARG 678 6.563 7.070 11.375 141 H ALA 679 H ALA 679 11.162 3.130 7.306 142 HA ALA 679 HA ALA 679 10.936 5.796 6.516 143 HB1 ALA 679 HB1 ALA 679 12.693 6.057 7.895 144 HB2 ALA 679 HB2 ALA 679 13.711 5.047 6.868 145 HB3 ALA 679 HB3 ALA 679 12.701 4.306 8.110 146 H GLY 680 H GLY 680 12.517 3.051 5.020 147 HA2 GLY 680 HA2 GLY 680 13.848 4.491 2.948 148 HA3 GLY 680 HA3 GLY 680 13.433 2.776 2.907 149 H ALA 681 H ALA 681 10.755 2.780 3.194 150 HA ALA 681 HA ALA 681 9.738 3.198 0.649 151 HB1 ALA 681 HB1 ALA 681 8.687 1.830 2.468 152 HB2 ALA 681 HB2 ALA 681 7.549 2.879 1.624 153 HB3 ALA 681 HB3 ALA 681 8.146 3.329 3.221 154 H GLU 682 H GLU 682 9.342 5.371 3.501 155 HA GLU 682 HA GLU 682 8.005 7.344 1.894 156 HB2 GLU 682 HB2 GLU 682 8.296 8.851 3.887 157 HB3 GLU 682 HB3 GLU 682 7.412 7.367 4.182 158 HG2 GLU 682 HG2 GLU 682 9.756 6.424 4.884 159 HG3 GLU 682 HG3 GLU 682 10.176 8.120 5.058 160 H SER 683 H SER 683 11.275 6.583 2.346 161 HA SER 683 HA SER 683 12.493 9.094 2.132 162 HB2 SER 683 HB2 SER 683 14.450 7.934 1.469 163 HB3 SER 683 HB3 SER 683 13.585 6.797 2.500 164 HG SER 683 HG SER 683 12.886 5.697 0.719 165 H ILE 684 H ILE 684 11.245 6.899 -0.302 166 HA ILE 684 HA ILE 684 11.934 8.650 -2.512 167 HB ILE 684 HB ILE 684 10.077 6.270 -2.624 168 HG12 ILE 684 HG12 ILE 684 12.803 5.588 -3.272 169 HG13 ILE 684 HG13 ILE 684 12.751 6.257 -1.641 170 HG21 ILE 684 HG21 ILE 684 10.928 6.070 -4.888 171 HG22 ILE 684 HG22 ILE 684 10.402 7.735 -4.638 172 HG23 ILE 684 HG23 ILE 684 12.120 7.339 -4.594 173 HD11 ILE 684 HD11 ILE 684 11.595 3.735 -2.686 174 HD12 ILE 684 HD12 ILE 684 12.191 4.120 -1.072 175 HD13 ILE 684 HD13 ILE 684 10.575 4.630 -1.559 176 H LEU 685 H LEU 685 8.940 7.459 -1.007 177 HA LEU 685 HA LEU 685 7.111 8.966 -2.494 178 HB2 LEU 685 HB2 LEU 685 7.109 7.541 0.107 179 HB3 LEU 685 HB3 LEU 685 5.812 8.699 -0.160 180 HG LEU 685 HG LEU 685 5.047 7.554 -2.102 181 HD11 LEU 685 HD11 LEU 685 7.686 6.082 -1.950 182 HD12 LEU 685 HD12 LEU 685 6.345 5.538 -2.958 183 HD13 LEU 685 HD13 LEU 685 7.097 7.103 -3.261 184 HD21 LEU 685 HD21 LEU 685 5.003 5.092 -1.257 185 HD22 LEU 685 HD22 LEU 685 5.866 5.724 0.143 186 HD23 LEU 685 HD23 LEU 685 4.262 6.337 -0.253 187 H ALA 686 H ALA 686 8.718 9.794 0.608 188 HA ALA 686 HA ALA 686 7.349 12.251 0.948 189 HB1 ALA 686 HB1 ALA 686 8.686 11.090 2.708 190 HB2 ALA 686 HB2 ALA 686 9.039 12.809 2.554 191 HB3 ALA 686 HB3 ALA 686 10.151 11.616 1.877 192 H ASN 687 H ASN 687 10.256 11.362 -0.825 193 HA ASN 687 HA ASN 687 10.967 14.057 -1.539 194 HB2 ASN 687 HB2 ASN 687 12.597 12.163 -1.499 195 HB3 ASN 687 HB3 ASN 687 11.758 11.455 -2.875 196 HD21 ASN 687 HD21 ASN 687 13.671 14.297 -1.872 197 HD22 ASN 687 HD22 ASN 687 14.122 14.741 -3.446 198 H ARG 688 H ARG 688 9.157 11.405 -3.039 199 HA ARG 688 HA ARG 688 8.709 12.655 -5.552 200 HB2 ARG 688 HB2 ARG 688 7.862 10.252 -4.182 201 HB3 ARG 688 HB3 ARG 688 6.524 10.990 -5.057 202 HG2 ARG 688 HG2 ARG 688 7.455 9.763 -6.774 203 HG3 ARG 688 HG3 ARG 688 8.377 11.256 -6.956 204 HD2 ARG 688 HD2 ARG 688 9.756 9.821 -4.998 205 HD3 ARG 688 HD3 ARG 688 9.284 8.618 -6.176 206 HE ARG 688 HE ARG 688 10.628 9.698 -7.791 207 HH11 ARG 688 HH21 ARG 688 10.454 11.426 -4.820 208 HH12 ARG 688 HH22 ARG 688 11.874 12.382 -5.130 209 HH21 ARG 688 HH11 ARG 688 12.453 10.951 -8.207 210 HH22 ARG 688 HH12 ARG 688 12.974 12.119 -7.046 211 H SER 689 H SER 689 6.300 13.008 -6.267 212 HA SER 689 HA SER 689 5.287 15.216 -4.686 213 HB2 SER 689 HB2 SER 689 5.280 15.414 -7.113 214 HB3 SER 689 HB3 SER 689 4.284 13.967 -7.257 215 HG SER 689 HG SER 689 2.573 15.054 -6.538 216 H ASP 690 H ASP 690 2.869 15.363 -4.342 217 HA ASP 690 HA ASP 690 2.030 13.315 -2.586 218 HB2 ASP 690 HB2 ASP 690 0.992 15.860 -3.553 219 HB3 ASP 690 HB3 ASP 690 -0.276 14.665 -3.300 220 H GLY 691 H GLY 691 0.743 11.587 -2.830 221 HA2 GLY 691 HA2 GLY 691 -0.999 10.360 -3.979 222 HA3 GLY 691 HA3 GLY 691 -0.476 11.106 -5.487 223 H THR 692 H THR 692 2.349 10.624 -4.213 224 HA THR 692 HA THR 692 2.900 8.237 -5.705 225 HB THR 692 HB THR 692 4.756 9.477 -3.667 226 HG1 THR 692 HG1 THR 692 4.226 11.229 -4.857 227 HG21 THR 692 HG21 THR 692 5.542 8.489 -6.368 228 HG22 THR 692 HG22 THR 692 6.421 8.405 -4.842 229 HG23 THR 692 HG23 THR 692 5.096 7.286 -5.158 230 H PHE 693 H PHE 693 2.976 6.152 -4.985 231 HA PHE 693 HA PHE 693 2.992 5.701 -2.071 232 HB2 PHE 693 HB2 PHE 693 1.045 4.309 -2.124 233 HB3 PHE 693 HB3 PHE 693 0.623 5.835 -2.898 234 HD1 PHE 693 HD2 PHE 693 1.374 2.267 -3.468 235 HD2 PHE 693 HD1 PHE 693 0.204 5.974 -5.287 236 HE1 PHE 693 HE2 PHE 693 0.720 1.053 -5.524 237 HE2 PHE 693 HE1 PHE 693 -0.450 4.758 -7.348 238 HZ PHE 693 HZ PHE 693 -0.188 2.296 -7.467 239 H LEU 694 H LEU 694 3.167 3.370 -1.521 240 HA LEU 694 HA LEU 694 4.114 1.522 -3.491 241 HB2 LEU 694 HB2 LEU 694 6.418 1.463 -3.054 242 HB3 LEU 694 HB3 LEU 694 6.064 3.188 -3.124 243 HG LEU 694 HG LEU 694 5.654 2.858 -0.519 244 HD11 LEU 694 HD11 LEU 694 7.871 1.156 -0.208 245 HD12 LEU 694 HD12 LEU 694 6.199 0.800 0.218 246 HD13 LEU 694 HD13 LEU 694 6.822 0.340 -1.365 247 HD21 LEU 694 HD21 LEU 694 7.578 4.045 -0.311 248 HD22 LEU 694 HD22 LEU 694 8.542 2.810 -1.119 249 HD23 LEU 694 HD23 LEU 694 7.619 3.973 -2.070 250 H VAL 695 H VAL 695 4.917 -0.512 -2.474 251 HA VAL 695 HA VAL 695 3.922 -0.858 0.292 252 HB VAL 695 HB VAL 695 3.400 -2.776 -1.989 253 HG11 VAL 695 HG11 VAL 695 3.439 -3.125 0.837 254 HG12 VAL 695 HG12 VAL 695 1.750 -3.119 0.342 255 HG13 VAL 695 HG13 VAL 695 2.877 -4.263 -0.382 256 HG21 VAL 695 HG21 VAL 695 1.042 -1.689 -0.728 257 HG22 VAL 695 HG22 VAL 695 2.065 -0.371 -1.297 258 HG23 VAL 695 HG23 VAL 695 1.523 -1.610 -2.424 259 H ARG 696 H ARG 696 5.086 -2.253 1.565 260 HA ARG 696 HA ARG 696 7.396 -3.616 0.311 261 HB2 ARG 696 HB2 ARG 696 8.671 -3.023 2.395 262 HB3 ARG 696 HB3 ARG 696 8.256 -1.643 1.374 263 HG2 ARG 696 HG2 ARG 696 6.318 -1.144 2.805 264 HG3 ARG 696 HG3 ARG 696 6.702 -2.536 3.818 265 HD2 ARG 696 HD2 ARG 696 8.696 -0.325 3.315 266 HD3 ARG 696 HD3 ARG 696 7.537 -0.254 4.637 267 HE ARG 696 HE ARG 696 9.622 -2.358 4.319 268 HH11 ARG 696 HH21 ARG 696 7.479 -0.447 6.263 269 HH12 ARG 696 HH22 ARG 696 8.040 -1.121 7.749 270 HH21 ARG 696 HH11 ARG 696 10.322 -3.202 6.261 271 HH22 ARG 696 HH12 ARG 696 9.630 -2.661 7.758 272 H GLN 697 H GLN 697 8.370 -5.256 1.869 273 HA GLN 697 HA GLN 697 6.152 -6.799 3.074 274 HB2 GLN 697 HB2 GLN 697 7.098 -8.141 1.442 275 HB3 GLN 697 HB3 GLN 697 8.721 -7.522 1.726 276 HG2 GLN 697 HG2 GLN 697 8.506 -9.835 2.556 277 HG3 GLN 697 HG3 GLN 697 8.811 -8.724 3.883 278 HE21 GLN 697 HE21 GLN 697 7.764 -10.116 5.449 279 HE22 GLN 697 HE22 GLN 697 6.078 -10.358 5.463 280 H ARG 698 H ARG 698 5.997 -6.666 5.205 281 HA ARG 698 HA ARG 698 7.566 -7.530 7.166 282 HB2 ARG 698 HB2 ARG 698 8.826 -5.110 6.078 283 HB3 ARG 698 HB3 ARG 698 8.537 -5.016 7.808 284 HG2 ARG 698 HG2 ARG 698 9.566 -7.636 7.044 285 HG3 ARG 698 HG3 ARG 698 10.662 -6.342 6.569 286 HD2 ARG 698 HD2 ARG 698 11.111 -7.182 8.879 287 HD3 ARG 698 HD3 ARG 698 10.709 -5.470 8.836 288 HE ARG 698 HE ARG 698 8.792 -5.933 10.060 289 HH11 ARG 698 HH21 ARG 698 10.041 -8.823 8.658 290 HH12 ARG 698 HH22 ARG 698 8.968 -9.865 9.521 291 HH21 ARG 698 HH11 ARG 698 7.397 -7.272 11.197 292 HH22 ARG 698 HH12 ARG 698 7.483 -8.995 10.957 293 H VAL 699 H VAL 699 6.976 -6.754 9.317 294 HA VAL 699 HA VAL 699 5.009 -4.638 9.555 295 HB VAL 699 HB VAL 699 3.678 -6.574 8.708 296 HG11 VAL 699 HG11 VAL 699 4.723 -7.825 11.260 297 HG12 VAL 699 HG12 VAL 699 3.273 -8.405 10.446 298 HG13 VAL 699 HG13 VAL 699 4.828 -8.458 9.617 299 HG21 VAL 699 HG21 VAL 699 3.170 -4.884 10.930 300 HG22 VAL 699 HG22 VAL 699 1.991 -5.665 9.887 301 HG23 VAL 699 HG23 VAL 699 2.536 -6.474 11.353 302 H LYS 700 H LYS 700 4.443 -4.161 11.752 303 HA LYS 700 HA LYS 700 6.479 -5.080 13.668 304 HB2 LYS 700 HB2 LYS 700 5.882 -3.069 14.964 305 HB3 LYS 700 HB3 LYS 700 6.363 -2.665 13.318 306 HG2 LYS 700 HG2 LYS 700 4.444 -1.433 13.340 307 HG3 LYS 700 HG3 LYS 700 3.682 -2.975 12.962 308 HD2 LYS 700 HD2 LYS 700 2.869 -3.257 15.117 309 HD3 LYS 700 HD3 LYS 700 4.159 -2.303 15.842 310 HE2 LYS 700 HE2 LYS 700 2.033 -1.079 15.962 311 HE3 LYS 700 HE3 LYS 700 3.159 -0.245 14.892 312 HZ1 LYS 700 HZ1 LYS 700 1.537 -2.224 13.527 313 HZ2 LYS 700 HZ2 LYS 700 0.597 -0.969 14.252 314 HZ3 LYS 700 HZ3 LYS 700 1.845 -0.566 13.136 315 H ASP 701 H ASP 701 2.952 -4.712 13.323 316 HA ASP 701 HA ASP 701 2.582 -6.085 15.895 317 HB2 ASP 701 HB2 ASP 701 0.143 -5.500 15.504 318 HB3 ASP 701 HB3 ASP 701 1.225 -4.131 15.725 319 H ALA 702 H ALA 702 0.146 -6.346 13.429 320 HA ALA 702 HA ALA 702 0.883 -9.178 12.957 321 HB1 ALA 702 HB1 ALA 702 -1.262 -9.949 13.457 322 HB2 ALA 702 HB2 ALA 702 -1.988 -8.351 13.270 323 HB3 ALA 702 HB3 ALA 702 -1.013 -8.716 14.695 324 H ALA 703 H ALA 703 1.387 -9.215 10.861 325 HA ALA 703 HA ALA 703 -0.455 -9.067 8.799 326 HB1 ALA 703 HB1 ALA 703 -0.647 -6.915 8.173 327 HB2 ALA 703 HB2 ALA 703 1.102 -6.694 8.190 328 HB3 ALA 703 HB3 ALA 703 0.171 -6.471 9.668 329 H GLU 704 H GLU 704 1.197 -8.021 6.706 330 HA GLU 704 HA GLU 704 3.685 -9.585 6.999 331 HB2 GLU 704 HB2 GLU 704 1.429 -10.197 5.228 332 HB3 GLU 704 HB3 GLU 704 2.977 -10.093 4.385 333 HG2 GLU 704 HG2 GLU 704 2.683 -11.660 6.951 334 HG3 GLU 704 HG3 GLU 704 2.343 -12.387 5.383 335 H PHE 705 H PHE 705 1.979 -7.714 4.483 336 HA PHE 705 HA PHE 705 4.509 -6.373 3.845 337 HB2 PHE 705 HB2 PHE 705 1.848 -6.274 2.408 338 HB3 PHE 705 HB3 PHE 705 3.363 -5.591 1.831 339 HD1 PHE 705 HD1 PHE 705 1.655 -8.780 2.710 340 HD2 PHE 705 HD2 PHE 705 5.009 -6.935 0.772 341 HE1 PHE 705 HE1 PHE 705 2.269 -10.957 1.705 342 HE2 PHE 705 HE2 PHE 705 5.622 -9.116 -0.238 343 HZ PHE 705 HZ PHE 705 4.251 -11.127 0.228 344 H ALA 706 H ALA 706 4.101 -3.982 3.103 345 HA ALA 706 HA ALA 706 2.223 -2.616 4.895 346 HB1 ALA 706 HB1 ALA 706 3.969 -2.372 6.367 347 HB2 ALA 706 HB2 ALA 706 4.286 -0.983 5.323 348 HB3 ALA 706 HB3 ALA 706 5.191 -2.483 5.101 349 H ILE 707 H ILE 707 1.249 -0.985 3.930 350 HA ILE 707 HA ILE 707 2.189 -0.164 1.263 351 HB ILE 707 HB ILE 707 -0.374 0.674 2.625 352 HG12 ILE 707 HG12 ILE 707 -1.239 -1.291 1.055 353 HG13 ILE 707 HG13 ILE 707 0.382 -1.925 1.341 354 HG21 ILE 707 HG21 ILE 707 -0.995 0.534 0.049 355 HG22 ILE 707 HG22 ILE 707 -0.167 1.954 0.696 356 HG23 ILE 707 HG23 ILE 707 0.749 0.710 -0.157 357 HD11 ILE 707 HD11 ILE 707 -1.873 -1.987 3.098 358 HD12 ILE 707 HD12 ILE 707 -0.263 -2.648 3.369 359 HD13 ILE 707 HD13 ILE 707 -0.631 -0.990 3.838 360 H SER 708 H SER 708 2.677 1.935 0.741 361 HA SER 708 HA SER 708 2.629 3.939 2.905 362 HB2 SER 708 HB2 SER 708 5.027 3.149 1.246 363 HB3 SER 708 HB3 SER 708 4.940 4.656 2.152 364 HG SER 708 HG SER 708 4.796 1.985 3.140 365 H ILE 709 H ILE 709 1.669 5.759 2.196 366 HA ILE 709 HA ILE 709 1.774 6.362 -0.711 367 HB ILE 709 HB ILE 709 -0.553 7.197 0.988 368 HG12 ILE 709 HG12 ILE 709 -1.600 5.021 -0.125 369 HG13 ILE 709 HG13 ILE 709 0.066 4.448 -0.007 370 HG21 ILE 709 HG21 ILE 709 0.164 7.595 -1.670 371 HG22 ILE 709 HG22 ILE 709 -1.017 6.286 -1.751 372 HG23 ILE 709 HG23 ILE 709 -1.449 7.816 -0.988 373 HD11 ILE 709 HD11 ILE 709 -1.236 5.782 2.351 374 HD12 ILE 709 HD12 ILE 709 -1.536 4.073 2.017 375 HD13 ILE 709 HD13 ILE 709 0.101 4.636 2.323 376 H LYS 710 H LYS 710 2.288 8.384 -1.288 377 HA LYS 710 HA LYS 710 2.989 10.280 0.831 378 HB2 LYS 710 HB2 LYS 710 4.651 10.075 -0.901 379 HB3 LYS 710 HB3 LYS 710 3.433 10.250 -2.163 380 HG2 LYS 710 HG2 LYS 710 4.487 12.371 -2.028 381 HG3 LYS 710 HG3 LYS 710 2.953 12.561 -1.189 382 HD2 LYS 710 HD2 LYS 710 3.938 12.685 0.900 383 HD3 LYS 710 HD3 LYS 710 5.370 11.763 0.410 384 HE2 LYS 710 HE2 LYS 710 4.723 14.521 -0.669 385 HE3 LYS 710 HE3 LYS 710 5.765 14.252 0.730 386 HZ1 LYS 710 HZ1 LYS 710 6.683 12.481 -1.164 387 HZ2 LYS 710 HZ2 LYS 710 6.363 13.900 -2.067 388 HZ3 LYS 710 HZ3 LYS 710 7.425 13.969 -0.724 389 H TYR 711 H TYR 711 1.143 11.165 1.590 390 HA TYR 711 HA TYR 711 -0.460 12.744 -0.310 391 HB2 TYR 711 HB2 TYR 711 -1.625 10.583 0.031 392 HB3 TYR 711 HB3 TYR 711 -1.631 10.880 1.768 393 HD1 TYR 711 HD1 TYR 711 -2.349 12.988 -1.259 394 HD2 TYR 711 HD2 TYR 711 -3.714 11.518 2.532 395 HE1 TYR 711 HE1 TYR 711 -4.434 14.312 -1.499 396 HE2 TYR 711 HE2 TYR 711 -5.805 12.836 2.296 397 HH TYR 711 HH TYR 711 -7.058 13.831 -0.249 398 H ASN 712 H ASN 712 -0.199 14.740 0.379 399 HA ASN 712 HA ASN 712 -0.562 16.557 1.801 400 HB2 ASN 712 HB2 ASN 712 -2.078 15.077 3.189 401 HB3 ASN 712 HB3 ASN 712 -0.647 14.589 4.094 402 HD21 ASN 712 HD21 ASN 712 -0.364 15.739 5.962 403 HD22 ASN 712 HD22 ASN 712 -0.824 17.366 6.182 404 H VAL 713 H VAL 713 1.825 15.967 0.804 405 HA VAL 713 HA VAL 713 4.118 15.970 1.113 406 HB VAL 713 HB VAL 713 4.923 17.803 2.490 407 HG11 VAL 713 HG11 VAL 713 2.441 18.149 0.847 408 HG12 VAL 713 HG12 VAL 713 3.078 19.548 1.711 409 HG13 VAL 713 HG13 VAL 713 4.084 18.711 0.528 410 HG21 VAL 713 HG21 VAL 713 2.101 18.114 3.551 411 HG22 VAL 713 HG22 VAL 713 3.360 17.261 4.444 412 HG23 VAL 713 HG23 VAL 713 3.552 18.972 4.068 413 H GLU 714 H GLU 714 2.840 13.838 2.391 414 HA GLU 714 HA GLU 714 4.884 13.100 4.307 415 HB2 GLU 714 HB2 GLU 714 3.384 12.597 6.133 416 HB3 GLU 714 HB3 GLU 714 3.109 14.279 5.670 417 HG2 GLU 714 HG2 GLU 714 1.205 13.526 4.237 418 HG3 GLU 714 HG3 GLU 714 1.436 11.887 4.838 419 H VAL 715 H VAL 715 4.912 10.811 4.689 420 HA VAL 715 HA VAL 715 3.413 9.309 2.639 421 HB VAL 715 HB VAL 715 5.822 8.348 4.166 422 HG11 VAL 715 HG11 VAL 715 4.445 6.668 2.967 423 HG12 VAL 715 HG12 VAL 715 4.625 7.597 1.478 424 HG13 VAL 715 HG13 VAL 715 6.034 6.843 2.225 425 HG21 VAL 715 HG21 VAL 715 6.763 10.204 3.122 426 HG22 VAL 715 HG22 VAL 715 6.918 9.005 1.841 427 HG23 VAL 715 HG23 VAL 715 5.602 10.174 1.797 428 H LYS 716 H LYS 716 1.660 8.270 3.383 429 HA LYS 716 HA LYS 716 1.500 7.574 6.230 430 HB2 LYS 716 HB2 LYS 716 -0.635 6.949 4.200 431 HB3 LYS 716 HB3 LYS 716 -0.808 7.308 5.918 432 HG2 LYS 716 HG2 LYS 716 0.421 9.590 4.888 433 HG3 LYS 716 HG3 LYS 716 -0.743 9.141 3.640 434 HD2 LYS 716 HD2 LYS 716 -2.560 9.146 5.248 435 HD3 LYS 716 HD3 LYS 716 -1.431 9.401 6.582 436 HE2 LYS 716 HE2 LYS 716 -0.858 11.459 4.759 437 HE3 LYS 716 HE3 LYS 716 -2.619 11.362 4.794 438 HZ1 LYS 716 HZ1 LYS 716 -2.205 12.726 6.567 439 HZ2 LYS 716 HZ2 LYS 716 -2.226 11.221 7.352 440 HZ3 LYS 716 HZ3 LYS 716 -0.724 11.970 6.986 441 H HIS 717 H HIS 717 2.227 5.682 6.912 442 HA HIS 717 HA HIS 717 2.428 3.443 5.021 443 HB2 HIS 717 HB2 HIS 717 3.696 3.635 7.743 444 HB3 HIS 717 HB3 HIS 717 4.117 2.549 6.419 445 HD1 HIS 717 HD1 HIS 717 5.200 3.674 4.255 446 HD2 HIS 717 HD2 HIS 717 4.898 6.138 7.628 447 HE1 HIS 717 HE1 HIS 717 6.811 5.606 3.903 448 HE2 HIS 717 HE2 HIS 717 6.652 7.124 5.959 449 H ILE 718 H ILE 718 1.423 1.591 5.298 450 HA ILE 718 HA ILE 718 0.081 0.987 7.844 451 HB ILE 718 HB ILE 718 -1.358 0.783 5.191 452 HG12 ILE 718 HG12 ILE 718 -2.333 2.656 7.271 453 HG13 ILE 718 HG13 ILE 718 -0.856 3.152 6.447 454 HG21 ILE 718 HG21 ILE 718 -3.321 0.504 6.793 455 HG22 ILE 718 HG22 ILE 718 -2.179 -0.840 6.746 456 HG23 ILE 718 HG23 ILE 718 -2.130 0.315 8.080 457 HD11 ILE 718 HD11 ILE 718 -3.561 2.592 5.271 458 HD12 ILE 718 HD12 ILE 718 -2.536 4.012 5.063 459 HD13 ILE 718 HD13 ILE 718 -2.106 2.493 4.274 460 H LYS 719 H LYS 719 -0.031 -1.157 8.276 461 HA LYS 719 HA LYS 719 1.637 -2.923 6.697 462 HB2 LYS 719 HB2 LYS 719 0.747 -4.532 8.605 463 HB3 LYS 719 HB3 LYS 719 1.985 -3.320 8.939 464 HG2 LYS 719 HG2 LYS 719 0.562 -1.996 10.154 465 HG3 LYS 719 HG3 LYS 719 -0.835 -2.397 9.150 466 HD2 LYS 719 HD2 LYS 719 0.381 -4.505 10.900 467 HD3 LYS 719 HD3 LYS 719 -0.705 -3.303 11.597 468 HE2 LYS 719 HE2 LYS 719 -2.383 -3.888 9.820 469 HE3 LYS 719 HE3 LYS 719 -1.321 -5.207 9.326 470 HZ1 LYS 719 HZ1 LYS 719 -1.804 -5.094 12.164 471 HZ2 LYS 719 HZ2 LYS 719 -3.234 -5.380 11.226 472 HZ3 LYS 719 HZ3 LYS 719 -1.874 -6.430 11.094 473 H ILE 720 H ILE 720 0.987 -4.764 5.599 474 HA ILE 720 HA ILE 720 -1.925 -4.957 5.088 475 HB ILE 720 HB ILE 720 0.320 -4.886 3.309 476 HG12 ILE 720 HG12 ILE 720 -2.552 -5.477 2.594 477 HG13 ILE 720 HG13 ILE 720 -2.060 -3.891 3.184 478 HG21 ILE 720 HG21 ILE 720 -0.126 -6.867 1.945 479 HG22 ILE 720 HG22 ILE 720 0.317 -7.378 3.573 480 HG23 ILE 720 HG23 ILE 720 -1.374 -7.396 3.071 481 HD11 ILE 720 HD11 ILE 720 -1.483 -3.397 1.061 482 HD12 ILE 720 HD12 ILE 720 -0.148 -4.532 1.245 483 HD13 ILE 720 HD13 ILE 720 -1.679 -5.072 0.556 484 H MET 721 H MET 721 -2.953 -6.888 5.213 485 HA MET 721 HA MET 721 -1.490 -9.064 6.570 486 HB2 MET 721 HB2 MET 721 -3.730 -7.861 7.414 487 HB3 MET 721 HB3 MET 721 -4.464 -9.060 6.350 488 HG2 MET 721 HG2 MET 721 -4.260 -10.528 8.058 489 HG3 MET 721 HG3 MET 721 -2.520 -10.495 7.762 490 HE1 MET 721 HE1 MET 721 -3.824 -10.762 11.183 491 HE2 MET 721 HE2 MET 721 -2.772 -11.443 9.944 492 HE3 MET 721 HE3 MET 721 -2.085 -10.486 11.261 493 H THR 722 H THR 722 -2.572 -11.283 6.021 494 HA THR 722 HA THR 722 -3.196 -11.457 3.145 495 HB THR 722 HB THR 722 -0.825 -11.924 3.266 496 HG1 THR 722 HG1 THR 722 -2.241 -14.374 3.206 497 HG21 THR 722 HG21 THR 722 0.183 -13.355 4.814 498 HG22 THR 722 HG22 THR 722 -1.061 -12.582 5.795 499 HG23 THR 722 HG23 THR 722 -1.322 -14.207 5.158 500 H ALA 723 H ALA 723 -5.260 -11.571 4.598 501 HA ALA 723 HA ALA 723 -5.875 -13.936 6.018 502 HB1 ALA 723 HB1 ALA 723 -8.273 -13.213 5.570 503 HB2 ALA 723 HB2 ALA 723 -7.597 -11.861 4.660 504 HB3 ALA 723 HB3 ALA 723 -7.250 -12.028 6.382 505 H GLU 724 H GLU 724 -5.940 -15.916 5.239 506 HA GLU 724 HA GLU 724 -6.107 -17.671 3.750 507 HB2 GLU 724 HB2 GLU 724 -8.523 -16.342 2.585 508 HB3 GLU 724 HB3 GLU 724 -8.283 -18.028 3.043 509 HG2 GLU 724 HG2 GLU 724 -8.899 -15.664 4.801 510 HG3 GLU 724 HG3 GLU 724 -9.693 -17.233 4.743 511 H GLY 725 H GLY 725 -4.698 -15.180 2.853 512 HA2 GLY 725 HA2 GLY 725 -3.338 -15.090 0.873 513 HA3 GLY 725 HA3 GLY 725 -4.670 -15.802 -0.032 514 H LEU 726 H LEU 726 -6.422 -13.813 1.669 515 HA LEU 726 HA LEU 726 -6.404 -11.752 -0.376 516 HB2 LEU 726 HB2 LEU 726 -8.102 -11.793 2.122 517 HB3 LEU 726 HB3 LEU 726 -8.423 -10.950 0.608 518 HG LEU 726 HG LEU 726 -8.219 -13.965 0.804 519 HD11 LEU 726 HD11 LEU 726 -10.293 -14.028 1.660 520 HD12 LEU 726 HD12 LEU 726 -10.287 -12.269 1.788 521 HD13 LEU 726 HD13 LEU 726 -10.887 -13.045 0.322 522 HD21 LEU 726 HD21 LEU 726 -9.277 -13.908 -1.384 523 HD22 LEU 726 HD22 LEU 726 -9.474 -12.158 -1.284 524 HD23 LEU 726 HD23 LEU 726 -7.861 -12.859 -1.423 525 H TYR 727 H TYR 727 -5.646 -9.697 -0.186 526 HA TYR 727 HA TYR 727 -4.151 -9.104 2.271 527 HB2 TYR 727 HB2 TYR 727 -3.975 -8.082 -0.551 528 HB3 TYR 727 HB3 TYR 727 -3.174 -7.262 0.783 529 HD1 TYR 727 HD2 TYR 727 -3.585 -10.950 0.767 530 HD2 TYR 727 HD1 TYR 727 -0.961 -7.687 -0.077 531 HE1 TYR 727 HE2 TYR 727 -1.682 -12.524 0.611 532 HE2 TYR 727 HE1 TYR 727 0.945 -9.245 -0.248 533 HH TYR 727 HH TYR 727 0.650 -12.586 0.680 534 H ARG 728 H ARG 728 -4.329 -7.127 3.317 535 HA ARG 728 HA ARG 728 -6.510 -5.318 2.562 536 HB2 ARG 728 HB2 ARG 728 -7.069 -5.554 5.201 537 HB3 ARG 728 HB3 ARG 728 -7.914 -6.460 3.951 538 HG2 ARG 728 HG2 ARG 728 -6.372 -8.352 4.244 539 HG3 ARG 728 HG3 ARG 728 -5.460 -7.439 5.446 540 HD2 ARG 728 HD2 ARG 728 -8.287 -7.476 6.103 541 HD3 ARG 728 HD3 ARG 728 -7.662 -9.117 5.921 542 HE ARG 728 HE ARG 728 -5.948 -7.417 7.522 543 HH11 ARG 728 HH21 ARG 728 -8.724 -9.470 7.538 544 HH12 ARG 728 HH22 ARG 728 -8.592 -9.839 9.219 545 HH21 ARG 728 HH11 ARG 728 -5.773 -7.862 9.667 546 HH22 ARG 728 HH12 ARG 728 -6.916 -8.946 10.430 547 H ILE 729 H ILE 729 -6.258 -3.258 3.314 548 HA ILE 729 HA ILE 729 -3.684 -2.648 4.599 549 HB ILE 729 HB ILE 729 -5.671 -0.685 3.456 550 HG12 ILE 729 HG12 ILE 729 -3.446 -2.216 2.082 551 HG13 ILE 729 HG13 ILE 729 -5.159 -2.230 1.670 552 HG21 ILE 729 HG21 ILE 729 -3.136 0.291 3.085 553 HG22 ILE 729 HG22 ILE 729 -4.155 0.671 4.473 554 HG23 ILE 729 HG23 ILE 729 -2.945 -0.605 4.591 555 HD11 ILE 729 HD11 ILE 729 -4.715 -0.558 0.229 556 HD12 ILE 729 HD12 ILE 729 -4.459 0.473 1.638 557 HD13 ILE 729 HD13 ILE 729 -3.092 -0.344 0.886 558 H THR 730 H THR 730 -7.144 -2.321 5.025 559 HA THR 730 HA THR 730 -6.716 -1.015 7.641 560 HB THR 730 HB THR 730 -8.231 0.142 6.116 561 HG1 THR 730 HG1 THR 730 -9.467 0.615 7.734 562 HG21 THR 730 HG21 THR 730 -10.088 -0.813 5.115 563 HG22 THR 730 HG22 THR 730 -8.978 -2.184 5.109 564 HG23 THR 730 HG23 THR 730 -10.228 -2.064 6.345 565 H GLU 731 H GLU 731 -7.234 -3.950 6.222 566 HA GLU 731 HA GLU 731 -7.530 -6.025 7.122 567 HB2 GLU 731 HB2 GLU 731 -8.065 -4.731 9.789 568 HB3 GLU 731 HB3 GLU 731 -7.440 -6.348 9.466 569 HG2 GLU 731 HG2 GLU 731 -5.668 -4.675 8.108 570 HG3 GLU 731 HG3 GLU 731 -5.998 -3.797 9.597 571 H LYS 732 H LYS 732 -9.814 -3.538 7.306 572 HA LYS 732 HA LYS 732 -12.063 -5.169 8.120 573 HB2 LYS 732 HB2 LYS 732 -12.241 -2.507 6.716 574 HB3 LYS 732 HB3 LYS 732 -13.352 -3.204 7.901 575 HG2 LYS 732 HG2 LYS 732 -10.530 -2.225 8.438 576 HG3 LYS 732 HG3 LYS 732 -12.022 -1.452 8.963 577 HD2 LYS 732 HD2 LYS 732 -11.711 -4.306 9.735 578 HD3 LYS 732 HD3 LYS 732 -10.620 -3.174 10.520 579 HE2 LYS 732 HE2 LYS 732 -13.347 -2.155 10.399 580 HE3 LYS 732 HE3 LYS 732 -13.243 -3.691 11.263 581 HZ1 LYS 732 HZ1 LYS 732 -12.784 -1.472 12.513 582 HZ2 LYS 732 HZ2 LYS 732 -11.816 -2.857 12.837 583 HZ3 LYS 732 HZ3 LYS 732 -11.227 -1.608 11.806 584 H LYS 733 H LYS 733 -10.691 -3.965 5.107 585 HA LYS 733 HA LYS 733 -12.486 -5.787 3.620 586 HB2 LYS 733 HB2 LYS 733 -13.284 -3.666 2.983 587 HB3 LYS 733 HB3 LYS 733 -11.672 -2.955 2.985 588 HG2 LYS 733 HG2 LYS 733 -12.485 -3.316 0.677 589 HG3 LYS 733 HG3 LYS 733 -11.062 -4.302 1.006 590 HD2 LYS 733 HD2 LYS 733 -12.323 -6.291 1.162 591 HD3 LYS 733 HD3 LYS 733 -13.829 -5.423 1.444 592 HE2 LYS 733 HE2 LYS 733 -14.235 -5.718 -0.762 593 HE3 LYS 733 HE3 LYS 733 -13.025 -4.464 -1.030 594 HZ1 LYS 733 HZ1 LYS 733 -12.901 -7.186 -1.724 595 HZ2 LYS 733 HZ2 LYS 733 -11.755 -5.972 -2.023 596 HZ3 LYS 733 HZ3 LYS 733 -11.662 -6.884 -0.585 597 H ALA 734 H ALA 734 -11.354 -7.378 2.738 598 HA ALA 734 HA ALA 734 -8.505 -6.944 2.123 599 HB1 ALA 734 HB1 ALA 734 -8.173 -9.262 2.405 600 HB2 ALA 734 HB2 ALA 734 -9.890 -9.620 2.210 601 HB3 ALA 734 HB3 ALA 734 -9.313 -8.836 3.682 602 H PHE 735 H PHE 735 -7.674 -8.175 0.218 603 HA PHE 735 HA PHE 735 -9.656 -8.389 -1.963 604 HB2 PHE 735 HB2 PHE 735 -7.362 -6.525 -1.789 605 HB3 PHE 735 HB3 PHE 735 -7.580 -7.347 -3.334 606 HD1 PHE 735 HD2 PHE 735 -9.658 -7.069 -4.635 607 HD2 PHE 735 HD1 PHE 735 -9.017 -4.952 -0.951 608 HE1 PHE 735 HE2 PHE 735 -11.544 -5.553 -5.176 609 HE2 PHE 735 HE1 PHE 735 -10.901 -3.438 -1.494 610 HZ PHE 735 HZ PHE 735 -12.165 -3.737 -3.606 611 H ARG 736 H ARG 736 -8.804 -9.553 -3.861 612 HA ARG 736 HA ARG 736 -8.021 -12.086 -3.454 613 HB2 ARG 736 HB2 ARG 736 -7.958 -10.296 -5.707 614 HB3 ARG 736 HB3 ARG 736 -6.579 -11.392 -5.764 615 HG2 ARG 736 HG2 ARG 736 -7.987 -12.954 -6.578 616 HG3 ARG 736 HG3 ARG 736 -8.722 -13.015 -4.976 617 HD2 ARG 736 HD2 ARG 736 -10.443 -12.570 -6.640 618 HD3 ARG 736 HD3 ARG 736 -10.227 -11.154 -5.621 619 HE ARG 736 HE ARG 736 -9.256 -9.992 -7.422 620 HH11 ARG 736 HH21 ARG 736 -9.954 -13.296 -8.215 621 HH12 ARG 736 HH22 ARG 736 -9.573 -13.109 -9.888 622 HH21 ARG 736 HH11 ARG 736 -8.691 -9.770 -9.569 623 HH22 ARG 736 HH12 ARG 736 -8.868 -11.122 -10.656 624 H GLY 737 H GLY 737 -5.755 -9.428 -3.998 625 HA2 GLY 737 HA2 GLY 737 -3.739 -10.707 -2.358 626 HA3 GLY 737 HA3 GLY 737 -3.328 -10.551 -4.067 627 H LEU 738 H LEU 738 -1.599 -9.216 -3.034 628 HA LEU 738 HA LEU 738 -2.214 -6.689 -1.873 629 HB2 LEU 738 HB2 LEU 738 0.079 -8.116 -2.120 630 HB3 LEU 738 HB3 LEU 738 0.315 -6.915 -3.389 631 HG LEU 738 HG LEU 738 -0.599 -6.094 -0.638 632 HD11 LEU 738 HD11 LEU 738 1.611 -7.448 -0.676 633 HD12 LEU 738 HD12 LEU 738 2.277 -6.039 -1.492 634 HD13 LEU 738 HD13 LEU 738 1.603 -5.884 0.128 635 HD21 LEU 738 HD21 LEU 738 0.306 -4.800 -3.129 636 HD22 LEU 738 HD22 LEU 738 -0.793 -4.215 -1.878 637 HD23 LEU 738 HD23 LEU 738 0.951 -4.112 -1.640 638 H THR 739 H THR 739 -1.390 -7.726 -5.151 639 HA THR 739 HA THR 739 -1.403 -5.242 -6.413 640 HB THR 739 HB THR 739 -2.451 -7.826 -7.589 641 HG1 THR 739 HG1 THR 739 -0.488 -8.497 -7.390 642 HG21 THR 739 HG21 THR 739 -1.672 -6.829 -9.708 643 HG22 THR 739 HG22 THR 739 -2.902 -5.831 -8.936 644 HG23 THR 739 HG23 THR 739 -1.204 -5.367 -8.839 645 H GLU 740 H GLU 740 -4.096 -7.560 -6.019 646 HA GLU 740 HA GLU 740 -6.083 -5.854 -7.127 647 HB2 GLU 740 HB2 GLU 740 -6.257 -8.190 -5.216 648 HB3 GLU 740 HB3 GLU 740 -7.674 -7.366 -5.863 649 HG2 GLU 740 HG2 GLU 740 -5.876 -7.962 -8.031 650 HG3 GLU 740 HG3 GLU 740 -6.143 -9.428 -7.092 651 H LEU 741 H LEU 741 -4.745 -6.277 -3.954 652 HA LEU 741 HA LEU 741 -6.664 -4.706 -2.547 653 HB2 LEU 741 HB2 LEU 741 -5.303 -6.448 -1.498 654 HB3 LEU 741 HB3 LEU 741 -3.837 -5.557 -1.881 655 HG LEU 741 HG LEU 741 -4.745 -5.353 0.498 656 HD11 LEU 741 HD11 LEU 741 -4.609 -2.593 -0.408 657 HD12 LEU 741 HD12 LEU 741 -3.484 -3.507 0.593 658 HD13 LEU 741 HD13 LEU 741 -3.373 -3.601 -1.161 659 HD21 LEU 741 HD21 LEU 741 -6.552 -3.798 0.878 660 HD22 LEU 741 HD22 LEU 741 -6.658 -3.426 -0.840 661 HD23 LEU 741 HD23 LEU 741 -7.128 -5.020 -0.253 662 H VAL 742 H VAL 742 -3.481 -4.030 -4.003 663 HA VAL 742 HA VAL 742 -3.613 -1.228 -3.153 664 HB VAL 742 HB VAL 742 -1.549 -3.008 -4.299 665 HG11 VAL 742 HG11 VAL 742 -1.503 -1.385 -6.068 666 HG12 VAL 742 HG12 VAL 742 -1.675 -0.052 -4.925 667 HG13 VAL 742 HG13 VAL 742 -0.182 -0.987 -4.972 668 HG21 VAL 742 HG21 VAL 742 -0.387 -2.300 -2.471 669 HG22 VAL 742 HG22 VAL 742 -0.909 -0.629 -2.662 670 HG23 VAL 742 HG23 VAL 742 -1.979 -1.806 -1.901 671 H GLU 743 H GLU 743 -4.064 -3.111 -6.115 672 HA GLU 743 HA GLU 743 -4.164 -0.763 -7.781 673 HB2 GLU 743 HB2 GLU 743 -4.968 -3.632 -8.302 674 HB3 GLU 743 HB3 GLU 743 -5.039 -2.354 -9.515 675 HG2 GLU 743 HG2 GLU 743 -2.532 -3.165 -8.008 676 HG3 GLU 743 HG3 GLU 743 -2.924 -3.674 -9.644 677 H PHE 744 H PHE 744 -6.150 -1.746 -5.434 678 HA PHE 744 HA PHE 744 -8.621 -0.919 -6.829 679 HB2 PHE 744 HB2 PHE 744 -8.646 -3.130 -5.653 680 HB3 PHE 744 HB3 PHE 744 -8.343 -2.284 -4.136 681 HD1 PHE 744 HD2 PHE 744 -10.743 -2.655 -6.950 682 HD2 PHE 744 HD1 PHE 744 -10.093 -1.111 -2.995 683 HE1 PHE 744 HE2 PHE 744 -13.169 -2.189 -6.732 684 HE2 PHE 744 HE1 PHE 744 -12.518 -0.650 -2.778 685 HZ PHE 744 HZ PHE 744 -14.055 -1.185 -4.645 686 H TYR 745 H TYR 745 -6.652 -0.408 -3.930 687 HA TYR 745 HA TYR 745 -8.206 1.711 -2.856 688 HB2 TYR 745 HB2 TYR 745 -5.380 0.774 -2.440 689 HB3 TYR 745 HB3 TYR 745 -5.939 2.275 -1.709 690 HD1 TYR 745 HD1 TYR 745 -7.461 -1.127 -2.252 691 HD2 TYR 745 HD2 TYR 745 -6.537 2.007 0.546 692 HE1 TYR 745 HE1 TYR 745 -8.555 -2.412 -0.435 693 HE2 TYR 745 HE2 TYR 745 -7.621 0.705 2.352 694 HH TYR 745 HH TYR 745 -9.222 -2.391 1.693 695 H GLN 746 H GLN 746 -6.209 1.534 -5.600 696 HA GLN 746 HA GLN 746 -5.321 4.267 -5.664 697 HB2 GLN 746 HB2 GLN 746 -4.957 3.774 -8.129 698 HB3 GLN 746 HB3 GLN 746 -4.093 2.709 -7.021 699 HG2 GLN 746 HG2 GLN 746 -5.234 0.890 -7.707 700 HG3 GLN 746 HG3 GLN 746 -6.779 1.728 -7.658 701 HE21 GLN 746 HE21 GLN 746 -4.344 0.504 -9.776 702 HE22 GLN 746 HE22 GLN 746 -4.938 1.216 -11.200 703 H GLN 747 H GLN 747 -8.243 2.638 -6.178 704 HA GLN 747 HA GLN 747 -9.444 4.974 -7.550 705 HB2 GLN 747 HB2 GLN 747 -10.770 2.278 -7.346 706 HB3 GLN 747 HB3 GLN 747 -11.027 3.554 -8.535 707 HG2 GLN 747 HG2 GLN 747 -8.276 2.766 -8.655 708 HG3 GLN 747 HG3 GLN 747 -9.264 1.312 -8.714 709 HE21 GLN 747 HE21 GLN 747 -7.689 2.834 -10.872 710 HE22 GLN 747 HE22 GLN 747 -8.835 3.057 -12.114 711 H ASN 748 H ASN 748 -9.855 2.572 -4.974 712 HA ASN 748 HA ASN 748 -12.208 3.774 -3.870 713 HB2 ASN 748 HB2 ASN 748 -11.331 1.367 -3.544 714 HB3 ASN 748 HB3 ASN 748 -10.261 2.061 -2.330 715 HD21 ASN 748 HD21 ASN 748 -11.939 3.955 -1.095 716 HD22 ASN 748 HD22 ASN 748 -13.260 3.157 -0.391 717 H SER 749 H SER 749 -12.281 5.675 -2.854 718 HA SER 749 HA SER 749 -10.128 7.282 -2.172 719 HB2 SER 749 HB2 SER 749 -12.152 7.957 -0.364 720 HB3 SER 749 HB3 SER 749 -11.892 8.652 -1.961 721 HG SER 749 HG SER 749 -13.592 6.519 -1.152 722 H LEU 750 H LEU 750 -8.559 6.970 -0.738 723 HA LEU 750 HA LEU 750 -8.450 4.932 1.134 724 HB2 LEU 750 HB2 LEU 750 -7.044 7.607 1.124 725 HB3 LEU 750 HB3 LEU 750 -6.626 6.285 2.217 726 HG LEU 750 HG LEU 750 -6.562 6.218 -0.808 727 HD11 LEU 750 HD11 LEU 750 -4.644 6.993 1.136 728 HD12 LEU 750 HD12 LEU 750 -4.128 5.439 0.487 729 HD13 LEU 750 HD13 LEU 750 -4.405 6.798 -0.599 730 HD21 LEU 750 HD21 LEU 750 -7.130 4.027 -0.359 731 HD22 LEU 750 HD22 LEU 750 -5.386 3.926 -0.131 732 HD23 LEU 750 HD23 LEU 750 -6.448 4.076 1.266 733 H LYS 751 H LYS 751 -9.874 8.106 1.464 734 HA LYS 751 HA LYS 751 -10.062 8.287 4.247 735 HB2 LYS 751 HB2 LYS 751 -11.679 9.963 3.907 736 HB3 LYS 751 HB3 LYS 751 -10.661 10.035 2.471 737 HG2 LYS 751 HG2 LYS 751 -12.449 8.276 1.559 738 HG3 LYS 751 HG3 LYS 751 -13.477 9.077 2.748 739 HD2 LYS 751 HD2 LYS 751 -11.904 10.483 0.562 740 HD3 LYS 751 HD3 LYS 751 -13.641 10.175 0.530 741 HE2 LYS 751 HE2 LYS 751 -13.975 11.570 2.497 742 HE3 LYS 751 HE3 LYS 751 -12.233 11.787 2.683 743 HZ1 LYS 751 HZ1 LYS 751 -13.140 13.697 1.580 744 HZ2 LYS 751 HZ2 LYS 751 -12.187 12.828 0.455 745 HZ3 LYS 751 HZ3 LYS 751 -13.895 12.725 0.403 746 H ASP 752 H ASP 752 -11.579 6.095 2.103 747 HA ASP 752 HA ASP 752 -13.836 5.530 3.875 748 HB2 ASP 752 HB2 ASP 752 -13.018 3.971 1.425 749 HB3 ASP 752 HB3 ASP 752 -14.610 4.067 2.169 750 H CYS 753 H CYS 753 -10.727 4.161 2.990 751 HA CYS 753 HA CYS 753 -11.218 1.822 4.716 752 HB2 CYS 753 HB2 CYS 753 -9.051 2.381 2.682 753 HB3 CYS 753 HB3 CYS 753 -9.166 0.915 3.656 754 HG CYS 753 HG CYS 753 -11.294 0.231 2.402 755 H PHE 754 H PHE 754 -9.010 4.563 4.253 756 HA PHE 754 HA PHE 754 -7.354 3.756 6.498 757 HB2 PHE 754 HB2 PHE 754 -7.379 6.199 4.720 758 HB3 PHE 754 HB3 PHE 754 -6.231 5.973 6.034 759 HD1 PHE 754 HD2 PHE 754 -7.299 2.905 4.381 760 HD2 PHE 754 HD1 PHE 754 -4.458 6.121 4.213 761 HE1 PHE 754 HE2 PHE 754 -5.869 1.572 2.870 762 HE2 PHE 754 HE1 PHE 754 -3.054 4.793 2.697 763 HZ PHE 754 HZ PHE 754 -3.745 2.515 2.021 764 H LYS 755 H LYS 755 -7.861 7.131 6.488 765 HA LYS 755 HA LYS 755 -9.996 7.156 8.458 766 HB2 LYS 755 HB2 LYS 755 -8.123 6.437 9.829 767 HB3 LYS 755 HB3 LYS 755 -7.167 7.805 9.273 768 HG2 LYS 755 HG2 LYS 755 -8.751 9.371 10.310 769 HG3 LYS 755 HG3 LYS 755 -9.794 8.028 10.779 770 HD2 LYS 755 HD2 LYS 755 -8.631 7.960 12.706 771 HD3 LYS 755 HD3 LYS 755 -7.306 7.289 11.761 772 HE2 LYS 755 HE2 LYS 755 -7.747 10.161 12.585 773 HE3 LYS 755 HE3 LYS 755 -6.341 9.140 12.886 774 HZ1 LYS 755 HZ1 LYS 755 -5.497 10.163 11.094 775 HZ2 LYS 755 HZ2 LYS 755 -6.491 9.132 10.192 776 HZ3 LYS 755 HZ3 LYS 755 -7.027 10.714 10.545 777 H SER 756 H SER 756 -7.598 9.544 8.875 778 HA SER 756 HA SER 756 -9.352 11.607 7.940 779 HB2 SER 756 HB2 SER 756 -6.442 11.966 8.649 780 HB3 SER 756 HB3 SER 756 -7.756 13.132 8.799 781 HG SER 756 HG SER 756 -8.400 12.191 10.608 782 H LEU 757 H LEU 757 -8.142 9.548 6.076 783 HA LEU 757 HA LEU 757 -6.403 11.009 4.317 784 HB2 LEU 757 HB2 LEU 757 -7.693 8.321 4.357 785 HB3 LEU 757 HB3 LEU 757 -7.182 8.958 2.797 786 HG LEU 757 HG LEU 757 -5.497 7.555 4.184 787 HD11 LEU 757 HD11 LEU 757 -3.803 9.669 3.576 788 HD12 LEU 757 HD12 LEU 757 -4.277 8.361 2.496 789 HD13 LEU 757 HD13 LEU 757 -5.175 9.877 2.486 790 HD21 LEU 757 HD21 LEU 757 -4.347 8.573 5.932 791 HD22 LEU 757 HD22 LEU 757 -4.863 10.190 5.457 792 HD23 LEU 757 HD23 LEU 757 -6.003 9.087 6.226 793 H ASP 758 H ASP 758 -7.003 11.098 1.970 794 HA ASP 758 HA ASP 758 -9.710 11.336 1.175 795 HB2 ASP 758 HB2 ASP 758 -9.085 13.495 2.637 796 HB3 ASP 758 HB3 ASP 758 -8.430 14.032 1.094 797 H THR 759 H THR 759 -7.901 9.854 0.113 798 HA THR 759 HA THR 759 -7.549 10.882 -2.551 799 HB THR 759 HB THR 759 -5.572 11.844 -1.324 800 HG1 THR 759 HG1 THR 759 -4.326 11.422 -3.028 801 HG21 THR 759 HG21 THR 759 -5.263 9.902 0.224 802 HG22 THR 759 HG22 THR 759 -4.741 8.932 -1.154 803 HG23 THR 759 HG23 THR 759 -3.789 10.321 -0.647 804 H THR 760 H THR 760 -5.518 9.163 -3.352 805 HA THR 760 HA THR 760 -6.203 6.445 -2.554 806 HB THR 760 HB THR 760 -6.816 5.772 -4.869 807 HG1 THR 760 HG1 THR 760 -7.001 7.231 -6.400 808 HG21 THR 760 HG21 THR 760 -8.478 6.450 -3.014 809 HG22 THR 760 HG22 THR 760 -8.702 7.927 -3.951 810 HG23 THR 760 HG23 THR 760 -9.082 6.362 -4.666 811 H LEU 761 H LEU 761 -4.903 4.839 -3.829 812 HA LEU 761 HA LEU 761 -2.171 5.478 -3.861 813 HB2 LEU 761 HB2 LEU 761 -3.711 3.278 -5.278 814 HB3 LEU 761 HB3 LEU 761 -1.964 3.334 -5.175 815 HG LEU 761 HG LEU 761 -3.355 1.895 -3.459 816 HD11 LEU 761 HD11 LEU 761 -1.035 3.694 -2.867 817 HD12 LEU 761 HD12 LEU 761 -1.614 2.517 -1.693 818 HD13 LEU 761 HD13 LEU 761 -1.022 1.972 -3.262 819 HD21 LEU 761 HD21 LEU 761 -3.723 3.153 -1.335 820 HD22 LEU 761 HD22 LEU 761 -3.466 4.656 -2.212 821 HD23 LEU 761 HD23 LEU 761 -4.838 3.621 -2.612 822 H GLN 762 H GLN 762 -2.000 7.442 -5.017 823 HA GLN 762 HA GLN 762 -2.974 7.791 -7.664 824 HB2 GLN 762 HB2 GLN 762 -1.661 9.341 -5.633 825 HB3 GLN 762 HB3 GLN 762 -0.893 9.634 -7.190 826 HG2 GLN 762 HG2 GLN 762 -3.725 9.603 -7.599 827 HG3 GLN 762 HG3 GLN 762 -3.388 10.641 -6.214 828 HE21 GLN 762 HE21 GLN 762 -1.247 12.090 -6.714 829 HE22 GLN 762 HE22 GLN 762 -1.300 12.863 -8.221 830 H PHE 763 H PHE 763 0.434 7.682 -6.535 831 HA PHE 763 HA PHE 763 1.085 6.360 -9.103 832 HB2 PHE 763 HB2 PHE 763 2.452 8.779 -7.920 833 HB3 PHE 763 HB3 PHE 763 3.137 7.815 -9.228 834 HD1 PHE 763 HD1 PHE 763 1.795 7.535 -11.376 835 HD2 PHE 763 HD2 PHE 763 0.775 10.403 -8.348 836 HE1 PHE 763 HE1 PHE 763 0.406 8.773 -13.015 837 HE2 PHE 763 HE2 PHE 763 -0.617 11.637 -9.985 838 HZ PHE 763 HZ PHE 763 -0.801 10.824 -12.319 839 HA PRO 764 HA PRO 764 3.659 3.779 -6.613 840 HB2 PRO 764 HB2 PRO 764 5.218 2.696 -8.552 841 HB3 PRO 764 HB3 PRO 764 3.490 2.324 -8.415 842 HG2 PRO 764 HG2 PRO 764 4.885 4.148 -10.290 843 HG3 PRO 764 HG3 PRO 764 3.489 3.094 -10.560 844 HD2 PRO 764 HD2 PRO 764 3.338 5.832 -10.118 845 HD3 PRO 764 HD3 PRO 764 1.999 4.685 -9.887 846 H PHE 765 H PHE 765 6.337 3.164 -6.874 847 HA PHE 765 HA PHE 765 7.646 5.810 -6.811 848 HB2 PHE 765 HB2 PHE 765 8.813 5.276 -4.858 849 HB3 PHE 765 HB3 PHE 765 7.213 4.605 -4.561 850 HD1 PHE 765 HD1 PHE 765 6.822 2.122 -5.092 851 HD2 PHE 765 HD2 PHE 765 10.723 3.896 -4.832 852 HE1 PHE 765 HE1 PHE 765 7.822 -0.123 -4.765 853 HE2 PHE 765 HE2 PHE 765 11.724 1.660 -4.507 854 HZ PHE 765 HZ PHE 765 10.275 -0.355 -4.471 855 H LYS 766 H LYS 766 7.585 2.821 -8.298 856 HA LYS 766 HA LYS 766 10.457 2.884 -8.951 857 HB2 LYS 766 HB2 LYS 766 8.348 0.803 -9.552 858 HB3 LYS 766 HB3 LYS 766 10.060 0.673 -9.957 859 HG2 LYS 766 HG2 LYS 766 10.267 1.297 -7.332 860 HG3 LYS 766 HG3 LYS 766 8.724 0.452 -7.306 861 HD2 LYS 766 HD2 LYS 766 11.001 -0.771 -8.810 862 HD3 LYS 766 HD3 LYS 766 10.996 -0.872 -7.051 863 HE2 LYS 766 HE2 LYS 766 8.372 -1.526 -7.799 864 HE3 LYS 766 HE3 LYS 766 9.393 -2.355 -8.976 865 HZ1 LYS 766 HZ1 LYS 766 10.603 -2.665 -6.498 866 HZ2 LYS 766 HZ2 LYS 766 8.944 -2.994 -6.247 867 HZ3 LYS 766 HZ3 LYS 766 9.830 -3.858 -7.423 868 H GLU 767 H GLU 767 7.250 3.072 -10.403 869 HA GLU 767 HA GLU 767 6.637 3.394 -12.643 870 HB2 GLU 767 HB2 GLU 767 7.585 5.690 -11.215 871 HB3 GLU 767 HB3 GLU 767 7.923 5.905 -12.931 872 HG2 GLU 767 HG2 GLU 767 5.467 5.037 -13.244 873 HG3 GLU 767 HG3 GLU 767 5.279 5.506 -11.559 874 H1 ASP 338 H1 ASP 338 5.087 3.576 17.163 875 H2 ASP 338 H2 ASP 338 5.085 3.894 17.190 876 H3 ASP 338 H3 ASP 338 4.103 3.795 18.583 877 HA ASP 338 HA ASP 338 5.782 4.794 19.652 878 HB2 ASP 338 HB2 ASP 338 7.606 3.101 20.289 879 HB3 ASP 338 HB3 ASP 338 5.944 2.624 20.644 880 H THR 339 H THR 339 7.779 2.662 17.641 881 HA THR 339 HA THR 339 9.715 4.689 17.107 882 HB THR 339 HB THR 339 10.366 2.786 15.342 883 HG1 THR 339 HG1 THR 339 8.772 1.440 17.294 884 HG21 THR 339 HG21 THR 339 11.190 1.520 17.576 885 HG22 THR 339 HG22 THR 339 11.936 3.008 16.992 886 HG23 THR 339 HG23 THR 339 10.728 3.072 18.276 887 H GLU 340 H GLU 340 10.364 5.349 14.911 888 HA GLU 340 HA GLU 340 8.201 6.507 13.505 889 HB2 GLU 340 HB2 GLU 340 10.641 7.293 13.631 890 HB3 GLU 340 HB3 GLU 340 10.966 6.114 12.363 891 HG2 GLU 340 HG2 GLU 340 10.448 8.495 11.578 892 HG3 GLU 340 HG3 GLU 340 9.513 7.211 10.827 893 H VAL 341 H VAL 341 7.268 4.114 13.542 894 HA VAL 341 HA VAL 341 7.697 2.986 10.824 895 HB VAL 341 HB VAL 341 8.469 1.490 12.671 896 HG11 VAL 341 HG11 VAL 341 7.128 0.832 14.410 897 HG12 VAL 341 HG12 VAL 341 6.372 2.397 14.101 898 HG13 VAL 341 HG13 VAL 341 5.652 0.922 13.453 899 HG21 VAL 341 HG21 VAL 341 6.561 0.866 10.567 900 HG22 VAL 341 HG22 VAL 341 7.965 -0.051 11.108 901 HG23 VAL 341 HG23 VAL 341 6.412 -0.264 11.913 902 H PTR 342 H PTR 342 5.213 1.249 11.833 903 HA PTR 342 HA PTR 342 3.226 3.350 11.221 904 HB2 PTR 342 HB2 PTR 342 1.934 1.130 10.359 905 HB3 PTR 342 HB3 PTR 342 2.897 2.159 9.304 906 HD1 PTR 342 HD1 PTR 342 3.547 -0.581 11.790 907 HD2 PTR 342 HD2 PTR 342 4.340 1.018 7.894 908 HE1 PTR 342 HE1 PTR 342 5.051 -2.480 11.319 909 HE2 PTR 342 HE2 PTR 342 5.844 -0.893 7.423 910 H GLU 343 H GLU 343 2.916 3.683 13.446 911 HA GLU 343 HA GLU 343 2.288 1.689 15.341 912 HB2 GLU 343 HB2 GLU 343 0.847 4.081 15.980 913 HB3 GLU 343 HB3 GLU 343 2.325 3.465 16.707 914 HG2 GLU 343 HG2 GLU 343 2.234 5.135 14.170 915 HG3 GLU 343 HG3 GLU 343 2.575 5.772 15.774 916 H SER 344 H SER 344 0.933 1.008 13.014 917 HA SER 344 HA SER 344 -1.104 0.446 12.142 918 HB2 SER 344 HB2 SER 344 -2.089 0.298 14.970 919 HB3 SER 344 HB3 SER 344 -2.463 -0.764 13.608 920 HG SER 344 HG SER 344 -0.954 -1.738 15.080 921 HA PRO 345 HA PRO 345 -2.636 4.829 12.724 922 HB2 PRO 345 HB2 PRO 345 -3.018 4.425 9.798 923 HB3 PRO 345 HB3 PRO 345 -2.321 5.807 10.664 924 HG2 PRO 345 HG2 PRO 345 -0.786 4.094 9.318 925 HG3 PRO 345 HG3 PRO 345 -0.247 4.817 10.844 926 HD2 PRO 345 HD2 PRO 345 -1.232 2.042 10.318 927 HD3 PRO 345 HD3 PRO 345 0.006 2.604 11.462 928 H PTR 346 H PTR 346 -4.096 2.744 10.195 929 HA PTR 346 HA PTR 346 -6.709 3.058 11.555 930 HB2 PTR 346 HB2 PTR 346 -6.654 2.752 8.597 931 HB3 PTR 346 HB3 PTR 346 -7.739 3.703 9.612 932 HD1 PTR 346 HD1 PTR 346 -5.261 4.023 7.196 933 HD2 PTR 346 HD2 PTR 346 -6.337 5.545 11.072 934 HE1 PTR 346 HE1 PTR 346 -3.903 6.066 6.784 935 HE2 PTR 346 HE2 PTR 346 -4.987 7.575 10.655 936 H ALA 347 H ALA 347 -7.943 1.297 11.773 937 HA ALA 347 HA ALA 347 -7.972 -0.988 10.167 938 HB1 ALA 347 HB1 ALA 347 -6.175 -1.223 12.591 939 HB2 ALA 347 HB2 ALA 347 -5.716 -1.442 10.902 940 HB3 ALA 347 HB3 ALA 347 -6.796 -2.601 11.680 941 H ASP 348 H ASP 348 -7.762 -1.026 13.707 942 HA ASP 348 HA ASP 348 -10.695 -1.339 13.842 943 HB2 ASP 348 HB2 ASP 348 -8.551 -3.089 15.012 944 HB3 ASP 348 HB3 ASP 348 -10.133 -2.981 15.780 945 HA PRO 349 HA PRO 349 -9.350 1.749 16.975 946 HB2 PRO 349 HB2 PRO 349 -10.674 3.901 16.018 947 HB3 PRO 349 HB3 PRO 349 -9.116 3.385 15.345 948 HG2 PRO 349 HG2 PRO 349 -11.841 3.096 14.234 949 HG3 PRO 349 HG3 PRO 349 -10.289 3.270 13.401 950 HD2 PRO 349 HD2 PRO 349 -11.711 0.845 13.839 951 HD3 PRO 349 HD3 PRO 349 -10.059 1.012 13.207 952 H GLU 350 H GLU 350 -12.604 1.716 15.516 953 HA GLU 350 HA GLU 350 -13.788 1.539 18.217 954 HB2 GLU 350 HB2 GLU 350 -14.732 3.171 15.849 955 HB3 GLU 350 HB3 GLU 350 -15.698 2.884 17.296 956 HG2 GLU 350 HG2 GLU 350 -14.598 4.488 18.430 957 HG3 GLU 350 HG3 GLU 350 -13.038 3.781 18.024 Start of MODEL 14 1 H1 GLY 661 H1 GLY 661 2.406 -15.640 -9.748 2 H2 GLY 661 H2 GLY 661 0.841 -16.072 -9.236 3 H3 GLY 661 H3 GLY 661 1.193 -14.452 -9.644 4 HA2 GLY 661 HA2 GLY 661 1.895 -15.867 -11.885 5 HA3 GLY 661 HA3 GLY 661 0.393 -16.618 -11.339 6 H HIS 662 H HIS 662 1.859 -13.411 -11.841 7 HA HIS 662 HA HIS 662 1.010 -11.437 -12.647 8 HB2 HIS 662 HB2 HIS 662 0.198 -13.277 -14.418 9 HB3 HIS 662 HB3 HIS 662 -1.381 -12.755 -13.833 10 HD1 HIS 662 HD1 HIS 662 1.209 -11.835 -16.187 11 HD2 HIS 662 HD2 HIS 662 -1.603 -9.742 -13.939 12 HE1 HIS 662 HE1 HIS 662 1.006 -9.543 -17.253 13 HE2 HIS 662 HE2 HIS 662 -0.707 -8.254 -15.894 14 H MET 663 H MET 663 0.232 -12.352 -10.021 15 HA MET 663 HA MET 663 -2.021 -10.558 -9.610 16 HB2 MET 663 HB2 MET 663 -3.016 -12.827 -10.145 17 HB3 MET 663 HB3 MET 663 -2.266 -13.426 -8.671 18 HG2 MET 663 HG2 MET 663 -4.716 -12.606 -8.533 19 HG3 MET 663 HG3 MET 663 -3.596 -12.038 -7.295 20 HE1 MET 663 HE1 MET 663 -5.128 -11.736 -10.498 21 HE2 MET 663 HE2 MET 663 -5.914 -10.158 -10.474 22 HE3 MET 663 HE3 MET 663 -4.324 -10.349 -11.227 23 H GLN 664 H GLN 664 -0.942 -13.222 -7.534 24 HA GLN 664 HA GLN 664 -0.484 -11.524 -5.306 25 HB2 GLN 664 HB2 GLN 664 -0.040 -14.393 -5.938 26 HB3 GLN 664 HB3 GLN 664 0.976 -13.709 -4.669 27 HG2 GLN 664 HG2 GLN 664 -0.982 -14.509 -3.558 28 HG3 GLN 664 HG3 GLN 664 -1.159 -12.758 -3.645 29 HE21 GLN 664 HE21 GLN 664 -3.569 -13.626 -3.351 30 HE22 GLN 664 HE22 GLN 664 -4.413 -13.901 -4.796 31 H ASP 665 H ASP 665 1.336 -12.268 -8.084 32 HA ASP 665 HA ASP 665 3.977 -11.938 -7.127 33 HB2 ASP 665 HB2 ASP 665 3.241 -10.975 -9.855 34 HB3 ASP 665 HB3 ASP 665 4.576 -12.007 -9.356 35 H LEU 666 H LEU 666 4.633 -10.162 -6.037 36 HA LEU 666 HA LEU 666 3.414 -7.579 -6.681 37 HB2 LEU 666 HB2 LEU 666 5.295 -8.058 -4.392 38 HB3 LEU 666 HB3 LEU 666 3.998 -6.872 -4.532 39 HG LEU 666 HG LEU 666 3.601 -9.875 -4.352 40 HD11 LEU 666 HD11 LEU 666 2.745 -7.891 -2.279 41 HD12 LEU 666 HD12 LEU 666 3.063 -9.614 -2.105 42 HD13 LEU 666 HD13 LEU 666 4.403 -8.483 -2.279 43 HD21 LEU 666 HD21 LEU 666 1.194 -9.029 -3.880 44 HD22 LEU 666 HD22 LEU 666 1.733 -7.518 -4.616 45 HD23 LEU 666 HD23 LEU 666 1.754 -9.013 -5.551 46 H SER 667 H SER 667 6.481 -9.241 -6.688 47 HA SER 667 HA SER 667 8.173 -7.010 -7.053 48 HB2 SER 667 HB2 SER 667 8.727 -9.720 -8.215 49 HB3 SER 667 HB3 SER 667 9.855 -8.575 -7.485 50 HG SER 667 HG SER 667 9.485 -10.055 -5.912 51 H VAL 668 H VAL 668 5.768 -8.131 -9.054 52 HA VAL 668 HA VAL 668 7.175 -7.482 -11.543 53 HB VAL 668 HB VAL 668 5.190 -8.326 -12.672 54 HG11 VAL 668 HG11 VAL 668 6.647 -10.099 -12.158 55 HG12 VAL 668 HG12 VAL 668 6.336 -9.977 -10.427 56 HG13 VAL 668 HG13 VAL 668 5.107 -10.651 -11.497 57 HG21 VAL 668 HG21 VAL 668 3.661 -7.412 -10.760 58 HG22 VAL 668 HG22 VAL 668 3.190 -8.908 -11.566 59 HG23 VAL 668 HG23 VAL 668 3.975 -8.965 -9.990 60 H HIS 669 H HIS 669 5.607 -5.882 -9.164 61 HA HIS 669 HA HIS 669 4.296 -3.915 -10.913 62 HB2 HIS 669 HB2 HIS 669 4.369 -4.015 -7.889 63 HB3 HIS 669 HB3 HIS 669 3.328 -3.006 -8.889 64 HD1 HIS 669 HD1 HIS 669 2.234 -4.957 -10.905 65 HD2 HIS 669 HD2 HIS 669 2.672 -5.908 -6.881 66 HE1 HIS 669 HE1 HIS 669 0.605 -6.845 -10.436 67 HE2 HIS 669 HE2 HIS 669 0.801 -7.397 -7.949 68 H LEU 670 H LEU 670 4.522 -1.651 -9.511 69 HA LEU 670 HA LEU 670 7.412 -1.095 -9.356 70 HB2 LEU 670 HB2 LEU 670 6.711 1.256 -10.181 71 HB3 LEU 670 HB3 LEU 670 6.864 -0.026 -11.357 72 HG LEU 670 HG LEU 670 4.263 0.841 -10.072 73 HD11 LEU 670 HD11 LEU 670 5.352 1.329 -12.861 74 HD12 LEU 670 HD12 LEU 670 3.768 1.827 -12.269 75 HD13 LEU 670 HD13 LEU 670 5.228 2.541 -11.589 76 HD21 LEU 670 HD21 LEU 670 3.788 -0.498 -12.490 77 HD22 LEU 670 HD22 LEU 670 5.025 -1.464 -11.690 78 HD23 LEU 670 HD23 LEU 670 3.497 -1.132 -10.872 79 H TRP 671 H TRP 671 4.483 -1.131 -7.757 80 HA TRP 671 HA TRP 671 5.275 1.101 -6.035 81 HB2 TRP 671 HB2 TRP 671 2.965 0.674 -4.982 82 HB3 TRP 671 HB3 TRP 671 3.019 1.401 -6.579 83 HD1 TRP 671 HD1 TRP 671 1.681 0.243 -8.409 84 HE1 TRP 671 HE1 TRP 671 0.426 -2.014 -8.642 85 HE3 TRP 671 HE3 TRP 671 3.198 -2.028 -4.088 86 HZ2 TRP 671 HZ2 TRP 671 0.154 -4.454 -7.180 87 HZ3 TRP 671 HZ3 TRP 671 2.429 -4.318 -3.537 88 HH2 TRP 671 HH2 TRP 671 0.907 -5.530 -5.074 89 H TYR 672 H TYR 672 5.492 -2.222 -6.259 90 HA TYR 672 HA TYR 672 5.333 -2.796 -3.413 91 HB2 TYR 672 HB2 TYR 672 4.575 -4.488 -4.980 92 HB3 TYR 672 HB3 TYR 672 6.137 -4.476 -5.795 93 HD1 TYR 672 HD2 TYR 672 4.927 -4.716 -2.238 94 HD2 TYR 672 HD1 TYR 672 7.491 -6.274 -5.305 95 HE1 TYR 672 HE2 TYR 672 5.783 -6.426 -0.659 96 HE2 TYR 672 HE1 TYR 672 8.341 -7.988 -3.729 97 HH TYR 672 HH TYR 672 7.270 -9.124 -1.510 98 H ALA 673 H ALA 673 6.954 -2.180 -2.120 99 HA ALA 673 HA ALA 673 9.690 -2.058 -3.198 100 HB1 ALA 673 HB1 ALA 673 10.219 -0.767 -1.208 101 HB2 ALA 673 HB2 ALA 673 8.636 -1.125 -0.514 102 HB3 ALA 673 HB3 ALA 673 8.761 -0.102 -1.947 103 H GLY 674 H GLY 674 7.648 -3.878 -1.106 104 HA2 GLY 674 HA2 GLY 674 7.964 -5.725 0.222 105 HA3 GLY 674 HA3 GLY 674 9.225 -6.146 -0.924 106 HA PRO 675 HA PRO 675 11.882 -6.015 2.634 107 HB2 PRO 675 HB2 PRO 675 14.281 -5.925 1.227 108 HB3 PRO 675 HB3 PRO 675 13.373 -7.401 1.595 109 HG2 PRO 675 HG2 PRO 675 13.463 -5.810 -0.915 110 HG3 PRO 675 HG3 PRO 675 13.376 -7.566 -0.688 111 HD2 PRO 675 HD2 PRO 675 11.201 -6.101 -1.391 112 HD3 PRO 675 HD3 PRO 675 11.073 -7.550 -0.362 113 H MET 676 H MET 676 10.732 -3.626 2.283 114 HA MET 676 HA MET 676 12.987 -1.700 2.398 115 HB2 MET 676 HB2 MET 676 11.521 -1.452 0.365 116 HB3 MET 676 HB3 MET 676 10.183 -1.092 1.447 117 HG2 MET 676 HG2 MET 676 10.887 1.025 1.789 118 HG3 MET 676 HG3 MET 676 12.538 0.497 2.102 119 HE1 MET 676 HE1 MET 676 14.317 2.096 -0.554 120 HE2 MET 676 HE2 MET 676 13.833 2.135 1.140 121 HE3 MET 676 HE3 MET 676 14.491 0.651 0.432 122 H GLU 677 H GLU 677 12.669 0.102 3.852 123 HA GLU 677 HA GLU 677 11.002 -0.624 6.162 124 HB2 GLU 677 HB2 GLU 677 12.425 1.035 7.382 125 HB3 GLU 677 HB3 GLU 677 13.322 -0.337 6.723 126 HG2 GLU 677 HG2 GLU 677 14.442 0.961 5.214 127 HG3 GLU 677 HG3 GLU 677 13.040 1.982 4.910 128 H ARG 678 H ARG 678 10.146 1.232 7.426 129 HA ARG 678 HA ARG 678 8.216 2.663 6.020 130 HB2 ARG 678 HB2 ARG 678 8.281 2.118 8.476 131 HB3 ARG 678 HB3 ARG 678 9.430 3.432 8.680 132 HG2 ARG 678 HG2 ARG 678 7.836 5.074 8.168 133 HG3 ARG 678 HG3 ARG 678 6.791 3.929 7.319 134 HD2 ARG 678 HD2 ARG 678 5.959 3.010 9.293 135 HD3 ARG 678 HD3 ARG 678 7.367 3.498 10.233 136 HE ARG 678 HE ARG 678 6.096 5.842 9.404 137 HH11 ARG 678 HH21 ARG 678 5.511 3.060 11.355 138 HH12 ARG 678 HH22 ARG 678 4.377 3.880 12.419 139 HH21 ARG 678 HH11 ARG 678 4.615 6.889 10.758 140 HH22 ARG 678 HH12 ARG 678 3.858 6.020 12.072 141 H ALA 679 H ALA 679 11.107 4.029 7.599 142 HA ALA 679 HA ALA 679 10.878 6.593 6.476 143 HB1 ALA 679 HB1 ALA 679 13.629 5.710 6.950 144 HB2 ALA 679 HB2 ALA 679 12.550 5.365 8.301 145 HB3 ALA 679 HB3 ALA 679 12.722 7.019 7.709 146 H GLY 680 H GLY 680 12.333 3.633 5.338 147 HA2 GLY 680 HA2 GLY 680 13.730 4.758 3.104 148 HA3 GLY 680 HA3 GLY 680 13.318 3.058 3.317 149 H ALA 681 H ALA 681 10.601 3.114 3.501 150 HA ALA 681 HA ALA 681 9.753 3.225 0.830 151 HB1 ALA 681 HB1 ALA 681 8.549 1.866 2.405 152 HB2 ALA 681 HB2 ALA 681 7.436 3.108 1.833 153 HB3 ALA 681 HB3 ALA 681 8.189 3.261 3.422 154 H GLU 682 H GLU 682 9.143 5.550 3.500 155 HA GLU 682 HA GLU 682 7.782 7.370 1.755 156 HB2 GLU 682 HB2 GLU 682 7.849 8.945 3.643 157 HB3 GLU 682 HB3 GLU 682 7.255 7.364 4.123 158 HG2 GLU 682 HG2 GLU 682 9.674 6.849 4.809 159 HG3 GLU 682 HG3 GLU 682 9.961 8.573 4.654 160 H SER 683 H SER 683 11.060 6.713 2.281 161 HA SER 683 HA SER 683 12.243 9.223 1.973 162 HB2 SER 683 HB2 SER 683 14.219 8.079 1.346 163 HB3 SER 683 HB3 SER 683 13.376 6.963 2.416 164 HG SER 683 HG SER 683 12.765 5.750 0.708 165 H ILE 684 H ILE 684 10.990 6.954 -0.385 166 HA ILE 684 HA ILE 684 11.666 8.678 -2.631 167 HB ILE 684 HB ILE 684 9.871 6.264 -2.794 168 HG12 ILE 684 HG12 ILE 684 12.570 5.489 -3.268 169 HG13 ILE 684 HG13 ILE 684 12.548 6.314 -1.711 170 HG21 ILE 684 HG21 ILE 684 11.804 6.311 -4.828 171 HG22 ILE 684 HG22 ILE 684 10.114 6.787 -4.979 172 HG23 ILE 684 HG23 ILE 684 11.341 8.000 -4.613 173 HD11 ILE 684 HD11 ILE 684 11.089 3.826 -2.549 174 HD12 ILE 684 HD12 ILE 684 12.032 4.126 -1.089 175 HD13 ILE 684 HD13 ILE 684 10.425 4.834 -1.262 176 H LEU 685 H LEU 685 8.715 7.460 -1.062 177 HA LEU 685 HA LEU 685 6.842 8.877 -2.599 178 HB2 LEU 685 HB2 LEU 685 6.882 7.531 0.046 179 HB3 LEU 685 HB3 LEU 685 5.580 8.684 -0.225 180 HG LEU 685 HG LEU 685 4.779 7.484 -2.122 181 HD11 LEU 685 HD11 LEU 685 7.432 6.045 -1.966 182 HD12 LEU 685 HD12 LEU 685 6.067 5.392 -2.873 183 HD13 LEU 685 HD13 LEU 685 6.760 6.949 -3.323 184 HD21 LEU 685 HD21 LEU 685 4.753 5.045 -1.167 185 HD22 LEU 685 HD22 LEU 685 5.595 5.763 0.205 186 HD23 LEU 685 HD23 LEU 685 3.988 6.335 -0.242 187 H ALA 686 H ALA 686 8.478 9.807 0.460 188 HA ALA 686 HA ALA 686 7.099 12.265 0.751 189 HB1 ALA 686 HB1 ALA 686 8.417 11.184 2.548 190 HB2 ALA 686 HB2 ALA 686 8.847 12.876 2.307 191 HB3 ALA 686 HB3 ALA 686 9.897 11.601 1.684 192 H ASN 687 H ASN 687 9.946 11.320 -1.067 193 HA ASN 687 HA ASN 687 10.698 13.990 -1.833 194 HB2 ASN 687 HB2 ASN 687 12.558 12.848 -2.380 195 HB3 ASN 687 HB3 ASN 687 11.724 11.317 -2.151 196 HD21 ASN 687 HD21 ASN 687 11.760 13.957 -4.624 197 HD22 ASN 687 HD22 ASN 687 11.770 12.897 -5.947 198 H ARG 688 H ARG 688 8.753 11.391 -3.197 199 HA ARG 688 HA ARG 688 8.285 12.628 -5.733 200 HB2 ARG 688 HB2 ARG 688 7.450 10.214 -4.315 201 HB3 ARG 688 HB3 ARG 688 6.169 10.904 -5.302 202 HG2 ARG 688 HG2 ARG 688 7.345 9.437 -6.756 203 HG3 ARG 688 HG3 ARG 688 7.902 11.054 -7.186 204 HD2 ARG 688 HD2 ARG 688 9.903 10.778 -5.862 205 HD3 ARG 688 HD3 ARG 688 9.331 9.239 -5.228 206 HE ARG 688 HE ARG 688 9.336 8.820 -7.914 207 HH11 ARG 688 HH21 ARG 688 11.663 10.078 -5.676 208 HH12 ARG 688 HH22 ARG 688 13.020 9.489 -6.587 209 HH21 ARG 688 HH11 ARG 688 11.102 8.059 -9.067 210 HH22 ARG 688 HH12 ARG 688 12.703 8.348 -8.487 211 H SER 689 H SER 689 5.899 12.910 -6.434 212 HA SER 689 HA SER 689 4.819 15.096 -4.873 213 HB2 SER 689 HB2 SER 689 4.857 15.233 -7.321 214 HB3 SER 689 HB3 SER 689 3.834 13.802 -7.430 215 HG SER 689 HG SER 689 2.288 15.242 -7.355 216 H ASP 690 H ASP 690 2.424 15.203 -4.509 217 HA ASP 690 HA ASP 690 1.614 13.159 -2.751 218 HB2 ASP 690 HB2 ASP 690 0.443 15.625 -3.841 219 HB3 ASP 690 HB3 ASP 690 -0.730 14.391 -3.387 220 H GLY 691 H GLY 691 0.413 11.389 -2.968 221 HA2 GLY 691 HA2 GLY 691 -1.312 10.098 -4.092 222 HA3 GLY 691 HA3 GLY 691 -0.786 10.808 -5.618 223 H THR 692 H THR 692 2.045 10.456 -4.402 224 HA THR 692 HA THR 692 2.660 8.021 -5.769 225 HB THR 692 HB THR 692 4.475 9.376 -3.767 226 HG1 THR 692 HG1 THR 692 3.868 11.069 -5.027 227 HG21 THR 692 HG21 THR 692 5.255 8.287 -6.441 228 HG22 THR 692 HG22 THR 692 6.177 8.339 -4.940 229 HG23 THR 692 HG23 THR 692 4.892 7.148 -5.144 230 H PHE 693 H PHE 693 2.719 5.971 -4.986 231 HA PHE 693 HA PHE 693 2.744 5.623 -2.057 232 HB2 PHE 693 HB2 PHE 693 0.848 4.157 -2.085 233 HB3 PHE 693 HB3 PHE 693 0.379 5.642 -2.907 234 HD1 PHE 693 HD2 PHE 693 1.293 2.093 -3.372 235 HD2 PHE 693 HD1 PHE 693 -0.042 5.692 -5.287 236 HE1 PHE 693 HE2 PHE 693 0.705 0.798 -5.401 237 HE2 PHE 693 HE1 PHE 693 -0.633 4.397 -7.316 238 HZ PHE 693 HZ PHE 693 -0.255 1.947 -7.375 239 H LEU 694 H LEU 694 2.982 3.332 -1.424 240 HA LEU 694 HA LEU 694 4.013 1.452 -3.317 241 HB2 LEU 694 HB2 LEU 694 6.312 1.442 -2.777 242 HB3 LEU 694 HB3 LEU 694 5.914 3.140 -3.029 243 HG LEU 694 HG LEU 694 5.441 3.074 -0.419 244 HD11 LEU 694 HD11 LEU 694 6.750 0.518 -0.976 245 HD12 LEU 694 HD12 LEU 694 7.635 1.478 0.207 246 HD13 LEU 694 HD13 LEU 694 5.946 1.065 0.495 247 HD21 LEU 694 HD21 LEU 694 7.586 3.861 -2.084 248 HD22 LEU 694 HD22 LEU 694 7.225 4.439 -0.458 249 HD23 LEU 694 HD23 LEU 694 8.314 3.072 -0.687 250 H VAL 695 H VAL 695 5.001 -0.460 -2.160 251 HA VAL 695 HA VAL 695 3.815 -0.788 0.530 252 HB VAL 695 HB VAL 695 3.714 -2.808 -1.718 253 HG11 VAL 695 HG11 VAL 695 3.039 -2.854 1.207 254 HG12 VAL 695 HG12 VAL 695 2.071 -3.806 0.090 255 HG13 VAL 695 HG13 VAL 695 3.802 -4.100 0.219 256 HG21 VAL 695 HG21 VAL 695 2.009 -0.595 -1.038 257 HG22 VAL 695 HG22 VAL 695 1.787 -1.797 -2.308 258 HG23 VAL 695 HG23 VAL 695 1.153 -2.094 -0.690 259 H ARG 696 H ARG 696 5.062 -1.799 1.997 260 HA ARG 696 HA ARG 696 7.585 -3.032 1.041 261 HB2 ARG 696 HB2 ARG 696 8.644 -2.059 3.101 262 HB3 ARG 696 HB3 ARG 696 8.145 -0.861 1.908 263 HG2 ARG 696 HG2 ARG 696 6.206 -0.263 3.166 264 HG3 ARG 696 HG3 ARG 696 6.360 -1.676 4.208 265 HD2 ARG 696 HD2 ARG 696 8.299 0.653 4.091 266 HD3 ARG 696 HD3 ARG 696 7.125 0.357 5.368 267 HE ARG 696 HE ARG 696 9.379 -1.493 4.746 268 HH11 ARG 696 HH21 ARG 696 7.331 0.164 7.013 269 HH12 ARG 696 HH22 ARG 696 7.987 -0.664 8.380 270 HH21 ARG 696 HH11 ARG 696 10.199 -2.522 6.519 271 HH22 ARG 696 HH12 ARG 696 9.587 -2.183 8.106 272 H GLN 697 H GLN 697 8.661 -4.309 2.832 273 HA GLN 697 HA GLN 697 6.860 -5.536 4.778 274 HB2 GLN 697 HB2 GLN 697 6.324 -6.921 2.918 275 HB3 GLN 697 HB3 GLN 697 8.011 -7.028 2.417 276 HG2 GLN 697 HG2 GLN 697 8.576 -8.363 4.341 277 HG3 GLN 697 HG3 GLN 697 7.001 -8.075 5.076 278 HE21 GLN 697 HE21 GLN 697 5.208 -9.335 4.335 279 HE22 GLN 697 HE22 GLN 697 5.394 -10.620 3.233 280 H ARG 698 H ARG 698 7.940 -6.560 6.434 281 HA ARG 698 HA ARG 698 10.559 -7.470 6.481 282 HB2 ARG 698 HB2 ARG 698 10.478 -4.612 6.425 283 HB3 ARG 698 HB3 ARG 698 11.049 -5.119 8.013 284 HG2 ARG 698 HG2 ARG 698 12.171 -6.445 5.560 285 HG3 ARG 698 HG3 ARG 698 12.771 -4.858 6.042 286 HD2 ARG 698 HD2 ARG 698 14.088 -6.749 7.024 287 HD3 ARG 698 HD3 ARG 698 13.386 -5.681 8.231 288 HE ARG 698 HE ARG 698 11.661 -7.370 8.638 289 HH11 ARG 698 HH21 ARG 698 14.350 -8.348 6.672 290 HH12 ARG 698 HH22 ARG 698 14.107 -10.030 6.972 291 HH21 ARG 698 HH11 ARG 698 11.347 -9.523 8.985 292 HH22 ARG 698 HH12 ARG 698 12.412 -10.699 8.286 293 H VAL 699 H VAL 699 7.726 -6.375 8.036 294 HA VAL 699 HA VAL 699 8.489 -6.800 10.750 295 HB VAL 699 HB VAL 699 6.505 -5.471 10.036 296 HG11 VAL 699 HG11 VAL 699 4.674 -7.697 9.801 297 HG12 VAL 699 HG12 VAL 699 4.916 -6.339 8.701 298 HG13 VAL 699 HG13 VAL 699 5.904 -7.792 8.547 299 HG21 VAL 699 HG21 VAL 699 5.462 -5.893 12.014 300 HG22 VAL 699 HG22 VAL 699 5.296 -7.614 11.679 301 HG23 VAL 699 HG23 VAL 699 6.826 -6.973 12.279 302 H LYS 700 H LYS 700 7.476 -8.570 12.103 303 HA LYS 700 HA LYS 700 7.363 -11.130 10.628 304 HB2 LYS 700 HB2 LYS 700 8.474 -11.896 12.992 305 HB3 LYS 700 HB3 LYS 700 9.401 -11.532 11.538 306 HG2 LYS 700 HG2 LYS 700 10.397 -10.291 13.356 307 HG3 LYS 700 HG3 LYS 700 9.554 -9.135 12.328 308 HD2 LYS 700 HD2 LYS 700 7.588 -9.257 13.869 309 HD3 LYS 700 HD3 LYS 700 8.516 -10.316 14.926 310 HE2 LYS 700 HE2 LYS 700 10.034 -8.610 15.507 311 HE3 LYS 700 HE3 LYS 700 9.601 -7.624 14.109 312 HZ1 LYS 700 HZ1 LYS 700 7.729 -6.852 15.106 313 HZ2 LYS 700 HZ2 LYS 700 7.461 -8.276 16.026 314 HZ3 LYS 700 HZ3 LYS 700 8.643 -7.134 16.513 315 H ASP 701 H ASP 701 5.714 -9.070 12.640 316 HA ASP 701 HA ASP 701 3.967 -11.256 13.554 317 HB2 ASP 701 HB2 ASP 701 3.775 -9.836 15.751 318 HB3 ASP 701 HB3 ASP 701 5.109 -10.966 15.555 319 H ALA 702 H ALA 702 4.315 -7.718 13.744 320 HA ALA 702 HA ALA 702 1.762 -6.877 14.028 321 HB1 ALA 702 HB1 ALA 702 4.002 -5.578 13.498 322 HB2 ALA 702 HB2 ALA 702 2.432 -4.828 13.213 323 HB3 ALA 702 HB3 ALA 702 3.330 -5.532 11.867 324 H ALA 703 H ALA 703 3.154 -7.954 10.934 325 HA ALA 703 HA ALA 703 0.689 -8.940 9.958 326 HB1 ALA 703 HB1 ALA 703 1.383 -6.589 8.296 327 HB2 ALA 703 HB2 ALA 703 0.659 -6.241 9.866 328 HB3 ALA 703 HB3 ALA 703 -0.194 -7.260 8.712 329 H GLU 704 H GLU 704 1.184 -8.289 7.159 330 HA GLU 704 HA GLU 704 3.560 -10.004 6.727 331 HB2 GLU 704 HB2 GLU 704 0.884 -10.117 5.741 332 HB3 GLU 704 HB3 GLU 704 1.952 -9.794 4.377 333 HG2 GLU 704 HG2 GLU 704 3.384 -11.700 5.067 334 HG3 GLU 704 HG3 GLU 704 2.268 -12.042 6.386 335 H PHE 705 H PHE 705 1.783 -7.356 5.109 336 HA PHE 705 HA PHE 705 4.381 -6.246 4.191 337 HB2 PHE 705 HB2 PHE 705 1.776 -6.389 2.644 338 HB3 PHE 705 HB3 PHE 705 3.200 -5.489 2.132 339 HD1 PHE 705 HD1 PHE 705 1.774 -8.848 2.654 340 HD2 PHE 705 HD2 PHE 705 5.204 -6.617 1.361 341 HE1 PHE 705 HE1 PHE 705 2.730 -10.899 1.644 342 HE2 PHE 705 HE2 PHE 705 6.161 -8.672 0.358 343 HZ PHE 705 HZ PHE 705 4.921 -10.813 0.496 344 H ALA 706 H ALA 706 4.229 -3.898 3.667 345 HA ALA 706 HA ALA 706 2.087 -2.560 5.204 346 HB1 ALA 706 HB1 ALA 706 4.757 -1.281 5.262 347 HB2 ALA 706 HB2 ALA 706 4.575 -2.746 6.229 348 HB3 ALA 706 HB3 ALA 706 3.514 -1.363 6.508 349 H ILE 707 H ILE 707 1.050 -1.078 4.069 350 HA ILE 707 HA ILE 707 2.021 -0.318 1.439 351 HB ILE 707 HB ILE 707 -0.426 0.760 2.861 352 HG12 ILE 707 HG12 ILE 707 -1.461 -1.176 1.341 353 HG13 ILE 707 HG13 ILE 707 0.115 -1.912 1.627 354 HG21 ILE 707 HG21 ILE 707 -0.206 1.973 0.883 355 HG22 ILE 707 HG22 ILE 707 0.578 0.639 0.031 356 HG23 ILE 707 HG23 ILE 707 -1.160 0.602 0.322 357 HD11 ILE 707 HD11 ILE 707 -0.880 -0.821 4.097 358 HD12 ILE 707 HD12 ILE 707 -2.106 -1.859 3.384 359 HD13 ILE 707 HD13 ILE 707 -0.499 -2.497 3.709 360 H SER 708 H SER 708 1.684 2.135 0.904 361 HA SER 708 HA SER 708 2.234 4.052 2.931 362 HB2 SER 708 HB2 SER 708 4.549 2.978 1.328 363 HB3 SER 708 HB3 SER 708 4.581 4.570 2.079 364 HG SER 708 HG SER 708 3.791 2.324 3.609 365 H ILE 709 H ILE 709 1.318 5.842 2.130 366 HA ILE 709 HA ILE 709 1.518 6.353 -0.784 367 HB ILE 709 HB ILE 709 -0.862 7.276 0.785 368 HG12 ILE 709 HG12 ILE 709 -1.883 5.046 -0.265 369 HG13 ILE 709 HG13 ILE 709 -0.233 4.468 -0.015 370 HG21 ILE 709 HG21 ILE 709 -0.016 7.433 -1.893 371 HG22 ILE 709 HG22 ILE 709 -1.316 6.239 -1.884 372 HG23 ILE 709 HG23 ILE 709 -1.603 7.861 -1.254 373 HD11 ILE 709 HD11 ILE 709 -0.328 5.105 2.339 374 HD12 ILE 709 HD12 ILE 709 -1.927 5.805 2.110 375 HD13 ILE 709 HD13 ILE 709 -1.700 4.062 1.963 376 H LYS 710 H LYS 710 2.007 8.379 -1.405 377 HA LYS 710 HA LYS 710 2.733 10.288 0.691 378 HB2 LYS 710 HB2 LYS 710 4.385 10.027 -1.036 379 HB3 LYS 710 HB3 LYS 710 3.172 10.208 -2.301 380 HG2 LYS 710 HG2 LYS 710 4.326 12.299 -2.166 381 HG3 LYS 710 HG3 LYS 710 2.752 12.548 -1.422 382 HD2 LYS 710 HD2 LYS 710 3.620 12.682 0.722 383 HD3 LYS 710 HD3 LYS 710 5.062 11.730 0.325 384 HE2 LYS 710 HE2 LYS 710 4.495 14.511 -0.751 385 HE3 LYS 710 HE3 LYS 710 5.551 14.170 0.623 386 HZ1 LYS 710 HZ1 LYS 710 6.058 13.822 -2.210 387 HZ2 LYS 710 HZ2 LYS 710 7.164 13.927 -0.902 388 HZ3 LYS 710 HZ3 LYS 710 6.426 12.428 -1.285 389 H TYR 711 H TYR 711 0.854 11.148 1.451 390 HA TYR 711 HA TYR 711 -0.704 12.782 -0.448 391 HB2 TYR 711 HB2 TYR 711 -2.017 10.761 -0.202 392 HB3 TYR 711 HB3 TYR 711 -1.848 10.813 1.551 393 HD1 TYR 711 HD1 TYR 711 -2.878 13.184 -1.189 394 HD2 TYR 711 HD2 TYR 711 -3.708 11.568 2.702 395 HE1 TYR 711 HE1 TYR 711 -4.905 14.607 -1.027 396 HE2 TYR 711 HE2 TYR 711 -5.735 12.990 2.863 397 HH TYR 711 HH TYR 711 -7.283 14.234 0.537 398 H ASN 712 H ASN 712 -0.434 14.776 0.230 399 HA ASN 712 HA ASN 712 -0.731 16.611 1.634 400 HB2 ASN 712 HB2 ASN 712 -2.265 15.176 3.058 401 HB3 ASN 712 HB3 ASN 712 -0.840 14.702 3.976 402 HD21 ASN 712 HD21 ASN 712 -0.441 15.961 5.767 403 HD22 ASN 712 HD22 ASN 712 -0.946 17.582 5.943 404 H VAL 713 H VAL 713 1.634 15.921 0.636 405 HA VAL 713 HA VAL 713 3.921 15.898 0.924 406 HB VAL 713 HB VAL 713 4.773 17.744 2.241 407 HG11 VAL 713 HG11 VAL 713 2.425 17.994 0.486 408 HG12 VAL 713 HG12 VAL 713 2.681 19.395 1.525 409 HG13 VAL 713 HG13 VAL 713 3.962 18.860 0.439 410 HG21 VAL 713 HG21 VAL 713 3.247 17.244 4.244 411 HG22 VAL 713 HG22 VAL 713 3.477 18.946 3.850 412 HG23 VAL 713 HG23 VAL 713 1.992 18.125 3.375 413 H GLU 714 H GLU 714 2.607 13.804 2.294 414 HA GLU 714 HA GLU 714 4.675 13.093 4.204 415 HB2 GLU 714 HB2 GLU 714 3.117 12.558 6.010 416 HB3 GLU 714 HB3 GLU 714 2.968 14.269 5.593 417 HG2 GLU 714 HG2 GLU 714 1.054 13.628 4.066 418 HG3 GLU 714 HG3 GLU 714 1.129 12.010 4.754 419 H VAL 715 H VAL 715 4.559 10.793 4.768 420 HA VAL 715 HA VAL 715 3.103 9.246 2.709 421 HB VAL 715 HB VAL 715 5.626 8.415 4.137 422 HG11 VAL 715 HG11 VAL 715 4.182 7.431 1.653 423 HG12 VAL 715 HG12 VAL 715 5.754 6.844 2.199 424 HG13 VAL 715 HG13 VAL 715 4.320 6.576 3.190 425 HG21 VAL 715 HG21 VAL 715 5.159 9.984 1.602 426 HG22 VAL 715 HG22 VAL 715 6.309 10.306 2.897 427 HG23 VAL 715 HG23 VAL 715 6.591 8.976 1.777 428 H LYS 716 H LYS 716 1.387 8.248 3.522 429 HA LYS 716 HA LYS 716 1.279 7.522 6.353 430 HB2 LYS 716 HB2 LYS 716 -0.895 6.845 4.399 431 HB3 LYS 716 HB3 LYS 716 -1.026 7.346 6.085 432 HG2 LYS 716 HG2 LYS 716 0.183 9.538 4.910 433 HG3 LYS 716 HG3 LYS 716 -0.922 8.989 3.648 434 HD2 LYS 716 HD2 LYS 716 -2.810 9.109 5.148 435 HD3 LYS 716 HD3 LYS 716 -1.755 9.421 6.529 436 HE2 LYS 716 HE2 LYS 716 -1.074 11.394 4.648 437 HE3 LYS 716 HE3 LYS 716 -2.835 11.299 4.594 438 HZ1 LYS 716 HZ1 LYS 716 -2.378 11.186 7.228 439 HZ2 LYS 716 HZ2 LYS 716 -1.079 12.205 6.738 440 HZ3 LYS 716 HZ3 LYS 716 -2.702 12.616 6.385 441 H HIS 717 H HIS 717 2.105 5.646 7.000 442 HA HIS 717 HA HIS 717 2.151 3.351 5.160 443 HB2 HIS 717 HB2 HIS 717 3.565 3.528 7.811 444 HB3 HIS 717 HB3 HIS 717 3.929 2.482 6.440 445 HD1 HIS 717 HD1 HIS 717 4.990 3.642 4.296 446 HD2 HIS 717 HD2 HIS 717 4.727 6.076 7.692 447 HE1 HIS 717 HE1 HIS 717 6.636 5.547 3.966 448 HE2 HIS 717 HE2 HIS 717 6.513 7.048 6.032 449 H ILE 718 H ILE 718 1.243 1.454 5.638 450 HA ILE 718 HA ILE 718 -0.056 1.016 8.233 451 HB ILE 718 HB ILE 718 -1.522 0.762 5.596 452 HG12 ILE 718 HG12 ILE 718 -2.654 2.507 7.664 453 HG13 ILE 718 HG13 ILE 718 -1.104 3.081 7.056 454 HG21 ILE 718 HG21 ILE 718 -2.796 -0.700 6.729 455 HG22 ILE 718 HG22 ILE 718 -1.960 -0.359 8.245 456 HG23 ILE 718 HG23 ILE 718 -3.317 0.648 7.737 457 HD11 ILE 718 HD11 ILE 718 -3.661 2.620 5.566 458 HD12 ILE 718 HD12 ILE 718 -2.581 4.013 5.519 459 HD13 ILE 718 HD13 ILE 718 -2.119 2.515 4.710 460 H LYS 719 H LYS 719 -0.027 -1.104 8.844 461 HA LYS 719 HA LYS 719 1.484 -2.964 7.216 462 HB2 LYS 719 HB2 LYS 719 1.097 -4.505 9.197 463 HB3 LYS 719 HB3 LYS 719 1.996 -3.034 9.531 464 HG2 LYS 719 HG2 LYS 719 0.508 -2.745 11.223 465 HG3 LYS 719 HG3 LYS 719 -0.593 -2.205 9.959 466 HD2 LYS 719 HD2 LYS 719 -0.949 -4.888 9.761 467 HD3 LYS 719 HD3 LYS 719 -0.565 -4.756 11.478 468 HE2 LYS 719 HE2 LYS 719 -2.809 -4.325 11.648 469 HE3 LYS 719 HE3 LYS 719 -2.295 -2.687 11.243 470 HZ1 LYS 719 HZ1 LYS 719 -3.701 -2.890 9.534 471 HZ2 LYS 719 HZ2 LYS 719 -2.503 -3.872 8.805 472 HZ3 LYS 719 HZ3 LYS 719 -3.808 -4.600 9.677 473 H ILE 720 H ILE 720 0.647 -4.257 5.768 474 HA ILE 720 HA ILE 720 -2.200 -4.622 5.471 475 HB ILE 720 HB ILE 720 0.141 -4.901 3.850 476 HG12 ILE 720 HG12 ILE 720 -2.658 -5.446 2.910 477 HG13 ILE 720 HG13 ILE 720 -2.227 -3.840 3.493 478 HG21 ILE 720 HG21 ILE 720 -1.654 -7.347 3.863 479 HG22 ILE 720 HG22 ILE 720 -0.423 -6.994 2.653 480 HG23 ILE 720 HG23 ILE 720 0.049 -7.317 4.320 481 HD11 ILE 720 HD11 ILE 720 -1.337 -5.261 1.041 482 HD12 ILE 720 HD12 ILE 720 -1.588 -3.537 1.311 483 HD13 ILE 720 HD13 ILE 720 -0.107 -4.310 1.876 484 H MET 721 H MET 721 -3.417 -6.368 5.961 485 HA MET 721 HA MET 721 -2.287 -8.357 7.762 486 HB2 MET 721 HB2 MET 721 -4.659 -7.137 7.784 487 HB3 MET 721 HB3 MET 721 -5.100 -8.524 6.790 488 HG2 MET 721 HG2 MET 721 -3.516 -9.434 9.018 489 HG3 MET 721 HG3 MET 721 -4.844 -8.439 9.616 490 HE1 MET 721 HE1 MET 721 -4.101 -11.750 9.708 491 HE2 MET 721 HE2 MET 721 -5.212 -10.902 10.782 492 HE3 MET 721 HE3 MET 721 -5.756 -12.328 9.888 493 H THR 722 H THR 722 -3.623 -10.612 7.292 494 HA THR 722 HA THR 722 -3.263 -11.413 4.499 495 HB THR 722 HB THR 722 -1.047 -11.623 5.663 496 HG1 THR 722 HG1 THR 722 -0.625 -13.540 4.749 497 HG21 THR 722 HG21 THR 722 -1.999 -14.028 7.110 498 HG22 THR 722 HG22 THR 722 -0.747 -12.865 7.548 499 HG23 THR 722 HG23 THR 722 -2.446 -12.469 7.806 500 H ALA 723 H ALA 723 -5.573 -11.118 6.034 501 HA ALA 723 HA ALA 723 -6.580 -13.291 7.412 502 HB1 ALA 723 HB1 ALA 723 -8.829 -12.544 6.368 503 HB2 ALA 723 HB2 ALA 723 -7.879 -11.268 5.602 504 HB3 ALA 723 HB3 ALA 723 -7.946 -11.384 7.361 505 H GLU 724 H GLU 724 -6.629 -15.365 6.866 506 HA GLU 724 HA GLU 724 -6.650 -17.277 5.573 507 HB2 GLU 724 HB2 GLU 724 -8.785 -15.953 3.924 508 HB3 GLU 724 HB3 GLU 724 -8.685 -17.624 4.481 509 HG2 GLU 724 HG2 GLU 724 -9.420 -15.160 6.064 510 HG3 GLU 724 HG3 GLU 724 -10.331 -16.655 5.881 511 H GLY 725 H GLY 725 -4.993 -14.917 4.625 512 HA2 GLY 725 HA2 GLY 725 -3.337 -15.077 2.903 513 HA3 GLY 725 HA3 GLY 725 -4.493 -15.953 1.907 514 H LEU 726 H LEU 726 -6.351 -13.596 3.141 515 HA LEU 726 HA LEU 726 -6.102 -11.972 0.726 516 HB2 LEU 726 HB2 LEU 726 -8.020 -11.553 3.029 517 HB3 LEU 726 HB3 LEU 726 -8.162 -10.948 1.380 518 HG LEU 726 HG LEU 726 -8.124 -13.894 2.079 519 HD11 LEU 726 HD11 LEU 726 -10.348 -11.895 1.893 520 HD12 LEU 726 HD12 LEU 726 -10.635 -13.543 1.329 521 HD13 LEU 726 HD13 LEU 726 -10.155 -13.252 3.002 522 HD21 LEU 726 HD21 LEU 726 -8.196 -12.292 -0.399 523 HD22 LEU 726 HD22 LEU 726 -7.709 -13.970 -0.161 524 HD23 LEU 726 HD23 LEU 726 -9.417 -13.560 -0.324 525 H TYR 727 H TYR 727 -5.362 -9.916 0.618 526 HA TYR 727 HA TYR 727 -4.000 -8.885 3.008 527 HB2 TYR 727 HB2 TYR 727 -3.815 -8.208 0.072 528 HB3 TYR 727 HB3 TYR 727 -3.006 -7.273 1.326 529 HD1 TYR 727 HD2 TYR 727 -3.134 -10.567 2.548 530 HD2 TYR 727 HD1 TYR 727 -1.120 -8.167 -0.378 531 HE1 TYR 727 HE2 TYR 727 -1.243 -12.169 2.521 532 HE2 TYR 727 HE1 TYR 727 0.767 -9.752 -0.401 533 HH TYR 727 HH TYR 727 1.189 -12.130 1.983 534 H ARG 728 H ARG 728 -4.386 -6.858 3.833 535 HA ARG 728 HA ARG 728 -6.458 -5.166 2.685 536 HB2 ARG 728 HB2 ARG 728 -7.492 -5.260 5.160 537 HB3 ARG 728 HB3 ARG 728 -8.052 -6.310 3.867 538 HG2 ARG 728 HG2 ARG 728 -6.418 -8.048 4.610 539 HG3 ARG 728 HG3 ARG 728 -5.957 -6.997 5.946 540 HD2 ARG 728 HD2 ARG 728 -8.821 -7.254 5.905 541 HD3 ARG 728 HD3 ARG 728 -8.096 -8.863 5.851 542 HE ARG 728 HE ARG 728 -6.926 -7.101 7.849 543 HH11 ARG 728 HH21 ARG 728 -9.401 -9.401 7.143 544 HH12 ARG 728 HH22 ARG 728 -9.625 -9.855 8.792 545 HH21 ARG 728 HH11 ARG 728 -7.222 -7.657 9.991 546 HH22 ARG 728 HH12 ARG 728 -8.405 -8.876 10.399 547 H ILE 729 H ILE 729 -6.116 -3.077 3.164 548 HA ILE 729 HA ILE 729 -3.811 -2.359 4.777 549 HB ILE 729 HB ILE 729 -5.738 -0.432 3.510 550 HG12 ILE 729 HG12 ILE 729 -3.564 -2.068 2.180 551 HG13 ILE 729 HG13 ILE 729 -5.268 -2.006 1.746 552 HG21 ILE 729 HG21 ILE 729 -2.963 -0.399 4.562 553 HG22 ILE 729 HG22 ILE 729 -3.271 0.574 3.129 554 HG23 ILE 729 HG23 ILE 729 -4.200 0.855 4.600 555 HD11 ILE 729 HD11 ILE 729 -3.129 0.052 1.305 556 HD12 ILE 729 HD12 ILE 729 -4.312 -0.582 0.162 557 HD13 ILE 729 HD13 ILE 729 -4.816 0.552 1.416 558 H THR 730 H THR 730 -7.287 -2.167 4.965 559 HA THR 730 HA THR 730 -7.076 -0.804 7.590 560 HB THR 730 HB THR 730 -8.290 0.387 5.792 561 HG1 THR 730 HG1 THR 730 -9.702 1.096 7.184 562 HG21 THR 730 HG21 THR 730 -9.953 -0.553 4.565 563 HG22 THR 730 HG22 THR 730 -9.218 -2.070 5.075 564 HG23 THR 730 HG23 THR 730 -10.605 -1.421 5.947 565 H GLU 731 H GLU 731 -7.607 -3.701 6.092 566 HA GLU 731 HA GLU 731 -8.195 -5.747 6.878 567 HB2 GLU 731 HB2 GLU 731 -8.708 -4.439 9.539 568 HB3 GLU 731 HB3 GLU 731 -8.289 -6.122 9.220 569 HG2 GLU 731 HG2 GLU 731 -6.254 -4.778 7.934 570 HG3 GLU 731 HG3 GLU 731 -6.546 -3.736 9.320 571 H LYS 732 H LYS 732 -10.179 -3.273 6.419 572 HA LYS 732 HA LYS 732 -12.650 -4.640 7.240 573 HB2 LYS 732 HB2 LYS 732 -12.478 -1.967 5.852 574 HB3 LYS 732 HB3 LYS 732 -13.773 -2.595 6.866 575 HG2 LYS 732 HG2 LYS 732 -10.975 -1.979 7.869 576 HG3 LYS 732 HG3 LYS 732 -12.347 -0.887 8.029 577 HD2 LYS 732 HD2 LYS 732 -12.758 -3.680 8.984 578 HD3 LYS 732 HD3 LYS 732 -11.682 -2.668 9.944 579 HE2 LYS 732 HE2 LYS 732 -14.256 -1.449 9.070 580 HE3 LYS 732 HE3 LYS 732 -14.334 -2.686 10.327 581 HZ1 LYS 732 HZ1 LYS 732 -13.267 -1.402 11.825 582 HZ2 LYS 732 HZ2 LYS 732 -12.228 -0.697 10.641 583 HZ3 LYS 732 HZ3 LYS 732 -13.826 -0.122 10.824 584 H LYS 733 H LYS 733 -10.805 -3.662 4.436 585 HA LYS 733 HA LYS 733 -12.568 -5.306 2.735 586 HB2 LYS 733 HB2 LYS 733 -13.144 -3.045 2.176 587 HB3 LYS 733 HB3 LYS 733 -11.451 -2.560 2.121 588 HG2 LYS 733 HG2 LYS 733 -12.354 -2.877 -0.157 589 HG3 LYS 733 HG3 LYS 733 -11.078 -4.046 0.186 590 HD2 LYS 733 HD2 LYS 733 -12.853 -5.710 0.827 591 HD3 LYS 733 HD3 LYS 733 -14.069 -4.548 0.298 592 HE2 LYS 733 HE2 LYS 733 -11.892 -5.094 -1.640 593 HE3 LYS 733 HE3 LYS 733 -12.989 -6.441 -1.332 594 HZ1 LYS 733 HZ1 LYS 733 -14.176 -5.376 -2.915 595 HZ2 LYS 733 HZ2 LYS 733 -14.746 -4.494 -1.580 596 HZ3 LYS 733 HZ3 LYS 733 -13.522 -3.844 -2.561 597 H ALA 734 H ALA 734 -11.231 -7.044 2.616 598 HA ALA 734 HA ALA 734 -8.407 -6.679 1.968 599 HB1 ALA 734 HB1 ALA 734 -9.951 -9.227 2.503 600 HB2 ALA 734 HB2 ALA 734 -9.124 -8.280 3.739 601 HB3 ALA 734 HB3 ALA 734 -8.196 -9.048 2.451 602 H PHE 735 H PHE 735 -7.502 -8.349 0.392 603 HA PHE 735 HA PHE 735 -9.275 -8.820 -1.907 604 HB2 PHE 735 HB2 PHE 735 -7.043 -6.907 -1.783 605 HB3 PHE 735 HB3 PHE 735 -6.998 -7.992 -3.170 606 HD1 PHE 735 HD2 PHE 735 -9.160 -8.268 -4.549 607 HD2 PHE 735 HD1 PHE 735 -8.531 -5.081 -1.742 608 HE1 PHE 735 HE2 PHE 735 -10.974 -6.969 -5.622 609 HE2 PHE 735 HE1 PHE 735 -10.347 -3.780 -2.815 610 HZ PHE 735 HZ PHE 735 -11.571 -4.724 -4.754 611 H ARG 736 H ARG 736 -8.042 -10.102 -3.637 612 HA ARG 736 HA ARG 736 -7.314 -12.594 -2.674 613 HB2 ARG 736 HB2 ARG 736 -7.042 -11.177 -5.257 614 HB3 ARG 736 HB3 ARG 736 -6.001 -12.581 -5.031 615 HG2 ARG 736 HG2 ARG 736 -7.853 -13.688 -5.804 616 HG3 ARG 736 HG3 ARG 736 -8.306 -13.621 -4.099 617 HD2 ARG 736 HD2 ARG 736 -10.174 -12.832 -5.436 618 HD3 ARG 736 HD3 ARG 736 -9.493 -11.478 -4.543 619 HE ARG 736 HE ARG 736 -8.852 -10.502 -6.554 620 HH11 ARG 736 HH21 ARG 736 -9.633 -13.844 -7.015 621 HH12 ARG 736 HH22 ARG 736 -9.400 -13.793 -8.724 622 HH21 ARG 736 HH11 ARG 736 -8.477 -10.452 -8.747 623 HH22 ARG 736 HH12 ARG 736 -8.751 -11.884 -9.703 624 H GLY 737 H GLY 737 -5.228 -9.863 -3.465 625 HA2 GLY 737 HA2 GLY 737 -3.110 -10.953 -1.806 626 HA3 GLY 737 HA3 GLY 737 -2.724 -10.819 -3.522 627 H LEU 738 H LEU 738 -1.083 -9.305 -2.804 628 HA LEU 738 HA LEU 738 -1.851 -6.800 -1.634 629 HB2 LEU 738 HB2 LEU 738 0.560 -8.158 -2.034 630 HB3 LEU 738 HB3 LEU 738 0.677 -6.726 -3.057 631 HG LEU 738 HG LEU 738 -0.211 -6.614 -0.165 632 HD11 LEU 738 HD11 LEU 738 2.038 -5.878 0.371 633 HD12 LEU 738 HD12 LEU 738 2.119 -7.468 -0.376 634 HD13 LEU 738 HD13 LEU 738 2.527 -6.031 -1.315 635 HD21 LEU 738 HD21 LEU 738 0.130 -4.255 -0.416 636 HD22 LEU 738 HD22 LEU 738 0.873 -4.473 -2.001 637 HD23 LEU 738 HD23 LEU 738 -0.848 -4.782 -1.779 638 H THR 739 H THR 739 -0.945 -7.901 -4.883 639 HA THR 739 HA THR 739 -1.099 -5.486 -6.235 640 HB THR 739 HB THR 739 -2.165 -8.106 -7.301 641 HG1 THR 739 HG1 THR 739 -0.218 -8.850 -7.331 642 HG21 THR 739 HG21 THR 739 -1.261 -7.179 -9.446 643 HG22 THR 739 HG22 THR 739 -2.595 -6.247 -8.769 644 HG23 THR 739 HG23 THR 739 -0.938 -5.667 -8.596 645 H GLU 740 H GLU 740 -3.661 -7.885 -5.786 646 HA GLU 740 HA GLU 740 -5.789 -6.354 -6.809 647 HB2 GLU 740 HB2 GLU 740 -5.678 -8.594 -4.790 648 HB3 GLU 740 HB3 GLU 740 -7.191 -7.896 -5.358 649 HG2 GLU 740 HG2 GLU 740 -5.500 -8.481 -7.621 650 HG3 GLU 740 HG3 GLU 740 -5.646 -9.916 -6.609 651 H LEU 741 H LEU 741 -4.387 -6.569 -3.614 652 HA LEU 741 HA LEU 741 -6.403 -5.022 -2.312 653 HB2 LEU 741 HB2 LEU 741 -4.979 -6.692 -1.180 654 HB3 LEU 741 HB3 LEU 741 -3.572 -5.680 -1.470 655 HG LEU 741 HG LEU 741 -4.746 -5.564 0.838 656 HD11 LEU 741 HD11 LEU 741 -3.599 -3.653 1.095 657 HD12 LEU 741 HD12 LEU 741 -3.184 -3.830 -0.605 658 HD13 LEU 741 HD13 LEU 741 -4.542 -2.810 -0.132 659 HD21 LEU 741 HD21 LEU 741 -6.595 -3.989 0.990 660 HD22 LEU 741 HD22 LEU 741 -6.549 -3.716 -0.746 661 HD23 LEU 741 HD23 LEU 741 -7.039 -5.286 -0.117 662 H VAL 742 H VAL 742 -3.261 -4.238 -3.779 663 HA VAL 742 HA VAL 742 -3.585 -1.424 -2.960 664 HB VAL 742 HB VAL 742 -1.328 -3.023 -4.102 665 HG11 VAL 742 HG11 VAL 742 -1.615 -0.012 -4.176 666 HG12 VAL 742 HG12 VAL 742 -0.071 -0.851 -4.315 667 HG13 VAL 742 HG13 VAL 742 -1.315 -1.088 -5.542 668 HG21 VAL 742 HG21 VAL 742 -1.091 -0.936 -1.991 669 HG22 VAL 742 HG22 VAL 742 -1.979 -2.404 -1.582 670 HG23 VAL 742 HG23 VAL 742 -0.302 -2.508 -2.112 671 H GLU 743 H GLU 743 -3.836 -3.432 -5.838 672 HA GLU 743 HA GLU 743 -3.929 -1.147 -7.610 673 HB2 GLU 743 HB2 GLU 743 -4.607 -4.058 -8.081 674 HB3 GLU 743 HB3 GLU 743 -4.577 -2.820 -9.334 675 HG2 GLU 743 HG2 GLU 743 -2.192 -3.419 -7.565 676 HG3 GLU 743 HG3 GLU 743 -2.447 -4.202 -9.118 677 H PHE 744 H PHE 744 -6.009 -2.139 -5.335 678 HA PHE 744 HA PHE 744 -8.384 -1.400 -6.939 679 HB2 PHE 744 HB2 PHE 744 -8.427 -3.658 -5.832 680 HB3 PHE 744 HB3 PHE 744 -8.363 -2.833 -4.275 681 HD1 PHE 744 HD1 PHE 744 -10.240 -1.478 -3.479 682 HD2 PHE 744 HD2 PHE 744 -10.409 -3.496 -7.267 683 HE1 PHE 744 HE1 PHE 744 -12.686 -1.092 -3.575 684 HE2 PHE 744 HE2 PHE 744 -12.855 -3.104 -7.364 685 HZ PHE 744 HZ PHE 744 -13.994 -1.900 -5.519 686 H TYR 745 H TYR 745 -6.700 -0.898 -3.858 687 HA TYR 745 HA TYR 745 -8.477 1.066 -2.846 688 HB2 TYR 745 HB2 TYR 745 -5.637 0.317 -2.251 689 HB3 TYR 745 HB3 TYR 745 -6.311 1.797 -1.572 690 HD1 TYR 745 HD1 TYR 745 -7.538 -1.706 -2.168 691 HD2 TYR 745 HD2 TYR 745 -7.145 1.558 0.617 692 HE1 TYR 745 HE1 TYR 745 -8.690 -3.045 -0.425 693 HE2 TYR 745 HE2 TYR 745 -8.285 0.204 2.346 694 HH TYR 745 HH TYR 745 -9.183 -3.187 1.780 695 H GLN 746 H GLN 746 -6.354 1.139 -5.469 696 HA GLN 746 HA GLN 746 -5.561 3.880 -5.428 697 HB2 GLN 746 HB2 GLN 746 -5.293 3.475 -7.955 698 HB3 GLN 746 HB3 GLN 746 -4.319 2.472 -6.879 699 HG2 GLN 746 HG2 GLN 746 -5.426 0.569 -7.431 700 HG3 GLN 746 HG3 GLN 746 -6.990 1.370 -7.500 701 HE21 GLN 746 HE21 GLN 746 -4.374 0.165 -9.417 702 HE22 GLN 746 HE22 GLN 746 -4.929 0.754 -10.907 703 H GLN 747 H GLN 747 -8.477 2.233 -6.147 704 HA GLN 747 HA GLN 747 -9.652 4.640 -7.403 705 HB2 GLN 747 HB2 GLN 747 -11.058 1.992 -7.242 706 HB3 GLN 747 HB3 GLN 747 -11.209 3.263 -8.455 707 HG2 GLN 747 HG2 GLN 747 -8.498 2.386 -8.489 708 HG3 GLN 747 HG3 GLN 747 -9.507 0.946 -8.497 709 HE21 GLN 747 HE21 GLN 747 -7.866 2.261 -10.704 710 HE22 GLN 747 HE22 GLN 747 -8.983 2.472 -11.975 711 H ASN 748 H ASN 748 -10.007 2.291 -4.804 712 HA ASN 748 HA ASN 748 -12.408 3.421 -3.738 713 HB2 ASN 748 HB2 ASN 748 -12.117 1.210 -3.090 714 HB3 ASN 748 HB3 ASN 748 -10.391 1.409 -2.815 715 HD21 ASN 748 HD21 ASN 748 -13.574 2.334 -1.450 716 HD22 ASN 748 HD22 ASN 748 -13.013 2.494 0.154 717 H SER 749 H SER 749 -12.577 5.299 -2.703 718 HA SER 749 HA SER 749 -10.456 6.992 -2.052 719 HB2 SER 749 HB2 SER 749 -12.046 8.417 -1.160 720 HB3 SER 749 HB3 SER 749 -13.009 7.450 -2.264 721 HG SER 749 HG SER 749 -12.781 6.253 0.169 722 H LEU 750 H LEU 750 -8.909 6.658 -0.627 723 HA LEU 750 HA LEU 750 -8.886 4.744 1.399 724 HB2 LEU 750 HB2 LEU 750 -7.323 7.334 1.234 725 HB3 LEU 750 HB3 LEU 750 -6.949 5.999 2.323 726 HG LEU 750 HG LEU 750 -7.008 5.857 -0.702 727 HD11 LEU 750 HD11 LEU 750 -4.983 6.690 1.123 728 HD12 LEU 750 HD12 LEU 750 -4.508 5.117 0.483 729 HD13 LEU 750 HD13 LEU 750 -4.842 6.453 -0.620 730 HD21 LEU 750 HD21 LEU 750 -7.371 3.654 -0.336 731 HD22 LEU 750 HD22 LEU 750 -5.719 3.606 0.276 732 HD23 LEU 750 HD23 LEU 750 -7.066 3.811 1.393 733 H LYS 751 H LYS 751 -10.099 8.005 1.400 734 HA LYS 751 HA LYS 751 -10.257 8.578 4.108 735 HB2 LYS 751 HB2 LYS 751 -11.760 10.234 3.529 736 HB3 LYS 751 HB3 LYS 751 -10.915 9.967 2.008 737 HG2 LYS 751 HG2 LYS 751 -12.862 8.130 1.729 738 HG3 LYS 751 HG3 LYS 751 -13.710 9.283 2.757 739 HD2 LYS 751 HD2 LYS 751 -12.588 9.693 0.005 740 HD3 LYS 751 HD3 LYS 751 -14.217 10.007 0.579 741 HE2 LYS 751 HE2 LYS 751 -11.743 11.631 0.878 742 HE3 LYS 751 HE3 LYS 751 -13.363 12.152 0.461 743 HZ1 LYS 751 HZ1 LYS 751 -12.226 12.517 2.844 744 HZ2 LYS 751 HZ2 LYS 751 -13.919 12.393 2.604 745 HZ3 LYS 751 HZ3 LYS 751 -13.049 11.032 3.113 746 H ASP 752 H ASP 752 -11.829 6.094 2.372 747 HA ASP 752 HA ASP 752 -13.955 5.806 4.385 748 HB2 ASP 752 HB2 ASP 752 -15.133 5.134 2.601 749 HB3 ASP 752 HB3 ASP 752 -13.699 5.226 1.590 750 H CYS 753 H CYS 753 -11.293 3.966 2.927 751 HA CYS 753 HA CYS 753 -11.520 1.808 4.840 752 HB2 CYS 753 HB2 CYS 753 -9.452 2.473 2.735 753 HB3 CYS 753 HB3 CYS 753 -9.395 1.034 3.747 754 HG CYS 753 HG CYS 753 -11.582 1.595 1.591 755 H PHE 754 H PHE 754 -9.337 4.551 4.258 756 HA PHE 754 HA PHE 754 -7.631 3.844 6.492 757 HB2 PHE 754 HB2 PHE 754 -7.755 6.186 4.601 758 HB3 PHE 754 HB3 PHE 754 -6.634 6.145 5.957 759 HD1 PHE 754 HD2 PHE 754 -7.672 3.102 4.074 760 HD2 PHE 754 HD1 PHE 754 -4.616 6.068 4.648 761 HE1 PHE 754 HE2 PHE 754 -6.101 1.741 2.737 762 HE2 PHE 754 HE1 PHE 754 -3.053 4.703 3.311 763 HZ PHE 754 HZ PHE 754 -3.787 2.543 2.349 764 H LYS 755 H LYS 755 -8.147 7.195 6.436 765 HA LYS 755 HA LYS 755 -10.242 7.290 8.446 766 HB2 LYS 755 HB2 LYS 755 -8.324 6.581 9.778 767 HB3 LYS 755 HB3 LYS 755 -7.388 7.945 9.175 768 HG2 LYS 755 HG2 LYS 755 -8.956 9.519 10.219 769 HG3 LYS 755 HG3 LYS 755 -9.975 8.179 10.745 770 HD2 LYS 755 HD2 LYS 755 -8.758 8.128 12.635 771 HD3 LYS 755 HD3 LYS 755 -7.437 7.492 11.661 772 HE2 LYS 755 HE2 LYS 755 -7.957 10.373 12.430 773 HE3 LYS 755 HE3 LYS 755 -6.536 9.393 12.794 774 HZ1 LYS 755 HZ1 LYS 755 -7.202 10.875 10.387 775 HZ2 LYS 755 HZ2 LYS 755 -5.673 10.367 10.980 776 HZ3 LYS 755 HZ3 LYS 755 -6.637 9.289 10.098 777 H SER 756 H SER 756 -7.775 9.643 8.711 778 HA SER 756 HA SER 756 -9.529 11.696 7.711 779 HB2 SER 756 HB2 SER 756 -6.630 12.073 8.452 780 HB3 SER 756 HB3 SER 756 -7.952 13.233 8.569 781 HG SER 756 HG SER 756 -8.669 12.263 10.358 782 H LEU 757 H LEU 757 -8.506 9.617 5.883 783 HA LEU 757 HA LEU 757 -6.657 10.969 4.106 784 HB2 LEU 757 HB2 LEU 757 -7.924 8.285 4.299 785 HB3 LEU 757 HB3 LEU 757 -7.493 8.836 2.684 786 HG LEU 757 HG LEU 757 -5.706 7.526 4.013 787 HD11 LEU 757 HD11 LEU 757 -5.194 10.210 2.752 788 HD12 LEU 757 HD12 LEU 757 -3.905 9.082 3.175 789 HD13 LEU 757 HD13 LEU 757 -5.124 8.625 1.985 790 HD21 LEU 757 HD21 LEU 757 -5.029 10.170 5.241 791 HD22 LEU 757 HD22 LEU 757 -6.208 9.137 6.048 792 HD23 LEU 757 HD23 LEU 757 -4.576 8.545 5.756 793 H ASP 758 H ASP 758 -7.219 11.123 1.768 794 HA ASP 758 HA ASP 758 -9.969 11.361 1.000 795 HB2 ASP 758 HB2 ASP 758 -8.714 13.668 2.154 796 HB3 ASP 758 HB3 ASP 758 -8.987 13.974 0.441 797 H THR 759 H THR 759 -7.940 9.821 0.086 798 HA THR 759 HA THR 759 -7.789 10.612 -2.695 799 HB THR 759 HB THR 759 -5.819 11.765 -1.694 800 HG1 THR 759 HG1 THR 759 -5.269 11.283 -3.672 801 HG21 THR 759 HG21 THR 759 -5.319 8.977 -0.706 802 HG22 THR 759 HG22 THR 759 -3.934 9.979 -1.132 803 HG23 THR 759 HG23 THR 759 -5.061 10.518 0.111 804 H THR 760 H THR 760 -5.715 8.866 -3.403 805 HA THR 760 HA THR 760 -6.281 6.226 -2.328 806 HB THR 760 HB THR 760 -7.075 5.242 -4.398 807 HG1 THR 760 HG1 THR 760 -7.110 6.296 -6.222 808 HG21 THR 760 HG21 THR 760 -8.742 7.700 -3.857 809 HG22 THR 760 HG22 THR 760 -9.294 6.140 -4.463 810 HG23 THR 760 HG23 THR 760 -8.723 6.287 -2.803 811 H LEU 761 H LEU 761 -5.060 4.531 -3.656 812 HA LEU 761 HA LEU 761 -2.325 5.171 -3.789 813 HB2 LEU 761 HB2 LEU 761 -3.909 2.929 -5.094 814 HB3 LEU 761 HB3 LEU 761 -2.157 3.008 -5.110 815 HG LEU 761 HG LEU 761 -3.142 1.518 -3.326 816 HD11 LEU 761 HD11 LEU 761 -1.272 3.768 -2.807 817 HD12 LEU 761 HD12 LEU 761 -1.787 2.790 -1.437 818 HD13 LEU 761 HD13 LEU 761 -0.977 2.027 -2.804 819 HD21 LEU 761 HD21 LEU 761 -5.063 2.990 -2.741 820 HD22 LEU 761 HD22 LEU 761 -4.104 2.521 -1.344 821 HD23 LEU 761 HD23 LEU 761 -3.927 4.134 -2.024 822 H GLN 762 H GLN 762 -2.187 7.111 -4.997 823 HA GLN 762 HA GLN 762 -3.221 7.355 -7.645 824 HB2 GLN 762 HB2 GLN 762 -1.952 9.019 -5.686 825 HB3 GLN 762 HB3 GLN 762 -1.181 9.270 -7.249 826 HG2 GLN 762 HG2 GLN 762 -4.006 9.144 -7.678 827 HG3 GLN 762 HG3 GLN 762 -3.714 10.240 -6.327 828 HE21 GLN 762 HE21 GLN 762 -1.730 11.818 -6.816 829 HE22 GLN 762 HE22 GLN 762 -1.740 12.502 -8.368 830 H PHE 763 H PHE 763 0.207 7.353 -6.551 831 HA PHE 763 HA PHE 763 0.859 5.969 -9.088 832 HB2 PHE 763 HB2 PHE 763 2.175 8.465 -8.004 833 HB3 PHE 763 HB3 PHE 763 2.873 7.475 -9.283 834 HD1 PHE 763 HD1 PHE 763 1.520 7.083 -11.406 835 HD2 PHE 763 HD2 PHE 763 0.454 10.031 -8.474 836 HE1 PHE 763 HE1 PHE 763 0.086 8.224 -13.076 837 HE2 PHE 763 HE2 PHE 763 -0.981 11.171 -10.141 838 HZ PHE 763 HZ PHE 763 -1.167 10.269 -12.443 839 HA PRO 764 HA PRO 764 3.548 3.546 -6.551 840 HB2 PRO 764 HB2 PRO 764 5.210 2.530 -8.446 841 HB3 PRO 764 HB3 PRO 764 3.506 2.053 -8.327 842 HG2 PRO 764 HG2 PRO 764 4.818 3.923 -10.215 843 HG3 PRO 764 HG3 PRO 764 3.486 2.788 -10.481 844 HD2 PRO 764 HD2 PRO 764 3.177 5.522 -10.095 845 HD3 PRO 764 HD3 PRO 764 1.900 4.309 -9.857 846 H PHE 765 H PHE 765 6.268 3.061 -6.777 847 HA PHE 765 HA PHE 765 7.434 5.775 -6.697 848 HB2 PHE 765 HB2 PHE 765 8.607 5.298 -4.727 849 HB3 PHE 765 HB3 PHE 765 7.029 4.569 -4.448 850 HD1 PHE 765 HD1 PHE 765 6.724 2.097 -4.768 851 HD2 PHE 765 HD2 PHE 765 10.585 3.968 -4.872 852 HE1 PHE 765 HE1 PHE 765 7.800 -0.109 -4.416 853 HE2 PHE 765 HE2 PHE 765 11.664 1.766 -4.522 854 HZ PHE 765 HZ PHE 765 10.272 -0.272 -4.290 855 H LYS 766 H LYS 766 7.591 2.715 -8.094 856 HA LYS 766 HA LYS 766 10.457 2.951 -8.694 857 HB2 LYS 766 HB2 LYS 766 8.472 0.760 -9.312 858 HB3 LYS 766 HB3 LYS 766 10.191 0.713 -9.698 859 HG2 LYS 766 HG2 LYS 766 10.341 1.378 -7.082 860 HG3 LYS 766 HG3 LYS 766 8.840 0.461 -7.057 861 HD2 LYS 766 HD2 LYS 766 11.048 -0.752 -8.604 862 HD3 LYS 766 HD3 LYS 766 11.297 -0.669 -6.864 863 HE2 LYS 766 HE2 LYS 766 8.601 -1.532 -7.367 864 HE3 LYS 766 HE3 LYS 766 9.704 -2.539 -8.303 865 HZ1 LYS 766 HZ1 LYS 766 9.150 -2.779 -5.615 866 HZ2 LYS 766 HZ2 LYS 766 10.433 -3.525 -6.462 867 HZ3 LYS 766 HZ3 LYS 766 10.692 -2.048 -5.671 868 H GLU 767 H GLU 767 7.290 2.977 -10.242 869 HA GLU 767 HA GLU 767 6.763 3.200 -12.528 870 HB2 GLU 767 HB2 GLU 767 7.440 5.584 -11.081 871 HB3 GLU 767 HB3 GLU 767 7.834 5.814 -12.784 872 HG2 GLU 767 HG2 GLU 767 5.472 4.716 -13.178 873 HG3 GLU 767 HG3 GLU 767 5.176 5.222 -11.522 874 H1 ASP 338 H1 ASP 338 5.053 5.019 14.753 875 H2 ASP 338 H2 ASP 338 4.904 5.820 15.876 876 H3 ASP 338 H3 ASP 338 5.032 5.119 14.331 877 HA ASP 338 HA ASP 338 5.773 7.582 13.721 878 HB2 ASP 338 HB2 ASP 338 7.399 8.103 15.732 879 HB3 ASP 338 HB3 ASP 338 5.720 8.628 15.813 880 H THR 339 H THR 339 7.115 5.039 15.827 881 HA THR 339 HA THR 339 9.669 4.857 14.735 882 HB THR 339 HB THR 339 9.561 3.506 16.573 883 HG1 THR 339 HG1 THR 339 10.297 2.099 14.975 884 HG21 THR 339 HG21 THR 339 7.441 1.894 16.751 885 HG22 THR 339 HG22 THR 339 7.371 3.571 17.289 886 HG23 THR 339 HG23 THR 339 6.729 3.124 15.709 887 H GLU 340 H GLU 340 10.533 2.988 13.487 888 HA GLU 340 HA GLU 340 9.804 3.024 10.841 889 HB2 GLU 340 HB2 GLU 340 10.933 0.536 12.112 890 HB3 GLU 340 HB3 GLU 340 11.300 1.234 10.535 891 HG2 GLU 340 HG2 GLU 340 13.155 1.993 11.671 892 HG3 GLU 340 HG3 GLU 340 12.055 3.306 12.076 893 H VAL 341 H VAL 341 8.419 1.061 13.401 894 HA VAL 341 HA VAL 341 7.104 -0.838 11.745 895 HB VAL 341 HB VAL 341 7.536 -0.872 14.305 896 HG11 VAL 341 HG11 VAL 341 5.659 -0.107 15.674 897 HG12 VAL 341 HG12 VAL 341 6.333 1.250 14.772 898 HG13 VAL 341 HG13 VAL 341 4.828 0.499 14.244 899 HG21 VAL 341 HG21 VAL 341 4.786 -1.813 13.991 900 HG22 VAL 341 HG22 VAL 341 5.802 -2.261 12.620 901 HG23 VAL 341 HG23 VAL 341 6.263 -2.739 14.252 902 H PTR 342 H PTR 342 4.436 -0.759 12.544 903 HA PTR 342 HA PTR 342 3.409 1.723 11.293 904 HB2 PTR 342 HB2 PTR 342 1.767 -0.639 10.765 905 HB3 PTR 342 HB3 PTR 342 2.396 0.568 9.639 906 HD1 PTR 342 HD1 PTR 342 3.371 -2.433 11.625 907 HD2 PTR 342 HD2 PTR 342 4.270 0.098 8.272 908 HE1 PTR 342 HE1 PTR 342 5.165 -3.990 10.928 909 HE2 PTR 342 HE2 PTR 342 6.049 -1.473 7.574 910 H GLU 343 H GLU 343 2.795 2.621 13.245 911 HA GLU 343 HA GLU 343 1.425 1.335 15.335 912 HB2 GLU 343 HB2 GLU 343 0.721 3.673 15.950 913 HB3 GLU 343 HB3 GLU 343 2.455 3.484 15.685 914 HG2 GLU 343 HG2 GLU 343 0.796 4.212 13.311 915 HG3 GLU 343 HG3 GLU 343 1.035 5.461 14.526 916 H SER 344 H SER 344 0.150 0.248 13.215 917 HA SER 344 HA SER 344 -1.859 0.316 11.912 918 HB2 SER 344 HB2 SER 344 -2.199 -0.348 14.782 919 HB3 SER 344 HB3 SER 344 -3.678 -0.132 13.848 920 HG SER 344 HG SER 344 -1.979 -2.191 13.864 921 HA PRO 345 HA PRO 345 -3.023 4.736 12.748 922 HB2 PRO 345 HB2 PRO 345 -3.213 4.839 9.809 923 HB3 PRO 345 HB3 PRO 345 -2.281 5.865 10.913 924 HG2 PRO 345 HG2 PRO 345 -1.155 4.037 9.265 925 HG3 PRO 345 HG3 PRO 345 -0.444 4.534 10.808 926 HD2 PRO 345 HD2 PRO 345 -1.879 2.008 10.123 927 HD3 PRO 345 HD3 PRO 345 -0.568 2.285 11.292 928 H PTR 346 H PTR 346 -4.352 2.765 10.084 929 HA PTR 346 HA PTR 346 -7.072 3.515 10.971 930 HB2 PTR 346 HB2 PTR 346 -6.390 2.817 8.131 931 HB3 PTR 346 HB3 PTR 346 -7.752 3.752 8.752 932 HD1 PTR 346 HD1 PTR 346 -5.137 4.287 6.763 933 HD2 PTR 346 HD2 PTR 346 -6.507 5.604 10.613 934 HE1 PTR 346 HE1 PTR 346 -3.814 6.384 6.530 935 HE2 PTR 346 HE2 PTR 346 -5.194 7.684 10.378 936 H ALA 347 H ALA 347 -8.699 2.020 10.787 937 HA ALA 347 HA ALA 347 -8.764 -0.484 9.692 938 HB1 ALA 347 HB1 ALA 347 -8.265 -1.725 12.039 939 HB2 ALA 347 HB2 ALA 347 -7.105 -0.400 12.159 940 HB3 ALA 347 HB3 ALA 347 -7.037 -1.510 10.790 941 H ASP 348 H ASP 348 -9.208 0.778 12.999 942 HA ASP 348 HA ASP 348 -12.113 0.650 12.661 943 HB2 ASP 348 HB2 ASP 348 -10.565 -0.906 14.735 944 HB3 ASP 348 HB3 ASP 348 -12.263 -0.486 14.950 945 HA PRO 349 HA PRO 349 -10.659 4.252 15.188 946 HB2 PRO 349 HB2 PRO 349 -11.083 6.245 13.422 947 HB3 PRO 349 HB3 PRO 349 -9.628 5.232 13.351 948 HG2 PRO 349 HG2 PRO 349 -12.045 5.194 11.639 949 HG3 PRO 349 HG3 PRO 349 -10.362 4.828 11.231 950 HD2 PRO 349 HD2 PRO 349 -12.399 2.937 11.794 951 HD3 PRO 349 HD3 PRO 349 -10.658 2.605 11.654 952 H GLU 350 H GLU 350 -11.989 6.570 15.241 953 HA GLU 350 HA GLU 350 -14.631 5.815 16.159 954 HB2 GLU 350 HB2 GLU 350 -14.777 8.297 16.687 955 HB3 GLU 350 HB3 GLU 350 -13.485 7.417 17.500 956 HG2 GLU 350 HG2 GLU 350 -12.896 8.686 14.847 957 HG3 GLU 350 HG3 GLU 350 -12.992 9.721 16.269 Start of MODEL 15 1 H1 GLY 661 H1 GLY 661 3.442 -15.943 -8.951 2 H2 GLY 661 H2 GLY 661 4.737 -15.118 -9.694 3 H3 GLY 661 H3 GLY 661 5.040 -16.427 -8.641 4 HA2 GLY 661 HA2 GLY 661 5.251 -16.944 -11.079 5 HA3 GLY 661 HA3 GLY 661 4.172 -18.003 -10.164 6 H HIS 662 H HIS 662 3.929 -14.758 -11.686 7 HA HIS 662 HA HIS 662 2.360 -13.849 -13.097 8 HB2 HIS 662 HB2 HIS 662 3.032 -15.895 -14.444 9 HB3 HIS 662 HB3 HIS 662 1.595 -16.681 -13.797 10 HD1 HIS 662 HD1 HIS 662 -0.566 -14.764 -13.972 11 HD2 HIS 662 HD2 HIS 662 2.366 -14.888 -16.936 12 HE1 HIS 662 HE1 HIS 662 -1.601 -13.724 -16.056 13 HE2 HIS 662 HE2 HIS 662 0.180 -13.795 -17.871 14 H MET 663 H MET 663 1.654 -14.232 -10.376 15 HA MET 663 HA MET 663 -1.287 -14.336 -10.666 16 HB2 MET 663 HB2 MET 663 0.406 -16.049 -8.903 17 HB3 MET 663 HB3 MET 663 -1.097 -15.437 -8.220 18 HG2 MET 663 HG2 MET 663 -2.267 -16.287 -10.303 19 HG3 MET 663 HG3 MET 663 -0.758 -17.098 -10.725 20 HE1 MET 663 HE1 MET 663 -3.608 -19.563 -9.346 21 HE2 MET 663 HE2 MET 663 -4.147 -17.892 -9.174 22 HE3 MET 663 HE3 MET 663 -3.296 -18.400 -10.636 23 H GLN 664 H GLN 664 0.227 -14.192 -7.548 24 HA GLN 664 HA GLN 664 -0.615 -11.386 -7.315 25 HB2 GLN 664 HB2 GLN 664 -1.258 -13.096 -5.563 26 HB3 GLN 664 HB3 GLN 664 0.447 -13.193 -5.123 27 HG2 GLN 664 HG2 GLN 664 -0.980 -11.569 -3.743 28 HG3 GLN 664 HG3 GLN 664 0.506 -10.916 -4.416 29 HE21 GLN 664 HE21 GLN 664 -2.847 -11.381 -5.671 30 HE22 GLN 664 HE22 GLN 664 -2.989 -9.800 -6.268 31 H ASP 665 H ASP 665 1.859 -12.465 -8.741 32 HA ASP 665 HA ASP 665 4.211 -11.853 -7.415 33 HB2 ASP 665 HB2 ASP 665 3.622 -11.168 -10.303 34 HB3 ASP 665 HB3 ASP 665 5.190 -11.538 -9.594 35 H LEU 666 H LEU 666 4.712 -10.073 -6.316 36 HA LEU 666 HA LEU 666 3.456 -7.530 -6.965 37 HB2 LEU 666 HB2 LEU 666 5.462 -8.107 -4.787 38 HB3 LEU 666 HB3 LEU 666 4.317 -6.770 -4.872 39 HG LEU 666 HG LEU 666 3.492 -9.682 -4.721 40 HD11 LEU 666 HD11 LEU 666 2.899 -9.116 -2.353 41 HD12 LEU 666 HD12 LEU 666 4.633 -9.108 -2.663 42 HD13 LEU 666 HD13 LEU 666 3.751 -7.585 -2.550 43 HD21 LEU 666 HD21 LEU 666 1.772 -8.315 -5.698 44 HD22 LEU 666 HD22 LEU 666 1.319 -8.586 -4.018 45 HD23 LEU 666 HD23 LEU 666 2.020 -7.041 -4.501 46 H SER 667 H SER 667 6.575 -9.096 -7.047 47 HA SER 667 HA SER 667 8.201 -6.854 -7.515 48 HB2 SER 667 HB2 SER 667 8.509 -9.762 -8.240 49 HB3 SER 667 HB3 SER 667 9.744 -8.563 -8.618 50 HG SER 667 HG SER 667 10.351 -9.074 -6.631 51 H VAL 668 H VAL 668 5.689 -7.877 -9.385 52 HA VAL 668 HA VAL 668 6.986 -7.165 -11.929 53 HB VAL 668 HB VAL 668 5.078 -8.110 -13.030 54 HG11 VAL 668 HG11 VAL 668 5.042 -10.408 -12.038 55 HG12 VAL 668 HG12 VAL 668 6.670 -9.760 -12.226 56 HG13 VAL 668 HG13 VAL 668 5.905 -9.775 -10.639 57 HG21 VAL 668 HG21 VAL 668 3.367 -9.167 -11.173 58 HG22 VAL 668 HG22 VAL 668 3.820 -7.654 -10.389 59 HG23 VAL 668 HG23 VAL 668 3.097 -7.632 -11.996 60 H HIS 669 H HIS 669 5.475 -5.719 -9.426 61 HA HIS 669 HA HIS 669 4.028 -3.705 -11.017 62 HB2 HIS 669 HB2 HIS 669 4.272 -3.976 -8.012 63 HB3 HIS 669 HB3 HIS 669 3.184 -2.901 -8.885 64 HD1 HIS 669 HD1 HIS 669 2.067 -4.791 -11.005 65 HD2 HIS 669 HD2 HIS 669 2.537 -5.863 -7.013 66 HE1 HIS 669 HE1 HIS 669 0.425 -6.673 -10.572 67 HE2 HIS 669 HE2 HIS 669 0.603 -7.266 -8.095 68 H LEU 670 H LEU 670 4.291 -1.457 -9.746 69 HA LEU 670 HA LEU 670 7.183 -0.910 -9.606 70 HB2 LEU 670 HB2 LEU 670 6.483 1.454 -10.354 71 HB3 LEU 670 HB3 LEU 670 6.568 0.201 -11.566 72 HG LEU 670 HG LEU 670 4.038 1.090 -10.165 73 HD11 LEU 670 HD11 LEU 670 5.042 1.605 -12.981 74 HD12 LEU 670 HD12 LEU 670 3.484 2.117 -12.336 75 HD13 LEU 670 HD13 LEU 670 4.973 2.796 -11.685 76 HD21 LEU 670 HD21 LEU 670 4.681 -1.216 -11.820 77 HD22 LEU 670 HD22 LEU 670 3.171 -0.834 -10.985 78 HD23 LEU 670 HD23 LEU 670 3.471 -0.205 -12.602 79 H TRP 671 H TRP 671 4.300 -1.001 -7.929 80 HA TRP 671 HA TRP 671 5.180 1.152 -6.155 81 HB2 TRP 671 HB2 TRP 671 2.905 0.732 -5.032 82 HB3 TRP 671 HB3 TRP 671 2.913 1.522 -6.600 83 HD1 TRP 671 HD1 TRP 671 1.458 0.482 -8.405 84 HE1 TRP 671 HE1 TRP 671 0.118 -1.714 -8.670 85 HE3 TRP 671 HE3 TRP 671 3.114 -2.023 -4.270 86 HZ2 TRP 671 HZ2 TRP 671 -0.149 -4.225 -7.305 87 HZ3 TRP 671 HZ3 TRP 671 2.304 -4.314 -3.782 88 HH2 TRP 671 HH2 TRP 671 0.673 -5.414 -5.292 89 H TYR 672 H TYR 672 5.604 -2.052 -6.554 90 HA TYR 672 HA TYR 672 5.413 -2.838 -3.751 91 HB2 TYR 672 HB2 TYR 672 4.766 -4.449 -5.484 92 HB3 TYR 672 HB3 TYR 672 6.383 -4.359 -6.184 93 HD1 TYR 672 HD2 TYR 672 4.948 -4.731 -2.725 94 HD2 TYR 672 HD1 TYR 672 7.730 -6.177 -5.666 95 HE1 TYR 672 HE2 TYR 672 5.731 -6.473 -1.141 96 HE2 TYR 672 HE1 TYR 672 8.501 -7.916 -4.079 97 HH TYR 672 HH TYR 672 7.691 -9.090 -2.124 98 H ALA 673 H ALA 673 6.980 -2.313 -2.392 99 HA ALA 673 HA ALA 673 9.722 -1.956 -3.423 100 HB1 ALA 673 HB1 ALA 673 8.966 -0.052 -2.193 101 HB2 ALA 673 HB2 ALA 673 10.077 -0.916 -1.132 102 HB3 ALA 673 HB3 ALA 673 8.336 -1.060 -0.890 103 H GLY 674 H GLY 674 7.737 -3.986 -1.454 104 HA2 GLY 674 HA2 GLY 674 8.167 -5.848 -0.171 105 HA3 GLY 674 HA3 GLY 674 9.443 -6.156 -1.335 106 HA PRO 675 HA PRO 675 12.127 -5.903 2.208 107 HB2 PRO 675 HB2 PRO 675 14.505 -5.700 0.793 108 HB3 PRO 675 HB3 PRO 675 13.661 -7.221 1.132 109 HG2 PRO 675 HG2 PRO 675 13.675 -5.575 -1.344 110 HG3 PRO 675 HG3 PRO 675 13.673 -7.338 -1.155 111 HD2 PRO 675 HD2 PRO 675 11.430 -5.950 -1.819 112 HD3 PRO 675 HD3 PRO 675 11.372 -7.439 -0.846 113 H MET 676 H MET 676 10.958 -3.659 2.279 114 HA MET 676 HA MET 676 13.055 -1.573 2.102 115 HB2 MET 676 HB2 MET 676 11.396 -1.347 0.256 116 HB3 MET 676 HB3 MET 676 10.123 -1.177 1.460 117 HG2 MET 676 HG2 MET 676 10.687 0.976 1.928 118 HG3 MET 676 HG3 MET 676 12.415 0.629 1.901 119 HE1 MET 676 HE1 MET 676 13.927 1.579 0.171 120 HE2 MET 676 HE2 MET 676 13.613 -0.086 -0.315 121 HE3 MET 676 HE3 MET 676 13.644 1.200 -1.526 122 H GLU 677 H GLU 677 12.780 0.201 3.591 123 HA GLU 677 HA GLU 677 11.419 -0.623 6.076 124 HB2 GLU 677 HB2 GLU 677 12.992 1.018 7.151 125 HB3 GLU 677 HB3 GLU 677 13.792 -0.353 6.376 126 HG2 GLU 677 HG2 GLU 677 14.704 0.938 4.718 127 HG3 GLU 677 HG3 GLU 677 13.312 2.013 4.651 128 H ARG 678 H ARG 678 10.722 1.265 7.463 129 HA ARG 678 HA ARG 678 8.702 2.723 6.175 130 HB2 ARG 678 HB2 ARG 678 8.748 2.119 8.591 131 HB3 ARG 678 HB3 ARG 678 10.016 3.317 8.834 132 HG2 ARG 678 HG2 ARG 678 8.150 4.835 7.550 133 HG3 ARG 678 HG3 ARG 678 7.105 3.705 8.416 134 HD2 ARG 678 HD2 ARG 678 8.975 4.312 10.323 135 HD3 ARG 678 HD3 ARG 678 8.847 5.840 9.471 136 HE ARG 678 HE ARG 678 6.750 4.537 11.052 137 HH11 ARG 678 HH21 ARG 678 7.590 6.916 8.690 138 HH12 ARG 678 HH22 ARG 678 6.301 7.984 9.133 139 HH21 ARG 678 HH11 ARG 678 5.099 5.926 11.667 140 HH22 ARG 678 HH12 ARG 678 4.893 7.426 10.797 141 H ALA 679 H ALA 679 11.724 3.986 7.611 142 HA ALA 679 HA ALA 679 11.475 6.604 6.640 143 HB1 ALA 679 HB1 ALA 679 14.185 5.362 6.865 144 HB2 ALA 679 HB2 ALA 679 13.196 5.479 8.320 145 HB3 ALA 679 HB3 ALA 679 13.623 6.937 7.426 146 H GLY 680 H GLY 680 12.790 3.687 5.215 147 HA2 GLY 680 HA2 GLY 680 13.892 4.945 2.888 148 HA3 GLY 680 HA3 GLY 680 13.568 3.224 3.079 149 H ALA 681 H ALA 681 10.878 3.251 3.640 150 HA ALA 681 HA ALA 681 9.691 3.314 1.111 151 HB1 ALA 681 HB1 ALA 681 7.547 3.097 2.343 152 HB2 ALA 681 HB2 ALA 681 8.396 3.460 3.846 153 HB3 ALA 681 HB3 ALA 681 8.779 1.991 2.950 154 H GLU 682 H GLU 682 9.341 5.680 3.804 155 HA GLU 682 HA GLU 682 7.798 7.426 2.112 156 HB2 GLU 682 HB2 GLU 682 7.989 9.043 4.025 157 HB3 GLU 682 HB3 GLU 682 7.259 7.496 4.423 158 HG2 GLU 682 HG2 GLU 682 9.856 6.938 4.971 159 HG3 GLU 682 HG3 GLU 682 9.832 8.654 5.313 160 H SER 683 H SER 683 11.097 6.857 2.423 161 HA SER 683 HA SER 683 12.186 9.420 2.097 162 HB2 SER 683 HB2 SER 683 14.169 8.338 1.348 163 HB3 SER 683 HB3 SER 683 13.436 7.227 2.498 164 HG SER 683 HG SER 683 12.711 5.965 0.839 165 H ILE 684 H ILE 684 11.132 7.046 -0.304 166 HA ILE 684 HA ILE 684 11.645 8.792 -2.539 167 HB ILE 684 HB ILE 684 9.783 6.430 -2.668 168 HG12 ILE 684 HG12 ILE 684 12.491 5.603 -3.150 169 HG13 ILE 684 HG13 ILE 684 12.416 6.329 -1.547 170 HG21 ILE 684 HG21 ILE 684 11.176 8.129 -4.518 171 HG22 ILE 684 HG22 ILE 684 11.798 6.488 -4.684 172 HG23 ILE 684 HG23 ILE 684 10.074 6.800 -4.870 173 HD11 ILE 684 HD11 ILE 684 10.345 4.322 -2.433 174 HD12 ILE 684 HD12 ILE 684 11.886 3.799 -1.753 175 HD13 ILE 684 HD13 ILE 684 10.790 4.791 -0.793 176 H LEU 685 H LEU 685 8.737 7.566 -0.932 177 HA LEU 685 HA LEU 685 6.833 9.011 -2.390 178 HB2 LEU 685 HB2 LEU 685 6.927 7.617 0.231 179 HB3 LEU 685 HB3 LEU 685 5.591 8.734 -0.032 180 HG LEU 685 HG LEU 685 4.822 7.539 -1.936 181 HD11 LEU 685 HD11 LEU 685 6.791 7.127 -3.191 182 HD12 LEU 685 HD12 LEU 685 7.548 6.243 -1.867 183 HD13 LEU 685 HD13 LEU 685 6.208 5.522 -2.756 184 HD21 LEU 685 HD21 LEU 685 4.136 6.312 -0.045 185 HD22 LEU 685 HD22 LEU 685 4.860 5.090 -1.087 186 HD23 LEU 685 HD23 LEU 685 5.768 5.730 0.281 187 H ALA 686 H ALA 686 8.436 9.877 0.712 188 HA ALA 686 HA ALA 686 7.078 12.340 1.021 189 HB1 ALA 686 HB1 ALA 686 8.396 11.230 2.807 190 HB2 ALA 686 HB2 ALA 686 8.816 12.928 2.593 191 HB3 ALA 686 HB3 ALA 686 9.875 11.670 1.952 192 H ASN 687 H ASN 687 9.980 11.425 -0.752 193 HA ASN 687 HA ASN 687 10.682 14.114 -1.502 194 HB2 ASN 687 HB2 ASN 687 12.319 12.223 -1.430 195 HB3 ASN 687 HB3 ASN 687 11.491 11.500 -2.805 196 HD21 ASN 687 HD21 ASN 687 13.319 14.415 -1.817 197 HD22 ASN 687 HD22 ASN 687 13.804 14.827 -3.390 198 H ARG 688 H ARG 688 8.913 11.422 -2.996 199 HA ARG 688 HA ARG 688 8.469 12.653 -5.517 200 HB2 ARG 688 HB2 ARG 688 7.628 10.253 -4.142 201 HB3 ARG 688 HB3 ARG 688 6.295 10.973 -5.039 202 HG2 ARG 688 HG2 ARG 688 7.253 9.758 -6.747 203 HG3 ARG 688 HG3 ARG 688 8.193 11.243 -6.907 204 HD2 ARG 688 HD2 ARG 688 9.525 9.803 -4.928 205 HD3 ARG 688 HD3 ARG 688 9.056 8.595 -6.099 206 HE ARG 688 HE ARG 688 10.446 9.631 -7.698 207 HH11 ARG 688 HH21 ARG 688 10.210 11.431 -4.773 208 HH12 ARG 688 HH22 ARG 688 11.638 12.380 -5.075 209 HH21 ARG 688 HH11 ARG 688 12.278 10.880 -8.109 210 HH22 ARG 688 HH12 ARG 688 12.775 12.074 -6.964 211 H SER 689 H SER 689 6.052 12.940 -6.250 212 HA SER 689 HA SER 689 4.989 15.164 -4.720 213 HB2 SER 689 HB2 SER 689 5.011 15.321 -7.151 214 HB3 SER 689 HB3 SER 689 4.039 13.856 -7.283 215 HG SER 689 HG SER 689 2.303 14.922 -6.554 216 H ASP 690 H ASP 690 2.609 15.293 -4.335 217 HA ASP 690 HA ASP 690 1.764 13.260 -2.586 218 HB2 ASP 690 HB2 ASP 690 0.712 15.774 -3.605 219 HB3 ASP 690 HB3 ASP 690 -0.550 14.569 -3.365 220 H GLY 691 H GLY 691 0.481 11.522 -2.806 221 HA2 GLY 691 HA2 GLY 691 -1.219 10.239 -3.940 222 HA3 GLY 691 HA3 GLY 691 -0.716 10.977 -5.458 223 H THR 692 H THR 692 2.122 10.543 -4.176 224 HA THR 692 HA THR 692 2.700 8.150 -5.652 225 HB THR 692 HB THR 692 4.534 9.485 -3.653 226 HG1 THR 692 HG1 THR 692 3.987 11.163 -4.937 227 HG21 THR 692 HG21 THR 692 5.127 7.280 -4.724 228 HG22 THR 692 HG22 THR 692 5.085 8.102 -6.282 229 HG23 THR 692 HG23 THR 692 6.261 8.585 -5.063 230 H PHE 693 H PHE 693 2.804 6.075 -4.918 231 HA PHE 693 HA PHE 693 2.878 5.654 -2.002 232 HB2 PHE 693 HB2 PHE 693 0.981 4.188 -2.019 233 HB3 PHE 693 HB3 PHE 693 0.496 5.697 -2.785 234 HD1 PHE 693 HD1 PHE 693 0.104 5.833 -5.192 235 HD2 PHE 693 HD2 PHE 693 1.276 2.144 -3.335 236 HE1 PHE 693 HE1 PHE 693 -0.558 4.595 -7.237 237 HE2 PHE 693 HE2 PHE 693 0.617 0.908 -5.380 238 HZ PHE 693 HZ PHE 693 -0.298 2.131 -7.331 239 H LEU 694 H LEU 694 3.084 3.318 -1.444 240 HA LEU 694 HA LEU 694 4.129 1.507 -3.406 241 HB2 LEU 694 HB2 LEU 694 6.420 1.482 -2.839 242 HB3 LEU 694 HB3 LEU 694 6.027 3.194 -2.985 243 HG LEU 694 HG LEU 694 5.506 2.991 -0.408 244 HD11 LEU 694 HD11 LEU 694 6.700 0.414 -1.058 245 HD12 LEU 694 HD12 LEU 694 7.649 1.273 0.152 246 HD13 LEU 694 HD13 LEU 694 5.942 0.943 0.442 247 HD21 LEU 694 HD21 LEU 694 8.139 3.236 -1.826 248 HD22 LEU 694 HD22 LEU 694 7.211 4.468 -0.972 249 HD23 LEU 694 HD23 LEU 694 8.107 3.257 -0.065 250 H VAL 695 H VAL 695 4.943 -0.511 -2.389 251 HA VAL 695 HA VAL 695 3.850 -0.921 0.335 252 HB VAL 695 HB VAL 695 3.568 -2.850 -1.979 253 HG11 VAL 695 HG11 VAL 695 3.136 -4.356 -0.373 254 HG12 VAL 695 HG12 VAL 695 3.432 -3.148 0.870 255 HG13 VAL 695 HG13 VAL 695 1.812 -3.350 0.211 256 HG21 VAL 695 HG21 VAL 695 1.249 -1.527 -0.618 257 HG22 VAL 695 HG22 VAL 695 2.142 -0.601 -1.821 258 HG23 VAL 695 HG23 VAL 695 1.386 -2.127 -2.269 259 H ARG 696 H ARG 696 5.132 -2.078 1.699 260 HA ARG 696 HA ARG 696 7.599 -3.244 0.535 261 HB2 ARG 696 HB2 ARG 696 8.733 -2.723 2.622 262 HB3 ARG 696 HB3 ARG 696 7.999 -1.263 1.961 263 HG2 ARG 696 HG2 ARG 696 6.157 -1.396 3.514 264 HG3 ARG 696 HG3 ARG 696 6.667 -2.993 4.063 265 HD2 ARG 696 HD2 ARG 696 8.837 -1.075 4.301 266 HD3 ARG 696 HD3 ARG 696 7.406 -0.517 5.168 267 HE ARG 696 HE ARG 696 7.956 -3.276 5.718 268 HH11 ARG 696 HH21 ARG 696 8.964 -0.058 6.421 269 HH12 ARG 696 HH22 ARG 696 9.497 -0.438 8.021 270 HH21 ARG 696 HH11 ARG 696 8.641 -3.786 7.806 271 HH22 ARG 696 HH12 ARG 696 9.303 -2.533 8.818 272 H GLN 697 H GLN 697 8.608 -4.941 1.881 273 HA GLN 697 HA GLN 697 6.637 -6.717 3.188 274 HB2 GLN 697 HB2 GLN 697 6.981 -7.636 0.984 275 HB3 GLN 697 HB3 GLN 697 8.725 -7.442 1.118 276 HG2 GLN 697 HG2 GLN 697 7.657 -9.803 1.567 277 HG3 GLN 697 HG3 GLN 697 8.953 -9.222 2.607 278 HE21 GLN 697 HE21 GLN 697 5.360 -9.301 2.436 279 HE22 GLN 697 HE22 GLN 697 5.147 -9.342 4.123 280 H ARG 698 H ARG 698 7.380 -6.122 5.207 281 HA ARG 698 HA ARG 698 9.552 -7.586 6.260 282 HB2 ARG 698 HB2 ARG 698 10.300 -5.074 5.128 283 HB3 ARG 698 HB3 ARG 698 10.422 -4.929 6.880 284 HG2 ARG 698 HG2 ARG 698 11.485 -7.445 5.693 285 HG3 ARG 698 HG3 ARG 698 12.395 -5.976 5.351 286 HD2 ARG 698 HD2 ARG 698 13.134 -7.199 7.432 287 HD3 ARG 698 HD3 ARG 698 12.696 -5.517 7.692 288 HE ARG 698 HE ARG 698 11.040 -7.857 8.448 289 HH11 ARG 698 HH21 ARG 698 11.769 -4.476 8.624 290 HH12 ARG 698 HH22 ARG 698 10.685 -4.187 9.940 291 HH21 ARG 698 HH11 ARG 698 9.645 -7.462 10.179 292 HH22 ARG 698 HH12 ARG 698 9.524 -5.849 10.812 293 H VAL 699 H VAL 699 7.915 -8.179 7.638 294 HA VAL 699 HA VAL 699 7.179 -6.178 9.675 295 HB VAL 699 HB VAL 699 5.329 -6.883 8.056 296 HG11 VAL 699 HG11 VAL 699 4.764 -9.054 7.852 297 HG12 VAL 699 HG12 VAL 699 6.247 -9.440 8.719 298 HG13 VAL 699 HG13 VAL 699 4.727 -9.282 9.598 299 HG21 VAL 699 HG21 VAL 699 4.083 -7.670 10.497 300 HG22 VAL 699 HG22 VAL 699 5.333 -6.494 10.904 301 HG23 VAL 699 HG23 VAL 699 4.075 -6.078 9.742 302 H LYS 700 H LYS 700 5.692 -8.442 11.020 303 HA LYS 700 HA LYS 700 7.977 -10.006 12.037 304 HB2 LYS 700 HB2 LYS 700 5.910 -9.180 14.009 305 HB3 LYS 700 HB3 LYS 700 7.645 -9.406 14.220 306 HG2 LYS 700 HG2 LYS 700 8.110 -7.287 13.116 307 HG3 LYS 700 HG3 LYS 700 6.402 -7.073 12.729 308 HD2 LYS 700 HD2 LYS 700 6.040 -7.287 15.309 309 HD3 LYS 700 HD3 LYS 700 7.760 -6.911 15.412 310 HE2 LYS 700 HE2 LYS 700 5.728 -5.221 13.921 311 HE3 LYS 700 HE3 LYS 700 6.304 -4.876 15.555 312 HZ1 LYS 700 HZ1 LYS 700 7.493 -3.709 13.671 313 HZ2 LYS 700 HZ2 LYS 700 8.484 -4.541 14.776 314 HZ3 LYS 700 HZ3 LYS 700 8.148 -5.222 13.257 315 H ASP 701 H ASP 701 4.454 -9.680 12.545 316 HA ASP 701 HA ASP 701 3.995 -12.401 11.625 317 HB2 ASP 701 HB2 ASP 701 2.765 -12.789 13.930 318 HB3 ASP 701 HB3 ASP 701 4.490 -13.111 13.773 319 H ALA 702 H ALA 702 2.332 -10.107 13.800 320 HA ALA 702 HA ALA 702 -0.242 -10.514 12.709 321 HB1 ALA 702 HB1 ALA 702 -0.470 -8.047 13.792 322 HB2 ALA 702 HB2 ALA 702 1.032 -8.572 14.552 323 HB3 ALA 702 HB3 ALA 702 -0.437 -9.524 14.753 324 H ALA 703 H ALA 703 1.238 -10.269 10.462 325 HA ALA 703 HA ALA 703 -0.127 -8.670 8.742 326 HB1 ALA 703 HB1 ALA 703 1.718 -6.766 8.500 327 HB2 ALA 703 HB2 ALA 703 1.924 -7.083 10.224 328 HB3 ALA 703 HB3 ALA 703 0.352 -6.589 9.599 329 H GLU 704 H GLU 704 0.911 -8.413 6.626 330 HA GLU 704 HA GLU 704 3.260 -10.209 6.337 331 HB2 GLU 704 HB2 GLU 704 0.700 -10.393 5.163 332 HB3 GLU 704 HB3 GLU 704 1.787 -9.874 3.879 333 HG2 GLU 704 HG2 GLU 704 3.278 -11.743 4.300 334 HG3 GLU 704 HG3 GLU 704 2.351 -12.213 5.724 335 H PHE 705 H PHE 705 1.607 -7.645 4.482 336 HA PHE 705 HA PHE 705 4.267 -6.505 3.827 337 HB2 PHE 705 HB2 PHE 705 1.673 -6.346 2.267 338 HB3 PHE 705 HB3 PHE 705 3.171 -5.535 1.825 339 HD1 PHE 705 HD1 PHE 705 1.523 -8.824 2.207 340 HD2 PHE 705 HD2 PHE 705 5.021 -6.735 0.860 341 HE1 PHE 705 HE1 PHE 705 2.292 -10.869 1.041 342 HE2 PHE 705 HE2 PHE 705 5.791 -8.784 -0.311 343 HZ PHE 705 HZ PHE 705 4.425 -10.850 -0.219 344 H ALA 706 H ALA 706 4.091 -4.093 3.320 345 HA ALA 706 HA ALA 706 2.088 -2.759 5.025 346 HB1 ALA 706 HB1 ALA 706 3.895 -2.718 6.518 347 HB2 ALA 706 HB2 ALA 706 4.020 -1.161 5.694 348 HB3 ALA 706 HB3 ALA 706 5.077 -2.495 5.231 349 H ILE 707 H ILE 707 1.145 -1.114 4.039 350 HA ILE 707 HA ILE 707 2.114 -0.329 1.397 351 HB ILE 707 HB ILE 707 -0.345 0.694 2.832 352 HG12 ILE 707 HG12 ILE 707 -1.366 -1.196 1.256 353 HG13 ILE 707 HG13 ILE 707 0.220 -1.924 1.489 354 HG21 ILE 707 HG21 ILE 707 -1.043 0.619 0.275 355 HG22 ILE 707 HG22 ILE 707 -0.114 1.979 0.905 356 HG23 ILE 707 HG23 ILE 707 0.699 0.687 0.016 357 HD11 ILE 707 HD11 ILE 707 -0.341 -2.596 3.558 358 HD12 ILE 707 HD12 ILE 707 -0.769 -0.949 4.015 359 HD13 ILE 707 HD13 ILE 707 -1.969 -1.995 3.271 360 H SER 708 H SER 708 1.852 2.086 0.874 361 HA SER 708 HA SER 708 2.335 3.984 2.944 362 HB2 SER 708 HB2 SER 708 4.679 2.936 1.377 363 HB3 SER 708 HB3 SER 708 4.694 4.517 2.154 364 HG SER 708 HG SER 708 3.811 2.311 3.659 365 H ILE 709 H ILE 709 1.357 5.727 2.172 366 HA ILE 709 HA ILE 709 1.605 6.347 -0.719 367 HB ILE 709 HB ILE 709 -0.767 7.209 0.897 368 HG12 ILE 709 HG12 ILE 709 -1.779 5.014 -0.241 369 HG13 ILE 709 HG13 ILE 709 -0.123 4.443 -0.019 370 HG21 ILE 709 HG21 ILE 709 -1.560 7.851 -1.108 371 HG22 ILE 709 HG22 ILE 709 0.047 7.526 -1.762 372 HG23 ILE 709 HG23 ILE 709 -1.201 6.279 -1.824 373 HD11 ILE 709 HD11 ILE 709 -2.112 4.469 1.922 374 HD12 ILE 709 HD12 ILE 709 -0.389 4.259 2.216 375 HD13 ILE 709 HD13 ILE 709 -1.113 5.864 2.333 376 H LYS 710 H LYS 710 2.057 8.396 -1.289 377 HA LYS 710 HA LYS 710 2.774 10.272 0.845 378 HB2 LYS 710 HB2 LYS 710 4.445 10.070 -0.869 379 HB3 LYS 710 HB3 LYS 710 3.240 10.230 -2.143 380 HG2 LYS 710 HG2 LYS 710 4.309 12.351 -2.012 381 HG3 LYS 710 HG3 LYS 710 2.752 12.555 -1.222 382 HD2 LYS 710 HD2 LYS 710 3.675 12.689 0.898 383 HD3 LYS 710 HD3 LYS 710 5.134 11.787 0.448 384 HE2 LYS 710 HE2 LYS 710 4.462 14.544 -0.626 385 HE3 LYS 710 HE3 LYS 710 5.515 14.265 0.764 386 HZ1 LYS 710 HZ1 LYS 710 6.455 12.532 -1.140 387 HZ2 LYS 710 HZ2 LYS 710 6.091 13.936 -2.047 388 HZ3 LYS 710 HZ3 LYS 710 7.163 14.038 -0.715 389 H TYR 711 H TYR 711 0.888 11.128 1.594 390 HA TYR 711 HA TYR 711 -0.677 12.735 -0.324 391 HB2 TYR 711 HB2 TYR 711 -1.953 10.681 -0.033 392 HB3 TYR 711 HB3 TYR 711 -1.832 10.819 1.719 393 HD1 TYR 711 HD1 TYR 711 -2.716 13.160 -1.088 394 HD2 TYR 711 HD2 TYR 711 -3.809 11.498 2.714 395 HE1 TYR 711 HE1 TYR 711 -4.756 14.572 -1.057 396 HE2 TYR 711 HE2 TYR 711 -5.853 12.908 2.746 397 HH TYR 711 HH TYR 711 -7.143 14.311 0.147 398 H ASN 712 H ASN 712 -0.495 14.742 0.329 399 HA ASN 712 HA ASN 712 -0.806 16.584 1.714 400 HB2 ASN 712 HB2 ASN 712 -2.325 15.147 3.142 401 HB3 ASN 712 HB3 ASN 712 -0.899 14.684 4.065 402 HD21 ASN 712 HD21 ASN 712 -0.567 15.925 5.878 403 HD22 ASN 712 HD22 ASN 712 -1.055 17.553 6.043 404 H VAL 713 H VAL 713 1.579 15.923 0.734 405 HA VAL 713 HA VAL 713 3.865 15.950 1.038 406 HB VAL 713 HB VAL 713 4.680 17.815 2.329 407 HG11 VAL 713 HG11 VAL 713 2.727 17.979 0.349 408 HG12 VAL 713 HG12 VAL 713 2.151 19.086 1.593 409 HG13 VAL 713 HG13 VAL 713 3.757 19.302 0.896 410 HG21 VAL 713 HG21 VAL 713 1.919 18.164 3.518 411 HG22 VAL 713 HG22 VAL 713 3.180 17.262 4.354 412 HG23 VAL 713 HG23 VAL 713 3.416 18.968 3.984 413 H GLU 714 H GLU 714 2.557 13.845 2.407 414 HA GLU 714 HA GLU 714 4.631 13.165 4.321 415 HB2 GLU 714 HB2 GLU 714 3.086 12.607 6.128 416 HB3 GLU 714 HB3 GLU 714 2.909 14.314 5.711 417 HG2 GLU 714 HG2 GLU 714 1.005 13.635 4.183 418 HG3 GLU 714 HG3 GLU 714 1.099 12.027 4.891 419 H VAL 715 H VAL 715 4.541 10.864 4.898 420 HA VAL 715 HA VAL 715 3.157 9.281 2.815 421 HB VAL 715 HB VAL 715 5.632 8.442 4.306 422 HG11 VAL 715 HG11 VAL 715 4.266 6.719 3.111 423 HG12 VAL 715 HG12 VAL 715 4.485 7.630 1.617 424 HG13 VAL 715 HG13 VAL 715 5.876 6.908 2.423 425 HG21 VAL 715 HG21 VAL 715 6.441 10.356 3.234 426 HG22 VAL 715 HG22 VAL 715 6.682 9.134 1.987 427 HG23 VAL 715 HG23 VAL 715 5.294 10.215 1.903 428 H LYS 716 H LYS 716 1.497 8.126 3.554 429 HA LYS 716 HA LYS 716 1.380 7.396 6.402 430 HB2 LYS 716 HB2 LYS 716 -0.817 6.704 4.501 431 HB3 LYS 716 HB3 LYS 716 -0.910 7.245 6.173 432 HG2 LYS 716 HG2 LYS 716 0.264 9.408 4.872 433 HG3 LYS 716 HG3 LYS 716 -0.928 8.828 3.708 434 HD2 LYS 716 HD2 LYS 716 -2.707 9.013 5.317 435 HD3 LYS 716 HD3 LYS 716 -1.566 9.326 6.628 436 HE2 LYS 716 HE2 LYS 716 -0.905 11.291 4.809 437 HE3 LYS 716 HE3 LYS 716 -2.653 11.176 4.609 438 HZ1 LYS 716 HZ1 LYS 716 -2.784 12.424 6.429 439 HZ2 LYS 716 HZ2 LYS 716 -2.285 11.067 7.306 440 HZ3 LYS 716 HZ3 LYS 716 -1.120 12.223 6.814 441 H HIS 717 H HIS 717 2.124 5.486 7.046 442 HA HIS 717 HA HIS 717 2.202 3.232 5.146 443 HB2 HIS 717 HB2 HIS 717 3.653 3.323 7.775 444 HB3 HIS 717 HB3 HIS 717 4.019 2.363 6.345 445 HD1 HIS 717 HD1 HIS 717 5.055 3.642 4.274 446 HD2 HIS 717 HD2 HIS 717 4.761 5.891 7.792 447 HE1 HIS 717 HE1 HIS 717 6.616 5.637 4.009 448 HE2 HIS 717 HE2 HIS 717 6.469 7.015 6.158 449 H ILE 718 H ILE 718 1.276 1.343 5.583 450 HA ILE 718 HA ILE 718 0.064 0.828 8.208 451 HB ILE 718 HB ILE 718 -1.483 0.655 5.611 452 HG12 ILE 718 HG12 ILE 718 -2.566 2.316 7.767 453 HG13 ILE 718 HG13 ILE 718 -1.025 2.915 7.161 454 HG21 ILE 718 HG21 ILE 718 -1.814 -0.659 8.145 455 HG22 ILE 718 HG22 ILE 718 -3.143 0.475 7.911 456 HG23 ILE 718 HG23 ILE 718 -2.826 -0.771 6.704 457 HD11 ILE 718 HD11 ILE 718 -2.489 3.907 5.670 458 HD12 ILE 718 HD12 ILE 718 -2.097 2.413 4.810 459 HD13 ILE 718 HD13 ILE 718 -3.612 2.546 5.712 460 H LYS 719 H LYS 719 0.077 -1.309 8.751 461 HA LYS 719 HA LYS 719 1.542 -3.130 7.032 462 HB2 LYS 719 HB2 LYS 719 1.203 -4.723 8.968 463 HB3 LYS 719 HB3 LYS 719 2.077 -3.245 9.362 464 HG2 LYS 719 HG2 LYS 719 0.573 -2.948 11.024 465 HG3 LYS 719 HG3 LYS 719 -0.593 -2.551 9.764 466 HD2 LYS 719 HD2 LYS 719 -1.045 -5.063 9.577 467 HD3 LYS 719 HD3 LYS 719 -0.120 -5.238 11.069 468 HE2 LYS 719 HE2 LYS 719 -2.464 -5.070 11.651 469 HE3 LYS 719 HE3 LYS 719 -1.663 -3.578 12.149 470 HZ1 LYS 719 HZ1 LYS 719 -2.580 -3.445 9.446 471 HZ2 LYS 719 HZ2 LYS 719 -3.877 -3.795 10.529 472 HZ3 LYS 719 HZ3 LYS 719 -2.901 -2.376 10.760 473 H ILE 720 H ILE 720 0.679 -4.513 5.652 474 HA ILE 720 HA ILE 720 -2.202 -4.731 5.398 475 HB ILE 720 HB ILE 720 0.074 -5.062 3.701 476 HG12 ILE 720 HG12 ILE 720 -2.789 -5.516 2.884 477 HG13 ILE 720 HG13 ILE 720 -2.252 -3.924 3.409 478 HG21 ILE 720 HG21 ILE 720 -0.148 -7.501 4.248 479 HG22 ILE 720 HG22 ILE 720 -1.801 -7.445 3.639 480 HG23 ILE 720 HG23 ILE 720 -0.450 -7.141 2.550 481 HD11 ILE 720 HD11 ILE 720 -1.554 -5.441 0.948 482 HD12 ILE 720 HD12 ILE 720 -1.753 -3.705 1.178 483 HD13 ILE 720 HD13 ILE 720 -0.259 -4.496 1.685 484 H MET 721 H MET 721 -3.463 -6.480 5.822 485 HA MET 721 HA MET 721 -2.378 -8.491 7.621 486 HB2 MET 721 HB2 MET 721 -4.766 -7.237 7.588 487 HB3 MET 721 HB3 MET 721 -5.188 -8.655 6.634 488 HG2 MET 721 HG2 MET 721 -4.939 -8.451 9.475 489 HG3 MET 721 HG3 MET 721 -5.373 -9.864 8.519 490 HE1 MET 721 HE1 MET 721 -3.244 -11.780 10.507 491 HE2 MET 721 HE2 MET 721 -3.228 -10.282 11.437 492 HE3 MET 721 HE3 MET 721 -4.686 -10.773 10.565 493 H THR 722 H THR 722 -3.479 -10.782 7.178 494 HA THR 722 HA THR 722 -3.228 -11.505 4.339 495 HB THR 722 HB THR 722 -0.988 -11.767 5.457 496 HG1 THR 722 HG1 THR 722 -0.620 -13.621 4.417 497 HG21 THR 722 HG21 THR 722 -2.231 -14.098 6.905 498 HG22 THR 722 HG22 THR 722 -0.646 -13.370 7.154 499 HG23 THR 722 HG23 THR 722 -2.100 -12.510 7.661 500 H ALA 723 H ALA 723 -5.422 -11.227 6.123 501 HA ALA 723 HA ALA 723 -6.414 -13.449 7.379 502 HB1 ALA 723 HB1 ALA 723 -7.752 -11.542 7.529 503 HB2 ALA 723 HB2 ALA 723 -8.698 -12.587 6.471 504 HB3 ALA 723 HB3 ALA 723 -7.739 -11.275 5.786 505 H GLU 724 H GLU 724 -6.367 -15.476 6.681 506 HA GLU 724 HA GLU 724 -6.533 -17.314 5.299 507 HB2 GLU 724 HB2 GLU 724 -8.730 -15.981 3.777 508 HB3 GLU 724 HB3 GLU 724 -8.659 -17.609 4.450 509 HG2 GLU 724 HG2 GLU 724 -8.673 -16.389 6.766 510 HG3 GLU 724 HG3 GLU 724 -9.284 -15.013 5.851 511 H GLY 725 H GLY 725 -4.917 -14.904 4.412 512 HA2 GLY 725 HA2 GLY 725 -3.374 -14.885 2.606 513 HA3 GLY 725 HA3 GLY 725 -4.520 -15.807 1.638 514 H LEU 726 H LEU 726 -6.336 -13.475 3.114 515 HA LEU 726 HA LEU 726 -6.310 -11.833 0.683 516 HB2 LEU 726 HB2 LEU 726 -8.139 -11.506 3.060 517 HB3 LEU 726 HB3 LEU 726 -8.389 -10.943 1.408 518 HG LEU 726 HG LEU 726 -8.137 -13.871 2.132 519 HD11 LEU 726 HD11 LEU 726 -10.210 -13.738 2.994 520 HD12 LEU 726 HD12 LEU 726 -10.342 -12.037 2.549 521 HD13 LEU 726 HD13 LEU 726 -10.783 -13.288 1.388 522 HD21 LEU 726 HD21 LEU 726 -7.717 -12.961 -0.258 523 HD22 LEU 726 HD22 LEU 726 -8.877 -14.277 -0.083 524 HD23 LEU 726 HD23 LEU 726 -9.447 -12.622 -0.288 525 H TYR 727 H TYR 727 -5.558 -9.804 0.568 526 HA TYR 727 HA TYR 727 -4.196 -8.757 2.942 527 HB2 TYR 727 HB2 TYR 727 -4.049 -7.982 0.025 528 HB3 TYR 727 HB3 TYR 727 -3.145 -7.190 1.313 529 HD1 TYR 727 HD2 TYR 727 -3.375 -10.481 2.422 530 HD2 TYR 727 HD1 TYR 727 -1.441 -8.152 -0.612 531 HE1 TYR 727 HE2 TYR 727 -1.607 -12.206 2.214 532 HE2 TYR 727 HE1 TYR 727 0.325 -9.866 -0.819 533 HH TYR 727 HH TYR 727 0.810 -12.284 1.467 534 H ARG 728 H ARG 728 -4.583 -6.788 3.802 535 HA ARG 728 HA ARG 728 -6.676 -5.062 2.728 536 HB2 ARG 728 HB2 ARG 728 -7.609 -5.202 5.246 537 HB3 ARG 728 HB3 ARG 728 -8.223 -6.230 3.958 538 HG2 ARG 728 HG2 ARG 728 -6.647 -8.012 4.596 539 HG3 ARG 728 HG3 ARG 728 -5.979 -6.979 5.856 540 HD2 ARG 728 HD2 ARG 728 -8.848 -7.130 6.138 541 HD3 ARG 728 HD3 ARG 728 -8.167 -8.755 6.065 542 HE ARG 728 HE ARG 728 -6.779 -6.927 7.867 543 HH11 ARG 728 HH21 ARG 728 -9.262 -9.295 7.488 544 HH12 ARG 728 HH22 ARG 728 -9.292 -9.713 9.162 545 HH21 ARG 728 HH11 ARG 728 -6.832 -7.428 10.043 546 HH22 ARG 728 HH12 ARG 728 -7.925 -8.674 10.599 547 H ILE 729 H ILE 729 -6.290 -2.969 3.239 548 HA ILE 729 HA ILE 729 -3.951 -2.359 4.878 549 HB ILE 729 HB ILE 729 -5.715 -0.333 3.533 550 HG12 ILE 729 HG12 ILE 729 -3.577 -2.075 2.277 551 HG13 ILE 729 HG13 ILE 729 -5.275 -1.995 1.820 552 HG21 ILE 729 HG21 ILE 729 -2.894 -0.500 4.531 553 HG22 ILE 729 HG22 ILE 729 -3.281 0.618 3.225 554 HG23 ILE 729 HG23 ILE 729 -4.096 0.767 4.781 555 HD11 ILE 729 HD11 ILE 729 -4.673 0.598 1.537 556 HD12 ILE 729 HD12 ILE 729 -3.064 -0.071 1.266 557 HD13 ILE 729 HD13 ILE 729 -4.407 -0.561 0.235 558 H THR 730 H THR 730 -7.409 -2.086 4.984 559 HA THR 730 HA THR 730 -7.252 -0.602 7.541 560 HB THR 730 HB THR 730 -8.589 0.405 5.710 561 HG1 THR 730 HG1 THR 730 -9.819 1.133 7.219 562 HG21 THR 730 HG21 THR 730 -9.350 -2.141 5.135 563 HG22 THR 730 HG22 THR 730 -10.752 -1.571 6.039 564 HG23 THR 730 HG23 THR 730 -10.227 -0.711 4.595 565 H GLU 731 H GLU 731 -7.683 -3.606 6.200 566 HA GLU 731 HA GLU 731 -8.113 -5.637 7.112 567 HB2 GLU 731 HB2 GLU 731 -8.623 -4.219 9.719 568 HB3 GLU 731 HB3 GLU 731 -8.147 -5.902 9.479 569 HG2 GLU 731 HG2 GLU 731 -6.156 -4.694 8.109 570 HG3 GLU 731 HG3 GLU 731 -6.506 -3.415 9.267 571 H LYS 732 H LYS 732 -10.349 -3.115 7.094 572 HA LYS 732 HA LYS 732 -12.641 -4.686 7.925 573 HB2 LYS 732 HB2 LYS 732 -12.667 -2.053 6.440 574 HB3 LYS 732 HB3 LYS 732 -13.922 -2.719 7.488 575 HG2 LYS 732 HG2 LYS 732 -11.148 -1.859 8.379 576 HG3 LYS 732 HG3 LYS 732 -12.638 -0.962 8.657 577 HD2 LYS 732 HD2 LYS 732 -12.693 -3.791 9.550 578 HD3 LYS 732 HD3 LYS 732 -11.593 -2.743 10.440 579 HE2 LYS 732 HE2 LYS 732 -14.349 -1.737 9.873 580 HE3 LYS 732 HE3 LYS 732 -14.145 -2.956 11.136 581 HZ1 LYS 732 HZ1 LYS 732 -13.140 -1.518 12.499 582 HZ2 LYS 732 HZ2 LYS 732 -12.162 -0.860 11.237 583 HZ3 LYS 732 HZ3 LYS 732 -13.760 -0.296 11.464 584 H LYS 733 H LYS 733 -11.070 -3.741 4.941 585 HA LYS 733 HA LYS 733 -12.825 -5.604 3.469 586 HB2 LYS 733 HB2 LYS 733 -13.676 -3.532 2.736 587 HB3 LYS 733 HB3 LYS 733 -12.084 -2.776 2.730 588 HG2 LYS 733 HG2 LYS 733 -12.882 -3.268 0.430 589 HG3 LYS 733 HG3 LYS 733 -11.405 -4.150 0.810 590 HD2 LYS 733 HD2 LYS 733 -12.566 -6.205 1.077 591 HD3 LYS 733 HD3 LYS 733 -14.126 -5.401 1.236 592 HE2 LYS 733 HE2 LYS 733 -14.446 -5.683 -0.974 593 HE3 LYS 733 HE3 LYS 733 -13.089 -4.598 -1.272 594 HZ1 LYS 733 HZ1 LYS 733 -13.223 -7.474 -1.484 595 HZ2 LYS 733 HZ2 LYS 733 -12.147 -6.383 -2.216 596 HZ3 LYS 733 HZ3 LYS 733 -11.846 -6.932 -0.629 597 H ALA 734 H ALA 734 -11.592 -7.210 2.750 598 HA ALA 734 HA ALA 734 -8.759 -6.674 2.124 599 HB1 ALA 734 HB1 ALA 734 -9.958 -9.415 2.433 600 HB2 ALA 734 HB2 ALA 734 -9.518 -8.460 3.848 601 HB3 ALA 734 HB3 ALA 734 -8.286 -8.904 2.666 602 H PHE 735 H PHE 735 -7.901 -8.291 0.429 603 HA PHE 735 HA PHE 735 -9.798 -8.646 -1.796 604 HB2 PHE 735 HB2 PHE 735 -7.471 -6.818 -1.704 605 HB3 PHE 735 HB3 PHE 735 -7.618 -7.791 -3.164 606 HD1 PHE 735 HD1 PHE 735 -9.190 -5.192 -1.085 607 HD2 PHE 735 HD2 PHE 735 -9.554 -7.560 -4.650 608 HE1 PHE 735 HE1 PHE 735 -11.002 -3.704 -1.888 609 HE2 PHE 735 HE2 PHE 735 -11.369 -6.072 -5.451 610 HZ PHE 735 HZ PHE 735 -12.093 -4.145 -4.070 611 H ARG 736 H ARG 736 -8.552 -9.801 -3.673 612 HA ARG 736 HA ARG 736 -7.881 -12.377 -2.882 613 HB2 ARG 736 HB2 ARG 736 -7.381 -10.782 -5.363 614 HB3 ARG 736 HB3 ARG 736 -6.648 -12.373 -5.206 615 HG2 ARG 736 HG2 ARG 736 -8.727 -12.766 -6.284 616 HG3 ARG 736 HG3 ARG 736 -8.997 -13.220 -4.602 617 HD2 ARG 736 HD2 ARG 736 -10.285 -11.330 -4.156 618 HD3 ARG 736 HD3 ARG 736 -9.565 -10.399 -5.464 619 HE ARG 736 HE ARG 736 -11.750 -12.320 -5.690 620 HH11 ARG 736 HH21 ARG 736 -9.364 -10.344 -7.300 621 HH12 ARG 736 HH22 ARG 736 -10.201 -10.432 -8.826 622 HH21 ARG 736 HH11 ARG 736 -12.781 -12.386 -7.670 623 HH22 ARG 736 HH12 ARG 736 -12.107 -11.558 -9.027 624 H GLY 737 H GLY 737 -5.729 -9.648 -3.575 625 HA2 GLY 737 HA2 GLY 737 -3.675 -10.772 -1.881 626 HA3 GLY 737 HA3 GLY 737 -3.256 -10.728 -3.590 627 H LEU 738 H LEU 738 -1.561 -9.278 -2.858 628 HA LEU 738 HA LEU 738 -2.126 -6.718 -1.757 629 HB2 LEU 738 HB2 LEU 738 0.168 -8.229 -2.315 630 HB3 LEU 738 HB3 LEU 738 0.306 -6.799 -3.336 631 HG LEU 738 HG LEU 738 -0.243 -6.770 -0.353 632 HD11 LEU 738 HD11 LEU 738 2.228 -5.911 -1.872 633 HD12 LEU 738 HD12 LEU 738 2.011 -5.957 -0.124 634 HD13 LEU 738 HD13 LEU 738 2.072 -7.457 -1.042 635 HD21 LEU 738 HD21 LEU 738 0.392 -4.276 -0.856 636 HD22 LEU 738 HD22 LEU 738 -0.098 -4.678 -2.499 637 HD23 LEU 738 HD23 LEU 738 -1.248 -4.832 -1.172 638 H THR 739 H THR 739 -1.199 -7.739 -5.041 639 HA THR 739 HA THR 739 -1.413 -5.297 -6.315 640 HB THR 739 HB THR 739 -2.376 -7.903 -7.499 641 HG1 THR 739 HG1 THR 739 -0.384 -8.298 -6.603 642 HG21 THR 739 HG21 THR 739 -2.759 -5.888 -8.855 643 HG22 THR 739 HG22 THR 739 -1.054 -5.461 -8.705 644 HG23 THR 739 HG23 THR 739 -1.526 -6.914 -9.585 645 H GLU 740 H GLU 740 -3.985 -7.711 -5.840 646 HA GLU 740 HA GLU 740 -6.048 -6.103 -6.949 647 HB2 GLU 740 HB2 GLU 740 -6.341 -8.319 -4.913 648 HB3 GLU 740 HB3 GLU 740 -7.573 -7.730 -6.029 649 HG2 GLU 740 HG2 GLU 740 -5.489 -8.340 -7.736 650 HG3 GLU 740 HG3 GLU 740 -5.341 -9.596 -6.513 651 H LEU 741 H LEU 741 -4.651 -6.338 -3.773 652 HA LEU 741 HA LEU 741 -6.741 -4.853 -2.462 653 HB2 LEU 741 HB2 LEU 741 -5.379 -6.539 -1.290 654 HB3 LEU 741 HB3 LEU 741 -3.936 -5.579 -1.574 655 HG LEU 741 HG LEU 741 -5.109 -5.405 0.723 656 HD11 LEU 741 HD11 LEU 741 -3.847 -3.572 0.934 657 HD12 LEU 741 HD12 LEU 741 -3.577 -3.648 -0.804 658 HD13 LEU 741 HD13 LEU 741 -4.880 -2.652 -0.159 659 HD21 LEU 741 HD21 LEU 741 -6.865 -3.500 -0.838 660 HD22 LEU 741 HD22 LEU 741 -7.388 -5.092 -0.295 661 HD23 LEU 741 HD23 LEU 741 -6.948 -3.859 0.883 662 H VAL 742 H VAL 742 -3.531 -4.129 -3.809 663 HA VAL 742 HA VAL 742 -3.769 -1.316 -2.987 664 HB VAL 742 HB VAL 742 -1.589 -2.986 -4.169 665 HG11 VAL 742 HG11 VAL 742 -0.279 -0.818 -4.421 666 HG12 VAL 742 HG12 VAL 742 -1.491 -1.120 -5.663 667 HG13 VAL 742 HG13 VAL 742 -1.828 0.021 -4.361 668 HG21 VAL 742 HG21 VAL 742 -2.220 -2.058 -1.640 669 HG22 VAL 742 HG22 VAL 742 -0.630 -2.617 -2.150 670 HG23 VAL 742 HG23 VAL 742 -1.013 -0.899 -2.191 671 H GLU 743 H GLU 743 -4.085 -3.255 -5.928 672 HA GLU 743 HA GLU 743 -4.189 -0.925 -7.636 673 HB2 GLU 743 HB2 GLU 743 -4.921 -3.817 -8.136 674 HB3 GLU 743 HB3 GLU 743 -5.018 -2.556 -9.362 675 HG2 GLU 743 HG2 GLU 743 -2.493 -3.260 -7.831 676 HG3 GLU 743 HG3 GLU 743 -2.866 -3.834 -9.451 677 H PHE 744 H PHE 744 -6.167 -1.814 -5.294 678 HA PHE 744 HA PHE 744 -8.639 -1.101 -6.748 679 HB2 PHE 744 HB2 PHE 744 -8.660 -3.280 -5.537 680 HB3 PHE 744 HB3 PHE 744 -8.357 -2.416 -4.032 681 HD1 PHE 744 HD2 PHE 744 -10.759 -2.799 -6.846 682 HD2 PHE 744 HD1 PHE 744 -10.115 -1.266 -2.885 683 HE1 PHE 744 HE2 PHE 744 -13.186 -2.334 -6.630 684 HE2 PHE 744 HE1 PHE 744 -12.540 -0.802 -2.669 685 HZ PHE 744 HZ PHE 744 -14.075 -1.334 -4.542 686 H TYR 745 H TYR 745 -6.756 -0.508 -3.806 687 HA TYR 745 HA TYR 745 -8.377 1.598 -2.813 688 HB2 TYR 745 HB2 TYR 745 -5.538 0.742 -2.296 689 HB3 TYR 745 HB3 TYR 745 -6.183 2.220 -1.586 690 HD1 TYR 745 HD1 TYR 745 -7.602 -1.202 -2.221 691 HD2 TYR 745 HD2 TYR 745 -6.811 1.904 0.647 692 HE1 TYR 745 HE1 TYR 745 -8.742 -2.525 -0.464 693 HE2 TYR 745 HE2 TYR 745 -7.943 0.564 2.396 694 HH TYR 745 HH TYR 745 -9.097 -2.718 1.748 695 H GLN 746 H GLN 746 -6.345 1.428 -5.508 696 HA GLN 746 HA GLN 746 -5.439 4.149 -5.581 697 HB2 GLN 746 HB2 GLN 746 -5.100 3.634 -8.055 698 HB3 GLN 746 HB3 GLN 746 -4.228 2.589 -6.932 699 HG2 GLN 746 HG2 GLN 746 -5.384 0.754 -7.559 700 HG3 GLN 746 HG3 GLN 746 -6.923 1.605 -7.557 701 HE21 GLN 746 HE21 GLN 746 -4.437 0.331 -9.603 702 HE22 GLN 746 HE22 GLN 746 -5.020 0.990 -11.055 703 H GLN 747 H GLN 747 -8.387 2.555 -6.114 704 HA GLN 747 HA GLN 747 -9.553 4.916 -7.474 705 HB2 GLN 747 HB2 GLN 747 -10.946 2.260 -7.269 706 HB3 GLN 747 HB3 GLN 747 -11.138 3.526 -8.481 707 HG2 GLN 747 HG2 GLN 747 -8.416 2.661 -8.559 708 HG3 GLN 747 HG3 GLN 747 -9.430 1.223 -8.574 709 HE21 GLN 747 HE21 GLN 747 -7.814 2.581 -10.782 710 HE22 GLN 747 HE22 GLN 747 -8.947 2.804 -12.037 711 H ASN 748 H ASN 748 -9.980 2.537 -4.880 712 HA ASN 748 HA ASN 748 -12.336 3.761 -3.797 713 HB2 ASN 748 HB2 ASN 748 -11.429 1.337 -3.486 714 HB3 ASN 748 HB3 ASN 748 -10.453 2.042 -2.201 715 HD21 ASN 748 HD21 ASN 748 -12.151 3.836 -0.966 716 HD22 ASN 748 HD22 ASN 748 -13.538 3.041 -0.396 717 H SER 749 H SER 749 -12.349 5.715 -2.870 718 HA SER 749 HA SER 749 -10.208 7.270 -2.103 719 HB2 SER 749 HB2 SER 749 -12.235 7.979 -0.328 720 HB3 SER 749 HB3 SER 749 -11.972 8.649 -1.935 721 HG SER 749 HG SER 749 -13.687 6.536 -1.096 722 H LEU 750 H LEU 750 -8.676 6.960 -0.631 723 HA LEU 750 HA LEU 750 -8.628 4.891 1.216 724 HB2 LEU 750 HB2 LEU 750 -7.181 7.543 1.255 725 HB3 LEU 750 HB3 LEU 750 -6.817 6.214 2.357 726 HG LEU 750 HG LEU 750 -6.612 6.197 -0.660 727 HD11 LEU 750 HD11 LEU 750 -4.545 6.954 -0.106 728 HD12 LEU 750 HD12 LEU 750 -4.732 6.488 1.585 729 HD13 LEU 750 HD13 LEU 750 -4.246 5.289 0.388 730 HD21 LEU 750 HD21 LEU 750 -5.603 3.828 -0.038 731 HD22 LEU 750 HD22 LEU 750 -6.674 3.981 1.353 732 HD23 LEU 750 HD23 LEU 750 -7.337 4.024 -0.281 733 H LYS 751 H LYS 751 -10.007 8.087 1.552 734 HA LYS 751 HA LYS 751 -10.232 8.272 4.327 735 HB2 LYS 751 HB2 LYS 751 -11.832 9.954 3.966 736 HB3 LYS 751 HB3 LYS 751 -10.817 10.008 2.528 737 HG2 LYS 751 HG2 LYS 751 -12.613 8.253 1.628 738 HG3 LYS 751 HG3 LYS 751 -13.637 9.060 2.818 739 HD2 LYS 751 HD2 LYS 751 -12.077 10.445 0.609 740 HD3 LYS 751 HD3 LYS 751 -13.817 10.160 0.610 741 HE2 LYS 751 HE2 LYS 751 -14.092 11.572 2.581 742 HE3 LYS 751 HE3 LYS 751 -12.344 11.777 2.717 743 HZ1 LYS 751 HZ1 LYS 751 -14.068 12.709 0.482 744 HZ2 LYS 751 HZ2 LYS 751 -13.251 13.683 1.617 745 HZ3 LYS 751 HZ3 LYS 751 -12.352 12.788 0.472 746 H ASP 752 H ASP 752 -11.784 6.111 2.161 747 HA ASP 752 HA ASP 752 -14.049 5.560 3.914 748 HB2 ASP 752 HB2 ASP 752 -13.152 3.998 1.484 749 HB3 ASP 752 HB3 ASP 752 -14.749 4.008 2.223 750 H CYS 753 H CYS 753 -10.907 4.219 3.153 751 HA CYS 753 HA CYS 753 -11.406 1.904 4.914 752 HB2 CYS 753 HB2 CYS 753 -9.214 2.460 2.906 753 HB3 CYS 753 HB3 CYS 753 -9.299 1.022 3.921 754 HG CYS 753 HG CYS 753 -11.223 1.671 1.567 755 H PHE 754 H PHE 754 -9.110 4.569 4.357 756 HA PHE 754 HA PHE 754 -7.472 3.884 6.626 757 HB2 PHE 754 HB2 PHE 754 -7.632 6.250 4.769 758 HB3 PHE 754 HB3 PHE 754 -6.542 6.237 6.152 759 HD1 PHE 754 HD2 PHE 754 -7.442 3.215 4.149 760 HD2 PHE 754 HD1 PHE 754 -4.471 6.211 4.951 761 HE1 PHE 754 HE2 PHE 754 -5.788 1.928 2.836 762 HE2 PHE 754 HE1 PHE 754 -2.824 4.927 3.638 763 HZ PHE 754 HZ PHE 754 -3.477 2.784 2.574 764 H LYS 755 H LYS 755 -8.124 7.233 6.612 765 HA LYS 755 HA LYS 755 -10.295 7.226 8.500 766 HB2 LYS 755 HB2 LYS 755 -8.267 6.451 9.828 767 HB3 LYS 755 HB3 LYS 755 -7.625 8.072 9.619 768 HG2 LYS 755 HG2 LYS 755 -10.428 8.029 10.516 769 HG3 LYS 755 HG3 LYS 755 -9.318 7.270 11.655 770 HD2 LYS 755 HD2 LYS 755 -9.039 10.062 10.503 771 HD3 LYS 755 HD3 LYS 755 -9.553 9.672 12.140 772 HE2 LYS 755 HE2 LYS 755 -7.384 9.733 12.755 773 HE3 LYS 755 HE3 LYS 755 -7.129 8.282 11.783 774 HZ1 LYS 755 HZ1 LYS 755 -7.154 10.979 10.535 775 HZ2 LYS 755 HZ2 LYS 755 -5.724 10.340 11.241 776 HZ3 LYS 755 HZ3 LYS 755 -6.464 9.529 9.958 777 H SER 756 H SER 756 -7.682 9.565 8.749 778 HA SER 756 HA SER 756 -9.501 11.666 7.985 779 HB2 SER 756 HB2 SER 756 -6.533 11.864 8.559 780 HB3 SER 756 HB3 SER 756 -7.698 13.185 8.552 781 HG SER 756 HG SER 756 -8.610 12.405 10.385 782 H LEU 757 H LEU 757 -7.943 9.500 6.219 783 HA LEU 757 HA LEU 757 -6.499 10.927 4.273 784 HB2 LEU 757 HB2 LEU 757 -7.787 8.248 4.458 785 HB3 LEU 757 HB3 LEU 757 -7.362 8.831 2.853 786 HG LEU 757 HG LEU 757 -5.577 7.476 4.092 787 HD11 LEU 757 HD11 LEU 757 -3.902 9.571 3.555 788 HD12 LEU 757 HD12 LEU 757 -4.528 8.442 2.357 789 HD13 LEU 757 HD13 LEU 757 -5.333 9.987 2.614 790 HD21 LEU 757 HD21 LEU 757 -4.457 8.369 5.910 791 HD22 LEU 757 HD22 LEU 757 -4.888 10.027 5.493 792 HD23 LEU 757 HD23 LEU 757 -6.085 8.958 6.221 793 H ASP 758 H ASP 758 -7.163 11.035 1.963 794 HA ASP 758 HA ASP 758 -9.902 11.258 1.231 795 HB2 ASP 758 HB2 ASP 758 -9.221 13.435 2.634 796 HB3 ASP 758 HB3 ASP 758 -8.599 13.933 1.066 797 H THR 759 H THR 759 -7.938 9.791 0.208 798 HA THR 759 HA THR 759 -7.750 10.755 -2.511 799 HB THR 759 HB THR 759 -5.762 11.809 -1.414 800 HG1 THR 759 HG1 THR 759 -4.710 11.425 -3.199 801 HG21 THR 759 HG21 THR 759 -5.240 10.167 0.287 802 HG22 THR 759 HG22 THR 759 -5.044 8.903 -0.924 803 HG23 THR 759 HG23 THR 759 -3.883 10.224 -0.836 804 H THR 760 H THR 760 -5.699 9.044 -3.325 805 HA THR 760 HA THR 760 -6.337 6.340 -2.444 806 HB THR 760 HB THR 760 -7.004 5.589 -4.708 807 HG1 THR 760 HG1 THR 760 -7.111 6.947 -6.312 808 HG21 THR 760 HG21 THR 760 -8.837 7.809 -3.833 809 HG22 THR 760 HG22 THR 760 -9.262 6.245 -4.527 810 HG23 THR 760 HG23 THR 760 -8.640 6.338 -2.882 811 H LEU 761 H LEU 761 -5.047 4.719 -3.697 812 HA LEU 761 HA LEU 761 -2.318 5.362 -3.773 813 HB2 LEU 761 HB2 LEU 761 -3.873 3.136 -5.136 814 HB3 LEU 761 HB3 LEU 761 -2.124 3.205 -5.088 815 HG LEU 761 HG LEU 761 -3.342 1.741 -3.331 816 HD11 LEU 761 HD11 LEU 761 -1.068 1.995 -2.994 817 HD12 LEU 761 HD12 LEU 761 -1.196 3.747 -2.803 818 HD13 LEU 761 HD13 LEU 761 -1.734 2.680 -1.512 819 HD21 LEU 761 HD21 LEU 761 -5.016 3.374 -2.597 820 HD22 LEU 761 HD22 LEU 761 -3.961 2.933 -1.263 821 HD23 LEU 761 HD23 LEU 761 -3.737 4.475 -2.082 822 H GLN 762 H GLN 762 -2.183 7.323 -4.955 823 HA GLN 762 HA GLN 762 -3.167 7.618 -7.606 824 HB2 GLN 762 HB2 GLN 762 -1.924 9.238 -5.607 825 HB3 GLN 762 HB3 GLN 762 -1.084 9.484 -7.133 826 HG2 GLN 762 HG2 GLN 762 -3.896 9.436 -7.671 827 HG3 GLN 762 HG3 GLN 762 -3.621 10.520 -6.309 828 HE21 GLN 762 HE21 GLN 762 -1.501 11.984 -6.745 829 HE22 GLN 762 HE22 GLN 762 -1.467 12.695 -8.284 830 H PHE 763 H PHE 763 0.243 7.576 -6.482 831 HA PHE 763 HA PHE 763 0.905 6.234 -9.038 832 HB2 PHE 763 HB2 PHE 763 2.206 8.710 -7.899 833 HB3 PHE 763 HB3 PHE 763 2.945 7.729 -9.165 834 HD1 PHE 763 HD1 PHE 763 1.669 7.354 -11.332 835 HD2 PHE 763 HD2 PHE 763 0.479 10.260 -8.403 836 HE1 PHE 763 HE1 PHE 763 0.274 8.497 -13.033 837 HE2 PHE 763 HE2 PHE 763 -0.915 11.401 -10.101 838 HZ PHE 763 HZ PHE 763 -1.021 10.522 -12.418 839 HA PRO 764 HA PRO 764 3.543 3.726 -6.542 840 HB2 PRO 764 HB2 PRO 764 5.123 2.669 -8.482 841 HB3 PRO 764 HB3 PRO 764 3.406 2.250 -8.329 842 HG2 PRO 764 HG2 PRO 764 4.736 4.099 -10.230 843 HG3 PRO 764 HG3 PRO 764 3.368 3.002 -10.481 844 HD2 PRO 764 HD2 PRO 764 3.136 5.736 -10.066 845 HD3 PRO 764 HD3 PRO 764 1.837 4.550 -9.801 846 H PHE 765 H PHE 765 6.213 3.175 -6.743 847 HA PHE 765 HA PHE 765 7.473 5.846 -6.713 848 HB2 PHE 765 HB2 PHE 765 8.630 5.350 -4.752 849 HB3 PHE 765 HB3 PHE 765 7.061 4.606 -4.467 850 HD1 PHE 765 HD1 PHE 765 6.777 2.122 -4.930 851 HD2 PHE 765 HD2 PHE 765 10.610 4.053 -4.817 852 HE1 PHE 765 HE1 PHE 765 7.876 -0.078 -4.623 853 HE2 PHE 765 HE2 PHE 765 11.711 1.860 -4.511 854 HZ PHE 765 HZ PHE 765 10.346 -0.210 -4.412 855 H LYS 766 H LYS 766 7.465 2.906 -8.258 856 HA LYS 766 HA LYS 766 10.344 3.039 -8.887 857 HB2 LYS 766 HB2 LYS 766 8.311 0.882 -9.480 858 HB3 LYS 766 HB3 LYS 766 10.029 0.808 -9.870 859 HG2 LYS 766 HG2 LYS 766 10.185 1.464 -7.247 860 HG3 LYS 766 HG3 LYS 766 8.680 0.553 -7.232 861 HD2 LYS 766 HD2 LYS 766 11.055 -0.566 -8.677 862 HD3 LYS 766 HD3 LYS 766 10.971 -0.691 -6.921 863 HE2 LYS 766 HE2 LYS 766 8.418 -1.442 -7.776 864 HE3 LYS 766 HE3 LYS 766 9.503 -2.193 -8.948 865 HZ1 LYS 766 HZ1 LYS 766 9.126 -2.772 -6.130 866 HZ2 LYS 766 HZ2 LYS 766 9.740 -3.759 -7.385 867 HZ3 LYS 766 HZ3 LYS 766 10.762 -2.651 -6.611 868 H GLU 767 H GLU 767 7.131 3.132 -10.330 869 HA GLU 767 HA GLU 767 6.507 3.401 -12.576 870 HB2 GLU 767 HB2 GLU 767 7.383 5.748 -11.175 871 HB3 GLU 767 HB3 GLU 767 7.687 5.955 -12.900 872 HG2 GLU 767 HG2 GLU 767 5.268 5.004 -13.180 873 HG3 GLU 767 HG3 GLU 767 5.079 5.445 -11.490 874 H1 ASP 338 H1 ASP 338 9.711 5.991 17.703 875 H2 ASP 338 H2 ASP 338 11.106 6.265 18.455 876 H3 ASP 338 H3 ASP 338 9.650 6.135 19.333 877 HA ASP 338 HA ASP 338 11.562 4.146 18.858 878 HB2 ASP 338 HB2 ASP 338 9.775 2.835 20.201 879 HB3 ASP 338 HB3 ASP 338 10.456 4.279 20.953 880 H THR 339 H THR 339 8.134 3.445 18.608 881 HA THR 339 HA THR 339 8.451 1.389 16.687 882 HB THR 339 HB THR 339 5.837 2.807 17.085 883 HG1 THR 339 HG1 THR 339 6.830 2.712 19.159 884 HG21 THR 339 HG21 THR 339 6.513 -0.136 17.187 885 HG22 THR 339 HG22 THR 339 4.942 0.610 16.901 886 HG23 THR 339 HG23 THR 339 6.199 0.704 15.670 887 H GLU 340 H GLU 340 9.775 3.493 15.565 888 HA GLU 340 HA GLU 340 8.227 5.063 13.767 889 HB2 GLU 340 HB2 GLU 340 11.125 4.381 14.061 890 HB3 GLU 340 HB3 GLU 340 10.582 5.103 12.547 891 HG2 GLU 340 HG2 GLU 340 11.183 6.945 13.938 892 HG3 GLU 340 HG3 GLU 340 9.424 6.887 13.976 893 H VAL 341 H VAL 341 6.799 3.245 13.088 894 HA VAL 341 HA VAL 341 7.741 2.213 10.518 895 HB VAL 341 HB VAL 341 8.272 0.512 12.342 896 HG11 VAL 341 HG11 VAL 341 6.650 -0.296 13.679 897 HG12 VAL 341 HG12 VAL 341 5.624 1.010 13.090 898 HG13 VAL 341 HG13 VAL 341 5.568 -0.574 12.317 899 HG21 VAL 341 HG21 VAL 341 8.323 -0.774 10.500 900 HG22 VAL 341 HG22 VAL 341 6.627 -1.155 10.773 901 HG23 VAL 341 HG23 VAL 341 7.068 0.195 9.731 902 H PTR 342 H PTR 342 5.324 0.313 10.665 903 HA PTR 342 HA PTR 342 3.356 2.316 9.792 904 HB2 PTR 342 HB2 PTR 342 2.138 -0.034 9.274 905 HB3 PTR 342 HB3 PTR 342 3.300 0.696 8.168 906 HD1 PTR 342 HD1 PTR 342 3.181 -1.542 11.177 907 HD2 PTR 342 HD2 PTR 342 5.163 -0.532 7.509 908 HE1 PTR 342 HE1 PTR 342 4.710 -3.457 11.483 909 HE2 PTR 342 HE2 PTR 342 6.678 -2.466 7.811 910 H GLU 343 H GLU 343 2.936 3.057 11.954 911 HA GLU 343 HA GLU 343 1.960 1.411 14.039 912 HB2 GLU 343 HB2 GLU 343 1.223 4.310 13.613 913 HB3 GLU 343 HB3 GLU 343 1.444 3.450 15.137 914 HG2 GLU 343 HG2 GLU 343 3.471 4.612 14.973 915 HG3 GLU 343 HG3 GLU 343 3.899 3.065 14.253 916 H SER 344 H SER 344 0.659 0.713 11.551 917 HA SER 344 HA SER 344 -1.473 0.798 10.470 918 HB2 SER 344 HB2 SER 344 -1.013 -1.189 12.191 919 HB3 SER 344 HB3 SER 344 -2.397 -0.474 13.009 920 HG SER 344 HG SER 344 -3.538 -0.636 11.002 921 HA PRO 345 HA PRO 345 -3.033 4.448 13.054 922 HB2 PRO 345 HB2 PRO 345 -3.195 5.582 10.299 923 HB3 PRO 345 HB3 PRO 345 -2.608 6.329 11.797 924 HG2 PRO 345 HG2 PRO 345 -0.921 5.531 9.914 925 HG3 PRO 345 HG3 PRO 345 -0.535 5.339 11.634 926 HD2 PRO 345 HD2 PRO 345 -1.436 3.265 9.662 927 HD3 PRO 345 HD3 PRO 345 -0.261 3.129 10.989 928 H PTR 346 H PTR 346 -4.235 2.705 10.260 929 HA PTR 346 HA PTR 346 -6.989 3.510 10.994 930 HB2 PTR 346 HB2 PTR 346 -6.173 2.685 8.219 931 HB3 PTR 346 HB3 PTR 346 -7.598 3.594 8.730 932 HD1 PTR 346 HD1 PTR 346 -4.824 4.116 6.909 933 HD2 PTR 346 HD2 PTR 346 -6.592 5.584 10.533 934 HE1 PTR 346 HE1 PTR 346 -3.542 6.238 6.689 935 HE2 PTR 346 HE2 PTR 346 -5.329 7.694 10.306 936 H ALA 347 H ALA 347 -8.586 2.030 11.002 937 HA ALA 347 HA ALA 347 -8.703 -0.521 9.985 938 HB1 ALA 347 HB1 ALA 347 -8.180 -1.846 12.135 939 HB2 ALA 347 HB2 ALA 347 -7.271 -0.420 12.637 940 HB3 ALA 347 HB3 ALA 347 -6.812 -1.288 11.172 941 H ASP 348 H ASP 348 -9.162 1.012 13.172 942 HA ASP 348 HA ASP 348 -12.066 0.766 12.869 943 HB2 ASP 348 HB2 ASP 348 -10.483 -0.453 15.140 944 HB3 ASP 348 HB3 ASP 348 -12.213 -0.135 15.235 945 HA PRO 349 HA PRO 349 -10.677 4.684 14.925 946 HB2 PRO 349 HB2 PRO 349 -11.405 6.446 13.017 947 HB3 PRO 349 HB3 PRO 349 -9.887 5.531 12.913 948 HG2 PRO 349 HG2 PRO 349 -12.456 5.106 11.478 949 HG3 PRO 349 HG3 PRO 349 -10.792 4.893 10.908 950 HD2 PRO 349 HD2 PRO 349 -12.480 2.833 11.793 951 HD3 PRO 349 HD3 PRO 349 -10.715 2.719 11.622 952 H GLU 350 H GLU 350 -12.107 6.833 15.114 953 HA GLU 350 HA GLU 350 -14.713 5.945 16.069 954 HB2 GLU 350 HB2 GLU 350 -14.865 8.321 16.893 955 HB3 GLU 350 HB3 GLU 350 -13.483 7.421 17.519 956 HG2 GLU 350 HG2 GLU 350 -13.135 8.995 14.991 957 HG3 GLU 350 HG3 GLU 350 -13.172 9.866 16.521 Start of MODEL 16 1 H1 GLY 661 H1 GLY 661 3.728 -16.010 -8.568 2 H2 GLY 661 H2 GLY 661 4.935 -15.148 -9.411 3 H3 GLY 661 H3 GLY 661 5.366 -16.376 -8.304 4 HA2 GLY 661 HA2 GLY 661 5.542 -17.064 -10.672 5 HA3 GLY 661 HA3 GLY 661 4.471 -18.076 -9.700 6 H HIS 662 H HIS 662 4.132 -14.892 -11.330 7 HA HIS 662 HA HIS 662 2.544 -14.087 -12.796 8 HB2 HIS 662 HB2 HIS 662 3.315 -16.168 -14.062 9 HB3 HIS 662 HB3 HIS 662 1.880 -16.965 -13.423 10 HD1 HIS 662 HD1 HIS 662 -0.330 -15.137 -13.709 11 HD2 HIS 662 HD2 HIS 662 2.689 -15.217 -16.586 12 HE1 HIS 662 HE1 HIS 662 -1.344 -14.193 -15.847 13 HE2 HIS 662 HE2 HIS 662 0.490 -14.236 -17.609 14 H MET 663 H MET 663 1.837 -14.561 -10.039 15 HA MET 663 HA MET 663 -1.096 -14.866 -10.375 16 HB2 MET 663 HB2 MET 663 0.721 -16.197 -8.385 17 HB3 MET 663 HB3 MET 663 -0.952 -15.843 -7.949 18 HG2 MET 663 HG2 MET 663 -1.805 -17.216 -9.701 19 HG3 MET 663 HG3 MET 663 -0.242 -17.291 -10.510 20 HE1 MET 663 HE1 MET 663 -2.144 -19.662 -9.869 21 HE2 MET 663 HE2 MET 663 -1.799 -20.623 -8.434 22 HE3 MET 663 HE3 MET 663 -2.668 -19.091 -8.288 23 H GLN 664 H GLN 664 0.521 -14.330 -7.307 24 HA GLN 664 HA GLN 664 -0.616 -11.607 -7.292 25 HB2 GLN 664 HB2 GLN 664 -1.276 -13.134 -5.436 26 HB3 GLN 664 HB3 GLN 664 0.416 -13.239 -4.956 27 HG2 GLN 664 HG2 GLN 664 -0.945 -11.534 -3.664 28 HG3 GLN 664 HG3 GLN 664 0.501 -10.896 -4.424 29 HE21 GLN 664 HE21 GLN 664 -2.902 -11.473 -5.514 30 HE22 GLN 664 HE22 GLN 664 -3.082 -9.930 -6.199 31 H ASP 665 H ASP 665 1.939 -12.667 -8.526 32 HA ASP 665 HA ASP 665 4.243 -11.882 -7.268 33 HB2 ASP 665 HB2 ASP 665 3.575 -11.323 -10.163 34 HB3 ASP 665 HB3 ASP 665 5.177 -11.576 -9.476 35 H LEU 666 H LEU 666 4.754 -10.059 -6.273 36 HA LEU 666 HA LEU 666 3.420 -7.556 -6.975 37 HB2 LEU 666 HB2 LEU 666 5.382 -8.050 -4.735 38 HB3 LEU 666 HB3 LEU 666 4.196 -6.751 -4.865 39 HG LEU 666 HG LEU 666 3.416 -9.673 -4.758 40 HD11 LEU 666 HD11 LEU 666 4.422 -9.398 -2.667 41 HD12 LEU 666 HD12 LEU 666 3.957 -7.701 -2.555 42 HD13 LEU 666 HD13 LEU 666 2.746 -8.966 -2.343 43 HD21 LEU 666 HD21 LEU 666 1.676 -8.292 -5.653 44 HD22 LEU 666 HD22 LEU 666 1.256 -8.595 -3.970 45 HD23 LEU 666 HD23 LEU 666 1.953 -7.044 -4.436 46 H SER 667 H SER 667 6.555 -9.085 -7.026 47 HA SER 667 HA SER 667 8.171 -6.818 -7.459 48 HB2 SER 667 HB2 SER 667 8.470 -9.743 -8.014 49 HB3 SER 667 HB3 SER 667 9.647 -8.613 -8.679 50 HG SER 667 HG SER 667 10.489 -8.887 -6.725 51 H VAL 668 H VAL 668 5.697 -7.874 -9.364 52 HA VAL 668 HA VAL 668 7.012 -7.160 -11.894 53 HB VAL 668 HB VAL 668 5.108 -8.101 -13.000 54 HG11 VAL 668 HG11 VAL 668 5.410 -10.335 -12.403 55 HG12 VAL 668 HG12 VAL 668 6.838 -9.588 -11.686 56 HG13 VAL 668 HG13 VAL 668 5.444 -9.970 -10.679 57 HG21 VAL 668 HG21 VAL 668 3.360 -9.150 -11.210 58 HG22 VAL 668 HG22 VAL 668 3.841 -7.698 -10.336 59 HG23 VAL 668 HG23 VAL 668 3.137 -7.564 -11.946 60 H HIS 669 H HIS 669 5.477 -5.693 -9.416 61 HA HIS 669 HA HIS 669 4.060 -3.689 -11.043 62 HB2 HIS 669 HB2 HIS 669 4.255 -3.914 -8.032 63 HB3 HIS 669 HB3 HIS 669 3.157 -2.884 -8.946 64 HD1 HIS 669 HD1 HIS 669 2.097 -4.843 -11.031 65 HD2 HIS 669 HD2 HIS 669 2.559 -5.827 -7.014 66 HE1 HIS 669 HE1 HIS 669 0.483 -6.744 -10.570 67 HE2 HIS 669 HE2 HIS 669 0.654 -7.282 -8.079 68 H LEU 670 H LEU 670 4.294 -1.433 -9.771 69 HA LEU 670 HA LEU 670 7.184 -0.869 -9.588 70 HB2 LEU 670 HB2 LEU 670 6.496 1.476 -10.380 71 HB3 LEU 670 HB3 LEU 670 6.585 0.206 -11.573 72 HG LEU 670 HG LEU 670 4.046 1.098 -10.194 73 HD11 LEU 670 HD11 LEU 670 5.072 1.640 -12.997 74 HD12 LEU 670 HD12 LEU 670 3.508 2.147 -12.358 75 HD13 LEU 670 HD13 LEU 670 4.993 2.819 -11.691 76 HD21 LEU 670 HD21 LEU 670 3.506 -0.182 -12.647 77 HD22 LEU 670 HD22 LEU 670 4.715 -1.192 -11.858 78 HD23 LEU 670 HD23 LEU 670 3.197 -0.824 -11.036 79 H TRP 671 H TRP 671 4.305 -0.981 -7.930 80 HA TRP 671 HA TRP 671 5.123 1.216 -6.177 81 HB2 TRP 671 HB2 TRP 671 2.842 0.775 -5.078 82 HB3 TRP 671 HB3 TRP 671 2.855 1.548 -6.653 83 HD1 TRP 671 HD1 TRP 671 1.440 0.461 -8.467 84 HE1 TRP 671 HE1 TRP 671 0.145 -1.764 -8.718 85 HE3 TRP 671 HE3 TRP 671 3.084 -1.963 -4.275 86 HZ2 TRP 671 HZ2 TRP 671 -0.105 -4.252 -7.326 87 HZ3 TRP 671 HZ3 TRP 671 2.301 -4.261 -3.768 88 HH2 TRP 671 HH2 TRP 671 0.706 -5.404 -5.286 89 H TYR 672 H TYR 672 5.514 -2.016 -6.550 90 HA TYR 672 HA TYR 672 5.341 -2.763 -3.741 91 HB2 TYR 672 HB2 TYR 672 4.674 -4.394 -5.440 92 HB3 TYR 672 HB3 TYR 672 6.279 -4.312 -6.167 93 HD1 TYR 672 HD2 TYR 672 4.885 -4.660 -2.690 94 HD2 TYR 672 HD1 TYR 672 7.661 -6.102 -5.641 95 HE1 TYR 672 HE2 TYR 672 5.709 -6.369 -1.091 96 HE2 TYR 672 HE1 TYR 672 8.478 -7.805 -4.038 97 HH TYR 672 HH TYR 672 7.421 -9.009 -1.953 98 H ALA 673 H ALA 673 6.905 -2.141 -2.420 99 HA ALA 673 HA ALA 673 9.656 -1.886 -3.448 100 HB1 ALA 673 HB1 ALA 673 8.547 -1.009 -0.771 101 HB2 ALA 673 HB2 ALA 673 8.609 0.026 -2.200 102 HB3 ALA 673 HB3 ALA 673 10.104 -0.568 -1.476 103 H GLY 674 H GLY 674 7.622 -3.803 -1.432 104 HA2 GLY 674 HA2 GLY 674 8.022 -5.578 0.007 105 HA3 GLY 674 HA3 GLY 674 9.200 -6.031 -1.216 106 HA PRO 675 HA PRO 675 12.249 -5.754 1.986 107 HB2 PRO 675 HB2 PRO 675 14.460 -5.382 0.349 108 HB3 PRO 675 HB3 PRO 675 13.708 -6.952 0.692 109 HG2 PRO 675 HG2 PRO 675 13.369 -5.167 -1.669 110 HG3 PRO 675 HG3 PRO 675 13.505 -6.934 -1.597 111 HD2 PRO 675 HD2 PRO 675 11.118 -5.727 -1.938 112 HD3 PRO 675 HD3 PRO 675 11.271 -7.216 -0.975 113 H MET 676 H MET 676 10.976 -3.547 2.207 114 HA MET 676 HA MET 676 13.020 -1.416 2.191 115 HB2 MET 676 HB2 MET 676 11.375 -1.204 0.242 116 HB3 MET 676 HB3 MET 676 10.136 -0.893 1.454 117 HG2 MET 676 HG2 MET 676 10.844 1.230 1.756 118 HG3 MET 676 HG3 MET 676 12.522 0.717 1.925 119 HE1 MET 676 HE1 MET 676 14.129 0.819 0.644 120 HE2 MET 676 HE2 MET 676 13.916 -0.083 -0.854 121 HE3 MET 676 HE3 MET 676 14.289 1.646 -0.903 122 H GLU 677 H GLU 677 12.322 0.424 3.687 123 HA GLU 677 HA GLU 677 10.803 -0.672 5.979 124 HB2 GLU 677 HB2 GLU 677 12.240 0.781 7.414 125 HB3 GLU 677 HB3 GLU 677 13.130 -0.497 6.579 126 HG2 GLU 677 HG2 GLU 677 14.379 1.002 5.452 127 HG3 GLU 677 HG3 GLU 677 12.960 1.929 4.980 128 H ARG 678 H ARG 678 9.842 0.921 7.390 129 HA ARG 678 HA ARG 678 7.946 2.504 6.243 130 HB2 ARG 678 HB2 ARG 678 7.709 2.022 8.526 131 HB3 ARG 678 HB3 ARG 678 9.314 2.620 8.920 132 HG2 ARG 678 HG2 ARG 678 7.904 4.795 7.761 133 HG3 ARG 678 HG3 ARG 678 6.821 4.043 8.931 134 HD2 ARG 678 HD2 ARG 678 8.621 4.109 10.627 135 HD3 ARG 678 HD3 ARG 678 9.676 4.908 9.468 136 HE ARG 678 HE ARG 678 7.402 6.093 10.882 137 HH11 ARG 678 HH21 ARG 678 9.604 6.245 8.235 138 HH12 ARG 678 HH22 ARG 678 9.437 7.963 8.005 139 HH21 ARG 678 HH11 ARG 678 7.242 8.304 10.682 140 HH22 ARG 678 HH12 ARG 678 8.123 9.122 9.412 141 H ALA 679 H ALA 679 11.001 3.792 7.601 142 HA ALA 679 HA ALA 679 10.587 6.415 6.543 143 HB1 ALA 679 HB1 ALA 679 12.480 5.061 8.235 144 HB2 ALA 679 HB2 ALA 679 12.174 6.794 8.078 145 HB3 ALA 679 HB3 ALA 679 13.339 6.002 7.012 146 H GLY 680 H GLY 680 12.007 3.481 5.371 147 HA2 GLY 680 HA2 GLY 680 13.532 4.657 3.226 148 HA3 GLY 680 HA3 GLY 680 13.121 2.953 3.394 149 H ALA 681 H ALA 681 10.330 3.182 3.564 150 HA ALA 681 HA ALA 681 9.610 3.241 0.828 151 HB1 ALA 681 HB1 ALA 681 7.401 2.812 1.558 152 HB2 ALA 681 HB2 ALA 681 7.660 3.635 3.097 153 HB3 ALA 681 HB3 ALA 681 8.421 2.075 2.793 154 H GLU 682 H GLU 682 8.920 5.571 3.452 155 HA GLU 682 HA GLU 682 7.691 7.471 1.717 156 HB2 GLU 682 HB2 GLU 682 7.883 9.031 3.620 157 HB3 GLU 682 HB3 GLU 682 7.180 7.488 4.081 158 HG2 GLU 682 HG2 GLU 682 9.429 6.745 4.863 159 HG3 GLU 682 HG3 GLU 682 10.043 8.357 4.524 160 H SER 683 H SER 683 10.953 6.792 2.560 161 HA SER 683 HA SER 683 12.158 9.255 2.102 162 HB2 SER 683 HB2 SER 683 13.086 6.419 1.777 163 HB3 SER 683 HB3 SER 683 14.128 7.752 1.282 164 HG SER 683 HG SER 683 13.023 7.181 3.847 165 H ILE 684 H ILE 684 10.738 6.980 -0.082 166 HA ILE 684 HA ILE 684 11.749 8.448 -2.424 167 HB ILE 684 HB ILE 684 9.978 6.002 -2.469 168 HG12 ILE 684 HG12 ILE 684 12.766 5.400 -2.926 169 HG13 ILE 684 HG13 ILE 684 12.584 6.151 -1.341 170 HG21 ILE 684 HG21 ILE 684 11.617 7.580 -4.384 171 HG22 ILE 684 HG22 ILE 684 11.655 5.829 -4.581 172 HG23 ILE 684 HG23 ILE 684 10.120 6.689 -4.648 173 HD11 ILE 684 HD11 ILE 684 10.740 4.535 -0.842 174 HD12 ILE 684 HD12 ILE 684 11.085 3.727 -2.373 175 HD13 ILE 684 HD13 ILE 684 12.300 3.755 -1.095 176 H LEU 685 H LEU 685 8.699 7.313 -0.967 177 HA LEU 685 HA LEU 685 6.916 8.651 -2.673 178 HB2 LEU 685 HB2 LEU 685 6.820 7.461 0.040 179 HB3 LEU 685 HB3 LEU 685 5.555 8.623 -0.340 180 HG LEU 685 HG LEU 685 4.763 7.333 -2.164 181 HD11 LEU 685 HD11 LEU 685 6.737 6.756 -3.349 182 HD12 LEU 685 HD12 LEU 685 7.428 5.924 -1.957 183 HD13 LEU 685 HD13 LEU 685 6.068 5.214 -2.826 184 HD21 LEU 685 HD21 LEU 685 3.998 6.264 -0.212 185 HD22 LEU 685 HD22 LEU 685 4.702 4.943 -1.143 186 HD23 LEU 685 HD23 LEU 685 5.604 5.655 0.194 187 H ALA 686 H ALA 686 8.603 9.748 0.260 188 HA ALA 686 HA ALA 686 7.244 12.248 0.439 189 HB1 ALA 686 HB1 ALA 686 8.510 11.315 2.319 190 HB2 ALA 686 HB2 ALA 686 9.106 12.919 1.893 191 HB3 ALA 686 HB3 ALA 686 10.009 11.484 1.405 192 H ASN 687 H ASN 687 10.067 11.088 -1.290 193 HA ASN 687 HA ASN 687 10.965 13.626 -2.248 194 HB2 ASN 687 HB2 ASN 687 12.703 12.247 -2.671 195 HB3 ASN 687 HB3 ASN 687 11.685 10.816 -2.573 196 HD21 ASN 687 HD21 ASN 687 12.076 13.588 -4.865 197 HD22 ASN 687 HD22 ASN 687 12.044 12.616 -6.255 198 H ARG 688 H ARG 688 8.796 11.126 -3.482 199 HA ARG 688 HA ARG 688 8.374 12.399 -6.019 200 HB2 ARG 688 HB2 ARG 688 7.174 10.089 -4.556 201 HB3 ARG 688 HB3 ARG 688 6.309 10.766 -5.934 202 HG2 ARG 688 HG2 ARG 688 7.626 9.355 -7.146 203 HG3 ARG 688 HG3 ARG 688 8.839 10.621 -6.950 204 HD2 ARG 688 HD2 ARG 688 9.931 9.490 -5.229 205 HD3 ARG 688 HD3 ARG 688 8.511 8.551 -4.812 206 HE ARG 688 HE ARG 688 8.938 7.137 -6.712 207 HH11 ARG 688 HH21 ARG 688 11.392 9.515 -6.076 208 HH12 ARG 688 HH22 ARG 688 12.581 8.687 -7.028 209 HH21 ARG 688 HH11 ARG 688 10.486 6.058 -7.872 210 HH22 ARG 688 HH12 ARG 688 12.079 6.744 -8.040 211 H SER 689 H SER 689 5.994 12.842 -6.684 212 HA SER 689 HA SER 689 5.062 15.040 -5.073 213 HB2 SER 689 HB2 SER 689 4.936 15.186 -7.499 214 HB3 SER 689 HB3 SER 689 3.910 13.753 -7.561 215 HG SER 689 HG SER 689 2.262 14.880 -6.733 216 H ASP 690 H ASP 690 2.616 15.221 -4.695 217 HA ASP 690 HA ASP 690 1.848 13.260 -2.810 218 HB2 ASP 690 HB2 ASP 690 0.764 15.747 -3.868 219 HB3 ASP 690 HB3 ASP 690 -0.487 14.561 -3.512 220 H GLY 691 H GLY 691 0.476 11.561 -2.908 221 HA2 GLY 691 HA2 GLY 691 -1.262 10.259 -3.944 222 HA3 GLY 691 HA3 GLY 691 -0.792 10.931 -5.504 223 H THR 692 H THR 692 2.075 10.497 -4.271 224 HA THR 692 HA THR 692 2.603 8.080 -5.701 225 HB THR 692 HB THR 692 4.469 9.346 -3.680 226 HG1 THR 692 HG1 THR 692 3.973 11.062 -4.944 227 HG21 THR 692 HG21 THR 692 5.267 8.260 -6.334 228 HG22 THR 692 HG22 THR 692 6.120 8.207 -4.793 229 HG23 THR 692 HG23 THR 692 4.781 7.102 -5.096 230 H PHE 693 H PHE 693 2.614 6.016 -4.975 231 HA PHE 693 HA PHE 693 2.630 5.584 -2.056 232 HB2 PHE 693 HB2 PHE 693 0.712 4.143 -2.137 233 HB3 PHE 693 HB3 PHE 693 0.270 5.666 -2.905 234 HD1 PHE 693 HD2 PHE 693 1.126 2.122 -3.503 235 HD2 PHE 693 HD1 PHE 693 -0.150 5.813 -5.282 236 HE1 PHE 693 HE2 PHE 693 0.518 0.915 -5.579 237 HE2 PHE 693 HE1 PHE 693 -0.762 4.603 -7.359 238 HZ PHE 693 HZ PHE 693 -0.423 2.153 -7.507 239 H LEU 694 H LEU 694 2.932 3.315 -1.459 240 HA LEU 694 HA LEU 694 3.890 1.452 -3.410 241 HB2 LEU 694 HB2 LEU 694 6.202 1.451 -2.987 242 HB3 LEU 694 HB3 LEU 694 5.796 3.159 -3.134 243 HG LEU 694 HG LEU 694 5.444 3.007 -0.528 244 HD11 LEU 694 HD11 LEU 694 7.543 1.308 0.040 245 HD12 LEU 694 HD12 LEU 694 5.839 0.908 0.250 246 HD13 LEU 694 HD13 LEU 694 6.684 0.428 -1.222 247 HD21 LEU 694 HD21 LEU 694 7.583 3.749 -2.224 248 HD22 LEU 694 HD22 LEU 694 7.300 4.278 -0.567 249 HD23 LEU 694 HD23 LEU 694 8.309 2.870 -0.883 250 H VAL 695 H VAL 695 4.827 -0.512 -2.345 251 HA VAL 695 HA VAL 695 3.840 -0.821 0.424 252 HB VAL 695 HB VAL 695 3.478 -2.866 -1.772 253 HG11 VAL 695 HG11 VAL 695 3.385 -2.964 1.116 254 HG12 VAL 695 HG12 VAL 695 1.787 -3.295 0.457 255 HG13 VAL 695 HG13 VAL 695 3.165 -4.271 -0.040 256 HG21 VAL 695 HG21 VAL 695 1.817 -0.609 -0.793 257 HG22 VAL 695 HG22 VAL 695 1.795 -1.430 -2.353 258 HG23 VAL 695 HG23 VAL 695 0.980 -2.148 -0.964 259 H ARG 696 H ARG 696 5.162 -1.838 1.776 260 HA ARG 696 HA ARG 696 7.604 -3.094 0.650 261 HB2 ARG 696 HB2 ARG 696 8.723 -2.354 2.751 262 HB3 ARG 696 HB3 ARG 696 8.150 -1.015 1.756 263 HG2 ARG 696 HG2 ARG 696 6.364 -0.530 3.196 264 HG3 ARG 696 HG3 ARG 696 6.379 -2.141 3.913 265 HD2 ARG 696 HD2 ARG 696 8.542 -0.047 4.270 266 HD3 ARG 696 HD3 ARG 696 7.310 -0.449 5.465 267 HE ARG 696 HE ARG 696 9.632 -2.084 4.719 268 HH11 ARG 696 HH21 ARG 696 6.596 -1.852 6.358 269 HH12 ARG 696 HH22 ARG 696 6.922 -3.182 7.420 270 HH21 ARG 696 HH11 ARG 696 9.999 -3.833 6.043 271 HH22 ARG 696 HH12 ARG 696 8.809 -4.321 7.218 272 H GLN 697 H GLN 697 8.688 -4.576 2.294 273 HA GLN 697 HA GLN 697 6.668 -6.179 3.758 274 HB2 GLN 697 HB2 GLN 697 7.196 -7.323 1.671 275 HB3 GLN 697 HB3 GLN 697 8.919 -7.190 1.999 276 HG2 GLN 697 HG2 GLN 697 7.978 -9.447 2.558 277 HG3 GLN 697 HG3 GLN 697 8.722 -8.646 3.936 278 HE21 GLN 697 HE21 GLN 697 5.684 -9.814 2.628 279 HE22 GLN 697 HE22 GLN 697 4.758 -9.480 4.007 280 H ARG 698 H ARG 698 7.470 -7.441 5.475 281 HA ARG 698 HA ARG 698 9.159 -8.160 7.005 282 HB2 ARG 698 HB2 ARG 698 10.973 -6.974 5.702 283 HB3 ARG 698 HB3 ARG 698 10.523 -5.496 6.549 284 HG2 ARG 698 HG2 ARG 698 10.755 -7.249 8.642 285 HG3 ARG 698 HG3 ARG 698 11.993 -7.857 7.543 286 HD2 ARG 698 HD2 ARG 698 12.986 -6.181 9.003 287 HD3 ARG 698 HD3 ARG 698 12.911 -5.547 7.360 288 HE ARG 698 HE ARG 698 10.656 -4.869 9.116 289 HH11 ARG 698 HH21 ARG 698 13.699 -3.950 7.747 290 HH12 ARG 698 HH22 ARG 698 13.438 -2.262 7.996 291 HH21 ARG 698 HH11 ARG 698 10.340 -2.692 9.429 292 HH22 ARG 698 HH12 ARG 698 11.546 -1.554 8.946 293 H VAL 699 H VAL 699 8.345 -8.095 8.985 294 HA VAL 699 HA VAL 699 7.986 -5.686 10.467 295 HB VAL 699 HB VAL 699 6.034 -5.458 8.976 296 HG11 VAL 699 HG11 VAL 699 5.802 -7.956 8.606 297 HG12 VAL 699 HG12 VAL 699 5.060 -8.052 10.203 298 HG13 VAL 699 HG13 VAL 699 4.288 -7.114 8.926 299 HG21 VAL 699 HG21 VAL 699 5.169 -6.306 11.759 300 HG22 VAL 699 HG22 VAL 699 5.931 -4.754 11.401 301 HG23 VAL 699 HG23 VAL 699 4.363 -5.153 10.703 302 H LYS 700 H LYS 700 6.961 -6.095 12.572 303 HA LYS 700 HA LYS 700 8.015 -8.367 13.845 304 HB2 LYS 700 HB2 LYS 700 5.815 -6.445 14.658 305 HB3 LYS 700 HB3 LYS 700 6.472 -7.681 15.729 306 HG2 LYS 700 HG2 LYS 700 7.989 -6.092 16.314 307 HG3 LYS 700 HG3 LYS 700 8.769 -6.499 14.788 308 HD2 LYS 700 HD2 LYS 700 6.978 -4.736 13.844 309 HD3 LYS 700 HD3 LYS 700 7.097 -4.120 15.491 310 HE2 LYS 700 HE2 LYS 700 9.541 -3.943 15.267 311 HE3 LYS 700 HE3 LYS 700 9.448 -4.600 13.632 312 HZ1 LYS 700 HZ1 LYS 700 8.330 -2.006 14.623 313 HZ2 LYS 700 HZ2 LYS 700 9.540 -2.261 13.432 314 HZ3 LYS 700 HZ3 LYS 700 7.939 -2.700 13.101 315 H ASP 701 H ASP 701 6.941 -10.217 14.725 316 HA ASP 701 HA ASP 701 5.270 -11.591 12.951 317 HB2 ASP 701 HB2 ASP 701 5.251 -12.311 15.850 318 HB3 ASP 701 HB3 ASP 701 5.451 -13.343 14.436 319 H ALA 702 H ALA 702 3.879 -9.332 13.026 320 HA ALA 702 HA ALA 702 1.336 -10.158 14.232 321 HB1 ALA 702 HB1 ALA 702 1.307 -7.481 14.838 322 HB2 ALA 702 HB2 ALA 702 2.980 -7.913 15.186 323 HB3 ALA 702 HB3 ALA 702 1.664 -8.768 15.989 324 H ALA 703 H ALA 703 2.819 -9.391 11.518 325 HA ALA 703 HA ALA 703 0.436 -8.556 10.176 326 HB1 ALA 703 HB1 ALA 703 1.119 -6.348 9.471 327 HB2 ALA 703 HB2 ALA 703 2.654 -6.505 10.323 328 HB3 ALA 703 HB3 ALA 703 1.147 -6.406 11.232 329 H GLU 704 H GLU 704 1.282 -7.546 7.870 330 HA GLU 704 HA GLU 704 3.407 -9.361 6.892 331 HB2 GLU 704 HB2 GLU 704 1.019 -10.097 6.378 332 HB3 GLU 704 HB3 GLU 704 0.905 -8.676 5.346 333 HG2 GLU 704 HG2 GLU 704 3.052 -9.533 4.209 334 HG3 GLU 704 HG3 GLU 704 2.760 -11.046 5.058 335 H PHE 705 H PHE 705 2.272 -7.968 4.212 336 HA PHE 705 HA PHE 705 4.444 -6.206 3.859 337 HB2 PHE 705 HB2 PHE 705 1.785 -6.318 2.413 338 HB3 PHE 705 HB3 PHE 705 3.170 -5.368 1.884 339 HD1 PHE 705 HD2 PHE 705 5.345 -6.549 1.340 340 HD2 PHE 705 HD1 PHE 705 1.653 -8.645 1.958 341 HE1 PHE 705 HE2 PHE 705 6.281 -8.541 0.189 342 HE2 PHE 705 HE1 PHE 705 2.585 -10.633 0.808 343 HZ PHE 705 HZ PHE 705 4.899 -10.580 -0.076 344 H ALA 706 H ALA 706 4.226 -3.853 3.362 345 HA ALA 706 HA ALA 706 2.200 -2.539 5.071 346 HB1 ALA 706 HB1 ALA 706 3.730 -1.450 6.338 347 HB2 ALA 706 HB2 ALA 706 4.817 -1.193 4.976 348 HB3 ALA 706 HB3 ALA 706 4.824 -2.737 5.829 349 H ILE 707 H ILE 707 1.088 -1.056 4.012 350 HA ILE 707 HA ILE 707 2.020 -0.183 1.366 351 HB ILE 707 HB ILE 707 -0.604 0.573 2.645 352 HG12 ILE 707 HG12 ILE 707 -1.370 -1.520 1.214 353 HG13 ILE 707 HG13 ILE 707 0.279 -2.065 1.516 354 HG21 ILE 707 HG21 ILE 707 0.492 1.380 0.314 355 HG22 ILE 707 HG22 ILE 707 -0.271 -0.112 -0.236 356 HG23 ILE 707 HG23 ILE 707 -1.245 1.151 0.515 357 HD11 ILE 707 HD11 ILE 707 -0.805 -1.033 3.963 358 HD12 ILE 707 HD12 ILE 707 -1.944 -2.184 3.284 359 HD13 ILE 707 HD13 ILE 707 -0.286 -2.680 3.604 360 H SER 708 H SER 708 2.710 1.817 0.908 361 HA SER 708 HA SER 708 2.443 3.884 3.008 362 HB2 SER 708 HB2 SER 708 4.868 3.206 1.344 363 HB3 SER 708 HB3 SER 708 4.713 4.699 2.265 364 HG SER 708 HG SER 708 4.503 2.048 3.311 365 H ILE 709 H ILE 709 1.608 5.809 2.302 366 HA ILE 709 HA ILE 709 1.578 6.294 -0.628 367 HB ILE 709 HB ILE 709 -0.705 7.253 1.043 368 HG12 ILE 709 HG12 ILE 709 -1.805 4.989 0.220 369 HG13 ILE 709 HG13 ILE 709 -0.145 4.397 0.319 370 HG21 ILE 709 HG21 ILE 709 -1.208 6.035 -1.571 371 HG22 ILE 709 HG22 ILE 709 -1.632 7.641 -0.980 372 HG23 ILE 709 HG23 ILE 709 -0.027 7.344 -1.650 373 HD11 ILE 709 HD11 ILE 709 -1.515 5.880 2.576 374 HD12 ILE 709 HD12 ILE 709 -1.498 4.119 2.443 375 HD13 ILE 709 HD13 ILE 709 0.011 5.003 2.641 376 H LYS 710 H LYS 710 1.980 8.324 -1.309 377 HA LYS 710 HA LYS 710 2.812 10.291 0.704 378 HB2 LYS 710 HB2 LYS 710 4.401 9.969 -1.072 379 HB3 LYS 710 HB3 LYS 710 3.144 10.124 -2.296 380 HG2 LYS 710 HG2 LYS 710 4.269 12.217 -2.282 381 HG3 LYS 710 HG3 LYS 710 2.762 12.488 -1.417 382 HD2 LYS 710 HD2 LYS 710 3.802 12.693 0.634 383 HD3 LYS 710 HD3 LYS 710 5.181 11.686 0.168 384 HE2 LYS 710 HE2 LYS 710 4.624 14.423 -1.005 385 HE3 LYS 710 HE3 LYS 710 5.716 14.145 0.354 386 HZ1 LYS 710 HZ1 LYS 710 6.471 12.268 -1.503 387 HZ2 LYS 710 HZ2 LYS 710 6.151 13.651 -2.461 388 HZ3 LYS 710 HZ3 LYS 710 7.288 13.748 -1.184 389 H TYR 711 H TYR 711 1.022 11.292 1.486 390 HA TYR 711 HA TYR 711 -0.562 12.864 -0.427 391 HB2 TYR 711 HB2 TYR 711 -1.957 10.935 -0.155 392 HB3 TYR 711 HB3 TYR 711 -1.701 10.920 1.589 393 HD1 TYR 711 HD1 TYR 711 -2.767 13.429 -1.008 394 HD2 TYR 711 HD2 TYR 711 -3.484 11.685 2.849 395 HE1 TYR 711 HE1 TYR 711 -4.735 14.913 -0.701 396 HE2 TYR 711 HE2 TYR 711 -5.450 13.171 3.158 397 HH TYR 711 HH TYR 711 -7.081 14.400 1.557 398 H ASN 712 H ASN 712 -0.243 14.864 0.199 399 HA ASN 712 HA ASN 712 -0.512 16.734 1.574 400 HB2 ASN 712 HB2 ASN 712 -1.996 15.330 3.073 401 HB3 ASN 712 HB3 ASN 712 -0.544 14.872 3.956 402 HD21 ASN 712 HD21 ASN 712 -0.042 16.184 5.690 403 HD22 ASN 712 HD22 ASN 712 -0.567 17.799 5.858 404 H VAL 713 H VAL 713 1.835 16.041 0.517 405 HA VAL 713 HA VAL 713 4.130 16.021 0.757 406 HB VAL 713 HB VAL 713 5.008 17.890 2.045 407 HG11 VAL 713 HG11 VAL 713 3.804 18.312 -0.100 408 HG12 VAL 713 HG12 VAL 713 2.323 18.584 0.820 409 HG13 VAL 713 HG13 VAL 713 3.694 19.675 1.016 410 HG21 VAL 713 HG21 VAL 713 2.218 18.314 3.144 411 HG22 VAL 713 HG22 VAL 713 3.467 17.458 4.050 412 HG23 VAL 713 HG23 VAL 713 3.701 19.147 3.604 413 H GLU 714 H GLU 714 2.843 13.966 2.175 414 HA GLU 714 HA GLU 714 4.935 13.261 4.053 415 HB2 GLU 714 HB2 GLU 714 3.421 12.757 5.904 416 HB3 GLU 714 HB3 GLU 714 3.270 14.464 5.474 417 HG2 GLU 714 HG2 GLU 714 1.325 13.743 3.967 418 HG3 GLU 714 HG3 GLU 714 1.388 12.196 4.805 419 H VAL 715 H VAL 715 4.731 10.964 4.697 420 HA VAL 715 HA VAL 715 3.192 9.444 2.686 421 HB VAL 715 HB VAL 715 5.788 8.610 3.951 422 HG11 VAL 715 HG11 VAL 715 4.693 7.596 1.352 423 HG12 VAL 715 HG12 VAL 715 5.709 6.770 2.531 424 HG13 VAL 715 HG13 VAL 715 3.991 6.989 2.850 425 HG21 VAL 715 HG21 VAL 715 6.337 10.518 2.638 426 HG22 VAL 715 HG22 VAL 715 6.656 9.148 1.580 427 HG23 VAL 715 HG23 VAL 715 5.177 10.084 1.386 428 H LYS 716 H LYS 716 1.578 8.349 3.543 429 HA LYS 716 HA LYS 716 1.600 7.629 6.386 430 HB2 LYS 716 HB2 LYS 716 -0.631 6.806 4.576 431 HB3 LYS 716 HB3 LYS 716 -0.701 7.432 6.219 432 HG2 LYS 716 HG2 LYS 716 0.384 9.551 4.774 433 HG3 LYS 716 HG3 LYS 716 -0.831 8.884 3.682 434 HD2 LYS 716 HD2 LYS 716 -2.573 9.164 5.281 435 HD3 LYS 716 HD3 LYS 716 -1.419 9.432 6.592 436 HE2 LYS 716 HE2 LYS 716 -0.755 11.410 4.760 437 HE3 LYS 716 HE3 LYS 716 -2.517 11.347 4.671 438 HZ1 LYS 716 HZ1 LYS 716 -0.887 12.438 6.718 439 HZ2 LYS 716 HZ2 LYS 716 -2.601 12.423 6.584 440 HZ3 LYS 716 HZ3 LYS 716 -1.821 11.138 7.354 441 H HIS 717 H HIS 717 1.988 5.606 7.145 442 HA HIS 717 HA HIS 717 2.393 3.438 5.162 443 HB2 HIS 717 HB2 HIS 717 3.685 3.661 7.881 444 HB3 HIS 717 HB3 HIS 717 4.101 2.551 6.579 445 HD1 HIS 717 HD1 HIS 717 5.135 3.675 4.359 446 HD2 HIS 717 HD2 HIS 717 4.962 6.121 7.759 447 HE1 HIS 717 HE1 HIS 717 6.760 5.594 3.976 448 HE2 HIS 717 HE2 HIS 717 6.671 7.107 6.038 449 H ILE 718 H ILE 718 1.243 1.618 5.367 450 HA ILE 718 HA ILE 718 -0.010 1.008 7.979 451 HB ILE 718 HB ILE 718 -1.477 0.804 5.348 452 HG12 ILE 718 HG12 ILE 718 -2.582 2.669 7.286 453 HG13 ILE 718 HG13 ILE 718 -0.945 3.139 6.836 454 HG21 ILE 718 HG21 ILE 718 -2.370 -0.785 6.855 455 HG22 ILE 718 HG22 ILE 718 -2.163 0.287 8.241 456 HG23 ILE 718 HG23 ILE 718 -3.418 0.620 7.048 457 HD11 ILE 718 HD11 ILE 718 -1.652 3.858 4.832 458 HD12 ILE 718 HD12 ILE 718 -2.391 2.296 4.488 459 HD13 ILE 718 HD13 ILE 718 -3.307 3.534 5.345 460 H LYS 719 H LYS 719 -0.092 -1.122 8.501 461 HA LYS 719 HA LYS 719 1.456 -2.975 6.908 462 HB2 LYS 719 HB2 LYS 719 1.019 -4.539 8.773 463 HB3 LYS 719 HB3 LYS 719 1.675 -3.008 9.331 464 HG2 LYS 719 HG2 LYS 719 -0.088 -2.882 10.742 465 HG3 LYS 719 HG3 LYS 719 -1.098 -2.597 9.325 466 HD2 LYS 719 HD2 LYS 719 -1.559 -4.965 9.096 467 HD3 LYS 719 HD3 LYS 719 -0.385 -5.361 10.347 468 HE2 LYS 719 HE2 LYS 719 -2.422 -5.452 11.510 469 HE3 LYS 719 HE3 LYS 719 -1.840 -3.827 11.874 470 HZ1 LYS 719 HZ1 LYS 719 -3.249 -3.749 9.457 471 HZ2 LYS 719 HZ2 LYS 719 -4.233 -4.580 10.593 472 HZ3 LYS 719 HZ3 LYS 719 -3.656 -2.985 10.935 473 H ILE 720 H ILE 720 0.736 -4.713 5.740 474 HA ILE 720 HA ILE 720 -2.172 -4.822 5.267 475 HB ILE 720 HB ILE 720 0.135 -5.159 3.594 476 HG12 ILE 720 HG12 ILE 720 -2.685 -5.607 2.687 477 HG13 ILE 720 HG13 ILE 720 -2.236 -4.031 3.336 478 HG21 ILE 720 HG21 ILE 720 -0.481 -7.218 2.404 479 HG22 ILE 720 HG22 ILE 720 -0.102 -7.596 4.083 480 HG23 ILE 720 HG23 ILE 720 -1.783 -7.519 3.552 481 HD11 ILE 720 HD11 ILE 720 -0.175 -4.253 1.714 482 HD12 ILE 720 HD12 ILE 720 -1.206 -5.415 0.881 483 HD13 ILE 720 HD13 ILE 720 -1.737 -3.746 1.070 484 H MET 721 H MET 721 -3.324 -6.770 5.334 485 HA MET 721 HA MET 721 -2.140 -8.846 7.086 486 HB2 MET 721 HB2 MET 721 -4.218 -7.341 7.763 487 HB3 MET 721 HB3 MET 721 -5.092 -8.495 6.760 488 HG2 MET 721 HG2 MET 721 -4.901 -9.059 9.264 489 HG3 MET 721 HG3 MET 721 -4.477 -10.340 8.133 490 HE1 MET 721 HE1 MET 721 -2.253 -8.384 11.367 491 HE2 MET 721 HE2 MET 721 -3.956 -8.559 10.948 492 HE3 MET 721 HE3 MET 721 -3.037 -9.952 11.524 493 H THR 722 H THR 722 -3.250 -11.044 6.760 494 HA THR 722 HA THR 722 -3.812 -11.467 3.879 495 HB THR 722 HB THR 722 -1.666 -12.376 4.112 496 HG1 THR 722 HG1 THR 722 -3.625 -14.368 4.629 497 HG21 THR 722 HG21 THR 722 -1.047 -13.854 6.028 498 HG22 THR 722 HG22 THR 722 -1.431 -12.208 6.527 499 HG23 THR 722 HG23 THR 722 -2.608 -13.500 6.766 500 H ALA 723 H ALA 723 -5.909 -11.010 5.445 501 HA ALA 723 HA ALA 723 -7.052 -13.077 6.915 502 HB1 ALA 723 HB1 ALA 723 -9.041 -11.904 6.782 503 HB2 ALA 723 HB2 ALA 723 -8.782 -11.441 5.099 504 HB3 ALA 723 HB3 ALA 723 -7.883 -10.634 6.387 505 H GLU 724 H GLU 724 -7.389 -15.102 6.352 506 HA GLU 724 HA GLU 724 -7.765 -16.980 5.071 507 HB2 GLU 724 HB2 GLU 724 -9.690 -15.395 3.415 508 HB3 GLU 724 HB3 GLU 724 -9.861 -17.017 4.087 509 HG2 GLU 724 HG2 GLU 724 -10.252 -14.356 5.431 510 HG3 GLU 724 HG3 GLU 724 -11.289 -15.775 5.463 511 H GLY 725 H GLY 725 -5.842 -14.814 4.114 512 HA2 GLY 725 HA2 GLY 725 -4.212 -15.150 2.394 513 HA3 GLY 725 HA3 GLY 725 -5.453 -15.907 1.400 514 H LEU 726 H LEU 726 -7.067 -13.400 2.638 515 HA LEU 726 HA LEU 726 -6.680 -11.785 0.238 516 HB2 LEU 726 HB2 LEU 726 -8.540 -11.242 2.562 517 HB3 LEU 726 HB3 LEU 726 -8.631 -10.566 0.938 518 HG LEU 726 HG LEU 726 -8.843 -13.531 1.500 519 HD11 LEU 726 HD11 LEU 726 -11.251 -13.284 1.350 520 HD12 LEU 726 HD12 LEU 726 -10.666 -12.196 2.608 521 HD13 LEU 726 HD13 LEU 726 -11.094 -11.558 1.021 522 HD21 LEU 726 HD21 LEU 726 -8.813 -13.677 -0.751 523 HD22 LEU 726 HD22 LEU 726 -10.218 -12.619 -0.838 524 HD23 LEU 726 HD23 LEU 726 -8.594 -11.933 -0.863 525 H TYR 727 H TYR 727 -5.850 -9.730 0.163 526 HA TYR 727 HA TYR 727 -4.361 -8.894 2.541 527 HB2 TYR 727 HB2 TYR 727 -4.156 -8.205 -0.370 528 HB3 TYR 727 HB3 TYR 727 -3.362 -7.232 0.860 529 HD1 TYR 727 HD2 TYR 727 -3.669 -10.682 1.849 530 HD2 TYR 727 HD1 TYR 727 -1.294 -7.975 -0.466 531 HE1 TYR 727 HE2 TYR 727 -1.779 -12.276 1.920 532 HE2 TYR 727 HE1 TYR 727 0.601 -9.559 -0.392 533 HH TYR 727 HH TYR 727 0.994 -11.837 1.716 534 H ARG 728 H ARG 728 -4.600 -6.939 3.501 535 HA ARG 728 HA ARG 728 -6.588 -5.050 2.500 536 HB2 ARG 728 HB2 ARG 728 -7.507 -5.138 5.006 537 HB3 ARG 728 HB3 ARG 728 -8.178 -6.154 3.740 538 HG2 ARG 728 HG2 ARG 728 -6.521 -7.947 4.417 539 HG3 ARG 728 HG3 ARG 728 -6.096 -6.936 5.797 540 HD2 ARG 728 HD2 ARG 728 -8.944 -7.120 5.691 541 HD3 ARG 728 HD3 ARG 728 -8.291 -8.750 5.533 542 HE ARG 728 HE ARG 728 -7.092 -7.180 7.672 543 HH11 ARG 728 HH21 ARG 728 -9.628 -9.336 6.763 544 HH12 ARG 728 HH22 ARG 728 -9.898 -9.901 8.372 545 HH21 ARG 728 HH11 ARG 728 -7.433 -7.879 9.752 546 HH22 ARG 728 HH12 ARG 728 -8.669 -9.079 10.066 547 H ILE 729 H ILE 729 -6.271 -2.993 3.228 548 HA ILE 729 HA ILE 729 -3.789 -2.494 4.711 549 HB ILE 729 HB ILE 729 -5.622 -0.424 3.512 550 HG12 ILE 729 HG12 ILE 729 -3.488 -2.083 2.142 551 HG13 ILE 729 HG13 ILE 729 -5.192 -1.964 1.704 552 HG21 ILE 729 HG21 ILE 729 -3.147 0.527 3.191 553 HG22 ILE 729 HG22 ILE 729 -4.020 0.716 4.713 554 HG23 ILE 729 HG23 ILE 729 -2.822 -0.566 4.534 555 HD11 ILE 729 HD11 ILE 729 -4.641 0.613 1.525 556 HD12 ILE 729 HD12 ILE 729 -2.991 0.027 1.312 557 HD13 ILE 729 HD13 ILE 729 -4.256 -0.475 0.188 558 H THR 730 H THR 730 -7.228 -2.070 4.904 559 HA THR 730 HA THR 730 -6.986 -0.771 7.552 560 HB THR 730 HB THR 730 -8.173 0.433 5.742 561 HG1 THR 730 HG1 THR 730 -9.576 1.179 7.125 562 HG21 THR 730 HG21 THR 730 -9.339 -2.143 5.342 563 HG22 THR 730 HG22 THR 730 -10.625 -1.000 5.723 564 HG23 THR 730 HG23 THR 730 -9.544 -0.691 4.369 565 H GLU 731 H GLU 731 -7.639 -3.642 6.008 566 HA GLU 731 HA GLU 731 -8.243 -5.691 6.800 567 HB2 GLU 731 HB2 GLU 731 -8.822 -4.348 9.438 568 HB3 GLU 731 HB3 GLU 731 -8.525 -6.064 9.149 569 HG2 GLU 731 HG2 GLU 731 -6.312 -4.987 7.985 570 HG3 GLU 731 HG3 GLU 731 -6.598 -3.800 9.255 571 H LYS 732 H LYS 732 -10.244 -2.948 6.958 572 HA LYS 732 HA LYS 732 -12.734 -4.326 7.434 573 HB2 LYS 732 HB2 LYS 732 -12.476 -1.639 6.101 574 HB3 LYS 732 HB3 LYS 732 -13.759 -2.226 7.157 575 HG2 LYS 732 HG2 LYS 732 -10.908 -1.682 8.048 576 HG3 LYS 732 HG3 LYS 732 -12.261 -0.585 8.290 577 HD2 LYS 732 HD2 LYS 732 -12.724 -3.363 9.215 578 HD3 LYS 732 HD3 LYS 732 -11.498 -2.469 10.110 579 HE2 LYS 732 HE2 LYS 732 -14.076 -1.087 9.496 580 HE3 LYS 732 HE3 LYS 732 -14.065 -2.306 10.774 581 HZ1 LYS 732 HZ1 LYS 732 -11.873 -0.358 10.779 582 HZ2 LYS 732 HZ2 LYS 732 -13.420 0.213 11.222 583 HZ3 LYS 732 HZ3 LYS 732 -12.710 -1.071 12.106 584 H LYS 733 H LYS 733 -10.852 -3.264 4.664 585 HA LYS 733 HA LYS 733 -12.663 -4.779 2.881 586 HB2 LYS 733 HB2 LYS 733 -13.002 -2.397 2.480 587 HB3 LYS 733 HB3 LYS 733 -11.267 -2.153 2.294 588 HG2 LYS 733 HG2 LYS 733 -12.353 -2.310 0.092 589 HG3 LYS 733 HG3 LYS 733 -11.266 -3.675 0.338 590 HD2 LYS 733 HD2 LYS 733 -13.015 -5.194 0.636 591 HD3 LYS 733 HD3 LYS 733 -14.149 -3.942 1.142 592 HE2 LYS 733 HE2 LYS 733 -13.042 -4.155 -1.675 593 HE3 LYS 733 HE3 LYS 733 -14.582 -4.860 -1.177 594 HZ1 LYS 733 HZ1 LYS 733 -14.380 -2.403 -2.137 595 HZ2 LYS 733 HZ2 LYS 733 -15.559 -2.837 -0.992 596 HZ3 LYS 733 HZ3 LYS 733 -14.137 -2.057 -0.490 597 H ALA 734 H ALA 734 -11.524 -6.594 2.477 598 HA ALA 734 HA ALA 734 -8.641 -6.381 1.910 599 HB1 ALA 734 HB1 ALA 734 -10.029 -9.014 2.154 600 HB2 ALA 734 HB2 ALA 734 -9.810 -8.049 3.613 601 HB3 ALA 734 HB3 ALA 734 -8.408 -8.543 2.665 602 H PHE 735 H PHE 735 -7.838 -8.045 0.285 603 HA PHE 735 HA PHE 735 -9.671 -8.453 -1.979 604 HB2 PHE 735 HB2 PHE 735 -7.405 -6.559 -1.916 605 HB3 PHE 735 HB3 PHE 735 -7.494 -7.591 -3.342 606 HD1 PHE 735 HD2 PHE 735 -9.545 -7.600 -4.761 607 HD2 PHE 735 HD1 PHE 735 -9.045 -4.854 -1.498 608 HE1 PHE 735 HE2 PHE 735 -11.396 -6.212 -5.646 609 HE2 PHE 735 HE1 PHE 735 -10.897 -3.466 -2.382 610 HZ PHE 735 HZ PHE 735 -12.074 -4.147 -4.454 611 H ARG 736 H ARG 736 -8.611 -9.759 -3.730 612 HA ARG 736 HA ARG 736 -7.836 -12.240 -2.945 613 HB2 ARG 736 HB2 ARG 736 -7.613 -10.699 -5.417 614 HB3 ARG 736 HB3 ARG 736 -6.383 -11.953 -5.269 615 HG2 ARG 736 HG2 ARG 736 -7.973 -13.389 -5.988 616 HG3 ARG 736 HG3 ARG 736 -8.687 -13.226 -4.382 617 HD2 ARG 736 HD2 ARG 736 -10.378 -12.751 -6.063 618 HD3 ARG 736 HD3 ARG 736 -9.991 -11.276 -5.190 619 HE ARG 736 HE ARG 736 -9.070 -10.372 -7.130 620 HH11 ARG 736 HH21 ARG 736 -9.658 -13.768 -7.510 621 HH12 ARG 736 HH22 ARG 736 -9.179 -13.795 -9.169 622 HH21 ARG 736 HH11 ARG 736 -8.387 -10.421 -9.251 623 HH22 ARG 736 HH12 ARG 736 -8.471 -11.909 -10.156 624 H GLY 737 H GLY 737 -5.639 -9.541 -3.645 625 HA2 GLY 737 HA2 GLY 737 -3.648 -10.616 -1.850 626 HA3 GLY 737 HA3 GLY 737 -3.178 -10.636 -3.546 627 H LEU 738 H LEU 738 -1.496 -9.171 -2.758 628 HA LEU 738 HA LEU 738 -2.057 -6.589 -1.758 629 HB2 LEU 738 HB2 LEU 738 0.241 -8.102 -2.280 630 HB3 LEU 738 HB3 LEU 738 0.372 -6.699 -3.338 631 HG LEU 738 HG LEU 738 -0.190 -6.571 -0.363 632 HD11 LEU 738 HD11 LEU 738 2.043 -6.074 -0.014 633 HD12 LEU 738 HD12 LEU 738 2.163 -7.285 -1.285 634 HD13 LEU 738 HD13 LEU 738 2.304 -5.575 -1.684 635 HD21 LEU 738 HD21 LEU 738 0.239 -4.483 -2.505 636 HD22 LEU 738 HD22 LEU 738 -1.178 -4.696 -1.477 637 HD23 LEU 738 HD23 LEU 738 0.336 -4.137 -0.780 638 H THR 739 H THR 739 -1.219 -7.721 -5.024 639 HA THR 739 HA THR 739 -1.409 -5.286 -6.348 640 HB THR 739 HB THR 739 -2.348 -7.926 -7.471 641 HG1 THR 739 HG1 THR 739 -0.359 -8.322 -6.628 642 HG21 THR 739 HG21 THR 739 -2.768 -5.951 -8.871 643 HG22 THR 739 HG22 THR 739 -1.072 -5.490 -8.737 644 HG23 THR 739 HG23 THR 739 -1.519 -6.969 -9.584 645 H GLU 740 H GLU 740 -3.960 -7.723 -5.842 646 HA GLU 740 HA GLU 740 -6.040 -6.167 -6.993 647 HB2 GLU 740 HB2 GLU 740 -6.104 -8.426 -4.984 648 HB3 GLU 740 HB3 GLU 740 -7.550 -7.717 -5.699 649 HG2 GLU 740 HG2 GLU 740 -5.666 -8.328 -7.795 650 HG3 GLU 740 HG3 GLU 740 -5.895 -9.755 -6.789 651 H LEU 741 H LEU 741 -4.681 -6.362 -3.803 652 HA LEU 741 HA LEU 741 -6.723 -4.816 -2.518 653 HB2 LEU 741 HB2 LEU 741 -5.354 -6.504 -1.357 654 HB3 LEU 741 HB3 LEU 741 -3.911 -5.549 -1.658 655 HG LEU 741 HG LEU 741 -5.068 -5.375 0.650 656 HD11 LEU 741 HD11 LEU 741 -3.797 -3.545 0.857 657 HD12 LEU 741 HD12 LEU 741 -3.512 -3.647 -0.876 658 HD13 LEU 741 HD13 LEU 741 -4.807 -2.624 -0.257 659 HD21 LEU 741 HD21 LEU 741 -6.879 -3.769 0.801 660 HD22 LEU 741 HD22 LEU 741 -6.815 -3.476 -0.934 661 HD23 LEU 741 HD23 LEU 741 -7.351 -5.040 -0.325 662 H VAL 742 H VAL 742 -3.502 -4.112 -3.865 663 HA VAL 742 HA VAL 742 -3.731 -1.295 -3.071 664 HB VAL 742 HB VAL 742 -1.581 -3.014 -4.187 665 HG11 VAL 742 HG11 VAL 742 -1.790 -0.039 -4.693 666 HG12 VAL 742 HG12 VAL 742 -0.267 -0.924 -4.740 667 HG13 VAL 742 HG13 VAL 742 -1.546 -1.316 -5.887 668 HG21 VAL 742 HG21 VAL 742 -1.396 -2.607 -1.885 669 HG22 VAL 742 HG22 VAL 742 -0.328 -1.388 -2.575 670 HG23 VAL 742 HG23 VAL 742 -1.946 -0.939 -2.041 671 H GLU 743 H GLU 743 -4.154 -3.243 -5.969 672 HA GLU 743 HA GLU 743 -4.259 -0.911 -7.677 673 HB2 GLU 743 HB2 GLU 743 -4.990 -3.801 -8.195 674 HB3 GLU 743 HB3 GLU 743 -5.029 -2.529 -9.414 675 HG2 GLU 743 HG2 GLU 743 -2.557 -3.243 -7.805 676 HG3 GLU 743 HG3 GLU 743 -2.895 -3.878 -9.410 677 H PHE 744 H PHE 744 -6.217 -1.738 -5.323 678 HA PHE 744 HA PHE 744 -8.671 -1.021 -6.809 679 HB2 PHE 744 HB2 PHE 744 -8.691 -3.263 -5.676 680 HB3 PHE 744 HB3 PHE 744 -8.524 -2.424 -4.134 681 HD1 PHE 744 HD2 PHE 744 -10.737 -3.051 -7.013 682 HD2 PHE 744 HD1 PHE 744 -10.333 -1.047 -3.233 683 HE1 PHE 744 HE2 PHE 744 -13.176 -2.608 -6.985 684 HE2 PHE 744 HE1 PHE 744 -12.771 -0.603 -3.207 685 HZ PHE 744 HZ PHE 744 -14.192 -1.384 -5.083 686 H TYR 745 H TYR 745 -6.848 -0.548 -3.803 687 HA TYR 745 HA TYR 745 -8.512 1.475 -2.727 688 HB2 TYR 745 HB2 TYR 745 -5.644 0.693 -2.285 689 HB3 TYR 745 HB3 TYR 745 -6.300 2.149 -1.542 690 HD1 TYR 745 HD1 TYR 745 -7.673 -1.294 -2.176 691 HD2 TYR 745 HD2 TYR 745 -6.852 1.798 0.706 692 HE1 TYR 745 HE1 TYR 745 -8.709 -2.672 -0.389 693 HE2 TYR 745 HE2 TYR 745 -7.876 0.403 2.479 694 HH TYR 745 HH TYR 745 -9.054 -2.894 1.827 695 H GLN 746 H GLN 746 -6.526 1.467 -5.448 696 HA GLN 746 HA GLN 746 -5.643 4.178 -5.474 697 HB2 GLN 746 HB2 GLN 746 -5.462 3.737 -7.989 698 HB3 GLN 746 HB3 GLN 746 -4.523 2.670 -6.940 699 HG2 GLN 746 HG2 GLN 746 -5.770 0.843 -7.458 700 HG3 GLN 746 HG3 GLN 746 -7.279 1.746 -7.491 701 HE21 GLN 746 HE21 GLN 746 -4.731 0.437 -9.465 702 HE22 GLN 746 HE22 GLN 746 -5.309 1.034 -10.944 703 H GLN 747 H GLN 747 -8.646 2.632 -6.019 704 HA GLN 747 HA GLN 747 -9.794 5.072 -7.240 705 HB2 GLN 747 HB2 GLN 747 -11.255 2.453 -7.051 706 HB3 GLN 747 HB3 GLN 747 -11.437 3.747 -8.235 707 HG2 GLN 747 HG2 GLN 747 -8.746 2.830 -8.412 708 HG3 GLN 747 HG3 GLN 747 -9.775 1.402 -8.388 709 HE21 GLN 747 HE21 GLN 747 -8.224 2.686 -10.662 710 HE22 GLN 747 HE22 GLN 747 -9.398 2.944 -11.873 711 H ASN 748 H ASN 748 -10.151 2.700 -4.648 712 HA ASN 748 HA ASN 748 -12.475 3.888 -3.491 713 HB2 ASN 748 HB2 ASN 748 -12.165 1.652 -2.888 714 HB3 ASN 748 HB3 ASN 748 -10.446 1.868 -2.589 715 HD21 ASN 748 HD21 ASN 748 -13.671 2.575 -1.232 716 HD22 ASN 748 HD22 ASN 748 -13.124 2.789 0.370 717 H SER 749 H SER 749 -12.600 5.740 -2.394 718 HA SER 749 HA SER 749 -10.436 7.423 -1.825 719 HB2 SER 749 HB2 SER 749 -11.984 8.794 -0.647 720 HB3 SER 749 HB3 SER 749 -12.889 8.045 -1.957 721 HG SER 749 HG SER 749 -12.755 6.636 0.446 722 H LEU 750 H LEU 750 -8.795 6.878 -0.543 723 HA LEU 750 HA LEU 750 -8.700 5.009 1.473 724 HB2 LEU 750 HB2 LEU 750 -7.193 7.632 1.385 725 HB3 LEU 750 HB3 LEU 750 -6.730 6.214 2.327 726 HG LEU 750 HG LEU 750 -7.036 6.270 -0.685 727 HD11 LEU 750 HD11 LEU 750 -5.105 7.606 0.246 728 HD12 LEU 750 HD12 LEU 750 -4.494 6.112 0.947 729 HD13 LEU 750 HD13 LEU 750 -4.631 6.273 -0.803 730 HD21 LEU 750 HD21 LEU 750 -5.811 4.163 1.110 731 HD22 LEU 750 HD22 LEU 750 -7.435 4.058 0.434 732 HD23 LEU 750 HD23 LEU 750 -6.034 4.063 -0.633 733 H LYS 751 H LYS 751 -10.020 8.242 1.623 734 HA LYS 751 HA LYS 751 -10.082 8.634 4.395 735 HB2 LYS 751 HB2 LYS 751 -11.704 10.308 4.004 736 HB3 LYS 751 HB3 LYS 751 -10.697 10.291 2.560 737 HG2 LYS 751 HG2 LYS 751 -12.491 8.554 1.696 738 HG3 LYS 751 HG3 LYS 751 -13.514 9.322 2.912 739 HD2 LYS 751 HD2 LYS 751 -12.025 10.773 0.696 740 HD3 LYS 751 HD3 LYS 751 -13.755 10.433 0.711 741 HE2 LYS 751 HE2 LYS 751 -14.052 11.813 2.704 742 HE3 LYS 751 HE3 LYS 751 -12.309 12.076 2.815 743 HZ1 LYS 751 HZ1 LYS 751 -14.080 12.955 0.593 744 HZ2 LYS 751 HZ2 LYS 751 -13.328 13.955 1.746 745 HZ3 LYS 751 HZ3 LYS 751 -12.371 13.124 0.602 746 H ASP 752 H ASP 752 -11.659 6.276 2.525 747 HA ASP 752 HA ASP 752 -13.812 5.890 4.497 748 HB2 ASP 752 HB2 ASP 752 -14.891 5.455 2.561 749 HB3 ASP 752 HB3 ASP 752 -13.392 5.223 1.675 750 H CYS 753 H CYS 753 -11.071 4.160 3.044 751 HA CYS 753 HA CYS 753 -11.347 1.938 4.890 752 HB2 CYS 753 HB2 CYS 753 -9.274 2.581 2.783 753 HB3 CYS 753 HB3 CYS 753 -9.292 1.108 3.748 754 HG CYS 753 HG CYS 753 -11.699 1.846 1.882 755 H PHE 754 H PHE 754 -9.117 4.665 4.345 756 HA PHE 754 HA PHE 754 -7.416 3.850 6.554 757 HB2 PHE 754 HB2 PHE 754 -7.465 6.268 4.745 758 HB3 PHE 754 HB3 PHE 754 -6.291 6.064 6.037 759 HD1 PHE 754 HD2 PHE 754 -7.344 2.915 4.621 760 HD2 PHE 754 HD1 PHE 754 -4.640 6.201 4.043 761 HE1 PHE 754 HE2 PHE 754 -5.957 1.517 3.132 762 HE2 PHE 754 HE1 PHE 754 -3.270 4.805 2.548 763 HZ PHE 754 HZ PHE 754 -3.914 2.461 2.091 764 H LYS 755 H LYS 755 -7.709 7.197 6.651 765 HA LYS 755 HA LYS 755 -9.803 7.281 8.694 766 HB2 LYS 755 HB2 LYS 755 -7.824 6.607 9.946 767 HB3 LYS 755 HB3 LYS 755 -6.929 7.974 9.293 768 HG2 LYS 755 HG2 LYS 755 -8.449 9.543 10.409 769 HG3 LYS 755 HG3 LYS 755 -9.448 8.204 10.973 770 HD2 LYS 755 HD2 LYS 755 -8.161 8.153 12.816 771 HD3 LYS 755 HD3 LYS 755 -6.876 7.519 11.795 772 HE2 LYS 755 HE2 LYS 755 -7.361 10.389 12.616 773 HE3 LYS 755 HE3 LYS 755 -5.918 9.410 12.880 774 HZ1 LYS 755 HZ1 LYS 755 -5.182 10.474 11.050 775 HZ2 LYS 755 HZ2 LYS 755 -6.119 9.342 10.208 776 HZ3 LYS 755 HZ3 LYS 755 -6.760 10.895 10.514 777 H SER 756 H SER 756 -7.411 9.691 8.911 778 HA SER 756 HA SER 756 -9.236 11.694 7.930 779 HB2 SER 756 HB2 SER 756 -6.362 12.221 8.635 780 HB3 SER 756 HB3 SER 756 -7.764 13.266 8.852 781 HG SER 756 HG SER 756 -8.148 12.333 10.708 782 H LEU 757 H LEU 757 -8.403 9.797 5.968 783 HA LEU 757 HA LEU 757 -6.474 11.194 4.274 784 HB2 LEU 757 HB2 LEU 757 -7.779 8.512 4.303 785 HB3 LEU 757 HB3 LEU 757 -7.268 9.147 2.745 786 HG LEU 757 HG LEU 757 -5.591 7.715 4.150 787 HD11 LEU 757 HD11 LEU 757 -4.792 8.635 2.169 788 HD12 LEU 757 HD12 LEU 757 -5.029 10.289 2.731 789 HD13 LEU 757 HD13 LEU 757 -3.713 9.314 3.385 790 HD21 LEU 757 HD21 LEU 757 -4.376 8.757 5.842 791 HD22 LEU 757 HD22 LEU 757 -4.897 10.372 5.359 792 HD23 LEU 757 HD23 LEU 757 -6.023 9.287 6.174 793 H ASP 758 H ASP 758 -7.160 11.122 1.846 794 HA ASP 758 HA ASP 758 -9.876 11.510 1.146 795 HB2 ASP 758 HB2 ASP 758 -8.927 13.715 2.465 796 HB3 ASP 758 HB3 ASP 758 -8.555 14.125 0.791 797 H THR 759 H THR 759 -7.797 10.002 0.218 798 HA THR 759 HA THR 759 -7.652 10.875 -2.553 799 HB THR 759 HB THR 759 -5.632 11.871 -1.423 800 HG1 THR 759 HG1 THR 759 -4.909 11.577 -3.359 801 HG21 THR 759 HG21 THR 759 -4.334 9.211 -1.306 802 HG22 THR 759 HG22 THR 759 -4.164 10.596 -0.230 803 HG23 THR 759 HG23 THR 759 -5.537 9.510 -0.049 804 H THR 760 H THR 760 -5.670 9.066 -3.319 805 HA THR 760 HA THR 760 -6.345 6.417 -2.339 806 HB THR 760 HB THR 760 -7.193 5.564 -4.454 807 HG1 THR 760 HG1 THR 760 -7.212 6.720 -6.208 808 HG21 THR 760 HG21 THR 760 -8.750 6.610 -2.738 809 HG22 THR 760 HG22 THR 760 -8.785 8.033 -3.778 810 HG23 THR 760 HG23 THR 760 -9.384 6.488 -4.377 811 H LEU 761 H LEU 761 -5.171 4.725 -3.696 812 HA LEU 761 HA LEU 761 -2.425 5.295 -3.836 813 HB2 LEU 761 HB2 LEU 761 -4.070 3.119 -5.178 814 HB3 LEU 761 HB3 LEU 761 -2.319 3.149 -5.183 815 HG LEU 761 HG LEU 761 -3.472 1.680 -3.410 816 HD11 LEU 761 HD11 LEU 761 -1.191 1.987 -3.114 817 HD12 LEU 761 HD12 LEU 761 -1.363 3.727 -2.859 818 HD13 LEU 761 HD13 LEU 761 -1.857 2.600 -1.601 819 HD21 LEU 761 HD21 LEU 761 -5.160 3.309 -2.659 820 HD22 LEU 761 HD22 LEU 761 -4.110 2.829 -1.333 821 HD23 LEU 761 HD23 LEU 761 -3.877 4.390 -2.112 822 H GLN 762 H GLN 762 -2.310 7.283 -4.991 823 HA GLN 762 HA GLN 762 -3.335 7.609 -7.622 824 HB2 GLN 762 HB2 GLN 762 -1.969 9.186 -5.639 825 HB3 GLN 762 HB3 GLN 762 -1.252 9.464 -7.222 826 HG2 GLN 762 HG2 GLN 762 -4.088 9.418 -7.558 827 HG3 GLN 762 HG3 GLN 762 -3.732 10.458 -6.180 828 HE21 GLN 762 HE21 GLN 762 -1.592 11.909 -6.739 829 HE22 GLN 762 HE22 GLN 762 -1.700 12.694 -8.237 830 H PHE 763 H PHE 763 0.090 7.535 -6.559 831 HA PHE 763 HA PHE 763 0.705 6.142 -9.097 832 HB2 PHE 763 HB2 PHE 763 2.076 8.621 -8.039 833 HB3 PHE 763 HB3 PHE 763 2.709 7.630 -9.354 834 HD1 PHE 763 HD1 PHE 763 1.240 7.264 -11.418 835 HD2 PHE 763 HD2 PHE 763 0.402 10.247 -8.443 836 HE1 PHE 763 HE1 PHE 763 -0.231 8.452 -13.023 837 HE2 PHE 763 HE2 PHE 763 -1.070 11.433 -10.047 838 HZ PHE 763 HZ PHE 763 -1.387 10.536 -12.337 839 HA PRO 764 HA PRO 764 3.391 3.705 -6.581 840 HB2 PRO 764 HB2 PRO 764 5.031 2.682 -8.487 841 HB3 PRO 764 HB3 PRO 764 3.325 2.219 -8.361 842 HG2 PRO 764 HG2 PRO 764 4.636 4.099 -10.238 843 HG3 PRO 764 HG3 PRO 764 3.313 2.959 -10.515 844 HD2 PRO 764 HD2 PRO 764 2.974 5.678 -10.127 845 HD3 PRO 764 HD3 PRO 764 1.714 4.452 -9.858 846 H PHE 765 H PHE 765 6.129 3.212 -6.939 847 HA PHE 765 HA PHE 765 7.280 5.927 -6.802 848 HB2 PHE 765 HB2 PHE 765 8.504 5.413 -4.865 849 HB3 PHE 765 HB3 PHE 765 6.919 4.703 -4.566 850 HD1 PHE 765 HD1 PHE 765 6.585 2.225 -5.141 851 HD2 PHE 765 HD2 PHE 765 10.443 4.077 -4.812 852 HE1 PHE 765 HE1 PHE 765 7.626 -0.005 -4.836 853 HE2 PHE 765 HE2 PHE 765 11.488 1.848 -4.515 854 HZ PHE 765 HZ PHE 765 10.079 -0.190 -4.524 855 H LYS 766 H LYS 766 7.459 2.823 -8.173 856 HA LYS 766 HA LYS 766 10.292 3.095 -8.879 857 HB2 LYS 766 HB2 LYS 766 8.296 0.925 -9.547 858 HB3 LYS 766 HB3 LYS 766 10.024 0.880 -9.893 859 HG2 LYS 766 HG2 LYS 766 10.129 1.467 -7.263 860 HG3 LYS 766 HG3 LYS 766 8.610 0.581 -7.288 861 HD2 LYS 766 HD2 LYS 766 10.935 -0.582 -8.752 862 HD3 LYS 766 HD3 LYS 766 10.935 -0.669 -6.993 863 HE2 LYS 766 HE2 LYS 766 8.337 -1.413 -7.690 864 HE3 LYS 766 HE3 LYS 766 9.340 -2.187 -8.919 865 HZ1 LYS 766 HZ1 LYS 766 9.098 -2.767 -6.097 866 HZ2 LYS 766 HZ2 LYS 766 9.693 -3.741 -7.374 867 HZ3 LYS 766 HZ3 LYS 766 10.719 -2.618 -6.624 868 H GLU 767 H GLU 767 7.086 3.159 -10.358 869 HA GLU 767 HA GLU 767 6.510 3.417 -12.624 870 HB2 GLU 767 HB2 GLU 767 7.222 5.782 -11.163 871 HB3 GLU 767 HB3 GLU 767 7.568 6.033 -12.874 872 HG2 GLU 767 HG2 GLU 767 5.223 4.978 -13.266 873 HG3 GLU 767 HG3 GLU 767 4.947 5.332 -11.569 874 H1 ASP 338 H1 ASP 338 4.864 -0.035 15.879 875 H2 ASP 338 H2 ASP 338 4.677 -1.670 16.410 876 H3 ASP 338 H3 ASP 338 6.039 -0.938 15.700 877 HA ASP 338 HA ASP 338 5.309 -1.145 18.472 878 HB2 ASP 338 HB2 ASP 338 7.819 -0.533 18.577 879 HB3 ASP 338 HB3 ASP 338 7.393 -2.044 17.775 880 H THR 339 H THR 339 7.443 1.301 17.158 881 HA THR 339 HA THR 339 6.195 3.366 18.825 882 HB THR 339 HB THR 339 8.204 4.679 18.159 883 HG1 THR 339 HG1 THR 339 8.869 2.275 16.778 884 HG21 THR 339 HG21 THR 339 9.342 3.675 19.828 885 HG22 THR 339 HG22 THR 339 8.079 2.441 19.830 886 HG23 THR 339 HG23 THR 339 9.547 2.203 18.885 887 H GLU 340 H GLU 340 7.692 3.594 15.634 888 HA GLU 340 HA GLU 340 5.209 4.676 14.486 889 HB2 GLU 340 HB2 GLU 340 6.930 6.487 15.392 890 HB3 GLU 340 HB3 GLU 340 7.750 6.135 13.866 891 HG2 GLU 340 HG2 GLU 340 4.823 6.480 13.637 892 HG3 GLU 340 HG3 GLU 340 5.692 7.932 14.123 893 H VAL 341 H VAL 341 5.011 2.880 13.154 894 HA VAL 341 HA VAL 341 6.932 2.817 10.937 895 HB VAL 341 HB VAL 341 6.496 0.178 11.061 896 HG11 VAL 341 HG11 VAL 341 8.625 0.492 12.844 897 HG12 VAL 341 HG12 VAL 341 8.731 0.464 11.083 898 HG13 VAL 341 HG13 VAL 341 8.598 2.001 11.934 899 HG21 VAL 341 HG21 VAL 341 5.143 0.357 13.143 900 HG22 VAL 341 HG22 VAL 341 6.598 -0.601 13.381 901 HG23 VAL 341 HG23 VAL 341 6.533 1.060 13.970 902 H PTR 342 H PTR 342 3.942 1.211 12.086 903 HA PTR 342 HA PTR 342 2.108 2.289 10.365 904 HB2 PTR 342 HB2 PTR 342 2.016 0.466 8.542 905 HB3 PTR 342 HB3 PTR 342 3.252 1.706 8.387 906 HD1 PTR 342 HD1 PTR 342 2.757 -1.634 10.007 907 HD2 PTR 342 HD2 PTR 342 5.453 1.016 7.982 908 HE1 PTR 342 HE1 PTR 342 4.499 -3.385 10.037 909 HE2 PTR 342 HE2 PTR 342 7.203 -0.736 8.024 910 H GLU 343 H GLU 343 2.468 0.846 12.888 911 HA GLU 343 HA GLU 343 1.263 -1.695 12.909 912 HB2 GLU 343 HB2 GLU 343 0.656 -0.939 15.346 913 HB3 GLU 343 HB3 GLU 343 2.342 -1.164 14.887 914 HG2 GLU 343 HG2 GLU 343 1.076 1.536 14.516 915 HG3 GLU 343 HG3 GLU 343 1.593 1.047 16.126 916 H SER 344 H SER 344 -0.320 -0.394 11.103 917 HA SER 344 HA SER 344 -2.555 -0.203 10.548 918 HB2 SER 344 HB2 SER 344 -2.495 -1.979 12.730 919 HB3 SER 344 HB3 SER 344 -3.790 -0.843 13.085 920 HG SER 344 HG SER 344 -4.736 -1.339 11.131 921 HA PRO 345 HA PRO 345 -2.329 3.870 13.051 922 HB2 PRO 345 HB2 PRO 345 -2.538 5.320 10.627 923 HB3 PRO 345 HB3 PRO 345 -1.076 5.096 11.604 924 HG2 PRO 345 HG2 PRO 345 -1.959 3.676 9.164 925 HG3 PRO 345 HG3 PRO 345 -0.323 4.048 9.733 926 HD2 PRO 345 HD2 PRO 345 -1.338 1.546 9.890 927 HD3 PRO 345 HD3 PRO 345 -0.235 2.186 11.131 928 H PTR 346 H PTR 346 -4.341 2.444 10.609 929 HA PTR 346 HA PTR 346 -6.654 4.027 11.564 930 HB2 PTR 346 HB2 PTR 346 -6.281 2.918 8.769 931 HB3 PTR 346 HB3 PTR 346 -7.590 3.958 9.336 932 HD1 PTR 346 HD1 PTR 346 -5.289 4.327 7.101 933 HD2 PTR 346 HD2 PTR 346 -5.962 5.801 11.083 934 HE1 PTR 346 HE1 PTR 346 -3.925 6.351 6.602 935 HE2 PTR 346 HE2 PTR 346 -4.607 7.803 10.582 936 H ALA 347 H ALA 347 -7.561 1.797 9.263 937 HA ALA 347 HA ALA 347 -8.665 -0.212 9.327 938 HB1 ALA 347 HB1 ALA 347 -7.205 -1.707 10.140 939 HB2 ALA 347 HB2 ALA 347 -7.901 -1.428 11.734 940 HB3 ALA 347 HB3 ALA 347 -6.489 -0.509 11.213 941 H ASP 348 H ASP 348 -8.416 1.053 12.661 942 HA ASP 348 HA ASP 348 -11.358 1.130 12.776 943 HB2 ASP 348 HB2 ASP 348 -9.587 -0.408 14.680 944 HB3 ASP 348 HB3 ASP 348 -11.244 0.048 15.066 945 HA PRO 349 HA PRO 349 -9.395 4.887 14.645 946 HB2 PRO 349 HB2 PRO 349 -11.587 6.327 13.341 947 HB3 PRO 349 HB3 PRO 349 -9.839 6.521 13.133 948 HG2 PRO 349 HG2 PRO 349 -11.469 5.483 11.232 949 HG3 PRO 349 HG3 PRO 349 -9.753 5.069 11.390 950 HD2 PRO 349 HD2 PRO 349 -12.159 3.490 12.226 951 HD3 PRO 349 HD3 PRO 349 -10.611 2.922 11.556 952 H GLU 350 H GLU 350 -10.739 3.247 16.241 953 HA GLU 350 HA GLU 350 -12.035 3.168 18.132 954 HB2 GLU 350 HB2 GLU 350 -12.058 6.143 17.612 955 HB3 GLU 350 HB3 GLU 350 -12.934 5.431 18.964 956 HG2 GLU 350 HG2 GLU 350 -11.005 4.817 20.077 957 HG3 GLU 350 HG3 GLU 350 -10.081 4.626 18.589 Start of MODEL 17 1 H1 GLY 661 H1 GLY 661 4.225 -13.863 -11.481 2 H2 GLY 661 H2 GLY 661 4.720 -12.978 -12.858 3 H3 GLY 661 H3 GLY 661 5.072 -14.637 -12.744 4 HA2 GLY 661 HA2 GLY 661 3.253 -14.507 -14.216 5 HA3 GLY 661 HA3 GLY 661 2.595 -15.034 -12.666 6 H HIS 662 H HIS 662 0.657 -14.097 -12.430 7 HA HIS 662 HA HIS 662 0.454 -11.189 -12.370 8 HB2 HIS 662 HB2 HIS 662 -0.013 -11.944 -14.763 9 HB3 HIS 662 HB3 HIS 662 -1.436 -12.763 -14.129 10 HD1 HIS 662 HD1 HIS 662 -2.858 -11.000 -12.417 11 HD2 HIS 662 HD2 HIS 662 -0.747 -9.426 -15.653 12 HE1 HIS 662 HE1 HIS 662 -3.894 -8.724 -12.922 13 HE2 HIS 662 HE2 HIS 662 -2.617 -7.761 -14.900 14 H MET 663 H MET 663 0.346 -12.931 -10.244 15 HA MET 663 HA MET 663 -2.516 -12.764 -9.473 16 HB2 MET 663 HB2 MET 663 -0.661 -15.118 -8.981 17 HB3 MET 663 HB3 MET 663 -2.257 -14.929 -8.259 18 HG2 MET 663 HG2 MET 663 -2.976 -16.081 -10.098 19 HG3 MET 663 HG3 MET 663 -2.820 -14.535 -10.925 20 HE1 MET 663 HE1 MET 663 -1.459 -18.019 -12.707 21 HE2 MET 663 HE2 MET 663 -2.841 -17.538 -11.730 22 HE3 MET 663 HE3 MET 663 -2.478 -16.683 -13.234 23 H GLN 664 H GLN 664 0.221 -14.088 -7.615 24 HA GLN 664 HA GLN 664 -0.189 -11.905 -5.671 25 HB2 GLN 664 HB2 GLN 664 0.262 -14.743 -5.380 26 HB3 GLN 664 HB3 GLN 664 1.532 -13.840 -4.549 27 HG2 GLN 664 HG2 GLN 664 -0.667 -12.381 -3.841 28 HG3 GLN 664 HG3 GLN 664 -1.368 -13.993 -3.956 29 HE21 GLN 664 HE21 GLN 664 0.463 -15.692 -2.924 30 HE22 GLN 664 HE22 GLN 664 0.922 -15.240 -1.354 31 H ASP 665 H ASP 665 1.647 -12.338 -8.238 32 HA ASP 665 HA ASP 665 4.311 -11.988 -7.318 33 HB2 ASP 665 HB2 ASP 665 3.539 -10.720 -9.880 34 HB3 ASP 665 HB3 ASP 665 4.850 -11.841 -9.528 35 H LEU 666 H LEU 666 5.210 -10.259 -6.373 36 HA LEU 666 HA LEU 666 3.804 -7.674 -6.595 37 HB2 LEU 666 HB2 LEU 666 5.741 -8.433 -4.416 38 HB3 LEU 666 HB3 LEU 666 4.536 -7.146 -4.413 39 HG LEU 666 HG LEU 666 3.921 -10.115 -4.496 40 HD11 LEU 666 HD11 LEU 666 4.283 -9.990 -2.272 41 HD12 LEU 666 HD12 LEU 666 4.386 -8.231 -2.304 42 HD13 LEU 666 HD13 LEU 666 2.812 -9.020 -2.205 43 HD21 LEU 666 HD21 LEU 666 2.048 -9.222 -5.488 44 HD22 LEU 666 HD22 LEU 666 1.610 -8.919 -3.808 45 HD23 LEU 666 HD23 LEU 666 2.307 -7.625 -4.786 46 H SER 667 H SER 667 6.952 -9.233 -6.710 47 HA SER 667 HA SER 667 8.520 -6.890 -7.028 48 HB2 SER 667 HB2 SER 667 9.043 -9.748 -7.843 49 HB3 SER 667 HB3 SER 667 10.256 -8.468 -7.817 50 HG SER 667 HG SER 667 10.400 -9.399 -5.833 51 H VAL 668 H VAL 668 6.205 -8.019 -9.088 52 HA VAL 668 HA VAL 668 7.687 -7.335 -11.536 53 HB VAL 668 HB VAL 668 5.905 -8.361 -12.757 54 HG11 VAL 668 HG11 VAL 668 6.916 -10.297 -12.194 55 HG12 VAL 668 HG12 VAL 668 7.224 -9.731 -10.553 56 HG13 VAL 668 HG13 VAL 668 5.683 -10.490 -10.949 57 HG21 VAL 668 HG21 VAL 668 3.952 -7.549 -11.633 58 HG22 VAL 668 HG22 VAL 668 3.916 -9.303 -11.458 59 HG23 VAL 668 HG23 VAL 668 4.436 -8.294 -10.109 60 H HIS 669 H HIS 669 6.240 -5.594 -9.279 61 HA HIS 669 HA HIS 669 4.902 -3.769 -11.196 62 HB2 HIS 669 HB2 HIS 669 4.470 -3.768 -8.213 63 HB3 HIS 669 HB3 HIS 669 3.466 -3.034 -9.461 64 HD1 HIS 669 HD1 HIS 669 2.737 -5.097 -11.357 65 HD2 HIS 669 HD2 HIS 669 3.292 -6.065 -7.348 66 HE1 HIS 669 HE1 HIS 669 1.517 -7.290 -10.978 67 HE2 HIS 669 HE2 HIS 669 1.890 -7.925 -8.537 68 H LEU 670 H LEU 670 4.778 -1.534 -9.629 69 HA LEU 670 HA LEU 670 7.597 -0.854 -9.125 70 HB2 LEU 670 HB2 LEU 670 6.778 1.533 -9.869 71 HB3 LEU 670 HB3 LEU 670 7.322 0.375 -11.056 72 HG LEU 670 HG LEU 670 4.458 0.965 -10.308 73 HD11 LEU 670 HD11 LEU 670 5.753 1.321 -12.992 74 HD12 LEU 670 HD12 LEU 670 4.304 2.094 -12.353 75 HD13 LEU 670 HD13 LEU 670 5.892 2.562 -11.749 76 HD21 LEU 670 HD21 LEU 670 5.665 -1.313 -11.693 77 HD22 LEU 670 HD22 LEU 670 4.005 -1.102 -11.123 78 HD23 LEU 670 HD23 LEU 670 4.490 -0.469 -12.695 79 H TRP 671 H TRP 671 4.622 -1.224 -7.816 80 HA TRP 671 HA TRP 671 5.025 0.978 -5.941 81 HB2 TRP 671 HB2 TRP 671 2.669 0.306 -5.151 82 HB3 TRP 671 HB3 TRP 671 2.813 1.116 -6.707 83 HD1 TRP 671 HD1 TRP 671 1.951 -0.128 -8.776 84 HE1 TRP 671 HE1 TRP 671 0.981 -2.483 -9.200 85 HE3 TRP 671 HE3 TRP 671 2.902 -2.306 -4.255 86 HZ2 TRP 671 HZ2 TRP 671 0.661 -4.951 -7.808 87 HZ3 TRP 671 HZ3 TRP 671 2.255 -4.658 -3.834 88 HH2 TRP 671 HH2 TRP 671 1.132 -5.983 -5.605 89 H TYR 672 H TYR 672 5.776 -2.197 -6.307 90 HA TYR 672 HA TYR 672 5.384 -2.919 -3.482 91 HB2 TYR 672 HB2 TYR 672 4.767 -4.612 -5.147 92 HB3 TYR 672 HB3 TYR 672 6.404 -4.572 -5.805 93 HD1 TYR 672 HD2 TYR 672 4.920 -4.695 -2.352 94 HD2 TYR 672 HD1 TYR 672 7.681 -6.404 -5.164 95 HE1 TYR 672 HE2 TYR 672 5.665 -6.325 -0.635 96 HE2 TYR 672 HE1 TYR 672 8.420 -8.035 -3.451 97 HH TYR 672 HH TYR 672 7.138 -9.040 -1.174 98 H ALA 673 H ALA 673 6.917 -2.418 -2.080 99 HA ALA 673 HA ALA 673 9.704 -2.122 -3.031 100 HB1 ALA 673 HB1 ALA 673 10.074 -0.805 -1.025 101 HB2 ALA 673 HB2 ALA 673 8.468 -1.209 -0.419 102 HB3 ALA 673 HB3 ALA 673 8.643 -0.194 -1.853 103 H GLY 674 H GLY 674 7.635 -4.143 -1.247 104 HA2 GLY 674 HA2 GLY 674 7.956 -5.935 0.160 105 HA3 GLY 674 HA3 GLY 674 9.299 -6.282 -0.911 106 HA PRO 675 HA PRO 675 11.712 -6.043 2.798 107 HB2 PRO 675 HB2 PRO 675 14.195 -5.972 1.570 108 HB3 PRO 675 HB3 PRO 675 13.257 -7.448 1.863 109 HG2 PRO 675 HG2 PRO 675 13.547 -5.852 -0.628 110 HG3 PRO 675 HG3 PRO 675 13.433 -7.608 -0.413 111 HD2 PRO 675 HD2 PRO 675 11.329 -6.100 -1.267 112 HD3 PRO 675 HD3 PRO 675 11.117 -7.583 -0.309 113 H MET 676 H MET 676 10.596 -3.692 2.511 114 HA MET 676 HA MET 676 12.823 -1.730 2.521 115 HB2 MET 676 HB2 MET 676 11.183 -1.395 0.660 116 HB3 MET 676 HB3 MET 676 9.916 -1.188 1.867 117 HG2 MET 676 HG2 MET 676 10.954 0.990 1.026 118 HG3 MET 676 HG3 MET 676 10.955 0.779 2.769 119 HE1 MET 676 HE1 MET 676 13.255 2.134 0.047 120 HE2 MET 676 HE2 MET 676 14.365 0.790 -0.204 121 HE3 MET 676 HE3 MET 676 12.632 0.572 -0.480 122 H GLU 677 H GLU 677 12.357 0.187 3.914 123 HA GLU 677 HA GLU 677 11.014 -0.631 6.418 124 HB2 GLU 677 HB2 GLU 677 12.597 1.093 7.448 125 HB3 GLU 677 HB3 GLU 677 13.326 -0.404 6.865 126 HG2 GLU 677 HG2 GLU 677 14.325 0.614 5.051 127 HG3 GLU 677 HG3 GLU 677 13.091 1.864 4.947 128 H ARG 678 H ARG 678 10.134 1.234 7.712 129 HA ARG 678 HA ARG 678 8.232 2.676 6.291 130 HB2 ARG 678 HB2 ARG 678 8.408 2.289 8.839 131 HB3 ARG 678 HB3 ARG 678 9.413 3.738 8.853 132 HG2 ARG 678 HG2 ARG 678 7.322 4.585 7.312 133 HG3 ARG 678 HG3 ARG 678 6.495 3.471 8.398 134 HD2 ARG 678 HD2 ARG 678 8.130 4.840 10.132 135 HD3 ARG 678 HD3 ARG 678 7.725 6.087 8.963 136 HE ARG 678 HE ARG 678 5.735 4.541 10.565 137 HH11 ARG 678 HH21 ARG 678 6.636 7.289 8.638 138 HH12 ARG 678 HH22 ARG 678 5.204 8.177 9.019 139 HH21 ARG 678 HH11 ARG 678 3.878 5.686 11.029 140 HH22 ARG 678 HH12 ARG 678 3.665 7.285 10.377 141 H ALA 679 H ALA 679 11.262 3.991 7.653 142 HA ALA 679 HA ALA 679 11.057 6.515 6.423 143 HB1 ALA 679 HB1 ALA 679 13.760 6.134 6.709 144 HB2 ALA 679 HB2 ALA 679 13.104 5.003 7.893 145 HB3 ALA 679 HB3 ALA 679 12.685 6.712 7.980 146 H GLY 680 H GLY 680 12.282 3.434 5.294 147 HA2 GLY 680 HA2 GLY 680 13.617 4.488 2.969 148 HA3 GLY 680 HA3 GLY 680 13.223 2.796 3.264 149 H ALA 681 H ALA 681 10.485 3.006 3.683 150 HA ALA 681 HA ALA 681 9.472 2.930 1.054 151 HB1 ALA 681 HB1 ALA 681 8.108 3.170 3.743 152 HB2 ALA 681 HB2 ALA 681 8.321 1.717 2.766 153 HB3 ALA 681 HB3 ALA 681 7.219 2.985 2.230 154 H GLU 682 H GLU 682 9.068 5.422 3.598 155 HA GLU 682 HA GLU 682 7.690 7.202 1.803 156 HB2 GLU 682 HB2 GLU 682 7.822 8.822 3.649 157 HB3 GLU 682 HB3 GLU 682 7.222 7.261 4.194 158 HG2 GLU 682 HG2 GLU 682 9.673 6.734 4.794 159 HG3 GLU 682 HG3 GLU 682 9.958 8.453 4.606 160 H SER 683 H SER 683 10.975 6.537 2.425 161 HA SER 683 HA SER 683 12.149 9.036 1.975 162 HB2 SER 683 HB2 SER 683 13.043 6.210 1.620 163 HB3 SER 683 HB3 SER 683 14.035 7.498 0.942 164 HG SER 683 HG SER 683 13.221 7.072 3.634 165 H ILE 684 H ILE 684 11.032 6.556 -0.257 166 HA ILE 684 HA ILE 684 11.872 8.055 -2.596 167 HB ILE 684 HB ILE 684 9.924 5.753 -2.600 168 HG12 ILE 684 HG12 ILE 684 12.639 4.882 -3.012 169 HG13 ILE 684 HG13 ILE 684 12.533 5.701 -1.453 170 HG21 ILE 684 HG21 ILE 684 10.166 6.115 -4.814 171 HG22 ILE 684 HG22 ILE 684 11.479 7.262 -4.551 172 HG23 ILE 684 HG23 ILE 684 11.822 5.536 -4.647 173 HD11 ILE 684 HD11 ILE 684 11.988 3.422 -1.017 174 HD12 ILE 684 HD12 ILE 684 10.453 4.288 -1.004 175 HD13 ILE 684 HD13 ILE 684 10.915 3.334 -2.414 176 H LEU 685 H LEU 685 8.786 7.127 -1.103 177 HA LEU 685 HA LEU 685 7.074 8.528 -2.822 178 HB2 LEU 685 HB2 LEU 685 6.927 7.346 -0.109 179 HB3 LEU 685 HB3 LEU 685 5.716 8.567 -0.475 180 HG LEU 685 HG LEU 685 4.862 7.327 -2.311 181 HD11 LEU 685 HD11 LEU 685 7.475 5.840 -2.113 182 HD12 LEU 685 HD12 LEU 685 6.080 5.103 -2.902 183 HD13 LEU 685 HD13 LEU 685 6.748 6.610 -3.522 184 HD21 LEU 685 HD21 LEU 685 4.702 4.930 -1.277 185 HD22 LEU 685 HD22 LEU 685 5.586 5.640 0.074 186 HD23 LEU 685 HD23 LEU 685 4.011 6.287 -0.390 187 H ALA 686 H ALA 686 8.608 9.589 0.239 188 HA ALA 686 HA ALA 686 7.342 12.106 0.365 189 HB1 ALA 686 HB1 ALA 686 8.606 11.137 2.232 190 HB2 ALA 686 HB2 ALA 686 9.188 12.754 1.838 191 HB3 ALA 686 HB3 ALA 686 10.107 11.337 1.325 192 H ASN 687 H ASN 687 10.261 11.008 -1.286 193 HA ASN 687 HA ASN 687 10.980 13.617 -2.272 194 HB2 ASN 687 HB2 ASN 687 12.524 11.599 -1.894 195 HB3 ASN 687 HB3 ASN 687 11.880 10.970 -3.405 196 HD21 ASN 687 HD21 ASN 687 11.629 13.601 -4.724 197 HD22 ASN 687 HD22 ASN 687 13.216 14.125 -5.026 198 H ARG 688 H ARG 688 8.803 11.126 -3.245 199 HA ARG 688 HA ARG 688 8.653 11.997 -6.028 200 HB2 ARG 688 HB2 ARG 688 7.849 9.674 -4.496 201 HB3 ARG 688 HB3 ARG 688 6.494 10.285 -5.434 202 HG2 ARG 688 HG2 ARG 688 7.424 9.014 -7.092 203 HG3 ARG 688 HG3 ARG 688 8.445 10.435 -7.312 204 HD2 ARG 688 HD2 ARG 688 10.289 9.397 -6.454 205 HD3 ARG 688 HD3 ARG 688 9.365 8.565 -5.218 206 HE ARG 688 HE ARG 688 9.505 6.718 -6.592 207 HH11 ARG 688 HH21 ARG 688 9.339 9.542 -8.574 208 HH12 ARG 688 HH22 ARG 688 9.357 8.648 -10.053 209 HH21 ARG 688 HH11 ARG 688 9.562 5.583 -8.482 210 HH22 ARG 688 HH12 ARG 688 9.473 6.409 -10.033 211 H SER 689 H SER 689 6.379 12.407 -6.924 212 HA SER 689 HA SER 689 5.283 14.708 -5.666 213 HB2 SER 689 HB2 SER 689 3.912 13.053 -7.788 214 HB3 SER 689 HB3 SER 689 3.742 14.779 -7.480 215 HG SER 689 HG SER 689 5.164 14.182 -9.273 216 H ASP 690 H ASP 690 2.885 14.908 -5.188 217 HA ASP 690 HA ASP 690 2.181 13.101 -3.107 218 HB2 ASP 690 HB2 ASP 690 1.245 15.617 -4.114 219 HB3 ASP 690 HB3 ASP 690 -0.124 14.526 -3.910 220 H GLY 691 H GLY 691 0.765 11.437 -3.042 221 HA2 GLY 691 HA2 GLY 691 -1.097 10.169 -3.926 222 HA3 GLY 691 HA3 GLY 691 -0.641 10.704 -5.542 223 H THR 692 H THR 692 2.240 10.289 -4.628 224 HA THR 692 HA THR 692 2.703 7.791 -5.829 225 HB THR 692 HB THR 692 4.555 9.085 -3.815 226 HG1 THR 692 HG1 THR 692 4.201 10.767 -5.123 227 HG21 THR 692 HG21 THR 692 5.295 7.817 -6.423 228 HG22 THR 692 HG22 THR 692 6.238 7.952 -4.941 229 HG23 THR 692 HG23 THR 692 4.914 6.790 -5.040 230 H PHE 693 H PHE 693 2.666 5.736 -5.051 231 HA PHE 693 HA PHE 693 2.623 5.374 -2.126 232 HB2 PHE 693 HB2 PHE 693 0.699 3.919 -2.243 233 HB3 PHE 693 HB3 PHE 693 0.287 5.463 -2.985 234 HD1 PHE 693 HD2 PHE 693 1.208 1.937 -3.689 235 HD2 PHE 693 HD1 PHE 693 -0.197 5.647 -5.325 236 HE1 PHE 693 HE2 PHE 693 0.611 0.782 -5.800 237 HE2 PHE 693 HE1 PHE 693 -0.797 4.488 -7.436 238 HZ PHE 693 HZ PHE 693 -0.389 2.058 -7.673 239 H LEU 694 H LEU 694 2.907 3.150 -1.444 240 HA LEU 694 HA LEU 694 3.869 1.216 -3.341 241 HB2 LEU 694 HB2 LEU 694 6.156 1.149 -2.788 242 HB3 LEU 694 HB3 LEU 694 5.812 2.866 -2.983 243 HG LEU 694 HG LEU 694 5.312 2.768 -0.402 244 HD11 LEU 694 HD11 LEU 694 7.317 1.040 0.334 245 HD12 LEU 694 HD12 LEU 694 5.599 0.658 0.414 246 HD13 LEU 694 HD13 LEU 694 6.552 0.152 -0.981 247 HD21 LEU 694 HD21 LEU 694 7.097 4.102 -1.321 248 HD22 LEU 694 HD22 LEU 694 7.760 3.174 0.017 249 HD23 LEU 694 HD23 LEU 694 8.071 2.669 -1.641 250 H VAL 695 H VAL 695 4.620 -0.772 -2.274 251 HA VAL 695 HA VAL 695 3.532 -1.061 0.463 252 HB VAL 695 HB VAL 695 3.242 -3.109 -1.747 253 HG11 VAL 695 HG11 VAL 695 2.970 -4.411 0.110 254 HG12 VAL 695 HG12 VAL 695 2.715 -3.025 1.163 255 HG13 VAL 695 HG13 VAL 695 1.384 -3.646 0.193 256 HG21 VAL 695 HG21 VAL 695 1.774 -1.372 -2.381 257 HG22 VAL 695 HG22 VAL 695 0.754 -2.432 -1.407 258 HG23 VAL 695 HG23 VAL 695 1.406 -0.951 -0.707 259 H ARG 696 H ARG 696 4.765 -2.206 1.860 260 HA ARG 696 HA ARG 696 7.248 -3.414 0.773 261 HB2 ARG 696 HB2 ARG 696 8.242 -2.887 3.020 262 HB3 ARG 696 HB3 ARG 696 7.826 -1.471 2.057 263 HG2 ARG 696 HG2 ARG 696 5.672 -1.297 3.309 264 HG3 ARG 696 HG3 ARG 696 6.183 -2.645 4.323 265 HD2 ARG 696 HD2 ARG 696 7.620 0.015 4.040 266 HD3 ARG 696 HD3 ARG 696 6.665 -0.502 5.426 267 HE ARG 696 HE ARG 696 9.115 -1.959 4.572 268 HH11 ARG 696 HH21 ARG 696 7.260 -0.341 7.013 269 HH12 ARG 696 HH22 ARG 696 8.202 -0.996 8.308 270 HH21 ARG 696 HH11 ARG 696 10.332 -2.713 6.229 271 HH22 ARG 696 HH12 ARG 696 9.929 -2.323 7.880 272 H GLN 697 H GLN 697 8.188 -5.102 2.157 273 HA GLN 697 HA GLN 697 6.096 -6.797 3.396 274 HB2 GLN 697 HB2 GLN 697 6.767 -7.802 1.305 275 HB3 GLN 697 HB3 GLN 697 8.473 -7.597 1.700 276 HG2 GLN 697 HG2 GLN 697 8.479 -9.337 3.219 277 HG3 GLN 697 HG3 GLN 697 6.785 -9.112 3.646 278 HE21 GLN 697 HE21 GLN 697 5.757 -11.037 3.111 279 HE22 GLN 697 HE22 GLN 697 5.933 -11.831 1.612 280 H ARG 698 H ARG 698 6.417 -6.550 5.518 281 HA ARG 698 HA ARG 698 8.608 -7.683 6.845 282 HB2 ARG 698 HB2 ARG 698 9.041 -4.958 5.950 283 HB3 ARG 698 HB3 ARG 698 9.080 -5.046 7.707 284 HG2 ARG 698 HG2 ARG 698 10.507 -7.283 6.500 285 HG3 ARG 698 HG3 ARG 698 11.161 -5.736 5.969 286 HD2 ARG 698 HD2 ARG 698 12.276 -6.474 8.033 287 HD3 ARG 698 HD3 ARG 698 11.351 -5.002 8.313 288 HE ARG 698 HE ARG 698 9.920 -6.200 9.707 289 HH11 ARG 698 HH21 ARG 698 11.881 -8.337 7.838 290 HH12 ARG 698 HH22 ARG 698 11.460 -9.741 8.755 291 HH21 ARG 698 HH11 ARG 698 9.374 -8.025 10.908 292 HH22 ARG 698 HH12 ARG 698 10.053 -9.567 10.482 293 H VAL 699 H VAL 699 8.335 -7.618 9.131 294 HA VAL 699 HA VAL 699 6.361 -6.005 10.409 295 HB VAL 699 HB VAL 699 4.990 -7.624 8.975 296 HG11 VAL 699 HG11 VAL 699 6.667 -9.510 10.279 297 HG12 VAL 699 HG12 VAL 699 5.038 -9.759 10.908 298 HG13 VAL 699 HG13 VAL 699 5.335 -9.833 9.173 299 HG21 VAL 699 HG21 VAL 699 3.748 -8.318 11.346 300 HG22 VAL 699 HG22 VAL 699 4.705 -6.911 11.816 301 HG23 VAL 699 HG23 VAL 699 3.539 -6.786 10.500 302 H LYS 700 H LYS 700 5.626 -8.369 12.149 303 HA LYS 700 HA LYS 700 8.183 -8.913 13.499 304 HB2 LYS 700 HB2 LYS 700 5.710 -7.995 14.986 305 HB3 LYS 700 HB3 LYS 700 7.318 -8.270 15.650 306 HG2 LYS 700 HG2 LYS 700 6.785 -6.197 13.502 307 HG3 LYS 700 HG3 LYS 700 6.684 -5.825 15.221 308 HD2 LYS 700 HD2 LYS 700 8.986 -6.238 15.572 309 HD3 LYS 700 HD3 LYS 700 9.143 -7.134 14.063 310 HE2 LYS 700 HE2 LYS 700 8.311 -4.246 13.963 311 HE3 LYS 700 HE3 LYS 700 10.013 -4.645 14.199 312 HZ1 LYS 700 HZ1 LYS 700 8.914 -6.268 12.148 313 HZ2 LYS 700 HZ2 LYS 700 8.600 -4.626 11.809 314 HZ3 LYS 700 HZ3 LYS 700 10.191 -5.146 12.058 315 H ASP 701 H ASP 701 4.672 -9.471 13.602 316 HA ASP 701 HA ASP 701 5.038 -12.348 13.497 317 HB2 ASP 701 HB2 ASP 701 3.478 -12.487 15.607 318 HB3 ASP 701 HB3 ASP 701 5.216 -12.309 15.816 319 H ALA 702 H ALA 702 2.664 -9.868 14.393 320 HA ALA 702 HA ALA 702 0.370 -11.196 13.468 321 HB1 ALA 702 HB1 ALA 702 -0.631 -8.853 13.470 322 HB2 ALA 702 HB2 ALA 702 0.976 -8.274 13.917 323 HB3 ALA 702 HB3 ALA 702 0.112 -9.384 14.979 324 H ALA 703 H ALA 703 1.270 -8.137 11.913 325 HA ALA 703 HA ALA 703 0.060 -8.918 9.445 326 HB1 ALA 703 HB1 ALA 703 0.649 -6.533 10.631 327 HB2 ALA 703 HB2 ALA 703 0.175 -6.721 8.945 328 HB3 ALA 703 HB3 ALA 703 1.880 -6.607 9.373 329 H GLU 704 H GLU 704 1.461 -8.133 7.376 330 HA GLU 704 HA GLU 704 4.073 -9.502 7.405 331 HB2 GLU 704 HB2 GLU 704 1.730 -10.633 6.339 332 HB3 GLU 704 HB3 GLU 704 2.639 -10.050 4.946 333 HG2 GLU 704 HG2 GLU 704 4.351 -11.371 6.922 334 HG3 GLU 704 HG3 GLU 704 3.097 -12.436 6.297 335 H PHE 705 H PHE 705 1.853 -7.897 5.102 336 HA PHE 705 HA PHE 705 4.138 -6.395 4.003 337 HB2 PHE 705 HB2 PHE 705 1.332 -6.505 2.886 338 HB3 PHE 705 HB3 PHE 705 2.802 -5.986 2.068 339 HD1 PHE 705 HD1 PHE 705 0.953 -8.918 3.377 340 HD2 PHE 705 HD2 PHE 705 4.382 -7.570 1.169 341 HE1 PHE 705 HE1 PHE 705 1.368 -11.236 2.600 342 HE2 PHE 705 HE2 PHE 705 4.791 -9.887 0.392 343 HZ PHE 705 HZ PHE 705 3.286 -11.720 1.109 344 H ALA 706 H ALA 706 3.832 -4.107 3.492 345 HA ALA 706 HA ALA 706 1.772 -2.757 5.108 346 HB1 ALA 706 HB1 ALA 706 4.402 -2.943 5.989 347 HB2 ALA 706 HB2 ALA 706 3.189 -1.785 6.541 348 HB3 ALA 706 HB3 ALA 706 4.307 -1.342 5.251 349 H ILE 707 H ILE 707 0.886 -1.077 4.143 350 HA ILE 707 HA ILE 707 1.795 -0.367 1.466 351 HB ILE 707 HB ILE 707 -0.559 0.775 2.990 352 HG12 ILE 707 HG12 ILE 707 -1.731 -1.049 1.457 353 HG13 ILE 707 HG13 ILE 707 -0.168 -1.849 1.586 354 HG21 ILE 707 HG21 ILE 707 -1.334 0.731 0.441 355 HG22 ILE 707 HG22 ILE 707 -0.366 2.065 1.067 356 HG23 ILE 707 HG23 ILE 707 0.402 0.768 0.149 357 HD11 ILE 707 HD11 ILE 707 -2.240 -1.943 3.467 358 HD12 ILE 707 HD12 ILE 707 -0.585 -2.493 3.707 359 HD13 ILE 707 HD13 ILE 707 -1.052 -0.859 4.174 360 H SER 708 H SER 708 1.663 2.035 0.917 361 HA SER 708 HA SER 708 2.301 3.961 2.920 362 HB2 SER 708 HB2 SER 708 4.547 2.766 1.302 363 HB3 SER 708 HB3 SER 708 4.662 4.350 2.065 364 HG SER 708 HG SER 708 3.785 2.109 3.560 365 H ILE 709 H ILE 709 1.303 5.688 2.078 366 HA ILE 709 HA ILE 709 1.574 6.198 -0.832 367 HB ILE 709 HB ILE 709 -0.788 7.206 0.703 368 HG12 ILE 709 HG12 ILE 709 -1.884 5.000 -0.292 369 HG13 ILE 709 HG13 ILE 709 -0.250 4.367 -0.067 370 HG21 ILE 709 HG21 ILE 709 -1.458 7.810 -1.352 371 HG22 ILE 709 HG22 ILE 709 0.088 7.247 -1.986 372 HG23 ILE 709 HG23 ILE 709 -1.296 6.154 -1.934 373 HD11 ILE 709 HD11 ILE 709 -1.941 4.198 1.911 374 HD12 ILE 709 HD12 ILE 709 -0.295 4.725 2.247 375 HD13 ILE 709 HD13 ILE 709 -1.589 5.915 2.136 376 H LYS 710 H LYS 710 2.106 8.189 -1.474 377 HA LYS 710 HA LYS 710 2.901 10.119 0.568 378 HB2 LYS 710 HB2 LYS 710 4.497 9.834 -1.194 379 HB3 LYS 710 HB3 LYS 710 3.251 9.971 -2.430 380 HG2 LYS 710 HG2 LYS 710 4.320 12.079 -2.438 381 HG3 LYS 710 HG3 LYS 710 2.842 12.340 -1.520 382 HD2 LYS 710 HD2 LYS 710 3.951 12.546 0.492 383 HD3 LYS 710 HD3 LYS 710 5.312 11.535 -0.016 384 HE2 LYS 710 HE2 LYS 710 4.732 14.260 -1.203 385 HE3 LYS 710 HE3 LYS 710 5.830 14.012 0.156 386 HZ1 LYS 710 HZ1 LYS 710 7.394 13.623 -1.397 387 HZ2 LYS 710 HZ2 LYS 710 6.616 12.115 -1.659 388 HZ3 LYS 710 HZ3 LYS 710 6.247 13.451 -2.660 389 H TYR 711 H TYR 711 1.144 11.178 1.370 390 HA TYR 711 HA TYR 711 -0.492 12.675 -0.570 391 HB2 TYR 711 HB2 TYR 711 -1.706 10.589 0.019 392 HB3 TYR 711 HB3 TYR 711 -1.665 11.078 1.712 393 HD1 TYR 711 HD1 TYR 711 -2.288 13.009 -1.452 394 HD2 TYR 711 HD2 TYR 711 -3.787 11.731 2.359 395 HE1 TYR 711 HE1 TYR 711 -4.336 14.366 -1.802 396 HE2 TYR 711 HE2 TYR 711 -5.839 13.082 2.009 397 HH TYR 711 HH TYR 711 -6.982 14.007 -0.644 398 H ASN 712 H ASN 712 -0.185 14.707 -0.083 399 HA ASN 712 HA ASN 712 -0.354 16.666 1.148 400 HB2 ASN 712 HB2 ASN 712 -1.983 15.290 2.627 401 HB3 ASN 712 HB3 ASN 712 -0.600 15.083 3.700 402 HD21 ASN 712 HD21 ASN 712 0.231 16.978 4.821 403 HD22 ASN 712 HD22 ASN 712 -0.643 18.434 4.857 404 H VAL 713 H VAL 713 1.992 15.975 0.312 405 HA VAL 713 HA VAL 713 4.263 15.878 0.677 406 HB VAL 713 HB VAL 713 5.117 17.699 2.085 407 HG11 VAL 713 HG11 VAL 713 3.936 19.537 0.946 408 HG12 VAL 713 HG12 VAL 713 4.217 18.194 -0.162 409 HG13 VAL 713 HG13 VAL 713 2.617 18.439 0.537 410 HG21 VAL 713 HG21 VAL 713 3.385 17.357 3.926 411 HG22 VAL 713 HG22 VAL 713 3.676 19.034 3.471 412 HG23 VAL 713 HG23 VAL 713 2.237 18.201 2.886 413 H GLU 714 H GLU 714 2.929 13.797 1.940 414 HA GLU 714 HA GLU 714 4.887 13.034 3.925 415 HB2 GLU 714 HB2 GLU 714 3.328 12.600 5.727 416 HB3 GLU 714 HB3 GLU 714 3.169 14.291 5.248 417 HG2 GLU 714 HG2 GLU 714 1.134 13.901 4.119 418 HG3 GLU 714 HG3 GLU 714 1.402 12.166 4.035 419 H VAL 715 H VAL 715 4.652 10.758 4.528 420 HA VAL 715 HA VAL 715 3.175 9.226 2.473 421 HB VAL 715 HB VAL 715 5.657 8.292 3.894 422 HG11 VAL 715 HG11 VAL 715 4.139 6.642 2.750 423 HG12 VAL 715 HG12 VAL 715 4.420 7.509 1.239 424 HG13 VAL 715 HG13 VAL 715 5.759 6.709 2.060 425 HG21 VAL 715 HG21 VAL 715 6.672 8.917 1.547 426 HG22 VAL 715 HG22 VAL 715 5.315 10.037 1.466 427 HG23 VAL 715 HG23 VAL 715 6.493 10.175 2.768 428 H LYS 716 H LYS 716 1.475 8.181 3.296 429 HA LYS 716 HA LYS 716 1.401 7.542 6.160 430 HB2 LYS 716 HB2 LYS 716 -0.825 6.923 4.243 431 HB3 LYS 716 HB3 LYS 716 -0.916 7.406 5.937 432 HG2 LYS 716 HG2 LYS 716 0.338 9.582 4.785 433 HG3 LYS 716 HG3 LYS 716 -0.780 9.081 3.514 434 HD2 LYS 716 HD2 LYS 716 -2.664 9.235 5.002 435 HD3 LYS 716 HD3 LYS 716 -1.613 9.474 6.400 436 HE2 LYS 716 HE2 LYS 716 -0.927 11.461 4.472 437 HE3 LYS 716 HE3 LYS 716 -2.683 11.459 4.626 438 HZ1 LYS 716 HZ1 LYS 716 -2.592 11.990 6.839 439 HZ2 LYS 716 HZ2 LYS 716 -1.038 11.339 7.055 440 HZ3 LYS 716 HZ3 LYS 716 -1.209 12.845 6.271 441 H HIS 717 H HIS 717 2.106 5.637 6.860 442 HA HIS 717 HA HIS 717 2.109 3.305 5.057 443 HB2 HIS 717 HB2 HIS 717 3.504 3.482 7.715 444 HB3 HIS 717 HB3 HIS 717 3.838 2.396 6.368 445 HD1 HIS 717 HD1 HIS 717 4.977 3.460 4.227 446 HD2 HIS 717 HD2 HIS 717 4.752 5.973 7.557 447 HE1 HIS 717 HE1 HIS 717 6.694 5.303 3.874 448 HE2 HIS 717 HE2 HIS 717 6.605 6.832 5.920 449 H ILE 718 H ILE 718 1.165 1.445 5.573 450 HA ILE 718 HA ILE 718 -0.174 1.107 8.161 451 HB ILE 718 HB ILE 718 -1.578 0.888 5.487 452 HG12 ILE 718 HG12 ILE 718 -2.865 2.513 7.519 453 HG13 ILE 718 HG13 ILE 718 -1.240 3.105 7.194 454 HG21 ILE 718 HG21 ILE 718 -2.323 0.035 8.279 455 HG22 ILE 718 HG22 ILE 718 -3.570 0.481 7.113 456 HG23 ILE 718 HG23 ILE 718 -2.481 -0.861 6.766 457 HD11 ILE 718 HD11 ILE 718 -1.911 2.790 4.682 458 HD12 ILE 718 HD12 ILE 718 -3.560 2.832 5.313 459 HD13 ILE 718 HD13 ILE 718 -2.486 4.208 5.560 460 H LYS 719 H LYS 719 -0.159 -0.985 8.840 461 HA LYS 719 HA LYS 719 1.303 -2.911 7.237 462 HB2 LYS 719 HB2 LYS 719 1.051 -4.374 9.245 463 HB3 LYS 719 HB3 LYS 719 1.818 -2.827 9.593 464 HG2 LYS 719 HG2 LYS 719 0.271 -2.578 11.225 465 HG3 LYS 719 HG3 LYS 719 -0.894 -2.287 9.934 466 HD2 LYS 719 HD2 LYS 719 -1.078 -4.888 9.824 467 HD3 LYS 719 HD3 LYS 719 -0.333 -4.846 11.423 468 HE2 LYS 719 HE2 LYS 719 -2.756 -4.859 11.681 469 HE3 LYS 719 HE3 LYS 719 -2.128 -3.285 12.177 470 HZ1 LYS 719 HZ1 LYS 719 -3.235 -2.270 10.571 471 HZ2 LYS 719 HZ2 LYS 719 -2.701 -3.376 9.373 472 HZ3 LYS 719 HZ3 LYS 719 -4.102 -3.749 10.313 473 H ILE 720 H ILE 720 0.398 -4.223 5.848 474 HA ILE 720 HA ILE 720 -2.456 -4.495 5.598 475 HB ILE 720 HB ILE 720 -0.168 -4.889 3.959 476 HG12 ILE 720 HG12 ILE 720 -2.992 -5.532 3.136 477 HG13 ILE 720 HG13 ILE 720 -2.525 -3.878 3.534 478 HG21 ILE 720 HG21 ILE 720 -0.692 -7.068 2.917 479 HG22 ILE 720 HG22 ILE 720 -0.204 -7.268 4.599 480 HG23 ILE 720 HG23 ILE 720 -1.909 -7.369 4.153 481 HD11 ILE 720 HD11 ILE 720 -2.248 -4.964 1.049 482 HD12 ILE 720 HD12 ILE 720 -1.247 -3.648 1.659 483 HD13 ILE 720 HD13 ILE 720 -0.659 -5.307 1.738 484 H MET 721 H MET 721 -3.706 -6.340 5.915 485 HA MET 721 HA MET 721 -2.543 -8.351 7.735 486 HB2 MET 721 HB2 MET 721 -4.759 -6.978 8.157 487 HB3 MET 721 HB3 MET 721 -5.469 -8.218 7.123 488 HG2 MET 721 HG2 MET 721 -5.557 -8.814 9.558 489 HG3 MET 721 HG3 MET 721 -4.651 -9.977 8.599 490 HE1 MET 721 HE1 MET 721 -2.902 -9.902 12.057 491 HE2 MET 721 HE2 MET 721 -4.524 -10.126 11.404 492 HE3 MET 721 HE3 MET 721 -3.158 -10.986 10.692 493 H THR 722 H THR 722 -3.173 -10.624 7.387 494 HA THR 722 HA THR 722 -3.447 -11.237 4.500 495 HB THR 722 HB THR 722 -1.284 -11.949 5.127 496 HG1 THR 722 HG1 THR 722 -3.171 -14.046 5.389 497 HG21 THR 722 HG21 THR 722 -1.175 -13.545 7.229 498 HG22 THR 722 HG22 THR 722 -1.136 -11.795 7.442 499 HG23 THR 722 HG23 THR 722 -2.639 -12.682 7.700 500 H ALA 723 H ALA 723 -5.769 -10.863 5.793 501 HA ALA 723 HA ALA 723 -6.923 -12.982 7.189 502 HB1 ALA 723 HB1 ALA 723 -8.214 -11.047 7.142 503 HB2 ALA 723 HB2 ALA 723 -9.082 -12.084 6.009 504 HB3 ALA 723 HB3 ALA 723 -8.003 -10.825 5.406 505 H GLU 724 H GLU 724 -7.090 -15.046 6.621 506 HA GLU 724 HA GLU 724 -7.153 -16.943 5.310 507 HB2 GLU 724 HB2 GLU 724 -9.137 -15.449 3.605 508 HB3 GLU 724 HB3 GLU 724 -9.140 -17.151 4.073 509 HG2 GLU 724 HG2 GLU 724 -9.821 -14.741 5.762 510 HG3 GLU 724 HG3 GLU 724 -10.801 -16.170 5.451 511 H GLY 725 H GLY 725 -5.312 -14.705 4.490 512 HA2 GLY 725 HA2 GLY 725 -3.575 -14.898 2.872 513 HA3 GLY 725 HA3 GLY 725 -4.685 -15.764 1.815 514 H LEU 726 H LEU 726 -6.529 -13.320 2.913 515 HA LEU 726 HA LEU 726 -6.145 -11.760 0.480 516 HB2 LEU 726 HB2 LEU 726 -8.094 -11.305 2.754 517 HB3 LEU 726 HB3 LEU 726 -8.156 -10.579 1.150 518 HG LEU 726 HG LEU 726 -8.402 -13.541 1.752 519 HD11 LEU 726 HD11 LEU 726 -10.360 -12.135 2.423 520 HD12 LEU 726 HD12 LEU 726 -10.463 -11.546 0.763 521 HD13 LEU 726 HD13 LEU 726 -10.738 -13.253 1.112 522 HD21 LEU 726 HD21 LEU 726 -9.309 -13.121 -0.804 523 HD22 LEU 726 HD22 LEU 726 -7.981 -11.965 -0.714 524 HD23 LEU 726 HD23 LEU 726 -7.681 -13.675 -0.409 525 H TYR 727 H TYR 727 -5.519 -9.610 0.378 526 HA TYR 727 HA TYR 727 -4.132 -8.620 2.787 527 HB2 TYR 727 HB2 TYR 727 -3.820 -7.845 -0.121 528 HB3 TYR 727 HB3 TYR 727 -2.933 -7.117 1.215 529 HD1 TYR 727 HD2 TYR 727 -3.201 -10.243 2.472 530 HD2 TYR 727 HD1 TYR 727 -1.356 -8.290 -0.881 531 HE1 TYR 727 HE2 TYR 727 -1.528 -12.064 2.327 532 HE2 TYR 727 HE1 TYR 727 0.315 -10.115 -1.016 533 HH TYR 727 HH TYR 727 0.366 -12.602 -0.333 534 H ARG 728 H ARG 728 -4.671 -6.756 3.743 535 HA ARG 728 HA ARG 728 -6.607 -4.944 2.480 536 HB2 ARG 728 HB2 ARG 728 -7.633 -5.055 4.999 537 HB3 ARG 728 HB3 ARG 728 -8.281 -5.961 3.638 538 HG2 ARG 728 HG2 ARG 728 -6.933 -7.911 4.237 539 HG3 ARG 728 HG3 ARG 728 -6.147 -7.001 5.524 540 HD2 ARG 728 HD2 ARG 728 -9.035 -6.867 5.773 541 HD3 ARG 728 HD3 ARG 728 -8.479 -8.541 5.740 542 HE ARG 728 HE ARG 728 -6.998 -6.758 7.522 543 HH11 ARG 728 HH21 ARG 728 -9.572 -9.037 7.165 544 HH12 ARG 728 HH22 ARG 728 -9.615 -9.430 8.842 545 HH21 ARG 728 HH11 ARG 728 -7.069 -7.223 9.680 546 HH22 ARG 728 HH12 ARG 728 -8.204 -8.419 10.267 547 H ILE 729 H ILE 729 -6.332 -2.857 3.071 548 HA ILE 729 HA ILE 729 -4.019 -2.225 4.740 549 HB ILE 729 HB ILE 729 -5.836 -0.240 3.402 550 HG12 ILE 729 HG12 ILE 729 -3.599 -1.872 2.171 551 HG13 ILE 729 HG13 ILE 729 -5.286 -1.824 1.664 552 HG21 ILE 729 HG21 ILE 729 -3.146 -0.272 4.648 553 HG22 ILE 729 HG22 ILE 729 -3.305 0.699 3.188 554 HG23 ILE 729 HG23 ILE 729 -4.344 1.020 4.575 555 HD11 ILE 729 HD11 ILE 729 -4.203 -0.387 0.140 556 HD12 ILE 729 HD12 ILE 729 -4.903 0.712 1.331 557 HD13 ILE 729 HD13 ILE 729 -3.185 0.316 1.398 558 H THR 730 H THR 730 -7.493 -1.794 4.684 559 HA THR 730 HA THR 730 -7.372 -0.452 7.313 560 HB THR 730 HB THR 730 -8.547 0.735 5.522 561 HG1 THR 730 HG1 THR 730 -9.932 1.395 6.922 562 HG21 THR 730 HG21 THR 730 -10.677 -1.370 5.541 563 HG22 THR 730 HG22 THR 730 -10.362 -0.133 4.338 564 HG23 THR 730 HG23 THR 730 -9.298 -1.532 4.457 565 H GLU 731 H GLU 731 -7.761 -3.410 5.945 566 HA GLU 731 HA GLU 731 -8.327 -5.431 6.831 567 HB2 GLU 731 HB2 GLU 731 -9.115 -4.057 9.385 568 HB3 GLU 731 HB3 GLU 731 -8.424 -5.666 9.164 569 HG2 GLU 731 HG2 GLU 731 -6.567 -3.955 7.953 570 HG3 GLU 731 HG3 GLU 731 -7.060 -3.082 9.395 571 H LYS 732 H LYS 732 -10.352 -2.985 6.224 572 HA LYS 732 HA LYS 732 -12.838 -4.363 6.943 573 HB2 LYS 732 HB2 LYS 732 -12.671 -1.754 5.448 574 HB3 LYS 732 HB3 LYS 732 -13.943 -2.335 6.522 575 HG2 LYS 732 HG2 LYS 732 -11.142 -1.552 7.389 576 HG3 LYS 732 HG3 LYS 732 -12.588 -0.574 7.607 577 HD2 LYS 732 HD2 LYS 732 -12.748 -3.360 8.631 578 HD3 LYS 732 HD3 LYS 732 -11.656 -2.282 9.496 579 HE2 LYS 732 HE2 LYS 732 -14.259 -1.084 8.816 580 HE3 LYS 732 HE3 LYS 732 -14.345 -2.436 9.949 581 HZ1 LYS 732 HZ1 LYS 732 -12.179 -0.588 10.484 582 HZ2 LYS 732 HZ2 LYS 732 -13.740 0.095 10.637 583 HZ3 LYS 732 HZ3 LYS 732 -13.334 -1.291 11.559 584 H LYS 733 H LYS 733 -10.956 -3.332 4.142 585 HA LYS 733 HA LYS 733 -12.596 -5.121 2.460 586 HB2 LYS 733 HB2 LYS 733 -13.233 -2.863 1.863 587 HB3 LYS 733 HB3 LYS 733 -11.544 -2.372 1.744 588 HG2 LYS 733 HG2 LYS 733 -12.367 -2.767 -0.499 589 HG3 LYS 733 HG3 LYS 733 -11.247 -4.066 -0.095 590 HD2 LYS 733 HD2 LYS 733 -13.268 -5.432 0.635 591 HD3 LYS 733 HD3 LYS 733 -14.274 -4.177 -0.083 592 HE2 LYS 733 HE2 LYS 733 -12.080 -5.570 -1.630 593 HE3 LYS 733 HE3 LYS 733 -13.733 -6.183 -1.579 594 HZ1 LYS 733 HZ1 LYS 733 -13.635 -3.375 -2.122 595 HZ2 LYS 733 HZ2 LYS 733 -12.782 -4.271 -3.287 596 HZ3 LYS 733 HZ3 LYS 733 -14.417 -4.615 -2.982 597 H ALA 734 H ALA 734 -11.245 -6.808 2.275 598 HA ALA 734 HA ALA 734 -8.407 -6.345 1.677 599 HB1 ALA 734 HB1 ALA 734 -9.668 -9.037 2.125 600 HB2 ALA 734 HB2 ALA 734 -9.313 -7.976 3.488 601 HB3 ALA 734 HB3 ALA 734 -8.008 -8.526 2.435 602 H PHE 735 H PHE 735 -7.459 -8.088 0.173 603 HA PHE 735 HA PHE 735 -9.213 -8.774 -2.075 604 HB2 PHE 735 HB2 PHE 735 -7.184 -6.648 -2.124 605 HB3 PHE 735 HB3 PHE 735 -7.048 -7.810 -3.440 606 HD1 PHE 735 HD2 PHE 735 -9.055 -8.280 -4.895 607 HD2 PHE 735 HD1 PHE 735 -8.964 -5.079 -2.037 608 HE1 PHE 735 HE2 PHE 735 -10.985 -7.219 -6.029 609 HE2 PHE 735 HE1 PHE 735 -10.894 -4.017 -3.166 610 HZ PHE 735 HZ PHE 735 -11.909 -5.085 -5.166 611 H ARG 736 H ARG 736 -7.949 -10.030 -3.759 612 HA ARG 736 HA ARG 736 -6.978 -12.397 -2.800 613 HB2 ARG 736 HB2 ARG 736 -6.845 -10.977 -5.365 614 HB3 ARG 736 HB3 ARG 736 -5.565 -12.167 -5.132 615 HG2 ARG 736 HG2 ARG 736 -7.099 -13.693 -5.799 616 HG3 ARG 736 HG3 ARG 736 -7.789 -13.506 -4.186 617 HD2 ARG 736 HD2 ARG 736 -9.544 -13.177 -5.828 618 HD3 ARG 736 HD3 ARG 736 -9.195 -11.640 -5.050 619 HE ARG 736 HE ARG 736 -8.387 -10.809 -7.064 620 HH11 ARG 736 HH21 ARG 736 -8.807 -14.249 -7.240 621 HH12 ARG 736 HH22 ARG 736 -8.354 -14.345 -8.904 622 HH21 ARG 736 HH11 ARG 736 -7.739 -10.944 -9.189 623 HH22 ARG 736 HH12 ARG 736 -7.764 -12.485 -10.007 624 H GLY 737 H GLY 737 -4.946 -9.687 -3.928 625 HA2 GLY 737 HA2 GLY 737 -2.852 -10.489 -2.034 626 HA3 GLY 737 HA3 GLY 737 -2.433 -10.424 -3.745 627 H LEU 738 H LEU 738 -0.921 -8.736 -3.306 628 HA LEU 738 HA LEU 738 -1.723 -6.268 -2.117 629 HB2 LEU 738 HB2 LEU 738 0.640 -7.129 -3.755 630 HB3 LEU 738 HB3 LEU 738 0.424 -5.459 -3.272 631 HG LEU 738 HG LEU 738 0.689 -7.854 -1.438 632 HD11 LEU 738 HD11 LEU 738 2.735 -6.814 -2.575 633 HD12 LEU 738 HD12 LEU 738 2.399 -5.371 -1.626 634 HD13 LEU 738 HD13 LEU 738 2.777 -6.889 -0.812 635 HD21 LEU 738 HD21 LEU 738 -0.094 -4.983 -0.944 636 HD22 LEU 738 HD22 LEU 738 -0.822 -6.449 -0.291 637 HD23 LEU 738 HD23 LEU 738 0.747 -5.908 0.299 638 H THR 739 H THR 739 -0.771 -7.088 -5.426 639 HA THR 739 HA THR 739 -1.448 -4.824 -6.777 640 HB THR 739 HB THR 739 -2.302 -7.487 -7.885 641 HG1 THR 739 HG1 THR 739 -0.366 -8.227 -7.668 642 HG21 THR 739 HG21 THR 739 -2.508 -5.944 -9.581 643 HG22 THR 739 HG22 THR 739 -1.283 -4.873 -8.900 644 HG23 THR 739 HG23 THR 739 -0.796 -6.326 -9.773 645 H GLU 740 H GLU 740 -3.678 -7.515 -6.135 646 HA GLU 740 HA GLU 740 -5.989 -6.236 -7.130 647 HB2 GLU 740 HB2 GLU 740 -5.690 -8.431 -5.069 648 HB3 GLU 740 HB3 GLU 740 -7.215 -7.957 -5.811 649 HG2 GLU 740 HG2 GLU 740 -5.273 -8.381 -7.891 650 HG3 GLU 740 HG3 GLU 740 -5.271 -9.780 -6.822 651 H LEU 741 H LEU 741 -4.448 -6.202 -3.986 652 HA LEU 741 HA LEU 741 -6.659 -4.845 -2.695 653 HB2 LEU 741 HB2 LEU 741 -5.175 -6.449 -1.509 654 HB3 LEU 741 HB3 LEU 741 -3.824 -5.347 -1.742 655 HG LEU 741 HG LEU 741 -5.039 -5.275 0.525 656 HD11 LEU 741 HD11 LEU 741 -5.209 -2.523 -0.306 657 HD12 LEU 741 HD12 LEU 741 -4.001 -3.312 0.708 658 HD13 LEU 741 HD13 LEU 741 -3.804 -3.295 -1.041 659 HD21 LEU 741 HD21 LEU 741 -7.076 -3.950 0.620 660 HD22 LEU 741 HD22 LEU 741 -7.033 -3.699 -1.123 661 HD23 LEU 741 HD23 LEU 741 -7.330 -5.309 -0.473 662 H VAL 742 H VAL 742 -3.542 -3.993 -4.078 663 HA VAL 742 HA VAL 742 -3.724 -1.214 -3.205 664 HB VAL 742 HB VAL 742 -1.779 -2.611 -5.054 665 HG11 VAL 742 HG11 VAL 742 -2.013 0.211 -4.071 666 HG12 VAL 742 HG12 VAL 742 -0.415 -0.485 -4.336 667 HG13 VAL 742 HG13 VAL 742 -1.563 -0.381 -5.671 668 HG21 VAL 742 HG21 VAL 742 -0.407 -2.916 -3.209 669 HG22 VAL 742 HG22 VAL 742 -1.127 -1.571 -2.324 670 HG23 VAL 742 HG23 VAL 742 -1.990 -3.105 -2.453 671 H GLU 743 H GLU 743 -4.278 -3.071 -6.159 672 HA GLU 743 HA GLU 743 -4.647 -0.716 -7.787 673 HB2 GLU 743 HB2 GLU 743 -5.216 -3.642 -8.281 674 HB3 GLU 743 HB3 GLU 743 -5.483 -2.379 -9.477 675 HG2 GLU 743 HG2 GLU 743 -2.812 -2.533 -8.113 676 HG3 GLU 743 HG3 GLU 743 -3.172 -3.669 -9.410 677 H PHE 744 H PHE 744 -6.357 -1.600 -5.313 678 HA PHE 744 HA PHE 744 -8.982 -1.105 -6.574 679 HB2 PHE 744 HB2 PHE 744 -8.778 -3.270 -5.364 680 HB3 PHE 744 HB3 PHE 744 -8.408 -2.380 -3.890 681 HD1 PHE 744 HD2 PHE 744 -11.007 -3.013 -6.455 682 HD2 PHE 744 HD1 PHE 744 -10.122 -1.211 -2.655 683 HE1 PHE 744 HE2 PHE 744 -13.429 -2.669 -6.052 684 HE2 PHE 744 HE1 PHE 744 -12.544 -0.867 -2.254 685 HZ PHE 744 HZ PHE 744 -14.196 -1.595 -3.952 686 H TYR 745 H TYR 745 -6.909 -0.370 -3.794 687 HA TYR 745 HA TYR 745 -8.624 1.671 -2.756 688 HB2 TYR 745 HB2 TYR 745 -5.730 0.967 -2.260 689 HB3 TYR 745 HB3 TYR 745 -6.498 2.359 -1.500 690 HD1 TYR 745 HD1 TYR 745 -7.628 -1.161 -2.234 691 HD2 TYR 745 HD2 TYR 745 -7.072 1.913 0.728 692 HE1 TYR 745 HE1 TYR 745 -8.599 -2.645 -0.500 693 HE2 TYR 745 HE2 TYR 745 -8.029 0.410 2.453 694 HH TYR 745 HH TYR 745 -9.104 -2.908 1.652 695 H GLN 746 H GLN 746 -6.593 1.546 -5.471 696 HA GLN 746 HA GLN 746 -5.696 4.252 -5.577 697 HB2 GLN 746 HB2 GLN 746 -5.522 3.773 -8.074 698 HB3 GLN 746 HB3 GLN 746 -4.602 2.698 -7.023 699 HG2 GLN 746 HG2 GLN 746 -5.856 0.890 -7.569 700 HG3 GLN 746 HG3 GLN 746 -7.363 1.797 -7.531 701 HE21 GLN 746 HE21 GLN 746 -4.801 0.619 -9.624 702 HE22 GLN 746 HE22 GLN 746 -5.470 1.212 -11.068 703 H GLN 747 H GLN 747 -8.708 2.734 -6.004 704 HA GLN 747 HA GLN 747 -9.884 5.127 -7.288 705 HB2 GLN 747 HB2 GLN 747 -11.295 2.487 -6.976 706 HB3 GLN 747 HB3 GLN 747 -11.578 3.761 -8.162 707 HG2 GLN 747 HG2 GLN 747 -8.867 2.880 -8.439 708 HG3 GLN 747 HG3 GLN 747 -9.901 1.456 -8.415 709 HE21 GLN 747 HE21 GLN 747 -8.420 2.783 -10.709 710 HE22 GLN 747 HE22 GLN 747 -9.629 3.076 -11.873 711 H ASN 748 H ASN 748 -10.222 2.796 -4.647 712 HA ASN 748 HA ASN 748 -12.506 4.003 -3.462 713 HB2 ASN 748 HB2 ASN 748 -10.869 1.745 -2.965 714 HB3 ASN 748 HB3 ASN 748 -10.850 2.711 -1.493 715 HD21 ASN 748 HD21 ASN 748 -12.910 3.050 -0.366 716 HD22 ASN 748 HD22 ASN 748 -14.267 2.095 -0.753 717 H SER 749 H SER 749 -12.597 5.967 -2.582 718 HA SER 749 HA SER 749 -10.420 7.640 -2.049 719 HB2 SER 749 HB2 SER 749 -11.966 9.084 -0.942 720 HB3 SER 749 HB3 SER 749 -12.841 8.315 -2.260 721 HG SER 749 HG SER 749 -12.802 6.999 0.205 722 H LEU 750 H LEU 750 -8.815 6.952 -0.783 723 HA LEU 750 HA LEU 750 -8.752 5.221 1.298 724 HB2 LEU 750 HB2 LEU 750 -7.206 7.808 1.050 725 HB3 LEU 750 HB3 LEU 750 -6.819 6.529 2.202 726 HG LEU 750 HG LEU 750 -6.927 6.225 -0.811 727 HD11 LEU 750 HD11 LEU 750 -4.545 5.995 1.039 728 HD12 LEU 750 HD12 LEU 750 -4.539 6.031 -0.725 729 HD13 LEU 750 HD13 LEU 750 -4.956 7.481 0.184 730 HD21 LEU 750 HD21 LEU 750 -7.391 4.070 -0.212 731 HD22 LEU 750 HD22 LEU 750 -5.661 4.010 0.125 732 HD23 LEU 750 HD23 LEU 750 -6.804 4.298 1.435 733 H LYS 751 H LYS 751 -9.915 8.536 1.457 734 HA LYS 751 HA LYS 751 -10.069 8.937 4.201 735 HB2 LYS 751 HB2 LYS 751 -11.692 10.593 3.751 736 HB3 LYS 751 HB3 LYS 751 -10.698 10.534 2.297 737 HG2 LYS 751 HG2 LYS 751 -12.511 8.706 1.571 738 HG3 LYS 751 HG3 LYS 751 -13.512 9.616 2.704 739 HD2 LYS 751 HD2 LYS 751 -11.966 10.836 0.389 740 HD3 LYS 751 HD3 LYS 751 -13.695 10.502 0.389 741 HE2 LYS 751 HE2 LYS 751 -12.466 12.212 2.547 742 HE3 LYS 751 HE3 LYS 751 -12.923 12.911 0.999 743 HZ1 LYS 751 HZ1 LYS 751 -14.720 11.426 2.844 744 HZ2 LYS 751 HZ2 LYS 751 -14.728 13.104 2.573 745 HZ3 LYS 751 HZ3 LYS 751 -15.168 12.041 1.328 746 H ASP 752 H ASP 752 -11.734 6.645 2.251 747 HA ASP 752 HA ASP 752 -13.867 6.211 4.209 748 HB2 ASP 752 HB2 ASP 752 -14.957 5.114 2.543 749 HB3 ASP 752 HB3 ASP 752 -13.831 5.989 1.518 750 H CYS 753 H CYS 753 -11.234 4.322 2.750 751 HA CYS 753 HA CYS 753 -11.480 2.194 4.674 752 HB2 CYS 753 HB2 CYS 753 -9.382 2.819 2.583 753 HB3 CYS 753 HB3 CYS 753 -9.388 1.362 3.571 754 HG CYS 753 HG CYS 753 -11.972 1.909 1.954 755 H PHE 754 H PHE 754 -9.335 4.976 4.175 756 HA PHE 754 HA PHE 754 -7.642 4.228 6.437 757 HB2 PHE 754 HB2 PHE 754 -7.686 6.566 4.532 758 HB3 PHE 754 HB3 PHE 754 -6.597 6.507 5.912 759 HD1 PHE 754 HD2 PHE 754 -7.630 3.471 4.010 760 HD2 PHE 754 HD1 PHE 754 -4.557 6.404 4.636 761 HE1 PHE 754 HE2 PHE 754 -6.051 2.091 2.709 762 HE2 PHE 754 HE1 PHE 754 -2.984 5.023 3.334 763 HZ PHE 754 HZ PHE 754 -3.723 2.865 2.364 764 H LYS 755 H LYS 755 -8.059 7.595 6.422 765 HA LYS 755 HA LYS 755 -10.285 7.706 8.272 766 HB2 LYS 755 HB2 LYS 755 -8.286 6.870 9.607 767 HB3 LYS 755 HB3 LYS 755 -7.577 8.460 9.374 768 HG2 LYS 755 HG2 LYS 755 -10.371 8.552 10.293 769 HG3 LYS 755 HG3 LYS 755 -9.293 7.745 11.429 770 HD2 LYS 755 HD2 LYS 755 -8.897 10.519 10.269 771 HD3 LYS 755 HD3 LYS 755 -9.404 10.154 11.913 772 HE2 LYS 755 HE2 LYS 755 -7.238 10.055 12.525 773 HE3 LYS 755 HE3 LYS 755 -7.025 8.668 11.454 774 HZ1 LYS 755 HZ1 LYS 755 -5.603 10.772 11.056 775 HZ2 LYS 755 HZ2 LYS 755 -6.307 10.000 9.733 776 HZ3 LYS 755 HZ3 LYS 755 -7.032 11.416 10.343 777 H SER 756 H SER 756 -7.635 9.970 8.567 778 HA SER 756 HA SER 756 -9.350 12.120 7.717 779 HB2 SER 756 HB2 SER 756 -6.391 12.233 8.362 780 HB3 SER 756 HB3 SER 756 -7.517 13.586 8.321 781 HG SER 756 HG SER 756 -8.331 12.985 10.207 782 H LEU 757 H LEU 757 -7.997 9.893 5.944 783 HA LEU 757 HA LEU 757 -6.373 11.237 4.052 784 HB2 LEU 757 HB2 LEU 757 -7.757 8.622 4.257 785 HB3 LEU 757 HB3 LEU 757 -7.387 9.172 2.627 786 HG LEU 757 HG LEU 757 -5.601 7.766 3.835 787 HD11 LEU 757 HD11 LEU 757 -3.801 9.558 3.067 788 HD12 LEU 757 HD12 LEU 757 -4.796 8.679 1.906 789 HD13 LEU 757 HD13 LEU 757 -5.234 10.320 2.372 790 HD21 LEU 757 HD21 LEU 757 -4.411 8.637 5.589 791 HD22 LEU 757 HD22 LEU 757 -4.652 10.303 5.060 792 HD23 LEU 757 HD23 LEU 757 -5.945 9.443 5.893 793 H ASP 758 H ASP 758 -7.004 11.291 1.701 794 HA ASP 758 HA ASP 758 -9.691 11.690 0.888 795 HB2 ASP 758 HB2 ASP 758 -8.571 13.931 2.193 796 HB3 ASP 758 HB3 ASP 758 -8.511 14.306 0.474 797 H THR 759 H THR 759 -7.949 10.065 -0.102 798 HA THR 759 HA THR 759 -7.528 10.941 -2.806 799 HB THR 759 HB THR 759 -5.501 11.862 -1.593 800 HG1 THR 759 HG1 THR 759 -4.230 11.268 -3.259 801 HG21 THR 759 HG21 THR 759 -5.504 9.497 -0.251 802 HG22 THR 759 HG22 THR 759 -4.335 9.135 -1.521 803 HG23 THR 759 HG23 THR 759 -4.069 10.498 -0.440 804 H THR 760 H THR 760 -5.573 9.082 -3.487 805 HA THR 760 HA THR 760 -6.336 6.453 -2.525 806 HB THR 760 HB THR 760 -7.125 5.610 -4.665 807 HG1 THR 760 HG1 THR 760 -7.159 6.800 -6.424 808 HG21 THR 760 HG21 THR 760 -8.740 6.661 -3.022 809 HG22 THR 760 HG22 THR 760 -8.695 8.108 -4.027 810 HG23 THR 760 HG23 THR 760 -9.304 6.593 -4.689 811 H LEU 761 H LEU 761 -5.160 4.737 -3.846 812 HA LEU 761 HA LEU 761 -2.402 5.256 -3.919 813 HB2 LEU 761 HB2 LEU 761 -4.085 3.094 -5.224 814 HB3 LEU 761 HB3 LEU 761 -2.331 3.086 -5.254 815 HG LEU 761 HG LEU 761 -3.422 1.674 -3.436 816 HD11 LEU 761 HD11 LEU 761 -1.419 3.833 -2.875 817 HD12 LEU 761 HD12 LEU 761 -1.871 2.676 -1.628 818 HD13 LEU 761 HD13 LEU 761 -1.147 2.108 -3.131 819 HD21 LEU 761 HD21 LEU 761 -5.185 3.287 -2.790 820 HD22 LEU 761 HD22 LEU 761 -4.184 2.823 -1.420 821 HD23 LEU 761 HD23 LEU 761 -3.942 4.387 -2.193 822 H GLN 762 H GLN 762 -2.208 7.220 -5.120 823 HA GLN 762 HA GLN 762 -3.164 7.519 -7.772 824 HB2 GLN 762 HB2 GLN 762 -1.710 9.072 -5.821 825 HB3 GLN 762 HB3 GLN 762 -1.024 9.294 -7.426 826 HG2 GLN 762 HG2 GLN 762 -3.858 9.352 -7.712 827 HG3 GLN 762 HG3 GLN 762 -3.456 10.377 -6.338 828 HE21 GLN 762 HE21 GLN 762 -1.243 11.735 -6.943 829 HE22 GLN 762 HE22 GLN 762 -1.365 12.539 -8.431 830 H PHE 763 H PHE 763 0.242 7.252 -6.656 831 HA PHE 763 HA PHE 763 0.804 5.770 -9.154 832 HB2 PHE 763 HB2 PHE 763 2.292 8.216 -8.179 833 HB3 PHE 763 HB3 PHE 763 2.860 7.163 -9.476 834 HD1 PHE 763 HD1 PHE 763 1.308 6.790 -11.493 835 HD2 PHE 763 HD2 PHE 763 0.730 9.927 -8.617 836 HE1 PHE 763 HE1 PHE 763 -0.134 8.003 -13.103 837 HE2 PHE 763 HE2 PHE 763 -0.715 11.139 -10.225 838 HZ PHE 763 HZ PHE 763 -1.145 10.178 -12.471 839 HA PRO 764 HA PRO 764 3.398 3.250 -6.603 840 HB2 PRO 764 HB2 PRO 764 5.190 2.341 -8.432 841 HB3 PRO 764 HB3 PRO 764 3.491 1.828 -8.432 842 HG2 PRO 764 HG2 PRO 764 4.849 3.878 -10.105 843 HG3 PRO 764 HG3 PRO 764 3.668 2.651 -10.571 844 HD2 PRO 764 HD2 PRO 764 2.994 5.259 -10.158 845 HD3 PRO 764 HD3 PRO 764 1.866 3.915 -9.864 846 H PHE 765 H PHE 765 6.138 2.777 -6.752 847 HA PHE 765 HA PHE 765 7.269 5.489 -6.405 848 HB2 PHE 765 HB2 PHE 765 8.445 4.828 -4.493 849 HB3 PHE 765 HB3 PHE 765 6.866 4.076 -4.294 850 HD1 PHE 765 HD1 PHE 765 6.556 1.664 -4.800 851 HD2 PHE 765 HD2 PHE 765 10.430 3.507 -4.783 852 HE1 PHE 765 HE1 PHE 765 7.617 -0.568 -4.646 853 HE2 PHE 765 HE2 PHE 765 11.496 1.273 -4.631 854 HZ PHE 765 HZ PHE 765 10.085 -0.767 -4.561 855 H LYS 766 H LYS 766 7.670 2.336 -7.849 856 HA LYS 766 HA LYS 766 10.490 2.799 -8.430 857 HB2 LYS 766 HB2 LYS 766 8.687 0.726 -9.684 858 HB3 LYS 766 HB3 LYS 766 10.442 0.732 -9.652 859 HG2 LYS 766 HG2 LYS 766 9.759 0.964 -6.974 860 HG3 LYS 766 HG3 LYS 766 8.555 -0.156 -7.593 861 HD2 LYS 766 HD2 LYS 766 11.290 -0.686 -8.552 862 HD3 LYS 766 HD3 LYS 766 11.087 -0.862 -6.813 863 HE2 LYS 766 HE2 LYS 766 10.533 -3.002 -7.594 864 HE3 LYS 766 HE3 LYS 766 8.952 -2.234 -7.442 865 HZ1 LYS 766 HZ1 LYS 766 8.685 -2.836 -9.577 866 HZ2 LYS 766 HZ2 LYS 766 9.716 -1.516 -9.927 867 HZ3 LYS 766 HZ3 LYS 766 10.362 -3.081 -9.815 868 H GLU 767 H GLU 767 7.410 3.434 -9.864 869 HA GLU 767 HA GLU 767 7.611 3.696 -12.489 870 HB2 GLU 767 HB2 GLU 767 6.230 5.139 -10.457 871 HB3 GLU 767 HB3 GLU 767 6.843 6.312 -11.618 872 HG2 GLU 767 HG2 GLU 767 5.915 4.441 -13.331 873 HG3 GLU 767 HG3 GLU 767 4.809 4.177 -11.992 874 H1 ASP 338 H1 ASP 338 9.932 6.910 17.247 875 H2 ASP 338 H2 ASP 338 10.204 6.822 16.935 876 H3 ASP 338 H3 ASP 338 11.541 7.366 17.850 877 HA ASP 338 HA ASP 338 12.204 5.233 17.657 878 HB2 ASP 338 HB2 ASP 338 11.126 3.848 19.580 879 HB3 ASP 338 HB3 ASP 338 11.981 5.326 20.007 880 H THR 339 H THR 339 8.675 4.940 18.233 881 HA THR 339 HA THR 339 8.432 2.528 16.709 882 HB THR 339 HB THR 339 6.175 2.597 17.218 883 HG1 THR 339 HG1 THR 339 5.989 4.641 16.004 884 HG21 THR 339 HG21 THR 339 6.026 3.160 19.455 885 HG22 THR 339 HG22 THR 339 7.779 3.169 19.257 886 HG23 THR 339 HG23 THR 339 6.880 4.687 19.238 887 H GLU 340 H GLU 340 9.873 4.323 15.172 888 HA GLU 340 HA GLU 340 8.267 5.719 13.269 889 HB2 GLU 340 HB2 GLU 340 11.153 4.933 13.465 890 HB3 GLU 340 HB3 GLU 340 10.523 5.515 11.922 891 HG2 GLU 340 HG2 GLU 340 11.286 7.471 13.035 892 HG3 GLU 340 HG3 GLU 340 9.539 7.486 13.250 893 H VAL 341 H VAL 341 6.927 3.519 13.317 894 HA VAL 341 HA VAL 341 7.610 2.146 10.785 895 HB VAL 341 HB VAL 341 7.979 0.810 12.995 896 HG11 VAL 341 HG11 VAL 341 6.153 0.042 14.167 897 HG12 VAL 341 HG12 VAL 341 5.495 1.591 13.636 898 HG13 VAL 341 HG13 VAL 341 5.086 0.111 12.766 899 HG21 VAL 341 HG21 VAL 341 6.521 -1.126 11.699 900 HG22 VAL 341 HG22 VAL 341 6.784 0.049 10.409 901 HG23 VAL 341 HG23 VAL 341 8.160 -0.646 11.264 902 H PTR 342 H PTR 342 5.176 0.574 10.814 903 HA PTR 342 HA PTR 342 3.299 2.702 10.067 904 HB2 PTR 342 HB2 PTR 342 1.988 0.354 9.521 905 HB3 PTR 342 HB3 PTR 342 3.009 1.220 8.377 906 HD1 PTR 342 HD1 PTR 342 3.476 -1.118 11.290 907 HD2 PTR 342 HD2 PTR 342 4.601 -0.052 7.287 908 HE1 PTR 342 HE1 PTR 342 5.054 -3.029 11.223 909 HE2 PTR 342 HE2 PTR 342 6.167 -1.973 7.221 910 H GLU 343 H GLU 343 2.826 3.408 12.203 911 HA GLU 343 HA GLU 343 1.845 1.736 14.267 912 HB2 GLU 343 HB2 GLU 343 0.944 3.888 15.195 913 HB3 GLU 343 HB3 GLU 343 2.646 3.972 14.741 914 HG2 GLU 343 HG2 GLU 343 0.565 4.726 12.711 915 HG3 GLU 343 HG3 GLU 343 0.972 5.876 13.978 916 H SER 344 H SER 344 0.585 0.868 11.915 917 HA SER 344 HA SER 344 -1.504 0.825 10.774 918 HB2 SER 344 HB2 SER 344 -1.196 -0.840 12.895 919 HB3 SER 344 HB3 SER 344 -2.683 -0.019 13.352 920 HG SER 344 HG SER 344 -3.635 -0.686 11.478 921 HA PRO 345 HA PRO 345 -2.877 4.984 12.552 922 HB2 PRO 345 HB2 PRO 345 -3.319 5.214 9.598 923 HB3 PRO 345 HB3 PRO 345 -2.716 6.426 10.744 924 HG2 PRO 345 HG2 PRO 345 -1.061 5.149 9.121 925 HG3 PRO 345 HG3 PRO 345 -0.599 5.519 10.791 926 HD2 PRO 345 HD2 PRO 345 -1.366 2.898 9.588 927 HD3 PRO 345 HD3 PRO 345 -0.248 3.246 10.926 928 H PTR 346 H PTR 346 -4.435 3.111 9.930 929 HA PTR 346 HA PTR 346 -7.048 3.651 11.220 930 HB2 PTR 346 HB2 PTR 346 -6.862 3.196 8.278 931 HB3 PTR 346 HB3 PTR 346 -7.996 4.191 9.195 932 HD1 PTR 346 HD1 PTR 346 -5.399 4.430 6.931 933 HD2 PTR 346 HD2 PTR 346 -6.615 6.038 10.723 934 HE1 PTR 346 HE1 PTR 346 -3.970 6.426 6.551 935 HE2 PTR 346 HE2 PTR 346 -5.197 8.030 10.335 936 H ALA 347 H ALA 347 -8.717 2.094 10.886 937 HA ALA 347 HA ALA 347 -8.651 -0.321 9.598 938 HB1 ALA 347 HB1 ALA 347 -8.008 -1.778 11.712 939 HB2 ALA 347 HB2 ALA 347 -7.037 -0.360 12.113 940 HB3 ALA 347 HB3 ALA 347 -6.770 -1.211 10.592 941 H ASP 348 H ASP 348 -9.009 -0.060 13.125 942 HA ASP 348 HA ASP 348 -11.930 0.027 12.843 943 HB2 ASP 348 HB2 ASP 348 -10.333 -2.266 13.868 944 HB3 ASP 348 HB3 ASP 348 -11.798 -1.854 14.753 945 HA PRO 349 HA PRO 349 -10.184 2.579 16.358 946 HB2 PRO 349 HB2 PRO 349 -11.294 4.953 15.582 947 HB3 PRO 349 HB3 PRO 349 -9.710 4.388 15.017 948 HG2 PRO 349 HG2 PRO 349 -12.351 4.292 13.646 949 HG3 PRO 349 HG3 PRO 349 -10.750 4.669 12.987 950 HD2 PRO 349 HD2 PRO 349 -11.943 2.228 12.674 951 HD3 PRO 349 HD3 PRO 349 -10.179 2.441 12.733 952 H GLU 350 H GLU 350 -12.147 0.845 16.789 953 HA GLU 350 HA GLU 350 -13.999 0.444 18.075 954 HB2 GLU 350 HB2 GLU 350 -13.672 3.381 18.748 955 HB3 GLU 350 HB3 GLU 350 -14.756 2.274 19.588 956 HG2 GLU 350 HG2 GLU 350 -12.967 0.992 20.457 957 HG3 GLU 350 HG3 GLU 350 -11.818 1.642 19.294 Start of MODEL 18 1 H1 GLY 661 H1 GLY 661 1.843 -13.636 -13.643 2 H2 GLY 661 H2 GLY 661 3.031 -12.537 -14.163 3 H3 GLY 661 H3 GLY 661 2.638 -12.643 -12.506 4 HA2 GLY 661 HA2 GLY 661 4.358 -14.335 -14.135 5 HA3 GLY 661 HA3 GLY 661 4.463 -13.929 -12.421 6 H HIS 662 H HIS 662 4.337 -15.769 -11.269 7 HA HIS 662 HA HIS 662 2.791 -18.050 -12.218 8 HB2 HIS 662 HB2 HIS 662 5.059 -18.228 -11.111 9 HB3 HIS 662 HB3 HIS 662 4.268 -17.794 -9.596 10 HD1 HIS 662 HD1 HIS 662 1.608 -19.372 -10.019 11 HD2 HIS 662 HD2 HIS 662 5.412 -20.951 -10.680 12 HE1 HIS 662 HE1 HIS 662 1.413 -21.893 -9.709 13 HE2 HIS 662 HE2 HIS 662 3.727 -22.869 -10.112 14 H MET 663 H MET 663 2.438 -15.456 -9.930 15 HA MET 663 HA MET 663 -0.307 -16.186 -9.457 16 HB2 MET 663 HB2 MET 663 1.037 -17.618 -7.826 17 HB3 MET 663 HB3 MET 663 1.479 -16.120 -7.012 18 HG2 MET 663 HG2 MET 663 -1.374 -16.164 -7.524 19 HG3 MET 663 HG3 MET 663 -0.891 -17.612 -6.647 20 HE1 MET 663 HE1 MET 663 -2.154 -17.265 -4.920 21 HE2 MET 663 HE2 MET 663 -1.637 -16.454 -3.444 22 HE3 MET 663 HE3 MET 663 -2.723 -15.632 -4.574 23 H GLN 664 H GLN 664 0.600 -14.603 -6.743 24 HA GLN 664 HA GLN 664 -0.187 -12.031 -7.859 25 HB2 GLN 664 HB2 GLN 664 -1.171 -13.020 -5.729 26 HB3 GLN 664 HB3 GLN 664 0.386 -12.693 -4.969 27 HG2 GLN 664 HG2 GLN 664 -1.367 -10.871 -4.686 28 HG3 GLN 664 HG3 GLN 664 0.179 -10.339 -5.334 29 HE21 GLN 664 HE21 GLN 664 -3.030 -11.488 -6.520 30 HE22 GLN 664 HE22 GLN 664 -3.047 -10.469 -7.878 31 H ASP 665 H ASP 665 2.178 -12.531 -8.899 32 HA ASP 665 HA ASP 665 4.485 -11.904 -7.443 33 HB2 ASP 665 HB2 ASP 665 4.624 -10.767 -10.091 34 HB3 ASP 665 HB3 ASP 665 5.445 -12.190 -9.451 35 H LEU 666 H LEU 666 5.209 -10.054 -6.533 36 HA LEU 666 HA LEU 666 3.702 -7.587 -7.108 37 HB2 LEU 666 HB2 LEU 666 5.545 -8.118 -4.775 38 HB3 LEU 666 HB3 LEU 666 4.393 -6.795 -4.958 39 HG LEU 666 HG LEU 666 3.554 -9.699 -4.960 40 HD11 LEU 666 HD11 LEU 666 4.675 -9.025 -2.814 41 HD12 LEU 666 HD12 LEU 666 3.462 -7.757 -2.640 42 HD13 LEU 666 HD13 LEU 666 2.974 -9.451 -2.629 43 HD21 LEU 666 HD21 LEU 666 2.114 -7.050 -4.662 44 HD22 LEU 666 HD22 LEU 666 1.933 -8.224 -5.967 45 HD23 LEU 666 HD23 LEU 666 1.360 -8.612 -4.347 46 H SER 667 H SER 667 6.977 -8.863 -6.814 47 HA SER 667 HA SER 667 8.474 -6.555 -7.179 48 HB2 SER 667 HB2 SER 667 9.108 -9.267 -8.338 49 HB3 SER 667 HB3 SER 667 10.255 -7.997 -7.910 50 HG SER 667 HG SER 667 10.253 -9.178 -6.109 51 H VAL 668 H VAL 668 6.214 -7.767 -9.332 52 HA VAL 668 HA VAL 668 7.643 -6.889 -11.725 53 HB VAL 668 HB VAL 668 5.678 -7.727 -12.937 54 HG11 VAL 668 HG11 VAL 668 6.051 -10.045 -12.512 55 HG12 VAL 668 HG12 VAL 668 7.566 -9.239 -12.107 56 HG13 VAL 668 HG13 VAL 668 6.464 -9.741 -10.826 57 HG21 VAL 668 HG21 VAL 668 3.871 -8.858 -11.673 58 HG22 VAL 668 HG22 VAL 668 4.620 -8.353 -10.160 59 HG23 VAL 668 HG23 VAL 668 3.960 -7.145 -11.262 60 H HIS 669 H HIS 669 5.844 -5.532 -9.323 61 HA HIS 669 HA HIS 669 4.555 -3.494 -11.008 62 HB2 HIS 669 HB2 HIS 669 4.516 -3.780 -7.997 63 HB3 HIS 669 HB3 HIS 669 3.470 -2.758 -8.978 64 HD1 HIS 669 HD1 HIS 669 2.593 -4.671 -11.164 65 HD2 HIS 669 HD2 HIS 669 2.845 -5.789 -7.168 66 HE1 HIS 669 HE1 HIS 669 1.017 -6.634 -10.870 67 HE2 HIS 669 HE2 HIS 669 1.022 -7.221 -8.389 68 H LEU 670 H LEU 670 4.655 -1.254 -9.671 69 HA LEU 670 HA LEU 670 7.515 -0.655 -9.264 70 HB2 LEU 670 HB2 LEU 670 6.864 1.700 -10.048 71 HB3 LEU 670 HB3 LEU 670 7.043 0.460 -11.264 72 HG LEU 670 HG LEU 670 4.413 1.314 -10.042 73 HD11 LEU 670 HD11 LEU 670 5.588 1.898 -12.778 74 HD12 LEU 670 HD12 LEU 670 4.022 2.440 -12.180 75 HD13 LEU 670 HD13 LEU 670 5.504 3.056 -11.452 76 HD21 LEU 670 HD21 LEU 670 4.043 0.089 -12.549 77 HD22 LEU 670 HD22 LEU 670 5.204 -0.936 -11.707 78 HD23 LEU 670 HD23 LEU 670 3.634 -0.592 -10.976 79 H TRP 671 H TRP 671 4.574 -0.885 -7.792 80 HA TRP 671 HA TRP 671 5.221 1.286 -5.936 81 HB2 TRP 671 HB2 TRP 671 2.875 0.766 -5.006 82 HB3 TRP 671 HB3 TRP 671 2.984 1.601 -6.548 83 HD1 TRP 671 HD1 TRP 671 1.739 0.558 -8.507 84 HE1 TRP 671 HE1 TRP 671 0.518 -1.683 -8.928 85 HE3 TRP 671 HE3 TRP 671 3.102 -1.981 -4.283 86 HZ2 TRP 671 HZ2 TRP 671 0.214 -4.214 -7.648 87 HZ3 TRP 671 HZ3 TRP 671 2.330 -4.309 -3.915 88 HH2 TRP 671 HH2 TRP 671 0.886 -5.426 -5.594 89 H TYR 672 H TYR 672 5.583 -1.974 -6.378 90 HA TYR 672 HA TYR 672 5.323 -2.737 -3.573 91 HB2 TYR 672 HB2 TYR 672 4.644 -4.341 -5.309 92 HB3 TYR 672 HB3 TYR 672 6.280 -4.324 -5.969 93 HD1 TYR 672 HD2 TYR 672 4.596 -4.729 -2.632 94 HD2 TYR 672 HD1 TYR 672 7.706 -6.032 -5.292 95 HE1 TYR 672 HE2 TYR 672 5.286 -6.453 -0.986 96 HE2 TYR 672 HE1 TYR 672 8.389 -7.758 -3.646 97 HH TYR 672 HH TYR 672 6.873 -9.005 -1.551 98 H ALA 673 H ALA 673 6.891 -2.316 -2.189 99 HA ALA 673 HA ALA 673 9.658 -2.054 -3.186 100 HB1 ALA 673 HB1 ALA 673 8.555 -0.186 -1.853 101 HB2 ALA 673 HB2 ALA 673 10.106 -0.752 -1.236 102 HB3 ALA 673 HB3 ALA 673 8.606 -1.270 -0.462 103 H GLY 674 H GLY 674 7.566 -4.132 -1.518 104 HA2 GLY 674 HA2 GLY 674 7.866 -5.971 -0.150 105 HA3 GLY 674 HA3 GLY 674 9.154 -6.324 -1.288 106 HA PRO 675 HA PRO 675 11.780 -6.303 2.291 107 HB2 PRO 675 HB2 PRO 675 14.194 -6.087 0.942 108 HB3 PRO 675 HB3 PRO 675 13.300 -7.601 1.176 109 HG2 PRO 675 HG2 PRO 675 13.412 -5.816 -1.199 110 HG3 PRO 675 HG3 PRO 675 13.364 -7.585 -1.115 111 HD2 PRO 675 HD2 PRO 675 11.170 -6.110 -1.744 112 HD3 PRO 675 HD3 PRO 675 11.054 -7.646 -0.852 113 H MET 676 H MET 676 10.565 -3.910 2.000 114 HA MET 676 HA MET 676 12.771 -1.936 2.233 115 HB2 MET 676 HB2 MET 676 11.246 -1.569 0.277 116 HB3 MET 676 HB3 MET 676 9.909 -1.392 1.409 117 HG2 MET 676 HG2 MET 676 10.526 0.714 1.988 118 HG3 MET 676 HG3 MET 676 12.230 0.281 2.100 119 HE1 MET 676 HE1 MET 676 13.841 1.095 0.850 120 HE2 MET 676 HE2 MET 676 13.708 -0.215 -0.320 121 HE3 MET 676 HE3 MET 676 13.872 1.457 -0.873 122 H GLU 677 H GLU 677 12.409 -0.228 3.807 123 HA GLU 677 HA GLU 677 10.786 -1.162 6.075 124 HB2 GLU 677 HB2 GLU 677 12.210 0.299 7.463 125 HB3 GLU 677 HB3 GLU 677 13.144 -0.932 6.604 126 HG2 GLU 677 HG2 GLU 677 14.283 0.627 5.437 127 HG3 GLU 677 HG3 GLU 677 12.813 1.513 5.042 128 H ARG 678 H ARG 678 9.831 0.574 7.439 129 HA ARG 678 HA ARG 678 8.031 2.127 5.980 130 HB2 ARG 678 HB2 ARG 678 7.716 1.423 8.338 131 HB3 ARG 678 HB3 ARG 678 8.946 2.590 8.822 132 HG2 ARG 678 HG2 ARG 678 6.791 3.647 7.086 133 HG3 ARG 678 HG3 ARG 678 6.294 3.178 8.710 134 HD2 ARG 678 HD2 ARG 678 8.734 4.581 9.000 135 HD3 ARG 678 HD3 ARG 678 7.759 5.504 7.863 136 HE ARG 678 HE ARG 678 6.297 4.646 10.223 137 HH11 ARG 678 HH21 ARG 678 8.364 7.084 8.814 138 HH12 ARG 678 HH22 ARG 678 7.804 8.319 9.902 139 HH21 ARG 678 HH11 ARG 678 5.591 6.283 11.571 140 HH22 ARG 678 HH12 ARG 678 6.243 7.879 11.428 141 H ALA 679 H ALA 679 10.834 3.292 7.865 142 HA ALA 679 HA ALA 679 10.671 5.962 7.020 143 HB1 ALA 679 HB1 ALA 679 12.499 6.253 8.320 144 HB2 ALA 679 HB2 ALA 679 13.395 4.980 7.489 145 HB3 ALA 679 HB3 ALA 679 12.260 4.564 8.773 146 H GLY 680 H GLY 680 12.176 3.140 5.622 147 HA2 GLY 680 HA2 GLY 680 13.604 4.527 3.555 148 HA3 GLY 680 HA3 GLY 680 13.231 2.804 3.579 149 H ALA 681 H ALA 681 10.501 2.825 3.763 150 HA ALA 681 HA ALA 681 9.651 3.094 1.118 151 HB1 ALA 681 HB1 ALA 681 8.197 2.916 3.748 152 HB2 ALA 681 HB2 ALA 681 8.343 1.699 2.481 153 HB3 ALA 681 HB3 ALA 681 7.309 3.107 2.235 154 H GLU 682 H GLU 682 9.021 5.304 3.876 155 HA GLU 682 HA GLU 682 7.695 7.213 2.211 156 HB2 GLU 682 HB2 GLU 682 7.876 8.732 4.182 157 HB3 GLU 682 HB3 GLU 682 7.130 7.180 4.535 158 HG2 GLU 682 HG2 GLU 682 9.540 6.439 5.198 159 HG3 GLU 682 HG3 GLU 682 9.871 8.159 5.289 160 H SER 683 H SER 683 10.980 6.550 2.785 161 HA SER 683 HA SER 683 12.136 9.077 2.516 162 HB2 SER 683 HB2 SER 683 14.145 7.952 1.971 163 HB3 SER 683 HB3 SER 683 13.269 6.818 2.995 164 HG SER 683 HG SER 683 12.703 5.636 1.236 165 H ILE 684 H ILE 684 11.047 6.767 0.098 166 HA ILE 684 HA ILE 684 11.751 8.511 -2.117 167 HB ILE 684 HB ILE 684 9.998 6.065 -2.310 168 HG12 ILE 684 HG12 ILE 684 12.769 5.432 -2.747 169 HG13 ILE 684 HG13 ILE 684 12.605 6.140 -1.142 170 HG21 ILE 684 HG21 ILE 684 11.593 7.778 -4.107 171 HG22 ILE 684 HG22 ILE 684 11.827 6.049 -4.358 172 HG23 ILE 684 HG23 ILE 684 10.213 6.744 -4.466 173 HD11 ILE 684 HD11 ILE 684 10.583 4.540 -0.867 174 HD12 ILE 684 HD12 ILE 684 11.259 3.683 -2.253 175 HD13 ILE 684 HD13 ILE 684 12.203 3.850 -0.773 176 H LEU 685 H LEU 685 8.751 7.244 -0.670 177 HA LEU 685 HA LEU 685 6.913 8.628 -2.261 178 HB2 LEU 685 HB2 LEU 685 6.894 7.321 0.394 179 HB3 LEU 685 HB3 LEU 685 5.618 8.500 0.113 180 HG LEU 685 HG LEU 685 4.802 7.316 -1.789 181 HD11 LEU 685 HD11 LEU 685 6.074 5.171 -2.489 182 HD12 LEU 685 HD12 LEU 685 6.739 6.718 -3.005 183 HD13 LEU 685 HD13 LEU 685 7.447 5.871 -1.630 184 HD21 LEU 685 HD21 LEU 685 4.735 4.874 -0.833 185 HD22 LEU 685 HD22 LEU 685 5.563 5.589 0.549 186 HD23 LEU 685 HD23 LEU 685 3.970 6.176 0.074 187 H ALA 686 H ALA 686 8.572 9.646 0.730 188 HA ALA 686 HA ALA 686 7.182 12.121 0.961 189 HB1 ALA 686 HB1 ALA 686 8.424 11.106 2.828 190 HB2 ALA 686 HB2 ALA 686 8.959 12.755 2.511 191 HB3 ALA 686 HB3 ALA 686 9.939 11.390 1.972 192 H ASN 687 H ASN 687 10.136 11.120 -0.693 193 HA ASN 687 HA ASN 687 10.934 13.738 -1.520 194 HB2 ASN 687 HB2 ASN 687 12.765 12.475 -1.908 195 HB3 ASN 687 HB3 ASN 687 11.826 10.987 -1.904 196 HD21 ASN 687 HD21 ASN 687 12.316 13.840 -4.070 197 HD22 ASN 687 HD22 ASN 687 12.333 12.920 -5.494 198 H ARG 688 H ARG 688 8.968 11.169 -2.952 199 HA ARG 688 HA ARG 688 8.582 12.481 -5.471 200 HB2 ARG 688 HB2 ARG 688 7.445 10.109 -4.081 201 HB3 ARG 688 HB3 ARG 688 6.476 10.821 -5.366 202 HG2 ARG 688 HG2 ARG 688 7.739 9.524 -6.747 203 HG3 ARG 688 HG3 ARG 688 8.961 10.777 -6.534 204 HD2 ARG 688 HD2 ARG 688 10.195 9.515 -5.037 205 HD3 ARG 688 HD3 ARG 688 8.787 8.637 -4.458 206 HE ARG 688 HE ARG 688 9.037 7.112 -6.237 207 HH11 ARG 688 HH21 ARG 688 11.192 9.790 -6.538 208 HH12 ARG 688 HH22 ARG 688 12.197 9.012 -7.707 209 HH21 ARG 688 HH11 ARG 688 10.356 6.086 -7.719 210 HH22 ARG 688 HH12 ARG 688 11.722 6.929 -8.385 211 H SER 689 H SER 689 6.198 12.897 -6.194 212 HA SER 689 HA SER 689 5.206 15.067 -4.578 213 HB2 SER 689 HB2 SER 689 5.150 15.188 -7.029 214 HB3 SER 689 HB3 SER 689 4.065 13.801 -7.081 215 HG SER 689 HG SER 689 2.458 15.041 -6.477 216 H ASP 690 H ASP 690 2.697 15.190 -4.348 217 HA ASP 690 HA ASP 690 1.932 13.192 -2.472 218 HB2 ASP 690 HB2 ASP 690 0.773 15.664 -3.566 219 HB3 ASP 690 HB3 ASP 690 -0.406 14.450 -3.071 220 H GLY 691 H GLY 691 0.532 11.516 -2.618 221 HA2 GLY 691 HA2 GLY 691 -1.185 10.242 -3.731 222 HA3 GLY 691 HA3 GLY 691 -0.637 10.911 -5.268 223 H THR 692 H THR 692 2.178 10.496 -4.030 224 HA THR 692 HA THR 692 2.778 8.081 -5.396 225 HB THR 692 HB THR 692 4.531 9.332 -3.273 226 HG1 THR 692 HG1 THR 692 4.149 11.079 -4.489 227 HG21 THR 692 HG21 THR 692 4.959 7.125 -4.681 228 HG22 THR 692 HG22 THR 692 5.424 8.288 -5.923 229 HG23 THR 692 HG23 THR 692 6.261 8.273 -4.372 230 H PHE 693 H PHE 693 2.767 6.006 -4.692 231 HA PHE 693 HA PHE 693 2.658 5.526 -1.782 232 HB2 PHE 693 HB2 PHE 693 0.750 4.065 -1.985 233 HB3 PHE 693 HB3 PHE 693 0.331 5.623 -2.695 234 HD1 PHE 693 HD2 PHE 693 1.199 2.107 -3.425 235 HD2 PHE 693 HD1 PHE 693 0.008 5.883 -5.080 236 HE1 PHE 693 HE2 PHE 693 0.668 0.999 -5.578 237 HE2 PHE 693 HE1 PHE 693 -0.525 4.773 -7.234 238 HZ PHE 693 HZ PHE 693 -0.190 2.331 -7.483 239 H LEU 694 H LEU 694 2.962 3.245 -1.214 240 HA LEU 694 HA LEU 694 3.995 1.448 -3.204 241 HB2 LEU 694 HB2 LEU 694 6.279 1.393 -2.623 242 HB3 LEU 694 HB3 LEU 694 5.895 3.106 -2.761 243 HG LEU 694 HG LEU 694 5.358 2.869 -0.182 244 HD11 LEU 694 HD11 LEU 694 5.844 0.839 0.670 245 HD12 LEU 694 HD12 LEU 694 6.553 0.314 -0.857 246 HD13 LEU 694 HD13 LEU 694 7.541 1.168 0.325 247 HD21 LEU 694 HD21 LEU 694 7.644 3.634 -1.730 248 HD22 LEU 694 HD22 LEU 694 7.122 4.259 -0.166 249 HD23 LEU 694 HD23 LEU 694 8.204 2.871 -0.245 250 H VAL 695 H VAL 695 4.743 -0.597 -2.264 251 HA VAL 695 HA VAL 695 3.615 -1.065 0.436 252 HB VAL 695 HB VAL 695 3.402 -2.908 -1.955 253 HG11 VAL 695 HG11 VAL 695 2.266 -4.405 -0.541 254 HG12 VAL 695 HG12 VAL 695 3.603 -3.856 0.461 255 HG13 VAL 695 HG13 VAL 695 1.992 -3.183 0.697 256 HG21 VAL 695 HG21 VAL 695 1.926 -0.664 -1.557 257 HG22 VAL 695 HG22 VAL 695 1.276 -2.125 -2.292 258 HG23 VAL 695 HG23 VAL 695 1.007 -1.807 -0.581 259 H ARG 696 H ARG 696 4.811 -2.301 1.798 260 HA ARG 696 HA ARG 696 7.313 -3.465 0.709 261 HB2 ARG 696 HB2 ARG 696 8.351 -2.903 2.905 262 HB3 ARG 696 HB3 ARG 696 7.860 -1.484 1.980 263 HG2 ARG 696 HG2 ARG 696 5.767 -1.354 3.295 264 HG3 ARG 696 HG3 ARG 696 6.278 -2.756 4.237 265 HD2 ARG 696 HD2 ARG 696 7.841 -0.165 4.036 266 HD3 ARG 696 HD3 ARG 696 6.765 -0.577 5.369 267 HE ARG 696 HE ARG 696 9.210 -2.135 4.667 268 HH11 ARG 696 HH21 ARG 696 6.987 -0.819 6.987 269 HH12 ARG 696 HH22 ARG 696 7.777 -1.571 8.330 270 HH21 ARG 696 HH11 ARG 696 10.204 -3.052 6.415 271 HH22 ARG 696 HH12 ARG 696 9.580 -2.811 8.017 272 H GLN 697 H GLN 697 8.286 -5.097 2.188 273 HA GLN 697 HA GLN 697 6.191 -6.834 3.376 274 HB2 GLN 697 HB2 GLN 697 7.062 -7.813 1.330 275 HB3 GLN 697 HB3 GLN 697 8.720 -7.556 1.870 276 HG2 GLN 697 HG2 GLN 697 8.506 -9.747 2.529 277 HG3 GLN 697 HG3 GLN 697 7.816 -8.997 3.966 278 HE21 GLN 697 HE21 GLN 697 5.404 -8.890 4.078 279 HE22 GLN 697 HE22 GLN 697 4.482 -10.004 3.185 280 H ARG 698 H ARG 698 6.380 -6.786 5.546 281 HA ARG 698 HA ARG 698 8.670 -7.661 6.919 282 HB2 ARG 698 HB2 ARG 698 8.982 -5.022 6.052 283 HB3 ARG 698 HB3 ARG 698 8.511 -4.871 7.742 284 HG2 ARG 698 HG2 ARG 698 10.492 -6.996 7.291 285 HG3 ARG 698 HG3 ARG 698 11.076 -5.397 6.833 286 HD2 ARG 698 HD2 ARG 698 11.616 -5.449 9.104 287 HD3 ARG 698 HD3 ARG 698 10.043 -4.659 9.131 288 HE ARG 698 HE ARG 698 9.144 -6.541 10.159 289 HH11 ARG 698 HH21 ARG 698 12.295 -7.163 8.910 290 HH12 ARG 698 HH22 ARG 698 12.441 -8.718 9.650 291 HH21 ARG 698 HH11 ARG 698 9.321 -8.604 11.118 292 HH22 ARG 698 HH12 ARG 698 10.772 -9.525 10.880 293 H VAL 699 H VAL 699 8.275 -7.951 9.116 294 HA VAL 699 HA VAL 699 5.989 -6.668 10.371 295 HB VAL 699 HB VAL 699 4.827 -8.447 9.245 296 HG11 VAL 699 HG11 VAL 699 6.528 -10.523 10.602 297 HG12 VAL 699 HG12 VAL 699 5.532 -10.673 9.154 298 HG13 VAL 699 HG13 VAL 699 7.070 -9.815 9.081 299 HG21 VAL 699 HG21 VAL 699 3.874 -9.611 11.143 300 HG22 VAL 699 HG22 VAL 699 5.325 -9.336 12.104 301 HG23 VAL 699 HG23 VAL 699 4.286 -7.979 11.665 302 H LYS 700 H LYS 700 6.263 -6.457 12.493 303 HA LYS 700 HA LYS 700 8.108 -8.258 13.929 304 HB2 LYS 700 HB2 LYS 700 8.991 -6.233 15.166 305 HB3 LYS 700 HB3 LYS 700 9.492 -6.339 13.479 306 HG2 LYS 700 HG2 LYS 700 8.745 -4.198 13.341 307 HG3 LYS 700 HG3 LYS 700 7.147 -4.936 13.250 308 HD2 LYS 700 HD2 LYS 700 6.821 -4.688 15.638 309 HD3 LYS 700 HD3 LYS 700 8.486 -4.145 15.853 310 HE2 LYS 700 HE2 LYS 700 6.827 -2.264 15.832 311 HE3 LYS 700 HE3 LYS 700 8.050 -2.129 14.566 312 HZ1 LYS 700 HZ1 LYS 700 5.420 -3.456 14.113 313 HZ2 LYS 700 HZ2 LYS 700 5.662 -1.772 13.873 314 HZ3 LYS 700 HZ3 LYS 700 6.556 -2.887 12.947 315 H ASP 701 H ASP 701 5.206 -7.857 13.625 316 HA ASP 701 HA ASP 701 4.454 -7.995 16.414 317 HB2 ASP 701 HB2 ASP 701 2.596 -6.177 15.744 318 HB3 ASP 701 HB3 ASP 701 4.148 -5.707 16.436 319 H ALA 702 H ALA 702 2.977 -7.325 13.233 320 HA ALA 702 HA ALA 702 1.798 -9.937 12.998 321 HB1 ALA 702 HB1 ALA 702 -0.378 -9.579 13.611 322 HB2 ALA 702 HB2 ALA 702 -0.335 -7.872 13.169 323 HB3 ALA 702 HB3 ALA 702 0.370 -8.406 14.695 324 H ALA 703 H ALA 703 0.625 -10.194 10.984 325 HA ALA 703 HA ALA 703 -0.043 -9.626 8.821 326 HB1 ALA 703 HB1 ALA 703 1.311 -6.966 8.895 327 HB2 ALA 703 HB2 ALA 703 -0.138 -7.184 9.876 328 HB3 ALA 703 HB3 ALA 703 -0.206 -7.435 8.136 329 H GLU 704 H GLU 704 1.224 -8.762 6.701 330 HA GLU 704 HA GLU 704 4.021 -9.724 6.934 331 HB2 GLU 704 HB2 GLU 704 2.986 -10.305 4.324 332 HB3 GLU 704 HB3 GLU 704 3.591 -11.425 5.540 333 HG2 GLU 704 HG2 GLU 704 1.347 -12.108 5.111 334 HG3 GLU 704 HG3 GLU 704 1.284 -11.251 6.645 335 H PHE 705 H PHE 705 1.772 -7.990 4.749 336 HA PHE 705 HA PHE 705 4.077 -6.434 3.719 337 HB2 PHE 705 HB2 PHE 705 1.259 -6.641 2.640 338 HB3 PHE 705 HB3 PHE 705 2.598 -5.785 1.883 339 HD1 PHE 705 HD2 PHE 705 4.574 -7.034 1.030 340 HD2 PHE 705 HD1 PHE 705 1.070 -9.032 2.503 341 HE1 PHE 705 HE2 PHE 705 5.297 -9.129 -0.084 342 HE2 PHE 705 HE1 PHE 705 1.791 -11.123 1.388 343 HZ PHE 705 HZ PHE 705 3.905 -11.173 0.095 344 H ALA 706 H ALA 706 3.740 -4.141 3.261 345 HA ALA 706 HA ALA 706 1.730 -2.813 4.936 346 HB1 ALA 706 HB1 ALA 706 4.133 -3.084 6.043 347 HB2 ALA 706 HB2 ALA 706 3.193 -1.602 6.229 348 HB3 ALA 706 HB3 ALA 706 4.483 -1.683 5.033 349 H ILE 707 H ILE 707 0.775 -1.229 3.910 350 HA ILE 707 HA ILE 707 1.875 -0.306 1.341 351 HB ILE 707 HB ILE 707 -0.821 0.412 2.483 352 HG12 ILE 707 HG12 ILE 707 -1.454 -1.607 0.845 353 HG13 ILE 707 HG13 ILE 707 0.138 -2.179 1.342 354 HG21 ILE 707 HG21 ILE 707 0.455 0.339 -0.251 355 HG22 ILE 707 HG22 ILE 707 -1.297 0.327 -0.065 356 HG23 ILE 707 HG23 ILE 707 -0.355 1.685 0.550 357 HD11 ILE 707 HD11 ILE 707 -2.330 -2.177 2.842 358 HD12 ILE 707 HD12 ILE 707 -0.794 -2.932 3.246 359 HD13 ILE 707 HD13 ILE 707 -1.103 -1.259 3.697 360 H SER 708 H SER 708 2.679 1.669 1.044 361 HA SER 708 HA SER 708 2.263 3.668 3.184 362 HB2 SER 708 HB2 SER 708 4.755 3.170 1.555 363 HB3 SER 708 HB3 SER 708 4.537 4.524 2.656 364 HG SER 708 HG SER 708 4.422 1.747 3.305 365 H ILE 709 H ILE 709 1.425 5.604 2.522 366 HA ILE 709 HA ILE 709 1.488 6.183 -0.392 367 HB ILE 709 HB ILE 709 -0.818 7.142 1.238 368 HG12 ILE 709 HG12 ILE 709 -1.929 4.896 0.370 369 HG13 ILE 709 HG13 ILE 709 -0.280 4.282 0.529 370 HG21 ILE 709 HG21 ILE 709 -1.702 7.546 -0.799 371 HG22 ILE 709 HG22 ILE 709 -0.085 7.247 -1.434 372 HG23 ILE 709 HG23 ILE 709 -1.272 5.944 -1.394 373 HD11 ILE 709 HD11 ILE 709 -1.730 4.035 2.605 374 HD12 ILE 709 HD12 ILE 709 -0.202 4.866 2.853 375 HD13 ILE 709 HD13 ILE 709 -1.693 5.796 2.738 376 H LYS 710 H LYS 710 1.912 8.222 -1.012 377 HA LYS 710 HA LYS 710 2.706 10.145 1.064 378 HB2 LYS 710 HB2 LYS 710 4.355 9.836 -0.657 379 HB3 LYS 710 HB3 LYS 710 3.144 10.004 -1.925 380 HG2 LYS 710 HG2 LYS 710 4.257 12.096 -1.869 381 HG3 LYS 710 HG3 LYS 710 2.736 12.365 -1.029 382 HD2 LYS 710 HD2 LYS 710 3.746 12.523 1.049 383 HD3 LYS 710 HD3 LYS 710 5.146 11.551 0.572 384 HE2 LYS 710 HE2 LYS 710 4.554 14.291 -0.575 385 HE3 LYS 710 HE3 LYS 710 5.610 14.031 0.816 386 HZ1 LYS 710 HZ1 LYS 710 6.154 13.593 -1.980 387 HZ2 LYS 710 HZ2 LYS 710 7.240 13.662 -0.657 388 HZ3 LYS 710 HZ3 LYS 710 6.455 12.189 -1.046 389 H TYR 711 H TYR 711 0.921 11.183 1.797 390 HA TYR 711 HA TYR 711 -0.615 12.765 -0.144 391 HB2 TYR 711 HB2 TYR 711 -1.999 10.806 0.075 392 HB3 TYR 711 HB3 TYR 711 -1.825 10.814 1.829 393 HD1 TYR 711 HD1 TYR 711 -2.807 13.249 -0.866 394 HD2 TYR 711 HD2 TYR 711 -3.641 11.612 3.015 395 HE1 TYR 711 HE1 TYR 711 -4.797 14.722 -0.671 396 HE2 TYR 711 HE2 TYR 711 -5.630 13.086 3.212 397 HH TYR 711 HH TYR 711 -7.188 14.361 0.979 398 H ASN 712 H ASN 712 -0.271 14.749 0.519 399 HA ASN 712 HA ASN 712 -0.594 16.610 1.894 400 HB2 ASN 712 HB2 ASN 712 -2.145 15.200 3.332 401 HB3 ASN 712 HB3 ASN 712 -0.726 14.744 4.269 402 HD21 ASN 712 HD21 ASN 712 -0.266 16.070 6.005 403 HD22 ASN 712 HD22 ASN 712 -0.802 17.684 6.152 404 H VAL 713 H VAL 713 1.767 15.938 0.914 405 HA VAL 713 HA VAL 713 4.054 15.881 1.222 406 HB VAL 713 HB VAL 713 4.915 17.709 2.571 407 HG11 VAL 713 HG11 VAL 713 2.262 18.568 1.395 408 HG12 VAL 713 HG12 VAL 713 3.750 19.510 1.496 409 HG13 VAL 713 HG13 VAL 713 3.652 18.130 0.402 410 HG21 VAL 713 HG21 VAL 713 3.340 17.246 4.537 411 HG22 VAL 713 HG22 VAL 713 3.581 18.945 4.132 412 HG23 VAL 713 HG23 VAL 713 2.106 18.122 3.630 413 H GLU 714 H GLU 714 2.713 13.796 2.540 414 HA GLU 714 HA GLU 714 4.732 13.041 4.478 415 HB2 GLU 714 HB2 GLU 714 3.138 12.503 6.261 416 HB3 GLU 714 HB3 GLU 714 3.060 14.225 5.877 417 HG2 GLU 714 HG2 GLU 714 1.143 13.592 4.274 418 HG3 GLU 714 HG3 GLU 714 1.113 12.045 5.112 419 H VAL 715 H VAL 715 4.669 10.759 4.952 420 HA VAL 715 HA VAL 715 3.183 9.236 2.905 421 HB VAL 715 HB VAL 715 5.661 8.327 4.345 422 HG11 VAL 715 HG11 VAL 715 4.472 7.521 1.676 423 HG12 VAL 715 HG12 VAL 715 5.787 6.724 2.537 424 HG13 VAL 715 HG13 VAL 715 4.149 6.666 3.183 425 HG21 VAL 715 HG21 VAL 715 6.416 10.265 3.219 426 HG22 VAL 715 HG22 VAL 715 6.729 8.974 2.063 427 HG23 VAL 715 HG23 VAL 715 5.319 10.010 1.864 428 H LYS 716 H LYS 716 1.483 8.196 3.679 429 HA LYS 716 HA LYS 716 1.347 7.413 6.503 430 HB2 LYS 716 HB2 LYS 716 -0.758 6.793 4.438 431 HB3 LYS 716 HB3 LYS 716 -0.964 7.121 6.157 432 HG2 LYS 716 HG2 LYS 716 0.240 9.443 5.201 433 HG3 LYS 716 HG3 LYS 716 -0.881 8.997 3.912 434 HD2 LYS 716 HD2 LYS 716 -2.738 8.937 5.450 435 HD3 LYS 716 HD3 LYS 716 -1.661 9.119 6.834 436 HE2 LYS 716 HE2 LYS 716 -1.107 11.288 5.088 437 HE3 LYS 716 HE3 LYS 716 -2.865 11.175 5.221 438 HZ1 LYS 716 HZ1 LYS 716 -2.788 11.930 7.283 439 HZ2 LYS 716 HZ2 LYS 716 -1.655 10.764 7.741 440 HZ3 LYS 716 HZ3 LYS 716 -1.100 12.248 7.088 441 H HIS 717 H HIS 717 1.617 5.341 7.235 442 HA HIS 717 HA HIS 717 2.052 3.216 5.209 443 HB2 HIS 717 HB2 HIS 717 3.274 3.311 7.965 444 HB3 HIS 717 HB3 HIS 717 3.699 2.245 6.629 445 HD1 HIS 717 HD1 HIS 717 4.887 3.380 4.523 446 HD2 HIS 717 HD2 HIS 717 4.557 5.781 7.942 447 HE1 HIS 717 HE1 HIS 717 6.544 5.291 4.250 448 HE2 HIS 717 HE2 HIS 717 6.368 6.769 6.330 449 H ILE 718 H ILE 718 0.915 1.400 5.353 450 HA ILE 718 HA ILE 718 -0.428 0.726 7.895 451 HB ILE 718 HB ILE 718 -1.868 0.572 5.243 452 HG12 ILE 718 HG12 ILE 718 -2.841 2.549 7.184 453 HG13 ILE 718 HG13 ILE 718 -1.249 2.948 6.546 454 HG21 ILE 718 HG21 ILE 718 -2.782 0.396 8.132 455 HG22 ILE 718 HG22 ILE 718 -3.839 0.316 6.722 456 HG23 ILE 718 HG23 ILE 718 -2.649 -0.955 7.004 457 HD11 ILE 718 HD11 ILE 718 -2.715 3.919 4.985 458 HD12 ILE 718 HD12 ILE 718 -2.272 2.387 4.229 459 HD13 ILE 718 HD13 ILE 718 -3.827 2.551 5.047 460 H LYS 719 H LYS 719 -0.506 -1.428 8.320 461 HA LYS 719 HA LYS 719 1.048 -3.202 6.629 462 HB2 LYS 719 HB2 LYS 719 -0.285 -3.488 9.319 463 HB3 LYS 719 HB3 LYS 719 0.448 -4.862 8.488 464 HG2 LYS 719 HG2 LYS 719 2.535 -3.316 8.258 465 HG3 LYS 719 HG3 LYS 719 1.781 -2.374 9.545 466 HD2 LYS 719 HD2 LYS 719 2.150 -5.360 9.795 467 HD3 LYS 719 HD3 LYS 719 3.429 -4.239 10.246 468 HE2 LYS 719 HE2 LYS 719 2.221 -3.356 12.025 469 HE3 LYS 719 HE3 LYS 719 0.662 -3.775 11.308 470 HZ1 LYS 719 HZ1 LYS 719 2.583 -5.485 12.770 471 HZ2 LYS 719 HZ2 LYS 719 0.878 -5.381 12.920 472 HZ3 LYS 719 HZ3 LYS 719 1.560 -6.195 11.584 473 H ILE 720 H ILE 720 0.275 -5.010 5.513 474 HA ILE 720 HA ILE 720 -2.631 -4.948 5.024 475 HB ILE 720 HB ILE 720 -0.343 -5.381 3.359 476 HG12 ILE 720 HG12 ILE 720 -3.194 -5.632 2.463 477 HG13 ILE 720 HG13 ILE 720 -2.626 -4.100 3.122 478 HG21 ILE 720 HG21 ILE 720 -2.355 -7.659 3.395 479 HG22 ILE 720 HG22 ILE 720 -1.205 -7.364 2.093 480 HG23 ILE 720 HG23 ILE 720 -0.626 -7.785 3.703 481 HD11 ILE 720 HD11 ILE 720 -2.141 -3.837 0.846 482 HD12 ILE 720 HD12 ILE 720 -0.607 -4.437 1.480 483 HD13 ILE 720 HD13 ILE 720 -1.707 -5.536 0.646 484 H MET 721 H MET 721 -3.944 -6.707 5.190 485 HA MET 721 HA MET 721 -2.933 -8.911 6.889 486 HB2 MET 721 HB2 MET 721 -4.901 -7.233 7.513 487 HB3 MET 721 HB3 MET 721 -5.842 -8.346 6.524 488 HG2 MET 721 HG2 MET 721 -5.889 -9.032 8.896 489 HG3 MET 721 HG3 MET 721 -5.075 -10.243 7.911 490 HE1 MET 721 HE1 MET 721 -3.634 -6.950 10.443 491 HE2 MET 721 HE2 MET 721 -5.229 -7.677 10.287 492 HE3 MET 721 HE3 MET 721 -4.097 -8.274 11.509 493 H THR 722 H THR 722 -3.895 -11.055 6.483 494 HA THR 722 HA THR 722 -4.565 -11.439 3.619 495 HB THR 722 HB THR 722 -2.474 -12.472 3.864 496 HG1 THR 722 HG1 THR 722 -4.524 -14.350 4.441 497 HG21 THR 722 HG21 THR 722 -3.478 -13.439 6.554 498 HG22 THR 722 HG22 THR 722 -1.958 -13.954 5.826 499 HG23 THR 722 HG23 THR 722 -2.197 -12.262 6.259 500 H ALA 723 H ALA 723 -6.702 -10.896 4.969 501 HA ALA 723 HA ALA 723 -7.948 -12.908 6.490 502 HB1 ALA 723 HB1 ALA 723 -9.963 -11.684 6.166 503 HB2 ALA 723 HB2 ALA 723 -9.364 -10.963 4.670 504 HB3 ALA 723 HB3 ALA 723 -8.661 -10.494 6.219 505 H GLU 724 H GLU 724 -8.589 -14.863 5.943 506 HA GLU 724 HA GLU 724 -9.046 -16.713 4.642 507 HB2 GLU 724 HB2 GLU 724 -10.825 -14.961 2.987 508 HB3 GLU 724 HB3 GLU 724 -11.122 -16.583 3.613 509 HG2 GLU 724 HG2 GLU 724 -11.326 -13.940 5.026 510 HG3 GLU 724 HG3 GLU 724 -12.461 -15.284 5.019 511 H GLY 725 H GLY 725 -6.894 -14.813 3.669 512 HA2 GLY 725 HA2 GLY 725 -5.331 -15.308 1.938 513 HA3 GLY 725 HA3 GLY 725 -6.647 -15.971 0.973 514 H LEU 726 H LEU 726 -7.921 -13.217 2.191 515 HA LEU 726 HA LEU 726 -7.297 -11.736 -0.270 516 HB2 LEU 726 HB2 LEU 726 -9.281 -10.954 1.875 517 HB3 LEU 726 HB3 LEU 726 -9.209 -10.388 0.207 518 HG LEU 726 HG LEU 726 -9.664 -13.287 0.943 519 HD11 LEU 726 HD11 LEU 726 -11.922 -12.945 1.072 520 HD12 LEU 726 HD12 LEU 726 -11.431 -11.327 1.570 521 HD13 LEU 726 HD13 LEU 726 -11.896 -11.631 -0.104 522 HD21 LEU 726 HD21 LEU 726 -9.038 -11.959 -1.474 523 HD22 LEU 726 HD22 LEU 726 -9.578 -13.627 -1.287 524 HD23 LEU 726 HD23 LEU 726 -10.756 -12.346 -1.571 525 H TYR 727 H TYR 727 -6.288 -9.763 -0.313 526 HA TYR 727 HA TYR 727 -4.858 -9.018 2.124 527 HB2 TYR 727 HB2 TYR 727 -4.560 -8.295 -0.775 528 HB3 TYR 727 HB3 TYR 727 -3.724 -7.398 0.485 529 HD1 TYR 727 HD2 TYR 727 -4.211 -10.774 1.530 530 HD2 TYR 727 HD1 TYR 727 -1.738 -8.314 -0.962 531 HE1 TYR 727 HE2 TYR 727 -2.434 -12.497 1.595 532 HE2 TYR 727 HE1 TYR 727 0.047 -10.022 -0.894 533 HH TYR 727 HH TYR 727 -0.157 -12.793 1.231 534 H ARG 728 H ARG 728 -5.178 -7.162 3.220 535 HA ARG 728 HA ARG 728 -6.983 -5.136 2.113 536 HB2 ARG 728 HB2 ARG 728 -8.089 -5.217 4.528 537 HB3 ARG 728 HB3 ARG 728 -8.685 -6.220 3.216 538 HG2 ARG 728 HG2 ARG 728 -7.098 -8.036 4.033 539 HG3 ARG 728 HG3 ARG 728 -6.827 -7.030 5.450 540 HD2 ARG 728 HD2 ARG 728 -9.640 -7.180 5.059 541 HD3 ARG 728 HD3 ARG 728 -9.005 -8.818 4.922 542 HE ARG 728 HE ARG 728 -7.879 -7.521 7.201 543 HH11 ARG 728 HH21 ARG 728 -10.794 -8.913 6.007 544 HH12 ARG 728 HH22 ARG 728 -11.402 -9.312 7.573 545 HH21 ARG 728 HH11 ARG 728 -8.659 -7.983 9.239 546 HH22 ARG 728 HH12 ARG 728 -10.197 -8.799 9.401 547 H ILE 729 H ILE 729 -6.683 -3.122 2.901 548 HA ILE 729 HA ILE 729 -4.238 -2.673 4.445 549 HB ILE 729 HB ILE 729 -6.048 -0.582 3.240 550 HG12 ILE 729 HG12 ILE 729 -3.902 -2.254 1.906 551 HG13 ILE 729 HG13 ILE 729 -5.592 -2.120 1.435 552 HG21 ILE 729 HG21 ILE 729 -4.448 0.505 4.526 553 HG22 ILE 729 HG22 ILE 729 -3.226 -0.738 4.243 554 HG23 ILE 729 HG23 ILE 729 -3.618 0.420 2.972 555 HD11 ILE 729 HD11 ILE 729 -4.737 -0.598 -0.049 556 HD12 ILE 729 HD12 ILE 729 -4.907 0.485 1.334 557 HD13 ILE 729 HD13 ILE 729 -3.341 -0.238 0.968 558 H THR 730 H THR 730 -7.704 -2.261 4.690 559 HA THR 730 HA THR 730 -7.358 -1.146 7.417 560 HB THR 730 HB THR 730 -8.300 0.450 5.822 561 HG1 THR 730 HG1 THR 730 -9.910 1.092 7.107 562 HG21 THR 730 HG21 THR 730 -10.350 0.079 4.667 563 HG22 THR 730 HG22 THR 730 -9.368 -1.356 4.380 564 HG23 THR 730 HG23 THR 730 -10.666 -1.394 5.568 565 H GLU 731 H GLU 731 -8.174 -3.872 5.810 566 HA GLU 731 HA GLU 731 -9.097 -5.843 6.543 567 HB2 GLU 731 HB2 GLU 731 -9.996 -4.403 9.037 568 HB3 GLU 731 HB3 GLU 731 -9.722 -6.131 8.820 569 HG2 GLU 731 HG2 GLU 731 -7.305 -5.043 8.040 570 HG3 GLU 731 HG3 GLU 731 -7.784 -3.987 9.364 571 H LYS 732 H LYS 732 -10.801 -2.895 6.513 572 HA LYS 732 HA LYS 732 -13.466 -3.975 6.562 573 HB2 LYS 732 HB2 LYS 732 -12.744 -1.305 5.392 574 HB3 LYS 732 HB3 LYS 732 -14.180 -1.761 6.310 575 HG2 LYS 732 HG2 LYS 732 -11.371 -1.477 7.416 576 HG3 LYS 732 HG3 LYS 732 -12.705 -0.367 7.688 577 HD2 LYS 732 HD2 LYS 732 -13.282 -3.193 8.358 578 HD3 LYS 732 HD3 LYS 732 -12.069 -2.418 9.373 579 HE2 LYS 732 HE2 LYS 732 -14.531 -0.858 8.775 580 HE3 LYS 732 HE3 LYS 732 -14.687 -2.220 9.888 581 HZ1 LYS 732 HZ1 LYS 732 -13.538 -1.183 11.481 582 HZ2 LYS 732 HZ2 LYS 732 -12.347 -0.591 10.378 583 HZ3 LYS 732 HZ3 LYS 732 -13.823 0.248 10.577 584 H LYS 733 H LYS 733 -11.100 -3.077 4.144 585 HA LYS 733 HA LYS 733 -12.803 -4.274 2.042 586 HB2 LYS 733 HB2 LYS 733 -12.785 -1.826 1.798 587 HB3 LYS 733 HB3 LYS 733 -11.025 -1.833 1.777 588 HG2 LYS 733 HG2 LYS 733 -11.528 -1.809 -0.505 589 HG3 LYS 733 HG3 LYS 733 -11.316 -3.534 -0.204 590 HD2 LYS 733 HD2 LYS 733 -13.528 -3.995 -0.523 591 HD3 LYS 733 HD3 LYS 733 -14.054 -2.516 0.282 592 HE2 LYS 733 HE2 LYS 733 -12.651 -2.147 -2.304 593 HE3 LYS 733 HE3 LYS 733 -14.239 -2.908 -2.397 594 HZ1 LYS 733 HZ1 LYS 733 -13.549 -0.164 -1.776 595 HZ2 LYS 733 HZ2 LYS 733 -15.046 -0.836 -2.271 596 HZ3 LYS 733 HZ3 LYS 733 -14.605 -0.866 -0.633 597 H ALA 734 H ALA 734 -11.856 -6.062 1.298 598 HA ALA 734 HA ALA 734 -8.894 -6.193 1.242 599 HB1 ALA 734 HB1 ALA 734 -10.666 -8.620 1.358 600 HB2 ALA 734 HB2 ALA 734 -10.245 -7.745 2.831 601 HB3 ALA 734 HB3 ALA 734 -8.976 -8.456 1.834 602 H PHE 735 H PHE 735 -8.186 -8.030 -0.332 603 HA PHE 735 HA PHE 735 -9.845 -8.253 -2.722 604 HB2 PHE 735 HB2 PHE 735 -7.552 -6.426 -2.525 605 HB3 PHE 735 HB3 PHE 735 -7.507 -7.500 -3.921 606 HD1 PHE 735 HD2 PHE 735 -9.403 -7.542 -5.538 607 HD2 PHE 735 HD1 PHE 735 -9.204 -4.700 -2.328 608 HE1 PHE 735 HE2 PHE 735 -11.150 -6.175 -6.644 609 HE2 PHE 735 HE1 PHE 735 -10.952 -3.330 -3.434 610 HZ PHE 735 HZ PHE 735 -11.928 -4.071 -5.590 611 H ARG 736 H ARG 736 -8.610 -9.527 -4.453 612 HA ARG 736 HA ARG 736 -8.046 -12.075 -3.600 613 HB2 ARG 736 HB2 ARG 736 -7.313 -10.533 -6.051 614 HB3 ARG 736 HB3 ARG 736 -6.606 -12.127 -5.811 615 HG2 ARG 736 HG2 ARG 736 -8.542 -12.725 -6.919 616 HG3 ARG 736 HG3 ARG 736 -9.124 -12.781 -5.254 617 HD2 ARG 736 HD2 ARG 736 -10.712 -11.507 -6.517 618 HD3 ARG 736 HD3 ARG 736 -9.819 -10.373 -5.512 619 HE ARG 736 HE ARG 736 -8.387 -10.391 -7.849 620 HH11 ARG 736 HH21 ARG 736 -11.757 -10.016 -7.136 621 HH12 ARG 736 HH22 ARG 736 -12.023 -8.857 -8.389 622 HH21 ARG 736 HH11 ARG 736 -8.710 -8.843 -9.420 623 HH22 ARG 736 HH12 ARG 736 -10.309 -8.199 -9.684 624 H GLY 737 H GLY 737 -5.635 -9.616 -4.480 625 HA2 GLY 737 HA2 GLY 737 -3.754 -10.811 -2.562 626 HA3 GLY 737 HA3 GLY 737 -3.250 -10.623 -4.239 627 H LEU 738 H LEU 738 -1.581 -9.211 -3.508 628 HA LEU 738 HA LEU 738 -2.218 -6.757 -2.159 629 HB2 LEU 738 HB2 LEU 738 0.132 -8.219 -2.777 630 HB3 LEU 738 HB3 LEU 738 0.303 -6.637 -3.535 631 HG LEU 738 HG LEU 738 -0.513 -7.029 -0.642 632 HD11 LEU 738 HD11 LEU 738 2.192 -6.263 -1.763 633 HD12 LEU 738 HD12 LEU 738 1.768 -6.444 -0.061 634 HD13 LEU 738 HD13 LEU 738 1.795 -7.854 -1.115 635 HD21 LEU 738 HD21 LEU 738 0.124 -4.619 -0.524 636 HD22 LEU 738 HD22 LEU 738 0.356 -4.632 -2.273 637 HD23 LEU 738 HD23 LEU 738 -1.245 -4.918 -1.591 638 H THR 739 H THR 739 -1.198 -7.589 -5.467 639 HA THR 739 HA THR 739 -1.331 -5.051 -6.593 640 HB THR 739 HB THR 739 -2.261 -7.554 -8.020 641 HG1 THR 739 HG1 THR 739 -0.361 -8.331 -7.646 642 HG21 THR 739 HG21 THR 739 -0.780 -6.204 -9.790 643 HG22 THR 739 HG22 THR 739 -2.490 -5.866 -9.555 644 HG23 THR 739 HG23 THR 739 -1.278 -4.849 -8.782 645 H GLU 740 H GLU 740 -3.918 -7.528 -6.538 646 HA GLU 740 HA GLU 740 -5.937 -5.872 -7.602 647 HB2 GLU 740 HB2 GLU 740 -6.438 -8.095 -5.621 648 HB3 GLU 740 HB3 GLU 740 -7.489 -7.544 -6.924 649 HG2 GLU 740 HG2 GLU 740 -5.037 -8.243 -8.151 650 HG3 GLU 740 HG3 GLU 740 -5.393 -9.531 -7.002 651 H LEU 741 H LEU 741 -4.630 -6.151 -4.416 652 HA LEU 741 HA LEU 741 -6.795 -4.725 -3.132 653 HB2 LEU 741 HB2 LEU 741 -5.538 -6.488 -1.978 654 HB3 LEU 741 HB3 LEU 741 -4.054 -5.561 -2.146 655 HG LEU 741 HG LEU 741 -5.308 -5.455 0.101 656 HD11 LEU 741 HD11 LEU 741 -4.114 -3.594 0.461 657 HD12 LEU 741 HD12 LEU 741 -3.670 -3.687 -1.239 658 HD13 LEU 741 HD13 LEU 741 -5.019 -2.670 -0.735 659 HD21 LEU 741 HD21 LEU 741 -6.997 -3.491 -1.468 660 HD22 LEU 741 HD22 LEU 741 -7.548 -5.092 -0.977 661 HD23 LEU 741 HD23 LEU 741 -7.141 -3.888 0.242 662 H VAL 742 H VAL 742 -3.516 -4.013 -4.281 663 HA VAL 742 HA VAL 742 -3.715 -1.236 -3.350 664 HB VAL 742 HB VAL 742 -1.556 -2.903 -4.594 665 HG11 VAL 742 HG11 VAL 742 -1.356 -0.904 -5.894 666 HG12 VAL 742 HG12 VAL 742 -1.687 0.117 -4.494 667 HG13 VAL 742 HG13 VAL 742 -0.167 -0.771 -4.600 668 HG21 VAL 742 HG21 VAL 742 -0.955 -1.050 -2.408 669 HG22 VAL 742 HG22 VAL 742 -2.250 -2.181 -2.007 670 HG23 VAL 742 HG23 VAL 742 -0.675 -2.787 -2.514 671 H GLU 743 H GLU 743 -4.146 -3.065 -6.291 672 HA GLU 743 HA GLU 743 -4.082 -0.700 -7.971 673 HB2 GLU 743 HB2 GLU 743 -4.897 -3.560 -8.536 674 HB3 GLU 743 HB3 GLU 743 -4.894 -2.280 -9.749 675 HG2 GLU 743 HG2 GLU 743 -2.458 -3.090 -8.127 676 HG3 GLU 743 HG3 GLU 743 -2.799 -3.672 -9.753 677 H PHE 744 H PHE 744 -6.187 -1.622 -5.714 678 HA PHE 744 HA PHE 744 -8.523 -0.662 -7.257 679 HB2 PHE 744 HB2 PHE 744 -8.549 -3.034 -6.177 680 HB3 PHE 744 HB3 PHE 744 -8.788 -2.157 -4.665 681 HD1 PHE 744 HD2 PHE 744 -10.221 -2.942 -7.968 682 HD2 PHE 744 HD1 PHE 744 -10.817 -0.861 -4.261 683 HE1 PHE 744 HE2 PHE 744 -12.613 -2.619 -8.534 684 HE2 PHE 744 HE1 PHE 744 -13.210 -0.538 -4.826 685 HZ PHE 744 HZ PHE 744 -14.107 -1.417 -6.963 686 H TYR 745 H TYR 745 -6.799 -0.483 -4.156 687 HA TYR 745 HA TYR 745 -8.454 1.472 -2.963 688 HB2 TYR 745 HB2 TYR 745 -5.610 0.618 -2.558 689 HB3 TYR 745 HB3 TYR 745 -6.171 2.107 -1.805 690 HD1 TYR 745 HD1 TYR 745 -7.634 -1.309 -2.381 691 HD2 TYR 745 HD2 TYR 745 -6.812 1.849 0.430 692 HE1 TYR 745 HE1 TYR 745 -8.695 -2.633 -0.564 693 HE2 TYR 745 HE2 TYR 745 -7.858 0.510 2.226 694 HH TYR 745 HH TYR 745 -9.003 -2.807 1.680 695 H GLN 746 H GLN 746 -6.336 1.602 -5.625 696 HA GLN 746 HA GLN 746 -5.545 4.328 -5.560 697 HB2 GLN 746 HB2 GLN 746 -5.315 4.000 -8.077 698 HB3 GLN 746 HB3 GLN 746 -4.394 2.879 -7.072 699 HG2 GLN 746 HG2 GLN 746 -5.617 1.085 -7.721 700 HG3 GLN 746 HG3 GLN 746 -7.133 1.975 -7.705 701 HE21 GLN 746 HE21 GLN 746 -4.585 0.789 -9.745 702 HE22 GLN 746 HE22 GLN 746 -5.151 1.481 -11.188 703 H GLN 747 H GLN 747 -8.504 2.725 -6.231 704 HA GLN 747 HA GLN 747 -9.716 5.199 -7.318 705 HB2 GLN 747 HB2 GLN 747 -11.071 2.510 -7.273 706 HB3 GLN 747 HB3 GLN 747 -11.351 3.873 -8.355 707 HG2 GLN 747 HG2 GLN 747 -8.606 3.022 -8.592 708 HG3 GLN 747 HG3 GLN 747 -9.663 1.631 -8.797 709 HE21 GLN 747 HE21 GLN 747 -8.034 3.159 -10.837 710 HE22 GLN 747 HE22 GLN 747 -9.169 3.633 -12.018 711 H ASN 748 H ASN 748 -9.946 2.692 -4.867 712 HA ASN 748 HA ASN 748 -12.303 3.668 -3.603 713 HB2 ASN 748 HB2 ASN 748 -11.081 1.355 -3.407 714 HB3 ASN 748 HB3 ASN 748 -10.163 2.154 -2.138 715 HD21 ASN 748 HD21 ASN 748 -11.792 3.494 -0.589 716 HD22 ASN 748 HD22 ASN 748 -13.140 2.597 -0.061 717 H SER 749 H SER 749 -12.383 5.701 -2.834 718 HA SER 749 HA SER 749 -10.306 7.362 -2.086 719 HB2 SER 749 HB2 SER 749 -11.924 8.765 -1.065 720 HB3 SER 749 HB3 SER 749 -12.769 7.949 -2.375 721 HG SER 749 HG SER 749 -12.729 6.647 0.088 722 H LEU 750 H LEU 750 -8.758 6.937 -0.674 723 HA LEU 750 HA LEU 750 -8.752 5.068 1.349 724 HB2 LEU 750 HB2 LEU 750 -7.257 7.695 1.245 725 HB3 LEU 750 HB3 LEU 750 -6.873 6.366 2.339 726 HG LEU 750 HG LEU 750 -6.821 6.297 -0.686 727 HD11 LEU 750 HD11 LEU 750 -4.383 5.477 0.127 728 HD12 LEU 750 HD12 LEU 750 -4.765 7.168 -0.194 729 HD13 LEU 750 HD13 LEU 750 -4.787 6.557 1.460 730 HD21 LEU 750 HD21 LEU 750 -6.812 4.139 1.372 731 HD22 LEU 750 HD22 LEU 750 -7.452 4.120 -0.272 732 HD23 LEU 750 HD23 LEU 750 -5.719 3.957 0.002 733 H LYS 751 H LYS 751 -10.167 8.262 1.420 734 HA LYS 751 HA LYS 751 -10.333 8.653 4.199 735 HB2 LYS 751 HB2 LYS 751 -11.944 10.313 3.739 736 HB3 LYS 751 HB3 LYS 751 -10.925 10.285 2.303 737 HG2 LYS 751 HG2 LYS 751 -12.666 8.534 1.418 738 HG3 LYS 751 HG3 LYS 751 -13.718 9.227 2.653 739 HD2 LYS 751 HD2 LYS 751 -12.322 10.759 0.432 740 HD3 LYS 751 HD3 LYS 751 -14.044 10.389 0.508 741 HE2 LYS 751 HE2 LYS 751 -12.551 12.044 2.571 742 HE3 LYS 751 HE3 LYS 751 -13.515 12.716 1.257 743 HZ1 LYS 751 HZ1 LYS 751 -14.417 11.926 3.742 744 HZ2 LYS 751 HZ2 LYS 751 -15.369 12.365 2.404 745 HZ3 LYS 751 HZ3 LYS 751 -14.978 10.735 2.667 746 H ASP 752 H ASP 752 -11.800 6.313 2.233 747 HA ASP 752 HA ASP 752 -14.014 5.843 4.111 748 HB2 ASP 752 HB2 ASP 752 -14.965 5.545 2.067 749 HB3 ASP 752 HB3 ASP 752 -13.426 5.202 1.292 750 H CYS 753 H CYS 753 -11.171 4.233 2.734 751 HA CYS 753 HA CYS 753 -11.482 1.910 4.449 752 HB2 CYS 753 HB2 CYS 753 -9.318 2.720 2.494 753 HB3 CYS 753 HB3 CYS 753 -9.361 1.187 3.358 754 HG CYS 753 HG CYS 753 -11.950 1.705 1.821 755 H PHE 754 H PHE 754 -9.224 4.627 4.086 756 HA PHE 754 HA PHE 754 -7.665 3.805 6.390 757 HB2 PHE 754 HB2 PHE 754 -7.589 6.263 4.629 758 HB3 PHE 754 HB3 PHE 754 -6.447 5.958 5.930 759 HD1 PHE 754 HD2 PHE 754 -7.528 2.868 4.464 760 HD2 PHE 754 HD1 PHE 754 -4.821 6.151 3.864 761 HE1 PHE 754 HE2 PHE 754 -6.170 1.477 2.942 762 HE2 PHE 754 HE1 PHE 754 -3.481 4.758 2.336 763 HZ PHE 754 HZ PHE 754 -4.143 2.418 1.874 764 H LYS 755 H LYS 755 -7.737 7.085 6.708 765 HA LYS 755 HA LYS 755 -10.057 7.151 8.528 766 HB2 LYS 755 HB2 LYS 755 -8.159 6.501 9.906 767 HB3 LYS 755 HB3 LYS 755 -7.246 7.888 9.329 768 HG2 LYS 755 HG2 LYS 755 -8.865 9.423 10.346 769 HG3 LYS 755 HG3 LYS 755 -9.883 8.064 10.822 770 HD2 LYS 755 HD2 LYS 755 -8.738 8.045 12.762 771 HD3 LYS 755 HD3 LYS 755 -7.386 7.395 11.840 772 HE2 LYS 755 HE2 LYS 755 -7.933 10.329 12.402 773 HE3 LYS 755 HE3 LYS 755 -6.632 9.357 13.091 774 HZ1 LYS 755 HZ1 LYS 755 -6.432 9.042 10.355 775 HZ2 LYS 755 HZ2 LYS 755 -6.736 10.707 10.567 776 HZ3 LYS 755 HZ3 LYS 755 -5.405 9.963 11.340 777 H SER 756 H SER 756 -7.775 9.655 8.956 778 HA SER 756 HA SER 756 -9.605 11.572 7.820 779 HB2 SER 756 HB2 SER 756 -7.358 13.024 8.391 780 HB3 SER 756 HB3 SER 756 -8.622 12.658 9.562 781 HG SER 756 HG SER 756 -6.254 11.151 9.049 782 H LEU 757 H LEU 757 -8.644 9.700 5.955 783 HA LEU 757 HA LEU 757 -6.649 11.086 4.334 784 HB2 LEU 757 HB2 LEU 757 -7.922 8.390 4.343 785 HB3 LEU 757 HB3 LEU 757 -7.349 9.010 2.800 786 HG LEU 757 HG LEU 757 -5.725 7.623 4.318 787 HD11 LEU 757 HD11 LEU 757 -3.815 9.159 3.564 788 HD12 LEU 757 HD12 LEU 757 -4.891 8.543 2.311 789 HD13 LEU 757 HD13 LEU 757 -5.079 10.193 2.898 790 HD21 LEU 757 HD21 LEU 757 -4.594 8.733 6.027 791 HD22 LEU 757 HD22 LEU 757 -5.100 10.325 5.465 792 HD23 LEU 757 HD23 LEU 757 -6.256 9.262 6.268 793 H ASP 758 H ASP 758 -7.177 11.100 1.915 794 HA ASP 758 HA ASP 758 -9.874 11.439 1.059 795 HB2 ASP 758 HB2 ASP 758 -8.606 13.719 2.297 796 HB3 ASP 758 HB3 ASP 758 -8.897 14.054 0.591 797 H THR 759 H THR 759 -7.870 9.892 0.164 798 HA THR 759 HA THR 759 -7.500 10.841 -2.552 799 HB THR 759 HB THR 759 -5.550 11.820 -1.388 800 HG1 THR 759 HG1 THR 759 -4.623 11.352 -3.197 801 HG21 THR 759 HG21 THR 759 -3.928 9.631 -0.840 802 HG22 THR 759 HG22 THR 759 -4.751 10.620 0.362 803 HG23 THR 759 HG23 THR 759 -5.496 9.131 -0.212 804 H THR 760 H THR 760 -5.465 9.047 -3.219 805 HA THR 760 HA THR 760 -6.183 6.369 -2.375 806 HB THR 760 HB THR 760 -6.899 5.574 -4.568 807 HG1 THR 760 HG1 THR 760 -7.005 6.840 -6.267 808 HG21 THR 760 HG21 THR 760 -8.571 6.468 -2.884 809 HG22 THR 760 HG22 THR 760 -8.611 7.947 -3.845 810 HG23 THR 760 HG23 THR 760 -9.125 6.418 -4.555 811 H LEU 761 H LEU 761 -5.011 4.740 -3.827 812 HA LEU 761 HA LEU 761 -2.246 5.257 -3.824 813 HB2 LEU 761 HB2 LEU 761 -3.890 3.159 -5.282 814 HB3 LEU 761 HB3 LEU 761 -2.138 3.145 -5.215 815 HG LEU 761 HG LEU 761 -3.381 1.660 -3.527 816 HD11 LEU 761 HD11 LEU 761 -1.296 3.682 -2.802 817 HD12 LEU 761 HD12 LEU 761 -1.849 2.496 -1.623 818 HD13 LEU 761 HD13 LEU 761 -1.105 1.957 -3.127 819 HD21 LEU 761 HD21 LEU 761 -5.085 3.317 -2.838 820 HD22 LEU 761 HD22 LEU 761 -4.134 2.751 -1.470 821 HD23 LEU 761 HD23 LEU 761 -3.809 4.334 -2.166 822 H GLN 762 H GLN 762 -2.151 7.307 -4.912 823 HA GLN 762 HA GLN 762 -3.030 7.682 -7.587 824 HB2 GLN 762 HB2 GLN 762 -1.815 9.225 -5.491 825 HB3 GLN 762 HB3 GLN 762 -0.990 9.544 -7.014 826 HG2 GLN 762 HG2 GLN 762 -3.790 9.486 -7.559 827 HG3 GLN 762 HG3 GLN 762 -3.551 10.488 -6.129 828 HE21 GLN 762 HE21 GLN 762 -1.457 12.018 -6.452 829 HE22 GLN 762 HE22 GLN 762 -1.425 12.827 -7.941 830 H PHE 763 H PHE 763 0.333 7.618 -6.341 831 HA PHE 763 HA PHE 763 1.100 6.331 -8.895 832 HB2 PHE 763 HB2 PHE 763 2.430 8.728 -7.619 833 HB3 PHE 763 HB3 PHE 763 3.126 7.802 -8.949 834 HD1 PHE 763 HD1 PHE 763 1.810 7.600 -11.123 835 HD2 PHE 763 HD2 PHE 763 0.773 10.377 -8.013 836 HE1 PHE 763 HE1 PHE 763 0.451 8.903 -12.735 837 HE2 PHE 763 HE2 PHE 763 -0.585 11.675 -9.627 838 HZ PHE 763 HZ PHE 763 -0.748 10.940 -11.987 839 HA PRO 764 HA PRO 764 3.599 3.726 -6.345 840 HB2 PRO 764 HB2 PRO 764 5.337 2.784 -8.197 841 HB3 PRO 764 HB3 PRO 764 3.620 2.340 -8.210 842 HG2 PRO 764 HG2 PRO 764 5.072 4.326 -9.866 843 HG3 PRO 764 HG3 PRO 764 3.791 3.197 -10.322 844 HD2 PRO 764 HD2 PRO 764 3.365 5.871 -9.817 845 HD3 PRO 764 HD3 PRO 764 2.115 4.614 -9.659 846 H PHE 765 H PHE 765 6.336 3.200 -6.605 847 HA PHE 765 HA PHE 765 7.527 5.878 -6.263 848 HB2 PHE 765 HB2 PHE 765 8.721 5.206 -4.355 849 HB3 PHE 765 HB3 PHE 765 7.118 4.517 -4.115 850 HD1 PHE 765 HD1 PHE 765 6.713 2.098 -4.698 851 HD2 PHE 765 HD2 PHE 765 10.644 3.818 -4.555 852 HE1 PHE 765 HE1 PHE 765 7.700 -0.170 -4.553 853 HE2 PHE 765 HE2 PHE 765 11.632 1.550 -4.411 854 HZ PHE 765 HZ PHE 765 10.159 -0.444 -4.410 855 H LYS 766 H LYS 766 7.753 2.748 -7.704 856 HA LYS 766 HA LYS 766 10.584 3.029 -8.310 857 HB2 LYS 766 HB2 LYS 766 8.567 1.055 -9.384 858 HB3 LYS 766 HB3 LYS 766 10.313 0.966 -9.585 859 HG2 LYS 766 HG2 LYS 766 10.118 1.241 -6.876 860 HG3 LYS 766 HG3 LYS 766 8.657 0.322 -7.220 861 HD2 LYS 766 HD2 LYS 766 11.059 -0.623 -8.642 862 HD3 LYS 766 HD3 LYS 766 11.132 -0.785 -6.891 863 HE2 LYS 766 HE2 LYS 766 9.962 -2.705 -7.182 864 HE3 LYS 766 HE3 LYS 766 8.570 -1.659 -7.457 865 HZ1 LYS 766 HZ1 LYS 766 10.110 -3.222 -9.349 866 HZ2 LYS 766 HZ2 LYS 766 8.482 -2.695 -9.441 867 HZ3 LYS 766 HZ3 LYS 766 9.757 -1.643 -9.866 868 H GLU 767 H GLU 767 7.489 3.371 -9.980 869 HA GLU 767 HA GLU 767 7.236 3.745 -12.341 870 HB2 GLU 767 HB2 GLU 767 7.199 5.892 -10.470 871 HB3 GLU 767 HB3 GLU 767 7.841 6.514 -11.991 872 HG2 GLU 767 HG2 GLU 767 5.869 5.152 -13.062 873 HG3 GLU 767 HG3 GLU 767 5.172 5.237 -11.456 874 H1 ASP 338 H1 ASP 338 12.510 8.329 13.723 875 H2 ASP 338 H2 ASP 338 12.486 8.163 13.816 876 H3 ASP 338 H3 ASP 338 13.795 8.968 13.082 877 HA ASP 338 HA ASP 338 15.129 7.235 13.393 878 HB2 ASP 338 HB2 ASP 338 15.335 6.336 15.805 879 HB3 ASP 338 HB3 ASP 338 15.751 8.033 15.554 880 H THR 339 H THR 339 12.947 6.130 15.911 881 HA THR 339 HA THR 339 12.526 3.578 14.765 882 HB THR 339 HB THR 339 10.609 4.799 16.729 883 HG1 THR 339 HG1 THR 339 12.719 5.472 17.362 884 HG21 THR 339 HG21 THR 339 10.792 2.542 17.720 885 HG22 THR 339 HG22 THR 339 10.303 2.466 16.026 886 HG23 THR 339 HG23 THR 339 11.968 2.101 16.482 887 H GLU 340 H GLU 340 12.012 5.124 12.675 888 HA GLU 340 HA GLU 340 9.245 5.849 12.387 889 HB2 GLU 340 HB2 GLU 340 11.668 5.808 10.657 890 HB3 GLU 340 HB3 GLU 340 10.101 5.799 9.851 891 HG2 GLU 340 HG2 GLU 340 10.597 8.097 10.103 892 HG3 GLU 340 HG3 GLU 340 9.489 7.755 11.429 893 H VAL 341 H VAL 341 7.761 4.283 12.488 894 HA VAL 341 HA VAL 341 7.839 2.146 10.484 895 HB VAL 341 HB VAL 341 8.802 1.306 12.699 896 HG11 VAL 341 HG11 VAL 341 6.017 1.018 13.708 897 HG12 VAL 341 HG12 VAL 341 7.528 1.213 14.597 898 HG13 VAL 341 HG13 VAL 341 6.751 2.615 13.864 899 HG21 VAL 341 HG21 VAL 341 8.210 -0.680 11.817 900 HG22 VAL 341 HG22 VAL 341 6.582 -0.492 12.465 901 HG23 VAL 341 HG23 VAL 341 6.966 0.117 10.855 902 H PTR 342 H PTR 342 5.489 0.864 11.815 903 HA PTR 342 HA PTR 342 3.470 2.977 11.336 904 HB2 PTR 342 HB2 PTR 342 2.022 0.883 10.632 905 HB3 PTR 342 HB3 PTR 342 3.092 1.661 9.471 906 HD1 PTR 342 HD1 PTR 342 3.457 -0.869 12.235 907 HD2 PTR 342 HD2 PTR 342 4.310 0.193 8.162 908 HE1 PTR 342 HE1 PTR 342 4.720 -2.979 11.946 909 HE2 PTR 342 HE2 PTR 342 5.563 -1.925 7.877 910 H GLU 343 H GLU 343 1.440 2.671 12.434 911 HA GLU 343 HA GLU 343 1.597 0.984 14.859 912 HB2 GLU 343 HB2 GLU 343 0.657 2.922 16.127 913 HB3 GLU 343 HB3 GLU 343 2.278 3.224 15.500 914 HG2 GLU 343 HG2 GLU 343 -0.287 4.110 14.130 915 HG3 GLU 343 HG3 GLU 343 0.722 5.151 15.126 916 H SER 344 H SER 344 0.134 0.276 12.562 917 HA SER 344 HA SER 344 -2.012 -0.131 11.754 918 HB2 SER 344 HB2 SER 344 -1.674 -1.173 14.301 919 HB3 SER 344 HB3 SER 344 -3.219 -0.335 14.406 920 HG SER 344 HG SER 344 -4.049 -1.645 12.924 921 HA PRO 345 HA PRO 345 -3.246 4.292 12.857 922 HB2 PRO 345 HB2 PRO 345 -3.306 5.125 10.214 923 HB3 PRO 345 HB3 PRO 345 -1.908 5.285 11.295 924 HG2 PRO 345 HG2 PRO 345 -2.470 3.227 9.219 925 HG3 PRO 345 HG3 PRO 345 -0.944 4.028 9.632 926 HD2 PRO 345 HD2 PRO 345 -1.485 1.510 10.450 927 HD3 PRO 345 HD3 PRO 345 -0.549 2.639 11.457 928 H PTR 346 H PTR 346 -4.377 2.458 9.985 929 HA PTR 346 HA PTR 346 -7.144 3.194 10.760 930 HB2 PTR 346 HB2 PTR 346 -6.351 2.672 7.913 931 HB3 PTR 346 HB3 PTR 346 -7.725 3.583 8.537 932 HD1 PTR 346 HD1 PTR 346 -5.064 4.186 6.655 933 HD2 PTR 346 HD2 PTR 346 -6.509 5.347 10.527 934 HE1 PTR 346 HE1 PTR 346 -3.740 6.288 6.527 935 HE2 PTR 346 HE2 PTR 346 -5.190 7.435 10.401 936 H ALA 347 H ALA 347 -8.718 1.665 10.685 937 HA ALA 347 HA ALA 347 -8.869 -0.691 9.290 938 HB1 ALA 347 HB1 ALA 347 -7.116 -0.941 11.702 939 HB2 ALA 347 HB2 ALA 347 -6.965 -1.708 10.121 940 HB3 ALA 347 HB3 ALA 347 -8.172 -2.288 11.269 941 H ASP 348 H ASP 348 -8.980 -0.781 12.811 942 HA ASP 348 HA ASP 348 -11.873 -0.311 12.816 943 HB2 ASP 348 HB2 ASP 348 -10.584 -2.938 13.204 944 HB3 ASP 348 HB3 ASP 348 -11.738 -2.503 14.459 945 HA PRO 349 HA PRO 349 -9.428 1.296 16.495 946 HB2 PRO 349 HB2 PRO 349 -9.864 3.957 16.074 947 HB3 PRO 349 HB3 PRO 349 -8.498 3.075 15.366 948 HG2 PRO 349 HG2 PRO 349 -11.084 3.873 14.125 949 HG3 PRO 349 HG3 PRO 349 -9.449 3.889 13.440 950 HD2 PRO 349 HD2 PRO 349 -11.282 1.920 12.900 951 HD3 PRO 349 HD3 PRO 349 -9.526 1.653 12.863 952 H GLU 350 H GLU 350 -11.729 0.083 16.848 953 HA GLU 350 HA GLU 350 -13.602 0.011 18.167 954 HB2 GLU 350 HB2 GLU 350 -12.539 2.696 19.081 955 HB3 GLU 350 HB3 GLU 350 -13.886 1.853 19.843 956 HG2 GLU 350 HG2 GLU 350 -12.532 0.264 20.797 957 HG3 GLU 350 HG3 GLU 350 -11.414 0.250 19.437 Start of MODEL 19 1 H1 GLY 661 H1 GLY 661 -7.059 -9.299 -10.704 2 H2 GLY 661 H2 GLY 661 -7.024 -10.076 -12.229 3 H3 GLY 661 H3 GLY 661 -7.509 -8.451 -12.115 4 HA2 GLY 661 HA2 GLY 661 -5.412 -7.932 -12.640 5 HA3 GLY 661 HA3 GLY 661 -5.050 -8.399 -10.976 6 H HIS 662 H HIS 662 -3.333 -9.723 -10.905 7 HA HIS 662 HA HIS 662 -3.035 -11.747 -13.037 8 HB2 HIS 662 HB2 HIS 662 -0.609 -11.757 -12.427 9 HB3 HIS 662 HB3 HIS 662 -1.161 -10.210 -13.067 10 HD1 HIS 662 HD1 HIS 662 0.780 -11.530 -10.368 11 HD2 HIS 662 HD2 HIS 662 -2.013 -8.433 -10.724 12 HE1 HIS 662 HE1 HIS 662 1.050 -10.045 -8.320 13 HE2 HIS 662 HE2 HIS 662 -0.567 -8.107 -8.557 14 H MET 663 H MET 663 -0.810 -12.646 -10.946 15 HA MET 663 HA MET 663 -2.643 -14.460 -9.517 16 HB2 MET 663 HB2 MET 663 -0.481 -15.070 -11.045 17 HB3 MET 663 HB3 MET 663 0.277 -14.986 -9.458 18 HG2 MET 663 HG2 MET 663 -0.648 -17.266 -10.148 19 HG3 MET 663 HG3 MET 663 -1.167 -16.665 -8.573 20 HE1 MET 663 HE1 MET 663 -2.871 -19.002 -10.071 21 HE2 MET 663 HE2 MET 663 -2.855 -18.283 -8.458 22 HE3 MET 663 HE3 MET 663 -4.364 -18.365 -9.379 23 H GLN 664 H GLN 664 0.655 -13.617 -8.621 24 HA GLN 664 HA GLN 664 -0.179 -11.917 -6.430 25 HB2 GLN 664 HB2 GLN 664 -0.491 -14.288 -5.571 26 HB3 GLN 664 HB3 GLN 664 1.254 -14.485 -5.726 27 HG2 GLN 664 HG2 GLN 664 1.421 -13.592 -3.655 28 HG3 GLN 664 HG3 GLN 664 0.991 -12.051 -4.389 29 HE21 GLN 664 HE21 GLN 664 -1.801 -12.805 -4.994 30 HE22 GLN 664 HE22 GLN 664 -2.608 -12.873 -3.496 31 H ASP 665 H ASP 665 1.636 -12.242 -8.872 32 HA ASP 665 HA ASP 665 4.325 -12.036 -7.958 33 HB2 ASP 665 HB2 ASP 665 3.604 -10.688 -10.489 34 HB3 ASP 665 HB3 ASP 665 4.823 -11.919 -10.176 35 H LEU 666 H LEU 666 4.949 -10.450 -6.636 36 HA LEU 666 HA LEU 666 3.716 -7.807 -6.891 37 HB2 LEU 666 HB2 LEU 666 5.575 -8.694 -4.702 38 HB3 LEU 666 HB3 LEU 666 4.355 -7.419 -4.661 39 HG LEU 666 HG LEU 666 3.812 -10.390 -4.912 40 HD11 LEU 666 HD11 LEU 666 3.150 -10.380 -2.686 41 HD12 LEU 666 HD12 LEU 666 4.547 -9.307 -2.651 42 HD13 LEU 666 HD13 LEU 666 2.918 -8.637 -2.654 43 HD21 LEU 666 HD21 LEU 666 1.882 -9.693 -5.869 44 HD22 LEU 666 HD22 LEU 666 1.442 -9.106 -4.268 45 HD23 LEU 666 HD23 LEU 666 2.177 -8.008 -5.439 46 H SER 667 H SER 667 6.812 -9.444 -7.090 47 HA SER 667 HA SER 667 8.407 -7.075 -7.213 48 HB2 SER 667 HB2 SER 667 9.062 -9.867 -8.159 49 HB3 SER 667 HB3 SER 667 10.217 -8.571 -7.850 50 HG SER 667 HG SER 667 9.919 -10.083 -6.076 51 H VAL 668 H VAL 668 6.142 -7.920 -9.328 52 HA VAL 668 HA VAL 668 7.750 -7.293 -11.722 53 HB VAL 668 HB VAL 668 5.987 -8.255 -13.029 54 HG11 VAL 668 HG11 VAL 668 6.395 -9.974 -10.567 55 HG12 VAL 668 HG12 VAL 668 5.973 -10.543 -12.180 56 HG13 VAL 668 HG13 VAL 668 7.555 -9.822 -11.885 57 HG21 VAL 668 HG21 VAL 668 4.068 -7.373 -11.761 58 HG22 VAL 668 HG22 VAL 668 3.916 -9.117 -11.964 59 HG23 VAL 668 HG23 VAL 668 4.446 -8.454 -10.420 60 H HIS 669 H HIS 669 6.230 -5.603 -9.472 61 HA HIS 669 HA HIS 669 4.934 -3.736 -11.372 62 HB2 HIS 669 HB2 HIS 669 4.543 -3.771 -8.379 63 HB3 HIS 669 HB3 HIS 669 3.543 -2.973 -9.594 64 HD1 HIS 669 HD1 HIS 669 2.549 -4.827 -11.468 65 HD2 HIS 669 HD2 HIS 669 3.556 -6.201 -7.675 66 HE1 HIS 669 HE1 HIS 669 1.430 -7.092 -11.209 67 HE2 HIS 669 HE2 HIS 669 2.134 -7.998 -8.933 68 H LEU 670 H LEU 670 4.855 -1.493 -9.882 69 HA LEU 670 HA LEU 670 7.691 -0.812 -9.454 70 HB2 LEU 670 HB2 LEU 670 6.963 1.533 -10.183 71 HB3 LEU 670 HB3 LEU 670 7.131 0.325 -11.433 72 HG LEU 670 HG LEU 670 4.512 1.091 -10.118 73 HD11 LEU 670 HD11 LEU 670 5.659 1.793 -12.837 74 HD12 LEU 670 HD12 LEU 670 4.029 2.184 -12.288 75 HD13 LEU 670 HD13 LEU 670 5.424 2.910 -11.495 76 HD21 LEU 670 HD21 LEU 670 5.297 -1.106 -11.854 77 HD22 LEU 670 HD22 LEU 670 3.742 -0.805 -11.071 78 HD23 LEU 670 HD23 LEU 670 4.096 -0.086 -12.639 79 H TRP 671 H TRP 671 4.713 -1.127 -8.007 80 HA TRP 671 HA TRP 671 5.276 1.032 -6.112 81 HB2 TRP 671 HB2 TRP 671 2.939 0.384 -5.224 82 HB3 TRP 671 HB3 TRP 671 3.033 1.226 -6.766 83 HD1 TRP 671 HD1 TRP 671 1.982 0.071 -8.790 84 HE1 TRP 671 HE1 TRP 671 0.983 -2.265 -9.243 85 HE3 TRP 671 HE3 TRP 671 3.266 -2.291 -4.449 86 HZ2 TRP 671 HZ2 TRP 671 0.773 -4.795 -7.931 87 HZ3 TRP 671 HZ3 TRP 671 2.656 -4.662 -4.082 88 HH2 TRP 671 HH2 TRP 671 1.409 -5.917 -5.817 89 H TYR 672 H TYR 672 5.799 -2.232 -6.514 90 HA TYR 672 HA TYR 672 5.500 -2.950 -3.695 91 HB2 TYR 672 HB2 TYR 672 4.863 -4.553 -5.494 92 HB3 TYR 672 HB3 TYR 672 6.552 -4.612 -5.996 93 HD1 TYR 672 HD2 TYR 672 4.818 -4.633 -2.658 94 HD2 TYR 672 HD1 TYR 672 7.571 -6.589 -5.309 95 HE1 TYR 672 HE2 TYR 672 5.280 -6.343 -0.922 96 HE2 TYR 672 HE1 TYR 672 8.029 -8.301 -3.574 97 HH TYR 672 HH TYR 672 6.949 -9.240 -1.589 98 H ALA 673 H ALA 673 7.052 -2.607 -2.275 99 HA ALA 673 HA ALA 673 9.830 -2.309 -3.244 100 HB1 ALA 673 HB1 ALA 673 8.570 -0.506 -1.833 101 HB2 ALA 673 HB2 ALA 673 10.239 -0.901 -1.426 102 HB3 ALA 673 HB3 ALA 673 8.916 -1.578 -0.476 103 H GLY 674 H GLY 674 7.743 -4.419 -1.623 104 HA2 GLY 674 HA2 GLY 674 8.032 -6.287 -0.296 105 HA3 GLY 674 HA3 GLY 674 9.391 -6.576 -1.369 106 HA PRO 675 HA PRO 675 11.790 -6.460 2.359 107 HB2 PRO 675 HB2 PRO 675 14.282 -6.396 1.195 108 HB3 PRO 675 HB3 PRO 675 13.295 -7.862 1.344 109 HG2 PRO 675 HG2 PRO 675 13.706 -6.084 -1.004 110 HG3 PRO 675 HG3 PRO 675 13.552 -7.849 -0.932 111 HD2 PRO 675 HD2 PRO 675 11.504 -6.204 -1.712 112 HD3 PRO 675 HD3 PRO 675 11.241 -7.783 -0.938 113 H MET 676 H MET 676 10.716 -4.099 2.193 114 HA MET 676 HA MET 676 12.959 -2.156 2.302 115 HB2 MET 676 HB2 MET 676 11.249 -1.847 0.418 116 HB3 MET 676 HB3 MET 676 10.088 -1.449 1.681 117 HG2 MET 676 HG2 MET 676 10.936 0.632 1.914 118 HG3 MET 676 HG3 MET 676 12.582 0.017 2.061 119 HE1 MET 676 HE1 MET 676 14.255 0.617 0.712 120 HE2 MET 676 HE2 MET 676 13.991 -0.839 -0.240 121 HE3 MET 676 HE3 MET 676 14.279 0.708 -1.049 122 H GLU 677 H GLU 677 12.383 -0.247 3.762 123 HA GLU 677 HA GLU 677 10.942 -1.182 6.165 124 HB2 GLU 677 HB2 GLU 677 12.537 0.385 7.381 125 HB3 GLU 677 HB3 GLU 677 13.257 -1.076 6.697 126 HG2 GLU 677 HG2 GLU 677 14.273 0.079 4.943 127 HG3 GLU 677 HG3 GLU 677 13.152 1.430 5.057 128 H ARG 678 H ARG 678 10.135 0.635 7.551 129 HA ARG 678 HA ARG 678 8.335 2.262 6.187 130 HB2 ARG 678 HB2 ARG 678 8.242 1.672 8.631 131 HB3 ARG 678 HB3 ARG 678 9.506 2.869 8.912 132 HG2 ARG 678 HG2 ARG 678 7.306 3.911 7.282 133 HG3 ARG 678 HG3 ARG 678 6.775 3.383 8.876 134 HD2 ARG 678 HD2 ARG 678 8.993 4.717 9.599 135 HD3 ARG 678 HD3 ARG 678 8.618 5.594 8.122 136 HE ARG 678 HE ARG 678 6.412 5.216 10.018 137 HH11 ARG 678 HH21 ARG 678 8.913 7.310 8.788 138 HH12 ARG 678 HH22 ARG 678 8.148 8.748 9.423 139 HH21 ARG 678 HH11 ARG 678 5.411 7.094 10.690 140 HH22 ARG 678 HH12 ARG 678 6.172 8.649 10.384 141 H ALA 679 H ALA 679 11.283 3.380 7.857 142 HA ALA 679 HA ALA 679 11.225 5.994 6.866 143 HB1 ALA 679 HB1 ALA 679 13.794 5.810 7.347 144 HB2 ALA 679 HB2 ALA 679 13.357 4.249 8.037 145 HB3 ALA 679 HB3 ALA 679 12.644 5.726 8.682 146 H GLY 680 H GLY 680 12.466 3.030 5.484 147 HA2 GLY 680 HA2 GLY 680 13.931 4.301 3.357 148 HA3 GLY 680 HA3 GLY 680 13.497 2.596 3.443 149 H ALA 681 H ALA 681 10.800 2.650 3.630 150 HA ALA 681 HA ALA 681 9.913 2.916 0.999 151 HB1 ALA 681 HB1 ALA 681 7.630 2.760 1.974 152 HB2 ALA 681 HB2 ALA 681 8.325 2.996 3.580 153 HB3 ALA 681 HB3 ALA 681 8.733 1.558 2.643 154 H GLU 682 H GLU 682 9.327 5.155 3.746 155 HA GLU 682 HA GLU 682 8.011 7.074 2.086 156 HB2 GLU 682 HB2 GLU 682 8.156 8.564 4.049 157 HB3 GLU 682 HB3 GLU 682 7.512 6.978 4.453 158 HG2 GLU 682 HG2 GLU 682 9.968 6.362 5.017 159 HG3 GLU 682 HG3 GLU 682 10.243 8.091 5.037 160 H SER 683 H SER 683 11.280 6.334 2.537 161 HA SER 683 HA SER 683 12.501 8.839 2.351 162 HB2 SER 683 HB2 SER 683 14.458 7.688 1.664 163 HB3 SER 683 HB3 SER 683 13.598 6.551 2.699 164 HG SER 683 HG SER 683 12.961 5.409 0.957 165 H ILE 684 H ILE 684 11.270 6.680 -0.124 166 HA ILE 684 HA ILE 684 11.962 8.479 -2.295 167 HB ILE 684 HB ILE 684 10.084 6.131 -2.507 168 HG12 ILE 684 HG12 ILE 684 12.806 5.388 -3.081 169 HG13 ILE 684 HG13 ILE 684 12.732 6.031 -1.442 170 HG21 ILE 684 HG21 ILE 684 11.259 5.947 -4.726 171 HG22 ILE 684 HG22 ILE 684 10.368 7.452 -4.518 172 HG23 ILE 684 HG23 ILE 684 12.120 7.436 -4.337 173 HD11 ILE 684 HD11 ILE 684 10.506 4.216 -2.100 174 HD12 ILE 684 HD12 ILE 684 12.091 3.447 -2.140 175 HD13 ILE 684 HD13 ILE 684 11.542 4.257 -0.674 176 H LEU 685 H LEU 685 8.965 7.265 -0.815 177 HA LEU 685 HA LEU 685 7.141 8.807 -2.273 178 HB2 LEU 685 HB2 LEU 685 7.143 7.357 0.321 179 HB3 LEU 685 HB3 LEU 685 5.859 8.534 0.077 180 HG LEU 685 HG LEU 685 5.081 7.416 -1.890 181 HD11 LEU 685 HD11 LEU 685 7.694 5.912 -1.697 182 HD12 LEU 685 HD12 LEU 685 6.342 5.318 -2.661 183 HD13 LEU 685 HD13 LEU 685 7.085 6.868 -3.048 184 HD21 LEU 685 HD21 LEU 685 4.968 4.958 -1.010 185 HD22 LEU 685 HD22 LEU 685 5.801 5.604 0.402 186 HD23 LEU 685 HD23 LEU 685 4.220 6.236 -0.056 187 H ALA 686 H ALA 686 8.780 9.566 0.828 188 HA ALA 686 HA ALA 686 7.476 12.042 1.232 189 HB1 ALA 686 HB1 ALA 686 8.776 10.867 2.972 190 HB2 ALA 686 HB2 ALA 686 9.277 12.546 2.783 191 HB3 ALA 686 HB3 ALA 686 10.262 11.251 2.102 192 H ASN 687 H ASN 687 10.296 11.115 -0.642 193 HA ASN 687 HA ASN 687 11.086 13.798 -1.317 194 HB2 ASN 687 HB2 ASN 687 12.925 12.653 -1.919 195 HB3 ASN 687 HB3 ASN 687 12.074 11.127 -1.725 196 HD21 ASN 687 HD21 ASN 687 12.181 13.832 -4.123 197 HD22 ASN 687 HD22 ASN 687 12.141 12.809 -5.476 198 H ARG 688 H ARG 688 8.991 11.339 -2.669 199 HA ARG 688 HA ARG 688 8.572 12.663 -5.191 200 HB2 ARG 688 HB2 ARG 688 7.746 10.182 -3.894 201 HB3 ARG 688 HB3 ARG 688 6.455 10.919 -4.835 202 HG2 ARG 688 HG2 ARG 688 7.615 9.541 -6.380 203 HG3 ARG 688 HG3 ARG 688 8.190 11.176 -6.715 204 HD2 ARG 688 HD2 ARG 688 10.210 10.812 -5.497 205 HD3 ARG 688 HD3 ARG 688 9.611 9.307 -4.813 206 HE ARG 688 HE ARG 688 9.545 8.849 -7.505 207 HH11 ARG 688 HH21 ARG 688 11.949 9.991 -5.284 208 HH12 ARG 688 HH22 ARG 688 13.269 9.320 -6.195 209 HH21 ARG 688 HH11 ARG 688 11.260 7.972 -8.654 210 HH22 ARG 688 HH12 ARG 688 12.877 8.175 -8.083 211 H SER 689 H SER 689 6.168 12.929 -5.866 212 HA SER 689 HA SER 689 5.087 15.073 -4.256 213 HB2 SER 689 HB2 SER 689 3.278 14.670 -6.264 214 HB3 SER 689 HB3 SER 689 4.719 15.677 -6.408 215 HG SER 689 HG SER 689 4.133 13.472 -7.749 216 H ASP 690 H ASP 690 2.770 15.182 -3.760 217 HA ASP 690 HA ASP 690 1.920 13.090 -2.110 218 HB2 ASP 690 HB2 ASP 690 0.672 15.559 -3.208 219 HB3 ASP 690 HB3 ASP 690 -0.379 14.352 -2.471 220 H GLY 691 H GLY 691 0.771 11.316 -2.406 221 HA2 GLY 691 HA2 GLY 691 -1.036 10.121 -3.535 222 HA3 GLY 691 HA3 GLY 691 -0.524 10.882 -5.040 223 H THR 692 H THR 692 2.329 10.457 -3.973 224 HA THR 692 HA THR 692 2.884 8.073 -5.430 225 HB THR 692 HB THR 692 4.729 9.323 -3.388 226 HG1 THR 692 HG1 THR 692 4.123 11.047 -4.615 227 HG21 THR 692 HG21 THR 692 5.379 8.175 -6.094 228 HG22 THR 692 HG22 THR 692 6.442 8.386 -4.705 229 HG23 THR 692 HG23 THR 692 5.203 7.131 -4.685 230 H PHE 693 H PHE 693 2.944 5.981 -4.755 231 HA PHE 693 HA PHE 693 2.984 5.480 -1.850 232 HB2 PHE 693 HB2 PHE 693 1.097 3.986 -1.963 233 HB3 PHE 693 HB3 PHE 693 0.618 5.539 -2.647 234 HD1 PHE 693 HD2 PHE 693 1.530 2.039 -3.439 235 HD2 PHE 693 HD1 PHE 693 0.147 5.789 -5.003 236 HE1 PHE 693 HE2 PHE 693 0.909 0.926 -5.567 237 HE2 PHE 693 HE1 PHE 693 -0.478 4.674 -7.128 238 HZ PHE 693 HZ PHE 693 -0.091 2.244 -7.412 239 H LEU 694 H LEU 694 3.193 3.152 -1.336 240 HA LEU 694 HA LEU 694 4.229 1.364 -3.320 241 HB2 LEU 694 HB2 LEU 694 6.516 1.279 -2.707 242 HB3 LEU 694 HB3 LEU 694 6.150 2.989 -2.911 243 HG LEU 694 HG LEU 694 5.611 2.859 -0.323 244 HD11 LEU 694 HD11 LEU 694 7.799 1.126 0.186 245 HD12 LEU 694 HD12 LEU 694 6.113 0.893 0.650 246 HD13 LEU 694 HD13 LEU 694 6.703 0.253 -0.883 247 HD21 LEU 694 HD21 LEU 694 7.799 3.668 -1.888 248 HD22 LEU 694 HD22 LEU 694 7.459 4.140 -0.225 249 HD23 LEU 694 HD23 LEU 694 8.501 2.758 -0.554 250 H VAL 695 H VAL 695 4.817 -0.722 -2.413 251 HA VAL 695 HA VAL 695 3.778 -1.111 0.338 252 HB VAL 695 HB VAL 695 3.386 -3.051 -1.951 253 HG11 VAL 695 HG11 VAL 695 3.323 -4.167 0.174 254 HG12 VAL 695 HG12 VAL 695 2.392 -2.861 0.905 255 HG13 VAL 695 HG13 VAL 695 1.643 -3.911 -0.294 256 HG21 VAL 695 HG21 VAL 695 0.903 -2.050 -1.153 257 HG22 VAL 695 HG22 VAL 695 1.930 -0.618 -1.220 258 HG23 VAL 695 HG23 VAL 695 1.753 -1.641 -2.643 259 H ARG 696 H ARG 696 4.915 -2.464 1.653 260 HA ARG 696 HA ARG 696 7.321 -3.762 0.491 261 HB2 ARG 696 HB2 ARG 696 8.536 -3.168 2.529 262 HB3 ARG 696 HB3 ARG 696 7.904 -1.718 1.745 263 HG2 ARG 696 HG2 ARG 696 5.953 -1.764 3.288 264 HG3 ARG 696 HG3 ARG 696 6.655 -3.161 4.106 265 HD2 ARG 696 HD2 ARG 696 8.187 -0.582 3.781 266 HD3 ARG 696 HD3 ARG 696 7.091 -0.833 5.134 267 HE ARG 696 HE ARG 696 9.583 -2.352 4.609 268 HH11 ARG 696 HH21 ARG 696 6.835 -1.716 6.611 269 HH12 ARG 696 HH22 ARG 696 7.573 -2.378 8.027 270 HH21 ARG 696 HH11 ARG 696 10.497 -3.208 6.431 271 HH22 ARG 696 HH12 ARG 696 9.632 -3.203 7.939 272 H GLN 697 H GLN 697 8.263 -5.420 2.001 273 HA GLN 697 HA GLN 697 6.091 -7.017 3.234 274 HB2 GLN 697 HB2 GLN 697 6.850 -8.248 1.374 275 HB3 GLN 697 HB3 GLN 697 8.530 -7.803 1.655 276 HG2 GLN 697 HG2 GLN 697 8.293 -10.089 2.362 277 HG3 GLN 697 HG3 GLN 697 8.417 -9.122 3.826 278 HE21 GLN 697 HE21 GLN 697 7.136 -11.758 3.609 279 HE22 GLN 697 HE22 GLN 697 5.493 -11.548 4.016 280 H ARG 698 H ARG 698 6.206 -6.749 5.367 281 HA ARG 698 HA ARG 698 8.308 -7.720 6.939 282 HB2 ARG 698 HB2 ARG 698 8.889 -5.151 5.904 283 HB3 ARG 698 HB3 ARG 698 8.454 -4.915 7.595 284 HG2 ARG 698 HG2 ARG 698 10.252 -7.212 7.035 285 HG3 ARG 698 HG3 ARG 698 10.949 -5.613 6.786 286 HD2 ARG 698 HD2 ARG 698 11.384 -6.124 9.072 287 HD3 ARG 698 HD3 ARG 698 10.025 -5.003 9.095 288 HE ARG 698 HE ARG 698 8.753 -6.683 10.042 289 HH11 ARG 698 HH21 ARG 698 11.410 -8.016 8.303 290 HH12 ARG 698 HH22 ARG 698 11.108 -9.644 8.792 291 HH21 ARG 698 HH11 ARG 698 8.348 -8.832 10.699 292 HH22 ARG 698 HH12 ARG 698 9.395 -10.100 10.140 293 H VAL 699 H VAL 699 7.454 -8.128 8.904 294 HA VAL 699 HA VAL 699 5.488 -6.325 10.063 295 HB VAL 699 HB VAL 699 4.233 -7.880 8.510 296 HG11 VAL 699 HG11 VAL 699 5.848 -9.828 9.571 297 HG12 VAL 699 HG12 VAL 699 4.378 -10.044 10.520 298 HG13 VAL 699 HG13 VAL 699 4.317 -10.146 8.762 299 HG21 VAL 699 HG21 VAL 699 3.590 -8.162 11.459 300 HG22 VAL 699 HG22 VAL 699 3.256 -6.716 10.509 301 HG23 VAL 699 HG23 VAL 699 2.456 -8.231 10.119 302 H LYS 700 H LYS 700 4.899 -6.887 12.230 303 HA LYS 700 HA LYS 700 6.159 -9.011 13.663 304 HB2 LYS 700 HB2 LYS 700 7.865 -7.935 14.817 305 HB3 LYS 700 HB3 LYS 700 8.022 -7.225 13.214 306 HG2 LYS 700 HG2 LYS 700 6.211 -5.831 15.153 307 HG3 LYS 700 HG3 LYS 700 7.944 -5.720 15.435 308 HD2 LYS 700 HD2 LYS 700 7.530 -3.880 14.038 309 HD3 LYS 700 HD3 LYS 700 8.090 -5.109 12.906 310 HE2 LYS 700 HE2 LYS 700 6.142 -5.012 11.795 311 HE3 LYS 700 HE3 LYS 700 5.261 -5.411 13.268 312 HZ1 LYS 700 HZ1 LYS 700 4.399 -3.371 12.934 313 HZ2 LYS 700 HZ2 LYS 700 5.830 -2.886 13.750 314 HZ3 LYS 700 HZ3 LYS 700 5.783 -2.820 12.051 315 H ASP 701 H ASP 701 3.731 -7.036 13.191 316 HA ASP 701 HA ASP 701 2.956 -6.838 16.037 317 HB2 ASP 701 HB2 ASP 701 1.253 -5.141 14.831 318 HB3 ASP 701 HB3 ASP 701 2.840 -4.633 15.401 319 H ALA 702 H ALA 702 1.423 -6.968 12.823 320 HA ALA 702 HA ALA 702 0.124 -9.448 13.171 321 HB1 ALA 702 HB1 ALA 702 -1.158 -8.363 14.937 322 HB2 ALA 702 HB2 ALA 702 -2.207 -8.655 13.551 323 HB3 ALA 702 HB3 ALA 702 -1.579 -7.036 13.854 324 H ALA 703 H ALA 703 0.994 -9.405 11.004 325 HA ALA 703 HA ALA 703 -0.838 -9.085 8.958 326 HB1 ALA 703 HB1 ALA 703 0.851 -6.863 8.268 327 HB2 ALA 703 HB2 ALA 703 0.123 -6.564 9.841 328 HB3 ALA 703 HB3 ALA 703 -0.902 -6.896 8.450 329 H GLU 704 H GLU 704 0.938 -8.069 6.899 330 HA GLU 704 HA GLU 704 3.285 -9.851 7.054 331 HB2 GLU 704 HB2 GLU 704 0.925 -10.303 5.402 332 HB3 GLU 704 HB3 GLU 704 2.391 -10.166 4.430 333 HG2 GLU 704 HG2 GLU 704 2.212 -11.925 6.888 334 HG3 GLU 704 HG3 GLU 704 1.859 -12.512 5.264 335 H PHE 705 H PHE 705 1.740 -8.057 4.409 336 HA PHE 705 HA PHE 705 4.263 -6.696 3.857 337 HB2 PHE 705 HB2 PHE 705 1.626 -6.486 2.382 338 HB3 PHE 705 HB3 PHE 705 3.206 -5.958 1.807 339 HD1 PHE 705 HD1 PHE 705 1.080 -8.887 2.541 340 HD2 PHE 705 HD2 PHE 705 4.872 -7.547 1.040 341 HE1 PHE 705 HE1 PHE 705 1.518 -11.150 1.632 342 HE2 PHE 705 HE2 PHE 705 5.311 -9.810 0.127 343 HZ PHE 705 HZ PHE 705 3.633 -11.612 0.424 344 H ALA 706 H ALA 706 4.109 -4.305 3.303 345 HA ALA 706 HA ALA 706 2.163 -2.919 5.041 346 HB1 ALA 706 HB1 ALA 706 3.753 -2.227 6.461 347 HB2 ALA 706 HB2 ALA 706 4.598 -1.447 5.127 348 HB3 ALA 706 HB3 ALA 706 4.971 -3.119 5.549 349 H ILE 707 H ILE 707 1.199 -1.245 4.096 350 HA ILE 707 HA ILE 707 2.051 -0.483 1.398 351 HB ILE 707 HB ILE 707 -0.307 0.595 2.964 352 HG12 ILE 707 HG12 ILE 707 -1.485 -1.194 1.407 353 HG13 ILE 707 HG13 ILE 707 0.084 -1.992 1.492 354 HG21 ILE 707 HG21 ILE 707 -1.104 0.610 0.426 355 HG22 ILE 707 HG22 ILE 707 -0.124 1.926 1.067 356 HG23 ILE 707 HG23 ILE 707 0.630 0.646 0.115 357 HD11 ILE 707 HD11 ILE 707 -0.722 -1.087 4.121 358 HD12 ILE 707 HD12 ILE 707 -1.977 -2.094 3.408 359 HD13 ILE 707 HD13 ILE 707 -0.340 -2.720 3.580 360 H SER 708 H SER 708 1.880 1.959 0.928 361 HA SER 708 HA SER 708 2.474 3.795 3.027 362 HB2 SER 708 HB2 SER 708 4.760 2.717 1.381 363 HB3 SER 708 HB3 SER 708 4.837 4.269 2.209 364 HG SER 708 HG SER 708 3.969 1.970 3.612 365 H ILE 709 H ILE 709 1.516 5.565 2.299 366 HA ILE 709 HA ILE 709 1.746 6.254 -0.576 367 HB ILE 709 HB ILE 709 -0.615 7.129 1.043 368 HG12 ILE 709 HG12 ILE 709 -1.659 4.958 -0.135 369 HG13 ILE 709 HG13 ILE 709 -0.027 4.349 0.150 370 HG21 ILE 709 HG21 ILE 709 0.223 7.415 -1.620 371 HG22 ILE 709 HG22 ILE 709 -1.080 6.225 -1.677 372 HG23 ILE 709 HG23 ILE 709 -1.366 7.813 -0.962 373 HD11 ILE 709 HD11 ILE 709 -1.833 5.599 2.234 374 HD12 ILE 709 HD12 ILE 709 -1.483 3.875 2.082 375 HD13 ILE 709 HD13 ILE 709 -0.202 5.004 2.524 376 H LYS 710 H LYS 710 2.384 8.266 -1.048 377 HA LYS 710 HA LYS 710 3.089 10.052 1.148 378 HB2 LYS 710 HB2 LYS 710 4.726 9.894 -0.597 379 HB3 LYS 710 HB3 LYS 710 3.510 10.135 -1.846 380 HG2 LYS 710 HG2 LYS 710 4.648 12.220 -1.626 381 HG3 LYS 710 HG3 LYS 710 3.095 12.431 -0.828 382 HD2 LYS 710 HD2 LYS 710 4.020 12.446 1.298 383 HD3 LYS 710 HD3 LYS 710 5.445 11.515 0.810 384 HE2 LYS 710 HE2 LYS 710 4.867 14.348 -0.106 385 HE3 LYS 710 HE3 LYS 710 5.937 13.940 1.238 386 HZ1 LYS 710 HZ1 LYS 710 6.411 13.725 -1.619 387 HZ2 LYS 710 HZ2 LYS 710 7.536 13.772 -0.322 388 HZ3 LYS 710 HZ3 LYS 710 6.792 12.291 -0.764 389 H TYR 711 H TYR 711 1.247 10.930 1.982 390 HA TYR 711 HA TYR 711 -0.335 12.643 0.174 391 HB2 TYR 711 HB2 TYR 711 -1.519 10.472 0.436 392 HB3 TYR 711 HB3 TYR 711 -1.541 10.723 2.178 393 HD1 TYR 711 HD1 TYR 711 -2.241 12.868 -0.834 394 HD2 TYR 711 HD2 TYR 711 -3.598 11.413 2.969 395 HE1 TYR 711 HE1 TYR 711 -4.318 14.206 -1.061 396 HE2 TYR 711 HE2 TYR 711 -5.677 12.743 2.742 397 HH TYR 711 HH TYR 711 -6.897 13.784 0.115 398 H ASN 712 H ASN 712 0.006 14.602 0.956 399 HA ASN 712 HA ASN 712 -0.316 16.366 2.441 400 HB2 ASN 712 HB2 ASN 712 -1.910 14.819 3.717 401 HB3 ASN 712 HB3 ASN 712 -0.516 14.375 4.700 402 HD21 ASN 712 HD21 ASN 712 -0.586 15.508 6.616 403 HD22 ASN 712 HD22 ASN 712 -1.008 17.146 6.762 404 H VAL 713 H VAL 713 2.057 15.804 1.505 405 HA VAL 713 HA VAL 713 4.335 15.696 1.864 406 HB VAL 713 HB VAL 713 5.154 17.410 3.407 407 HG11 VAL 713 HG11 VAL 713 3.769 19.317 2.508 408 HG12 VAL 713 HG12 VAL 713 4.309 18.180 1.274 409 HG13 VAL 713 HG13 VAL 713 2.647 18.122 1.860 410 HG21 VAL 713 HG21 VAL 713 3.465 16.866 5.237 411 HG22 VAL 713 HG22 VAL 713 3.699 18.584 4.922 412 HG23 VAL 713 HG23 VAL 713 2.274 17.760 4.292 413 H GLU 714 H GLU 714 3.013 13.510 2.926 414 HA GLU 714 HA GLU 714 4.953 12.597 4.864 415 HB2 GLU 714 HB2 GLU 714 3.390 12.018 6.606 416 HB3 GLU 714 HB3 GLU 714 3.162 13.731 6.238 417 HG2 GLU 714 HG2 GLU 714 1.221 13.241 4.875 418 HG3 GLU 714 HG3 GLU 714 1.490 11.510 5.023 419 H VAL 715 H VAL 715 4.821 10.287 5.188 420 HA VAL 715 HA VAL 715 3.367 8.924 2.999 421 HB VAL 715 HB VAL 715 5.878 8.005 4.400 422 HG11 VAL 715 HG11 VAL 715 6.021 6.462 2.496 423 HG12 VAL 715 HG12 VAL 715 4.483 6.249 3.330 424 HG13 VAL 715 HG13 VAL 715 4.546 7.144 1.812 425 HG21 VAL 715 HG21 VAL 715 5.430 9.658 1.914 426 HG22 VAL 715 HG22 VAL 715 6.539 9.965 3.249 427 HG23 VAL 715 HG23 VAL 715 6.878 8.675 2.101 428 H LYS 716 H LYS 716 1.561 8.027 3.844 429 HA LYS 716 HA LYS 716 1.521 7.102 6.602 430 HB2 LYS 716 HB2 LYS 716 -0.708 6.610 4.648 431 HB3 LYS 716 HB3 LYS 716 -0.798 6.941 6.376 432 HG2 LYS 716 HG2 LYS 716 0.424 9.221 5.451 433 HG3 LYS 716 HG3 LYS 716 -0.655 8.827 4.110 434 HD2 LYS 716 HD2 LYS 716 -2.575 8.793 5.575 435 HD3 LYS 716 HD3 LYS 716 -1.549 8.956 7.003 436 HE2 LYS 716 HE2 LYS 716 -0.938 11.087 5.168 437 HE3 LYS 716 HE3 LYS 716 -2.681 11.041 5.438 438 HZ1 LYS 716 HZ1 LYS 716 -2.257 11.002 7.836 439 HZ2 LYS 716 HZ2 LYS 716 -0.565 11.122 7.545 440 HZ3 LYS 716 HZ3 LYS 716 -1.607 12.397 7.103 441 H HIS 717 H HIS 717 2.292 5.201 7.156 442 HA HIS 717 HA HIS 717 2.305 2.980 5.231 443 HB2 HIS 717 HB2 HIS 717 3.675 3.025 7.911 444 HB3 HIS 717 HB3 HIS 717 4.036 2.017 6.511 445 HD1 HIS 717 HD1 HIS 717 5.151 3.237 4.414 446 HD2 HIS 717 HD2 HIS 717 4.921 5.525 7.916 447 HE1 HIS 717 HE1 HIS 717 6.862 5.108 4.191 448 HE2 HIS 717 HE2 HIS 717 6.756 6.510 6.325 449 H ILE 718 H ILE 718 1.348 1.078 5.637 450 HA ILE 718 HA ILE 718 -0.011 0.622 8.197 451 HB ILE 718 HB ILE 718 -1.429 0.423 5.528 452 HG12 ILE 718 HG12 ILE 718 -2.526 2.153 7.646 453 HG13 ILE 718 HG13 ILE 718 -0.995 2.721 6.989 454 HG21 ILE 718 HG21 ILE 718 -2.251 -0.185 8.377 455 HG22 ILE 718 HG22 ILE 718 -3.412 0.028 7.068 456 HG23 ILE 718 HG23 ILE 718 -2.240 -1.289 7.000 457 HD11 ILE 718 HD11 ILE 718 -2.552 3.680 5.536 458 HD12 ILE 718 HD12 ILE 718 -2.078 2.214 4.674 459 HD13 ILE 718 HD13 ILE 718 -3.598 2.260 5.570 460 H LYS 719 H LYS 719 -0.148 -1.495 8.756 461 HA LYS 719 HA LYS 719 1.467 -3.388 7.267 462 HB2 LYS 719 HB2 LYS 719 0.687 -4.866 9.283 463 HB3 LYS 719 HB3 LYS 719 1.842 -3.570 9.553 464 HG2 LYS 719 HG2 LYS 719 0.290 -2.211 10.614 465 HG3 LYS 719 HG3 LYS 719 -1.078 -2.924 9.758 466 HD2 LYS 719 HD2 LYS 719 0.157 -4.986 11.317 467 HD3 LYS 719 HD3 LYS 719 -0.083 -3.584 12.359 468 HE2 LYS 719 HE2 LYS 719 -2.121 -4.784 12.518 469 HE3 LYS 719 HE3 LYS 719 -2.467 -3.483 11.378 470 HZ1 LYS 719 HZ1 LYS 719 -1.819 -5.127 9.586 471 HZ2 LYS 719 HZ2 LYS 719 -1.900 -6.346 10.791 472 HZ3 LYS 719 HZ3 LYS 719 -3.313 -5.436 10.391 473 H ILE 720 H ILE 720 0.651 -4.587 5.668 474 HA ILE 720 HA ILE 720 -2.201 -4.988 5.348 475 HB ILE 720 HB ILE 720 0.128 -5.145 3.689 476 HG12 ILE 720 HG12 ILE 720 -2.712 -5.682 2.842 477 HG13 ILE 720 HG13 ILE 720 -2.209 -4.078 3.371 478 HG21 ILE 720 HG21 ILE 720 -0.432 -7.203 2.415 479 HG22 ILE 720 HG22 ILE 720 0.098 -7.576 4.053 480 HG23 ILE 720 HG23 ILE 720 -1.616 -7.629 3.647 481 HD11 ILE 720 HD11 ILE 720 -1.927 -5.108 0.801 482 HD12 ILE 720 HD12 ILE 720 -1.109 -3.684 1.440 483 HD13 ILE 720 HD13 ILE 720 -0.311 -5.254 1.494 484 H MET 721 H MET 721 -3.354 -6.847 5.659 485 HA MET 721 HA MET 721 -2.072 -8.945 7.271 486 HB2 MET 721 HB2 MET 721 -4.394 -7.720 7.694 487 HB3 MET 721 HB3 MET 721 -4.984 -8.982 6.614 488 HG2 MET 721 HG2 MET 721 -5.167 -9.864 8.835 489 HG3 MET 721 HG3 MET 721 -3.771 -10.656 8.108 490 HE1 MET 721 HE1 MET 721 -3.830 -10.044 11.860 491 HE2 MET 721 HE2 MET 721 -4.027 -11.172 10.521 492 HE3 MET 721 HE3 MET 721 -2.423 -10.882 11.207 493 H THR 722 H THR 722 -2.650 -11.233 6.774 494 HA THR 722 HA THR 722 -2.823 -11.677 3.849 495 HB THR 722 HB THR 722 -0.636 -12.328 4.413 496 HG1 THR 722 HG1 THR 722 -2.407 -14.529 4.647 497 HG21 THR 722 HG21 THR 722 -0.236 -13.830 6.440 498 HG22 THR 722 HG22 THR 722 -0.658 -12.156 6.797 499 HG23 THR 722 HG23 THR 722 -1.875 -13.424 6.946 500 H ALA 723 H ALA 723 -5.195 -11.527 5.089 501 HA ALA 723 HA ALA 723 -6.227 -13.795 6.352 502 HB1 ALA 723 HB1 ALA 723 -8.296 -12.837 6.042 503 HB2 ALA 723 HB2 ALA 723 -7.943 -12.347 4.386 504 HB3 ALA 723 HB3 ALA 723 -7.280 -11.429 5.736 505 H GLU 724 H GLU 724 -5.996 -15.815 5.639 506 HA GLU 724 HA GLU 724 -5.882 -17.632 4.227 507 HB2 GLU 724 HB2 GLU 724 -8.089 -16.397 2.615 508 HB3 GLU 724 HB3 GLU 724 -7.886 -18.070 3.137 509 HG2 GLU 724 HG2 GLU 724 -8.783 -15.695 4.777 510 HG3 GLU 724 HG3 GLU 724 -9.617 -17.224 4.523 511 H GLY 725 H GLY 725 -4.381 -15.124 3.452 512 HA2 GLY 725 HA2 GLY 725 -2.704 -15.081 1.734 513 HA3 GLY 725 HA3 GLY 725 -3.820 -15.924 0.664 514 H LEU 726 H LEU 726 -5.816 -13.800 2.037 515 HA LEU 726 HA LEU 726 -5.617 -11.949 -0.205 516 HB2 LEU 726 HB2 LEU 726 -7.573 -11.886 2.106 517 HB3 LEU 726 HB3 LEU 726 -7.734 -11.079 0.547 518 HG LEU 726 HG LEU 726 -7.579 -14.087 0.891 519 HD11 LEU 726 HD11 LEU 726 -10.022 -13.985 0.316 520 HD12 LEU 726 HD12 LEU 726 -9.640 -13.283 1.887 521 HD13 LEU 726 HD13 LEU 726 -9.947 -12.234 0.505 522 HD21 LEU 726 HD21 LEU 726 -8.080 -12.230 -1.442 523 HD22 LEU 726 HD22 LEU 726 -6.856 -13.492 -1.303 524 HD23 LEU 726 HD23 LEU 726 -8.555 -13.926 -1.480 525 H TYR 727 H TYR 727 -5.053 -9.805 -0.094 526 HA TYR 727 HA TYR 727 -3.785 -8.968 2.423 527 HB2 TYR 727 HB2 TYR 727 -3.462 -7.823 -0.356 528 HB3 TYR 727 HB3 TYR 727 -2.556 -7.341 1.077 529 HD1 TYR 727 HD2 TYR 727 -2.698 -10.484 2.007 530 HD2 TYR 727 HD1 TYR 727 -1.206 -8.320 -1.384 531 HE1 TYR 727 HE2 TYR 727 -1.080 -12.303 1.557 532 HE2 TYR 727 HE1 TYR 727 0.411 -10.145 -1.834 533 HH TYR 727 HH TYR 727 0.262 -12.906 -1.129 534 H ARG 728 H ARG 728 -4.350 -7.202 3.508 535 HA ARG 728 HA ARG 728 -6.386 -5.384 2.418 536 HB2 ARG 728 HB2 ARG 728 -7.328 -5.648 4.937 537 HB3 ARG 728 HB3 ARG 728 -7.954 -6.568 3.578 538 HG2 ARG 728 HG2 ARG 728 -6.454 -8.435 4.100 539 HG3 ARG 728 HG3 ARG 728 -5.714 -7.500 5.399 540 HD2 ARG 728 HD2 ARG 728 -8.583 -7.548 5.732 541 HD3 ARG 728 HD3 ARG 728 -7.966 -9.194 5.578 542 HE ARG 728 HE ARG 728 -6.463 -7.502 7.416 543 HH11 ARG 728 HH21 ARG 728 -9.078 -9.730 7.031 544 HH12 ARG 728 HH22 ARG 728 -9.080 -10.194 8.693 545 HH21 ARG 728 HH11 ARG 728 -6.464 -8.079 9.542 546 HH22 ARG 728 HH12 ARG 728 -7.606 -9.278 10.112 547 H ILE 729 H ILE 729 -6.086 -3.325 3.046 548 HA ILE 729 HA ILE 729 -3.753 -2.697 4.675 549 HB ILE 729 HB ILE 729 -5.660 -0.700 3.488 550 HG12 ILE 729 HG12 ILE 729 -3.474 -2.265 2.089 551 HG13 ILE 729 HG13 ILE 729 -5.193 -2.267 1.698 552 HG21 ILE 729 HG21 ILE 729 -2.935 -0.003 3.195 553 HG22 ILE 729 HG22 ILE 729 -4.111 0.698 4.307 554 HG23 ILE 729 HG23 ILE 729 -3.108 -0.656 4.821 555 HD11 ILE 729 HD11 ILE 729 -3.350 -0.675 0.476 556 HD12 ILE 729 HD12 ILE 729 -5.068 -0.305 0.573 557 HD13 ILE 729 HD13 ILE 729 -3.950 0.404 1.733 558 H THR 730 H THR 730 -7.234 -2.402 4.808 559 HA THR 730 HA THR 730 -7.039 -1.136 7.473 560 HB THR 730 HB THR 730 -8.345 0.059 5.793 561 HG1 THR 730 HG1 THR 730 -9.749 0.574 7.247 562 HG21 THR 730 HG21 THR 730 -9.342 -2.601 5.238 563 HG22 THR 730 HG22 THR 730 -10.668 -1.474 5.513 564 HG23 THR 730 HG23 THR 730 -9.472 -1.140 4.265 565 H GLU 731 H GLU 731 -7.336 -4.025 5.996 566 HA GLU 731 HA GLU 731 -7.768 -6.113 6.760 567 HB2 GLU 731 HB2 GLU 731 -8.438 -4.881 9.425 568 HB3 GLU 731 HB3 GLU 731 -7.833 -6.507 9.098 569 HG2 GLU 731 HG2 GLU 731 -5.957 -4.874 7.852 570 HG3 GLU 731 HG3 GLU 731 -6.348 -3.973 9.312 571 H LYS 732 H LYS 732 -10.004 -3.681 6.570 572 HA LYS 732 HA LYS 732 -12.342 -5.269 7.277 573 HB2 LYS 732 HB2 LYS 732 -12.332 -2.615 5.833 574 HB3 LYS 732 HB3 LYS 732 -13.619 -3.317 6.812 575 HG2 LYS 732 HG2 LYS 732 -10.908 -2.547 7.929 576 HG3 LYS 732 HG3 LYS 732 -12.306 -1.480 7.958 577 HD2 LYS 732 HD2 LYS 732 -12.768 -4.227 8.988 578 HD3 LYS 732 HD3 LYS 732 -11.716 -3.209 9.970 579 HE2 LYS 732 HE2 LYS 732 -14.280 -2.047 8.942 580 HE3 LYS 732 HE3 LYS 732 -14.340 -3.156 10.314 581 HZ1 LYS 732 HZ1 LYS 732 -12.242 -1.168 10.499 582 HZ2 LYS 732 HZ2 LYS 732 -13.825 -0.517 10.496 583 HZ3 LYS 732 HZ3 LYS 732 -13.392 -1.677 11.681 584 H LYS 733 H LYS 733 -10.662 -4.109 4.395 585 HA LYS 733 HA LYS 733 -12.277 -5.973 2.764 586 HB2 LYS 733 HB2 LYS 733 -13.100 -3.831 2.145 587 HB3 LYS 733 HB3 LYS 733 -11.483 -3.125 2.139 588 HG2 LYS 733 HG2 LYS 733 -12.368 -3.588 -0.164 589 HG3 LYS 733 HG3 LYS 733 -10.860 -4.434 0.181 590 HD2 LYS 733 HD2 LYS 733 -11.969 -6.517 0.483 591 HD3 LYS 733 HD3 LYS 733 -13.547 -5.747 0.642 592 HE2 LYS 733 HE2 LYS 733 -13.865 -6.061 -1.561 593 HE3 LYS 733 HE3 LYS 733 -12.541 -4.937 -1.872 594 HZ1 LYS 733 HZ1 LYS 733 -11.603 -6.723 -2.838 595 HZ2 LYS 733 HZ2 LYS 733 -11.188 -7.183 -1.244 596 HZ3 LYS 733 HZ3 LYS 733 -12.572 -7.836 -1.998 597 H ALA 734 H ALA 734 -10.974 -7.546 2.110 598 HA ALA 734 HA ALA 734 -8.131 -6.969 1.602 599 HB1 ALA 734 HB1 ALA 734 -9.057 -8.860 3.183 600 HB2 ALA 734 HB2 ALA 734 -7.667 -9.175 2.145 601 HB3 ALA 734 HB3 ALA 734 -9.270 -9.739 1.669 602 H PHE 735 H PHE 735 -7.194 -8.545 -0.117 603 HA PHE 735 HA PHE 735 -8.958 -8.967 -2.408 604 HB2 PHE 735 HB2 PHE 735 -6.956 -6.805 -2.237 605 HB3 PHE 735 HB3 PHE 735 -6.903 -7.763 -3.715 606 HD1 PHE 735 HD2 PHE 735 -9.036 -8.069 -5.061 607 HD2 PHE 735 HD1 PHE 735 -8.704 -5.238 -1.850 608 HE1 PHE 735 HE2 PHE 735 -11.036 -6.876 -5.909 609 HE2 PHE 735 HE1 PHE 735 -10.703 -4.042 -2.697 610 HZ PHE 735 HZ PHE 735 -11.872 -4.861 -4.726 611 H ARG 736 H ARG 736 -7.770 -10.039 -4.221 612 HA ARG 736 HA ARG 736 -6.671 -12.450 -3.526 613 HB2 ARG 736 HB2 ARG 736 -6.543 -10.794 -6.007 614 HB3 ARG 736 HB3 ARG 736 -5.567 -12.255 -5.913 615 HG2 ARG 736 HG2 ARG 736 -7.661 -12.900 -6.885 616 HG3 ARG 736 HG3 ARG 736 -7.675 -13.494 -5.226 617 HD2 ARG 736 HD2 ARG 736 -9.216 -11.895 -4.520 618 HD3 ARG 736 HD3 ARG 736 -8.801 -10.771 -5.809 619 HE ARG 736 HE ARG 736 -10.636 -13.038 -5.996 620 HH11 ARG 736 HH21 ARG 736 -8.835 -10.532 -7.623 621 HH12 ARG 736 HH22 ARG 736 -9.774 -10.685 -9.081 622 HH21 ARG 736 HH11 ARG 736 -11.816 -13.176 -7.888 623 HH22 ARG 736 HH12 ARG 736 -11.439 -12.148 -9.224 624 H GLY 737 H GLY 737 -4.839 -9.486 -4.268 625 HA2 GLY 737 HA2 GLY 737 -2.580 -10.523 -2.753 626 HA3 GLY 737 HA3 GLY 737 -2.285 -10.269 -4.472 627 H LEU 738 H LEU 738 -0.709 -8.683 -3.829 628 HA LEU 738 HA LEU 738 -1.449 -6.325 -2.393 629 HB2 LEU 738 HB2 LEU 738 0.900 -7.135 -4.068 630 HB3 LEU 738 HB3 LEU 738 0.705 -5.462 -3.583 631 HG LEU 738 HG LEU 738 0.994 -7.876 -1.780 632 HD11 LEU 738 HD11 LEU 738 3.035 -6.894 -1.131 633 HD12 LEU 738 HD12 LEU 738 2.989 -6.631 -2.873 634 HD13 LEU 738 HD13 LEU 738 2.584 -5.318 -1.773 635 HD21 LEU 738 HD21 LEU 738 0.949 -5.922 -0.006 636 HD22 LEU 738 HD22 LEU 738 -0.012 -5.094 -1.232 637 HD23 LEU 738 HD23 LEU 738 -0.566 -6.627 -0.561 638 H THR 739 H THR 739 -0.734 -7.009 -5.779 639 HA THR 739 HA THR 739 -1.358 -4.589 -6.928 640 HB THR 739 HB THR 739 -2.324 -7.103 -8.239 641 HG1 THR 739 HG1 THR 739 0.416 -6.469 -8.090 642 HG21 THR 739 HG21 THR 739 -2.346 -5.514 -9.857 643 HG22 THR 739 HG22 THR 739 -1.202 -4.477 -9.000 644 HG23 THR 739 HG23 THR 739 -0.616 -5.845 -9.946 645 H GLU 740 H GLU 740 -3.595 -7.340 -6.525 646 HA GLU 740 HA GLU 740 -5.896 -5.945 -7.329 647 HB2 GLU 740 HB2 GLU 740 -5.667 -8.296 -5.437 648 HB3 GLU 740 HB3 GLU 740 -7.149 -7.761 -6.230 649 HG2 GLU 740 HG2 GLU 740 -5.223 -8.003 -8.287 650 HG3 GLU 740 HG3 GLU 740 -5.029 -9.435 -7.281 651 H LEU 741 H LEU 741 -4.310 -6.170 -4.213 652 HA LEU 741 HA LEU 741 -6.478 -4.917 -2.774 653 HB2 LEU 741 HB2 LEU 741 -4.925 -6.534 -1.716 654 HB3 LEU 741 HB3 LEU 741 -3.595 -5.415 -1.977 655 HG LEU 741 HG LEU 741 -4.727 -5.450 0.350 656 HD11 LEU 741 HD11 LEU 741 -3.605 -3.537 0.566 657 HD12 LEU 741 HD12 LEU 741 -3.503 -3.429 -1.188 658 HD13 LEU 741 HD13 LEU 741 -4.842 -2.661 -0.336 659 HD21 LEU 741 HD21 LEU 741 -6.735 -4.175 0.617 660 HD22 LEU 741 HD22 LEU 741 -6.711 -3.658 -1.066 661 HD23 LEU 741 HD23 LEU 741 -7.056 -5.338 -0.664 662 H VAL 742 H VAL 742 -3.395 -3.928 -4.177 663 HA VAL 742 HA VAL 742 -3.655 -1.188 -3.198 664 HB VAL 742 HB VAL 742 -1.657 -2.530 -5.026 665 HG11 VAL 742 HG11 VAL 742 -0.457 -0.255 -4.104 666 HG12 VAL 742 HG12 VAL 742 -1.210 -0.414 -5.692 667 HG13 VAL 742 HG13 VAL 742 -2.109 0.301 -4.356 668 HG21 VAL 742 HG21 VAL 742 -1.777 -3.131 -2.536 669 HG22 VAL 742 HG22 VAL 742 -0.219 -2.562 -3.132 670 HG23 VAL 742 HG23 VAL 742 -1.266 -1.472 -2.224 671 H GLU 743 H GLU 743 -4.054 -2.936 -6.251 672 HA GLU 743 HA GLU 743 -4.438 -0.569 -7.835 673 HB2 GLU 743 HB2 GLU 743 -5.233 -3.428 -8.427 674 HB3 GLU 743 HB3 GLU 743 -5.134 -2.110 -9.592 675 HG2 GLU 743 HG2 GLU 743 -2.726 -2.733 -7.910 676 HG3 GLU 743 HG3 GLU 743 -3.103 -3.774 -9.276 677 H PHE 744 H PHE 744 -6.208 -1.696 -5.410 678 HA PHE 744 HA PHE 744 -8.808 -1.079 -6.661 679 HB2 PHE 744 HB2 PHE 744 -8.622 -3.282 -5.518 680 HB3 PHE 744 HB3 PHE 744 -8.244 -2.443 -4.014 681 HD1 PHE 744 HD2 PHE 744 -10.844 -2.900 -6.628 682 HD2 PHE 744 HD1 PHE 744 -9.956 -1.381 -2.707 683 HE1 PHE 744 HE2 PHE 744 -13.263 -2.553 -6.213 684 HE2 PHE 744 HE1 PHE 744 -12.376 -1.033 -2.293 685 HZ PHE 744 HZ PHE 744 -14.029 -1.619 -4.046 686 H TYR 745 H TYR 745 -6.726 -0.421 -3.882 687 HA TYR 745 HA TYR 745 -8.426 1.574 -2.756 688 HB2 TYR 745 HB2 TYR 745 -5.563 0.773 -2.303 689 HB3 TYR 745 HB3 TYR 745 -6.247 2.200 -1.524 690 HD1 TYR 745 HD1 TYR 745 -7.492 -1.263 -2.293 691 HD2 TYR 745 HD2 TYR 745 -6.941 1.800 0.674 692 HE1 TYR 745 HE1 TYR 745 -8.597 -2.697 -0.601 693 HE2 TYR 745 HE2 TYR 745 -8.034 0.351 2.359 694 HH TYR 745 HH TYR 745 -8.961 -2.976 1.620 695 H GLN 746 H GLN 746 -6.326 1.568 -5.449 696 HA GLN 746 HA GLN 746 -5.500 4.295 -5.415 697 HB2 GLN 746 HB2 GLN 746 -5.272 3.952 -7.928 698 HB3 GLN 746 HB3 GLN 746 -4.349 2.838 -6.922 699 HG2 GLN 746 HG2 GLN 746 -5.571 1.038 -7.569 700 HG3 GLN 746 HG3 GLN 746 -7.088 1.927 -7.546 701 HE21 GLN 746 HE21 GLN 746 -4.571 0.726 -9.613 702 HE22 GLN 746 HE22 GLN 746 -5.135 1.439 -11.045 703 H GLN 747 H GLN 747 -8.438 2.676 -6.060 704 HA GLN 747 HA GLN 747 -9.690 5.122 -7.156 705 HB2 GLN 747 HB2 GLN 747 -11.040 2.441 -7.116 706 HB3 GLN 747 HB3 GLN 747 -11.269 3.785 -8.231 707 HG2 GLN 747 HG2 GLN 747 -8.543 2.967 -8.434 708 HG3 GLN 747 HG3 GLN 747 -9.534 1.515 -8.512 709 HE21 GLN 747 HE21 GLN 747 -7.997 3.080 -10.658 710 HE22 GLN 747 HE22 GLN 747 -9.164 3.346 -11.872 711 H ASN 748 H ASN 748 -10.012 2.524 -4.768 712 HA ASN 748 HA ASN 748 -12.333 3.594 -3.504 713 HB2 ASN 748 HB2 ASN 748 -11.487 1.201 -3.360 714 HB3 ASN 748 HB3 ASN 748 -10.258 1.792 -2.248 715 HD21 ASN 748 HD21 ASN 748 -11.360 3.308 -0.421 716 HD22 ASN 748 HD22 ASN 748 -12.747 2.623 0.298 717 H SER 749 H SER 749 -12.333 5.537 -2.570 718 HA SER 749 HA SER 749 -10.225 7.114 -1.803 719 HB2 SER 749 HB2 SER 749 -12.103 7.850 0.017 720 HB3 SER 749 HB3 SER 749 -12.107 8.359 -1.669 721 HG SER 749 HG SER 749 -13.395 6.048 -0.615 722 H LEU 750 H LEU 750 -8.673 6.886 -0.325 723 HA LEU 750 HA LEU 750 -8.615 4.779 1.544 724 HB2 LEU 750 HB2 LEU 750 -7.060 7.382 1.528 725 HB3 LEU 750 HB3 LEU 750 -6.684 5.991 2.544 726 HG LEU 750 HG LEU 750 -6.730 6.013 -0.485 727 HD11 LEU 750 HD11 LEU 750 -4.312 5.721 -0.297 728 HD12 LEU 750 HD12 LEU 750 -4.794 7.180 0.565 729 HD13 LEU 750 HD13 LEU 750 -4.426 5.708 1.463 730 HD21 LEU 750 HD21 LEU 750 -6.764 3.864 1.512 731 HD22 LEU 750 HD22 LEU 750 -7.094 3.794 -0.217 732 HD23 LEU 750 HD23 LEU 750 -5.434 3.724 0.367 733 H LYS 751 H LYS 751 -9.838 8.028 1.707 734 HA LYS 751 HA LYS 751 -10.025 8.461 4.440 735 HB2 LYS 751 HB2 LYS 751 -11.486 10.175 3.921 736 HB3 LYS 751 HB3 LYS 751 -10.607 9.974 2.410 737 HG2 LYS 751 HG2 LYS 751 -12.610 8.186 2.020 738 HG3 LYS 751 HG3 LYS 751 -13.439 9.360 3.037 739 HD2 LYS 751 HD2 LYS 751 -12.164 9.791 0.345 740 HD3 LYS 751 HD3 LYS 751 -13.823 10.114 0.829 741 HE2 LYS 751 HE2 LYS 751 -11.356 11.706 1.292 742 HE3 LYS 751 HE3 LYS 751 -12.959 12.251 0.840 743 HZ1 LYS 751 HZ1 LYS 751 -12.729 11.047 3.466 744 HZ2 LYS 751 HZ2 LYS 751 -11.901 12.543 3.266 745 HZ3 LYS 751 HZ3 LYS 751 -13.583 12.423 2.975 746 H ASP 752 H ASP 752 -11.569 6.056 2.596 747 HA ASP 752 HA ASP 752 -13.744 5.732 4.553 748 HB2 ASP 752 HB2 ASP 752 -14.900 5.280 2.683 749 HB3 ASP 752 HB3 ASP 752 -13.431 5.229 1.719 750 H CYS 753 H CYS 753 -11.081 3.930 3.043 751 HA CYS 753 HA CYS 753 -11.404 1.670 4.832 752 HB2 CYS 753 HB2 CYS 753 -9.309 2.364 2.766 753 HB3 CYS 753 HB3 CYS 753 -9.297 0.877 3.714 754 HG CYS 753 HG CYS 753 -11.955 1.316 2.264 755 H PHE 754 H PHE 754 -9.190 4.412 4.427 756 HA PHE 754 HA PHE 754 -7.488 3.535 6.614 757 HB2 PHE 754 HB2 PHE 754 -7.555 5.981 4.849 758 HB3 PHE 754 HB3 PHE 754 -6.427 5.824 6.188 759 HD1 PHE 754 HD2 PHE 754 -7.526 2.878 4.193 760 HD2 PHE 754 HD1 PHE 754 -4.451 5.818 4.785 761 HE1 PHE 754 HE2 PHE 754 -6.003 1.573 2.754 762 HE2 PHE 754 HE1 PHE 754 -2.938 4.509 3.345 763 HZ PHE 754 HZ PHE 754 -3.703 2.391 2.324 764 H LYS 755 H LYS 755 -7.957 6.904 6.700 765 HA LYS 755 HA LYS 755 -10.058 6.924 8.708 766 HB2 LYS 755 HB2 LYS 755 -8.143 6.160 10.013 767 HB3 LYS 755 HB3 LYS 755 -7.209 7.549 9.473 768 HG2 LYS 755 HG2 LYS 755 -8.785 9.076 10.575 769 HG3 LYS 755 HG3 LYS 755 -9.806 7.714 11.035 770 HD2 LYS 755 HD2 LYS 755 -8.606 7.595 12.934 771 HD3 LYS 755 HD3 LYS 755 -7.277 6.990 11.948 772 HE2 LYS 755 HE2 LYS 755 -7.792 9.835 12.840 773 HE3 LYS 755 HE3 LYS 755 -6.367 8.841 13.146 774 HZ1 LYS 755 HZ1 LYS 755 -5.516 9.895 11.373 775 HZ2 LYS 755 HZ2 LYS 755 -6.495 8.872 10.445 776 HZ3 LYS 755 HZ3 LYS 755 -7.050 10.441 10.823 777 H SER 756 H SER 756 -7.617 9.273 9.100 778 HA SER 756 HA SER 756 -9.363 11.364 8.180 779 HB2 SER 756 HB2 SER 756 -6.467 11.709 8.949 780 HB3 SER 756 HB3 SER 756 -7.787 12.866 9.106 781 HG SER 756 HG SER 756 -8.550 11.790 10.829 782 H LEU 757 H LEU 757 -8.168 9.328 6.308 783 HA LEU 757 HA LEU 757 -6.353 10.769 4.607 784 HB2 LEU 757 HB2 LEU 757 -7.668 8.108 4.638 785 HB3 LEU 757 HB3 LEU 757 -7.239 8.742 3.053 786 HG LEU 757 HG LEU 757 -5.472 7.331 4.306 787 HD11 LEU 757 HD11 LEU 757 -4.804 8.422 2.349 788 HD12 LEU 757 HD12 LEU 757 -4.990 10.017 3.070 789 HD13 LEU 757 HD13 LEU 757 -3.653 8.981 3.562 790 HD21 LEU 757 HD21 LEU 757 -5.928 8.922 6.397 791 HD22 LEU 757 HD22 LEU 757 -4.343 8.217 6.103 792 HD23 LEU 757 HD23 LEU 757 -4.669 9.882 5.623 793 H ASP 758 H ASP 758 -6.857 11.102 2.300 794 HA ASP 758 HA ASP 758 -9.572 11.431 1.457 795 HB2 ASP 758 HB2 ASP 758 -8.353 13.636 2.819 796 HB3 ASP 758 HB3 ASP 758 -8.526 14.066 1.122 797 H THR 759 H THR 759 -7.834 9.860 0.380 798 HA THR 759 HA THR 759 -7.464 10.851 -2.282 799 HB THR 759 HB THR 759 -5.460 11.827 -1.132 800 HG1 THR 759 HG1 THR 759 -5.064 11.486 -3.205 801 HG21 THR 759 HG21 THR 759 -4.820 8.892 -0.709 802 HG22 THR 759 HG22 THR 759 -3.653 10.195 -0.523 803 HG23 THR 759 HG23 THR 759 -5.052 10.110 0.546 804 H THR 760 H THR 760 -5.468 9.080 -3.091 805 HA THR 760 HA THR 760 -6.129 6.397 -2.192 806 HB THR 760 HB THR 760 -6.857 5.612 -4.421 807 HG1 THR 760 HG1 THR 760 -7.074 6.939 -6.047 808 HG21 THR 760 HG21 THR 760 -8.473 6.350 -2.590 809 HG22 THR 760 HG22 THR 760 -8.672 7.840 -3.513 810 HG23 THR 760 HG23 THR 760 -9.123 6.292 -4.227 811 H LEU 761 H LEU 761 -4.949 4.752 -3.593 812 HA LEU 761 HA LEU 761 -2.203 5.312 -3.683 813 HB2 LEU 761 HB2 LEU 761 -3.863 3.188 -5.075 814 HB3 LEU 761 HB3 LEU 761 -2.109 3.216 -5.126 815 HG LEU 761 HG LEU 761 -3.104 1.692 -3.374 816 HD11 LEU 761 HD11 LEU 761 -1.187 3.897 -2.761 817 HD12 LEU 761 HD12 LEU 761 -1.646 2.774 -1.487 818 HD13 LEU 761 HD13 LEU 761 -0.885 2.170 -2.956 819 HD21 LEU 761 HD21 LEU 761 -4.960 3.206 -2.695 820 HD22 LEU 761 HD22 LEU 761 -3.986 2.656 -1.337 821 HD23 LEU 761 HD23 LEU 761 -3.770 4.286 -1.966 822 H GLN 762 H GLN 762 -1.987 7.298 -4.788 823 HA GLN 762 HA GLN 762 -2.954 7.713 -7.436 824 HB2 GLN 762 HB2 GLN 762 -1.544 9.196 -5.393 825 HB3 GLN 762 HB3 GLN 762 -0.885 9.531 -6.989 826 HG2 GLN 762 HG2 GLN 762 -3.719 9.510 -7.248 827 HG3 GLN 762 HG3 GLN 762 -3.343 10.461 -5.813 828 HE21 GLN 762 HE21 GLN 762 -1.107 11.869 -6.392 829 HE22 GLN 762 HE22 GLN 762 -1.300 12.787 -7.804 830 H PHE 763 H PHE 763 0.455 7.487 -6.290 831 HA PHE 763 HA PHE 763 1.080 6.159 -8.859 832 HB2 PHE 763 HB2 PHE 763 2.478 8.598 -7.746 833 HB3 PHE 763 HB3 PHE 763 3.099 7.628 -9.081 834 HD1 PHE 763 HD1 PHE 763 1.663 7.343 -11.164 835 HD2 PHE 763 HD2 PHE 763 0.780 10.219 -8.098 836 HE1 PHE 763 HE1 PHE 763 0.191 8.568 -12.739 837 HE2 PHE 763 HE2 PHE 763 -0.693 11.445 -9.672 838 HZ PHE 763 HZ PHE 763 -0.988 10.620 -11.994 839 HA PRO 764 HA PRO 764 3.760 3.633 -6.413 840 HB2 PRO 764 HB2 PRO 764 5.413 2.675 -8.343 841 HB3 PRO 764 HB3 PRO 764 3.702 2.219 -8.254 842 HG2 PRO 764 HG2 PRO 764 5.049 4.159 -10.046 843 HG3 PRO 764 HG3 PRO 764 3.717 3.041 -10.378 844 HD2 PRO 764 HD2 PRO 764 3.410 5.755 -9.879 845 HD3 PRO 764 HD3 PRO 764 2.128 4.537 -9.692 846 H PHE 765 H PHE 765 6.453 3.122 -6.593 847 HA PHE 765 HA PHE 765 7.672 5.811 -6.420 848 HB2 PHE 765 HB2 PHE 765 8.862 5.214 -4.486 849 HB3 PHE 765 HB3 PHE 765 7.254 4.545 -4.224 850 HD1 PHE 765 HD1 PHE 765 6.850 2.087 -4.803 851 HD2 PHE 765 HD2 PHE 765 10.768 3.815 -4.509 852 HE1 PHE 765 HE1 PHE 765 7.829 -0.175 -4.535 853 HE2 PHE 765 HE2 PHE 765 11.747 1.558 -4.243 854 HZ PHE 765 HZ PHE 765 10.277 -0.438 -4.255 855 H LYS 766 H LYS 766 7.803 2.815 -7.970 856 HA LYS 766 HA LYS 766 10.677 3.058 -8.541 857 HB2 LYS 766 HB2 LYS 766 8.707 0.909 -9.335 858 HB3 LYS 766 HB3 LYS 766 10.447 0.868 -9.608 859 HG2 LYS 766 HG2 LYS 766 10.403 1.410 -6.951 860 HG3 LYS 766 HG3 LYS 766 8.921 0.470 -7.091 861 HD2 LYS 766 HD2 LYS 766 11.348 -0.575 -8.468 862 HD3 LYS 766 HD3 LYS 766 11.294 -0.690 -6.712 863 HE2 LYS 766 HE2 LYS 766 8.743 -1.508 -7.591 864 HE3 LYS 766 HE3 LYS 766 9.890 -2.288 -8.683 865 HZ1 LYS 766 HZ1 LYS 766 11.006 -2.526 -6.190 866 HZ2 LYS 766 HZ2 LYS 766 9.346 -2.836 -5.921 867 HZ3 LYS 766 HZ3 LYS 766 10.225 -3.755 -7.061 868 H GLU 767 H GLU 767 7.524 3.227 -10.088 869 HA GLU 767 HA GLU 767 7.002 3.532 -12.365 870 HB2 GLU 767 HB2 GLU 767 7.682 5.843 -10.826 871 HB3 GLU 767 HB3 GLU 767 8.126 6.140 -12.506 872 HG2 GLU 767 HG2 GLU 767 5.744 5.054 -12.971 873 HG3 GLU 767 HG3 GLU 767 5.429 5.591 -11.325 874 H1 ASP 338 H1 ASP 338 9.923 8.447 12.173 875 H2 ASP 338 H2 ASP 338 10.421 10.152 12.561 876 H3 ASP 338 H3 ASP 338 9.437 9.387 11.399 877 HA ASP 338 HA ASP 338 8.813 10.166 14.162 878 HB2 ASP 338 HB2 ASP 338 6.623 10.679 12.956 879 HB3 ASP 338 HB3 ASP 338 8.021 11.611 12.423 880 H THR 339 H THR 339 6.312 8.703 12.273 881 HA THR 339 HA THR 339 5.980 6.634 14.266 882 HB THR 339 HB THR 339 3.970 6.074 13.197 883 HG1 THR 339 HG1 THR 339 3.936 5.831 11.142 884 HG21 THR 339 HG21 THR 339 3.016 8.062 13.590 885 HG22 THR 339 HG22 THR 339 4.604 8.823 13.525 886 HG23 THR 339 HG23 THR 339 3.633 8.683 12.060 887 H GLU 340 H GLU 340 8.400 6.211 13.549 888 HA GLU 340 HA GLU 340 9.311 4.917 11.392 889 HB2 GLU 340 HB2 GLU 340 9.855 4.668 14.270 890 HB3 GLU 340 HB3 GLU 340 10.375 3.287 13.303 891 HG2 GLU 340 HG2 GLU 340 12.063 5.212 13.568 892 HG3 GLU 340 HG3 GLU 340 11.771 4.634 11.931 893 H VAL 341 H VAL 341 7.108 3.466 13.739 894 HA VAL 341 HA VAL 341 6.849 1.151 11.918 895 HB VAL 341 HB VAL 341 7.839 0.492 14.064 896 HG11 VAL 341 HG11 VAL 341 6.927 2.255 15.498 897 HG12 VAL 341 HG12 VAL 341 5.292 1.649 15.241 898 HG13 VAL 341 HG13 VAL 341 6.460 0.677 16.132 899 HG21 VAL 341 HG21 VAL 341 6.331 -1.074 12.907 900 HG22 VAL 341 HG22 VAL 341 6.171 -1.239 14.657 901 HG23 VAL 341 HG23 VAL 341 4.945 -0.366 13.738 902 H PTR 342 H PTR 342 4.888 0.710 11.131 903 HA PTR 342 HA PTR 342 2.773 2.572 11.296 904 HB2 PTR 342 HB2 PTR 342 1.517 0.352 10.358 905 HB3 PTR 342 HB3 PTR 342 2.523 1.399 9.358 906 HD1 PTR 342 HD1 PTR 342 2.358 -1.809 11.166 907 HD2 PTR 342 HD2 PTR 342 4.788 0.765 8.740 908 HE1 PTR 342 HE1 PTR 342 3.967 -3.662 10.806 909 HE2 PTR 342 HE2 PTR 342 6.394 -1.070 8.399 910 H GLU 343 H GLU 343 2.275 2.899 13.465 911 HA GLU 343 HA GLU 343 1.540 0.850 15.292 912 HB2 GLU 343 HB2 GLU 343 0.534 2.746 16.576 913 HB3 GLU 343 HB3 GLU 343 2.196 3.051 16.069 914 HG2 GLU 343 HG2 GLU 343 -0.016 3.910 14.237 915 HG3 GLU 343 HG3 GLU 343 0.286 4.872 15.680 916 H SER 344 H SER 344 0.231 0.093 13.018 917 HA SER 344 HA SER 344 -1.861 -0.250 12.025 918 HB2 SER 344 HB2 SER 344 -1.672 -1.361 14.548 919 HB3 SER 344 HB3 SER 344 -3.210 -0.506 14.616 920 HG SER 344 HG SER 344 -4.003 -1.785 13.094 921 HA PRO 345 HA PRO 345 -3.128 4.218 13.167 922 HB2 PRO 345 HB2 PRO 345 -3.206 4.886 10.428 923 HB3 PRO 345 HB3 PRO 345 -1.912 5.285 11.572 924 HG2 PRO 345 HG2 PRO 345 -2.090 3.058 9.614 925 HG3 PRO 345 HG3 PRO 345 -0.685 4.016 10.117 926 HD2 PRO 345 HD2 PRO 345 -1.026 1.512 11.023 927 HD3 PRO 345 HD3 PRO 345 -0.387 2.786 12.091 928 H PTR 346 H PTR 346 -4.236 2.320 10.333 929 HA PTR 346 HA PTR 346 -7.014 3.057 11.054 930 HB2 PTR 346 HB2 PTR 346 -6.164 2.364 8.257 931 HB3 PTR 346 HB3 PTR 346 -7.572 3.279 8.797 932 HD1 PTR 346 HD1 PTR 346 -4.967 3.897 6.896 933 HD2 PTR 346 HD2 PTR 346 -6.359 5.101 10.774 934 HE1 PTR 346 HE1 PTR 346 -3.661 6.011 6.723 935 HE2 PTR 346 HE2 PTR 346 -5.067 7.197 10.600 936 H ALA 347 H ALA 347 -8.659 1.595 10.669 937 HA ALA 347 HA ALA 347 -8.748 -0.875 9.573 938 HB1 ALA 347 HB1 ALA 347 -7.267 -0.967 12.181 939 HB2 ALA 347 HB2 ALA 347 -6.965 -1.862 10.692 940 HB3 ALA 347 HB3 ALA 347 -8.315 -2.313 11.733 941 H ASP 348 H ASP 348 -9.252 0.426 12.851 942 HA ASP 348 HA ASP 348 -12.145 0.295 12.486 943 HB2 ASP 348 HB2 ASP 348 -10.619 -1.392 14.452 944 HB3 ASP 348 HB3 ASP 348 -12.244 -0.835 14.841 945 HA PRO 349 HA PRO 349 -10.695 3.838 15.084 946 HB2 PRO 349 HB2 PRO 349 -11.145 5.859 13.336 947 HB3 PRO 349 HB3 PRO 349 -9.666 4.880 13.292 948 HG2 PRO 349 HG2 PRO 349 -12.000 4.849 11.487 949 HG3 PRO 349 HG3 PRO 349 -10.312 4.426 11.166 950 HD2 PRO 349 HD2 PRO 349 -12.463 2.621 11.688 951 HD3 PRO 349 HD3 PRO 349 -10.741 2.219 11.519 952 H GLU 350 H GLU 350 -12.003 6.108 15.300 953 HA GLU 350 HA GLU 350 -14.679 5.323 16.096 954 HB2 GLU 350 HB2 GLU 350 -14.793 7.748 16.849 955 HB3 GLU 350 HB3 GLU 350 -13.538 6.768 17.607 956 HG2 GLU 350 HG2 GLU 350 -12.882 8.300 15.107 957 HG3 GLU 350 HG3 GLU 350 -12.949 9.159 16.643 Start of MODEL 20 1 H1 GLY 661 H1 GLY 661 5.017 -14.658 -11.054 2 H2 GLY 661 H2 GLY 661 5.649 -15.967 -10.155 3 H3 GLY 661 H3 GLY 661 3.970 -15.809 -10.358 4 HA2 GLY 661 HA2 GLY 661 5.911 -16.310 -12.557 5 HA3 GLY 661 HA3 GLY 661 4.892 -17.541 -11.807 6 H HIS 662 H HIS 662 4.366 -14.182 -12.927 7 HA HIS 662 HA HIS 662 2.769 -13.257 -14.294 8 HB2 HIS 662 HB2 HIS 662 2.718 -16.060 -15.442 9 HB3 HIS 662 HB3 HIS 662 1.902 -14.672 -16.160 10 HD1 HIS 662 HD1 HIS 662 4.553 -16.384 -17.163 11 HD2 HIS 662 HD2 HIS 662 4.368 -12.472 -15.747 12 HE1 HIS 662 HE1 HIS 662 6.635 -15.213 -18.024 13 HE2 HIS 662 HE2 HIS 662 6.537 -12.820 -17.165 14 H MET 663 H MET 663 1.872 -13.748 -11.839 15 HA MET 663 HA MET 663 -0.963 -14.324 -12.320 16 HB2 MET 663 HB2 MET 663 0.193 -16.486 -11.602 17 HB3 MET 663 HB3 MET 663 0.465 -15.711 -10.046 18 HG2 MET 663 HG2 MET 663 -2.180 -15.179 -10.389 19 HG3 MET 663 HG3 MET 663 -2.048 -16.717 -11.236 20 HE1 MET 663 HE1 MET 663 -1.925 -19.112 -9.858 21 HE2 MET 663 HE2 MET 663 -3.022 -18.797 -8.519 22 HE3 MET 663 HE3 MET 663 -3.312 -18.047 -10.092 23 H GLN 664 H GLN 664 0.930 -14.139 -9.315 24 HA GLN 664 HA GLN 664 -0.450 -11.590 -8.715 25 HB2 GLN 664 HB2 GLN 664 -1.072 -13.620 -7.297 26 HB3 GLN 664 HB3 GLN 664 0.568 -13.549 -6.655 27 HG2 GLN 664 HG2 GLN 664 -1.287 -12.309 -5.343 28 HG3 GLN 664 HG3 GLN 664 0.220 -11.452 -5.643 29 HE21 GLN 664 HE21 GLN 664 -3.120 -11.801 -6.912 30 HE22 GLN 664 HE22 GLN 664 -3.178 -10.247 -7.592 31 H ASP 665 H ASP 665 2.229 -12.373 -9.971 32 HA ASP 665 HA ASP 665 4.407 -11.823 -8.385 33 HB2 ASP 665 HB2 ASP 665 4.165 -10.593 -11.118 34 HB3 ASP 665 HB3 ASP 665 5.560 -11.360 -10.371 35 H LEU 666 H LEU 666 5.036 -10.128 -7.195 36 HA LEU 666 HA LEU 666 3.562 -7.608 -7.467 37 HB2 LEU 666 HB2 LEU 666 5.469 -8.448 -5.280 38 HB3 LEU 666 HB3 LEU 666 4.308 -7.121 -5.235 39 HG LEU 666 HG LEU 666 3.533 -10.031 -5.587 40 HD11 LEU 666 HD11 LEU 666 4.148 -8.427 -3.192 41 HD12 LEU 666 HD12 LEU 666 2.603 -9.266 -3.132 42 HD13 LEU 666 HD13 LEU 666 4.087 -10.176 -3.394 43 HD21 LEU 666 HD21 LEU 666 1.934 -7.524 -4.969 44 HD22 LEU 666 HD22 LEU 666 1.905 -8.426 -6.484 45 HD23 LEU 666 HD23 LEU 666 1.279 -9.162 -5.011 46 H SER 667 H SER 667 6.833 -8.902 -7.421 47 HA SER 667 HA SER 667 8.264 -6.502 -7.593 48 HB2 SER 667 HB2 SER 667 8.951 -9.197 -8.771 49 HB3 SER 667 HB3 SER 667 10.084 -7.872 -8.507 50 HG SER 667 HG SER 667 10.253 -9.083 -6.695 51 H VAL 668 H VAL 668 6.005 -7.636 -9.749 52 HA VAL 668 HA VAL 668 7.384 -6.651 -12.135 53 HB VAL 668 HB VAL 668 5.532 -7.530 -13.386 54 HG11 VAL 668 HG11 VAL 668 7.206 -9.155 -12.491 55 HG12 VAL 668 HG12 VAL 668 6.138 -9.447 -11.118 56 HG13 VAL 668 HG13 VAL 668 5.617 -9.878 -12.747 57 HG21 VAL 668 HG21 VAL 668 3.701 -8.727 -11.882 58 HG22 VAL 668 HG22 VAL 668 4.197 -7.518 -10.698 59 HG23 VAL 668 HG23 VAL 668 3.562 -7.011 -12.262 60 H HIS 669 H HIS 669 5.609 -5.457 -9.633 61 HA HIS 669 HA HIS 669 4.244 -3.354 -11.161 62 HB2 HIS 669 HB2 HIS 669 4.349 -3.779 -8.166 63 HB3 HIS 669 HB3 HIS 669 3.248 -2.726 -9.048 64 HD1 HIS 669 HD1 HIS 669 2.281 -4.558 -11.274 65 HD2 HIS 669 HD2 HIS 669 2.723 -5.824 -7.337 66 HE1 HIS 669 HE1 HIS 669 0.698 -6.514 -10.968 67 HE2 HIS 669 HE2 HIS 669 0.838 -7.212 -8.518 68 H LEU 670 H LEU 670 4.390 -1.196 -9.625 69 HA LEU 670 HA LEU 670 7.257 -0.616 -9.295 70 HB2 LEU 670 HB2 LEU 670 6.498 1.815 -9.940 71 HB3 LEU 670 HB3 LEU 670 6.922 0.663 -11.181 72 HG LEU 670 HG LEU 670 4.139 1.359 -10.254 73 HD11 LEU 670 HD11 LEU 670 5.394 1.751 -12.965 74 HD12 LEU 670 HD12 LEU 670 3.903 2.461 -12.347 75 HD13 LEU 670 HD13 LEU 670 5.459 2.978 -11.702 76 HD21 LEU 670 HD21 LEU 670 5.161 -0.930 -11.771 77 HD22 LEU 670 HD22 LEU 670 3.560 -0.678 -11.068 78 HD23 LEU 670 HD23 LEU 670 3.943 -0.019 -12.657 79 H TRP 671 H TRP 671 4.332 -0.893 -7.819 80 HA TRP 671 HA TRP 671 4.978 1.223 -5.913 81 HB2 TRP 671 HB2 TRP 671 2.658 0.651 -4.964 82 HB3 TRP 671 HB3 TRP 671 2.736 1.519 -6.489 83 HD1 TRP 671 HD1 TRP 671 1.426 0.526 -8.415 84 HE1 TRP 671 HE1 TRP 671 0.239 -1.722 -8.882 85 HE3 TRP 671 HE3 TRP 671 3.001 -2.143 -4.350 86 HZ2 TRP 671 HZ2 TRP 671 0.045 -4.312 -7.700 87 HZ3 TRP 671 HZ3 TRP 671 2.299 -4.503 -4.051 88 HH2 TRP 671 HH2 TRP 671 0.820 -5.588 -5.720 89 H TYR 672 H TYR 672 5.386 -2.022 -6.435 90 HA TYR 672 HA TYR 672 5.209 -2.838 -3.634 91 HB2 TYR 672 HB2 TYR 672 4.462 -4.428 -5.333 92 HB3 TYR 672 HB3 TYR 672 6.042 -4.361 -6.113 93 HD1 TYR 672 HD2 TYR 672 4.845 -4.692 -2.564 94 HD2 TYR 672 HD1 TYR 672 7.323 -6.251 -5.710 95 HE1 TYR 672 HE2 TYR 672 5.701 -6.444 -1.032 96 HE2 TYR 672 HE1 TYR 672 8.169 -8.005 -4.177 97 HH TYR 672 HH TYR 672 7.434 -9.146 -2.112 98 H ALA 673 H ALA 673 6.834 -2.341 -2.315 99 HA ALA 673 HA ALA 673 9.567 -2.123 -3.415 100 HB1 ALA 673 HB1 ALA 673 8.627 -0.215 -2.089 101 HB2 ALA 673 HB2 ALA 673 10.104 -0.890 -1.400 102 HB3 ALA 673 HB3 ALA 673 8.538 -1.288 -0.691 103 H GLY 674 H GLY 674 7.536 -4.040 -1.401 104 HA2 GLY 674 HA2 GLY 674 7.885 -5.928 -0.131 105 HA3 GLY 674 HA3 GLY 674 9.156 -6.283 -1.287 106 HA PRO 675 HA PRO 675 11.845 -6.136 2.247 107 HB2 PRO 675 HB2 PRO 675 14.230 -5.959 0.841 108 HB3 PRO 675 HB3 PRO 675 13.352 -7.467 1.154 109 HG2 PRO 675 HG2 PRO 675 13.416 -5.787 -1.297 110 HG3 PRO 675 HG3 PRO 675 13.362 -7.551 -1.134 111 HD2 PRO 675 HD2 PRO 675 11.163 -6.083 -1.783 112 HD3 PRO 675 HD3 PRO 675 11.059 -7.591 -0.844 113 H MET 676 H MET 676 10.707 -3.847 2.297 114 HA MET 676 HA MET 676 12.870 -1.822 2.219 115 HB2 MET 676 HB2 MET 676 11.258 -1.554 0.315 116 HB3 MET 676 HB3 MET 676 9.976 -1.306 1.498 117 HG2 MET 676 HG2 MET 676 10.660 0.812 1.976 118 HG3 MET 676 HG3 MET 676 12.364 0.365 1.957 119 HE1 MET 676 HE1 MET 676 13.690 -0.155 -0.371 120 HE2 MET 676 HE2 MET 676 13.732 1.380 -1.232 121 HE3 MET 676 HE3 MET 676 13.840 1.350 0.533 122 H GLU 677 H GLU 677 12.648 -0.100 3.741 123 HA GLU 677 HA GLU 677 11.175 -0.893 6.160 124 HB2 GLU 677 HB2 GLU 677 12.634 0.753 7.306 125 HB3 GLU 677 HB3 GLU 677 13.561 -0.502 6.477 126 HG2 GLU 677 HG2 GLU 677 14.514 0.993 5.080 127 HG3 GLU 677 HG3 GLU 677 12.972 1.761 4.732 128 H ARG 678 H ARG 678 10.180 0.901 7.431 129 HA ARG 678 HA ARG 678 8.271 2.256 5.921 130 HB2 ARG 678 HB2 ARG 678 8.183 1.787 8.421 131 HB3 ARG 678 HB3 ARG 678 9.212 3.214 8.628 132 HG2 ARG 678 HG2 ARG 678 6.964 3.631 6.792 133 HG3 ARG 678 HG3 ARG 678 6.465 3.283 8.445 134 HD2 ARG 678 HD2 ARG 678 8.669 5.109 8.510 135 HD3 ARG 678 HD3 ARG 678 7.466 5.718 7.377 136 HE ARG 678 HE ARG 678 6.089 4.888 9.681 137 HH11 ARG 678 HH21 ARG 678 8.384 7.263 8.600 138 HH12 ARG 678 HH22 ARG 678 8.060 8.359 9.938 139 HH21 ARG 678 HH11 ARG 678 5.638 6.309 11.334 140 HH22 ARG 678 HH12 ARG 678 6.500 7.820 11.481 141 H ALA 679 H ALA 679 11.091 3.660 7.567 142 HA ALA 679 HA ALA 679 10.782 6.238 6.530 143 HB1 ALA 679 HB1 ALA 679 12.478 5.119 8.324 144 HB2 ALA 679 HB2 ALA 679 12.732 6.712 7.613 145 HB3 ALA 679 HB3 ALA 679 13.560 5.304 6.945 146 H GLY 680 H GLY 680 12.353 3.381 5.281 147 HA2 GLY 680 HA2 GLY 680 13.623 4.603 3.034 148 HA3 GLY 680 HA3 GLY 680 13.242 2.888 3.190 149 H ALA 681 H ALA 681 10.520 2.986 3.563 150 HA ALA 681 HA ALA 681 9.506 3.085 0.965 151 HB1 ALA 681 HB1 ALA 681 8.438 1.883 2.866 152 HB2 ALA 681 HB2 ALA 681 7.301 2.908 1.993 153 HB3 ALA 681 HB3 ALA 681 7.954 3.437 3.544 154 H GLU 682 H GLU 682 9.153 5.502 3.596 155 HA GLU 682 HA GLU 682 7.846 7.358 1.823 156 HB2 GLU 682 HB2 GLU 682 8.097 8.984 3.713 157 HB3 GLU 682 HB3 GLU 682 7.244 7.508 4.123 158 HG2 GLU 682 HG2 GLU 682 9.626 6.676 4.874 159 HG3 GLU 682 HG3 GLU 682 9.982 8.396 4.955 160 H SER 683 H SER 683 11.079 6.540 2.406 161 HA SER 683 HA SER 683 12.356 9.008 1.998 162 HB2 SER 683 HB2 SER 683 13.491 6.886 2.713 163 HB3 SER 683 HB3 SER 683 13.347 6.308 1.056 164 HG SER 683 HG SER 683 14.425 8.424 0.542 165 H ILE 684 H ILE 684 10.906 6.719 -0.223 166 HA ILE 684 HA ILE 684 11.819 8.260 -2.547 167 HB ILE 684 HB ILE 684 9.999 5.851 -2.577 168 HG12 ILE 684 HG12 ILE 684 12.772 5.220 -3.118 169 HG13 ILE 684 HG13 ILE 684 12.623 5.927 -1.509 170 HG21 ILE 684 HG21 ILE 684 11.489 7.479 -4.533 171 HG22 ILE 684 HG22 ILE 684 11.717 5.741 -4.727 172 HG23 ILE 684 HG23 ILE 684 10.094 6.427 -4.772 173 HD11 ILE 684 HD11 ILE 684 10.796 4.315 -0.998 174 HD12 ILE 684 HD12 ILE 684 11.044 3.570 -2.578 175 HD13 ILE 684 HD13 ILE 684 12.321 3.508 -1.363 176 H LEU 685 H LEU 685 8.779 7.166 -1.053 177 HA LEU 685 HA LEU 685 7.001 8.517 -2.742 178 HB2 LEU 685 HB2 LEU 685 6.903 7.355 -0.006 179 HB3 LEU 685 HB3 LEU 685 5.633 8.499 -0.419 180 HG LEU 685 HG LEU 685 4.872 7.167 -2.232 181 HD11 LEU 685 HD11 LEU 685 6.781 6.493 -3.411 182 HD12 LEU 685 HD12 LEU 685 7.565 5.852 -1.967 183 HD13 LEU 685 HD13 LEU 685 6.225 4.979 -2.704 184 HD21 LEU 685 HD21 LEU 685 4.775 4.814 -1.136 185 HD22 LEU 685 HD22 LEU 685 5.663 5.560 0.192 186 HD23 LEU 685 HD23 LEU 685 4.069 6.167 -0.255 187 H ALA 686 H ALA 686 8.660 9.631 0.213 188 HA ALA 686 HA ALA 686 7.258 12.098 0.384 189 HB1 ALA 686 HB1 ALA 686 8.537 11.174 2.265 190 HB2 ALA 686 HB2 ALA 686 9.068 12.807 1.870 191 HB3 ALA 686 HB3 ALA 686 10.038 11.419 1.371 192 H ASN 687 H ASN 687 10.215 11.088 -1.256 193 HA ASN 687 HA ASN 687 10.918 13.688 -2.231 194 HB2 ASN 687 HB2 ASN 687 12.513 11.759 -2.032 195 HB3 ASN 687 HB3 ASN 687 11.666 10.978 -3.365 196 HD21 ASN 687 HD21 ASN 687 13.373 14.057 -2.585 197 HD22 ASN 687 HD22 ASN 687 13.958 14.290 -4.160 198 H ARG 688 H ARG 688 8.996 10.982 -3.420 199 HA ARG 688 HA ARG 688 8.551 12.035 -6.046 200 HB2 ARG 688 HB2 ARG 688 7.722 9.718 -4.490 201 HB3 ARG 688 HB3 ARG 688 6.387 10.378 -5.425 202 HG2 ARG 688 HG2 ARG 688 7.291 9.044 -7.062 203 HG3 ARG 688 HG3 ARG 688 8.291 10.474 -7.320 204 HD2 ARG 688 HD2 ARG 688 10.159 9.487 -6.441 205 HD3 ARG 688 HD3 ARG 688 9.248 8.612 -5.227 206 HE ARG 688 HE ARG 688 9.443 6.796 -6.636 207 HH11 ARG 688 HH21 ARG 688 9.183 9.651 -8.562 208 HH12 ARG 688 HH22 ARG 688 9.206 8.784 -10.058 209 HH21 ARG 688 HH11 ARG 688 9.515 5.701 -8.545 210 HH22 ARG 688 HH12 ARG 688 9.382 6.553 -10.080 211 H SER 689 H SER 689 6.255 12.514 -6.807 212 HA SER 689 HA SER 689 5.277 14.805 -5.424 213 HB2 SER 689 HB2 SER 689 5.052 14.654 -7.833 214 HB3 SER 689 HB3 SER 689 4.082 13.188 -7.688 215 HG SER 689 HG SER 689 2.399 14.354 -7.099 216 H ASP 690 H ASP 690 2.810 14.982 -5.054 217 HA ASP 690 HA ASP 690 2.131 13.198 -2.922 218 HB2 ASP 690 HB2 ASP 690 1.279 15.737 -3.851 219 HB3 ASP 690 HB3 ASP 690 -0.136 14.691 -3.830 220 H GLY 691 H GLY 691 0.606 11.577 -2.860 221 HA2 GLY 691 HA2 GLY 691 -1.207 10.296 -3.789 222 HA3 GLY 691 HA3 GLY 691 -0.743 10.859 -5.394 223 H THR 692 H THR 692 2.124 10.383 -4.233 224 HA THR 692 HA THR 692 2.591 7.911 -5.547 225 HB THR 692 HB THR 692 4.441 9.208 -3.531 226 HG1 THR 692 HG1 THR 692 4.134 10.881 -4.844 227 HG21 THR 692 HG21 THR 692 5.259 7.979 -6.121 228 HG22 THR 692 HG22 THR 692 6.113 8.024 -4.583 229 HG23 THR 692 HG23 THR 692 4.776 6.899 -4.813 230 H PHE 693 H PHE 693 2.662 5.848 -4.770 231 HA PHE 693 HA PHE 693 2.600 5.448 -1.854 232 HB2 PHE 693 HB2 PHE 693 0.670 3.995 -1.968 233 HB3 PHE 693 HB3 PHE 693 0.244 5.549 -2.682 234 HD1 PHE 693 HD2 PHE 693 1.085 2.022 -3.413 235 HD2 PHE 693 HD1 PHE 693 -0.199 5.775 -5.049 236 HE1 PHE 693 HE2 PHE 693 0.465 0.891 -5.529 237 HE2 PHE 693 HE1 PHE 693 -0.818 4.641 -7.166 238 HZ PHE 693 HZ PHE 693 -0.483 2.198 -7.405 239 H LEU 694 H LEU 694 2.886 3.147 -1.254 240 HA LEU 694 HA LEU 694 3.815 1.305 -3.240 241 HB2 LEU 694 HB2 LEU 694 6.127 1.255 -2.812 242 HB3 LEU 694 HB3 LEU 694 5.746 2.969 -2.936 243 HG LEU 694 HG LEU 694 5.370 2.736 -0.322 244 HD11 LEU 694 HD11 LEU 694 7.558 1.085 0.129 245 HD12 LEU 694 HD12 LEU 694 5.874 0.664 0.432 246 HD13 LEU 694 HD13 LEU 694 6.635 0.212 -1.093 247 HD21 LEU 694 HD21 LEU 694 8.143 2.846 -0.398 248 HD22 LEU 694 HD22 LEU 694 7.674 3.342 -2.020 249 HD23 LEU 694 HD23 LEU 694 7.057 4.214 -0.619 250 H VAL 695 H VAL 695 4.686 -0.706 -2.277 251 HA VAL 695 HA VAL 695 3.701 -1.122 0.477 252 HB VAL 695 HB VAL 695 3.312 -3.008 -1.850 253 HG11 VAL 695 HG11 VAL 695 3.169 -3.292 1.066 254 HG12 VAL 695 HG12 VAL 695 1.674 -3.758 0.260 255 HG13 VAL 695 HG13 VAL 695 3.193 -4.534 -0.181 256 HG21 VAL 695 HG21 VAL 695 1.607 -1.535 -2.249 257 HG22 VAL 695 HG22 VAL 695 0.836 -2.385 -0.910 258 HG23 VAL 695 HG23 VAL 695 1.673 -0.862 -0.622 259 H ARG 696 H ARG 696 4.959 -2.307 1.801 260 HA ARG 696 HA ARG 696 7.423 -3.479 0.639 261 HB2 ARG 696 HB2 ARG 696 8.469 -3.022 2.847 262 HB3 ARG 696 HB3 ARG 696 7.930 -1.558 2.026 263 HG2 ARG 696 HG2 ARG 696 5.881 -1.526 3.380 264 HG3 ARG 696 HG3 ARG 696 6.375 -3.020 4.181 265 HD2 ARG 696 HD2 ARG 696 8.087 -0.527 4.195 266 HD3 ARG 696 HD3 ARG 696 6.882 -0.849 5.440 267 HE ARG 696 HE ARG 696 9.432 -2.238 5.061 268 HH11 ARG 696 HH21 ARG 696 6.258 -2.306 6.443 269 HH12 ARG 696 HH22 ARG 696 6.699 -3.347 7.755 270 HH21 ARG 696 HH11 ARG 696 9.973 -3.617 6.761 271 HH22 ARG 696 HH12 ARG 696 8.760 -4.146 7.891 272 H GLN 697 H GLN 697 8.405 -5.209 2.089 273 HA GLN 697 HA GLN 697 6.306 -6.954 3.256 274 HB2 GLN 697 HB2 GLN 697 6.768 -7.856 1.084 275 HB3 GLN 697 HB3 GLN 697 8.503 -7.683 1.309 276 HG2 GLN 697 HG2 GLN 697 7.835 -10.028 1.614 277 HG3 GLN 697 HG3 GLN 697 8.437 -9.364 3.127 278 HE21 GLN 697 HE21 GLN 697 5.804 -11.014 1.708 279 HE22 GLN 697 HE22 GLN 697 4.699 -10.840 2.997 280 H ARG 698 H ARG 698 6.840 -6.621 5.374 281 HA ARG 698 HA ARG 698 8.722 -8.168 6.641 282 HB2 ARG 698 HB2 ARG 698 10.020 -5.909 5.459 283 HB3 ARG 698 HB3 ARG 698 10.039 -5.692 7.206 284 HG2 ARG 698 HG2 ARG 698 10.677 -8.430 6.246 285 HG3 ARG 698 HG3 ARG 698 11.869 -7.192 5.868 286 HD2 ARG 698 HD2 ARG 698 12.133 -8.461 8.104 287 HD3 ARG 698 HD3 ARG 698 12.276 -6.711 8.143 288 HE ARG 698 HE ARG 698 9.984 -8.289 9.141 289 HH11 ARG 698 HH21 ARG 698 11.607 -5.263 8.743 290 HH12 ARG 698 HH22 ARG 698 10.577 -4.429 9.855 291 HH21 ARG 698 HH11 ARG 698 8.688 -7.199 10.615 292 HH22 ARG 698 HH12 ARG 698 8.950 -5.497 10.894 293 H VAL 699 H VAL 699 6.854 -8.326 7.917 294 HA VAL 699 HA VAL 699 6.250 -5.981 9.608 295 HB VAL 699 HB VAL 699 4.423 -7.093 8.201 296 HG11 VAL 699 HG11 VAL 699 4.681 -9.194 10.378 297 HG12 VAL 699 HG12 VAL 699 3.419 -9.117 9.159 298 HG13 VAL 699 HG13 VAL 699 5.082 -9.430 8.678 299 HG21 VAL 699 HG21 VAL 699 4.425 -6.028 10.864 300 HG22 VAL 699 HG22 VAL 699 3.142 -5.955 9.659 301 HG23 VAL 699 HG23 VAL 699 3.215 -7.312 10.782 302 H LYS 700 H LYS 700 4.915 -7.560 11.635 303 HA LYS 700 HA LYS 700 7.182 -9.036 12.821 304 HB2 LYS 700 HB2 LYS 700 6.203 -7.993 15.042 305 HB3 LYS 700 HB3 LYS 700 7.359 -7.096 14.057 306 HG2 LYS 700 HG2 LYS 700 5.615 -5.808 13.026 307 HG3 LYS 700 HG3 LYS 700 4.363 -6.845 13.712 308 HD2 LYS 700 HD2 LYS 700 5.923 -5.942 15.897 309 HD3 LYS 700 HD3 LYS 700 5.628 -4.529 14.885 310 HE2 LYS 700 HE2 LYS 700 3.647 -4.449 16.023 311 HE3 LYS 700 HE3 LYS 700 3.158 -5.680 14.858 312 HZ1 LYS 700 HZ1 LYS 700 2.701 -6.389 17.120 313 HZ2 LYS 700 HZ2 LYS 700 3.872 -7.416 16.403 314 HZ3 LYS 700 HZ3 LYS 700 4.339 -6.216 17.533 315 H ASP 701 H ASP 701 3.670 -8.593 12.640 316 HA ASP 701 HA ASP 701 3.226 -11.368 13.170 317 HB2 ASP 701 HB2 ASP 701 1.799 -10.822 15.279 318 HB3 ASP 701 HB3 ASP 701 3.545 -10.984 15.445 319 H ALA 702 H ALA 702 1.057 -8.866 14.345 320 HA ALA 702 HA ALA 702 -1.175 -9.838 12.928 321 HB1 ALA 702 HB1 ALA 702 -1.111 -8.411 15.043 322 HB2 ALA 702 HB2 ALA 702 -2.367 -8.022 13.865 323 HB3 ALA 702 HB3 ALA 702 -0.918 -7.022 13.972 324 H ALA 703 H ALA 703 0.552 -9.671 10.859 325 HA ALA 703 HA ALA 703 -0.861 -8.248 8.917 326 HB1 ALA 703 HB1 ALA 703 1.026 -6.606 10.404 327 HB2 ALA 703 HB2 ALA 703 -0.223 -6.127 9.259 328 HB3 ALA 703 HB3 ALA 703 1.366 -6.608 8.675 329 H GLU 704 H GLU 704 0.831 -7.619 7.007 330 HA GLU 704 HA GLU 704 2.834 -9.757 6.715 331 HB2 GLU 704 HB2 GLU 704 0.267 -9.835 5.491 332 HB3 GLU 704 HB3 GLU 704 1.428 -9.453 4.223 333 HG2 GLU 704 HG2 GLU 704 2.484 -11.511 5.974 334 HG3 GLU 704 HG3 GLU 704 0.916 -11.988 5.329 335 H PHE 705 H PHE 705 1.454 -7.666 4.230 336 HA PHE 705 HA PHE 705 4.081 -6.434 3.823 337 HB2 PHE 705 HB2 PHE 705 1.494 -6.250 2.251 338 HB3 PHE 705 HB3 PHE 705 2.991 -5.438 1.808 339 HD1 PHE 705 HD1 PHE 705 1.389 -8.756 2.265 340 HD2 PHE 705 HD2 PHE 705 4.811 -6.622 0.797 341 HE1 PHE 705 HE1 PHE 705 2.169 -10.801 1.107 342 HE2 PHE 705 HE2 PHE 705 5.587 -8.673 -0.366 343 HZ PHE 705 HZ PHE 705 4.264 -10.761 -0.209 344 H ALA 706 H ALA 706 3.933 -3.984 3.266 345 HA ALA 706 HA ALA 706 1.991 -2.630 5.031 346 HB1 ALA 706 HB1 ALA 706 3.621 -2.116 6.485 347 HB2 ALA 706 HB2 ALA 706 4.296 -1.074 5.232 348 HB3 ALA 706 HB3 ALA 706 4.870 -2.735 5.409 349 H ILE 707 H ILE 707 0.977 -1.048 4.059 350 HA ILE 707 HA ILE 707 1.921 -0.173 1.415 351 HB ILE 707 HB ILE 707 -0.708 0.507 2.736 352 HG12 ILE 707 HG12 ILE 707 -1.451 -1.457 1.134 353 HG13 ILE 707 HG13 ILE 707 0.212 -1.995 1.353 354 HG21 ILE 707 HG21 ILE 707 0.403 0.574 -0.069 355 HG22 ILE 707 HG22 ILE 707 -1.334 0.498 0.213 356 HG23 ILE 707 HG23 ILE 707 -0.399 1.860 0.827 357 HD11 ILE 707 HD11 ILE 707 -1.953 -2.377 3.127 358 HD12 ILE 707 HD12 ILE 707 -0.264 -2.784 3.404 359 HD13 ILE 707 HD13 ILE 707 -0.889 -1.214 3.901 360 H SER 708 H SER 708 2.807 1.734 1.079 361 HA SER 708 HA SER 708 2.503 3.814 3.160 362 HB2 SER 708 HB2 SER 708 4.876 3.245 1.380 363 HB3 SER 708 HB3 SER 708 4.738 4.648 2.432 364 HG SER 708 HG SER 708 4.588 1.921 3.255 365 H ILE 709 H ILE 709 1.545 5.687 2.487 366 HA ILE 709 HA ILE 709 1.450 6.175 -0.444 367 HB ILE 709 HB ILE 709 -0.754 7.202 1.282 368 HG12 ILE 709 HG12 ILE 709 -1.895 4.904 0.536 369 HG13 ILE 709 HG13 ILE 709 -0.238 4.314 0.711 370 HG21 ILE 709 HG21 ILE 709 -1.284 5.873 -1.297 371 HG22 ILE 709 HG22 ILE 709 -1.817 7.446 -0.707 372 HG23 ILE 709 HG23 ILE 709 -0.207 7.266 -1.403 373 HD11 ILE 709 HD11 ILE 709 -0.139 5.102 2.995 374 HD12 ILE 709 HD12 ILE 709 -1.694 5.914 2.836 375 HD13 ILE 709 HD13 ILE 709 -1.607 4.152 2.823 376 H LYS 710 H LYS 710 1.831 8.184 -1.166 377 HA LYS 710 HA LYS 710 2.712 10.204 0.780 378 HB2 LYS 710 HB2 LYS 710 4.278 9.817 -1.018 379 HB3 LYS 710 HB3 LYS 710 3.001 9.969 -2.222 380 HG2 LYS 710 HG2 LYS 710 4.080 12.062 -2.284 381 HG3 LYS 710 HG3 LYS 710 2.653 12.350 -1.297 382 HD2 LYS 710 HD2 LYS 710 3.865 12.544 0.657 383 HD3 LYS 710 HD3 LYS 710 5.189 11.521 0.081 384 HE2 LYS 710 HE2 LYS 710 4.583 14.234 -1.118 385 HE3 LYS 710 HE3 LYS 710 5.704 14.018 0.228 386 HZ1 LYS 710 HZ1 LYS 710 6.433 12.080 -1.590 387 HZ2 LYS 710 HZ2 LYS 710 6.099 13.439 -2.571 388 HZ3 LYS 710 HZ3 LYS 710 7.250 13.566 -1.314 389 H TYR 711 H TYR 711 0.979 11.296 1.535 390 HA TYR 711 HA TYR 711 -0.709 12.699 -0.421 391 HB2 TYR 711 HB2 TYR 711 -2.029 10.742 0.094 392 HB3 TYR 711 HB3 TYR 711 -1.753 10.955 1.821 393 HD1 TYR 711 HD1 TYR 711 -2.826 13.193 -1.007 394 HD2 TYR 711 HD2 TYR 711 -3.619 11.733 2.951 395 HE1 TYR 711 HE1 TYR 711 -4.830 14.654 -0.867 396 HE2 TYR 711 HE2 TYR 711 -5.623 13.189 3.092 397 HH TYR 711 HH TYR 711 -7.249 14.269 1.080 398 H ASN 712 H ASN 712 -0.188 14.723 0.045 399 HA ASN 712 HA ASN 712 -0.467 16.710 1.270 400 HB2 ASN 712 HB2 ASN 712 -1.978 15.410 2.860 401 HB3 ASN 712 HB3 ASN 712 -0.533 15.053 3.797 402 HD21 ASN 712 HD21 ASN 712 0.127 16.593 5.296 403 HD22 ASN 712 HD22 ASN 712 -0.495 18.181 5.362 404 H VAL 713 H VAL 713 1.875 15.972 0.285 405 HA VAL 713 HA VAL 713 4.169 15.942 0.545 406 HB VAL 713 HB VAL 713 5.061 17.848 1.765 407 HG11 VAL 713 HG11 VAL 713 3.925 18.241 -0.395 408 HG12 VAL 713 HG12 VAL 713 2.399 18.480 0.456 409 HG13 VAL 713 HG13 VAL 713 3.726 19.618 0.688 410 HG21 VAL 713 HG21 VAL 713 3.510 17.521 3.777 411 HG22 VAL 713 HG22 VAL 713 3.756 19.187 3.259 412 HG23 VAL 713 HG23 VAL 713 2.269 18.343 2.832 413 H GLU 714 H GLU 714 2.820 13.971 2.061 414 HA GLU 714 HA GLU 714 4.905 13.321 3.976 415 HB2 GLU 714 HB2 GLU 714 3.333 12.858 5.807 416 HB3 GLU 714 HB3 GLU 714 3.267 14.563 5.351 417 HG2 GLU 714 HG2 GLU 714 1.332 13.823 3.770 418 HG3 GLU 714 HG3 GLU 714 1.271 12.380 4.776 419 H VAL 715 H VAL 715 4.836 11.044 4.573 420 HA VAL 715 HA VAL 715 3.303 9.448 2.614 421 HB VAL 715 HB VAL 715 5.889 8.687 3.950 422 HG11 VAL 715 HG11 VAL 715 5.947 6.946 2.249 423 HG12 VAL 715 HG12 VAL 715 4.395 6.858 3.078 424 HG13 VAL 715 HG13 VAL 715 4.501 7.597 1.481 425 HG21 VAL 715 HG21 VAL 715 6.941 9.262 1.780 426 HG22 VAL 715 HG22 VAL 715 5.388 9.852 1.194 427 HG23 VAL 715 HG23 VAL 715 6.199 10.679 2.522 428 H LYS 716 H LYS 716 1.668 8.376 3.468 429 HA LYS 716 HA LYS 716 1.658 7.656 6.318 430 HB2 LYS 716 HB2 LYS 716 -0.555 6.940 4.420 431 HB3 LYS 716 HB3 LYS 716 -0.659 7.423 6.112 432 HG2 LYS 716 HG2 LYS 716 0.478 9.644 4.883 433 HG3 LYS 716 HG3 LYS 716 -0.706 9.083 3.701 434 HD2 LYS 716 HD2 LYS 716 -2.488 9.205 5.298 435 HD3 LYS 716 HD3 LYS 716 -1.360 9.454 6.630 436 HE2 LYS 716 HE2 LYS 716 -0.797 11.486 4.740 437 HE3 LYS 716 HE3 LYS 716 -2.554 11.422 4.888 438 HZ1 LYS 716 HZ1 LYS 716 -1.217 11.188 7.410 439 HZ2 LYS 716 HZ2 LYS 716 -0.852 12.674 6.627 440 HZ3 LYS 716 HZ3 LYS 716 -2.477 12.220 6.951 441 H HIS 717 H HIS 717 1.990 5.607 7.062 442 HA HIS 717 HA HIS 717 2.309 3.434 5.063 443 HB2 HIS 717 HB2 HIS 717 3.701 3.573 7.729 444 HB3 HIS 717 HB3 HIS 717 4.074 2.534 6.354 445 HD1 HIS 717 HD1 HIS 717 5.242 3.625 4.286 446 HD2 HIS 717 HD2 HIS 717 4.711 6.191 7.556 447 HE1 HIS 717 HE1 HIS 717 6.752 5.637 3.902 448 HE2 HIS 717 HE2 HIS 717 6.449 7.219 5.893 449 H ILE 718 H ILE 718 1.168 1.626 5.322 450 HA ILE 718 HA ILE 718 -0.054 1.092 7.963 451 HB ILE 718 HB ILE 718 -1.532 0.784 5.344 452 HG12 ILE 718 HG12 ILE 718 -2.413 2.799 7.334 453 HG13 ILE 718 HG13 ILE 718 -0.937 3.203 6.462 454 HG21 ILE 718 HG21 ILE 718 -2.239 0.460 8.266 455 HG22 ILE 718 HG22 ILE 718 -3.473 0.687 7.027 456 HG23 ILE 718 HG23 ILE 718 -2.410 -0.719 6.965 457 HD11 ILE 718 HD11 ILE 718 -3.683 2.671 5.361 458 HD12 ILE 718 HD12 ILE 718 -2.627 4.054 5.071 459 HD13 ILE 718 HD13 ILE 718 -2.252 2.489 4.343 460 H LYS 719 H LYS 719 -0.027 -0.972 8.587 461 HA LYS 719 HA LYS 719 1.452 -2.897 7.001 462 HB2 LYS 719 HB2 LYS 719 0.945 -4.353 9.082 463 HB3 LYS 719 HB3 LYS 719 2.028 -2.978 9.272 464 HG2 LYS 719 HG2 LYS 719 0.637 -1.998 10.752 465 HG3 LYS 719 HG3 LYS 719 -0.728 -2.143 9.645 466 HD2 LYS 719 HD2 LYS 719 0.193 -4.616 11.053 467 HD3 LYS 719 HD3 LYS 719 -0.707 -3.420 11.985 468 HE2 LYS 719 HE2 LYS 719 -2.464 -3.451 10.162 469 HE3 LYS 719 HE3 LYS 719 -1.611 -4.823 9.455 470 HZ1 LYS 719 HZ1 LYS 719 -3.512 -5.362 11.014 471 HZ2 LYS 719 HZ2 LYS 719 -1.995 -6.140 11.356 472 HZ3 LYS 719 HZ3 LYS 719 -2.500 -4.789 12.277 473 H ILE 720 H ILE 720 0.596 -4.426 5.731 474 HA ILE 720 HA ILE 720 -2.292 -4.655 5.506 475 HB ILE 720 HB ILE 720 -0.067 -5.056 3.795 476 HG12 ILE 720 HG12 ILE 720 -2.888 -5.789 3.066 477 HG13 ILE 720 HG13 ILE 720 -2.503 -4.124 3.493 478 HG21 ILE 720 HG21 ILE 720 -0.429 -7.256 2.876 479 HG22 ILE 720 HG22 ILE 720 -0.171 -7.453 4.608 480 HG23 ILE 720 HG23 ILE 720 -1.803 -7.538 3.944 481 HD11 ILE 720 HD11 ILE 720 -0.442 -4.846 1.764 482 HD12 ILE 720 HD12 ILE 720 -1.872 -5.596 1.050 483 HD13 ILE 720 HD13 ILE 720 -1.839 -3.859 1.348 484 H MET 721 H MET 721 -3.509 -6.535 5.847 485 HA MET 721 HA MET 721 -2.312 -8.472 7.731 486 HB2 MET 721 HB2 MET 721 -4.472 -7.112 8.231 487 HB3 MET 721 HB3 MET 721 -5.246 -8.245 7.127 488 HG2 MET 721 HG2 MET 721 -5.325 -8.901 9.585 489 HG3 MET 721 HG3 MET 721 -4.685 -10.124 8.494 490 HE1 MET 721 HE1 MET 721 -2.962 -11.484 10.536 491 HE2 MET 721 HE2 MET 721 -2.994 -10.410 11.932 492 HE3 MET 721 HE3 MET 721 -4.464 -10.684 10.989 493 H THR 722 H THR 722 -3.258 -10.752 7.509 494 HA THR 722 HA THR 722 -3.513 -11.458 4.643 495 HB THR 722 HB THR 722 -1.328 -12.167 5.230 496 HG1 THR 722 HG1 THR 722 -3.227 -14.246 5.544 497 HG21 THR 722 HG21 THR 722 -2.548 -13.326 7.755 498 HG22 THR 722 HG22 THR 722 -0.856 -13.462 7.278 499 HG23 THR 722 HG23 THR 722 -1.537 -11.883 7.672 500 H ALA 723 H ALA 723 -5.768 -10.995 6.079 501 HA ALA 723 HA ALA 723 -6.907 -13.082 7.538 502 HB1 ALA 723 HB1 ALA 723 -8.574 -11.547 5.573 503 HB2 ALA 723 HB2 ALA 723 -7.809 -10.688 6.912 504 HB3 ALA 723 HB3 ALA 723 -8.941 -12.001 7.239 505 H GLU 724 H GLU 724 -7.236 -15.143 7.009 506 HA GLU 724 HA GLU 724 -7.380 -17.055 5.719 507 HB2 GLU 724 HB2 GLU 724 -9.354 -15.475 4.071 508 HB3 GLU 724 HB3 GLU 724 -9.386 -17.193 4.473 509 HG2 GLU 724 HG2 GLU 724 -9.988 -14.835 6.258 510 HG3 GLU 724 HG3 GLU 724 -10.988 -16.248 5.931 511 H GLY 725 H GLY 725 -5.441 -14.949 4.839 512 HA2 GLY 725 HA2 GLY 725 -3.771 -15.206 3.175 513 HA3 GLY 725 HA3 GLY 725 -4.931 -16.065 2.169 514 H LEU 726 H LEU 726 -6.635 -13.491 3.273 515 HA LEU 726 HA LEU 726 -6.205 -12.018 0.775 516 HB2 LEU 726 HB2 LEU 726 -8.192 -11.385 2.966 517 HB3 LEU 726 HB3 LEU 726 -8.230 -10.851 1.289 518 HG LEU 726 HG LEU 726 -8.400 -13.759 2.116 519 HD11 LEU 726 HD11 LEU 726 -10.816 -13.545 1.651 520 HD12 LEU 726 HD12 LEU 726 -10.333 -12.489 2.974 521 HD13 LEU 726 HD13 LEU 726 -10.608 -11.817 1.368 522 HD21 LEU 726 HD21 LEU 726 -7.632 -12.956 -0.257 523 HD22 LEU 726 HD22 LEU 726 -8.882 -14.190 -0.149 524 HD23 LEU 726 HD23 LEU 726 -9.325 -12.517 -0.472 525 H TYR 727 H TYR 727 -5.483 -9.921 0.632 526 HA TYR 727 HA TYR 727 -4.117 -8.911 3.021 527 HB2 TYR 727 HB2 TYR 727 -3.851 -8.190 0.104 528 HB3 TYR 727 HB3 TYR 727 -2.986 -7.375 1.401 529 HD1 TYR 727 HD2 TYR 727 -3.068 -10.387 2.858 530 HD2 TYR 727 HD1 TYR 727 -1.445 -8.647 -0.719 531 HE1 TYR 727 HE2 TYR 727 -1.326 -12.140 2.794 532 HE2 TYR 727 HE1 TYR 727 0.301 -10.409 -0.775 533 HH TYR 727 HH TYR 727 1.048 -12.339 1.845 534 H ARG 728 H ARG 728 -4.526 -6.980 3.925 535 HA ARG 728 HA ARG 728 -6.511 -5.189 2.740 536 HB2 ARG 728 HB2 ARG 728 -7.526 -5.229 5.235 537 HB3 ARG 728 HB3 ARG 728 -8.152 -6.237 3.940 538 HG2 ARG 728 HG2 ARG 728 -6.650 -8.081 4.660 539 HG3 ARG 728 HG3 ARG 728 -6.065 -7.061 5.971 540 HD2 ARG 728 HD2 ARG 728 -8.930 -7.076 6.044 541 HD3 ARG 728 HD3 ARG 728 -8.364 -8.744 5.951 542 HE ARG 728 HE ARG 728 -6.927 -7.166 7.911 543 HH11 ARG 728 HH21 ARG 728 -9.757 -9.044 7.300 544 HH12 ARG 728 HH22 ARG 728 -10.005 -9.440 8.962 545 HH21 ARG 728 HH11 ARG 728 -7.251 -7.641 10.070 546 HH22 ARG 728 HH12 ARG 728 -8.597 -8.663 10.523 547 H ILE 729 H ILE 729 -6.104 -3.131 3.200 548 HA ILE 729 HA ILE 729 -3.736 -2.478 4.731 549 HB ILE 729 HB ILE 729 -5.672 -0.512 3.527 550 HG12 ILE 729 HG12 ILE 729 -3.533 -2.147 2.132 551 HG13 ILE 729 HG13 ILE 729 -5.258 -2.131 1.771 552 HG21 ILE 729 HG21 ILE 729 -4.047 0.706 4.625 553 HG22 ILE 729 HG22 ILE 729 -2.825 -0.551 4.437 554 HG23 ILE 729 HG23 ILE 729 -3.238 0.488 3.074 555 HD11 ILE 729 HD11 ILE 729 -4.779 0.487 1.516 556 HD12 ILE 729 HD12 ILE 729 -3.167 -0.115 1.128 557 HD13 ILE 729 HD13 ILE 729 -4.555 -0.637 0.175 558 H THR 730 H THR 730 -7.212 -2.097 5.055 559 HA THR 730 HA THR 730 -6.797 -0.785 7.684 560 HB THR 730 HB THR 730 -8.014 0.533 6.025 561 HG1 THR 730 HG1 THR 730 -9.382 1.231 7.464 562 HG21 THR 730 HG21 THR 730 -10.045 -0.151 5.030 563 HG22 THR 730 HG22 THR 730 -8.981 -1.547 4.880 564 HG23 THR 730 HG23 THR 730 -10.216 -1.504 6.133 565 H GLU 731 H GLU 731 -7.379 -3.676 6.345 566 HA GLU 731 HA GLU 731 -8.039 -5.678 7.186 567 HB2 GLU 731 HB2 GLU 731 -8.539 -4.227 9.779 568 HB3 GLU 731 HB3 GLU 731 -8.235 -5.950 9.556 569 HG2 GLU 731 HG2 GLU 731 -6.088 -4.838 8.250 570 HG3 GLU 731 HG3 GLU 731 -6.336 -3.684 9.555 571 H LYS 732 H LYS 732 -9.935 -3.213 6.568 572 HA LYS 732 HA LYS 732 -12.458 -4.476 7.405 573 HB2 LYS 732 HB2 LYS 732 -12.222 -1.824 5.990 574 HB3 LYS 732 HB3 LYS 732 -13.513 -2.398 7.046 575 HG2 LYS 732 HG2 LYS 732 -10.680 -1.766 7.936 576 HG3 LYS 732 HG3 LYS 732 -12.078 -0.729 8.187 577 HD2 LYS 732 HD2 LYS 732 -12.376 -3.533 9.124 578 HD3 LYS 732 HD3 LYS 732 -11.216 -2.550 10.011 579 HE2 LYS 732 HE2 LYS 732 -13.835 -1.287 9.392 580 HE3 LYS 732 HE3 LYS 732 -13.832 -2.568 10.607 581 HZ1 LYS 732 HZ1 LYS 732 -13.335 -0.116 11.286 582 HZ2 LYS 732 HZ2 LYS 732 -12.457 -1.401 12.013 583 HZ3 LYS 732 HZ3 LYS 732 -11.755 -0.476 10.744 584 H LYS 733 H LYS 733 -10.735 -3.309 4.523 585 HA LYS 733 HA LYS 733 -12.485 -5.037 2.879 586 HB2 LYS 733 HB2 LYS 733 -13.017 -2.785 2.270 587 HB3 LYS 733 HB3 LYS 733 -11.313 -2.327 2.223 588 HG2 LYS 733 HG2 LYS 733 -12.388 -2.743 -0.051 589 HG3 LYS 733 HG3 LYS 733 -10.915 -3.660 0.263 590 HD2 LYS 733 HD2 LYS 733 -12.160 -5.662 0.751 591 HD3 LYS 733 HD3 LYS 733 -13.685 -4.779 0.789 592 HE2 LYS 733 HE2 LYS 733 -13.950 -5.107 -1.418 593 HE3 LYS 733 HE3 LYS 733 -12.421 -4.287 -1.738 594 HZ1 LYS 733 HZ1 LYS 733 -12.983 -7.150 -1.494 595 HZ2 LYS 733 HZ2 LYS 733 -11.912 -6.342 -2.536 596 HZ3 LYS 733 HZ3 LYS 733 -11.469 -6.613 -0.911 597 H ALA 734 H ALA 734 -11.268 -6.806 2.571 598 HA ALA 734 HA ALA 734 -8.414 -6.524 1.936 599 HB1 ALA 734 HB1 ALA 734 -9.513 -9.241 2.061 600 HB2 ALA 734 HB2 ALA 734 -9.781 -8.313 3.537 601 HB3 ALA 734 HB3 ALA 734 -8.144 -8.538 2.924 602 H PHE 735 H PHE 735 -7.707 -8.415 0.374 603 HA PHE 735 HA PHE 735 -9.521 -8.768 -1.890 604 HB2 PHE 735 HB2 PHE 735 -7.222 -6.918 -1.898 605 HB3 PHE 735 HB3 PHE 735 -7.292 -8.025 -3.267 606 HD1 PHE 735 HD2 PHE 735 -9.389 -8.151 -4.659 607 HD2 PHE 735 HD1 PHE 735 -8.772 -5.119 -1.685 608 HE1 PHE 735 HE2 PHE 735 -11.206 -6.798 -5.665 609 HE2 PHE 735 HE1 PHE 735 -10.587 -3.764 -2.690 610 HZ PHE 735 HZ PHE 735 -11.808 -4.604 -4.679 611 H ARG 736 H ARG 736 -8.164 -9.964 -3.702 612 HA ARG 736 HA ARG 736 -7.554 -12.512 -2.795 613 HB2 ARG 736 HB2 ARG 736 -6.990 -10.996 -5.303 614 HB3 ARG 736 HB3 ARG 736 -6.165 -12.531 -5.060 615 HG2 ARG 736 HG2 ARG 736 -8.111 -13.236 -6.118 616 HG3 ARG 736 HG3 ARG 736 -8.573 -13.393 -4.423 617 HD2 ARG 736 HD2 ARG 736 -10.354 -12.235 -5.531 618 HD3 ARG 736 HD3 ARG 736 -9.493 -11.048 -4.557 619 HE ARG 736 HE ARG 736 -8.260 -10.926 -7.026 620 HH11 ARG 736 HH21 ARG 736 -11.541 -10.741 -5.930 621 HH12 ARG 736 HH22 ARG 736 -11.996 -9.536 -7.080 622 HH21 ARG 736 HH11 ARG 736 -8.832 -9.326 -8.486 623 HH22 ARG 736 HH12 ARG 736 -10.475 -8.741 -8.523 624 H GLY 737 H GLY 737 -5.197 -10.058 -3.876 625 HA2 GLY 737 HA2 GLY 737 -3.266 -11.125 -1.920 626 HA3 GLY 737 HA3 GLY 737 -2.792 -11.021 -3.613 627 H LEU 738 H LEU 738 -1.274 -9.448 -3.556 628 HA LEU 738 HA LEU 738 -1.713 -6.997 -2.054 629 HB2 LEU 738 HB2 LEU 738 0.560 -8.404 -3.163 630 HB3 LEU 738 HB3 LEU 738 0.577 -6.713 -3.658 631 HG LEU 738 HG LEU 738 0.317 -7.715 -0.807 632 HD11 LEU 738 HD11 LEU 738 2.591 -6.622 -2.447 633 HD12 LEU 738 HD12 LEU 738 2.559 -6.399 -0.701 634 HD13 LEU 738 HD13 LEU 738 2.568 -8.024 -1.376 635 HD21 LEU 738 HD21 LEU 738 -0.732 -5.400 -1.742 636 HD22 LEU 738 HD22 LEU 738 -0.024 -5.542 -0.135 637 HD23 LEU 738 HD23 LEU 738 0.927 -4.876 -1.462 638 H THR 739 H THR 739 -0.968 -7.798 -5.453 639 HA THR 739 HA THR 739 -1.327 -5.308 -6.584 640 HB THR 739 HB THR 739 -2.290 -7.880 -7.849 641 HG1 THR 739 HG1 THR 739 -0.308 -8.484 -7.506 642 HG21 THR 739 HG21 THR 739 -1.730 -6.795 -9.928 643 HG22 THR 739 HG22 THR 739 -2.757 -5.699 -9.006 644 HG23 THR 739 HG23 THR 739 -1.017 -5.426 -9.076 645 H GLU 740 H GLU 740 -3.867 -7.815 -6.283 646 HA GLU 740 HA GLU 740 -6.002 -6.207 -7.151 647 HB2 GLU 740 HB2 GLU 740 -6.326 -8.351 -5.059 648 HB3 GLU 740 HB3 GLU 740 -7.452 -7.882 -6.331 649 HG2 GLU 740 HG2 GLU 740 -5.075 -8.620 -7.663 650 HG3 GLU 740 HG3 GLU 740 -5.318 -9.838 -6.412 651 H LEU 741 H LEU 741 -4.486 -6.497 -4.020 652 HA LEU 741 HA LEU 741 -6.533 -5.041 -2.615 653 HB2 LEU 741 HB2 LEU 741 -5.077 -6.758 -1.560 654 HB3 LEU 741 HB3 LEU 741 -3.692 -5.701 -1.794 655 HG LEU 741 HG LEU 741 -4.830 -5.685 0.514 656 HD11 LEU 741 HD11 LEU 741 -3.804 -3.713 0.796 657 HD12 LEU 741 HD12 LEU 741 -3.478 -3.752 -0.933 658 HD13 LEU 741 HD13 LEU 741 -4.891 -2.893 -0.322 659 HD21 LEU 741 HD21 LEU 741 -6.803 -4.300 0.750 660 HD22 LEU 741 HD22 LEU 741 -6.801 -3.929 -0.972 661 HD23 LEU 741 HD23 LEU 741 -7.155 -5.566 -0.423 662 H VAL 742 H VAL 742 -3.373 -4.285 -4.035 663 HA VAL 742 HA VAL 742 -3.523 -1.505 -3.116 664 HB VAL 742 HB VAL 742 -1.504 -3.023 -4.768 665 HG11 VAL 742 HG11 VAL 742 -0.147 -0.865 -4.421 666 HG12 VAL 742 HG12 VAL 742 -1.394 -0.839 -5.669 667 HG13 VAL 742 HG13 VAL 742 -1.698 -0.089 -4.101 668 HG21 VAL 742 HG21 VAL 742 -1.156 -1.628 -2.113 669 HG22 VAL 742 HG22 VAL 742 -1.723 -3.295 -2.214 670 HG23 VAL 742 HG23 VAL 742 -0.132 -2.866 -2.840 671 H GLU 743 H GLU 743 -4.143 -3.337 -6.044 672 HA GLU 743 HA GLU 743 -4.309 -0.946 -7.677 673 HB2 GLU 743 HB2 GLU 743 -5.000 -3.832 -8.244 674 HB3 GLU 743 HB3 GLU 743 -5.125 -2.534 -9.431 675 HG2 GLU 743 HG2 GLU 743 -2.574 -3.223 -7.933 676 HG3 GLU 743 HG3 GLU 743 -2.951 -3.799 -9.554 677 H PHE 744 H PHE 744 -6.217 -1.923 -5.308 678 HA PHE 744 HA PHE 744 -8.702 -1.148 -6.713 679 HB2 PHE 744 HB2 PHE 744 -8.621 -3.445 -5.598 680 HB3 PHE 744 HB3 PHE 744 -8.589 -2.582 -4.060 681 HD1 PHE 744 HD2 PHE 744 -10.578 -3.293 -7.089 682 HD2 PHE 744 HD1 PHE 744 -10.525 -1.340 -3.263 683 HE1 PHE 744 HE2 PHE 744 -13.034 -2.977 -7.215 684 HE2 PHE 744 HE1 PHE 744 -12.981 -1.023 -3.390 685 HZ PHE 744 HZ PHE 744 -14.235 -1.842 -5.365 686 H TYR 745 H TYR 745 -6.800 -0.749 -3.748 687 HA TYR 745 HA TYR 745 -8.458 1.230 -2.571 688 HB2 TYR 745 HB2 TYR 745 -5.612 0.369 -2.194 689 HB3 TYR 745 HB3 TYR 745 -6.168 1.863 -1.442 690 HD1 TYR 745 HD1 TYR 745 -7.449 -1.636 -1.960 691 HD2 TYR 745 HD2 TYR 745 -6.985 1.683 0.746 692 HE1 TYR 745 HE1 TYR 745 -8.529 -2.949 -0.148 693 HE2 TYR 745 HE2 TYR 745 -8.053 0.356 2.543 694 HH TYR 745 HH TYR 745 -9.058 -3.032 2.032 695 H GLN 746 H GLN 746 -6.530 1.307 -5.333 696 HA GLN 746 HA GLN 746 -5.674 4.035 -5.284 697 HB2 GLN 746 HB2 GLN 746 -5.478 3.665 -7.806 698 HB3 GLN 746 HB3 GLN 746 -4.523 2.583 -6.789 699 HG2 GLN 746 HG2 GLN 746 -5.720 0.753 -7.388 700 HG3 GLN 746 HG3 GLN 746 -7.253 1.614 -7.353 701 HE21 GLN 746 HE21 GLN 746 -4.720 0.452 -9.434 702 HE22 GLN 746 HE22 GLN 746 -5.342 1.102 -10.873 703 H GLN 747 H GLN 747 -8.665 2.476 -5.774 704 HA GLN 747 HA GLN 747 -9.844 4.882 -7.026 705 HB2 GLN 747 HB2 GLN 747 -11.228 2.221 -6.754 706 HB3 GLN 747 HB3 GLN 747 -11.542 3.515 -7.909 707 HG2 GLN 747 HG2 GLN 747 -8.804 2.615 -8.163 708 HG3 GLN 747 HG3 GLN 747 -9.898 1.243 -8.291 709 HE21 GLN 747 HE21 GLN 747 -8.271 2.718 -10.410 710 HE22 GLN 747 HE22 GLN 747 -9.426 3.138 -11.592 711 H ASN 748 H ASN 748 -10.191 2.557 -4.379 712 HA ASN 748 HA ASN 748 -12.494 3.787 -3.234 713 HB2 ASN 748 HB2 ASN 748 -11.699 1.414 -2.823 714 HB3 ASN 748 HB3 ASN 748 -10.463 2.096 -1.772 715 HD21 ASN 748 HD21 ASN 748 -11.086 2.338 0.386 716 HD22 ASN 748 HD22 ASN 748 -12.698 2.421 0.933 717 H SER 749 H SER 749 -12.625 5.631 -2.128 718 HA SER 749 HA SER 749 -10.466 7.342 -1.613 719 HB2 SER 749 HB2 SER 749 -12.008 8.722 -0.451 720 HB3 SER 749 HB3 SER 749 -12.942 7.923 -1.711 721 HG SER 749 HG SER 749 -12.726 6.564 0.708 722 H LEU 750 H LEU 750 -8.806 6.844 -0.343 723 HA LEU 750 HA LEU 750 -8.653 4.985 1.673 724 HB2 LEU 750 HB2 LEU 750 -7.182 7.615 1.437 725 HB3 LEU 750 HB3 LEU 750 -6.725 6.324 2.545 726 HG LEU 750 HG LEU 750 -6.894 6.123 -0.469 727 HD11 LEU 750 HD11 LEU 750 -4.361 5.408 0.248 728 HD12 LEU 750 HD12 LEU 750 -4.820 7.033 -0.254 729 HD13 LEU 750 HD13 LEU 750 -4.718 6.637 1.460 730 HD21 LEU 750 HD21 LEU 750 -5.630 3.865 0.312 731 HD22 LEU 750 HD22 LEU 750 -6.710 4.089 1.686 732 HD23 LEU 750 HD23 LEU 750 -7.372 3.949 0.058 733 H LYS 751 H LYS 751 -10.027 8.196 1.860 734 HA LYS 751 HA LYS 751 -10.044 8.591 4.630 735 HB2 LYS 751 HB2 LYS 751 -11.682 10.233 4.254 736 HB3 LYS 751 HB3 LYS 751 -10.782 10.179 2.740 737 HG2 LYS 751 HG2 LYS 751 -12.573 8.405 2.032 738 HG3 LYS 751 HG3 LYS 751 -13.530 9.109 3.335 739 HD2 LYS 751 HD2 LYS 751 -12.331 10.610 0.983 740 HD3 LYS 751 HD3 LYS 751 -14.039 10.238 1.212 741 HE2 LYS 751 HE2 LYS 751 -12.381 11.928 3.112 742 HE3 LYS 751 HE3 LYS 751 -13.453 12.580 1.873 743 HZ1 LYS 751 HZ1 LYS 751 -14.564 10.595 3.709 744 HZ2 LYS 751 HZ2 LYS 751 -14.262 12.146 4.334 745 HZ3 LYS 751 HZ3 LYS 751 -15.303 11.955 3.007 746 H ASP 752 H ASP 752 -11.644 6.234 2.748 747 HA ASP 752 HA ASP 752 -13.747 5.769 4.743 748 HB2 ASP 752 HB2 ASP 752 -14.752 5.330 2.751 749 HB3 ASP 752 HB3 ASP 752 -13.227 4.987 1.945 750 H CYS 753 H CYS 753 -10.931 4.129 3.350 751 HA CYS 753 HA CYS 753 -11.140 1.903 5.215 752 HB2 CYS 753 HB2 CYS 753 -9.167 2.608 3.036 753 HB3 CYS 753 HB3 CYS 753 -9.008 1.187 4.063 754 HG CYS 753 HG CYS 753 -11.764 1.178 2.879 755 H PHE 754 H PHE 754 -8.908 4.576 4.521 756 HA PHE 754 HA PHE 754 -7.169 3.891 6.716 757 HB2 PHE 754 HB2 PHE 754 -7.325 6.282 4.872 758 HB3 PHE 754 HB3 PHE 754 -6.067 6.070 6.082 759 HD1 PHE 754 HD2 PHE 754 -7.162 2.882 4.863 760 HD2 PHE 754 HD1 PHE 754 -4.632 6.208 3.854 761 HE1 PHE 754 HE2 PHE 754 -5.914 1.459 3.286 762 HE2 PHE 754 HE1 PHE 754 -3.399 4.774 2.268 763 HZ PHE 754 HZ PHE 754 -4.029 2.399 1.985 764 H LYS 755 H LYS 755 -7.559 7.240 6.775 765 HA LYS 755 HA LYS 755 -9.703 7.312 8.725 766 HB2 LYS 755 HB2 LYS 755 -7.555 6.491 9.900 767 HB3 LYS 755 HB3 LYS 755 -6.986 8.143 9.733 768 HG2 LYS 755 HG2 LYS 755 -9.735 7.980 10.753 769 HG3 LYS 755 HG3 LYS 755 -8.574 7.162 11.795 770 HD2 LYS 755 HD2 LYS 755 -8.403 10.034 10.840 771 HD3 LYS 755 HD3 LYS 755 -8.802 9.507 12.469 772 HE2 LYS 755 HE2 LYS 755 -6.598 9.602 12.944 773 HE3 LYS 755 HE3 LYS 755 -6.380 8.211 11.880 774 HZ1 LYS 755 HZ1 LYS 755 -5.057 10.352 11.381 775 HZ2 LYS 755 HZ2 LYS 755 -5.820 9.560 10.100 776 HZ3 LYS 755 HZ3 LYS 755 -6.542 10.957 10.758 777 H SER 756 H SER 756 -7.300 9.716 9.216 778 HA SER 756 HA SER 756 -9.020 11.754 8.202 779 HB2 SER 756 HB2 SER 756 -6.092 12.144 8.820 780 HB3 SER 756 HB3 SER 756 -7.412 13.298 8.990 781 HG SER 756 HG SER 756 -8.014 12.365 10.834 782 H LEU 757 H LEU 757 -8.389 9.834 6.206 783 HA LEU 757 HA LEU 757 -6.480 11.172 4.419 784 HB2 LEU 757 HB2 LEU 757 -7.689 8.458 4.605 785 HB3 LEU 757 HB3 LEU 757 -7.300 9.044 2.993 786 HG LEU 757 HG LEU 757 -5.487 7.733 4.353 787 HD11 LEU 757 HD11 LEU 757 -4.869 8.611 2.266 788 HD12 LEU 757 HD12 LEU 757 -5.073 10.275 2.810 789 HD13 LEU 757 HD13 LEU 757 -3.706 9.320 3.388 790 HD21 LEU 757 HD21 LEU 757 -4.259 8.860 5.953 791 HD22 LEU 757 HD22 LEU 757 -4.754 10.449 5.369 792 HD23 LEU 757 HD23 LEU 757 -5.879 9.457 6.295 793 H ASP 758 H ASP 758 -7.173 11.090 2.048 794 HA ASP 758 HA ASP 758 -9.913 11.367 1.342 795 HB2 ASP 758 HB2 ASP 758 -8.676 13.700 2.467 796 HB3 ASP 758 HB3 ASP 758 -8.971 13.990 0.753 797 H THR 759 H THR 759 -7.832 9.867 0.417 798 HA THR 759 HA THR 759 -7.666 10.730 -2.360 799 HB THR 759 HB THR 759 -5.666 11.751 -1.308 800 HG1 THR 759 HG1 THR 759 -4.405 11.087 -2.919 801 HG21 THR 759 HG21 THR 759 -4.831 10.546 0.439 802 HG22 THR 759 HG22 THR 759 -5.461 9.026 -0.181 803 HG23 THR 759 HG23 THR 759 -3.944 9.672 -0.808 804 H THR 760 H THR 760 -5.673 8.937 -3.120 805 HA THR 760 HA THR 760 -6.318 6.273 -2.165 806 HB THR 760 HB THR 760 -7.200 5.394 -4.222 807 HG1 THR 760 HG1 THR 760 -7.164 6.457 -6.045 808 HG21 THR 760 HG21 THR 760 -8.790 6.536 -2.628 809 HG22 THR 760 HG22 THR 760 -8.709 7.954 -3.675 810 HG23 THR 760 HG23 THR 760 -9.360 6.436 -4.292 811 H LEU 761 H LEU 761 -5.145 4.609 -3.577 812 HA LEU 761 HA LEU 761 -2.402 5.193 -3.683 813 HB2 LEU 761 HB2 LEU 761 -4.019 3.033 -5.075 814 HB3 LEU 761 HB3 LEU 761 -2.270 3.054 -5.015 815 HG LEU 761 HG LEU 761 -3.588 1.601 -3.289 816 HD11 LEU 761 HD11 LEU 761 -1.882 2.270 -1.503 817 HD12 LEU 761 HD12 LEU 761 -1.259 1.757 -3.073 818 HD13 LEU 761 HD13 LEU 761 -1.334 3.472 -2.667 819 HD21 LEU 761 HD21 LEU 761 -5.135 3.284 -2.448 820 HD22 LEU 761 HD22 LEU 761 -4.031 2.818 -1.163 821 HD23 LEU 761 HD23 LEU 761 -3.792 4.341 -2.007 822 H GLN 762 H GLN 762 -2.314 7.205 -4.824 823 HA GLN 762 HA GLN 762 -3.281 7.508 -7.484 824 HB2 GLN 762 HB2 GLN 762 -1.977 9.118 -5.469 825 HB3 GLN 762 HB3 GLN 762 -1.289 9.428 -7.060 826 HG2 GLN 762 HG2 GLN 762 -4.245 9.243 -6.973 827 HG3 GLN 762 HG3 GLN 762 -3.554 10.620 -6.120 828 HE21 GLN 762 HE21 GLN 762 -2.679 12.328 -7.368 829 HE22 GLN 762 HE22 GLN 762 -2.674 12.327 -9.064 830 H PHE 763 H PHE 763 0.123 7.483 -6.323 831 HA PHE 763 HA PHE 763 0.809 6.181 -8.899 832 HB2 PHE 763 HB2 PHE 763 2.256 8.517 -7.637 833 HB3 PHE 763 HB3 PHE 763 2.816 7.627 -9.054 834 HD1 PHE 763 HD1 PHE 763 1.240 7.488 -11.088 835 HD2 PHE 763 HD2 PHE 763 0.701 10.268 -7.858 836 HE1 PHE 763 HE1 PHE 763 -0.221 8.880 -12.528 837 HE2 PHE 763 HE2 PHE 763 -0.758 11.658 -9.298 838 HZ PHE 763 HZ PHE 763 -1.221 10.966 -11.633 839 HA PRO 764 HA PRO 764 3.341 3.501 -6.468 840 HB2 PRO 764 HB2 PRO 764 5.040 2.605 -8.385 841 HB3 PRO 764 HB3 PRO 764 3.322 2.157 -8.365 842 HG2 PRO 764 HG2 PRO 764 4.730 4.202 -10.002 843 HG3 PRO 764 HG3 PRO 764 3.458 3.070 -10.467 844 HD2 PRO 764 HD2 PRO 764 2.995 5.714 -9.897 845 HD3 PRO 764 HD3 PRO 764 1.773 4.434 -9.707 846 H PHE 765 H PHE 765 6.066 2.975 -6.720 847 HA PHE 765 HA PHE 765 7.258 5.654 -6.324 848 HB2 PHE 765 HB2 PHE 765 8.462 4.918 -4.462 849 HB3 PHE 765 HB3 PHE 765 6.885 4.166 -4.255 850 HD1 PHE 765 HD1 PHE 765 6.553 1.772 -4.865 851 HD2 PHE 765 HD2 PHE 765 10.430 3.610 -4.820 852 HE1 PHE 765 HE1 PHE 765 7.611 -0.468 -4.839 853 HE2 PHE 765 HE2 PHE 765 11.493 1.369 -4.797 854 HZ PHE 765 HZ PHE 765 10.082 -0.671 -4.806 855 H LYS 766 H LYS 766 7.523 2.565 -7.905 856 HA LYS 766 HA LYS 766 10.335 2.959 -8.565 857 HB2 LYS 766 HB2 LYS 766 8.401 1.004 -9.822 858 HB3 LYS 766 HB3 LYS 766 10.158 0.949 -9.877 859 HG2 LYS 766 HG2 LYS 766 9.638 1.090 -7.165 860 HG3 LYS 766 HG3 LYS 766 8.335 0.066 -7.750 861 HD2 LYS 766 HD2 LYS 766 10.939 -0.608 -8.923 862 HD3 LYS 766 HD3 LYS 766 10.897 -0.784 -7.171 863 HE2 LYS 766 HE2 LYS 766 10.105 -2.868 -7.803 864 HE3 LYS 766 HE3 LYS 766 8.583 -1.986 -7.674 865 HZ1 LYS 766 HZ1 LYS 766 9.405 -1.441 -10.199 866 HZ2 LYS 766 HZ2 LYS 766 9.882 -3.060 -10.008 867 HZ3 LYS 766 HZ3 LYS 766 8.244 -2.628 -9.784 868 H GLU 767 H GLU 767 7.204 3.665 -9.909 869 HA GLU 767 HA GLU 767 7.286 4.064 -12.493 870 HB2 GLU 767 HB2 GLU 767 6.081 5.489 -10.353 871 HB3 GLU 767 HB3 GLU 767 6.719 6.688 -11.473 872 HG2 GLU 767 HG2 GLU 767 5.626 4.962 -13.243 873 HG3 GLU 767 HG3 GLU 767 4.551 4.697 -11.880 874 H1 ASP 338 H1 ASP 338 6.343 3.321 16.652 875 H2 ASP 338 H2 ASP 338 5.285 3.746 18.136 876 H3 ASP 338 H3 ASP 338 6.585 2.832 17.525 877 HA ASP 338 HA ASP 338 6.594 5.738 18.148 878 HB2 ASP 338 HB2 ASP 338 8.533 4.762 19.656 879 HB3 ASP 338 HB3 ASP 338 6.861 4.657 20.196 880 H THR 339 H THR 339 8.611 2.934 17.192 881 HA THR 339 HA THR 339 10.810 4.493 16.280 882 HB THR 339 HB THR 339 11.732 2.484 15.448 883 HG1 THR 339 HG1 THR 339 9.795 2.047 14.178 884 HG21 THR 339 HG21 THR 339 10.542 0.732 17.193 885 HG22 THR 339 HG22 THR 339 11.807 1.877 17.633 886 HG23 THR 339 HG23 THR 339 10.115 2.284 17.909 887 H GLU 340 H GLU 340 9.000 5.964 15.182 888 HA GLU 340 HA GLU 340 7.750 6.497 13.228 889 HB2 GLU 340 HB2 GLU 340 10.676 6.769 13.005 890 HB3 GLU 340 HB3 GLU 340 9.812 6.856 11.472 891 HG2 GLU 340 HG2 GLU 340 8.928 8.443 13.883 892 HG3 GLU 340 HG3 GLU 340 10.126 9.059 12.751 893 H VAL 341 H VAL 341 6.903 4.164 13.088 894 HA VAL 341 HA VAL 341 7.741 3.055 10.477 895 HB VAL 341 HB VAL 341 8.513 1.588 12.262 896 HG11 VAL 341 HG11 VAL 341 7.254 1.893 14.161 897 HG12 VAL 341 HG12 VAL 341 5.736 1.998 13.278 898 HG13 VAL 341 HG13 VAL 341 6.489 0.427 13.550 899 HG21 VAL 341 HG21 VAL 341 7.989 -0.163 10.967 900 HG22 VAL 341 HG22 VAL 341 6.325 -0.149 11.546 901 HG23 VAL 341 HG23 VAL 341 6.787 0.836 10.160 902 H PTR 342 H PTR 342 5.237 1.253 11.690 903 HA PTR 342 HA PTR 342 3.108 3.061 10.771 904 HB2 PTR 342 HB2 PTR 342 2.119 0.922 9.597 905 HB3 PTR 342 HB3 PTR 342 3.309 1.908 8.754 906 HD1 PTR 342 HD1 PTR 342 2.903 -1.149 10.841 907 HD2 PTR 342 HD2 PTR 342 5.420 1.035 8.134 908 HE1 PTR 342 HE1 PTR 342 4.431 -3.092 10.696 909 HE2 PTR 342 HE2 PTR 342 6.950 -0.906 7.993 910 H GLU 343 H GLU 343 3.486 2.769 13.292 911 HA GLU 343 HA GLU 343 2.572 0.525 14.673 912 HB2 GLU 343 HB2 GLU 343 1.914 2.406 16.426 913 HB3 GLU 343 HB3 GLU 343 3.598 2.031 16.066 914 HG2 GLU 343 HG2 GLU 343 2.197 4.095 14.394 915 HG3 GLU 343 HG3 GLU 343 2.737 4.540 16.009 916 H SER 344 H SER 344 0.799 0.447 12.689 917 HA SER 344 HA SER 344 -1.435 0.296 12.157 918 HB2 SER 344 HB2 SER 344 -1.902 0.297 15.136 919 HB3 SER 344 HB3 SER 344 -2.855 -0.503 13.887 920 HG SER 344 HG SER 344 -0.754 -1.436 15.230 921 HA PRO 345 HA PRO 345 -2.379 4.721 13.050 922 HB2 PRO 345 HB2 PRO 345 -2.411 5.614 10.479 923 HB3 PRO 345 HB3 PRO 345 -0.922 5.483 11.435 924 HG2 PRO 345 HG2 PRO 345 -1.950 3.724 9.284 925 HG3 PRO 345 HG3 PRO 345 -0.283 4.149 9.700 926 HD2 PRO 345 HD2 PRO 345 -1.553 1.749 10.394 927 HD3 PRO 345 HD3 PRO 345 -0.081 2.390 11.155 928 H PTR 346 H PTR 346 -3.692 2.829 10.302 929 HA PTR 346 HA PTR 346 -6.396 3.820 11.010 930 HB2 PTR 346 HB2 PTR 346 -5.541 2.950 8.251 931 HB3 PTR 346 HB3 PTR 346 -6.990 3.838 8.715 932 HD1 PTR 346 HD1 PTR 346 -4.562 4.523 6.729 933 HD2 PTR 346 HD2 PTR 346 -5.691 5.752 10.685 934 HE1 PTR 346 HE1 PTR 346 -3.356 6.679 6.414 935 HE2 PTR 346 HE2 PTR 346 -4.492 7.888 10.374 936 H ALA 347 H ALA 347 -8.153 2.417 10.800 937 HA ALA 347 HA ALA 347 -8.311 -0.122 9.797 938 HB1 ALA 347 HB1 ALA 347 -6.880 -0.071 12.422 939 HB2 ALA 347 HB2 ALA 347 -6.637 -1.122 11.027 940 HB3 ALA 347 HB3 ALA 347 -8.007 -1.391 12.106 941 H ASP 348 H ASP 348 -8.891 1.105 13.109 942 HA ASP 348 HA ASP 348 -11.794 0.950 12.589 943 HB2 ASP 348 HB2 ASP 348 -10.416 -0.026 15.102 944 HB3 ASP 348 HB3 ASP 348 -12.150 -0.047 14.790 945 HA PRO 349 HA PRO 349 -10.852 5.016 14.501 946 HB2 PRO 349 HB2 PRO 349 -12.466 6.497 12.887 947 HB3 PRO 349 HB3 PRO 349 -10.837 5.992 12.395 948 HG2 PRO 349 HG2 PRO 349 -13.479 4.903 11.599 949 HG3 PRO 349 HG3 PRO 349 -11.989 5.062 10.655 950 HD2 PRO 349 HD2 PRO 349 -12.894 2.697 11.841 951 HD3 PRO 349 HD3 PRO 349 -11.227 3.002 11.303 952 H GLU 350 H GLU 350 -11.998 4.130 16.371 953 HA GLU 350 HA GLU 350 -13.660 4.159 17.951 954 HB2 GLU 350 HB2 GLU 350 -14.616 6.416 16.167 955 HB3 GLU 350 HB3 GLU 350 -15.425 5.979 17.670 956 HG2 GLU 350 HG2 GLU 350 -13.856 7.761 18.157 957 HG3 GLU 350 HG3 GLU 350 -13.219 6.278 18.860
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