NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
565459 | 2mc1 | 19423 | 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 5.665 -13.191 -10.212 2 H2 GLY 661 H2 GLY 661 5.388 -14.458 -9.100 3 H3 GLY 661 H3 GLY 661 4.925 -14.628 -10.736 4 HA2 GLY 661 HA2 GLY 661 7.145 -14.766 -11.482 5 HA3 GLY 661 HA3 GLY 661 7.748 -14.227 -9.913 6 H HIS 662 H HIS 662 7.829 -15.664 -8.182 7 HA HIS 662 HA HIS 662 7.977 -18.466 -8.883 8 HB2 HIS 662 HB2 HIS 662 9.549 -17.326 -7.308 9 HB3 HIS 662 HB3 HIS 662 8.215 -17.110 -6.179 10 HD1 HIS 662 HD1 HIS 662 7.025 -20.060 -6.992 11 HD2 HIS 662 HD2 HIS 662 10.813 -19.143 -5.484 12 HE1 HIS 662 HE1 HIS 662 7.896 -22.170 -5.867 13 HE2 HIS 662 HE2 HIS 662 10.194 -21.618 -4.937 14 H MET 663 H MET 663 5.630 -16.308 -7.576 15 HA MET 663 HA MET 663 3.505 -18.152 -7.702 16 HB2 MET 663 HB2 MET 663 4.554 -19.192 -5.744 17 HB3 MET 663 HB3 MET 663 4.535 -17.643 -4.897 18 HG2 MET 663 HG2 MET 663 1.892 -18.078 -5.832 19 HG3 MET 663 HG3 MET 663 2.434 -19.601 -5.126 20 HE1 MET 663 HE1 MET 663 2.089 -20.109 -2.762 21 HE2 MET 663 HE2 MET 663 1.102 -18.990 -1.821 22 HE3 MET 663 HE3 MET 663 0.605 -19.459 -3.451 23 H GLN 664 H GLN 664 3.348 -16.244 -4.874 24 HA GLN 664 HA GLN 664 1.591 -14.350 -6.251 25 HB2 GLN 664 HB2 GLN 664 1.109 -15.616 -4.005 26 HB3 GLN 664 HB3 GLN 664 2.080 -14.328 -3.291 27 HG2 GLN 664 HG2 GLN 664 0.255 -13.132 -5.148 28 HG3 GLN 664 HG3 GLN 664 -0.659 -14.225 -4.116 29 HE21 GLN 664 HE21 GLN 664 2.186 -12.118 -3.449 30 HE22 GLN 664 HE22 GLN 664 1.449 -11.311 -2.140 31 H ASP 665 H ASP 665 4.275 -14.047 -6.915 32 HA ASP 665 HA ASP 665 5.560 -12.058 -5.311 33 HB2 ASP 665 HB2 ASP 665 6.222 -12.167 -8.187 34 HB3 ASP 665 HB3 ASP 665 7.277 -12.210 -6.783 35 H LEU 666 H LEU 666 3.775 -10.601 -5.022 36 HA LEU 666 HA LEU 666 2.399 -9.228 -7.023 37 HB2 LEU 666 HB2 LEU 666 3.303 -8.087 -4.371 38 HB3 LEU 666 HB3 LEU 666 1.961 -7.513 -5.351 39 HG LEU 666 HG LEU 666 2.164 -10.250 -4.064 40 HD11 LEU 666 HD11 LEU 666 1.726 -8.319 -2.521 41 HD12 LEU 666 HD12 LEU 666 0.290 -7.947 -3.472 42 HD13 LEU 666 HD13 LEU 666 0.397 -9.475 -2.599 43 HD21 LEU 666 HD21 LEU 666 0.006 -8.946 -5.749 44 HD22 LEU 666 HD22 LEU 666 0.927 -10.394 -6.152 45 HD23 LEU 666 HD23 LEU 666 -0.230 -10.427 -4.823 46 H SER 667 H SER 667 5.692 -9.055 -6.156 47 HA SER 667 HA SER 667 6.504 -6.487 -6.700 48 HB2 SER 667 HB2 SER 667 7.754 -8.958 -6.386 49 HB3 SER 667 HB3 SER 667 8.279 -8.401 -7.974 50 HG SER 667 HG SER 667 8.867 -6.416 -6.968 51 H VAL 668 H VAL 668 5.052 -8.697 -8.876 52 HA VAL 668 HA VAL 668 6.142 -7.668 -11.302 53 HB VAL 668 HB VAL 668 4.325 -8.877 -12.402 54 HG11 VAL 668 HG11 VAL 668 5.651 -10.656 -12.002 55 HG12 VAL 668 HG12 VAL 668 6.113 -10.028 -10.419 56 HG13 VAL 668 HG13 VAL 668 4.651 -11.003 -10.591 57 HG21 VAL 668 HG21 VAL 668 2.557 -8.199 -10.734 58 HG22 VAL 668 HG22 VAL 668 2.529 -9.914 -11.140 59 HG23 VAL 668 HG23 VAL 668 3.234 -9.381 -9.614 60 H HIS 669 H HIS 669 3.731 -6.546 -9.093 61 HA HIS 669 HA HIS 669 2.393 -4.843 -11.027 62 HB2 HIS 669 HB2 HIS 669 2.193 -4.750 -8.015 63 HB3 HIS 669 HB3 HIS 669 1.044 -4.107 -9.192 64 HD1 HIS 669 HD1 HIS 669 0.419 -6.209 -11.082 65 HD2 HIS 669 HD2 HIS 669 1.235 -7.176 -7.112 66 HE1 HIS 669 HE1 HIS 669 -0.558 -8.515 -10.698 67 HE2 HIS 669 HE2 HIS 669 -0.079 -9.119 -8.276 68 H LEU 670 H LEU 670 2.984 -2.909 -11.611 69 HA LEU 670 HA LEU 670 5.365 -1.689 -11.085 70 HB2 LEU 670 HB2 LEU 670 3.812 -1.090 -12.918 71 HB3 LEU 670 HB3 LEU 670 2.760 -0.296 -11.749 72 HG LEU 670 HG LEU 670 4.607 1.252 -11.154 73 HD11 LEU 670 HD11 LEU 670 6.587 1.287 -12.725 74 HD12 LEU 670 HD12 LEU 670 6.545 -0.102 -11.635 75 HD13 LEU 670 HD13 LEU 670 6.061 -0.288 -13.320 76 HD21 LEU 670 HD21 LEU 670 4.243 1.176 -14.156 77 HD22 LEU 670 HD22 LEU 670 2.962 1.685 -13.057 78 HD23 LEU 670 HD23 LEU 670 4.473 2.591 -13.130 79 H TRP 671 H TRP 671 2.424 -1.460 -9.129 80 HA TRP 671 HA TRP 671 3.610 0.665 -7.535 81 HB2 TRP 671 HB2 TRP 671 1.456 0.150 -6.101 82 HB3 TRP 671 HB3 TRP 671 1.364 1.084 -7.588 83 HD1 TRP 671 HD1 TRP 671 -0.046 0.138 -9.518 84 HE1 TRP 671 HE1 TRP 671 -1.477 -2.000 -9.858 85 HE3 TRP 671 HE3 TRP 671 1.408 -2.524 -5.404 86 HZ2 TRP 671 HZ2 TRP 671 -1.900 -4.486 -8.545 87 HZ3 TRP 671 HZ3 TRP 671 0.466 -4.778 -4.973 88 HH2 TRP 671 HH2 TRP 671 -1.185 -5.762 -6.542 89 H TYR 672 H TYR 672 4.206 -2.537 -7.672 90 HA TYR 672 HA TYR 672 4.344 -2.907 -4.753 91 HB2 TYR 672 HB2 TYR 672 3.636 -4.684 -6.621 92 HB3 TYR 672 HB3 TYR 672 5.371 -4.987 -6.613 93 HD1 TYR 672 HD2 TYR 672 2.366 -4.759 -4.447 94 HD2 TYR 672 HD1 TYR 672 6.411 -6.147 -4.791 95 HE1 TYR 672 HE2 TYR 672 2.118 -6.015 -2.318 96 HE2 TYR 672 HE1 TYR 672 6.162 -7.401 -2.666 97 HH TYR 672 HH TYR 672 3.564 -8.319 -1.364 98 H ALA 673 H ALA 673 6.047 -1.969 -3.827 99 HA ALA 673 HA ALA 673 8.577 -1.686 -5.240 100 HB1 ALA 673 HB1 ALA 673 7.974 -1.014 -2.358 101 HB2 ALA 673 HB2 ALA 673 7.572 0.057 -3.696 102 HB3 ALA 673 HB3 ALA 673 9.256 -0.354 -3.374 103 H GLY 674 H GLY 674 7.105 -4.143 -3.713 104 HA2 GLY 674 HA2 GLY 674 7.742 -6.105 -2.697 105 HA3 GLY 674 HA3 GLY 674 9.141 -5.965 -3.739 106 HA PRO 675 HA PRO 675 11.453 -6.231 0.055 107 HB2 PRO 675 HB2 PRO 675 13.861 -5.383 -1.051 108 HB3 PRO 675 HB3 PRO 675 13.251 -7.047 -1.077 109 HG2 PRO 675 HG2 PRO 675 13.179 -4.967 -3.193 110 HG3 PRO 675 HG3 PRO 675 13.408 -6.717 -3.334 111 HD2 PRO 675 HD2 PRO 675 11.054 -5.526 -3.946 112 HD3 PRO 675 HD3 PRO 675 11.130 -7.161 -3.249 113 H MET 676 H MET 676 10.798 -3.362 -1.635 114 HA MET 676 HA MET 676 12.469 -1.489 -0.425 115 HB2 MET 676 HB2 MET 676 10.798 -1.109 -2.283 116 HB3 MET 676 HB3 MET 676 9.536 -1.107 -1.058 117 HG2 MET 676 HG2 MET 676 9.933 1.083 -0.705 118 HG3 MET 676 HG3 MET 676 11.553 0.676 -0.150 119 HE1 MET 676 HE1 MET 676 13.814 1.330 -1.650 120 HE2 MET 676 HE2 MET 676 13.157 -0.299 -1.737 121 HE3 MET 676 HE3 MET 676 13.682 0.523 -3.206 122 H GLU 677 H GLU 677 12.085 -0.051 1.391 123 HA GLU 677 HA GLU 677 10.525 -1.359 3.532 124 HB2 GLU 677 HB2 GLU 677 11.999 0.231 4.994 125 HB3 GLU 677 HB3 GLU 677 12.687 -1.261 4.366 126 HG2 GLU 677 HG2 GLU 677 13.666 -0.004 2.470 127 HG3 GLU 677 HG3 GLU 677 12.993 1.487 3.119 128 H ARG 678 H ARG 678 9.574 0.196 5.147 129 HA ARG 678 HA ARG 678 7.749 1.912 3.911 130 HB2 ARG 678 HB2 ARG 678 7.274 1.104 6.109 131 HB3 ARG 678 HB3 ARG 678 8.759 1.808 6.754 132 HG2 ARG 678 HG2 ARG 678 6.971 3.739 5.406 133 HG3 ARG 678 HG3 ARG 678 6.305 3.022 6.873 134 HD2 ARG 678 HD2 ARG 678 8.464 3.603 8.039 135 HD3 ARG 678 HD3 ARG 678 8.942 4.484 6.596 136 HE ARG 678 HE ARG 678 7.461 6.190 7.166 137 HH11 ARG 678 HH21 ARG 678 6.819 3.282 8.967 138 HH12 ARG 678 HH22 ARG 678 5.757 4.067 10.119 139 HH21 ARG 678 HH11 ARG 678 6.086 7.180 8.635 140 HH22 ARG 678 HH12 ARG 678 5.350 6.266 9.908 141 H ALA 679 H ALA 679 10.549 2.870 5.916 142 HA ALA 679 HA ALA 679 10.521 5.606 5.416 143 HB1 ALA 679 HB1 ALA 679 12.858 3.709 5.770 144 HB2 ALA 679 HB2 ALA 679 12.054 4.653 7.025 145 HB3 ALA 679 HB3 ALA 679 13.013 5.468 5.790 146 H GLY 680 H GLY 680 11.927 2.976 3.562 147 HA2 GLY 680 HA2 GLY 680 13.111 4.522 1.502 148 HA3 GLY 680 HA3 GLY 680 12.667 2.818 1.384 149 H ALA 681 H ALA 681 9.969 2.865 1.797 150 HA ALA 681 HA ALA 681 8.912 3.511 -0.702 151 HB1 ALA 681 HB1 ALA 681 6.667 3.482 0.568 152 HB2 ALA 681 HB2 ALA 681 7.628 3.109 1.998 153 HB3 ALA 681 HB3 ALA 681 7.643 2.013 0.617 154 H GLU 682 H GLU 682 8.968 5.367 2.313 155 HA GLU 682 HA GLU 682 7.462 7.576 1.345 156 HB2 GLU 682 HB2 GLU 682 9.587 7.888 3.449 157 HB3 GLU 682 HB3 GLU 682 8.005 8.662 3.343 158 HG2 GLU 682 HG2 GLU 682 7.270 6.048 3.512 159 HG3 GLU 682 HG3 GLU 682 8.739 6.020 4.458 160 H SER 683 H SER 683 10.882 6.756 1.268 161 HA SER 683 HA SER 683 12.032 9.188 0.634 162 HB2 SER 683 HB2 SER 683 13.868 7.982 -0.253 163 HB3 SER 683 HB3 SER 683 13.189 6.947 1.000 164 HG SER 683 HG SER 683 12.124 5.765 -0.601 165 H ILE 684 H ILE 684 10.737 6.794 -1.654 166 HA ILE 684 HA ILE 684 11.102 8.517 -3.933 167 HB ILE 684 HB ILE 684 9.177 6.195 -3.782 168 HG12 ILE 684 HG12 ILE 684 11.642 5.316 -4.846 169 HG13 ILE 684 HG13 ILE 684 12.039 6.159 -3.348 170 HG21 ILE 684 HG21 ILE 684 10.789 6.430 -6.169 171 HG22 ILE 684 HG22 ILE 684 9.035 6.504 -6.007 172 HG23 ILE 684 HG23 ILE 684 10.000 7.969 -5.827 173 HD11 ILE 684 HD11 ILE 684 9.839 4.092 -3.537 174 HD12 ILE 684 HD12 ILE 684 11.495 3.694 -3.080 175 HD13 ILE 684 HD13 ILE 684 10.539 4.787 -2.079 176 H LEU 685 H LEU 685 8.234 7.355 -2.196 177 HA LEU 685 HA LEU 685 6.305 8.869 -3.477 178 HB2 LEU 685 HB2 LEU 685 6.458 7.986 -0.591 179 HB3 LEU 685 HB3 LEU 685 5.025 8.714 -1.316 180 HG LEU 685 HG LEU 685 6.387 6.184 -2.283 181 HD11 LEU 685 HD11 LEU 685 4.206 5.158 -1.513 182 HD12 LEU 685 HD12 LEU 685 5.233 5.753 -0.209 183 HD13 LEU 685 HD13 LEU 685 3.836 6.693 -0.733 184 HD21 LEU 685 HD21 LEU 685 4.038 6.123 -3.513 185 HD22 LEU 685 HD22 LEU 685 4.125 7.871 -3.304 186 HD23 LEU 685 HD23 LEU 685 5.383 7.029 -4.207 187 H ALA 686 H ALA 686 8.174 9.770 -0.538 188 HA ALA 686 HA ALA 686 7.070 12.262 -0.065 189 HB1 ALA 686 HB1 ALA 686 9.296 12.897 0.864 190 HB2 ALA 686 HB2 ALA 686 9.969 11.423 0.168 191 HB3 ALA 686 HB3 ALA 686 8.736 11.323 1.425 192 H ASN 687 H ASN 687 9.545 11.373 -2.436 193 HA ASN 687 HA ASN 687 9.933 14.072 -3.371 194 HB2 ASN 687 HB2 ASN 687 11.605 12.142 -3.505 195 HB3 ASN 687 HB3 ASN 687 10.645 11.539 -4.853 196 HD21 ASN 687 HD21 ASN 687 9.975 13.970 -6.157 197 HD22 ASN 687 HD22 ASN 687 11.407 14.695 -6.712 198 H ARG 688 H ARG 688 7.795 11.418 -4.202 199 HA ARG 688 HA ARG 688 7.032 12.489 -6.764 200 HB2 ARG 688 HB2 ARG 688 6.778 10.040 -5.504 201 HB3 ARG 688 HB3 ARG 688 5.127 10.660 -5.513 202 HG2 ARG 688 HG2 ARG 688 5.371 9.518 -7.590 203 HG3 ARG 688 HG3 ARG 688 5.517 11.226 -7.986 204 HD2 ARG 688 HD2 ARG 688 8.059 10.878 -7.654 205 HD3 ARG 688 HD3 ARG 688 7.698 9.160 -7.766 206 HE ARG 688 HE ARG 688 7.100 11.141 -9.903 207 HH11 ARG 688 HH21 ARG 688 7.905 7.926 -8.882 208 HH12 ARG 688 HH22 ARG 688 7.976 7.300 -10.508 209 HH21 ARG 688 HH11 ARG 688 7.136 10.295 -11.969 210 HH22 ARG 688 HH12 ARG 688 7.476 8.606 -12.229 211 H SER 689 H SER 689 4.592 12.835 -7.183 212 HA SER 689 HA SER 689 3.769 15.032 -5.486 213 HB2 SER 689 HB2 SER 689 3.278 14.216 -8.184 214 HB3 SER 689 HB3 SER 689 1.727 14.391 -7.359 215 HG SER 689 HG SER 689 2.282 16.478 -6.806 216 H ASP 690 H ASP 690 1.445 15.239 -4.861 217 HA ASP 690 HA ASP 690 0.717 13.234 -3.030 218 HB2 ASP 690 HB2 ASP 690 -1.539 14.515 -3.135 219 HB3 ASP 690 HB3 ASP 690 -0.110 15.373 -2.569 220 H GLY 691 H GLY 691 -0.568 11.475 -3.160 221 HA2 GLY 691 HA2 GLY 691 -2.430 10.263 -4.148 222 HA3 GLY 691 HA3 GLY 691 -2.044 11.017 -5.694 223 H THR 692 H THR 692 0.872 10.606 -5.168 224 HA THR 692 HA THR 692 1.297 8.246 -6.604 225 HB THR 692 HB THR 692 3.242 9.344 -4.567 226 HG1 THR 692 HG1 THR 692 2.717 11.131 -5.702 227 HG21 THR 692 HG21 THR 692 4.901 8.385 -5.946 228 HG22 THR 692 HG22 THR 692 3.623 7.173 -5.929 229 HG23 THR 692 HG23 THR 692 3.801 8.244 -7.317 230 H PHE 693 H PHE 693 1.378 6.101 -6.037 231 HA PHE 693 HA PHE 693 1.435 5.482 -3.150 232 HB2 PHE 693 HB2 PHE 693 -0.464 4.046 -3.291 233 HB3 PHE 693 HB3 PHE 693 -0.926 5.578 -4.028 234 HD1 PHE 693 HD1 PHE 693 -0.957 5.809 -6.530 235 HD2 PHE 693 HD2 PHE 693 -0.344 2.030 -4.579 236 HE1 PHE 693 HE1 PHE 693 -1.499 4.631 -8.642 237 HE2 PHE 693 HE2 PHE 693 -0.886 0.856 -6.693 238 HZ PHE 693 HZ PHE 693 -1.462 2.153 -8.725 239 H LEU 694 H LEU 694 1.729 3.201 -2.648 240 HA LEU 694 HA LEU 694 2.685 1.376 -4.627 241 HB2 LEU 694 HB2 LEU 694 5.019 1.336 -4.130 242 HB3 LEU 694 HB3 LEU 694 4.596 3.009 -4.459 243 HG LEU 694 HG LEU 694 4.165 3.015 -1.820 244 HD11 LEU 694 HD11 LEU 694 5.491 0.512 -2.307 245 HD12 LEU 694 HD12 LEU 694 6.576 1.562 -1.397 246 HD13 LEU 694 HD13 LEU 694 4.969 1.195 -0.767 247 HD21 LEU 694 HD21 LEU 694 5.703 4.485 -3.104 248 HD22 LEU 694 HD22 LEU 694 6.394 3.981 -1.567 249 HD23 LEU 694 HD23 LEU 694 6.922 3.213 -3.062 250 H VAL 695 H VAL 695 3.756 -0.520 -3.615 251 HA VAL 695 HA VAL 695 2.875 -1.022 -0.837 252 HB VAL 695 HB VAL 695 2.555 -3.144 -2.944 253 HG11 VAL 695 HG11 VAL 695 1.340 -4.240 -1.307 254 HG12 VAL 695 HG12 VAL 695 2.413 -3.299 -0.268 255 HG13 VAL 695 HG13 VAL 695 0.771 -2.737 -0.580 256 HG21 VAL 695 HG21 VAL 695 1.253 -1.268 -3.794 257 HG22 VAL 695 HG22 VAL 695 0.141 -2.430 -3.068 258 HG23 VAL 695 HG23 VAL 695 0.582 -0.964 -2.192 259 H ARG 696 H ARG 696 4.187 -2.498 0.307 260 HA ARG 696 HA ARG 696 6.518 -3.618 -1.093 261 HB2 ARG 696 HB2 ARG 696 8.052 -2.520 0.574 262 HB3 ARG 696 HB3 ARG 696 7.304 -1.417 -0.576 263 HG2 ARG 696 HG2 ARG 696 6.138 -0.327 1.035 264 HG3 ARG 696 HG3 ARG 696 5.672 -1.829 1.830 265 HD2 ARG 696 HD2 ARG 696 8.194 -0.220 2.187 266 HD3 ARG 696 HD3 ARG 696 7.048 -0.741 3.417 267 HE ARG 696 HE ARG 696 9.233 -2.304 2.302 268 HH11 ARG 696 HH21 ARG 696 6.181 -2.358 3.829 269 HH12 ARG 696 HH22 ARG 696 6.353 -3.954 4.497 270 HH21 ARG 696 HH11 ARG 696 9.521 -4.339 3.167 271 HH22 ARG 696 HH12 ARG 696 8.282 -5.050 4.144 272 H GLN 697 H GLN 697 7.842 -5.036 0.211 273 HA GLN 697 HA GLN 697 6.838 -5.835 2.820 274 HB2 GLN 697 HB2 GLN 697 5.450 -7.153 1.193 275 HB3 GLN 697 HB3 GLN 697 6.938 -7.892 0.602 276 HG2 GLN 697 HG2 GLN 697 5.607 -9.155 2.444 277 HG3 GLN 697 HG3 GLN 697 7.349 -8.999 2.650 278 HE21 GLN 697 HE21 GLN 697 4.233 -8.082 3.975 279 HE22 GLN 697 HE22 GLN 697 4.848 -7.208 5.307 280 H ARG 698 H ARG 698 8.359 -7.005 4.026 281 HA ARG 698 HA ARG 698 10.832 -7.950 2.886 282 HB2 ARG 698 HB2 ARG 698 11.043 -5.402 2.872 283 HB3 ARG 698 HB3 ARG 698 11.066 -5.493 4.631 284 HG2 ARG 698 HG2 ARG 698 13.030 -6.991 4.530 285 HG3 ARG 698 HG3 ARG 698 13.002 -6.906 2.768 286 HD2 ARG 698 HD2 ARG 698 14.641 -5.310 3.538 287 HD3 ARG 698 HD3 ARG 698 13.243 -4.403 2.962 288 HE ARG 698 HE ARG 698 13.008 -4.924 5.756 289 HH11 ARG 698 HH21 ARG 698 14.698 -2.991 3.453 290 HH12 ARG 698 HH22 ARG 698 14.949 -1.648 4.546 291 HH21 ARG 698 HH11 ARG 698 13.357 -3.219 7.178 292 HH22 ARG 698 HH12 ARG 698 14.254 -1.818 6.670 293 H VAL 699 H VAL 699 8.635 -7.534 5.468 294 HA VAL 699 HA VAL 699 10.335 -8.454 7.593 295 HB VAL 699 HB VAL 699 8.348 -7.079 8.029 296 HG11 VAL 699 HG11 VAL 699 6.360 -7.530 7.081 297 HG12 VAL 699 HG12 VAL 699 7.095 -8.907 6.260 298 HG13 VAL 699 HG13 VAL 699 6.329 -9.124 7.833 299 HG21 VAL 699 HG21 VAL 699 8.860 -9.701 9.273 300 HG22 VAL 699 HG22 VAL 699 8.666 -8.117 10.022 301 HG23 VAL 699 HG23 VAL 699 7.244 -9.065 9.585 302 H LYS 700 H LYS 700 11.267 -10.283 6.449 303 HA LYS 700 HA LYS 700 9.834 -12.558 5.597 304 HB2 LYS 700 HB2 LYS 700 12.013 -13.737 5.854 305 HB3 LYS 700 HB3 LYS 700 12.164 -12.208 4.989 306 HG2 LYS 700 HG2 LYS 700 13.654 -11.486 6.514 307 HG3 LYS 700 HG3 LYS 700 12.432 -11.641 7.776 308 HD2 LYS 700 HD2 LYS 700 13.273 -14.276 7.257 309 HD3 LYS 700 HD3 LYS 700 14.752 -13.317 7.257 310 HE2 LYS 700 HE2 LYS 700 14.594 -13.693 9.522 311 HE3 LYS 700 HE3 LYS 700 13.579 -12.251 9.431 312 HZ1 LYS 700 HZ1 LYS 700 12.822 -15.020 9.888 313 HZ2 LYS 700 HZ2 LYS 700 12.077 -13.575 10.445 314 HZ3 LYS 700 HZ3 LYS 700 11.791 -14.139 8.847 315 H ASP 701 H ASP 701 8.557 -11.851 7.904 316 HA ASP 701 HA ASP 701 8.987 -14.224 9.594 317 HB2 ASP 701 HB2 ASP 701 8.591 -11.447 10.735 318 HB3 ASP 701 HB3 ASP 701 8.863 -12.936 11.636 319 H ALA 702 H ALA 702 6.951 -11.484 8.680 320 HA ALA 702 HA ALA 702 4.563 -13.126 9.287 321 HB1 ALA 702 HB1 ALA 702 4.805 -11.289 10.923 322 HB2 ALA 702 HB2 ALA 702 3.379 -11.070 9.907 323 HB3 ALA 702 HB3 ALA 702 4.836 -10.124 9.599 324 H ALA 703 H ALA 703 3.692 -13.707 7.397 325 HA ALA 703 HA ALA 703 4.189 -12.421 4.923 326 HB1 ALA 703 HB1 ALA 703 1.918 -14.292 5.637 327 HB2 ALA 703 HB2 ALA 703 3.539 -14.809 5.175 328 HB3 ALA 703 HB3 ALA 703 2.523 -13.947 4.017 329 H GLU 704 H GLU 704 3.474 -10.295 6.405 330 HA GLU 704 HA GLU 704 0.636 -9.726 5.850 331 HB2 GLU 704 HB2 GLU 704 0.933 -7.763 7.275 332 HB3 GLU 704 HB3 GLU 704 1.491 -9.214 8.104 333 HG2 GLU 704 HG2 GLU 704 3.271 -7.784 8.522 334 HG3 GLU 704 HG3 GLU 704 3.822 -8.553 7.038 335 H PHE 705 H PHE 705 0.298 -7.265 5.249 336 HA PHE 705 HA PHE 705 2.246 -6.298 3.297 337 HB2 PHE 705 HB2 PHE 705 -0.579 -7.041 2.485 338 HB3 PHE 705 HB3 PHE 705 0.607 -6.234 1.461 339 HD1 PHE 705 HD2 PHE 705 2.780 -7.438 0.915 340 HD2 PHE 705 HD1 PHE 705 -0.571 -9.403 2.752 341 HE1 PHE 705 HE2 PHE 705 3.715 -9.643 0.264 342 HE2 PHE 705 HE1 PHE 705 0.361 -11.607 2.100 343 HZ PHE 705 HZ PHE 705 2.504 -11.726 0.855 344 H ALA 706 H ALA 706 1.717 -4.153 2.480 345 HA ALA 706 HA ALA 706 -0.455 -2.662 3.721 346 HB1 ALA 706 HB1 ALA 706 0.779 -1.293 5.110 347 HB2 ALA 706 HB2 ALA 706 2.260 -1.547 4.201 348 HB3 ALA 706 HB3 ALA 706 1.677 -2.801 5.294 349 H ILE 707 H ILE 707 -0.889 -0.734 2.676 350 HA ILE 707 HA ILE 707 0.638 -0.321 0.172 351 HB ILE 707 HB ILE 707 -2.150 0.630 0.863 352 HG12 ILE 707 HG12 ILE 707 -1.251 -1.673 -0.900 353 HG13 ILE 707 HG13 ILE 707 -1.945 -1.852 0.710 354 HG21 ILE 707 HG21 ILE 707 -2.079 0.720 -1.786 355 HG22 ILE 707 HG22 ILE 707 -1.432 2.057 -0.834 356 HG23 ILE 707 HG23 ILE 707 -0.341 0.855 -1.525 357 HD11 ILE 707 HD11 ILE 707 -3.272 -1.237 -1.846 358 HD12 ILE 707 HD12 ILE 707 -3.923 -1.983 -0.387 359 HD13 ILE 707 HD13 ILE 707 -3.792 -0.228 -0.497 360 H SER 708 H SER 708 1.536 1.617 -0.309 361 HA SER 708 HA SER 708 1.350 3.719 1.778 362 HB2 SER 708 HB2 SER 708 3.561 2.662 1.707 363 HB3 SER 708 HB3 SER 708 3.680 3.011 -0.013 364 HG SER 708 HG SER 708 3.672 4.778 2.188 365 H ILE 709 H ILE 709 0.632 5.657 1.151 366 HA ILE 709 HA ILE 709 0.717 6.346 -1.720 367 HB ILE 709 HB ILE 709 -1.670 6.987 -0.002 368 HG12 ILE 709 HG12 ILE 709 -2.565 5.005 -1.630 369 HG13 ILE 709 HG13 ILE 709 -0.927 4.433 -1.319 370 HG21 ILE 709 HG21 ILE 709 -0.834 7.436 -2.774 371 HG22 ILE 709 HG22 ILE 709 -2.420 6.680 -2.664 372 HG23 ILE 709 HG23 ILE 709 -2.116 8.215 -1.852 373 HD11 ILE 709 HD11 ILE 709 -2.080 3.512 0.483 374 HD12 ILE 709 HD12 ILE 709 -1.509 5.029 1.180 375 HD13 ILE 709 HD13 ILE 709 -3.174 4.889 0.614 376 H LYS 710 H LYS 710 1.007 8.448 -2.235 377 HA LYS 710 HA LYS 710 2.126 10.175 -0.186 378 HB2 LYS 710 HB2 LYS 710 3.115 10.018 -2.447 379 HB3 LYS 710 HB3 LYS 710 1.637 10.673 -3.134 380 HG2 LYS 710 HG2 LYS 710 3.085 12.547 -2.928 381 HG3 LYS 710 HG3 LYS 710 1.984 12.680 -1.559 382 HD2 LYS 710 HD2 LYS 710 3.615 11.891 -0.030 383 HD3 LYS 710 HD3 LYS 710 4.637 11.263 -1.317 384 HE2 LYS 710 HE2 LYS 710 4.024 14.186 -1.354 385 HE3 LYS 710 HE3 LYS 710 5.157 13.605 -0.130 386 HZ1 LYS 710 HZ1 LYS 710 6.067 12.302 -2.247 387 HZ2 LYS 710 HZ2 LYS 710 5.433 13.669 -3.047 388 HZ3 LYS 710 HZ3 LYS 710 6.625 13.867 -1.830 389 H TYR 711 H TYR 711 1.099 11.723 0.896 390 HA TYR 711 HA TYR 711 -1.247 13.036 -0.282 391 HB2 TYR 711 HB2 TYR 711 -1.693 10.938 1.385 392 HB3 TYR 711 HB3 TYR 711 -1.599 12.258 2.552 393 HD1 TYR 711 HD2 TYR 711 -2.776 14.532 1.505 394 HD2 TYR 711 HD1 TYR 711 -3.855 10.463 0.678 395 HE1 TYR 711 HE2 TYR 711 -5.046 15.272 0.853 396 HE2 TYR 711 HE1 TYR 711 -6.130 11.196 0.027 397 HH TYR 711 HH TYR 711 -7.463 12.995 -0.414 398 H ASN 712 H ASN 712 -0.979 15.156 -0.059 399 HA ASN 712 HA ASN 712 -0.114 17.180 0.635 400 HB2 ASN 712 HB2 ASN 712 -0.903 15.874 3.244 401 HB3 ASN 712 HB3 ASN 712 -0.391 17.555 3.127 402 HD21 ASN 712 HD21 ASN 712 -2.661 18.076 3.865 403 HD22 ASN 712 HD22 ASN 712 -3.909 18.075 2.714 404 H VAL 713 H VAL 713 2.006 16.306 -0.165 405 HA VAL 713 HA VAL 713 4.250 15.893 0.034 406 HB VAL 713 HB VAL 713 5.460 17.471 1.384 407 HG11 VAL 713 HG11 VAL 713 4.321 18.427 -0.547 408 HG12 VAL 713 HG12 VAL 713 2.838 18.627 0.388 409 HG13 VAL 713 HG13 VAL 713 4.268 19.581 0.786 410 HG21 VAL 713 HG21 VAL 713 3.911 16.999 3.437 411 HG22 VAL 713 HG22 VAL 713 4.588 18.616 3.244 412 HG23 VAL 713 HG23 VAL 713 2.918 18.300 2.779 413 H GLU 714 H GLU 714 2.345 14.266 1.788 414 HA GLU 714 HA GLU 714 4.461 13.043 3.425 415 HB2 GLU 714 HB2 GLU 714 1.912 14.182 4.311 416 HB3 GLU 714 HB3 GLU 714 2.169 12.521 4.854 417 HG2 GLU 714 HG2 GLU 714 4.341 14.598 5.073 418 HG3 GLU 714 HG3 GLU 714 3.124 14.411 6.335 419 H VAL 715 H VAL 715 3.921 10.786 4.073 420 HA VAL 715 HA VAL 715 2.469 9.450 1.854 421 HB VAL 715 HB VAL 715 4.746 8.423 3.542 422 HG11 VAL 715 HG11 VAL 715 3.199 7.250 1.227 423 HG12 VAL 715 HG12 VAL 715 4.759 6.624 1.762 424 HG13 VAL 715 HG13 VAL 715 3.373 6.584 2.849 425 HG21 VAL 715 HG21 VAL 715 5.030 10.277 1.642 426 HG22 VAL 715 HG22 VAL 715 6.193 8.965 1.834 427 HG23 VAL 715 HG23 VAL 715 4.938 8.859 0.603 428 H LYS 716 H LYS 716 0.870 8.041 2.281 429 HA LYS 716 HA LYS 716 0.231 7.503 5.130 430 HB2 LYS 716 HB2 LYS 716 -1.448 8.626 3.438 431 HB3 LYS 716 HB3 LYS 716 -1.673 6.977 2.864 432 HG2 LYS 716 HG2 LYS 716 -2.811 6.328 4.752 433 HG3 LYS 716 HG3 LYS 716 -1.758 7.260 5.812 434 HD2 LYS 716 HD2 LYS 716 -4.038 8.367 4.132 435 HD3 LYS 716 HD3 LYS 716 -4.015 8.217 5.879 436 HE2 LYS 716 HE2 LYS 716 -1.710 9.646 5.427 437 HE3 LYS 716 HE3 LYS 716 -2.747 10.246 4.136 438 HZ1 LYS 716 HZ1 LYS 716 -4.436 10.268 6.261 439 HZ2 LYS 716 HZ2 LYS 716 -2.934 10.647 6.994 440 HZ3 LYS 716 HZ3 LYS 716 -3.510 11.605 5.723 441 H HIS 717 H HIS 717 1.061 5.586 5.760 442 HA HIS 717 HA HIS 717 1.084 3.327 3.841 443 HB2 HIS 717 HB2 HIS 717 2.482 3.489 6.521 444 HB3 HIS 717 HB3 HIS 717 2.712 2.273 5.273 445 HD1 HIS 717 HD1 HIS 717 4.452 2.744 3.522 446 HD2 HIS 717 HD2 HIS 717 3.539 6.122 5.784 447 HE1 HIS 717 HE1 HIS 717 6.165 4.512 2.907 448 HE2 HIS 717 HE2 HIS 717 5.605 6.592 4.289 449 H ILE 718 H ILE 718 -0.818 2.211 4.012 450 HA ILE 718 HA ILE 718 -1.824 1.693 6.752 451 HB ILE 718 HB ILE 718 -3.174 2.164 4.146 452 HG12 ILE 718 HG12 ILE 718 -3.137 3.782 6.084 453 HG13 ILE 718 HG13 ILE 718 -4.744 3.359 5.515 454 HG21 ILE 718 HG21 ILE 718 -5.214 0.953 4.970 455 HG22 ILE 718 HG22 ILE 718 -3.887 -0.121 4.532 456 HG23 ILE 718 HG23 ILE 718 -4.218 0.228 6.229 457 HD11 ILE 718 HD11 ILE 718 -3.556 1.696 7.690 458 HD12 ILE 718 HD12 ILE 718 -4.134 3.310 8.097 459 HD13 ILE 718 HD13 ILE 718 -5.238 2.129 7.397 460 H LYS 719 H LYS 719 -1.880 -0.340 7.480 461 HA LYS 719 HA LYS 719 -0.571 -2.393 5.960 462 HB2 LYS 719 HB2 LYS 719 -0.789 -3.748 7.950 463 HB3 LYS 719 HB3 LYS 719 -0.319 -2.118 8.431 464 HG2 LYS 719 HG2 LYS 719 -2.952 -1.764 8.570 465 HG3 LYS 719 HG3 LYS 719 -2.945 -3.516 8.784 466 HD2 LYS 719 HD2 LYS 719 -1.385 -3.307 10.664 467 HD3 LYS 719 HD3 LYS 719 -1.317 -1.560 10.432 468 HE2 LYS 719 HE2 LYS 719 -3.938 -1.719 10.673 469 HE3 LYS 719 HE3 LYS 719 -3.570 -3.241 11.489 470 HZ1 LYS 719 HZ1 LYS 719 -3.485 -0.742 12.604 471 HZ2 LYS 719 HZ2 LYS 719 -2.829 -2.159 13.270 472 HZ3 LYS 719 HZ3 LYS 719 -1.832 -1.119 12.349 473 H ILE 720 H ILE 720 -1.392 -4.336 5.247 474 HA ILE 720 HA ILE 720 -4.290 -4.293 4.699 475 HB ILE 720 HB ILE 720 -1.970 -5.728 3.398 476 HG12 ILE 720 HG12 ILE 720 -4.024 -3.749 2.366 477 HG13 ILE 720 HG13 ILE 720 -2.360 -3.350 2.794 478 HG21 ILE 720 HG21 ILE 720 -3.558 -7.377 3.102 479 HG22 ILE 720 HG22 ILE 720 -4.901 -6.260 3.332 480 HG23 ILE 720 HG23 ILE 720 -4.052 -6.308 1.789 481 HD11 ILE 720 HD11 ILE 720 -2.136 -5.552 1.086 482 HD12 ILE 720 HD12 ILE 720 -3.394 -4.554 0.359 483 HD13 ILE 720 HD13 ILE 720 -1.800 -3.872 0.674 484 H MET 721 H MET 721 -5.621 -5.794 5.603 485 HA MET 721 HA MET 721 -4.451 -7.641 7.536 486 HB2 MET 721 HB2 MET 721 -6.610 -6.244 7.828 487 HB3 MET 721 HB3 MET 721 -7.367 -7.501 6.860 488 HG2 MET 721 HG2 MET 721 -6.466 -9.213 8.446 489 HG3 MET 721 HG3 MET 721 -5.864 -7.899 9.458 490 HE1 MET 721 HE1 MET 721 -7.961 -9.399 11.462 491 HE2 MET 721 HE2 MET 721 -6.684 -8.197 11.320 492 HE3 MET 721 HE3 MET 721 -8.291 -7.727 11.894 493 H THR 722 H THR 722 -4.787 -9.871 7.588 494 HA THR 722 HA THR 722 -5.737 -11.156 5.116 495 HB THR 722 HB THR 722 -3.724 -12.751 5.411 496 HG1 THR 722 HG1 THR 722 -2.145 -12.070 6.657 497 HG21 THR 722 HG21 THR 722 -3.434 -9.893 4.468 498 HG22 THR 722 HG22 THR 722 -2.300 -11.188 4.075 499 HG23 THR 722 HG23 THR 722 -3.970 -11.275 3.507 500 H ALA 723 H ALA 723 -6.963 -12.890 5.484 501 HA ALA 723 HA ALA 723 -6.671 -14.497 7.891 502 HB1 ALA 723 HB1 ALA 723 -8.861 -14.071 8.773 503 HB2 ALA 723 HB2 ALA 723 -9.292 -13.076 7.379 504 HB3 ALA 723 HB3 ALA 723 -8.092 -12.500 8.539 505 H GLU 724 H GLU 724 -9.350 -13.766 5.724 506 HA GLU 724 HA GLU 724 -9.764 -16.583 5.127 507 HB2 GLU 724 HB2 GLU 724 -11.301 -14.420 3.786 508 HB3 GLU 724 HB3 GLU 724 -11.881 -15.918 4.505 509 HG2 GLU 724 HG2 GLU 724 -12.679 -14.340 6.036 510 HG3 GLU 724 HG3 GLU 724 -11.138 -14.768 6.768 511 H GLY 725 H GLY 725 -7.298 -15.376 4.199 512 HA2 GLY 725 HA2 GLY 725 -5.988 -15.358 2.296 513 HA3 GLY 725 HA3 GLY 725 -7.278 -16.263 1.500 514 H LEU 726 H LEU 726 -8.075 -13.291 3.036 515 HA LEU 726 HA LEU 726 -8.433 -12.013 0.398 516 HB2 LEU 726 HB2 LEU 726 -9.871 -11.549 3.019 517 HB3 LEU 726 HB3 LEU 726 -10.138 -10.611 1.554 518 HG LEU 726 HG LEU 726 -10.343 -13.597 1.427 519 HD11 LEU 726 HD11 LEU 726 -11.729 -12.499 3.386 520 HD12 LEU 726 HD12 LEU 726 -12.767 -11.950 2.069 521 HD13 LEU 726 HD13 LEU 726 -12.494 -13.673 2.314 522 HD21 LEU 726 HD21 LEU 726 -10.861 -12.967 -0.682 523 HD22 LEU 726 HD22 LEU 726 -12.372 -12.337 -0.030 524 HD23 LEU 726 HD23 LEU 726 -10.979 -11.273 -0.218 525 H TYR 727 H TYR 727 -7.991 -9.792 0.188 526 HA TYR 727 HA TYR 727 -5.993 -8.778 2.138 527 HB2 TYR 727 HB2 TYR 727 -6.316 -8.140 -0.808 528 HB3 TYR 727 HB3 TYR 727 -5.083 -7.468 0.258 529 HD1 TYR 727 HD2 TYR 727 -6.274 -10.524 -1.442 530 HD2 TYR 727 HD1 TYR 727 -3.194 -8.800 1.006 531 HE1 TYR 727 HE2 TYR 727 -4.830 -12.496 -1.867 532 HE2 TYR 727 HE1 TYR 727 -1.754 -10.772 0.578 533 HH TYR 727 HH TYR 727 -1.678 -12.582 -1.506 534 H ARG 728 H ARG 728 -6.535 -6.992 3.266 535 HA ARG 728 HA ARG 728 -8.347 -5.036 2.069 536 HB2 ARG 728 HB2 ARG 728 -9.499 -4.982 4.431 537 HB3 ARG 728 HB3 ARG 728 -10.025 -6.105 3.180 538 HG2 ARG 728 HG2 ARG 728 -9.250 -7.938 4.311 539 HG3 ARG 728 HG3 ARG 728 -7.828 -7.088 4.911 540 HD2 ARG 728 HD2 ARG 728 -9.012 -6.127 6.714 541 HD3 ARG 728 HD3 ARG 728 -10.577 -6.433 5.975 542 HE ARG 728 HE ARG 728 -9.024 -8.296 7.553 543 HH11 ARG 728 HH21 ARG 728 -11.494 -7.910 5.150 544 HH12 ARG 728 HH22 ARG 728 -12.109 -9.522 5.375 545 HH21 ARG 728 HH11 ARG 728 -9.850 -10.365 7.816 546 HH22 ARG 728 HH12 ARG 728 -11.185 -10.923 6.836 547 H ILE 729 H ILE 729 -7.909 -3.013 2.569 548 HA ILE 729 HA ILE 729 -5.576 -2.407 4.176 549 HB ILE 729 HB ILE 729 -6.418 0.015 3.515 550 HG12 ILE 729 HG12 ILE 729 -8.615 -1.147 2.676 551 HG13 ILE 729 HG13 ILE 729 -7.906 0.157 1.730 552 HG21 ILE 729 HG21 ILE 729 -5.362 -0.452 1.183 553 HG22 ILE 729 HG22 ILE 729 -4.379 -0.752 2.616 554 HG23 ILE 729 HG23 ILE 729 -5.148 -2.098 1.777 555 HD11 ILE 729 HD11 ILE 729 -8.575 -2.290 0.715 556 HD12 ILE 729 HD12 ILE 729 -7.375 -1.214 0.004 557 HD13 ILE 729 HD13 ILE 729 -6.864 -2.523 1.067 558 H THR 730 H THR 730 -8.799 -2.859 4.730 559 HA THR 730 HA THR 730 -8.607 -1.574 7.338 560 HB THR 730 HB THR 730 -9.709 -0.020 5.618 561 HG1 THR 730 HG1 THR 730 -11.528 0.293 7.230 562 HG21 THR 730 HG21 THR 730 -11.085 -1.943 4.658 563 HG22 THR 730 HG22 THR 730 -12.090 -1.805 6.097 564 HG23 THR 730 HG23 THR 730 -11.957 -0.445 4.985 565 H GLU 731 H GLU 731 -9.479 -2.695 8.860 566 HA GLU 731 HA GLU 731 -10.065 -5.373 8.745 567 HB2 GLU 731 HB2 GLU 731 -11.220 -4.877 10.980 568 HB3 GLU 731 HB3 GLU 731 -9.555 -4.292 10.818 569 HG2 GLU 731 HG2 GLU 731 -11.652 -2.437 9.860 570 HG3 GLU 731 HG3 GLU 731 -11.609 -2.698 11.595 571 H LYS 732 H LYS 732 -11.961 -2.946 7.461 572 HA LYS 732 HA LYS 732 -14.488 -4.353 7.886 573 HB2 LYS 732 HB2 LYS 732 -14.152 -1.673 6.576 574 HB3 LYS 732 HB3 LYS 732 -15.566 -2.323 7.416 575 HG2 LYS 732 HG2 LYS 732 -14.178 -2.403 9.515 576 HG3 LYS 732 HG3 LYS 732 -12.906 -1.555 8.639 577 HD2 LYS 732 HD2 LYS 732 -14.563 0.277 8.155 578 HD3 LYS 732 HD3 LYS 732 -15.691 -0.539 9.245 579 HE2 LYS 732 HE2 LYS 732 -14.161 -0.347 11.091 580 HE3 LYS 732 HE3 LYS 732 -12.878 0.250 10.037 581 HZ1 LYS 732 HZ1 LYS 732 -14.892 1.982 9.546 582 HZ2 LYS 732 HZ2 LYS 732 -15.108 1.666 11.200 583 HZ3 LYS 732 HZ3 LYS 732 -13.604 2.270 10.650 584 H LYS 733 H LYS 733 -12.068 -4.347 5.561 585 HA LYS 733 HA LYS 733 -14.016 -4.954 3.391 586 HB2 LYS 733 HB2 LYS 733 -12.363 -2.824 3.363 587 HB3 LYS 733 HB3 LYS 733 -11.301 -4.031 2.642 588 HG2 LYS 733 HG2 LYS 733 -12.369 -3.354 0.729 589 HG3 LYS 733 HG3 LYS 733 -13.546 -4.559 1.244 590 HD2 LYS 733 HD2 LYS 733 -14.965 -2.765 0.938 591 HD3 LYS 733 HD3 LYS 733 -14.518 -2.486 2.622 592 HE2 LYS 733 HE2 LYS 733 -14.243 -0.386 1.498 593 HE3 LYS 733 HE3 LYS 733 -12.617 -1.029 1.744 594 HZ1 LYS 733 HZ1 LYS 733 -12.289 -1.318 -0.441 595 HZ2 LYS 733 HZ2 LYS 733 -13.885 -1.877 -0.711 596 HZ3 LYS 733 HZ3 LYS 733 -13.580 -0.208 -0.626 597 H ALA 734 H ALA 734 -12.524 -6.020 1.487 598 HA ALA 734 HA ALA 734 -10.510 -7.838 2.227 599 HB1 ALA 734 HB1 ALA 734 -12.360 -9.837 1.816 600 HB2 ALA 734 HB2 ALA 734 -13.247 -8.691 2.820 601 HB3 ALA 734 HB3 ALA 734 -11.712 -9.352 3.382 602 H PHE 735 H PHE 735 -9.467 -8.235 0.377 603 HA PHE 735 HA PHE 735 -11.049 -8.587 -2.111 604 HB2 PHE 735 HB2 PHE 735 -8.472 -7.090 -1.656 605 HB3 PHE 735 HB3 PHE 735 -8.837 -7.786 -3.234 606 HD1 PHE 735 HD2 PHE 735 -10.532 -5.787 -0.547 607 HD2 PHE 735 HD1 PHE 735 -10.014 -6.492 -4.752 608 HE1 PHE 735 HE2 PHE 735 -12.073 -3.905 -1.062 609 HE2 PHE 735 HE1 PHE 735 -11.538 -4.608 -5.267 610 HZ PHE 735 HZ PHE 735 -12.578 -3.322 -3.413 611 H ARG 736 H ARG 736 -10.016 -10.031 -3.716 612 HA ARG 736 HA ARG 736 -8.880 -12.336 -2.356 613 HB2 ARG 736 HB2 ARG 736 -9.947 -11.794 -5.102 614 HB3 ARG 736 HB3 ARG 736 -8.929 -13.211 -4.832 615 HG2 ARG 736 HG2 ARG 736 -10.942 -12.865 -2.742 616 HG3 ARG 736 HG3 ARG 736 -11.660 -13.056 -4.339 617 HD2 ARG 736 HD2 ARG 736 -11.102 -15.242 -4.436 618 HD3 ARG 736 HD3 ARG 736 -9.453 -14.925 -3.911 619 HE ARG 736 HE ARG 736 -11.682 -15.728 -2.234 620 HH11 ARG 736 HH21 ARG 736 -8.587 -14.237 -2.396 621 HH12 ARG 736 HH22 ARG 736 -8.204 -14.501 -0.721 622 HH21 ARG 736 HH11 ARG 736 -11.209 -16.105 -0.077 623 HH22 ARG 736 HH12 ARG 736 -9.707 -15.570 0.599 624 H GLY 737 H GLY 737 -7.716 -9.655 -4.102 625 HA2 GLY 737 HA2 GLY 737 -4.983 -10.552 -3.802 626 HA3 GLY 737 HA3 GLY 737 -5.507 -10.458 -5.478 627 H LEU 738 H LEU 738 -3.586 -8.898 -3.695 628 HA LEU 738 HA LEU 738 -4.226 -6.316 -3.125 629 HB2 LEU 738 HB2 LEU 738 -1.842 -7.754 -3.924 630 HB3 LEU 738 HB3 LEU 738 -1.836 -6.145 -4.632 631 HG LEU 738 HG LEU 738 -0.741 -6.114 -2.451 632 HD11 LEU 738 HD11 LEU 738 -3.369 -4.793 -1.912 633 HD12 LEU 738 HD12 LEU 738 -1.732 -4.176 -1.682 634 HD13 LEU 738 HD13 LEU 738 -2.419 -4.273 -3.303 635 HD21 LEU 738 HD21 LEU 738 -2.407 -8.067 -1.695 636 HD22 LEU 738 HD22 LEU 738 -1.621 -7.004 -0.529 637 HD23 LEU 738 HD23 LEU 738 -3.287 -6.696 -1.018 638 H THR 739 H THR 739 -3.299 -7.545 -6.299 639 HA THR 739 HA THR 739 -3.538 -5.217 -7.791 640 HB THR 739 HB THR 739 -4.172 -7.990 -8.797 641 HG1 THR 739 HG1 THR 739 -1.610 -6.950 -8.910 642 HG21 THR 739 HG21 THR 739 -4.541 -6.224 -10.432 643 HG22 THR 739 HG22 THR 739 -2.968 -5.513 -10.066 644 HG23 THR 739 HG23 THR 739 -3.062 -7.091 -10.848 645 H GLU 740 H GLU 740 -6.099 -7.386 -6.693 646 HA GLU 740 HA GLU 740 -8.029 -6.114 -8.463 647 HB2 GLU 740 HB2 GLU 740 -8.820 -7.848 -6.141 648 HB3 GLU 740 HB3 GLU 740 -9.560 -7.713 -7.737 649 HG2 GLU 740 HG2 GLU 740 -6.910 -9.044 -7.090 650 HG3 GLU 740 HG3 GLU 740 -8.399 -9.853 -7.558 651 H LEU 741 H LEU 741 -6.650 -5.648 -5.403 652 HA LEU 741 HA LEU 741 -8.854 -4.097 -4.307 653 HB2 LEU 741 HB2 LEU 741 -7.562 -5.474 -2.781 654 HB3 LEU 741 HB3 LEU 741 -6.056 -4.739 -3.318 655 HG LEU 741 HG LEU 741 -7.132 -3.922 -1.086 656 HD11 LEU 741 HD11 LEU 741 -5.365 -2.809 -2.825 657 HD12 LEU 741 HD12 LEU 741 -6.621 -1.571 -2.827 658 HD13 LEU 741 HD13 LEU 741 -5.850 -2.043 -1.314 659 HD21 LEU 741 HD21 LEU 741 -9.354 -3.579 -2.503 660 HD22 LEU 741 HD22 LEU 741 -8.937 -2.497 -1.183 661 HD23 LEU 741 HD23 LEU 741 -8.618 -2.015 -2.844 662 H VAL 742 H VAL 742 -5.510 -3.597 -5.265 663 HA VAL 742 HA VAL 742 -5.408 -0.788 -4.998 664 HB VAL 742 HB VAL 742 -3.855 -2.684 -6.770 665 HG11 VAL 742 HG11 VAL 742 -2.223 -0.978 -7.015 666 HG12 VAL 742 HG12 VAL 742 -3.767 -0.200 -7.355 667 HG13 VAL 742 HG13 VAL 742 -2.985 0.038 -5.790 668 HG21 VAL 742 HG21 VAL 742 -2.239 -2.703 -4.958 669 HG22 VAL 742 HG22 VAL 742 -3.202 -1.544 -4.040 670 HG23 VAL 742 HG23 VAL 742 -3.821 -3.173 -4.327 671 H GLU 743 H GLU 743 -5.616 -2.762 -7.904 672 HA GLU 743 HA GLU 743 -5.959 -0.615 -9.684 673 HB2 GLU 743 HB2 GLU 743 -6.755 -3.485 -10.115 674 HB3 GLU 743 HB3 GLU 743 -6.282 -2.306 -11.347 675 HG2 GLU 743 HG2 GLU 743 -4.363 -2.885 -9.108 676 HG3 GLU 743 HG3 GLU 743 -4.528 -4.074 -10.376 677 H PHE 744 H PHE 744 -8.209 -2.270 -7.670 678 HA PHE 744 HA PHE 744 -10.536 -1.529 -9.239 679 HB2 PHE 744 HB2 PHE 744 -10.689 -3.535 -7.947 680 HB3 PHE 744 HB3 PHE 744 -10.159 -2.712 -6.486 681 HD1 PHE 744 HD2 PHE 744 -12.792 -2.152 -9.124 682 HD2 PHE 744 HD1 PHE 744 -11.822 -2.302 -4.949 683 HE1 PHE 744 HE2 PHE 744 -15.141 -1.592 -8.558 684 HE2 PHE 744 HE1 PHE 744 -14.171 -1.746 -4.373 685 HZ PHE 744 HZ PHE 744 -15.831 -1.388 -6.184 686 H TYR 745 H TYR 745 -8.739 -0.359 -6.458 687 HA TYR 745 HA TYR 745 -10.666 1.630 -5.706 688 HB2 TYR 745 HB2 TYR 745 -7.793 1.119 -4.991 689 HB3 TYR 745 HB3 TYR 745 -8.655 2.541 -4.405 690 HD1 TYR 745 HD2 TYR 745 -10.993 -0.065 -4.927 691 HD2 TYR 745 HD1 TYR 745 -7.969 1.253 -2.172 692 HE1 TYR 745 HE2 TYR 745 -12.020 -1.429 -3.147 693 HE2 TYR 745 HE1 TYR 745 -9.009 -0.127 -0.394 694 HH TYR 745 HH TYR 745 -10.676 -2.492 -0.661 695 H GLN 746 H GLN 746 -8.258 1.443 -8.144 696 HA GLN 746 HA GLN 746 -7.431 4.055 -8.505 697 HB2 GLN 746 HB2 GLN 746 -8.244 1.964 -10.525 698 HB3 GLN 746 HB3 GLN 746 -7.587 3.533 -10.998 699 HG2 GLN 746 HG2 GLN 746 -5.501 3.105 -9.963 700 HG3 GLN 746 HG3 GLN 746 -6.154 1.786 -8.991 701 HE21 GLN 746 HE21 GLN 746 -4.114 0.737 -10.126 702 HE22 GLN 746 HE22 GLN 746 -4.434 -0.077 -11.587 703 H GLN 747 H GLN 747 -10.600 2.703 -8.888 704 HA GLN 747 HA GLN 747 -11.622 5.307 -9.855 705 HB2 GLN 747 HB2 GLN 747 -12.905 2.580 -10.156 706 HB3 GLN 747 HB3 GLN 747 -13.486 4.099 -10.840 707 HG2 GLN 747 HG2 GLN 747 -10.783 2.874 -11.476 708 HG3 GLN 747 HG3 GLN 747 -12.214 2.685 -12.484 709 HE21 GLN 747 HE21 GLN 747 -10.033 5.212 -11.131 710 HE22 GLN 747 HE22 GLN 747 -10.325 6.320 -12.385 711 H ASN 748 H ASN 748 -11.144 3.870 -7.073 712 HA ASN 748 HA ASN 748 -13.662 4.885 -5.920 713 HB2 ASN 748 HB2 ASN 748 -13.983 2.476 -6.028 714 HB3 ASN 748 HB3 ASN 748 -12.414 2.200 -5.280 715 HD21 ASN 748 HD21 ASN 748 -14.969 4.563 -4.396 716 HD22 ASN 748 HD22 ASN 748 -15.152 3.998 -2.802 717 H SER 749 H SER 749 -13.060 6.490 -4.642 718 HA SER 749 HA SER 749 -10.584 7.190 -3.752 719 HB2 SER 749 HB2 SER 749 -12.864 8.391 -3.435 720 HB3 SER 749 HB3 SER 749 -12.924 7.519 -1.906 721 HG SER 749 HG SER 749 -10.500 8.712 -2.449 722 H LEU 750 H LEU 750 -9.218 6.707 -2.096 723 HA LEU 750 HA LEU 750 -9.397 4.102 -0.961 724 HB2 LEU 750 HB2 LEU 750 -7.610 6.441 -0.303 725 HB3 LEU 750 HB3 LEU 750 -7.405 4.821 0.358 726 HG LEU 750 HG LEU 750 -7.759 4.704 -2.518 727 HD11 LEU 750 HD11 LEU 750 -6.297 6.220 -3.307 728 HD12 LEU 750 HD12 LEU 750 -6.448 7.008 -1.742 729 HD13 LEU 750 HD13 LEU 750 -5.126 5.880 -2.035 730 HD21 LEU 750 HD21 LEU 750 -5.677 3.413 -2.346 731 HD22 LEU 750 HD22 LEU 750 -5.436 4.001 -0.700 732 HD23 LEU 750 HD23 LEU 750 -6.800 2.945 -1.068 733 H LYS 751 H LYS 751 -10.271 7.292 0.215 734 HA LYS 751 HA LYS 751 -10.504 6.905 2.949 735 HB2 LYS 751 HB2 LYS 751 -12.128 8.651 2.947 736 HB3 LYS 751 HB3 LYS 751 -11.060 9.006 1.590 737 HG2 LYS 751 HG2 LYS 751 -12.773 7.503 0.257 738 HG3 LYS 751 HG3 LYS 751 -13.862 7.954 1.568 739 HD2 LYS 751 HD2 LYS 751 -13.423 10.336 1.114 740 HD3 LYS 751 HD3 LYS 751 -12.320 9.885 -0.189 741 HE2 LYS 751 HE2 LYS 751 -14.894 10.450 -0.662 742 HE3 LYS 751 HE3 LYS 751 -14.018 9.239 -1.598 743 HZ1 LYS 751 HZ1 LYS 751 -16.229 8.501 -0.690 744 HZ2 LYS 751 HZ2 LYS 751 -14.914 7.473 -0.279 745 HZ3 LYS 751 HZ3 LYS 751 -15.547 8.582 0.862 746 H ASP 752 H ASP 752 -12.233 5.423 0.382 747 HA ASP 752 HA ASP 752 -14.565 4.668 1.897 748 HB2 ASP 752 HB2 ASP 752 -13.391 3.612 -0.690 749 HB3 ASP 752 HB3 ASP 752 -14.936 3.092 -0.026 750 H CYS 753 H CYS 753 -11.367 3.511 1.510 751 HA CYS 753 HA CYS 753 -11.952 1.056 3.065 752 HB2 CYS 753 HB2 CYS 753 -9.549 1.458 1.318 753 HB3 CYS 753 HB3 CYS 753 -10.280 -0.046 1.866 754 HG CYS 753 HG CYS 753 -11.797 1.814 -0.138 755 H PHE 754 H PHE 754 -9.500 3.485 2.346 756 HA PHE 754 HA PHE 754 -7.887 2.926 4.619 757 HB2 PHE 754 HB2 PHE 754 -8.098 5.192 2.670 758 HB3 PHE 754 HB3 PHE 754 -7.051 5.331 4.082 759 HD1 PHE 754 HD2 PHE 754 -7.893 2.687 1.551 760 HD2 PHE 754 HD1 PHE 754 -4.824 4.784 3.693 761 HE1 PHE 754 HE2 PHE 754 -6.169 1.338 0.394 762 HE2 PHE 754 HE1 PHE 754 -3.096 3.439 2.536 763 HZ PHE 754 HZ PHE 754 -3.769 1.716 0.888 764 H LYS 755 H LYS 755 -7.495 4.520 6.378 765 HA LYS 755 HA LYS 755 -10.038 5.237 7.562 766 HB2 LYS 755 HB2 LYS 755 -7.511 5.968 8.929 767 HB3 LYS 755 HB3 LYS 755 -8.958 5.191 9.564 768 HG2 LYS 755 HG2 LYS 755 -6.800 3.887 7.875 769 HG3 LYS 755 HG3 LYS 755 -7.136 3.570 9.570 770 HD2 LYS 755 HD2 LYS 755 -9.572 3.017 8.602 771 HD3 LYS 755 HD3 LYS 755 -8.638 2.691 7.141 772 HE2 LYS 755 HE2 LYS 755 -7.582 0.862 8.049 773 HE3 LYS 755 HE3 LYS 755 -7.588 1.535 9.679 774 HZ1 LYS 755 HZ1 LYS 755 -9.101 -0.372 9.484 775 HZ2 LYS 755 HZ2 LYS 755 -9.968 1.083 9.855 776 HZ3 LYS 755 HZ3 LYS 755 -9.979 0.443 8.248 777 H SER 756 H SER 756 -6.992 7.061 7.073 778 HA SER 756 HA SER 756 -8.546 9.552 7.102 779 HB2 SER 756 HB2 SER 756 -6.762 10.282 8.245 780 HB3 SER 756 HB3 SER 756 -5.888 8.796 7.905 781 HG SER 756 HG SER 756 -6.184 10.946 6.065 782 H LEU 757 H LEU 757 -6.552 7.605 4.998 783 HA LEU 757 HA LEU 757 -5.833 9.213 2.931 784 HB2 LEU 757 HB2 LEU 757 -5.829 6.577 3.306 785 HB3 LEU 757 HB3 LEU 757 -7.186 6.676 2.191 786 HG LEU 757 HG LEU 757 -5.259 6.357 0.843 787 HD11 LEU 757 HD11 LEU 757 -6.842 8.184 0.134 788 HD12 LEU 757 HD12 LEU 757 -5.705 9.335 0.837 789 HD13 LEU 757 HD13 LEU 757 -5.206 8.320 -0.509 790 HD21 LEU 757 HD21 LEU 757 -3.211 7.489 1.115 791 HD22 LEU 757 HD22 LEU 757 -3.935 8.715 2.148 792 HD23 LEU 757 HD23 LEU 757 -3.712 7.069 2.755 793 H ASP 758 H ASP 758 -6.889 10.668 1.692 794 HA ASP 758 HA ASP 758 -9.659 10.024 0.908 795 HB2 ASP 758 HB2 ASP 758 -9.231 11.962 2.662 796 HB3 ASP 758 HB3 ASP 758 -8.893 12.888 1.201 797 H THR 759 H THR 759 -8.396 9.089 -0.908 798 HA THR 759 HA THR 759 -8.653 10.765 -3.185 799 HB THR 759 HB THR 759 -6.428 11.587 -2.279 800 HG1 THR 759 HG1 THR 759 -5.830 11.880 -4.298 801 HG21 THR 759 HG21 THR 759 -5.895 8.743 -2.332 802 HG22 THR 759 HG22 THR 759 -4.754 9.598 -3.361 803 HG23 THR 759 HG23 THR 759 -4.911 10.042 -1.664 804 H THR 760 H THR 760 -6.970 9.406 -4.962 805 HA THR 760 HA THR 760 -7.892 6.596 -4.704 806 HB THR 760 HB THR 760 -8.133 6.670 -7.243 807 HG1 THR 760 HG1 THR 760 -8.356 9.444 -6.787 808 HG21 THR 760 HG21 THR 760 -10.083 6.597 -5.827 809 HG22 THR 760 HG22 THR 760 -9.934 8.320 -5.463 810 HG23 THR 760 HG23 THR 760 -10.367 7.794 -7.092 811 H LEU 761 H LEU 761 -6.743 5.150 -6.316 812 HA LEU 761 HA LEU 761 -3.918 5.345 -5.912 813 HB2 LEU 761 HB2 LEU 761 -5.639 3.561 -7.661 814 HB3 LEU 761 HB3 LEU 761 -3.887 3.401 -7.564 815 HG LEU 761 HG LEU 761 -4.919 1.831 -6.006 816 HD11 LEU 761 HD11 LEU 761 -2.884 3.429 -5.397 817 HD12 LEU 761 HD12 LEU 761 -4.005 4.003 -4.167 818 HD13 LEU 761 HD13 LEU 761 -3.543 2.301 -4.215 819 HD21 LEU 761 HD21 LEU 761 -7.027 3.285 -5.765 820 HD22 LEU 761 HD22 LEU 761 -6.451 2.469 -4.311 821 HD23 LEU 761 HD23 LEU 761 -6.125 4.184 -4.544 822 H GLN 762 H GLN 762 -3.630 7.513 -6.743 823 HA GLN 762 HA GLN 762 -4.193 8.302 -9.379 824 HB2 GLN 762 HB2 GLN 762 -2.087 9.267 -7.444 825 HB3 GLN 762 HB3 GLN 762 -2.474 10.070 -8.965 826 HG2 GLN 762 HG2 GLN 762 -4.741 9.417 -7.135 827 HG3 GLN 762 HG3 GLN 762 -3.687 10.750 -6.686 828 HE21 GLN 762 HE21 GLN 762 -6.441 10.010 -8.457 829 HE22 GLN 762 HE22 GLN 762 -6.452 11.364 -9.481 830 H PHE 763 H PHE 763 -0.952 7.498 -8.095 831 HA PHE 763 HA PHE 763 -0.361 6.022 -10.529 832 HB2 PHE 763 HB2 PHE 763 1.880 7.679 -10.383 833 HB3 PHE 763 HB3 PHE 763 0.619 7.720 -11.613 834 HD1 PHE 763 HD1 PHE 763 1.694 9.159 -8.356 835 HD2 PHE 763 HD2 PHE 763 -0.981 9.494 -11.699 836 HE1 PHE 763 HE1 PHE 763 1.008 11.412 -7.580 837 HE2 PHE 763 HE2 PHE 763 -1.664 11.749 -10.925 838 HZ PHE 763 HZ PHE 763 -0.672 12.708 -8.866 839 HA PRO 764 HA PRO 764 2.166 3.772 -7.736 840 HB2 PRO 764 HB2 PRO 764 3.837 2.544 -9.532 841 HB3 PRO 764 HB3 PRO 764 2.152 2.054 -9.266 842 HG2 PRO 764 HG2 PRO 764 3.340 3.636 -11.470 843 HG3 PRO 764 HG3 PRO 764 1.987 2.496 -11.493 844 HD2 PRO 764 HD2 PRO 764 1.707 5.254 -11.508 845 HD3 PRO 764 HD3 PRO 764 0.453 4.115 -10.978 846 H PHE 765 H PHE 765 4.150 3.916 -6.685 847 HA PHE 765 HA PHE 765 5.661 6.277 -7.013 848 HB2 PHE 765 HB2 PHE 765 6.915 5.532 -5.210 849 HB3 PHE 765 HB3 PHE 765 5.427 4.613 -4.996 850 HD1 PHE 765 HD1 PHE 765 5.337 2.284 -6.248 851 HD2 PHE 765 HD2 PHE 765 8.949 4.391 -5.279 852 HE1 PHE 765 HE1 PHE 765 6.611 0.176 -6.428 853 HE2 PHE 765 HE2 PHE 765 10.229 2.274 -5.456 854 HZ PHE 765 HZ PHE 765 9.061 0.165 -6.029 855 H LYS 766 H LYS 766 6.039 3.052 -8.311 856 HA LYS 766 HA LYS 766 8.694 3.186 -9.191 857 HB2 LYS 766 HB2 LYS 766 6.302 1.555 -9.696 858 HB3 LYS 766 HB3 LYS 766 7.540 1.510 -10.943 859 HG2 LYS 766 HG2 LYS 766 8.667 1.380 -8.262 860 HG3 LYS 766 HG3 LYS 766 7.562 0.053 -8.596 861 HD2 LYS 766 HD2 LYS 766 9.840 -0.544 -9.302 862 HD3 LYS 766 HD3 LYS 766 8.783 -0.410 -10.709 863 HE2 LYS 766 HE2 LYS 766 10.270 2.037 -9.802 864 HE3 LYS 766 HE3 LYS 766 11.158 0.790 -10.674 865 HZ1 LYS 766 HZ1 LYS 766 9.233 2.697 -11.669 866 HZ2 LYS 766 HZ2 LYS 766 10.367 1.739 -12.516 867 HZ3 LYS 766 HZ3 LYS 766 8.857 1.087 -12.110 868 H GLU 767 H GLU 767 5.842 4.652 -10.438 869 HA GLU 767 HA GLU 767 6.643 4.794 -13.155 870 HB2 GLU 767 HB2 GLU 767 4.413 5.643 -11.585 871 HB3 GLU 767 HB3 GLU 767 4.990 7.031 -12.502 872 HG2 GLU 767 HG2 GLU 767 5.101 5.240 -14.471 873 HG3 GLU 767 HG3 GLU 767 3.878 4.438 -13.493 874 H1 ASP 338 H1 ASP 338 15.006 2.249 5.902 875 H2 ASP 338 H2 ASP 338 15.550 3.048 7.317 876 H3 ASP 338 H3 ASP 338 14.260 1.932 7.410 877 HA ASP 338 HA ASP 338 16.484 0.664 6.229 878 HB2 ASP 338 HB2 ASP 338 17.975 0.825 8.291 879 HB3 ASP 338 HB3 ASP 338 17.928 2.262 7.270 880 H THR 339 H THR 339 15.919 0.897 9.693 881 HA THR 339 HA THR 339 14.956 -1.870 9.732 882 HB THR 339 HB THR 339 15.307 -0.465 12.289 883 HG1 THR 339 HG1 THR 339 16.910 0.567 10.960 884 HG21 THR 339 HG21 THR 339 15.169 -2.802 12.410 885 HG22 THR 339 HG22 THR 339 16.182 -3.032 10.983 886 HG23 THR 339 HG23 THR 339 16.905 -2.508 12.503 887 H GLU 340 H GLU 340 13.388 0.839 9.184 888 HA GLU 340 HA GLU 340 11.270 0.443 11.197 889 HB2 GLU 340 HB2 GLU 340 10.671 2.638 10.880 890 HB3 GLU 340 HB3 GLU 340 12.378 2.745 10.457 891 HG2 GLU 340 HG2 GLU 340 10.003 2.612 8.590 892 HG3 GLU 340 HG3 GLU 340 11.219 3.876 8.707 893 H VAL 341 H VAL 341 9.009 1.021 10.143 894 HA VAL 341 HA VAL 341 8.593 -0.007 7.478 895 HB VAL 341 HB VAL 341 7.050 -1.859 8.281 896 HG11 VAL 341 HG11 VAL 341 9.859 -2.387 9.208 897 HG12 VAL 341 HG12 VAL 341 8.760 -3.451 8.330 898 HG13 VAL 341 HG13 VAL 341 9.518 -2.091 7.502 899 HG21 VAL 341 HG21 VAL 341 6.726 -1.200 10.582 900 HG22 VAL 341 HG22 VAL 341 7.602 -2.730 10.589 901 HG23 VAL 341 HG23 VAL 341 8.465 -1.221 10.884 902 H TYR 342 H TYR 342 5.829 -0.822 8.238 903 HA TYR 342 HA TYR 342 4.683 1.878 8.516 904 HB2 TYR 342 HB2 TYR 342 2.577 0.327 7.755 905 HB3 TYR 342 HB3 TYR 342 3.630 1.174 6.629 906 HD1 TYR 342 HD2 TYR 342 4.329 -1.892 8.686 907 HD2 TYR 342 HD1 TYR 342 3.781 -0.237 4.752 908 HE1 TYR 342 HE2 TYR 342 5.035 -4.042 7.680 909 HE2 TYR 342 HE1 TYR 342 4.476 -2.390 3.763 910 HH TYR 342 HH TYR 342 4.760 -5.271 5.566 911 H GLU 343 H GLU 343 4.411 2.214 10.679 912 HA GLU 343 HA GLU 343 3.819 0.285 12.618 913 HB2 GLU 343 HB2 GLU 343 3.142 3.239 12.551 914 HB3 GLU 343 HB3 GLU 343 2.998 2.219 13.983 915 HG2 GLU 343 HG2 GLU 343 5.143 3.355 14.068 916 HG3 GLU 343 HG3 GLU 343 5.432 1.647 13.751 917 H SER 344 H SER 344 1.426 2.779 11.894 918 HA SER 344 HA SER 344 -0.612 1.287 10.770 919 HB2 SER 344 HB2 SER 344 -0.421 0.941 13.738 920 HB3 SER 344 HB3 SER 344 -2.009 1.004 12.977 921 HG SER 344 HG SER 344 0.154 -0.675 12.167 922 HA PRO 345 HA PRO 345 -1.124 5.925 11.090 923 HB2 PRO 345 HB2 PRO 345 -2.918 4.877 8.893 924 HB3 PRO 345 HB3 PRO 345 -2.034 6.412 8.962 925 HG2 PRO 345 HG2 PRO 345 -1.088 4.401 7.586 926 HG3 PRO 345 HG3 PRO 345 -0.001 5.406 8.559 927 HD2 PRO 345 HD2 PRO 345 -0.897 2.606 9.046 928 HD3 PRO 345 HD3 PRO 345 0.587 3.426 9.585 929 H PTR 346 H PTR 346 -3.787 3.564 10.535 930 HA PTR 346 HA PTR 346 -5.088 4.312 12.989 931 HB2 PTR 346 HB2 PTR 346 -6.525 5.882 12.287 932 HB3 PTR 346 HB3 PTR 346 -7.071 4.863 10.961 933 HD1 PTR 346 HD1 PTR 346 -5.421 4.701 8.898 934 HD2 PTR 346 HD2 PTR 346 -5.337 7.837 11.824 935 HE1 PTR 346 HE1 PTR 346 -4.154 6.125 7.312 936 HE2 PTR 346 HE2 PTR 346 -4.069 9.268 10.249 937 H ALA 347 H ALA 347 -6.972 3.105 13.449 938 HA ALA 347 HA ALA 347 -7.758 0.848 11.712 939 HB1 ALA 347 HB1 ALA 347 -7.305 -0.814 13.344 940 HB2 ALA 347 HB2 ALA 347 -6.986 0.380 14.603 941 HB3 ALA 347 HB3 ALA 347 -5.831 0.154 13.288 942 H ASP 348 H ASP 348 -9.720 -0.179 12.549 943 HA ASP 348 HA ASP 348 -11.323 1.760 14.120 944 HB2 ASP 348 HB2 ASP 348 -12.307 -0.181 12.034 945 HB3 ASP 348 HB3 ASP 348 -13.216 1.126 12.789 946 HA PRO 349 HA PRO 349 -11.656 -1.777 16.868 947 HB2 PRO 349 HB2 PRO 349 -12.747 -0.443 18.953 948 HB3 PRO 349 HB3 PRO 349 -11.036 -0.276 18.515 949 HG2 PRO 349 HG2 PRO 349 -13.314 1.559 17.991 950 HG3 PRO 349 HG3 PRO 349 -11.635 1.932 18.413 951 HD2 PRO 349 HD2 PRO 349 -12.670 2.041 15.836 952 HD3 PRO 349 HD3 PRO 349 -10.944 1.880 16.230 953 H GLU 350 H GLU 350 -13.530 -2.470 18.469 954 HA GLU 350 HA GLU 350 -15.852 -2.943 16.817 955 HB2 GLU 350 HB2 GLU 350 -16.628 -4.237 18.829 956 HB3 GLU 350 HB3 GLU 350 -15.060 -4.742 18.205 957 HG2 GLU 350 HG2 GLU 350 -15.099 -2.624 20.314 958 HG3 GLU 350 HG3 GLU 350 -15.433 -4.281 20.808 Start of MODEL 2 1 H1 GLY 661 H1 GLY 661 3.067 -22.474 -5.502 2 H2 GLY 661 H2 GLY 661 1.590 -21.726 -5.892 3 H3 GLY 661 H3 GLY 661 1.628 -23.374 -5.473 4 HA2 GLY 661 HA2 GLY 661 1.085 -22.707 -3.421 5 HA3 GLY 661 HA3 GLY 661 2.776 -22.211 -3.312 6 H HIS 662 H HIS 662 1.751 -20.601 -1.786 7 HA HIS 662 HA HIS 662 0.060 -18.524 -2.681 8 HB2 HIS 662 HB2 HIS 662 1.633 -19.144 -0.317 9 HB3 HIS 662 HB3 HIS 662 1.726 -17.428 -0.705 10 HD1 HIS 662 HD1 HIS 662 -0.032 -16.149 0.451 11 HD2 HIS 662 HD2 HIS 662 -1.382 -19.953 -0.626 12 HE1 HIS 662 HE1 HIS 662 -2.434 -16.325 1.260 13 HE2 HIS 662 HE2 HIS 662 -3.274 -18.632 0.606 14 H MET 663 H MET 663 3.577 -18.384 -2.087 15 HA MET 663 HA MET 663 5.248 -17.159 -3.061 16 HB2 MET 663 HB2 MET 663 3.472 -16.772 -5.455 17 HB3 MET 663 HB3 MET 663 5.229 -16.890 -5.400 18 HG2 MET 663 HG2 MET 663 3.201 -19.097 -5.024 19 HG3 MET 663 HG3 MET 663 4.497 -18.999 -6.212 20 HE1 MET 663 HE1 MET 663 7.101 -18.351 -5.041 21 HE2 MET 663 HE2 MET 663 7.649 -19.956 -4.559 22 HE3 MET 663 HE3 MET 663 6.683 -19.750 -6.027 23 H GLN 664 H GLN 664 2.218 -15.683 -4.107 24 HA GLN 664 HA GLN 664 1.448 -13.509 -4.045 25 HB2 GLN 664 HB2 GLN 664 3.090 -13.663 -1.522 26 HB3 GLN 664 HB3 GLN 664 2.241 -12.185 -1.976 27 HG2 GLN 664 HG2 GLN 664 0.139 -13.148 -1.728 28 HG3 GLN 664 HG3 GLN 664 0.733 -14.776 -2.039 29 HE21 GLN 664 HE21 GLN 664 1.565 -12.228 0.381 30 HE22 GLN 664 HE22 GLN 664 1.466 -13.271 1.721 31 H ASP 665 H ASP 665 3.685 -14.004 -5.722 32 HA ASP 665 HA ASP 665 5.739 -12.070 -5.457 33 HB2 ASP 665 HB2 ASP 665 4.932 -12.893 -8.176 34 HB3 ASP 665 HB3 ASP 665 6.516 -12.923 -7.412 35 H LEU 666 H LEU 666 3.680 -10.617 -4.804 36 HA LEU 666 HA LEU 666 2.248 -9.214 -6.768 37 HB2 LEU 666 HB2 LEU 666 3.260 -8.136 -4.125 38 HB3 LEU 666 HB3 LEU 666 1.911 -7.501 -5.065 39 HG LEU 666 HG LEU 666 1.893 -10.387 -4.221 40 HD11 LEU 666 HD11 LEU 666 2.357 -9.234 -2.146 41 HD12 LEU 666 HD12 LEU 666 1.151 -8.000 -2.513 42 HD13 LEU 666 HD13 LEU 666 0.642 -9.652 -2.168 43 HD21 LEU 666 HD21 LEU 666 -0.094 -8.273 -5.018 44 HD22 LEU 666 HD22 LEU 666 0.089 -9.916 -5.634 45 HD23 LEU 666 HD23 LEU 666 -0.623 -9.645 -4.043 46 H SER 667 H SER 667 5.580 -9.179 -6.060 47 HA SER 667 HA SER 667 6.428 -6.602 -6.615 48 HB2 SER 667 HB2 SER 667 8.541 -7.572 -7.280 49 HB3 SER 667 HB3 SER 667 7.898 -8.502 -5.932 50 HG SER 667 HG SER 667 8.107 -9.171 -8.655 51 H VAL 668 H VAL 668 4.945 -8.878 -8.721 52 HA VAL 668 HA VAL 668 5.926 -7.946 -11.210 53 HB VAL 668 HB VAL 668 3.963 -9.088 -12.174 54 HG11 VAL 668 HG11 VAL 668 5.755 -10.557 -11.706 55 HG12 VAL 668 HG12 VAL 668 5.522 -10.424 -9.963 56 HG13 VAL 668 HG13 VAL 668 4.369 -11.333 -10.939 57 HG21 VAL 668 HG21 VAL 668 2.059 -9.428 -10.989 58 HG22 VAL 668 HG22 VAL 668 2.951 -10.173 -9.663 59 HG23 VAL 668 HG23 VAL 668 2.760 -8.421 -9.722 60 H HIS 669 H HIS 669 3.811 -6.487 -8.947 61 HA HIS 669 HA HIS 669 2.423 -4.882 -10.964 62 HB2 HIS 669 HB2 HIS 669 2.281 -4.576 -7.964 63 HB3 HIS 669 HB3 HIS 669 1.126 -4.012 -9.169 64 HD1 HIS 669 HD1 HIS 669 0.272 -6.188 -10.797 65 HD2 HIS 669 HD2 HIS 669 1.417 -6.951 -6.869 66 HE1 HIS 669 HE1 HIS 669 -0.745 -8.427 -10.180 67 HE2 HIS 669 HE2 HIS 669 -0.056 -8.907 -7.783 68 H LEU 670 H LEU 670 3.101 -2.982 -11.666 69 HA LEU 670 HA LEU 670 5.540 -1.837 -11.171 70 HB2 LEU 670 HB2 LEU 670 4.162 -1.188 -13.068 71 HB3 LEU 670 HB3 LEU 670 2.976 -0.453 -11.992 72 HG LEU 670 HG LEU 670 4.738 1.137 -11.200 73 HD11 LEU 670 HD11 LEU 670 6.784 1.315 -12.678 74 HD12 LEU 670 HD12 LEU 670 6.752 -0.109 -11.632 75 HD13 LEU 670 HD13 LEU 670 6.354 -0.261 -13.345 76 HD21 LEU 670 HD21 LEU 670 4.703 2.537 -13.162 77 HD22 LEU 670 HD22 LEU 670 4.461 1.144 -14.215 78 HD23 LEU 670 HD23 LEU 670 3.178 1.651 -13.118 79 H TRP 671 H TRP 671 2.565 -1.359 -9.309 80 HA TRP 671 HA TRP 671 3.755 0.797 -7.778 81 HB2 TRP 671 HB2 TRP 671 1.612 0.204 -6.294 82 HB3 TRP 671 HB3 TRP 671 1.515 1.196 -7.742 83 HD1 TRP 671 HD1 TRP 671 0.417 0.139 -9.899 84 HE1 TRP 671 HE1 TRP 671 -1.093 -1.925 -10.233 85 HE3 TRP 671 HE3 TRP 671 1.170 -2.239 -5.447 86 HZ2 TRP 671 HZ2 TRP 671 -1.878 -4.274 -8.800 87 HZ3 TRP 671 HZ3 TRP 671 0.030 -4.384 -4.955 88 HH2 TRP 671 HH2 TRP 671 -1.491 -5.404 -6.627 89 H TYR 672 H TYR 672 4.388 -2.398 -7.800 90 HA TYR 672 HA TYR 672 4.503 -2.694 -4.890 91 HB2 TYR 672 HB2 TYR 672 3.924 -4.522 -6.768 92 HB3 TYR 672 HB3 TYR 672 5.666 -4.779 -6.647 93 HD1 TYR 672 HD2 TYR 672 2.480 -4.750 -4.768 94 HD2 TYR 672 HD1 TYR 672 6.671 -5.654 -4.640 95 HE1 TYR 672 HE2 TYR 672 2.164 -5.910 -2.599 96 HE2 TYR 672 HE1 TYR 672 6.359 -6.797 -2.473 97 HH TYR 672 HH TYR 672 4.074 -6.390 -0.490 98 H ALA 673 H ALA 673 6.178 -2.030 -3.783 99 HA ALA 673 HA ALA 673 8.729 -1.509 -5.134 100 HB1 ALA 673 HB1 ALA 673 7.591 0.144 -3.577 101 HB2 ALA 673 HB2 ALA 673 9.285 -0.197 -3.228 102 HB3 ALA 673 HB3 ALA 673 8.014 -0.946 -2.259 103 H GLY 674 H GLY 674 7.343 -4.091 -3.679 104 HA2 GLY 674 HA2 GLY 674 8.124 -6.096 -2.887 105 HA3 GLY 674 HA3 GLY 674 9.680 -5.637 -3.541 106 HA PRO 675 HA PRO 675 10.863 -5.856 0.759 107 HB2 PRO 675 HB2 PRO 675 13.490 -5.233 0.393 108 HB3 PRO 675 HB3 PRO 675 12.807 -6.820 -0.016 109 HG2 PRO 675 HG2 PRO 675 13.402 -4.500 -1.802 110 HG3 PRO 675 HG3 PRO 675 13.704 -6.229 -2.061 111 HD2 PRO 675 HD2 PRO 675 11.566 -4.944 -3.178 112 HD3 PRO 675 HD3 PRO 675 11.513 -6.658 -2.699 113 H MET 676 H MET 676 10.527 -3.067 -1.035 114 HA MET 676 HA MET 676 12.009 -1.123 0.308 115 HB2 MET 676 HB2 MET 676 10.519 -0.902 -1.782 116 HB3 MET 676 HB3 MET 676 9.195 -0.621 -0.653 117 HG2 MET 676 HG2 MET 676 9.893 1.481 -0.205 118 HG3 MET 676 HG3 MET 676 11.563 0.965 0.014 119 HE1 MET 676 HE1 MET 676 13.327 0.649 -2.181 120 HE2 MET 676 HE2 MET 676 13.359 2.302 -2.784 121 HE3 MET 676 HE3 MET 676 13.156 1.992 -1.054 122 H GLU 677 H GLU 677 11.490 0.376 1.915 123 HA GLU 677 HA GLU 677 9.634 -0.631 3.978 124 HB2 GLU 677 HB2 GLU 677 11.078 0.672 5.560 125 HB3 GLU 677 HB3 GLU 677 11.925 -0.652 4.752 126 HG2 GLU 677 HG2 GLU 677 13.346 0.772 3.719 127 HG3 GLU 677 HG3 GLU 677 12.027 1.814 3.195 128 H ARG 678 H ARG 678 9.057 1.260 5.544 129 HA ARG 678 HA ARG 678 7.286 2.972 4.236 130 HB2 ARG 678 HB2 ARG 678 7.298 2.324 6.691 131 HB3 ARG 678 HB3 ARG 678 8.552 3.541 6.922 132 HG2 ARG 678 HG2 ARG 678 6.674 4.925 5.465 133 HG3 ARG 678 HG3 ARG 678 5.663 3.888 6.466 134 HD2 ARG 678 HD2 ARG 678 6.937 4.689 8.473 135 HD3 ARG 678 HD3 ARG 678 7.810 5.799 7.423 136 HE ARG 678 HE ARG 678 5.800 7.034 7.069 137 HH11 ARG 678 HH21 ARG 678 5.438 4.353 9.287 138 HH12 ARG 678 HH22 ARG 678 3.880 4.903 9.871 139 HH21 ARG 678 HH11 ARG 678 3.845 7.734 7.910 140 HH22 ARG 678 HH12 ARG 678 3.034 6.814 9.136 141 H ALA 679 H ALA 679 10.155 4.090 6.026 142 HA ALA 679 HA ALA 679 10.326 6.658 5.036 143 HB1 ALA 679 HB1 ALA 679 12.329 6.737 6.103 144 HB2 ALA 679 HB2 ALA 679 12.937 5.303 5.276 145 HB3 ALA 679 HB3 ALA 679 11.886 5.131 6.681 146 H GLY 680 H GLY 680 11.450 3.659 3.608 147 HA2 GLY 680 HA2 GLY 680 12.798 4.806 1.388 148 HA3 GLY 680 HA3 GLY 680 12.186 3.153 1.473 149 H ALA 681 H ALA 681 9.554 3.395 1.779 150 HA ALA 681 HA ALA 681 8.567 4.046 -0.775 151 HB1 ALA 681 HB1 ALA 681 7.223 3.657 1.902 152 HB2 ALA 681 HB2 ALA 681 7.313 2.518 0.560 153 HB3 ALA 681 HB3 ALA 681 6.311 3.962 0.426 154 H GLU 682 H GLU 682 8.533 5.829 2.298 155 HA GLU 682 HA GLU 682 7.083 8.086 1.408 156 HB2 GLU 682 HB2 GLU 682 9.327 8.302 3.402 157 HB3 GLU 682 HB3 GLU 682 7.805 9.195 3.358 158 HG2 GLU 682 HG2 GLU 682 6.821 6.711 3.639 159 HG3 GLU 682 HG3 GLU 682 8.374 6.473 4.409 160 H SER 683 H SER 683 10.518 7.310 1.426 161 HA SER 683 HA SER 683 11.633 9.696 0.667 162 HB2 SER 683 HB2 SER 683 12.374 6.907 -0.185 163 HB3 SER 683 HB3 SER 683 13.400 8.316 -0.424 164 HG SER 683 HG SER 683 12.400 7.282 2.044 165 H ILE 684 H ILE 684 10.288 7.196 -1.464 166 HA ILE 684 HA ILE 684 10.674 8.835 -3.829 167 HB ILE 684 HB ILE 684 8.890 6.407 -3.652 168 HG12 ILE 684 HG12 ILE 684 11.413 5.588 -4.573 169 HG13 ILE 684 HG13 ILE 684 11.753 6.566 -3.146 170 HG21 ILE 684 HG21 ILE 684 10.723 7.056 -5.923 171 HG22 ILE 684 HG22 ILE 684 9.122 6.321 -5.951 172 HG23 ILE 684 HG23 ILE 684 9.290 8.060 -5.716 173 HD11 ILE 684 HD11 ILE 684 9.804 5.213 -2.059 174 HD12 ILE 684 HD12 ILE 684 10.100 4.064 -3.364 175 HD13 ILE 684 HD13 ILE 684 11.385 4.448 -2.219 176 H LEU 685 H LEU 685 7.876 7.639 -1.978 177 HA LEU 685 HA LEU 685 5.893 8.992 -3.419 178 HB2 LEU 685 HB2 LEU 685 6.003 8.101 -0.536 179 HB3 LEU 685 HB3 LEU 685 4.549 8.754 -1.291 180 HG LEU 685 HG LEU 685 6.093 6.314 -2.230 181 HD11 LEU 685 HD11 LEU 685 4.832 5.889 -0.180 182 HD12 LEU 685 HD12 LEU 685 3.391 6.618 -0.890 183 HD13 LEU 685 HD13 LEU 685 4.030 5.111 -1.543 184 HD21 LEU 685 HD21 LEU 685 5.132 7.243 -4.176 185 HD22 LEU 685 HD22 LEU 685 3.917 6.083 -3.635 186 HD23 LEU 685 HD23 LEU 685 3.701 7.802 -3.308 187 H ALA 686 H ALA 686 7.733 10.056 -0.531 188 HA ALA 686 HA ALA 686 6.420 12.493 -0.115 189 HB1 ALA 686 HB1 ALA 686 8.492 13.228 0.984 190 HB2 ALA 686 HB2 ALA 686 9.365 11.882 0.251 191 HB3 ALA 686 HB3 ALA 686 8.098 11.570 1.437 192 H ASN 687 H ASN 687 9.046 11.667 -2.346 193 HA ASN 687 HA ASN 687 9.318 14.377 -3.313 194 HB2 ASN 687 HB2 ASN 687 11.145 12.581 -3.276 195 HB3 ASN 687 HB3 ASN 687 10.340 11.890 -4.683 196 HD21 ASN 687 HD21 ASN 687 9.512 14.564 -5.757 197 HD22 ASN 687 HD22 ASN 687 10.945 15.270 -6.344 198 H ARG 688 H ARG 688 7.505 11.518 -4.225 199 HA ARG 688 HA ARG 688 6.849 12.411 -6.862 200 HB2 ARG 688 HB2 ARG 688 6.544 10.045 -5.394 201 HB3 ARG 688 HB3 ARG 688 4.902 10.592 -5.723 202 HG2 ARG 688 HG2 ARG 688 5.566 9.238 -7.597 203 HG3 ARG 688 HG3 ARG 688 5.602 10.912 -8.143 204 HD2 ARG 688 HD2 ARG 688 8.120 10.781 -7.329 205 HD3 ARG 688 HD3 ARG 688 7.882 9.054 -7.566 206 HE ARG 688 HE ARG 688 7.691 11.127 -9.666 207 HH11 ARG 688 HH21 ARG 688 7.841 7.793 -8.715 208 HH12 ARG 688 HH22 ARG 688 8.051 7.218 -10.347 209 HH21 ARG 688 HH11 ARG 688 7.876 10.337 -11.761 210 HH22 ARG 688 HH12 ARG 688 7.973 8.622 -12.049 211 H SER 689 H SER 689 4.436 12.616 -7.457 212 HA SER 689 HA SER 689 3.464 14.928 -6.056 213 HB2 SER 689 HB2 SER 689 3.300 14.140 -8.637 214 HB3 SER 689 HB3 SER 689 1.709 13.645 -8.061 215 HG SER 689 HG SER 689 1.984 15.904 -8.831 216 H ASP 690 H ASP 690 1.239 15.193 -5.373 217 HA ASP 690 HA ASP 690 0.464 13.407 -3.370 218 HB2 ASP 690 HB2 ASP 690 -0.459 15.892 -4.476 219 HB3 ASP 690 HB3 ASP 690 -1.835 14.826 -4.216 220 H GLY 691 H GLY 691 -0.522 11.488 -3.434 221 HA2 GLY 691 HA2 GLY 691 -2.469 10.195 -4.180 222 HA3 GLY 691 HA3 GLY 691 -2.219 10.857 -5.790 223 H THR 692 H THR 692 0.772 10.525 -5.302 224 HA THR 692 HA THR 692 1.174 8.128 -6.697 225 HB THR 692 HB THR 692 3.168 9.334 -4.770 226 HG1 THR 692 HG1 THR 692 2.495 11.042 -5.995 227 HG21 THR 692 HG21 THR 692 3.775 8.223 -7.482 228 HG22 THR 692 HG22 THR 692 4.779 8.248 -6.032 229 HG23 THR 692 HG23 THR 692 3.450 7.099 -6.165 230 H PHE 693 H PHE 693 1.407 6.001 -6.070 231 HA PHE 693 HA PHE 693 1.521 5.456 -3.172 232 HB2 PHE 693 HB2 PHE 693 -0.344 3.990 -3.222 233 HB3 PHE 693 HB3 PHE 693 -0.862 5.450 -4.064 234 HD1 PHE 693 HD1 PHE 693 -0.889 5.503 -6.579 235 HD2 PHE 693 HD2 PHE 693 -0.171 1.894 -4.361 236 HE1 PHE 693 HE1 PHE 693 -1.390 4.160 -8.602 237 HE2 PHE 693 HE2 PHE 693 -0.673 0.553 -6.385 238 HZ PHE 693 HZ PHE 693 -1.281 1.686 -8.505 239 H LEU 694 H LEU 694 1.831 3.119 -2.685 240 HA LEU 694 HA LEU 694 2.911 1.385 -4.697 241 HB2 LEU 694 HB2 LEU 694 5.208 1.308 -3.987 242 HB3 LEU 694 HB3 LEU 694 4.807 2.976 -4.362 243 HG LEU 694 HG LEU 694 4.155 2.970 -1.760 244 HD11 LEU 694 HD11 LEU 694 6.645 1.418 -1.478 245 HD12 LEU 694 HD12 LEU 694 5.179 1.379 -0.499 246 HD13 LEU 694 HD13 LEU 694 5.260 0.461 -2.001 247 HD21 LEU 694 HD21 LEU 694 6.037 4.288 -1.463 248 HD22 LEU 694 HD22 LEU 694 7.077 3.194 -2.370 249 HD23 LEU 694 HD23 LEU 694 5.963 4.262 -3.216 250 H VAL 695 H VAL 695 3.835 -0.602 -3.738 251 HA VAL 695 HA VAL 695 2.892 -1.154 -0.996 252 HB VAL 695 HB VAL 695 2.355 -3.137 -3.198 253 HG11 VAL 695 HG11 VAL 695 0.539 -3.674 -1.383 254 HG12 VAL 695 HG12 VAL 695 2.206 -4.169 -1.087 255 HG13 VAL 695 HG13 VAL 695 1.569 -2.716 -0.314 256 HG21 VAL 695 HG21 VAL 695 1.141 -1.070 -3.780 257 HG22 VAL 695 HG22 VAL 695 0.011 -2.288 -3.189 258 HG23 VAL 695 HG23 VAL 695 0.514 -0.965 -2.138 259 H ARG 696 H ARG 696 4.007 -2.801 0.098 260 HA ARG 696 HA ARG 696 6.502 -3.678 -1.245 261 HB2 ARG 696 HB2 ARG 696 7.707 -3.253 0.724 262 HB3 ARG 696 HB3 ARG 696 6.607 -1.881 0.596 263 HG2 ARG 696 HG2 ARG 696 6.170 -2.446 2.784 264 HG3 ARG 696 HG3 ARG 696 5.025 -3.544 2.014 265 HD2 ARG 696 HD2 ARG 696 6.857 -5.283 1.990 266 HD3 ARG 696 HD3 ARG 696 7.826 -4.193 2.952 267 HE ARG 696 HE ARG 696 6.431 -4.628 4.813 268 HH11 ARG 696 HH21 ARG 696 4.997 -5.898 1.909 269 HH12 ARG 696 HH22 ARG 696 4.098 -7.111 2.763 270 HH21 ARG 696 HH11 ARG 696 5.213 -6.216 5.873 271 HH22 ARG 696 HH12 ARG 696 4.208 -7.281 4.916 272 H GLN 697 H GLN 697 7.517 -5.596 -0.433 273 HA GLN 697 HA GLN 697 5.624 -7.596 0.678 274 HB2 GLN 697 HB2 GLN 697 6.174 -8.393 -1.476 275 HB3 GLN 697 HB3 GLN 697 7.850 -7.863 -1.344 276 HG2 GLN 697 HG2 GLN 697 7.160 -9.744 0.777 277 HG3 GLN 697 HG3 GLN 697 6.864 -10.433 -0.817 278 HE21 GLN 697 HE21 GLN 697 9.238 -10.211 1.479 279 HE22 GLN 697 HE22 GLN 697 10.603 -10.312 0.467 280 H ARG 698 H ARG 698 9.159 -7.537 0.287 281 HA ARG 698 HA ARG 698 10.857 -7.947 1.794 282 HB2 ARG 698 HB2 ARG 698 9.671 -5.634 2.439 283 HB3 ARG 698 HB3 ARG 698 9.353 -6.522 3.928 284 HG2 ARG 698 HG2 ARG 698 11.970 -7.157 3.551 285 HG3 ARG 698 HG3 ARG 698 11.935 -5.564 2.806 286 HD2 ARG 698 HD2 ARG 698 11.767 -6.301 5.636 287 HD3 ARG 698 HD3 ARG 698 12.198 -4.760 4.906 288 HE ARG 698 HE ARG 698 9.684 -5.403 6.046 289 HH11 ARG 698 HH21 ARG 698 11.049 -3.906 3.244 290 HH12 ARG 698 HH22 ARG 698 9.721 -2.804 3.018 291 HH21 ARG 698 HH11 ARG 698 7.954 -3.974 5.753 292 HH22 ARG 698 HH12 ARG 698 8.016 -2.824 4.455 293 H VAL 699 H VAL 699 10.650 -8.029 4.651 294 HA VAL 699 HA VAL 699 10.703 -9.739 6.198 295 HB VAL 699 HB VAL 699 8.440 -10.347 6.961 296 HG11 VAL 699 HG11 VAL 699 7.680 -8.094 7.419 297 HG12 VAL 699 HG12 VAL 699 9.443 -8.106 7.447 298 HG13 VAL 699 HG13 VAL 699 8.590 -7.468 6.043 299 HG21 VAL 699 HG21 VAL 699 6.479 -9.701 5.719 300 HG22 VAL 699 HG22 VAL 699 7.450 -8.842 4.527 301 HG23 VAL 699 HG23 VAL 699 7.511 -10.600 4.609 302 H LYS 700 H LYS 700 8.788 -11.955 6.328 303 HA LYS 700 HA LYS 700 9.404 -13.573 3.978 304 HB2 LYS 700 HB2 LYS 700 11.374 -13.703 5.608 305 HB3 LYS 700 HB3 LYS 700 10.285 -14.564 6.693 306 HG2 LYS 700 HG2 LYS 700 9.908 -15.843 4.242 307 HG3 LYS 700 HG3 LYS 700 11.638 -15.517 4.274 308 HD2 LYS 700 HD2 LYS 700 11.373 -17.640 5.345 309 HD3 LYS 700 HD3 LYS 700 11.642 -16.481 6.646 310 HE2 LYS 700 HE2 LYS 700 9.745 -18.064 7.111 311 HE3 LYS 700 HE3 LYS 700 9.258 -16.368 7.118 312 HZ1 LYS 700 HZ1 LYS 700 8.153 -16.556 5.135 313 HZ2 LYS 700 HZ2 LYS 700 9.110 -17.868 4.599 314 HZ3 LYS 700 HZ3 LYS 700 7.906 -18.126 5.767 315 H ASP 701 H ASP 701 7.407 -12.739 6.546 316 HA ASP 701 HA ASP 701 6.038 -15.223 6.960 317 HB2 ASP 701 HB2 ASP 701 4.289 -13.711 7.974 318 HB3 ASP 701 HB3 ASP 701 5.904 -13.519 8.659 319 H ALA 702 H ALA 702 5.905 -12.693 4.609 320 HA ALA 702 HA ALA 702 4.608 -12.351 2.744 321 HB1 ALA 702 HB1 ALA 702 4.066 -14.237 1.497 322 HB2 ALA 702 HB2 ALA 702 3.603 -15.173 2.919 323 HB3 ALA 702 HB3 ALA 702 5.308 -14.886 2.568 324 H ALA 703 H ALA 703 3.511 -12.217 5.574 325 HA ALA 703 HA ALA 703 0.633 -12.387 4.897 326 HB1 ALA 703 HB1 ALA 703 1.784 -12.376 7.690 327 HB2 ALA 703 HB2 ALA 703 1.535 -13.866 6.779 328 HB3 ALA 703 HB3 ALA 703 0.159 -12.838 7.180 329 H GLU 704 H GLU 704 3.140 -10.485 6.572 330 HA GLU 704 HA GLU 704 1.396 -8.280 7.164 331 HB2 GLU 704 HB2 GLU 704 3.705 -8.870 8.216 332 HB3 GLU 704 HB3 GLU 704 4.380 -8.002 6.839 333 HG2 GLU 704 HG2 GLU 704 2.295 -6.359 7.799 334 HG3 GLU 704 HG3 GLU 704 3.108 -6.944 9.240 335 H PHE 705 H PHE 705 0.671 -6.722 5.833 336 HA PHE 705 HA PHE 705 2.286 -5.920 3.527 337 HB2 PHE 705 HB2 PHE 705 -0.526 -7.005 3.293 338 HB3 PHE 705 HB3 PHE 705 0.217 -5.992 2.056 339 HD1 PHE 705 HD1 PHE 705 2.532 -6.734 1.151 340 HD2 PHE 705 HD2 PHE 705 -0.128 -9.321 3.315 341 HE1 PHE 705 HE1 PHE 705 3.715 -8.715 0.237 342 HE2 PHE 705 HE2 PHE 705 1.050 -11.295 2.399 343 HZ PHE 705 HZ PHE 705 2.976 -10.994 0.863 344 H ALA 706 H ALA 706 1.736 -3.871 2.682 345 HA ALA 706 HA ALA 706 -0.380 -2.292 3.825 346 HB1 ALA 706 HB1 ALA 706 0.706 -1.322 5.532 347 HB2 ALA 706 HB2 ALA 706 1.991 -0.805 4.448 348 HB3 ALA 706 HB3 ALA 706 2.085 -2.379 5.238 349 H ILE 707 H ILE 707 -0.838 -0.552 2.573 350 HA ILE 707 HA ILE 707 0.846 -0.164 0.182 351 HB ILE 707 HB ILE 707 -1.979 0.795 0.724 352 HG12 ILE 707 HG12 ILE 707 -0.999 -1.522 -0.977 353 HG13 ILE 707 HG13 ILE 707 -1.752 -1.690 0.606 354 HG21 ILE 707 HG21 ILE 707 -0.126 0.892 -1.660 355 HG22 ILE 707 HG22 ILE 707 -1.875 0.947 -1.863 356 HG23 ILE 707 HG23 ILE 707 -1.057 2.203 -0.936 357 HD11 ILE 707 HD11 ILE 707 -3.769 -0.511 -0.268 358 HD12 ILE 707 HD12 ILE 707 -3.020 -0.476 -1.864 359 HD13 ILE 707 HD13 ILE 707 -3.440 -2.018 -1.122 360 H SER 708 H SER 708 1.943 1.683 -0.151 361 HA SER 708 HA SER 708 1.608 3.839 1.855 362 HB2 SER 708 HB2 SER 708 3.968 3.253 0.055 363 HB3 SER 708 HB3 SER 708 3.887 4.523 1.269 364 HG SER 708 HG SER 708 3.770 1.704 1.655 365 H ILE 709 H ILE 709 0.579 5.627 1.188 366 HA ILE 709 HA ILE 709 0.734 6.305 -1.692 367 HB ILE 709 HB ILE 709 -1.682 6.923 -0.011 368 HG12 ILE 709 HG12 ILE 709 -2.434 4.778 -1.546 369 HG13 ILE 709 HG13 ILE 709 -0.797 4.316 -1.087 370 HG21 ILE 709 HG21 ILE 709 -0.853 7.167 -2.829 371 HG22 ILE 709 HG22 ILE 709 -2.440 6.428 -2.624 372 HG23 ILE 709 HG23 ILE 709 -2.117 8.026 -1.952 373 HD11 ILE 709 HD11 ILE 709 -3.193 4.779 0.648 374 HD12 ILE 709 HD12 ILE 709 -1.981 3.499 0.732 375 HD13 ILE 709 HD13 ILE 709 -1.595 5.119 1.311 376 H LYS 710 H LYS 710 1.016 8.356 -2.269 377 HA LYS 710 HA LYS 710 1.985 10.235 -0.280 378 HB2 LYS 710 HB2 LYS 710 3.096 10.116 -2.443 379 HB3 LYS 710 HB3 LYS 710 1.585 10.452 -3.277 380 HG2 LYS 710 HG2 LYS 710 2.822 12.519 -3.189 381 HG3 LYS 710 HG3 LYS 710 1.494 12.656 -2.040 382 HD2 LYS 710 HD2 LYS 710 2.889 12.463 -0.189 383 HD3 LYS 710 HD3 LYS 710 4.145 11.622 -1.091 384 HE2 LYS 710 HE2 LYS 710 3.417 14.469 -1.756 385 HE3 LYS 710 HE3 LYS 710 4.546 14.109 -0.448 386 HZ1 LYS 710 HZ1 LYS 710 5.465 12.514 -2.396 387 HZ2 LYS 710 HZ2 LYS 710 4.914 13.838 -3.327 388 HZ3 LYS 710 HZ3 LYS 710 6.071 14.087 -2.084 389 H TYR 711 H TYR 711 0.695 11.557 0.834 390 HA TYR 711 HA TYR 711 -1.688 12.687 -0.496 391 HB2 TYR 711 HB2 TYR 711 -2.078 10.614 1.115 392 HB3 TYR 711 HB3 TYR 711 -1.931 11.850 2.364 393 HD1 TYR 711 HD2 TYR 711 -3.209 14.164 1.621 394 HD2 TYR 711 HD1 TYR 711 -4.243 10.180 0.417 395 HE1 TYR 711 HE2 TYR 711 -5.520 14.915 1.134 396 HE2 TYR 711 HE1 TYR 711 -6.556 10.931 -0.077 397 HH TYR 711 HH TYR 711 -7.867 12.812 -0.427 398 H ASN 712 H ASN 712 -1.444 14.814 -0.453 399 HA ASN 712 HA ASN 712 -0.892 16.932 0.237 400 HB2 ASN 712 HB2 ASN 712 -1.710 15.607 2.812 401 HB3 ASN 712 HB3 ASN 712 -1.156 17.279 2.797 402 HD21 ASN 712 HD21 ASN 712 -2.914 15.894 0.058 403 HD22 ASN 712 HD22 ASN 712 -4.331 16.799 0.299 404 H VAL 713 H VAL 713 1.287 16.140 -0.526 405 HA VAL 713 HA VAL 713 3.565 15.937 -0.279 406 HB VAL 713 HB VAL 713 4.611 17.737 0.868 407 HG11 VAL 713 HG11 VAL 713 2.707 18.155 -0.972 408 HG12 VAL 713 HG12 VAL 713 1.966 19.028 0.370 409 HG13 VAL 713 HG13 VAL 713 3.568 19.488 -0.204 410 HG21 VAL 713 HG21 VAL 713 3.670 18.950 2.685 411 HG22 VAL 713 HG22 VAL 713 2.061 18.292 2.398 412 HG23 VAL 713 HG23 VAL 713 3.328 17.261 3.058 413 H GLU 714 H GLU 714 1.802 14.252 1.498 414 HA GLU 714 HA GLU 714 3.933 13.325 3.300 415 HB2 GLU 714 HB2 GLU 714 1.322 14.367 4.040 416 HB3 GLU 714 HB3 GLU 714 1.554 12.716 4.619 417 HG2 GLU 714 HG2 GLU 714 3.716 14.783 4.931 418 HG3 GLU 714 HG3 GLU 714 2.412 14.663 6.108 419 H VAL 715 H VAL 715 3.586 11.057 4.033 420 HA VAL 715 HA VAL 715 2.263 9.518 1.866 421 HB VAL 715 HB VAL 715 4.574 8.593 3.568 422 HG11 VAL 715 HG11 VAL 715 4.830 7.025 1.610 423 HG12 VAL 715 HG12 VAL 715 3.342 6.786 2.525 424 HG13 VAL 715 HG13 VAL 715 3.302 7.642 0.985 425 HG21 VAL 715 HG21 VAL 715 4.461 10.447 1.285 426 HG22 VAL 715 HG22 VAL 715 5.783 10.128 2.408 427 HG23 VAL 715 HG23 VAL 715 5.530 9.079 1.018 428 H LYS 716 H LYS 716 0.854 7.940 2.315 429 HA LYS 716 HA LYS 716 0.273 7.400 5.179 430 HB2 LYS 716 HB2 LYS 716 -1.446 8.525 3.450 431 HB3 LYS 716 HB3 LYS 716 -1.767 6.835 3.074 432 HG2 LYS 716 HG2 LYS 716 -2.635 6.374 5.189 433 HG3 LYS 716 HG3 LYS 716 -1.659 7.624 5.964 434 HD2 LYS 716 HD2 LYS 716 -4.083 8.107 4.201 435 HD3 LYS 716 HD3 LYS 716 -4.020 8.296 5.933 436 HE2 LYS 716 HE2 LYS 716 -1.966 9.901 5.287 437 HE3 LYS 716 HE3 LYS 716 -2.908 10.045 3.802 438 HZ1 LYS 716 HZ1 LYS 716 -4.137 11.524 4.894 439 HZ2 LYS 716 HZ2 LYS 716 -4.775 10.241 5.835 440 HZ3 LYS 716 HZ3 LYS 716 -3.430 11.141 6.387 441 H HIS 717 H HIS 717 0.903 5.427 5.821 442 HA HIS 717 HA HIS 717 0.765 3.183 3.885 443 HB2 HIS 717 HB2 HIS 717 2.507 3.011 6.320 444 HB3 HIS 717 HB3 HIS 717 2.678 2.189 4.771 445 HD1 HIS 717 HD1 HIS 717 4.147 3.272 3.020 446 HD2 HIS 717 HD2 HIS 717 3.375 5.809 6.259 447 HE1 HIS 717 HE1 HIS 717 5.766 5.231 2.838 448 HE2 HIS 717 HE2 HIS 717 5.281 6.807 4.797 449 H ILE 718 H ILE 718 -1.078 2.113 4.334 450 HA ILE 718 HA ILE 718 -1.817 1.627 7.172 451 HB ILE 718 HB ILE 718 -3.394 1.961 4.653 452 HG12 ILE 718 HG12 ILE 718 -3.216 3.754 6.370 453 HG13 ILE 718 HG13 ILE 718 -4.869 3.209 6.122 454 HG21 ILE 718 HG21 ILE 718 -4.184 0.174 6.967 455 HG22 ILE 718 HG22 ILE 718 -5.342 0.847 5.821 456 HG23 ILE 718 HG23 ILE 718 -4.093 -0.265 5.262 457 HD11 ILE 718 HD11 ILE 718 -3.624 1.591 8.155 458 HD12 ILE 718 HD12 ILE 718 -3.443 3.297 8.553 459 HD13 ILE 718 HD13 ILE 718 -5.046 2.623 8.278 460 H LYS 719 H LYS 719 -2.085 -0.500 7.863 461 HA LYS 719 HA LYS 719 -0.619 -2.481 6.386 462 HB2 LYS 719 HB2 LYS 719 -2.276 -2.835 8.893 463 HB3 LYS 719 HB3 LYS 719 -1.017 -3.918 8.298 464 HG2 LYS 719 HG2 LYS 719 -0.057 -1.163 8.551 465 HG3 LYS 719 HG3 LYS 719 -0.658 -1.790 10.082 466 HD2 LYS 719 HD2 LYS 719 1.617 -2.436 10.061 467 HD3 LYS 719 HD3 LYS 719 0.762 -3.894 9.562 468 HE2 LYS 719 HE2 LYS 719 1.701 -3.865 7.507 469 HE3 LYS 719 HE3 LYS 719 1.393 -2.143 7.308 470 HZ1 LYS 719 HZ1 LYS 719 3.698 -2.318 7.347 471 HZ2 LYS 719 HZ2 LYS 719 3.324 -1.832 8.941 472 HZ3 LYS 719 HZ3 LYS 719 3.709 -3.485 8.605 473 H ILE 720 H ILE 720 -1.329 -4.260 5.319 474 HA ILE 720 HA ILE 720 -4.198 -4.307 4.648 475 HB ILE 720 HB ILE 720 -1.740 -5.415 3.307 476 HG12 ILE 720 HG12 ILE 720 -4.007 -3.729 2.233 477 HG13 ILE 720 HG13 ILE 720 -2.556 -3.031 2.959 478 HG21 ILE 720 HG21 ILE 720 -3.360 -7.208 3.144 479 HG22 ILE 720 HG22 ILE 720 -4.651 -6.068 2.762 480 HG23 ILE 720 HG23 ILE 720 -3.356 -6.353 1.602 481 HD11 ILE 720 HD11 ILE 720 -2.683 -3.460 0.353 482 HD12 ILE 720 HD12 ILE 720 -1.184 -3.751 1.234 483 HD13 ILE 720 HD13 ILE 720 -2.242 -5.100 0.819 484 H MET 721 H MET 721 -5.360 -5.571 5.920 485 HA MET 721 HA MET 721 -4.233 -7.758 7.387 486 HB2 MET 721 HB2 MET 721 -6.476 -6.216 7.678 487 HB3 MET 721 HB3 MET 721 -7.154 -7.711 7.040 488 HG2 MET 721 HG2 MET 721 -5.387 -8.701 8.868 489 HG3 MET 721 HG3 MET 721 -5.879 -7.199 9.647 490 HE1 MET 721 HE1 MET 721 -7.466 -7.543 11.482 491 HE2 MET 721 HE2 MET 721 -8.276 -9.090 11.695 492 HE3 MET 721 HE3 MET 721 -6.528 -9.037 11.447 493 H THR 722 H THR 722 -4.999 -9.948 7.256 494 HA THR 722 HA THR 722 -6.199 -10.914 4.826 495 HB THR 722 HB THR 722 -3.732 -10.462 4.268 496 HG1 THR 722 HG1 THR 722 -5.138 -11.872 3.112 497 HG21 THR 722 HG21 THR 722 -2.954 -11.402 6.501 498 HG22 THR 722 HG22 THR 722 -3.333 -13.002 5.859 499 HG23 THR 722 HG23 THR 722 -2.101 -12.008 5.081 500 H ALA 723 H ALA 723 -6.830 -13.071 4.998 501 HA ALA 723 HA ALA 723 -6.080 -14.720 7.224 502 HB1 ALA 723 HB1 ALA 723 -8.207 -14.638 8.417 503 HB2 ALA 723 HB2 ALA 723 -8.829 -13.457 7.262 504 HB3 ALA 723 HB3 ALA 723 -7.510 -13.018 8.350 505 H GLU 724 H GLU 724 -9.146 -14.124 5.641 506 HA GLU 724 HA GLU 724 -9.542 -16.885 4.942 507 HB2 GLU 724 HB2 GLU 724 -11.164 -14.706 3.734 508 HB3 GLU 724 HB3 GLU 724 -11.698 -16.204 4.489 509 HG2 GLU 724 HG2 GLU 724 -12.350 -14.704 6.131 510 HG3 GLU 724 HG3 GLU 724 -10.700 -15.003 6.672 511 H GLY 725 H GLY 725 -7.144 -15.748 3.848 512 HA2 GLY 725 HA2 GLY 725 -5.966 -15.782 1.856 513 HA3 GLY 725 HA3 GLY 725 -7.378 -16.537 1.115 514 H LEU 726 H LEU 726 -7.670 -13.531 2.832 515 HA LEU 726 HA LEU 726 -8.114 -12.130 0.259 516 HB2 LEU 726 HB2 LEU 726 -9.420 -11.635 2.945 517 HB3 LEU 726 HB3 LEU 726 -9.739 -10.732 1.463 518 HG LEU 726 HG LEU 726 -10.056 -13.727 1.539 519 HD11 LEU 726 HD11 LEU 726 -12.235 -11.721 2.159 520 HD12 LEU 726 HD12 LEU 726 -12.358 -13.479 2.198 521 HD13 LEU 726 HD13 LEU 726 -11.377 -12.638 3.398 522 HD21 LEU 726 HD21 LEU 726 -11.988 -12.636 -0.084 523 HD22 LEU 726 HD22 LEU 726 -10.660 -11.495 -0.291 524 HD23 LEU 726 HD23 LEU 726 -10.414 -13.205 -0.645 525 H TYR 727 H TYR 727 -8.012 -9.728 0.493 526 HA TYR 727 HA TYR 727 -5.810 -8.840 2.266 527 HB2 TYR 727 HB2 TYR 727 -6.170 -8.096 -0.655 528 HB3 TYR 727 HB3 TYR 727 -4.921 -7.480 0.425 529 HD1 TYR 727 HD2 TYR 727 -6.130 -10.444 -1.413 530 HD2 TYR 727 HD1 TYR 727 -3.042 -8.868 1.122 531 HE1 TYR 727 HE2 TYR 727 -4.702 -12.407 -1.928 532 HE2 TYR 727 HE1 TYR 727 -1.620 -10.832 0.606 533 HH TYR 727 HH TYR 727 -2.853 -13.610 -1.031 534 H ARG 728 H ARG 728 -6.219 -6.954 3.308 535 HA ARG 728 HA ARG 728 -8.112 -5.028 2.226 536 HB2 ARG 728 HB2 ARG 728 -9.232 -5.082 4.633 537 HB3 ARG 728 HB3 ARG 728 -9.821 -6.080 3.305 538 HG2 ARG 728 HG2 ARG 728 -9.035 -8.028 4.229 539 HG3 ARG 728 HG3 ARG 728 -7.623 -7.244 4.933 540 HD2 ARG 728 HD2 ARG 728 -8.812 -6.501 6.817 541 HD3 ARG 728 HD3 ARG 728 -10.371 -6.663 6.025 542 HE ARG 728 HE ARG 728 -8.888 -8.766 7.359 543 HH11 ARG 728 HH21 ARG 728 -11.371 -7.956 5.084 544 HH12 ARG 728 HH22 ARG 728 -12.050 -9.557 5.094 545 HH21 ARG 728 HH11 ARG 728 -9.781 -10.821 7.342 546 HH22 ARG 728 HH12 ARG 728 -11.158 -11.185 6.337 547 H ILE 729 H ILE 729 -7.501 -3.045 2.703 548 HA ILE 729 HA ILE 729 -5.198 -2.547 4.306 549 HB ILE 729 HB ILE 729 -6.243 -0.069 3.973 550 HG12 ILE 729 HG12 ILE 729 -8.275 -1.243 2.887 551 HG13 ILE 729 HG13 ILE 729 -7.560 0.122 2.034 552 HG21 ILE 729 HG21 ILE 729 -5.070 -0.280 1.601 553 HG22 ILE 729 HG22 ILE 729 -4.128 -0.372 3.088 554 HG23 ILE 729 HG23 ILE 729 -4.579 -1.846 2.233 555 HD11 ILE 729 HD11 ILE 729 -7.994 -2.445 1.010 556 HD12 ILE 729 HD12 ILE 729 -7.049 -1.156 0.266 557 HD13 ILE 729 HD13 ILE 729 -6.253 -2.358 1.281 558 H THR 730 H THR 730 -8.591 -2.542 4.829 559 HA THR 730 HA THR 730 -8.143 -1.747 7.635 560 HB THR 730 HB THR 730 -9.262 0.030 6.170 561 HG1 THR 730 HG1 THR 730 -10.171 -1.044 8.608 562 HG21 THR 730 HG21 THR 730 -10.659 -1.544 4.878 563 HG22 THR 730 HG22 THR 730 -11.558 -1.937 6.344 564 HG23 THR 730 HG23 THR 730 -11.630 -0.307 5.680 565 H GLU 731 H GLU 731 -9.118 -2.994 9.118 566 HA GLU 731 HA GLU 731 -9.786 -5.632 8.657 567 HB2 GLU 731 HB2 GLU 731 -10.689 -5.594 10.931 568 HB3 GLU 731 HB3 GLU 731 -9.228 -4.599 10.852 569 HG2 GLU 731 HG2 GLU 731 -11.915 -3.330 10.383 570 HG3 GLU 731 HG3 GLU 731 -11.363 -3.626 12.025 571 H LYS 732 H LYS 732 -11.603 -2.904 7.881 572 HA LYS 732 HA LYS 732 -14.212 -4.152 8.120 573 HB2 LYS 732 HB2 LYS 732 -13.621 -1.495 6.835 574 HB3 LYS 732 HB3 LYS 732 -15.096 -2.024 7.649 575 HG2 LYS 732 HG2 LYS 732 -13.794 -2.185 9.787 576 HG3 LYS 732 HG3 LYS 732 -12.404 -1.503 8.948 577 HD2 LYS 732 HD2 LYS 732 -13.585 0.557 8.506 578 HD3 LYS 732 HD3 LYS 732 -15.094 -0.122 9.120 579 HE2 LYS 732 HE2 LYS 732 -13.760 -0.522 11.312 580 HE3 LYS 732 HE3 LYS 732 -12.617 0.656 10.658 581 HZ1 LYS 732 HZ1 LYS 732 -14.747 2.048 10.260 582 HZ2 LYS 732 HZ2 LYS 732 -15.464 1.018 11.425 583 HZ3 LYS 732 HZ3 LYS 732 -14.100 1.987 11.849 584 H LYS 733 H LYS 733 -11.778 -4.176 5.739 585 HA LYS 733 HA LYS 733 -13.809 -4.705 3.625 586 HB2 LYS 733 HB2 LYS 733 -11.865 -2.726 3.606 587 HB3 LYS 733 HB3 LYS 733 -11.173 -4.004 2.610 588 HG2 LYS 733 HG2 LYS 733 -12.483 -2.607 1.146 589 HG3 LYS 733 HG3 LYS 733 -13.385 -4.102 1.368 590 HD2 LYS 733 HD2 LYS 733 -15.139 -2.838 2.012 591 HD3 LYS 733 HD3 LYS 733 -14.234 -2.461 3.478 592 HE2 LYS 733 HE2 LYS 733 -13.106 -0.609 2.070 593 HE3 LYS 733 HE3 LYS 733 -14.420 -0.864 0.922 594 HZ1 LYS 733 HZ1 LYS 733 -15.902 0.095 2.288 595 HZ2 LYS 733 HZ2 LYS 733 -15.249 -0.624 3.684 596 HZ3 LYS 733 HZ3 LYS 733 -14.535 0.789 3.050 597 H ALA 734 H ALA 734 -12.386 -5.759 1.657 598 HA ALA 734 HA ALA 734 -10.472 -7.709 2.313 599 HB1 ALA 734 HB1 ALA 734 -11.605 -9.502 3.048 600 HB2 ALA 734 HB2 ALA 734 -12.843 -9.323 1.803 601 HB3 ALA 734 HB3 ALA 734 -12.966 -8.413 3.308 602 H PHE 735 H PHE 735 -9.513 -8.336 0.500 603 HA PHE 735 HA PHE 735 -11.074 -8.596 -1.999 604 HB2 PHE 735 HB2 PHE 735 -8.480 -7.077 -1.619 605 HB3 PHE 735 HB3 PHE 735 -8.991 -7.685 -3.195 606 HD1 PHE 735 HD2 PHE 735 -10.152 -5.591 -0.316 607 HD2 PHE 735 HD1 PHE 735 -10.532 -6.476 -4.500 608 HE1 PHE 735 HE2 PHE 735 -11.653 -3.637 -0.598 609 HE2 PHE 735 HE1 PHE 735 -12.025 -4.522 -4.783 610 HZ PHE 735 HZ PHE 735 -12.591 -3.105 -2.827 611 H ARG 736 H ARG 736 -9.999 -10.095 -3.567 612 HA ARG 736 HA ARG 736 -8.742 -12.273 -2.099 613 HB2 ARG 736 HB2 ARG 736 -9.385 -12.156 -5.047 614 HB3 ARG 736 HB3 ARG 736 -9.038 -13.586 -4.088 615 HG2 ARG 736 HG2 ARG 736 -11.266 -13.742 -3.758 616 HG3 ARG 736 HG3 ARG 736 -11.061 -12.394 -2.650 617 HD2 ARG 736 HD2 ARG 736 -12.785 -12.350 -4.737 618 HD3 ARG 736 HD3 ARG 736 -12.052 -10.909 -4.049 619 HE ARG 736 HE ARG 736 -10.420 -10.930 -5.844 620 HH11 ARG 736 HH21 ARG 736 -13.108 -13.113 -6.199 621 HH12 ARG 736 HH22 ARG 736 -12.861 -13.328 -7.892 622 HH21 ARG 736 HH11 ARG 736 -10.097 -11.241 -8.003 623 HH22 ARG 736 HH12 ARG 736 -11.172 -12.277 -8.916 624 H GLY 737 H GLY 737 -7.749 -9.632 -3.996 625 HA2 GLY 737 HA2 GLY 737 -4.968 -10.476 -3.757 626 HA3 GLY 737 HA3 GLY 737 -5.556 -10.240 -5.401 627 H LEU 738 H LEU 738 -3.499 -8.758 -3.957 628 HA LEU 738 HA LEU 738 -4.326 -6.257 -3.026 629 HB2 LEU 738 HB2 LEU 738 -1.863 -7.466 -4.007 630 HB3 LEU 738 HB3 LEU 738 -1.983 -5.774 -4.476 631 HG LEU 738 HG LEU 738 -0.869 -6.028 -2.288 632 HD11 LEU 738 HD11 LEU 738 -1.809 -4.107 -1.573 633 HD12 LEU 738 HD12 LEU 738 -2.899 -4.269 -2.949 634 HD13 LEU 738 HD13 LEU 738 -3.389 -4.862 -1.362 635 HD21 LEU 738 HD21 LEU 738 -1.996 -6.956 -0.388 636 HD22 LEU 738 HD22 LEU 738 -3.523 -7.062 -1.262 637 HD23 LEU 738 HD23 LEU 738 -2.186 -8.128 -1.690 638 H THR 739 H THR 739 -3.477 -7.272 -6.312 639 HA THR 739 HA THR 739 -3.807 -4.921 -7.691 640 HB THR 739 HB THR 739 -4.842 -7.463 -8.868 641 HG1 THR 739 HG1 THR 739 -2.114 -7.130 -8.824 642 HG21 THR 739 HG21 THR 739 -4.639 -6.028 -10.625 643 HG22 THR 739 HG22 THR 739 -3.535 -4.967 -9.752 644 HG23 THR 739 HG23 THR 739 -2.925 -6.429 -10.524 645 H GLU 740 H GLU 740 -6.375 -7.230 -6.751 646 HA GLU 740 HA GLU 740 -8.430 -5.836 -8.144 647 HB2 GLU 740 HB2 GLU 740 -9.293 -7.255 -5.743 648 HB3 GLU 740 HB3 GLU 740 -9.754 -7.514 -7.420 649 HG2 GLU 740 HG2 GLU 740 -7.498 -8.674 -7.704 650 HG3 GLU 740 HG3 GLU 740 -7.361 -8.620 -5.951 651 H LEU 741 H LEU 741 -6.995 -5.632 -4.976 652 HA LEU 741 HA LEU 741 -8.974 -3.852 -3.891 653 HB2 LEU 741 HB2 LEU 741 -7.706 -5.252 -2.392 654 HB3 LEU 741 HB3 LEU 741 -6.180 -4.680 -3.053 655 HG LEU 741 HG LEU 741 -6.959 -3.712 -0.796 656 HD11 LEU 741 HD11 LEU 741 -5.541 -1.986 -1.235 657 HD12 LEU 741 HD12 LEU 741 -5.370 -2.751 -2.816 658 HD13 LEU 741 HD13 LEU 741 -6.500 -1.414 -2.598 659 HD21 LEU 741 HD21 LEU 741 -8.736 -2.243 -0.727 660 HD22 LEU 741 HD22 LEU 741 -8.481 -1.692 -2.377 661 HD23 LEU 741 HD23 LEU 741 -9.292 -3.223 -2.075 662 H VAL 742 H VAL 742 -5.770 -3.617 -5.289 663 HA VAL 742 HA VAL 742 -5.467 -0.794 -5.096 664 HB VAL 742 HB VAL 742 -4.199 -2.802 -6.971 665 HG11 VAL 742 HG11 VAL 742 -3.743 -0.691 -7.892 666 HG12 VAL 742 HG12 VAL 742 -3.609 0.074 -6.307 667 HG13 VAL 742 HG13 VAL 742 -2.338 -1.010 -6.872 668 HG21 VAL 742 HG21 VAL 742 -2.546 -3.123 -5.342 669 HG22 VAL 742 HG22 VAL 742 -2.987 -1.658 -4.466 670 HG23 VAL 742 HG23 VAL 742 -4.033 -3.077 -4.396 671 H GLU 743 H GLU 743 -6.355 -2.936 -7.803 672 HA GLU 743 HA GLU 743 -6.785 -0.819 -9.646 673 HB2 GLU 743 HB2 GLU 743 -7.743 -3.678 -9.642 674 HB3 GLU 743 HB3 GLU 743 -7.908 -2.577 -11.012 675 HG2 GLU 743 HG2 GLU 743 -5.206 -2.454 -10.056 676 HG3 GLU 743 HG3 GLU 743 -5.632 -4.139 -10.299 677 H PHE 744 H PHE 744 -8.749 -2.213 -7.184 678 HA PHE 744 HA PHE 744 -11.284 -1.363 -8.267 679 HB2 PHE 744 HB2 PHE 744 -11.337 -3.174 -6.715 680 HB3 PHE 744 HB3 PHE 744 -10.392 -2.280 -5.529 681 HD1 PHE 744 HD2 PHE 744 -13.578 -1.905 -7.492 682 HD2 PHE 744 HD1 PHE 744 -11.532 -1.271 -3.768 683 HE1 PHE 744 HE2 PHE 744 -15.663 -1.001 -6.500 684 HE2 PHE 744 HE1 PHE 744 -13.618 -0.370 -2.772 685 HZ PHE 744 HZ PHE 744 -15.683 -0.232 -4.141 686 H TYR 745 H TYR 745 -8.913 -0.090 -6.005 687 HA TYR 745 HA TYR 745 -10.575 2.199 -5.406 688 HB2 TYR 745 HB2 TYR 745 -7.928 1.203 -4.459 689 HB3 TYR 745 HB3 TYR 745 -8.332 2.905 -4.222 690 HD1 TYR 745 HD2 TYR 745 -11.347 2.616 -3.883 691 HD2 TYR 745 HD1 TYR 745 -8.077 0.397 -2.206 692 HE1 TYR 745 HE2 TYR 745 -12.762 1.995 -1.971 693 HE2 TYR 745 HE1 TYR 745 -9.508 -0.219 -0.273 694 HH TYR 745 HH TYR 745 -12.213 1.318 0.565 695 H GLN 746 H GLN 746 -8.650 1.448 -7.986 696 HA GLN 746 HA GLN 746 -7.324 3.906 -8.483 697 HB2 GLN 746 HB2 GLN 746 -8.268 1.640 -10.207 698 HB3 GLN 746 HB3 GLN 746 -7.695 3.133 -10.953 699 HG2 GLN 746 HG2 GLN 746 -5.550 2.944 -9.888 700 HG3 GLN 746 HG3 GLN 746 -6.110 1.628 -8.862 701 HE21 GLN 746 HE21 GLN 746 -7.573 0.348 -11.197 702 HE22 GLN 746 HE22 GLN 746 -6.341 -0.391 -12.113 703 H GLN 747 H GLN 747 -10.581 2.752 -9.068 704 HA GLN 747 HA GLN 747 -11.350 5.342 -10.261 705 HB2 GLN 747 HB2 GLN 747 -12.846 2.707 -10.142 706 HB3 GLN 747 HB3 GLN 747 -13.409 4.170 -10.952 707 HG2 GLN 747 HG2 GLN 747 -11.524 4.107 -12.488 708 HG3 GLN 747 HG3 GLN 747 -10.817 2.747 -11.622 709 HE21 GLN 747 HE21 GLN 747 -11.302 0.734 -12.503 710 HE22 GLN 747 HE22 GLN 747 -12.649 0.403 -13.477 711 H ASN 748 H ASN 748 -11.626 3.433 -7.408 712 HA ASN 748 HA ASN 748 -13.726 5.238 -6.360 713 HB2 ASN 748 HB2 ASN 748 -14.263 2.751 -6.517 714 HB3 ASN 748 HB3 ASN 748 -13.030 2.496 -5.286 715 HD21 ASN 748 HD21 ASN 748 -13.372 3.833 -3.202 716 HD22 ASN 748 HD22 ASN 748 -14.985 4.069 -2.696 717 H SER 749 H SER 749 -13.262 6.414 -4.582 718 HA SER 749 HA SER 749 -10.634 6.910 -3.822 719 HB2 SER 749 HB2 SER 749 -12.591 8.407 -3.393 720 HB3 SER 749 HB3 SER 749 -13.048 7.329 -2.075 721 HG SER 749 HG SER 749 -10.483 8.527 -2.327 722 H LEU 750 H LEU 750 -9.426 6.458 -1.984 723 HA LEU 750 HA LEU 750 -9.645 3.750 -1.016 724 HB2 LEU 750 HB2 LEU 750 -7.794 6.013 -0.260 725 HB3 LEU 750 HB3 LEU 750 -7.630 4.354 0.305 726 HG LEU 750 HG LEU 750 -7.961 4.325 -2.545 727 HD11 LEU 750 HD11 LEU 750 -5.486 5.838 -1.792 728 HD12 LEU 750 HD12 LEU 750 -6.328 5.764 -3.341 729 HD13 LEU 750 HD13 LEU 750 -6.995 6.721 -2.022 730 HD21 LEU 750 HD21 LEU 750 -6.603 2.941 -0.603 731 HD22 LEU 750 HD22 LEU 750 -6.336 2.747 -2.331 732 HD23 LEU 750 HD23 LEU 750 -5.289 3.812 -1.394 733 H LYS 751 H LYS 751 -10.508 6.912 0.148 734 HA LYS 751 HA LYS 751 -10.646 6.672 2.885 735 HB2 LYS 751 HB2 LYS 751 -12.456 8.267 2.825 736 HB3 LYS 751 HB3 LYS 751 -11.369 8.653 1.488 737 HG2 LYS 751 HG2 LYS 751 -12.877 7.045 0.106 738 HG3 LYS 751 HG3 LYS 751 -14.050 7.296 1.398 739 HD2 LYS 751 HD2 LYS 751 -13.937 9.726 1.037 740 HD3 LYS 751 HD3 LYS 751 -12.742 9.482 -0.240 741 HE2 LYS 751 HE2 LYS 751 -15.362 9.698 -0.772 742 HE3 LYS 751 HE3 LYS 751 -14.291 8.681 -1.732 743 HZ1 LYS 751 HZ1 LYS 751 -14.917 6.745 -0.421 744 HZ2 LYS 751 HZ2 LYS 751 -15.873 7.735 0.602 745 HZ3 LYS 751 HZ3 LYS 751 -16.328 7.515 -1.016 746 H ASP 752 H ASP 752 -12.349 4.909 0.505 747 HA ASP 752 HA ASP 752 -14.600 4.103 2.080 748 HB2 ASP 752 HB2 ASP 752 -13.321 2.879 -0.374 749 HB3 ASP 752 HB3 ASP 752 -14.873 2.385 0.292 750 H CYS 753 H CYS 753 -11.309 3.118 1.831 751 HA CYS 753 HA CYS 753 -11.749 0.824 3.682 752 HB2 CYS 753 HB2 CYS 753 -9.884 1.216 1.398 753 HB3 CYS 753 HB3 CYS 753 -9.244 0.437 2.828 754 HG CYS 753 HG CYS 753 -11.218 -0.829 0.888 755 H PHE 754 H PHE 754 -9.567 3.384 2.651 756 HA PHE 754 HA PHE 754 -7.962 3.324 4.990 757 HB2 PHE 754 HB2 PHE 754 -8.286 5.144 2.656 758 HB3 PHE 754 HB3 PHE 754 -7.427 5.738 4.075 759 HD1 PHE 754 HD2 PHE 754 -7.562 2.799 1.761 760 HD2 PHE 754 HD1 PHE 754 -5.141 5.231 4.344 761 HE1 PHE 754 HE2 PHE 754 -5.544 1.564 1.033 762 HE2 PHE 754 HE1 PHE 754 -3.119 3.994 3.613 763 HZ PHE 754 HZ PHE 754 -3.322 2.158 1.958 764 H LYS 755 H LYS 755 -7.798 5.083 6.538 765 HA LYS 755 HA LYS 755 -10.425 5.828 7.505 766 HB2 LYS 755 HB2 LYS 755 -7.995 6.789 8.904 767 HB3 LYS 755 HB3 LYS 755 -9.441 6.007 9.546 768 HG2 LYS 755 HG2 LYS 755 -7.108 4.688 8.134 769 HG3 LYS 755 HG3 LYS 755 -7.637 4.436 9.790 770 HD2 LYS 755 HD2 LYS 755 -9.911 3.745 8.528 771 HD3 LYS 755 HD3 LYS 755 -8.759 3.344 7.257 772 HE2 LYS 755 HE2 LYS 755 -7.853 1.602 8.420 773 HE3 LYS 755 HE3 LYS 755 -8.013 2.430 9.971 774 HZ1 LYS 755 HZ1 LYS 755 -10.582 2.078 9.325 775 HZ2 LYS 755 HZ2 LYS 755 -9.916 0.672 8.605 776 HZ3 LYS 755 HZ3 LYS 755 -9.700 0.977 10.288 777 H SER 756 H SER 756 -7.414 7.703 6.971 778 HA SER 756 HA SER 756 -9.040 10.130 6.660 779 HB2 SER 756 HB2 SER 756 -7.015 11.365 6.920 780 HB3 SER 756 HB3 SER 756 -6.957 10.070 8.115 781 HG SER 756 HG SER 756 -5.254 9.321 7.152 782 H LEU 757 H LEU 757 -6.844 8.064 4.898 783 HA LEU 757 HA LEU 757 -6.158 9.369 2.636 784 HB2 LEU 757 HB2 LEU 757 -6.055 6.822 3.390 785 HB3 LEU 757 HB3 LEU 757 -7.396 6.695 2.259 786 HG LEU 757 HG LEU 757 -5.453 6.254 0.990 787 HD11 LEU 757 HD11 LEU 757 -7.067 7.881 -0.002 788 HD12 LEU 757 HD12 LEU 757 -6.023 9.179 0.572 789 HD13 LEU 757 HD13 LEU 757 -5.420 8.031 -0.618 790 HD21 LEU 757 HD21 LEU 757 -3.494 7.741 1.024 791 HD22 LEU 757 HD22 LEU 757 -4.284 8.743 2.237 792 HD23 LEU 757 HD23 LEU 757 -3.824 7.082 2.632 793 H ASP 758 H ASP 758 -7.451 10.857 1.631 794 HA ASP 758 HA ASP 758 -10.056 9.874 0.655 795 HB2 ASP 758 HB2 ASP 758 -9.746 11.965 2.348 796 HB3 ASP 758 HB3 ASP 758 -9.673 12.799 0.798 797 H THR 759 H THR 759 -8.677 9.004 -1.076 798 HA THR 759 HA THR 759 -8.913 10.647 -3.397 799 HB THR 759 HB THR 759 -6.748 11.539 -2.507 800 HG1 THR 759 HG1 THR 759 -5.857 11.486 -4.507 801 HG21 THR 759 HG21 THR 759 -6.175 8.669 -2.374 802 HG22 THR 759 HG22 THR 759 -4.939 9.565 -3.253 803 HG23 THR 759 HG23 THR 759 -5.341 10.014 -1.597 804 H THR 760 H THR 760 -7.161 9.319 -5.099 805 HA THR 760 HA THR 760 -7.967 6.475 -4.819 806 HB THR 760 HB THR 760 -8.278 6.442 -7.316 807 HG1 THR 760 HG1 THR 760 -8.789 8.712 -8.047 808 HG21 THR 760 HG21 THR 760 -10.286 6.448 -6.140 809 HG22 THR 760 HG22 THR 760 -10.011 8.061 -5.475 810 HG23 THR 760 HG23 THR 760 -10.454 7.868 -7.173 811 H LEU 761 H LEU 761 -6.745 5.075 -6.402 812 HA LEU 761 HA LEU 761 -3.946 5.370 -5.969 813 HB2 LEU 761 HB2 LEU 761 -5.563 3.530 -7.754 814 HB3 LEU 761 HB3 LEU 761 -3.811 3.446 -7.653 815 HG LEU 761 HG LEU 761 -5.002 1.811 -6.152 816 HD11 LEU 761 HD11 LEU 761 -3.754 2.808 -3.997 817 HD12 LEU 761 HD12 LEU 761 -2.867 2.130 -5.361 818 HD13 LEU 761 HD13 LEU 761 -3.057 3.876 -5.214 819 HD21 LEU 761 HD21 LEU 761 -6.868 3.431 -5.597 820 HD22 LEU 761 HD22 LEU 761 -6.172 2.590 -4.217 821 HD23 LEU 761 HD23 LEU 761 -5.732 4.264 -4.535 822 H GLN 762 H GLN 762 -3.556 7.490 -6.798 823 HA GLN 762 HA GLN 762 -4.140 8.312 -9.429 824 HB2 GLN 762 HB2 GLN 762 -2.139 9.209 -7.374 825 HB3 GLN 762 HB3 GLN 762 -2.141 9.916 -8.986 826 HG2 GLN 762 HG2 GLN 762 -4.841 9.895 -8.222 827 HG3 GLN 762 HG3 GLN 762 -3.973 10.391 -6.773 828 HE21 GLN 762 HE21 GLN 762 -2.283 12.235 -7.194 829 HE22 GLN 762 HE22 GLN 762 -2.742 13.419 -8.320 830 H PHE 763 H PHE 763 -0.924 7.350 -8.182 831 HA PHE 763 HA PHE 763 -0.426 5.778 -10.555 832 HB2 PHE 763 HB2 PHE 763 1.839 7.402 -10.617 833 HB3 PHE 763 HB3 PHE 763 0.522 7.394 -11.788 834 HD1 PHE 763 HD1 PHE 763 1.636 8.936 -8.572 835 HD2 PHE 763 HD2 PHE 763 -0.912 9.259 -12.014 836 HE1 PHE 763 HE1 PHE 763 1.030 11.246 -7.906 837 HE2 PHE 763 HE2 PHE 763 -1.518 11.569 -11.349 838 HZ PHE 763 HZ PHE 763 -0.547 12.563 -9.295 839 HA PRO 764 HA PRO 764 2.233 3.644 -7.796 840 HB2 PRO 764 HB2 PRO 764 3.991 2.510 -9.568 841 HB3 PRO 764 HB3 PRO 764 2.322 1.947 -9.351 842 HG2 PRO 764 HG2 PRO 764 3.486 3.640 -11.491 843 HG3 PRO 764 HG3 PRO 764 2.220 2.406 -11.583 844 HD2 PRO 764 HD2 PRO 764 1.715 5.114 -11.569 845 HD3 PRO 764 HD3 PRO 764 0.557 3.887 -11.033 846 H PHE 765 H PHE 765 4.193 3.838 -6.718 847 HA PHE 765 HA PHE 765 5.624 6.264 -7.010 848 HB2 PHE 765 HB2 PHE 765 6.820 5.590 -5.148 849 HB3 PHE 765 HB3 PHE 765 5.367 4.606 -4.985 850 HD1 PHE 765 HD1 PHE 765 5.457 2.269 -6.290 851 HD2 PHE 765 HD2 PHE 765 8.888 4.524 -5.033 852 HE1 PHE 765 HE1 PHE 765 6.840 0.227 -6.409 853 HE2 PHE 765 HE2 PHE 765 10.276 2.473 -5.148 854 HZ PHE 765 HZ PHE 765 9.252 0.324 -5.834 855 H LYS 766 H LYS 766 6.110 3.051 -8.302 856 HA LYS 766 HA LYS 766 8.793 3.236 -9.073 857 HB2 LYS 766 HB2 LYS 766 6.454 1.569 -9.696 858 HB3 LYS 766 HB3 LYS 766 7.740 1.565 -10.896 859 HG2 LYS 766 HG2 LYS 766 8.743 1.411 -8.158 860 HG3 LYS 766 HG3 LYS 766 7.706 0.060 -8.591 861 HD2 LYS 766 HD2 LYS 766 10.035 -0.448 -9.185 862 HD3 LYS 766 HD3 LYS 766 9.062 -0.293 -10.649 863 HE2 LYS 766 HE2 LYS 766 10.407 2.165 -9.577 864 HE3 LYS 766 HE3 LYS 766 11.397 0.971 -10.411 865 HZ1 LYS 766 HZ1 LYS 766 9.193 1.234 -12.002 866 HZ2 LYS 766 HZ2 LYS 766 9.491 2.841 -11.499 867 HZ3 LYS 766 HZ3 LYS 766 10.707 1.939 -12.281 868 H GLU 767 H GLU 767 5.952 4.650 -10.448 869 HA GLU 767 HA GLU 767 6.856 4.843 -13.115 870 HB2 GLU 767 HB2 GLU 767 4.594 5.717 -11.589 871 HB3 GLU 767 HB3 GLU 767 5.203 7.086 -12.517 872 HG2 GLU 767 HG2 GLU 767 5.287 5.487 -14.518 873 HG3 GLU 767 HG3 GLU 767 4.316 4.389 -13.548 874 H1 ASP 338 H1 ASP 338 12.675 8.167 12.095 875 H2 ASP 338 H2 ASP 338 13.912 9.314 11.841 876 H3 ASP 338 H3 ASP 338 13.730 8.585 13.375 877 HA ASP 338 HA ASP 338 15.041 7.597 10.986 878 HB2 ASP 338 HB2 ASP 338 16.172 6.243 12.891 879 HB3 ASP 338 HB3 ASP 338 16.428 7.985 12.859 880 H THR 339 H THR 339 13.346 6.041 13.748 881 HA THR 339 HA THR 339 13.060 3.550 12.383 882 HB THR 339 HB THR 339 11.864 2.794 14.253 883 HG1 THR 339 HG1 THR 339 10.315 4.569 14.006 884 HG21 THR 339 HG21 THR 339 12.888 4.483 16.173 885 HG22 THR 339 HG22 THR 339 13.756 3.131 15.444 886 HG23 THR 339 HG23 THR 339 13.974 4.762 14.814 887 H GLU 340 H GLU 340 12.276 5.229 10.517 888 HA GLU 340 HA GLU 340 9.432 5.736 10.536 889 HB2 GLU 340 HB2 GLU 340 11.674 6.105 8.582 890 HB3 GLU 340 HB3 GLU 340 10.009 6.172 8.003 891 HG2 GLU 340 HG2 GLU 340 10.544 8.416 8.571 892 HG3 GLU 340 HG3 GLU 340 9.579 7.829 9.922 893 H VAL 341 H VAL 341 8.293 3.858 10.704 894 HA VAL 341 HA VAL 341 8.535 1.958 8.444 895 HB VAL 341 HB VAL 341 9.488 1.042 10.579 896 HG11 VAL 341 HG11 VAL 341 7.299 2.279 11.745 897 HG12 VAL 341 HG12 VAL 341 6.836 0.578 11.752 898 HG13 VAL 341 HG13 VAL 341 8.334 1.087 12.530 899 HG21 VAL 341 HG21 VAL 341 6.991 -0.517 10.068 900 HG22 VAL 341 HG22 VAL 341 8.069 -0.238 8.699 901 HG23 VAL 341 HG23 VAL 341 8.664 -1.070 10.135 902 H TYR 342 H TYR 342 6.520 0.783 7.975 903 HA TYR 342 HA TYR 342 4.229 2.540 8.219 904 HB2 TYR 342 HB2 TYR 342 3.066 0.779 6.841 905 HB3 TYR 342 HB3 TYR 342 4.468 1.519 6.084 906 HD1 TYR 342 HD2 TYR 342 5.683 -0.619 8.630 907 HD2 TYR 342 HD1 TYR 342 3.957 -0.715 4.685 908 HE1 TYR 342 HE2 TYR 342 6.674 -2.849 8.253 909 HE2 TYR 342 HE1 TYR 342 4.939 -2.945 4.327 910 HH TYR 342 HH TYR 342 5.989 -4.931 6.672 911 H GLU 343 H GLU 343 3.901 2.507 10.444 912 HA GLU 343 HA GLU 343 3.391 0.133 11.933 913 HB2 GLU 343 HB2 GLU 343 2.125 2.141 13.344 914 HB3 GLU 343 HB3 GLU 343 3.814 1.680 13.514 915 HG2 GLU 343 HG2 GLU 343 3.668 4.092 13.190 916 HG3 GLU 343 HG3 GLU 343 4.420 3.369 11.774 917 H SER 344 H SER 344 0.963 2.699 11.794 918 HA SER 344 HA SER 344 -0.976 1.381 10.247 919 HB2 SER 344 HB2 SER 344 -1.359 -0.378 11.672 920 HB3 SER 344 HB3 SER 344 -0.799 0.506 13.089 921 HG SER 344 HG SER 344 -2.780 1.818 12.766 922 HA PRO 345 HA PRO 345 -1.405 5.975 11.199 923 HB2 PRO 345 HB2 PRO 345 -3.203 5.145 8.897 924 HB3 PRO 345 HB3 PRO 345 -2.368 6.693 9.132 925 HG2 PRO 345 HG2 PRO 345 -1.354 4.792 7.574 926 HG3 PRO 345 HG3 PRO 345 -0.316 5.813 8.584 927 HD2 PRO 345 HD2 PRO 345 -0.898 2.937 8.858 928 HD3 PRO 345 HD3 PRO 345 0.403 3.892 9.601 929 H PTR 346 H PTR 346 -3.876 3.463 10.705 930 HA PTR 346 HA PTR 346 -5.176 3.846 13.159 931 HB2 PTR 346 HB2 PTR 346 -6.519 5.605 12.823 932 HB3 PTR 346 HB3 PTR 346 -7.359 4.675 11.591 933 HD1 PTR 346 HD1 PTR 346 -5.549 4.486 9.361 934 HD2 PTR 346 HD2 PTR 346 -6.113 7.758 12.081 935 HE1 PTR 346 HE1 PTR 346 -4.685 6.049 7.638 936 HE2 PTR 346 HE2 PTR 346 -5.248 9.326 10.373 937 H ALA 347 H ALA 347 -6.904 2.388 13.488 938 HA ALA 347 HA ALA 347 -7.313 0.372 11.331 939 HB1 ALA 347 HB1 ALA 347 -7.161 -0.047 14.331 940 HB2 ALA 347 HB2 ALA 347 -5.936 -0.526 13.156 941 HB3 ALA 347 HB3 ALA 347 -7.522 -1.298 13.140 942 H ASP 348 H ASP 348 -8.795 1.002 14.499 943 HA ASP 348 HA ASP 348 -10.954 1.484 15.118 944 HB2 ASP 348 HB2 ASP 348 -10.861 3.194 13.299 945 HB3 ASP 348 HB3 ASP 348 -11.467 1.982 12.177 946 HA PRO 349 HA PRO 349 -12.054 -2.804 13.917 947 HB2 PRO 349 HB2 PRO 349 -12.828 -3.385 16.587 948 HB3 PRO 349 HB3 PRO 349 -11.340 -3.880 15.771 949 HG2 PRO 349 HG2 PRO 349 -11.666 -1.974 17.860 950 HG3 PRO 349 HG3 PRO 349 -10.177 -2.491 17.066 951 HD2 PRO 349 HD2 PRO 349 -11.619 0.009 16.748 952 HD3 PRO 349 HD3 PRO 349 -10.038 -0.453 16.088 953 H GLU 350 H GLU 350 -13.725 -0.722 13.300 954 HA GLU 350 HA GLU 350 -16.345 -1.837 13.999 955 HB2 GLU 350 HB2 GLU 350 -15.304 0.706 14.978 956 HB3 GLU 350 HB3 GLU 350 -16.798 0.923 14.071 957 HG2 GLU 350 HG2 GLU 350 -17.992 -0.580 15.492 958 HG3 GLU 350 HG3 GLU 350 -16.510 -1.189 16.217 Start of MODEL 3 1 H1 GLY 661 H1 GLY 661 2.211 -13.458 -8.710 2 H2 GLY 661 H2 GLY 661 0.794 -12.561 -8.376 3 H3 GLY 661 H3 GLY 661 2.173 -11.773 -8.993 4 HA2 GLY 661 HA2 GLY 661 0.275 -12.276 -10.620 5 HA3 GLY 661 HA3 GLY 661 1.917 -12.698 -11.112 6 H HIS 662 H HIS 662 2.421 -14.817 -11.499 7 HA HIS 662 HA HIS 662 0.385 -16.724 -11.901 8 HB2 HIS 662 HB2 HIS 662 2.606 -16.748 -13.035 9 HB3 HIS 662 HB3 HIS 662 3.346 -17.242 -11.514 10 HD1 HIS 662 HD1 HIS 662 0.696 -19.091 -10.847 11 HD2 HIS 662 HD2 HIS 662 3.252 -19.340 -14.146 12 HE1 HIS 662 HE1 HIS 662 0.480 -21.454 -11.761 13 HE2 HIS 662 HE2 HIS 662 2.031 -21.619 -13.765 14 H MET 663 H MET 663 2.418 -16.011 -9.149 15 HA MET 663 HA MET 663 0.842 -17.895 -7.519 16 HB2 MET 663 HB2 MET 663 3.857 -17.769 -7.729 17 HB3 MET 663 HB3 MET 663 3.054 -18.412 -6.295 18 HG2 MET 663 HG2 MET 663 1.755 -19.942 -7.873 19 HG3 MET 663 HG3 MET 663 2.885 -19.451 -9.135 20 HE1 MET 663 HE1 MET 663 5.023 -21.416 -9.505 21 HE2 MET 663 HE2 MET 663 5.016 -19.668 -9.300 22 HE3 MET 663 HE3 MET 663 6.164 -20.663 -8.391 23 H GLN 664 H GLN 664 -0.074 -15.628 -7.302 24 HA GLN 664 HA GLN 664 -0.504 -13.851 -5.912 25 HB2 GLN 664 HB2 GLN 664 0.688 -15.709 -4.247 26 HB3 GLN 664 HB3 GLN 664 1.701 -14.283 -4.024 27 HG2 GLN 664 HG2 GLN 664 -0.135 -14.210 -2.420 28 HG3 GLN 664 HG3 GLN 664 -0.357 -12.930 -3.608 29 HE21 GLN 664 HE21 GLN 664 -2.652 -13.542 -2.372 30 HE22 GLN 664 HE22 GLN 664 -3.650 -14.542 -3.328 31 H ASP 665 H ASP 665 3.002 -14.469 -6.072 32 HA ASP 665 HA ASP 665 4.543 -12.511 -5.872 33 HB2 ASP 665 HB2 ASP 665 4.565 -12.519 -8.728 34 HB3 ASP 665 HB3 ASP 665 5.666 -13.323 -7.620 35 H LEU 666 H LEU 666 3.572 -10.610 -5.189 36 HA LEU 666 HA LEU 666 1.948 -9.045 -6.998 37 HB2 LEU 666 HB2 LEU 666 3.144 -8.213 -4.351 38 HB3 LEU 666 HB3 LEU 666 1.779 -7.473 -5.179 39 HG LEU 666 HG LEU 666 1.772 -10.371 -4.304 40 HD11 LEU 666 HD11 LEU 666 2.077 -8.902 -2.340 41 HD12 LEU 666 HD12 LEU 666 0.676 -7.956 -2.840 42 HD13 LEU 666 HD13 LEU 666 0.475 -9.639 -2.353 43 HD21 LEU 666 HD21 LEU 666 0.088 -9.982 -5.932 44 HD22 LEU 666 HD22 LEU 666 -0.754 -9.843 -4.390 45 HD23 LEU 666 HD23 LEU 666 -0.294 -8.390 -5.278 46 H SER 667 H SER 667 5.270 -9.478 -6.522 47 HA SER 667 HA SER 667 6.323 -6.914 -6.895 48 HB2 SER 667 HB2 SER 667 8.279 -8.207 -7.942 49 HB3 SER 667 HB3 SER 667 7.841 -8.610 -6.282 50 HG SER 667 HG SER 667 8.125 -10.404 -7.868 51 H VAL 668 H VAL 668 4.682 -8.983 -9.126 52 HA VAL 668 HA VAL 668 5.770 -7.896 -11.529 53 HB VAL 668 HB VAL 668 3.991 -9.048 -12.665 54 HG11 VAL 668 HG11 VAL 668 4.138 -11.079 -10.620 55 HG12 VAL 668 HG12 VAL 668 4.967 -11.016 -12.174 56 HG13 VAL 668 HG13 VAL 668 5.695 -10.266 -10.755 57 HG21 VAL 668 HG21 VAL 668 2.315 -8.204 -10.748 58 HG22 VAL 668 HG22 VAL 668 1.953 -9.620 -11.731 59 HG23 VAL 668 HG23 VAL 668 2.629 -9.817 -10.115 60 H HIS 669 H HIS 669 3.726 -6.544 -9.199 61 HA HIS 669 HA HIS 669 2.302 -4.824 -11.094 62 HB2 HIS 669 HB2 HIS 669 2.212 -4.700 -8.080 63 HB3 HIS 669 HB3 HIS 669 1.037 -4.059 -9.231 64 HD1 HIS 669 HD1 HIS 669 0.350 -6.217 -11.057 65 HD2 HIS 669 HD2 HIS 669 1.186 -7.040 -7.061 66 HE1 HIS 669 HE1 HIS 669 -0.658 -8.493 -10.575 67 HE2 HIS 669 HE2 HIS 669 -0.169 -9.005 -8.134 68 H LEU 670 H LEU 670 2.997 -2.924 -11.702 69 HA LEU 670 HA LEU 670 5.450 -1.825 -11.183 70 HB2 LEU 670 HB2 LEU 670 3.999 -1.137 -13.039 71 HB3 LEU 670 HB3 LEU 670 2.904 -0.353 -11.903 72 HG LEU 670 HG LEU 670 4.731 1.173 -11.206 73 HD11 LEU 670 HD11 LEU 670 6.281 -0.360 -13.308 74 HD12 LEU 670 HD12 LEU 670 6.782 1.218 -12.692 75 HD13 LEU 670 HD13 LEU 670 6.690 -0.169 -11.603 76 HD21 LEU 670 HD21 LEU 670 4.723 2.533 -13.178 77 HD22 LEU 670 HD22 LEU 670 4.496 1.131 -14.222 78 HD23 LEU 670 HD23 LEU 670 3.188 1.665 -13.167 79 H TRP 671 H TRP 671 2.506 -1.433 -9.257 80 HA TRP 671 HA TRP 671 3.722 0.670 -7.678 81 HB2 TRP 671 HB2 TRP 671 1.617 0.165 -6.189 82 HB3 TRP 671 HB3 TRP 671 1.464 1.051 -7.698 83 HD1 TRP 671 HD1 TRP 671 0.037 0.003 -9.584 84 HE1 TRP 671 HE1 TRP 671 -1.416 -2.144 -9.773 85 HE3 TRP 671 HE3 TRP 671 1.552 -2.448 -5.355 86 HZ2 TRP 671 HZ2 TRP 671 -1.826 -4.547 -8.329 87 HZ3 TRP 671 HZ3 TRP 671 0.603 -4.668 -4.793 88 HH2 TRP 671 HH2 TRP 671 -1.083 -5.721 -6.276 89 H TYR 672 H TYR 672 4.331 -2.535 -7.793 90 HA TYR 672 HA TYR 672 4.441 -2.945 -4.905 91 HB2 TYR 672 HB2 TYR 672 3.972 -4.712 -6.848 92 HB3 TYR 672 HB3 TYR 672 5.728 -4.878 -6.758 93 HD1 TYR 672 HD2 TYR 672 2.675 -4.746 -4.619 94 HD2 TYR 672 HD1 TYR 672 6.710 -6.145 -5.032 95 HE1 TYR 672 HE2 TYR 672 2.444 -6.028 -2.507 96 HE2 TYR 672 HE1 TYR 672 6.487 -7.419 -2.923 97 HH TYR 672 HH TYR 672 4.134 -6.877 -0.694 98 H ALA 673 H ALA 673 6.038 -2.201 -3.741 99 HA ALA 673 HA ALA 673 8.615 -1.551 -4.968 100 HB1 ALA 673 HB1 ALA 673 9.055 -0.343 -2.938 101 HB2 ALA 673 HB2 ALA 673 7.691 -1.114 -2.126 102 HB3 ALA 673 HB3 ALA 673 7.407 0.027 -3.439 103 H GLY 674 H GLY 674 7.279 -4.246 -3.691 104 HA2 GLY 674 HA2 GLY 674 8.048 -6.203 -2.749 105 HA3 GLY 674 HA3 GLY 674 9.505 -5.850 -3.653 106 HA PRO 675 HA PRO 675 11.513 -5.945 0.298 107 HB2 PRO 675 HB2 PRO 675 13.928 -4.918 -0.460 108 HB3 PRO 675 HB3 PRO 675 13.400 -6.565 -0.859 109 HG2 PRO 675 HG2 PRO 675 13.344 -4.103 -2.547 110 HG3 PRO 675 HG3 PRO 675 13.824 -5.755 -2.980 111 HD2 PRO 675 HD2 PRO 675 11.378 -4.752 -3.623 112 HD3 PRO 675 HD3 PRO 675 11.630 -6.470 -3.246 113 H MET 676 H MET 676 10.784 -3.013 -1.338 114 HA MET 676 HA MET 676 12.134 -1.119 0.230 115 HB2 MET 676 HB2 MET 676 10.830 -0.618 -1.837 116 HB3 MET 676 HB3 MET 676 9.349 -0.838 -0.904 117 HG2 MET 676 HG2 MET 676 10.225 1.578 -1.159 118 HG3 MET 676 HG3 MET 676 9.791 1.048 0.464 119 HE1 MET 676 HE1 MET 676 13.135 3.006 -1.109 120 HE2 MET 676 HE2 MET 676 13.590 1.416 -1.716 121 HE3 MET 676 HE3 MET 676 11.977 2.065 -2.042 122 H GLU 677 H GLU 677 11.275 0.269 1.916 123 HA GLU 677 HA GLU 677 9.578 -1.227 3.824 124 HB2 GLU 677 HB2 GLU 677 10.750 0.272 5.531 125 HB3 GLU 677 HB3 GLU 677 11.743 -0.967 4.765 126 HG2 GLU 677 HG2 GLU 677 13.021 0.557 3.658 127 HG3 GLU 677 HG3 GLU 677 11.644 1.595 3.302 128 H ARG 678 H ARG 678 8.917 0.705 5.587 129 HA ARG 678 HA ARG 678 6.851 2.130 4.206 130 HB2 ARG 678 HB2 ARG 678 6.505 1.313 6.476 131 HB3 ARG 678 HB3 ARG 678 7.811 2.340 7.069 132 HG2 ARG 678 HG2 ARG 678 5.645 3.664 5.505 133 HG3 ARG 678 HG3 ARG 678 5.241 3.129 7.132 134 HD2 ARG 678 HD2 ARG 678 7.764 4.367 7.362 135 HD3 ARG 678 HD3 ARG 678 6.819 5.412 6.299 136 HE ARG 678 HE ARG 678 5.432 4.512 8.717 137 HH11 ARG 678 HH21 ARG 678 7.349 6.990 7.158 138 HH12 ARG 678 HH22 ARG 678 6.901 8.196 8.309 139 HH21 ARG 678 HH11 ARG 678 4.916 6.089 10.196 140 HH22 ARG 678 HH12 ARG 678 5.537 7.711 9.995 141 H ALA 679 H ALA 679 9.502 3.341 6.267 142 HA ALA 679 HA ALA 679 9.308 6.032 5.538 143 HB1 ALA 679 HB1 ALA 679 12.027 4.945 6.041 144 HB2 ALA 679 HB2 ALA 679 10.825 4.685 7.307 145 HB3 ALA 679 HB3 ALA 679 11.210 6.323 6.777 146 H GLY 680 H GLY 680 10.994 3.344 4.052 147 HA2 GLY 680 HA2 GLY 680 12.458 4.788 2.092 148 HA3 GLY 680 HA3 GLY 680 12.008 3.086 1.987 149 H ALA 681 H ALA 681 9.262 3.220 2.055 150 HA ALA 681 HA ALA 681 8.526 3.694 -0.580 151 HB1 ALA 681 HB1 ALA 681 6.160 3.846 0.422 152 HB2 ALA 681 HB2 ALA 681 6.939 3.620 1.985 153 HB3 ALA 681 HB3 ALA 681 7.075 2.376 0.746 154 H GLU 682 H GLU 682 8.422 5.811 2.233 155 HA GLU 682 HA GLU 682 7.098 8.003 1.027 156 HB2 GLU 682 HB2 GLU 682 9.178 8.397 3.152 157 HB3 GLU 682 HB3 GLU 682 7.607 9.178 2.969 158 HG2 GLU 682 HG2 GLU 682 6.643 6.804 3.369 159 HG3 GLU 682 HG3 GLU 682 8.221 6.424 4.010 160 H SER 683 H SER 683 10.495 7.086 1.302 161 HA SER 683 HA SER 683 11.832 9.310 0.475 162 HB2 SER 683 HB2 SER 683 12.720 6.920 0.956 163 HB3 SER 683 HB3 SER 683 12.501 6.661 -0.773 164 HG SER 683 HG SER 683 13.722 8.746 -0.950 165 H ILE 684 H ILE 684 10.033 7.066 -1.556 166 HA ILE 684 HA ILE 684 10.619 8.664 -3.950 167 HB ILE 684 HB ILE 684 8.818 6.247 -3.829 168 HG12 ILE 684 HG12 ILE 684 11.322 5.363 -4.682 169 HG13 ILE 684 HG13 ILE 684 11.696 6.399 -3.303 170 HG21 ILE 684 HG21 ILE 684 10.648 6.636 -6.087 171 HG22 ILE 684 HG22 ILE 684 8.909 6.358 -6.089 172 HG23 ILE 684 HG23 ILE 684 9.541 7.988 -5.865 173 HD11 ILE 684 HD11 ILE 684 11.279 4.411 -2.199 174 HD12 ILE 684 HD12 ILE 684 9.654 5.096 -2.209 175 HD13 ILE 684 HD13 ILE 684 10.102 3.870 -3.394 176 H LEU 685 H LEU 685 7.835 7.528 -2.058 177 HA LEU 685 HA LEU 685 5.844 8.896 -3.500 178 HB2 LEU 685 HB2 LEU 685 5.958 8.027 -0.608 179 HB3 LEU 685 HB3 LEU 685 4.505 8.653 -1.385 180 HG LEU 685 HG LEU 685 6.065 6.182 -2.182 181 HD11 LEU 685 HD11 LEU 685 4.645 5.892 -0.194 182 HD12 LEU 685 HD12 LEU 685 3.270 6.569 -1.068 183 HD13 LEU 685 HD13 LEU 685 3.959 5.026 -1.568 184 HD21 LEU 685 HD21 LEU 685 3.828 7.694 -3.505 185 HD22 LEU 685 HD22 LEU 685 5.266 6.981 -4.234 186 HD23 LEU 685 HD23 LEU 685 3.941 5.947 -3.703 187 H ALA 686 H ALA 686 7.717 9.864 -0.619 188 HA ALA 686 HA ALA 686 6.465 12.314 -0.120 189 HB1 ALA 686 HB1 ALA 686 8.196 11.195 1.325 190 HB2 ALA 686 HB2 ALA 686 8.458 12.923 1.087 191 HB3 ALA 686 HB3 ALA 686 9.423 11.754 0.187 192 H ASN 687 H ASN 687 9.030 11.483 -2.410 193 HA ASN 687 HA ASN 687 9.397 14.209 -3.295 194 HB2 ASN 687 HB2 ASN 687 11.153 12.360 -3.325 195 HB3 ASN 687 HB3 ASN 687 10.304 11.711 -4.724 196 HD21 ASN 687 HD21 ASN 687 9.583 14.381 -5.834 197 HD22 ASN 687 HD22 ASN 687 11.043 15.040 -6.407 198 H ARG 688 H ARG 688 7.314 11.557 -4.180 199 HA ARG 688 HA ARG 688 6.716 12.642 -6.810 200 HB2 ARG 688 HB2 ARG 688 6.438 10.131 -5.570 201 HB3 ARG 688 HB3 ARG 688 4.797 10.690 -5.893 202 HG2 ARG 688 HG2 ARG 688 5.421 9.603 -7.898 203 HG3 ARG 688 HG3 ARG 688 5.685 11.312 -8.248 204 HD2 ARG 688 HD2 ARG 688 8.100 10.921 -7.438 205 HD3 ARG 688 HD3 ARG 688 7.742 9.204 -7.580 206 HE ARG 688 HE ARG 688 7.757 11.144 -9.814 207 HH11 ARG 688 HH21 ARG 688 7.751 7.880 -8.639 208 HH12 ARG 688 HH22 ARG 688 8.045 7.189 -10.216 209 HH21 ARG 688 HH11 ARG 688 8.084 10.210 -11.833 210 HH22 ARG 688 HH12 ARG 688 8.142 8.479 -11.998 211 H SER 689 H SER 689 4.272 12.827 -7.363 212 HA SER 689 HA SER 689 3.245 14.971 -5.730 213 HB2 SER 689 HB2 SER 689 3.016 14.377 -8.390 214 HB3 SER 689 HB3 SER 689 1.445 13.862 -7.775 215 HG SER 689 HG SER 689 1.100 15.908 -6.961 216 H ASP 690 H ASP 690 0.864 15.038 -5.333 217 HA ASP 690 HA ASP 690 0.146 13.168 -3.356 218 HB2 ASP 690 HB2 ASP 690 -2.159 14.351 -3.777 219 HB3 ASP 690 HB3 ASP 690 -0.814 15.264 -3.103 220 H GLY 691 H GLY 691 -0.870 11.262 -3.453 221 HA2 GLY 691 HA2 GLY 691 -2.664 9.876 -4.354 222 HA3 GLY 691 HA3 GLY 691 -2.355 10.581 -5.936 223 H THR 692 H THR 692 0.605 10.398 -5.306 224 HA THR 692 HA THR 692 1.182 8.011 -6.679 225 HB THR 692 HB THR 692 3.099 9.333 -4.758 226 HG1 THR 692 HG1 THR 692 2.401 11.060 -5.872 227 HG21 THR 692 HG21 THR 692 3.759 8.397 -7.519 228 HG22 THR 692 HG22 THR 692 4.752 8.374 -6.057 229 HG23 THR 692 HG23 THR 692 3.478 7.171 -6.277 230 H PHE 693 H PHE 693 1.512 5.923 -6.000 231 HA PHE 693 HA PHE 693 1.656 5.447 -3.091 232 HB2 PHE 693 HB2 PHE 693 -0.128 3.856 -3.137 233 HB3 PHE 693 HB3 PHE 693 -0.721 5.325 -3.910 234 HD1 PHE 693 HD1 PHE 693 -0.530 5.480 -6.491 235 HD2 PHE 693 HD2 PHE 693 -0.186 1.805 -4.291 236 HE1 PHE 693 HE1 PHE 693 -1.037 4.200 -8.551 237 HE2 PHE 693 HE2 PHE 693 -0.694 0.529 -6.352 238 HZ PHE 693 HZ PHE 693 -1.118 1.724 -8.482 239 H LEU 694 H LEU 694 1.799 2.979 -2.694 240 HA LEU 694 HA LEU 694 2.984 1.270 -4.602 241 HB2 LEU 694 HB2 LEU 694 5.290 1.252 -3.902 242 HB3 LEU 694 HB3 LEU 694 4.855 2.884 -4.372 243 HG LEU 694 HG LEU 694 4.223 2.990 -1.750 244 HD11 LEU 694 HD11 LEU 694 5.261 1.433 -0.492 245 HD12 LEU 694 HD12 LEU 694 5.587 0.552 -1.981 246 HD13 LEU 694 HD13 LEU 694 6.786 1.676 -1.342 247 HD21 LEU 694 HD21 LEU 694 7.029 3.369 -2.823 248 HD22 LEU 694 HD22 LEU 694 5.706 4.497 -3.102 249 HD23 LEU 694 HD23 LEU 694 6.290 4.216 -1.469 250 H VAL 695 H VAL 695 3.928 -0.675 -3.605 251 HA VAL 695 HA VAL 695 3.145 -1.161 -0.803 252 HB VAL 695 HB VAL 695 2.377 -3.175 -2.902 253 HG11 VAL 695 HG11 VAL 695 1.524 -2.516 -0.070 254 HG12 VAL 695 HG12 VAL 695 0.651 -3.657 -1.093 255 HG13 VAL 695 HG13 VAL 695 2.324 -3.979 -0.639 256 HG21 VAL 695 HG21 VAL 695 0.731 -0.815 -1.940 257 HG22 VAL 695 HG22 VAL 695 1.262 -1.110 -3.595 258 HG23 VAL 695 HG23 VAL 695 0.080 -2.182 -2.841 259 H ARG 696 H ARG 696 4.420 -2.705 0.234 260 HA ARG 696 HA ARG 696 6.520 -3.987 -1.414 261 HB2 ARG 696 HB2 ARG 696 8.080 -3.595 0.494 262 HB3 ARG 696 HB3 ARG 696 7.523 -2.110 -0.270 263 HG2 ARG 696 HG2 ARG 696 5.731 -2.994 1.859 264 HG3 ARG 696 HG3 ARG 696 7.360 -2.714 2.439 265 HD2 ARG 696 HD2 ARG 696 6.882 -0.518 2.478 266 HD3 ARG 696 HD3 ARG 696 6.848 -0.567 0.712 267 HE ARG 696 HE ARG 696 4.373 -1.498 1.551 268 HH11 ARG 696 HH21 ARG 696 6.234 1.387 1.900 269 HH12 ARG 696 HH22 ARG 696 4.824 2.399 2.021 270 HH21 ARG 696 HH11 ARG 696 2.617 -0.203 1.681 271 HH22 ARG 696 HH12 ARG 696 2.824 1.521 1.883 272 H GLN 697 H GLN 697 7.567 -5.832 -0.388 273 HA GLN 697 HA GLN 697 5.700 -7.352 1.346 274 HB2 GLN 697 HB2 GLN 697 6.377 -8.081 -1.142 275 HB3 GLN 697 HB3 GLN 697 7.743 -8.778 -0.287 276 HG2 GLN 697 HG2 GLN 697 4.917 -9.235 0.676 277 HG3 GLN 697 HG3 GLN 697 5.607 -10.240 -0.590 278 HE21 GLN 697 HE21 GLN 697 8.367 -9.886 0.796 279 HE22 GLN 697 HE22 GLN 697 8.304 -10.971 2.102 280 H ARG 698 H ARG 698 8.788 -5.977 1.023 281 HA ARG 698 HA ARG 698 10.419 -5.720 2.645 282 HB2 ARG 698 HB2 ARG 698 8.432 -6.873 4.178 283 HB3 ARG 698 HB3 ARG 698 9.763 -8.018 4.341 284 HG2 ARG 698 HG2 ARG 698 9.922 -6.300 6.085 285 HG3 ARG 698 HG3 ARG 698 11.271 -6.133 4.961 286 HD2 ARG 698 HD2 ARG 698 8.810 -4.612 4.285 287 HD3 ARG 698 HD3 ARG 698 9.697 -4.048 5.699 288 HE ARG 698 HE ARG 698 10.535 -3.838 2.939 289 HH11 ARG 698 HH21 ARG 698 11.580 -4.098 6.216 290 HH12 ARG 698 HH22 ARG 698 13.120 -3.373 5.919 291 HH21 ARG 698 HH11 ARG 698 12.553 -2.996 2.527 292 HH22 ARG 698 HH12 ARG 698 13.674 -2.751 3.835 293 H VAL 699 H VAL 699 12.437 -6.674 3.052 294 HA VAL 699 HA VAL 699 13.326 -8.442 1.044 295 HB VAL 699 HB VAL 699 15.033 -8.262 3.440 296 HG11 VAL 699 HG11 VAL 699 16.696 -7.853 1.836 297 HG12 VAL 699 HG12 VAL 699 15.572 -8.903 0.976 298 HG13 VAL 699 HG13 VAL 699 15.554 -7.162 0.687 299 HG21 VAL 699 HG21 VAL 699 13.996 -5.785 2.032 300 HG22 VAL 699 HG22 VAL 699 13.961 -6.132 3.762 301 HG23 VAL 699 HG23 VAL 699 15.497 -5.811 2.957 302 H LYS 700 H LYS 700 11.280 -9.860 2.090 303 HA LYS 700 HA LYS 700 12.407 -12.388 2.592 304 HB2 LYS 700 HB2 LYS 700 12.778 -11.083 4.856 305 HB3 LYS 700 HB3 LYS 700 11.072 -11.448 5.109 306 HG2 LYS 700 HG2 LYS 700 12.807 -13.693 4.180 307 HG3 LYS 700 HG3 LYS 700 13.029 -13.147 5.842 308 HD2 LYS 700 HD2 LYS 700 10.777 -13.620 6.422 309 HD3 LYS 700 HD3 LYS 700 10.281 -13.739 4.735 310 HE2 LYS 700 HE2 LYS 700 12.415 -15.621 5.294 311 HE3 LYS 700 HE3 LYS 700 11.073 -15.856 6.415 312 HZ1 LYS 700 HZ1 LYS 700 11.007 -15.899 3.430 313 HZ2 LYS 700 HZ2 LYS 700 10.567 -17.142 4.524 314 HZ3 LYS 700 HZ3 LYS 700 9.584 -15.755 4.383 315 H ASP 701 H ASP 701 10.921 -13.939 2.219 316 HA ASP 701 HA ASP 701 8.231 -13.157 1.518 317 HB2 ASP 701 HB2 ASP 701 8.013 -15.631 1.051 318 HB3 ASP 701 HB3 ASP 701 9.314 -14.831 0.174 319 H ALA 702 H ALA 702 6.743 -12.824 3.071 320 HA ALA 702 HA ALA 702 6.165 -14.896 5.003 321 HB1 ALA 702 HB1 ALA 702 7.659 -14.078 6.518 322 HB2 ALA 702 HB2 ALA 702 6.380 -12.906 6.832 323 HB3 ALA 702 HB3 ALA 702 7.716 -12.487 5.760 324 H ALA 703 H ALA 703 4.790 -13.501 2.864 325 HA ALA 703 HA ALA 703 2.796 -12.445 2.399 326 HB1 ALA 703 HB1 ALA 703 1.775 -14.318 3.417 327 HB2 ALA 703 HB2 ALA 703 1.001 -12.928 4.178 328 HB3 ALA 703 HB3 ALA 703 2.264 -13.812 5.035 329 H GLU 704 H GLU 704 4.745 -10.724 3.404 330 HA GLU 704 HA GLU 704 3.441 -8.995 5.380 331 HB2 GLU 704 HB2 GLU 704 6.068 -9.584 4.947 332 HB3 GLU 704 HB3 GLU 704 5.922 -8.096 4.013 333 HG2 GLU 704 HG2 GLU 704 4.752 -8.156 6.776 334 HG3 GLU 704 HG3 GLU 704 6.501 -8.031 6.607 335 H PHE 705 H PHE 705 2.207 -7.257 4.782 336 HA PHE 705 HA PHE 705 2.732 -5.958 2.234 337 HB2 PHE 705 HB2 PHE 705 0.065 -6.176 1.889 338 HB3 PHE 705 HB3 PHE 705 1.233 -7.269 1.161 339 HD1 PHE 705 HD1 PHE 705 -0.239 -6.927 4.613 340 HD2 PHE 705 HD2 PHE 705 0.508 -9.468 1.232 341 HE1 PHE 705 HE1 PHE 705 -1.284 -8.828 5.811 342 HE2 PHE 705 HE2 PHE 705 -0.534 -11.372 2.435 343 HZ PHE 705 HZ PHE 705 -1.429 -11.050 4.722 344 H ALA 706 H ALA 706 1.696 -3.981 1.936 345 HA ALA 706 HA ALA 706 -0.104 -2.676 3.636 346 HB1 ALA 706 HB1 ALA 706 2.783 -2.526 4.461 347 HB2 ALA 706 HB2 ALA 706 1.354 -2.728 5.472 348 HB3 ALA 706 HB3 ALA 706 1.703 -1.159 4.747 349 H ILE 707 H ILE 707 -0.792 -1.003 2.418 350 HA ILE 707 HA ILE 707 0.909 -0.163 0.185 351 HB ILE 707 HB ILE 707 -1.933 0.711 0.690 352 HG12 ILE 707 HG12 ILE 707 -0.982 -1.737 -0.836 353 HG13 ILE 707 HG13 ILE 707 -1.752 -1.781 0.748 354 HG21 ILE 707 HG21 ILE 707 -1.411 0.345 -2.033 355 HG22 ILE 707 HG22 ILE 707 -1.466 1.888 -1.182 356 HG23 ILE 707 HG23 ILE 707 0.073 1.058 -1.404 357 HD11 ILE 707 HD11 ILE 707 -3.113 -1.950 -1.610 358 HD12 ILE 707 HD12 ILE 707 -3.817 -1.378 -0.099 359 HD13 ILE 707 HD13 ILE 707 -3.216 -0.220 -1.286 360 H SER 708 H SER 708 1.630 1.831 -0.194 361 HA SER 708 HA SER 708 1.134 3.874 1.897 362 HB2 SER 708 HB2 SER 708 3.707 3.263 0.436 363 HB3 SER 708 HB3 SER 708 3.455 4.672 1.471 364 HG SER 708 HG SER 708 2.624 2.811 2.969 365 H ILE 709 H ILE 709 0.295 5.720 1.171 366 HA ILE 709 HA ILE 709 0.617 6.355 -1.702 367 HB ILE 709 HB ILE 709 -1.880 6.964 -0.131 368 HG12 ILE 709 HG12 ILE 709 -2.620 4.925 -1.762 369 HG13 ILE 709 HG13 ILE 709 -0.976 4.421 -1.378 370 HG21 ILE 709 HG21 ILE 709 -2.639 7.839 -2.078 371 HG22 ILE 709 HG22 ILE 709 -0.957 7.833 -2.599 372 HG23 ILE 709 HG23 ILE 709 -2.018 6.493 -3.026 373 HD11 ILE 709 HD11 ILE 709 -1.537 3.871 0.742 374 HD12 ILE 709 HD12 ILE 709 -2.420 5.377 0.980 375 HD13 ILE 709 HD13 ILE 709 -3.213 4.004 0.214 376 H LYS 710 H LYS 710 0.868 8.421 -2.289 377 HA LYS 710 HA LYS 710 1.804 10.303 -0.291 378 HB2 LYS 710 HB2 LYS 710 2.884 10.092 -2.499 379 HB3 LYS 710 HB3 LYS 710 1.396 10.605 -3.276 380 HG2 LYS 710 HG2 LYS 710 2.854 12.531 -3.110 381 HG3 LYS 710 HG3 LYS 710 1.524 12.753 -1.977 382 HD2 LYS 710 HD2 LYS 710 2.873 12.305 -0.110 383 HD3 LYS 710 HD3 LYS 710 4.088 11.466 -1.068 384 HE2 LYS 710 HE2 LYS 710 3.515 14.392 -1.517 385 HE3 LYS 710 HE3 LYS 710 4.631 13.871 -0.251 386 HZ1 LYS 710 HZ1 LYS 710 4.927 13.757 -3.161 387 HZ2 LYS 710 HZ2 LYS 710 6.122 13.940 -1.936 388 HZ3 LYS 710 HZ3 LYS 710 5.486 12.393 -2.296 389 H TYR 711 H TYR 711 0.488 11.599 0.816 390 HA TYR 711 HA TYR 711 -1.837 12.813 -0.546 391 HB2 TYR 711 HB2 TYR 711 -2.258 10.718 1.084 392 HB3 TYR 711 HB3 TYR 711 -2.196 11.997 2.294 393 HD1 TYR 711 HD2 TYR 711 -3.470 14.270 1.345 394 HD2 TYR 711 HD1 TYR 711 -4.393 10.198 0.364 395 HE1 TYR 711 HE2 TYR 711 -5.778 14.942 0.745 396 HE2 TYR 711 HE1 TYR 711 -6.705 10.870 -0.238 397 HH TYR 711 HH TYR 711 -8.054 12.677 -0.722 398 H ASN 712 H ASN 712 -1.715 14.962 -0.336 399 HA ASN 712 HA ASN 712 -1.039 17.040 0.406 400 HB2 ASN 712 HB2 ASN 712 -1.857 15.598 2.915 401 HB3 ASN 712 HB3 ASN 712 -1.254 17.251 2.988 402 HD21 ASN 712 HD21 ASN 712 -3.159 18.443 3.332 403 HD22 ASN 712 HD22 ASN 712 -4.515 18.370 2.315 404 H VAL 713 H VAL 713 1.139 16.282 -0.404 405 HA VAL 713 HA VAL 713 3.409 15.988 -0.192 406 HB VAL 713 HB VAL 713 4.518 17.660 1.152 407 HG11 VAL 713 HG11 VAL 713 2.006 18.392 -0.298 408 HG12 VAL 713 HG12 VAL 713 2.853 19.658 0.588 409 HG13 VAL 713 HG13 VAL 713 3.681 18.773 -0.691 410 HG21 VAL 713 HG21 VAL 713 2.973 17.201 3.182 411 HG22 VAL 713 HG22 VAL 713 3.496 18.863 2.915 412 HG23 VAL 713 HG23 VAL 713 1.874 18.361 2.436 413 H GLU 714 H GLU 714 1.634 14.247 1.544 414 HA GLU 714 HA GLU 714 3.805 13.230 3.245 415 HB2 GLU 714 HB2 GLU 714 1.181 14.226 4.096 416 HB3 GLU 714 HB3 GLU 714 1.569 12.615 4.709 417 HG2 GLU 714 HG2 GLU 714 3.574 14.862 4.824 418 HG3 GLU 714 HG3 GLU 714 2.378 14.640 6.098 419 H VAL 715 H VAL 715 3.457 10.964 3.934 420 HA VAL 715 HA VAL 715 2.044 9.485 1.791 421 HB VAL 715 HB VAL 715 4.327 8.488 3.493 422 HG11 VAL 715 HG11 VAL 715 2.882 6.766 2.462 423 HG12 VAL 715 HG12 VAL 715 3.110 7.524 0.885 424 HG13 VAL 715 HG13 VAL 715 4.479 6.787 1.715 425 HG21 VAL 715 HG21 VAL 715 4.313 10.362 1.281 426 HG22 VAL 715 HG22 VAL 715 5.678 9.786 2.238 427 HG23 VAL 715 HG23 VAL 715 5.145 8.881 0.826 428 H LYS 716 H LYS 716 0.533 7.997 2.263 429 HA LYS 716 HA LYS 716 -0.082 7.569 5.130 430 HB2 LYS 716 HB2 LYS 716 -1.786 8.496 3.305 431 HB3 LYS 716 HB3 LYS 716 -1.998 6.776 2.982 432 HG2 LYS 716 HG2 LYS 716 -2.988 6.362 5.024 433 HG3 LYS 716 HG3 LYS 716 -2.005 7.569 5.851 434 HD2 LYS 716 HD2 LYS 716 -4.383 8.151 4.054 435 HD3 LYS 716 HD3 LYS 716 -4.346 8.292 5.789 436 HE2 LYS 716 HE2 LYS 716 -2.259 9.875 5.253 437 HE3 LYS 716 HE3 LYS 716 -3.126 10.063 3.728 438 HZ1 LYS 716 HZ1 LYS 716 -5.043 10.238 5.758 439 HZ2 LYS 716 HZ2 LYS 716 -3.711 11.198 6.252 440 HZ3 LYS 716 HZ3 LYS 716 -4.451 11.495 4.756 441 H HIS 717 H HIS 717 0.795 5.762 5.886 442 HA HIS 717 HA HIS 717 0.956 3.368 4.157 443 HB2 HIS 717 HB2 HIS 717 2.318 3.740 6.828 444 HB3 HIS 717 HB3 HIS 717 2.706 2.579 5.565 445 HD1 HIS 717 HD1 HIS 717 3.919 3.506 3.409 446 HD2 HIS 717 HD2 HIS 717 3.497 6.274 6.512 447 HE1 HIS 717 HE1 HIS 717 5.573 5.368 2.953 448 HE2 HIS 717 HE2 HIS 717 5.282 7.112 4.811 449 H ILE 718 H ILE 718 -0.823 2.090 4.421 450 HA ILE 718 HA ILE 718 -1.809 1.666 7.191 451 HB ILE 718 HB ILE 718 -3.231 1.915 4.577 452 HG12 ILE 718 HG12 ILE 718 -3.114 3.718 6.340 453 HG13 ILE 718 HG13 ILE 718 -4.742 3.242 5.869 454 HG21 ILE 718 HG21 ILE 718 -5.212 0.775 5.633 455 HG22 ILE 718 HG22 ILE 718 -3.894 -0.324 5.232 456 HG23 ILE 718 HG23 ILE 718 -4.137 0.192 6.901 457 HD11 ILE 718 HD11 ILE 718 -3.677 1.639 8.081 458 HD12 ILE 718 HD12 ILE 718 -3.804 3.354 8.459 459 HD13 ILE 718 HD13 ILE 718 -5.227 2.462 7.932 460 H LYS 719 H LYS 719 -1.818 -0.397 7.971 461 HA LYS 719 HA LYS 719 -0.328 -2.365 6.500 462 HB2 LYS 719 HB2 LYS 719 -0.961 -1.887 9.210 463 HB3 LYS 719 HB3 LYS 719 -1.637 -3.468 8.821 464 HG2 LYS 719 HG2 LYS 719 1.163 -2.766 7.954 465 HG3 LYS 719 HG3 LYS 719 0.857 -3.318 9.599 466 HD2 LYS 719 HD2 LYS 719 -0.063 -5.400 8.820 467 HD3 LYS 719 HD3 LYS 719 -0.089 -4.832 7.151 468 HE2 LYS 719 HE2 LYS 719 2.479 -5.066 8.736 469 HE3 LYS 719 HE3 LYS 719 1.836 -6.398 7.771 470 HZ1 LYS 719 HZ1 LYS 719 2.681 -3.715 6.826 471 HZ2 LYS 719 HZ2 LYS 719 3.332 -5.239 6.374 472 HZ3 LYS 719 HZ3 LYS 719 1.752 -4.784 5.862 473 H ILE 720 H ILE 720 -1.020 -4.094 5.395 474 HA ILE 720 HA ILE 720 -3.869 -4.263 4.833 475 HB ILE 720 HB ILE 720 -1.419 -5.547 3.631 476 HG12 ILE 720 HG12 ILE 720 -3.606 -3.723 2.583 477 HG13 ILE 720 HG13 ILE 720 -1.955 -3.243 2.965 478 HG21 ILE 720 HG21 ILE 720 -4.327 -6.100 2.946 479 HG22 ILE 720 HG22 ILE 720 -2.932 -6.689 2.046 480 HG23 ILE 720 HG23 ILE 720 -3.219 -7.253 3.690 481 HD11 ILE 720 HD11 ILE 720 -2.707 -5.306 0.882 482 HD12 ILE 720 HD12 ILE 720 -2.304 -3.629 0.531 483 HD13 ILE 720 HD13 ILE 720 -1.086 -4.702 1.213 484 H MET 721 H MET 721 -5.216 -5.760 5.541 485 HA MET 721 HA MET 721 -4.145 -7.854 7.339 486 HB2 MET 721 HB2 MET 721 -6.135 -5.992 7.749 487 HB3 MET 721 HB3 MET 721 -7.038 -7.433 7.288 488 HG2 MET 721 HG2 MET 721 -6.153 -8.706 9.081 489 HG3 MET 721 HG3 MET 721 -4.837 -7.561 9.354 490 HE1 MET 721 HE1 MET 721 -5.227 -7.934 11.516 491 HE2 MET 721 HE2 MET 721 -5.401 -6.270 12.066 492 HE3 MET 721 HE3 MET 721 -6.593 -7.490 12.533 493 H THR 722 H THR 722 -5.987 -9.680 7.435 494 HA THR 722 HA THR 722 -7.079 -10.450 4.882 495 HB THR 722 HB THR 722 -4.680 -11.083 4.612 496 HG1 THR 722 HG1 THR 722 -6.114 -12.282 3.488 497 HG21 THR 722 HG21 THR 722 -3.618 -11.933 6.408 498 HG22 THR 722 HG22 THR 722 -5.136 -12.159 7.273 499 HG23 THR 722 HG23 THR 722 -4.553 -13.411 6.177 500 H ALA 723 H ALA 723 -7.672 -12.930 5.105 501 HA ALA 723 HA ALA 723 -8.364 -13.791 7.734 502 HB1 ALA 723 HB1 ALA 723 -10.426 -12.436 6.032 503 HB2 ALA 723 HB2 ALA 723 -10.195 -12.369 7.779 504 HB3 ALA 723 HB3 ALA 723 -10.907 -13.801 7.042 505 H GLU 724 H GLU 724 -10.207 -14.221 4.744 506 HA GLU 724 HA GLU 724 -9.487 -17.073 4.789 507 HB2 GLU 724 HB2 GLU 724 -11.594 -15.705 3.112 508 HB3 GLU 724 HB3 GLU 724 -11.451 -17.428 3.476 509 HG2 GLU 724 HG2 GLU 724 -13.021 -16.846 5.062 510 HG3 GLU 724 HG3 GLU 724 -11.557 -16.550 5.984 511 H GLY 725 H GLY 725 -7.403 -15.582 3.992 512 HA2 GLY 725 HA2 GLY 725 -5.782 -15.728 2.314 513 HA3 GLY 725 HA3 GLY 725 -6.984 -16.468 1.261 514 H LEU 726 H LEU 726 -8.280 -13.709 2.624 515 HA LEU 726 HA LEU 726 -7.966 -12.252 0.110 516 HB2 LEU 726 HB2 LEU 726 -9.708 -11.685 2.521 517 HB3 LEU 726 HB3 LEU 726 -9.753 -10.802 0.997 518 HG LEU 726 HG LEU 726 -10.040 -13.778 0.881 519 HD11 LEU 726 HD11 LEU 726 -12.196 -11.870 1.821 520 HD12 LEU 726 HD12 LEU 726 -12.513 -13.503 1.239 521 HD13 LEU 726 HD13 LEU 726 -11.548 -13.255 2.693 522 HD21 LEU 726 HD21 LEU 726 -11.901 -12.755 -0.765 523 HD22 LEU 726 HD22 LEU 726 -10.818 -11.368 -0.687 524 HD23 LEU 726 HD23 LEU 726 -10.217 -12.928 -1.246 525 H TYR 727 H TYR 727 -7.808 -9.824 0.287 526 HA TYR 727 HA TYR 727 -5.787 -9.025 2.330 527 HB2 TYR 727 HB2 TYR 727 -5.961 -8.095 -0.554 528 HB3 TYR 727 HB3 TYR 727 -4.738 -7.620 0.620 529 HD1 TYR 727 HD2 TYR 727 -6.166 -10.565 -1.170 530 HD2 TYR 727 HD1 TYR 727 -2.787 -8.944 0.926 531 HE1 TYR 727 HE2 TYR 727 -4.813 -12.531 -1.835 532 HE2 TYR 727 HE1 TYR 727 -1.433 -10.910 0.253 533 HH TYR 727 HH TYR 727 -2.132 -13.474 -0.429 534 H ARG 728 H ARG 728 -6.052 -7.036 3.286 535 HA ARG 728 HA ARG 728 -7.929 -5.109 2.209 536 HB2 ARG 728 HB2 ARG 728 -9.023 -5.160 4.648 537 HB3 ARG 728 HB3 ARG 728 -9.646 -6.108 3.300 538 HG2 ARG 728 HG2 ARG 728 -8.903 -8.097 4.164 539 HG3 ARG 728 HG3 ARG 728 -7.449 -7.372 4.840 540 HD2 ARG 728 HD2 ARG 728 -8.721 -6.435 6.694 541 HD3 ARG 728 HD3 ARG 728 -10.222 -7.028 5.997 542 HE ARG 728 HE ARG 728 -8.153 -9.017 6.603 543 HH11 ARG 728 HH21 ARG 728 -11.141 -7.484 7.443 544 HH12 ARG 728 HH22 ARG 728 -11.632 -8.755 8.502 545 HH21 ARG 728 HH11 ARG 728 -8.783 -10.654 7.995 546 HH22 ARG 728 HH12 ARG 728 -10.316 -10.540 8.808 547 H ILE 729 H ILE 729 -7.393 -3.100 2.749 548 HA ILE 729 HA ILE 729 -5.038 -2.599 4.322 549 HB ILE 729 HB ILE 729 -6.149 -0.125 3.960 550 HG12 ILE 729 HG12 ILE 729 -8.081 -1.366 2.795 551 HG13 ILE 729 HG13 ILE 729 -7.365 -0.001 1.941 552 HG21 ILE 729 HG21 ILE 729 -4.871 -0.421 1.594 553 HG22 ILE 729 HG22 ILE 729 -4.025 -0.243 3.130 554 HG23 ILE 729 HG23 ILE 729 -4.269 -1.845 2.435 555 HD11 ILE 729 HD11 ILE 729 -7.726 -2.525 0.896 556 HD12 ILE 729 HD12 ILE 729 -6.612 -1.312 0.267 557 HD13 ILE 729 HD13 ILE 729 -6.027 -2.551 1.376 558 H THR 730 H THR 730 -8.449 -2.469 4.754 559 HA THR 730 HA THR 730 -8.076 -1.696 7.579 560 HB THR 730 HB THR 730 -9.154 0.062 6.047 561 HG1 THR 730 HG1 THR 730 -10.270 -0.971 8.442 562 HG21 THR 730 HG21 THR 730 -11.421 -1.937 6.190 563 HG22 THR 730 HG22 THR 730 -11.552 -0.290 5.579 564 HG23 THR 730 HG23 THR 730 -10.541 -1.464 4.734 565 H GLU 731 H GLU 731 -8.960 -3.052 8.993 566 HA GLU 731 HA GLU 731 -9.630 -5.649 8.480 567 HB2 GLU 731 HB2 GLU 731 -10.604 -5.692 10.716 568 HB3 GLU 731 HB3 GLU 731 -9.179 -4.646 10.718 569 HG2 GLU 731 HG2 GLU 731 -11.975 -3.566 10.308 570 HG3 GLU 731 HG3 GLU 731 -11.235 -3.705 11.897 571 H LYS 732 H LYS 732 -11.551 -2.865 7.983 572 HA LYS 732 HA LYS 732 -14.140 -4.026 8.048 573 HB2 LYS 732 HB2 LYS 732 -13.418 -1.579 6.486 574 HB3 LYS 732 HB3 LYS 732 -14.915 -1.942 7.351 575 HG2 LYS 732 HG2 LYS 732 -12.863 -2.130 9.268 576 HG3 LYS 732 HG3 LYS 732 -12.503 -0.684 8.328 577 HD2 LYS 732 HD2 LYS 732 -14.869 0.054 8.663 578 HD3 LYS 732 HD3 LYS 732 -15.104 -1.337 9.728 579 HE2 LYS 732 HE2 LYS 732 -12.740 0.392 10.223 580 HE3 LYS 732 HE3 LYS 732 -14.321 1.032 10.675 581 HZ1 LYS 732 HZ1 LYS 732 -13.927 -1.725 11.451 582 HZ2 LYS 732 HZ2 LYS 732 -12.807 -0.635 12.189 583 HZ3 LYS 732 HZ3 LYS 732 -14.494 -0.389 12.372 584 H LYS 733 H LYS 733 -11.671 -4.130 5.624 585 HA LYS 733 HA LYS 733 -13.698 -4.890 3.574 586 HB2 LYS 733 HB2 LYS 733 -11.846 -2.855 3.448 587 HB3 LYS 733 HB3 LYS 733 -11.067 -4.154 2.548 588 HG2 LYS 733 HG2 LYS 733 -12.375 -2.995 0.929 589 HG3 LYS 733 HG3 LYS 733 -13.320 -4.430 1.320 590 HD2 LYS 733 HD2 LYS 733 -14.820 -2.525 1.311 591 HD3 LYS 733 HD3 LYS 733 -14.609 -3.039 2.987 592 HE2 LYS 733 HE2 LYS 733 -13.134 -1.238 3.464 593 HE3 LYS 733 HE3 LYS 733 -12.888 -0.886 1.755 594 HZ1 LYS 733 HZ1 LYS 733 -14.442 0.630 3.034 595 HZ2 LYS 733 HZ2 LYS 733 -15.022 0.015 1.533 596 HZ3 LYS 733 HZ3 LYS 733 -15.556 -0.671 3.013 597 H ALA 734 H ALA 734 -12.202 -5.955 1.656 598 HA ALA 734 HA ALA 734 -10.250 -7.835 2.374 599 HB1 ALA 734 HB1 ALA 734 -11.732 -9.912 2.228 600 HB2 ALA 734 HB2 ALA 734 -13.095 -8.831 2.510 601 HB3 ALA 734 HB3 ALA 734 -11.825 -8.987 3.725 602 H PHE 735 H PHE 735 -9.244 -8.306 0.514 603 HA PHE 735 HA PHE 735 -10.858 -8.539 -1.971 604 HB2 PHE 735 HB2 PHE 735 -8.270 -7.097 -1.457 605 HB3 PHE 735 HB3 PHE 735 -8.632 -7.721 -3.068 606 HD1 PHE 735 HD2 PHE 735 -10.073 -5.631 -0.319 607 HD2 PHE 735 HD1 PHE 735 -10.027 -6.511 -4.523 608 HE1 PHE 735 HE2 PHE 735 -11.541 -3.675 -0.749 609 HE2 PHE 735 HE1 PHE 735 -11.486 -4.555 -4.953 610 HZ PHE 735 HZ PHE 735 -12.249 -3.141 -3.059 611 H ARG 736 H ARG 736 -9.962 -9.980 -3.608 612 HA ARG 736 HA ARG 736 -8.852 -12.372 -2.448 613 HB2 ARG 736 HB2 ARG 736 -8.910 -12.223 -5.384 614 HB3 ARG 736 HB3 ARG 736 -9.596 -13.429 -4.301 615 HG2 ARG 736 HG2 ARG 736 -11.585 -12.535 -4.963 616 HG3 ARG 736 HG3 ARG 736 -11.219 -11.293 -3.767 617 HD2 ARG 736 HD2 ARG 736 -9.864 -10.213 -5.759 618 HD3 ARG 736 HD3 ARG 736 -10.932 -11.204 -6.751 619 HE ARG 736 HE ARG 736 -12.411 -9.718 -4.799 620 HH11 ARG 736 HH21 ARG 736 -10.724 -9.473 -7.832 621 HH12 ARG 736 HH22 ARG 736 -11.715 -8.148 -8.386 622 HH21 ARG 736 HH11 ARG 736 -13.641 -7.993 -5.541 623 HH22 ARG 736 HH12 ARG 736 -13.332 -7.314 -7.098 624 H GLY 737 H GLY 737 -7.487 -9.561 -3.730 625 HA2 GLY 737 HA2 GLY 737 -4.829 -10.511 -3.410 626 HA3 GLY 737 HA3 GLY 737 -5.243 -10.461 -5.120 627 H LEU 738 H LEU 738 -3.355 -8.859 -3.416 628 HA LEU 738 HA LEU 738 -4.013 -6.278 -2.865 629 HB2 LEU 738 HB2 LEU 738 -1.618 -7.658 -3.828 630 HB3 LEU 738 HB3 LEU 738 -1.682 -5.983 -4.363 631 HG LEU 738 HG LEU 738 -0.536 -6.154 -2.206 632 HD11 LEU 738 HD11 LEU 738 -3.099 -4.960 -1.346 633 HD12 LEU 738 HD12 LEU 738 -1.484 -4.251 -1.411 634 HD13 LEU 738 HD13 LEU 738 -2.457 -4.360 -2.874 635 HD21 LEU 738 HD21 LEU 738 -2.879 -6.793 -0.599 636 HD22 LEU 738 HD22 LEU 738 -2.449 -8.121 -1.674 637 HD23 LEU 738 HD23 LEU 738 -1.258 -7.486 -0.537 638 H THR 739 H THR 739 -3.107 -7.507 -6.044 639 HA THR 739 HA THR 739 -3.478 -5.255 -7.600 640 HB THR 739 HB THR 739 -4.253 -8.027 -8.502 641 HG1 THR 739 HG1 THR 739 -1.629 -7.088 -8.592 642 HG21 THR 739 HG21 THR 739 -4.527 -6.437 -10.243 643 HG22 THR 739 HG22 THR 739 -3.053 -5.575 -9.796 644 HG23 THR 739 HG23 THR 739 -2.952 -7.170 -10.541 645 H GLU 740 H GLU 740 -5.922 -7.535 -6.437 646 HA GLU 740 HA GLU 740 -8.026 -6.364 -8.013 647 HB2 GLU 740 HB2 GLU 740 -8.508 -7.945 -5.494 648 HB3 GLU 740 HB3 GLU 740 -9.470 -7.893 -6.966 649 HG2 GLU 740 HG2 GLU 740 -6.704 -8.884 -7.325 650 HG3 GLU 740 HG3 GLU 740 -7.733 -9.906 -6.339 651 H LEU 741 H LEU 741 -6.503 -5.712 -5.021 652 HA LEU 741 HA LEU 741 -8.664 -4.080 -3.949 653 HB2 LEU 741 HB2 LEU 741 -7.433 -5.379 -2.356 654 HB3 LEU 741 HB3 LEU 741 -5.888 -4.845 -3.002 655 HG LEU 741 HG LEU 741 -6.657 -3.796 -0.797 656 HD11 LEU 741 HD11 LEU 741 -5.074 -2.861 -2.794 657 HD12 LEU 741 HD12 LEU 741 -6.264 -1.560 -2.710 658 HD13 LEU 741 HD13 LEU 741 -5.337 -2.002 -1.279 659 HD21 LEU 741 HD21 LEU 741 -8.951 -3.310 -1.191 660 HD22 LEU 741 HD22 LEU 741 -8.146 -1.746 -1.223 661 HD23 LEU 741 HD23 LEU 741 -8.614 -2.525 -2.729 662 H VAL 742 H VAL 742 -5.375 -3.733 -5.110 663 HA VAL 742 HA VAL 742 -5.175 -0.903 -4.979 664 HB VAL 742 HB VAL 742 -3.750 -2.986 -6.644 665 HG11 VAL 742 HG11 VAL 742 -3.261 -1.011 -7.773 666 HG12 VAL 742 HG12 VAL 742 -3.324 -0.034 -6.304 667 HG13 VAL 742 HG13 VAL 742 -1.951 -1.099 -6.596 668 HG21 VAL 742 HG21 VAL 742 -3.051 -1.612 -4.033 669 HG22 VAL 742 HG22 VAL 742 -3.521 -3.303 -4.234 670 HG23 VAL 742 HG23 VAL 742 -1.999 -2.723 -4.912 671 H GLU 743 H GLU 743 -5.540 -3.026 -7.775 672 HA GLU 743 HA GLU 743 -5.928 -0.963 -9.648 673 HB2 GLU 743 HB2 GLU 743 -6.869 -3.813 -9.875 674 HB3 GLU 743 HB3 GLU 743 -6.426 -2.721 -11.195 675 HG2 GLU 743 HG2 GLU 743 -4.438 -3.439 -9.030 676 HG3 GLU 743 HG3 GLU 743 -4.679 -4.482 -10.408 677 H PHE 744 H PHE 744 -8.094 -2.404 -7.402 678 HA PHE 744 HA PHE 744 -10.502 -1.669 -8.856 679 HB2 PHE 744 HB2 PHE 744 -10.606 -3.620 -7.464 680 HB3 PHE 744 HB3 PHE 744 -9.999 -2.732 -6.072 681 HD1 PHE 744 HD1 PHE 744 -12.801 -2.572 -8.572 682 HD2 PHE 744 HD2 PHE 744 -11.525 -1.922 -4.528 683 HE1 PHE 744 HE1 PHE 744 -15.118 -1.948 -7.941 684 HE2 PHE 744 HE2 PHE 744 -13.840 -1.295 -3.890 685 HZ PHE 744 HZ PHE 744 -15.637 -1.307 -5.602 686 H TYR 745 H TYR 745 -8.424 -0.353 -6.378 687 HA TYR 745 HA TYR 745 -10.305 1.712 -5.616 688 HB2 TYR 745 HB2 TYR 745 -7.492 1.015 -4.857 689 HB3 TYR 745 HB3 TYR 745 -8.176 2.577 -4.407 690 HD1 TYR 745 HD2 TYR 745 -10.792 0.189 -4.671 691 HD2 TYR 745 HD1 TYR 745 -7.623 1.472 -2.072 692 HE1 TYR 745 HE2 TYR 745 -11.951 -0.842 -2.746 693 HE2 TYR 745 HE1 TYR 745 -8.787 0.429 -0.153 694 HH TYR 745 HH TYR 745 -12.022 -0.495 -0.270 695 H GLN 746 H GLN 746 -8.150 1.306 -8.186 696 HA GLN 746 HA GLN 746 -7.100 3.866 -8.587 697 HB2 GLN 746 HB2 GLN 746 -8.112 1.787 -10.530 698 HB3 GLN 746 HB3 GLN 746 -7.397 3.307 -11.072 699 HG2 GLN 746 HG2 GLN 746 -5.291 2.791 -10.162 700 HG3 GLN 746 HG3 GLN 746 -5.956 1.587 -9.058 701 HE21 GLN 746 HE21 GLN 746 -4.034 0.372 -10.230 702 HE22 GLN 746 HE22 GLN 746 -4.482 -0.537 -11.599 703 H GLN 747 H GLN 747 -10.313 2.588 -9.237 704 HA GLN 747 HA GLN 747 -11.267 5.262 -10.059 705 HB2 GLN 747 HB2 GLN 747 -12.889 2.725 -10.160 706 HB3 GLN 747 HB3 GLN 747 -13.057 4.183 -11.137 707 HG2 GLN 747 HG2 GLN 747 -12.032 2.662 -12.617 708 HG3 GLN 747 HG3 GLN 747 -10.677 3.613 -12.014 709 HE21 GLN 747 HE21 GLN 747 -10.247 0.988 -13.025 710 HE22 GLN 747 HE22 GLN 747 -9.798 -0.019 -11.730 711 H ASN 748 H ASN 748 -11.441 2.864 -7.570 712 HA ASN 748 HA ASN 748 -13.673 4.244 -6.223 713 HB2 ASN 748 HB2 ASN 748 -12.317 1.624 -5.528 714 HB3 ASN 748 HB3 ASN 748 -13.764 2.280 -4.771 715 HD21 ASN 748 HD21 ASN 748 -12.508 0.791 -7.734 716 HD22 ASN 748 HD22 ASN 748 -14.038 0.483 -8.413 717 H SER 749 H SER 749 -13.078 5.859 -4.930 718 HA SER 749 HA SER 749 -10.596 6.551 -4.070 719 HB2 SER 749 HB2 SER 749 -13.025 7.613 -3.779 720 HB3 SER 749 HB3 SER 749 -12.809 6.983 -2.153 721 HG SER 749 HG SER 749 -10.524 8.137 -2.941 722 H LEU 750 H LEU 750 -9.242 6.102 -2.401 723 HA LEU 750 HA LEU 750 -9.301 3.527 -1.243 724 HB2 LEU 750 HB2 LEU 750 -7.720 5.998 -0.555 725 HB3 LEU 750 HB3 LEU 750 -7.457 4.438 0.218 726 HG LEU 750 HG LEU 750 -7.583 4.073 -2.636 727 HD11 LEU 750 HD11 LEU 750 -6.912 6.412 -2.766 728 HD12 LEU 750 HD12 LEU 750 -5.608 6.126 -1.616 729 HD13 LEU 750 HD13 LEU 750 -5.554 5.380 -3.212 730 HD21 LEU 750 HD21 LEU 750 -5.144 3.897 -0.857 731 HD22 LEU 750 HD22 LEU 750 -6.450 2.717 -0.752 732 HD23 LEU 750 HD23 LEU 750 -5.551 2.904 -2.257 733 H LYS 751 H LYS 751 -10.483 6.619 -0.105 734 HA LYS 751 HA LYS 751 -10.703 6.194 2.599 735 HB2 LYS 751 HB2 LYS 751 -12.657 7.691 2.570 736 HB3 LYS 751 HB3 LYS 751 -11.318 8.302 1.617 737 HG2 LYS 751 HG2 LYS 751 -12.613 6.999 -0.330 738 HG3 LYS 751 HG3 LYS 751 -13.993 7.352 0.720 739 HD2 LYS 751 HD2 LYS 751 -13.369 9.717 0.791 740 HD3 LYS 751 HD3 LYS 751 -11.942 9.383 -0.175 741 HE2 LYS 751 HE2 LYS 751 -14.067 8.374 -1.685 742 HE3 LYS 751 HE3 LYS 751 -14.639 9.921 -1.048 743 HZ1 LYS 751 HZ1 LYS 751 -13.451 10.451 -2.995 744 HZ2 LYS 751 HZ2 LYS 751 -12.380 10.838 -1.701 745 HZ3 LYS 751 HZ3 LYS 751 -12.160 9.380 -2.607 746 H ASP 752 H ASP 752 -12.193 4.453 0.081 747 HA ASP 752 HA ASP 752 -14.540 3.492 1.366 748 HB2 ASP 752 HB2 ASP 752 -14.456 2.851 -0.870 749 HB3 ASP 752 HB3 ASP 752 -12.740 2.463 -0.806 750 H CYS 753 H CYS 753 -11.179 2.470 1.406 751 HA CYS 753 HA CYS 753 -11.687 0.592 3.649 752 HB2 CYS 753 HB2 CYS 753 -9.704 0.713 1.453 753 HB3 CYS 753 HB3 CYS 753 -9.111 0.193 3.019 754 HG CYS 753 HG CYS 753 -10.897 -1.449 1.196 755 H PHE 754 H PHE 754 -9.443 3.038 2.427 756 HA PHE 754 HA PHE 754 -8.013 3.321 4.833 757 HB2 PHE 754 HB2 PHE 754 -8.338 4.991 2.376 758 HB3 PHE 754 HB3 PHE 754 -7.485 5.632 3.777 759 HD1 PHE 754 HD2 PHE 754 -7.611 2.614 1.568 760 HD2 PHE 754 HD1 PHE 754 -5.209 5.132 4.084 761 HE1 PHE 754 HE2 PHE 754 -5.588 1.342 0.914 762 HE2 PHE 754 HE1 PHE 754 -3.185 3.861 3.427 763 HZ PHE 754 HZ PHE 754 -3.376 1.963 1.841 764 H LYS 755 H LYS 755 -8.095 5.026 6.353 765 HA LYS 755 HA LYS 755 -10.800 5.802 7.012 766 HB2 LYS 755 HB2 LYS 755 -8.697 6.889 8.722 767 HB3 LYS 755 HB3 LYS 755 -10.051 5.837 9.126 768 HG2 LYS 755 HG2 LYS 755 -7.381 4.987 7.959 769 HG3 LYS 755 HG3 LYS 755 -7.990 4.638 9.566 770 HD2 LYS 755 HD2 LYS 755 -10.002 3.611 8.028 771 HD3 LYS 755 HD3 LYS 755 -8.605 3.315 6.998 772 HE2 LYS 755 HE2 LYS 755 -7.811 1.684 8.349 773 HE3 LYS 755 HE3 LYS 755 -8.077 2.656 9.799 774 HZ1 LYS 755 HZ1 LYS 755 -10.567 2.176 9.350 775 HZ2 LYS 755 HZ2 LYS 755 -9.973 0.844 8.406 776 HZ3 LYS 755 HZ3 LYS 755 -9.611 0.955 10.084 777 H SER 756 H SER 756 -7.755 7.699 6.852 778 HA SER 756 HA SER 756 -9.308 10.130 6.351 779 HB2 SER 756 HB2 SER 756 -7.291 11.325 6.747 780 HB3 SER 756 HB3 SER 756 -7.301 10.011 7.921 781 HG SER 756 HG SER 756 -5.580 9.231 7.012 782 H LEU 757 H LEU 757 -7.125 7.973 4.703 783 HA LEU 757 HA LEU 757 -6.316 9.334 2.472 784 HB2 LEU 757 HB2 LEU 757 -6.118 6.808 3.254 785 HB3 LEU 757 HB3 LEU 757 -7.421 6.600 2.092 786 HG LEU 757 HG LEU 757 -5.452 6.239 0.860 787 HD11 LEU 757 HD11 LEU 757 -7.063 7.792 -0.201 788 HD12 LEU 757 HD12 LEU 757 -6.132 9.141 0.448 789 HD13 LEU 757 HD13 LEU 757 -5.398 8.051 -0.721 790 HD21 LEU 757 HD21 LEU 757 -3.533 7.757 0.942 791 HD22 LEU 757 HD22 LEU 757 -4.377 8.764 2.114 792 HD23 LEU 757 HD23 LEU 757 -3.896 7.120 2.552 793 H ASP 758 H ASP 758 -7.691 10.777 1.460 794 HA ASP 758 HA ASP 758 -10.188 9.625 0.394 795 HB2 ASP 758 HB2 ASP 758 -10.376 11.590 2.033 796 HB3 ASP 758 HB3 ASP 758 -9.717 12.585 0.738 797 H THR 759 H THR 759 -8.735 8.790 -1.277 798 HA THR 759 HA THR 759 -8.958 10.417 -3.620 799 HB THR 759 HB THR 759 -6.830 11.351 -2.726 800 HG1 THR 759 HG1 THR 759 -6.071 11.396 -4.712 801 HG21 THR 759 HG21 THR 759 -5.444 9.887 -1.706 802 HG22 THR 759 HG22 THR 759 -6.233 8.500 -2.459 803 HG23 THR 759 HG23 THR 759 -4.974 9.376 -3.327 804 H THR 760 H THR 760 -7.113 9.064 -5.246 805 HA THR 760 HA THR 760 -7.896 6.222 -4.954 806 HB THR 760 HB THR 760 -8.304 6.119 -7.414 807 HG1 THR 760 HG1 THR 760 -8.411 8.931 -7.299 808 HG21 THR 760 HG21 THR 760 -9.976 7.932 -5.683 809 HG22 THR 760 HG22 THR 760 -10.456 7.528 -7.333 810 HG23 THR 760 HG23 THR 760 -10.273 6.250 -6.131 811 H LEU 761 H LEU 761 -6.625 4.822 -6.501 812 HA LEU 761 HA LEU 761 -3.843 5.251 -6.096 813 HB2 LEU 761 HB2 LEU 761 -5.395 3.289 -7.800 814 HB3 LEU 761 HB3 LEU 761 -3.638 3.277 -7.709 815 HG LEU 761 HG LEU 761 -4.592 1.672 -6.104 816 HD11 LEU 761 HD11 LEU 761 -3.676 3.947 -4.383 817 HD12 LEU 761 HD12 LEU 761 -3.196 2.250 -4.347 818 HD13 LEU 761 HD13 LEU 761 -2.581 3.315 -5.606 819 HD21 LEU 761 HD21 LEU 761 -6.737 3.009 -5.818 820 HD22 LEU 761 HD22 LEU 761 -6.052 2.343 -4.337 821 HD23 LEU 761 HD23 LEU 761 -5.841 4.049 -4.715 822 H GLN 762 H GLN 762 -3.570 7.361 -6.972 823 HA GLN 762 HA GLN 762 -4.143 8.110 -9.620 824 HB2 GLN 762 HB2 GLN 762 -2.189 9.101 -7.562 825 HB3 GLN 762 HB3 GLN 762 -2.206 9.787 -9.181 826 HG2 GLN 762 HG2 GLN 762 -4.902 9.714 -8.478 827 HG3 GLN 762 HG3 GLN 762 -4.097 10.180 -6.983 828 HE21 GLN 762 HE21 GLN 762 -2.404 12.058 -7.304 829 HE22 GLN 762 HE22 GLN 762 -2.855 13.272 -8.402 830 H PHE 763 H PHE 763 -0.911 7.290 -8.325 831 HA PHE 763 HA PHE 763 -0.322 5.723 -10.690 832 HB2 PHE 763 HB2 PHE 763 1.908 7.398 -10.658 833 HB3 PHE 763 HB3 PHE 763 0.635 7.370 -11.874 834 HD1 PHE 763 HD1 PHE 763 1.604 8.907 -8.611 835 HD2 PHE 763 HD2 PHE 763 -0.846 9.199 -12.126 836 HE1 PHE 763 HE1 PHE 763 0.916 11.194 -7.941 837 HE2 PHE 763 HE2 PHE 763 -1.534 11.486 -11.456 838 HZ PHE 763 HZ PHE 763 -0.653 12.483 -9.365 839 HA PRO 764 HA PRO 764 2.214 3.604 -7.799 840 HB2 PRO 764 HB2 PRO 764 3.985 2.399 -9.514 841 HB3 PRO 764 HB3 PRO 764 2.307 1.860 -9.297 842 HG2 PRO 764 HG2 PRO 764 3.511 3.478 -11.476 843 HG3 PRO 764 HG3 PRO 764 2.236 2.252 -11.546 844 HD2 PRO 764 HD2 PRO 764 1.748 4.958 -11.629 845 HD3 PRO 764 HD3 PRO 764 0.576 3.760 -11.046 846 H PHE 765 H PHE 765 4.176 3.773 -6.708 847 HA PHE 765 HA PHE 765 5.641 6.173 -7.004 848 HB2 PHE 765 HB2 PHE 765 6.842 5.476 -5.152 849 HB3 PHE 765 HB3 PHE 765 5.375 4.516 -4.982 850 HD1 PHE 765 HD1 PHE 765 5.411 2.158 -6.228 851 HD2 PHE 765 HD2 PHE 765 8.907 4.395 -5.120 852 HE1 PHE 765 HE1 PHE 765 6.763 0.100 -6.352 853 HE2 PHE 765 HE2 PHE 765 10.263 2.323 -5.240 854 HZ PHE 765 HZ PHE 765 9.194 0.175 -5.853 855 H LYS 766 H LYS 766 6.099 2.952 -8.289 856 HA LYS 766 HA LYS 766 8.780 3.111 -9.054 857 HB2 LYS 766 HB2 LYS 766 6.424 1.475 -9.698 858 HB3 LYS 766 HB3 LYS 766 7.719 1.460 -10.888 859 HG2 LYS 766 HG2 LYS 766 8.703 1.291 -8.145 860 HG3 LYS 766 HG3 LYS 766 7.650 -0.048 -8.582 861 HD2 LYS 766 HD2 LYS 766 9.966 -0.594 -9.168 862 HD3 LYS 766 HD3 LYS 766 9.011 -0.408 -10.640 863 HE2 LYS 766 HE2 LYS 766 10.406 2.005 -9.522 864 HE3 LYS 766 HE3 LYS 766 11.361 0.807 -10.390 865 HZ1 LYS 766 HZ1 LYS 766 9.141 1.172 -11.951 866 HZ2 LYS 766 HZ2 LYS 766 9.512 2.756 -11.427 867 HZ3 LYS 766 HZ3 LYS 766 10.680 1.818 -12.240 868 H GLU 767 H GLU 767 5.952 4.549 -10.428 869 HA GLU 767 HA GLU 767 6.886 4.768 -13.086 870 HB2 GLU 767 HB2 GLU 767 4.607 5.635 -11.581 871 HB3 GLU 767 HB3 GLU 767 5.239 7.014 -12.479 872 HG2 GLU 767 HG2 GLU 767 5.371 5.325 -14.475 873 HG3 GLU 767 HG3 GLU 767 4.223 4.385 -13.529 874 H1 ASP 338 H1 ASP 338 13.451 4.332 7.262 875 H2 ASP 338 H2 ASP 338 12.396 3.043 7.631 876 H3 ASP 338 H3 ASP 338 13.839 2.742 6.776 877 HA ASP 338 HA ASP 338 14.492 2.109 8.854 878 HB2 ASP 338 HB2 ASP 338 15.441 4.379 9.943 879 HB3 ASP 338 HB3 ASP 338 16.190 3.618 8.547 880 H THR 339 H THR 339 12.193 4.806 9.018 881 HA THR 339 HA THR 339 11.753 4.589 11.850 882 HB THR 339 HB THR 339 9.782 6.031 11.407 883 HG1 THR 339 HG1 THR 339 9.921 6.691 8.982 884 HG21 THR 339 HG21 THR 339 12.428 6.699 10.122 885 HG22 THR 339 HG22 THR 339 11.115 7.874 10.177 886 HG23 THR 339 HG23 THR 339 11.796 7.243 11.676 887 H GLU 340 H GLU 340 9.041 4.355 12.218 888 HA GLU 340 HA GLU 340 8.606 1.626 12.344 889 HB2 GLU 340 HB2 GLU 340 7.294 3.389 13.558 890 HB3 GLU 340 HB3 GLU 340 6.412 3.689 12.058 891 HG2 GLU 340 HG2 GLU 340 5.289 2.071 13.673 892 HG3 GLU 340 HG3 GLU 340 5.513 1.465 12.036 893 H VAL 341 H VAL 341 7.442 0.123 11.154 894 HA VAL 341 HA VAL 341 7.216 0.788 8.288 895 HB VAL 341 HB VAL 341 7.210 -1.711 7.988 896 HG11 VAL 341 HG11 VAL 341 9.328 0.068 8.578 897 HG12 VAL 341 HG12 VAL 341 9.697 -1.430 9.429 898 HG13 VAL 341 HG13 VAL 341 9.425 -1.450 7.687 899 HG21 VAL 341 HG21 VAL 341 8.386 -2.186 10.630 900 HG22 VAL 341 HG22 VAL 341 6.689 -1.721 10.726 901 HG23 VAL 341 HG23 VAL 341 7.167 -3.120 9.765 902 H TYR 342 H TYR 342 5.248 1.315 7.617 903 HA TYR 342 HA TYR 342 2.990 1.304 7.253 904 HB2 TYR 342 HB2 TYR 342 2.586 -1.372 8.468 905 HB3 TYR 342 HB3 TYR 342 1.983 -0.720 6.949 906 HD1 TYR 342 HD1 TYR 342 3.733 -0.353 5.042 907 HD2 TYR 342 HD2 TYR 342 4.405 -2.820 8.499 908 HE1 TYR 342 HE1 TYR 342 5.540 -1.550 3.849 909 HE2 TYR 342 HE2 TYR 342 6.206 -4.017 7.290 910 HH TYR 342 HH TYR 342 6.811 -4.503 4.956 911 H GLU 343 H GLU 343 4.205 0.775 10.409 912 HA GLU 343 HA GLU 343 3.127 0.750 12.502 913 HB2 GLU 343 HB2 GLU 343 2.202 3.125 12.848 914 HB3 GLU 343 HB3 GLU 343 3.887 2.979 12.360 915 HG2 GLU 343 HG2 GLU 343 2.098 3.092 10.051 916 HG3 GLU 343 HG3 GLU 343 1.941 4.509 11.079 917 H SER 344 H SER 344 0.699 2.956 11.615 918 HA SER 344 HA SER 344 -1.409 1.413 10.727 919 HB2 SER 344 HB2 SER 344 -1.459 -0.076 12.509 920 HB3 SER 344 HB3 SER 344 -0.929 1.134 13.674 921 HG SER 344 HG SER 344 -3.022 2.186 13.211 922 HA PRO 345 HA PRO 345 -1.772 6.129 11.219 923 HB2 PRO 345 HB2 PRO 345 -3.446 5.162 8.879 924 HB3 PRO 345 HB3 PRO 345 -2.604 6.714 9.060 925 HG2 PRO 345 HG2 PRO 345 -1.539 4.748 7.655 926 HG3 PRO 345 HG3 PRO 345 -0.532 5.769 8.696 927 HD2 PRO 345 HD2 PRO 345 -1.293 2.923 9.056 928 HD3 PRO 345 HD3 PRO 345 0.078 3.819 9.745 929 H PTR 346 H PTR 346 -4.151 3.540 10.713 930 HA PTR 346 HA PTR 346 -5.592 3.995 13.067 931 HB2 PTR 346 HB2 PTR 346 -6.969 5.692 12.591 932 HB3 PTR 346 HB3 PTR 346 -7.706 4.695 11.346 933 HD1 PTR 346 HD1 PTR 346 -5.791 4.483 9.224 934 HD2 PTR 346 HD2 PTR 346 -6.549 7.823 11.813 935 HE1 PTR 346 HE1 PTR 346 -4.844 6.008 7.506 936 HE2 PTR 346 HE2 PTR 346 -5.609 9.354 10.113 937 H ALA 347 H ALA 347 -7.514 2.671 13.238 938 HA ALA 347 HA ALA 347 -7.660 0.468 11.243 939 HB1 ALA 347 HB1 ALA 347 -7.502 0.406 14.246 940 HB2 ALA 347 HB2 ALA 347 -6.630 -0.570 13.065 941 HB3 ALA 347 HB3 ALA 347 -8.337 -0.881 13.377 942 H ASP 348 H ASP 348 -9.341 2.054 13.930 943 HA ASP 348 HA ASP 348 -11.497 2.741 14.214 944 HB2 ASP 348 HB2 ASP 348 -12.595 1.833 11.648 945 HB3 ASP 348 HB3 ASP 348 -12.729 3.390 12.437 946 HA PRO 349 HA PRO 349 -12.932 -1.190 15.745 947 HB2 PRO 349 HB2 PRO 349 -15.394 0.375 16.355 948 HB3 PRO 349 HB3 PRO 349 -14.389 -0.616 17.431 949 HG2 PRO 349 HG2 PRO 349 -14.316 2.039 17.529 950 HG3 PRO 349 HG3 PRO 349 -12.856 1.062 17.766 951 HD2 PRO 349 HD2 PRO 349 -13.686 2.660 15.371 952 HD3 PRO 349 HD3 PRO 349 -12.059 2.374 16.034 953 H GLU 350 H GLU 350 -14.491 -2.781 15.253 954 HA GLU 350 HA GLU 350 -15.663 -4.022 13.705 955 HB2 GLU 350 HB2 GLU 350 -17.374 -1.554 14.063 956 HB3 GLU 350 HB3 GLU 350 -17.933 -3.030 13.276 957 HG2 GLU 350 HG2 GLU 350 -18.605 -3.103 15.612 958 HG3 GLU 350 HG3 GLU 350 -17.345 -4.304 15.355 Start of MODEL 4 1 H1 GLY 661 H1 GLY 661 4.306 -12.635 -10.400 2 H2 GLY 661 H2 GLY 661 3.818 -13.774 -9.230 3 H3 GLY 661 H3 GLY 661 3.046 -12.246 -9.321 4 HA2 GLY 661 HA2 GLY 661 1.580 -13.020 -10.788 5 HA3 GLY 661 HA3 GLY 661 2.899 -13.529 -11.845 6 H HIS 662 H HIS 662 3.897 -15.624 -11.442 7 HA HIS 662 HA HIS 662 2.178 -17.763 -11.231 8 HB2 HIS 662 HB2 HIS 662 4.525 -18.830 -10.236 9 HB3 HIS 662 HB3 HIS 662 4.126 -18.650 -11.940 10 HD1 HIS 662 HD1 HIS 662 5.017 -15.739 -9.636 11 HD2 HIS 662 HD2 HIS 662 6.656 -17.906 -12.825 12 HE1 HIS 662 HE1 HIS 662 7.129 -14.521 -10.347 13 HE2 HIS 662 HE2 HIS 662 8.132 -15.822 -12.284 14 H MET 663 H MET 663 4.585 -17.417 -8.647 15 HA MET 663 HA MET 663 2.837 -18.624 -6.729 16 HB2 MET 663 HB2 MET 663 5.464 -18.531 -6.839 17 HB3 MET 663 HB3 MET 663 5.252 -17.018 -5.951 18 HG2 MET 663 HG2 MET 663 5.155 -18.316 -4.097 19 HG3 MET 663 HG3 MET 663 3.538 -18.772 -4.644 20 HE1 MET 663 HE1 MET 663 5.595 -20.795 -2.825 21 HE2 MET 663 HE2 MET 663 6.929 -21.368 -3.817 22 HE3 MET 663 HE3 MET 663 6.710 -19.635 -3.536 23 H GLN 664 H GLN 664 1.449 -16.527 -7.813 24 HA GLN 664 HA GLN 664 0.227 -14.652 -7.287 25 HB2 GLN 664 HB2 GLN 664 0.046 -16.285 -5.176 26 HB3 GLN 664 HB3 GLN 664 0.860 -14.934 -4.388 27 HG2 GLN 664 HG2 GLN 664 -1.294 -13.986 -6.101 28 HG3 GLN 664 HG3 GLN 664 -1.892 -15.159 -4.932 29 HE21 GLN 664 HE21 GLN 664 0.579 -12.529 -4.785 30 HE22 GLN 664 HE22 GLN 664 -0.055 -11.843 -3.362 31 H ASP 665 H ASP 665 3.332 -14.600 -7.395 32 HA ASP 665 HA ASP 665 4.358 -12.612 -5.754 33 HB2 ASP 665 HB2 ASP 665 5.224 -12.407 -8.560 34 HB3 ASP 665 HB3 ASP 665 6.170 -12.715 -7.112 35 H LEU 666 H LEU 666 3.519 -10.673 -5.357 36 HA LEU 666 HA LEU 666 1.817 -9.318 -7.275 37 HB2 LEU 666 HB2 LEU 666 2.861 -8.265 -4.639 38 HB3 LEU 666 HB3 LEU 666 1.443 -7.712 -5.523 39 HG LEU 666 HG LEU 666 1.662 -10.569 -4.571 40 HD11 LEU 666 HD11 LEU 666 1.420 -8.179 -2.949 41 HD12 LEU 666 HD12 LEU 666 -0.024 -9.180 -2.813 42 HD13 LEU 666 HD13 LEU 666 1.561 -9.861 -2.441 43 HD21 LEU 666 HD21 LEU 666 -0.216 -10.527 -5.879 44 HD22 LEU 666 HD22 LEU 666 -0.952 -9.830 -4.437 45 HD23 LEU 666 HD23 LEU 666 -0.398 -8.779 -5.740 46 H SER 667 H SER 667 5.133 -9.395 -6.487 47 HA SER 667 HA SER 667 6.084 -6.844 -6.926 48 HB2 SER 667 HB2 SER 667 7.606 -8.589 -6.287 49 HB3 SER 667 HB3 SER 667 7.275 -9.492 -7.764 50 HG SER 667 HG SER 667 7.977 -7.133 -8.593 51 H VAL 668 H VAL 668 4.436 -8.819 -9.154 52 HA VAL 668 HA VAL 668 5.596 -7.830 -11.564 53 HB VAL 668 HB VAL 668 3.632 -8.809 -12.663 54 HG11 VAL 668 HG11 VAL 668 5.269 -10.435 -12.191 55 HG12 VAL 668 HG12 VAL 668 4.985 -10.348 -10.452 56 HG13 VAL 668 HG13 VAL 668 3.802 -11.127 -11.502 57 HG21 VAL 668 HG21 VAL 668 2.575 -9.542 -9.932 58 HG22 VAL 668 HG22 VAL 668 2.091 -8.036 -10.708 59 HG23 VAL 668 HG23 VAL 668 1.737 -9.580 -11.481 60 H HIS 669 H HIS 669 3.461 -6.461 -9.266 61 HA HIS 669 HA HIS 669 2.205 -4.635 -11.155 62 HB2 HIS 669 HB2 HIS 669 2.056 -4.572 -8.142 63 HB3 HIS 669 HB3 HIS 669 0.956 -3.824 -9.297 64 HD1 HIS 669 HD1 HIS 669 0.119 -5.846 -11.190 65 HD2 HIS 669 HD2 HIS 669 0.908 -6.914 -7.245 66 HE1 HIS 669 HE1 HIS 669 -1.075 -8.046 -10.797 67 HE2 HIS 669 HE2 HIS 669 -0.618 -8.707 -8.388 68 H LEU 670 H LEU 670 2.931 -2.751 -11.713 69 HA LEU 670 HA LEU 670 5.403 -1.695 -11.205 70 HB2 LEU 670 HB2 LEU 670 3.860 -1.007 -13.025 71 HB3 LEU 670 HB3 LEU 670 2.884 -0.141 -11.844 72 HG LEU 670 HG LEU 670 4.781 1.334 -11.324 73 HD11 LEU 670 HD11 LEU 670 6.814 1.203 -12.805 74 HD12 LEU 670 HD12 LEU 670 6.660 -0.152 -11.682 75 HD13 LEU 670 HD13 LEU 670 6.227 -0.361 -13.380 76 HD21 LEU 670 HD21 LEU 670 4.919 2.489 -13.491 77 HD22 LEU 670 HD22 LEU 670 4.323 1.046 -14.309 78 HD23 LEU 670 HD23 LEU 670 3.274 1.926 -13.199 79 H TRP 671 H TRP 671 2.510 -1.355 -9.214 80 HA TRP 671 HA TRP 671 3.738 0.747 -7.627 81 HB2 TRP 671 HB2 TRP 671 1.618 0.155 -6.137 82 HB3 TRP 671 HB3 TRP 671 1.503 1.166 -7.570 83 HD1 TRP 671 HD1 TRP 671 0.306 0.177 -9.692 84 HE1 TRP 671 HE1 TRP 671 -1.224 -1.873 -10.031 85 HE3 TRP 671 HE3 TRP 671 1.218 -2.336 -5.346 86 HZ2 TRP 671 HZ2 TRP 671 -1.968 -4.262 -8.641 87 HZ3 TRP 671 HZ3 TRP 671 0.088 -4.492 -4.873 88 HH2 TRP 671 HH2 TRP 671 -1.502 -5.457 -6.520 89 H TYR 672 H TYR 672 4.218 -2.516 -7.752 90 HA TYR 672 HA TYR 672 4.357 -2.958 -4.874 91 HB2 TYR 672 HB2 TYR 672 3.903 -4.655 -6.909 92 HB3 TYR 672 HB3 TYR 672 5.644 -4.872 -6.736 93 HD1 TYR 672 HD2 TYR 672 2.500 -4.709 -4.709 94 HD2 TYR 672 HD1 TYR 672 6.482 -6.286 -5.052 95 HE1 TYR 672 HE2 TYR 672 2.122 -6.107 -2.696 96 HE2 TYR 672 HE1 TYR 672 6.096 -7.686 -3.042 97 HH TYR 672 HH TYR 672 4.417 -8.568 -1.712 98 H ALA 673 H ALA 673 5.967 -2.159 -3.712 99 HA ALA 673 HA ALA 673 8.590 -1.669 -4.937 100 HB1 ALA 673 HB1 ALA 673 7.402 -0.015 -3.393 101 HB2 ALA 673 HB2 ALA 673 9.081 -0.380 -2.998 102 HB3 ALA 673 HB3 ALA 673 7.775 -1.129 -2.078 103 H GLY 674 H GLY 674 6.999 -4.146 -3.417 104 HA2 GLY 674 HA2 GLY 674 7.612 -6.079 -2.323 105 HA3 GLY 674 HA3 GLY 674 9.008 -6.001 -3.382 106 HA PRO 675 HA PRO 675 11.272 -6.028 0.443 107 HB2 PRO 675 HB2 PRO 675 13.759 -5.540 -0.633 108 HB3 PRO 675 HB3 PRO 675 12.959 -7.124 -0.651 109 HG2 PRO 675 HG2 PRO 675 13.153 -5.077 -2.804 110 HG3 PRO 675 HG3 PRO 675 13.268 -6.842 -2.909 111 HD2 PRO 675 HD2 PRO 675 11.011 -5.489 -3.602 112 HD3 PRO 675 HD3 PRO 675 10.965 -7.130 -2.913 113 H MET 676 H MET 676 9.934 -3.547 -0.289 114 HA MET 676 HA MET 676 11.956 -1.500 0.364 115 HB2 MET 676 HB2 MET 676 10.445 -1.108 -1.572 116 HB3 MET 676 HB3 MET 676 9.068 -1.153 -0.471 117 HG2 MET 676 HG2 MET 676 10.008 1.173 -1.050 118 HG3 MET 676 HG3 MET 676 9.769 0.820 0.659 119 HE1 MET 676 HE1 MET 676 12.987 2.578 -1.332 120 HE2 MET 676 HE2 MET 676 13.149 0.984 -2.065 121 HE3 MET 676 HE3 MET 676 11.584 1.804 -2.060 122 H GLU 677 H GLU 677 11.410 0.115 1.980 123 HA GLU 677 HA GLU 677 9.847 -1.038 4.206 124 HB2 GLU 677 HB2 GLU 677 11.266 0.359 5.677 125 HB3 GLU 677 HB3 GLU 677 12.217 -0.795 4.740 126 HG2 GLU 677 HG2 GLU 677 13.302 0.848 3.621 127 HG3 GLU 677 HG3 GLU 677 11.815 1.748 3.341 128 H ARG 678 H ARG 678 8.750 0.565 5.599 129 HA ARG 678 HA ARG 678 7.013 2.179 4.156 130 HB2 ARG 678 HB2 ARG 678 6.826 1.345 6.591 131 HB3 ARG 678 HB3 ARG 678 7.702 2.820 7.012 132 HG2 ARG 678 HG2 ARG 678 5.840 3.782 5.259 133 HG3 ARG 678 HG3 ARG 678 4.936 2.486 6.033 134 HD2 ARG 678 HD2 ARG 678 4.511 4.296 7.444 135 HD3 ARG 678 HD3 ARG 678 5.866 3.504 8.244 136 HE ARG 678 HE ARG 678 6.621 5.591 6.366 137 HH11 ARG 678 HH21 ARG 678 5.536 4.877 9.564 138 HH12 ARG 678 HH22 ARG 678 6.579 6.082 10.317 139 HH21 ARG 678 HH11 ARG 678 7.823 7.255 7.289 140 HH22 ARG 678 HH12 ARG 678 7.825 7.426 9.032 141 H ALA 679 H ALA 679 9.596 3.422 6.309 142 HA ALA 679 HA ALA 679 9.420 6.085 5.529 143 HB1 ALA 679 HB1 ALA 679 11.018 4.642 7.259 144 HB2 ALA 679 HB2 ALA 679 11.137 6.375 6.952 145 HB3 ALA 679 HB3 ALA 679 12.167 5.251 6.066 146 H GLY 680 H GLY 680 11.273 3.440 4.110 147 HA2 GLY 680 HA2 GLY 680 12.743 4.930 2.209 148 HA3 GLY 680 HA3 GLY 680 12.335 3.220 2.067 149 H ALA 681 H ALA 681 9.618 3.242 1.998 150 HA ALA 681 HA ALA 681 8.994 3.780 -0.660 151 HB1 ALA 681 HB1 ALA 681 6.548 3.894 0.384 152 HB2 ALA 681 HB2 ALA 681 7.393 3.312 1.818 153 HB3 ALA 681 HB3 ALA 681 7.445 2.375 0.327 154 H GLU 682 H GLU 682 8.778 5.829 2.180 155 HA GLU 682 HA GLU 682 7.260 7.938 1.039 156 HB2 GLU 682 HB2 GLU 682 9.290 8.378 3.211 157 HB3 GLU 682 HB3 GLU 682 7.698 9.113 3.010 158 HG2 GLU 682 HG2 GLU 682 6.833 6.656 3.272 159 HG3 GLU 682 HG3 GLU 682 8.388 6.366 4.005 160 H SER 683 H SER 683 10.705 7.238 1.189 161 HA SER 683 HA SER 683 11.816 9.646 0.424 162 HB2 SER 683 HB2 SER 683 13.176 7.709 1.016 163 HB3 SER 683 HB3 SER 683 12.654 6.873 -0.444 164 HG SER 683 HG SER 683 13.500 9.102 -1.361 165 H ILE 684 H ILE 684 10.095 7.322 -1.563 166 HA ILE 684 HA ILE 684 10.726 8.840 -4.001 167 HB ILE 684 HB ILE 684 8.962 6.400 -3.847 168 HG12 ILE 684 HG12 ILE 684 11.544 5.616 -4.677 169 HG13 ILE 684 HG13 ILE 684 11.794 6.575 -3.219 170 HG21 ILE 684 HG21 ILE 684 10.858 6.992 -6.069 171 HG22 ILE 684 HG22 ILE 684 9.233 6.312 -6.129 172 HG23 ILE 684 HG23 ILE 684 9.455 8.048 -5.913 173 HD11 ILE 684 HD11 ILE 684 10.922 3.890 -3.369 174 HD12 ILE 684 HD12 ILE 684 11.022 4.902 -1.930 175 HD13 ILE 684 HD13 ILE 684 9.521 4.829 -2.853 176 H LEU 685 H LEU 685 7.891 7.656 -2.205 177 HA LEU 685 HA LEU 685 5.925 8.915 -3.743 178 HB2 LEU 685 HB2 LEU 685 5.961 8.170 -0.816 179 HB3 LEU 685 HB3 LEU 685 4.518 8.719 -1.665 180 HG LEU 685 HG LEU 685 6.198 6.313 -2.439 181 HD11 LEU 685 HD11 LEU 685 4.905 5.097 -1.059 182 HD12 LEU 685 HD12 LEU 685 4.232 6.597 -0.435 183 HD13 LEU 685 HD13 LEU 685 3.442 5.771 -1.774 184 HD21 LEU 685 HD21 LEU 685 3.960 5.957 -3.811 185 HD22 LEU 685 HD22 LEU 685 3.842 7.710 -3.662 186 HD23 LEU 685 HD23 LEU 685 5.242 6.985 -4.450 187 H ALA 686 H ALA 686 7.383 10.090 -0.682 188 HA ALA 686 HA ALA 686 6.091 12.552 -0.548 189 HB1 ALA 686 HB1 ALA 686 8.968 12.543 0.176 190 HB2 ALA 686 HB2 ALA 686 7.961 11.334 0.972 191 HB3 ALA 686 HB3 ALA 686 7.565 13.045 1.121 192 H ASN 687 H ASN 687 8.827 11.554 -2.497 193 HA ASN 687 HA ASN 687 9.400 14.222 -3.464 194 HB2 ASN 687 HB2 ASN 687 11.067 12.291 -3.209 195 HB3 ASN 687 HB3 ASN 687 10.354 11.628 -4.676 196 HD21 ASN 687 HD21 ASN 687 9.876 14.268 -5.945 197 HD22 ASN 687 HD22 ASN 687 11.414 14.861 -6.366 198 H ARG 688 H ARG 688 7.288 11.635 -4.333 199 HA ARG 688 HA ARG 688 6.951 12.519 -7.083 200 HB2 ARG 688 HB2 ARG 688 6.555 10.112 -5.702 201 HB3 ARG 688 HB3 ARG 688 4.935 10.674 -6.108 202 HG2 ARG 688 HG2 ARG 688 5.716 9.354 -7.967 203 HG3 ARG 688 HG3 ARG 688 5.755 11.042 -8.473 204 HD2 ARG 688 HD2 ARG 688 8.214 10.999 -7.605 205 HD3 ARG 688 HD3 ARG 688 8.054 9.251 -7.721 206 HE ARG 688 HE ARG 688 7.977 11.159 -9.962 207 HH11 ARG 688 HH21 ARG 688 7.891 7.898 -8.804 208 HH12 ARG 688 HH22 ARG 688 8.061 7.201 -10.397 209 HH21 ARG 688 HH11 ARG 688 8.118 10.230 -12.008 210 HH22 ARG 688 HH12 ARG 688 8.099 8.499 -12.187 211 H SER 689 H SER 689 4.560 12.742 -7.806 212 HA SER 689 HA SER 689 3.505 15.058 -6.541 213 HB2 SER 689 HB2 SER 689 2.784 13.359 -8.851 214 HB3 SER 689 HB3 SER 689 1.445 14.225 -8.100 215 HG SER 689 HG SER 689 2.678 15.378 -9.779 216 H ASP 690 H ASP 690 1.629 15.360 -5.329 217 HA ASP 690 HA ASP 690 1.016 13.408 -3.430 218 HB2 ASP 690 HB2 ASP 690 0.201 16.094 -3.980 219 HB3 ASP 690 HB3 ASP 690 -1.229 15.121 -3.646 220 H GLY 691 H GLY 691 -0.035 11.592 -3.585 221 HA2 GLY 691 HA2 GLY 691 -2.284 10.601 -4.162 222 HA3 GLY 691 HA3 GLY 691 -1.999 11.246 -5.777 223 H THR 692 H THR 692 0.919 10.682 -5.466 224 HA THR 692 HA THR 692 1.117 8.241 -6.821 225 HB THR 692 HB THR 692 3.255 9.424 -5.033 226 HG1 THR 692 HG1 THR 692 2.605 11.092 -6.310 227 HG21 THR 692 HG21 THR 692 3.725 8.173 -7.710 228 HG22 THR 692 HG22 THR 692 4.774 8.211 -6.292 229 HG23 THR 692 HG23 THR 692 3.398 7.111 -6.341 230 H PHE 693 H PHE 693 1.355 6.106 -6.178 231 HA PHE 693 HA PHE 693 1.519 5.596 -3.269 232 HB2 PHE 693 HB2 PHE 693 -0.377 4.193 -3.252 233 HB3 PHE 693 HB3 PHE 693 -0.878 5.610 -4.173 234 HD1 PHE 693 HD1 PHE 693 -1.031 5.524 -6.647 235 HD2 PHE 693 HD2 PHE 693 -0.094 2.038 -4.318 236 HE1 PHE 693 HE1 PHE 693 -1.538 4.084 -8.601 237 HE2 PHE 693 HE2 PHE 693 -0.601 0.599 -6.271 238 HZ PHE 693 HZ PHE 693 -1.320 1.621 -8.414 239 H LEU 694 H LEU 694 1.691 3.210 -2.793 240 HA LEU 694 HA LEU 694 2.689 1.404 -4.742 241 HB2 LEU 694 HB2 LEU 694 5.016 1.333 -4.238 242 HB3 LEU 694 HB3 LEU 694 4.622 3.010 -4.577 243 HG LEU 694 HG LEU 694 4.237 3.134 -1.968 244 HD11 LEU 694 HD11 LEU 694 6.410 1.501 -1.311 245 HD12 LEU 694 HD12 LEU 694 4.722 1.185 -0.918 246 HD13 LEU 694 HD13 LEU 694 5.432 0.499 -2.379 247 HD21 LEU 694 HD21 LEU 694 6.616 3.772 -1.708 248 HD22 LEU 694 HD22 LEU 694 6.986 2.988 -3.242 249 HD23 LEU 694 HD23 LEU 694 5.938 4.405 -3.203 250 H VAL 695 H VAL 695 3.754 -0.521 -3.686 251 HA VAL 695 HA VAL 695 2.822 -0.940 -0.909 252 HB VAL 695 HB VAL 695 2.414 -3.093 -2.976 253 HG11 VAL 695 HG11 VAL 695 2.273 -3.056 -0.218 254 HG12 VAL 695 HG12 VAL 695 0.598 -2.750 -0.674 255 HG13 VAL 695 HG13 VAL 695 1.414 -4.201 -1.253 256 HG21 VAL 695 HG21 VAL 695 1.153 -1.072 -3.717 257 HG22 VAL 695 HG22 VAL 695 0.070 -2.353 -3.178 258 HG23 VAL 695 HG23 VAL 695 0.403 -0.978 -2.126 259 H ARG 696 H ARG 696 4.025 -2.436 0.293 260 HA ARG 696 HA ARG 696 6.499 -3.396 -1.029 261 HB2 ARG 696 HB2 ARG 696 7.772 -2.855 0.919 262 HB3 ARG 696 HB3 ARG 696 6.830 -1.422 0.508 263 HG2 ARG 696 HG2 ARG 696 6.341 -1.534 2.762 264 HG3 ARG 696 HG3 ARG 696 5.060 -2.575 2.152 265 HD2 ARG 696 HD2 ARG 696 5.999 -3.854 3.886 266 HD3 ARG 696 HD3 ARG 696 6.774 -4.509 2.460 267 HE ARG 696 HE ARG 696 8.673 -2.882 3.042 268 HH11 ARG 696 HH21 ARG 696 6.523 -4.290 5.425 269 HH12 ARG 696 HH22 ARG 696 7.730 -4.238 6.669 270 HH21 ARG 696 HH11 ARG 696 10.174 -2.869 4.687 271 HH22 ARG 696 HH12 ARG 696 9.764 -3.451 6.262 272 H GLN 697 H GLN 697 7.564 -5.176 -0.005 273 HA GLN 697 HA GLN 697 5.755 -6.950 1.528 274 HB2 GLN 697 HB2 GLN 697 6.160 -7.543 -0.960 275 HB3 GLN 697 HB3 GLN 697 7.783 -7.993 -0.444 276 HG2 GLN 697 HG2 GLN 697 7.003 -9.718 0.948 277 HG3 GLN 697 HG3 GLN 697 5.380 -9.039 1.038 278 HE21 GLN 697 HE21 GLN 697 6.468 -11.762 0.042 279 HE22 GLN 697 HE22 GLN 697 5.748 -11.936 -1.485 280 H ARG 698 H ARG 698 9.122 -7.319 0.458 281 HA ARG 698 HA ARG 698 11.085 -7.623 1.606 282 HB2 ARG 698 HB2 ARG 698 10.385 -5.292 2.413 283 HB3 ARG 698 HB3 ARG 698 9.835 -6.091 3.885 284 HG2 ARG 698 HG2 ARG 698 11.973 -5.829 4.608 285 HG3 ARG 698 HG3 ARG 698 12.344 -7.187 3.547 286 HD2 ARG 698 HD2 ARG 698 12.941 -5.692 1.740 287 HD3 ARG 698 HD3 ARG 698 12.390 -4.289 2.655 288 HE ARG 698 HE ARG 698 14.368 -5.631 4.154 289 HH11 ARG 698 HH21 ARG 698 13.989 -3.801 1.226 290 HH12 ARG 698 HH22 ARG 698 15.621 -3.198 1.270 291 HH21 ARG 698 HH11 ARG 698 16.453 -4.826 4.183 292 HH22 ARG 698 HH12 ARG 698 16.995 -3.764 2.932 293 H VAL 699 H VAL 699 8.355 -7.893 3.879 294 HA VAL 699 HA VAL 699 9.670 -10.239 5.102 295 HB VAL 699 HB VAL 699 8.855 -8.230 6.483 296 HG11 VAL 699 HG11 VAL 699 6.225 -9.145 6.947 297 HG12 VAL 699 HG12 VAL 699 6.707 -7.615 6.218 298 HG13 VAL 699 HG13 VAL 699 6.380 -9.013 5.198 299 HG21 VAL 699 HG21 VAL 699 7.451 -10.546 7.621 300 HG22 VAL 699 HG22 VAL 699 9.074 -10.928 7.045 301 HG23 VAL 699 HG23 VAL 699 8.840 -9.656 8.243 302 H LYS 700 H LYS 700 7.900 -11.875 5.952 303 HA LYS 700 HA LYS 700 5.604 -12.232 4.258 304 HB2 LYS 700 HB2 LYS 700 6.284 -14.199 3.063 305 HB3 LYS 700 HB3 LYS 700 7.489 -12.953 2.759 306 HG2 LYS 700 HG2 LYS 700 7.908 -14.887 5.031 307 HG3 LYS 700 HG3 LYS 700 8.262 -15.389 3.382 308 HD2 LYS 700 HD2 LYS 700 9.715 -13.363 3.127 309 HD3 LYS 700 HD3 LYS 700 9.451 -13.007 4.833 310 HE2 LYS 700 HE2 LYS 700 10.280 -15.784 4.355 311 HE3 LYS 700 HE3 LYS 700 11.480 -14.603 3.828 312 HZ1 LYS 700 HZ1 LYS 700 12.059 -14.428 5.962 313 HZ2 LYS 700 HZ2 LYS 700 10.553 -13.681 6.260 314 HZ3 LYS 700 HZ3 LYS 700 10.720 -15.362 6.490 315 H ASP 701 H ASP 701 7.852 -13.575 6.605 316 HA ASP 701 HA ASP 701 6.297 -15.739 7.515 317 HB2 ASP 701 HB2 ASP 701 7.983 -14.316 9.497 318 HB3 ASP 701 HB3 ASP 701 7.975 -16.016 9.034 319 H ALA 702 H ALA 702 4.425 -13.803 7.156 320 HA ALA 702 HA ALA 702 3.018 -13.795 9.609 321 HB1 ALA 702 HB1 ALA 702 3.492 -10.956 9.064 322 HB2 ALA 702 HB2 ALA 702 4.941 -11.814 9.591 323 HB3 ALA 702 HB3 ALA 702 3.493 -11.827 10.597 324 H ALA 703 H ALA 703 3.167 -13.466 6.331 325 HA ALA 703 HA ALA 703 1.673 -12.854 4.675 326 HB1 ALA 703 HB1 ALA 703 0.452 -14.645 6.119 327 HB2 ALA 703 HB2 ALA 703 -0.495 -13.695 4.975 328 HB3 ALA 703 HB3 ALA 703 -0.520 -13.288 6.691 329 H GLU 704 H GLU 704 2.679 -10.756 6.428 330 HA GLU 704 HA GLU 704 0.478 -8.860 6.735 331 HB2 GLU 704 HB2 GLU 704 2.208 -9.088 8.496 332 HB3 GLU 704 HB3 GLU 704 3.431 -8.559 7.342 333 HG2 GLU 704 HG2 GLU 704 0.993 -6.855 7.793 334 HG3 GLU 704 HG3 GLU 704 2.305 -6.808 8.965 335 H PHE 705 H PHE 705 0.178 -7.055 5.548 336 HA PHE 705 HA PHE 705 2.155 -6.234 3.553 337 HB2 PHE 705 HB2 PHE 705 -0.701 -6.941 2.818 338 HB3 PHE 705 HB3 PHE 705 0.468 -6.172 1.746 339 HD1 PHE 705 HD2 PHE 705 2.397 -7.422 0.883 340 HD2 PHE 705 HD1 PHE 705 -0.519 -9.294 3.421 341 HE1 PHE 705 HE2 PHE 705 3.269 -9.650 0.242 342 HE2 PHE 705 HE1 PHE 705 0.351 -11.524 2.776 343 HZ PHE 705 HZ PHE 705 2.247 -11.703 1.190 344 H ALA 706 H ALA 706 1.554 -4.107 2.582 345 HA ALA 706 HA ALA 706 -0.532 -2.540 3.818 346 HB1 ALA 706 HB1 ALA 706 1.652 -2.742 5.389 347 HB2 ALA 706 HB2 ALA 706 0.651 -1.293 5.317 348 HB3 ALA 706 HB3 ALA 706 2.131 -1.384 4.374 349 H ILE 707 H ILE 707 -0.978 -0.702 2.655 350 HA ILE 707 HA ILE 707 0.627 -0.329 0.213 351 HB ILE 707 HB ILE 707 -2.138 0.706 0.880 352 HG12 ILE 707 HG12 ILE 707 -1.253 -1.579 -0.911 353 HG13 ILE 707 HG13 ILE 707 -1.978 -1.775 0.682 354 HG21 ILE 707 HG21 ILE 707 -1.174 2.146 -0.759 355 HG22 ILE 707 HG22 ILE 707 -0.392 0.802 -1.590 356 HG23 ILE 707 HG23 ILE 707 -2.143 0.994 -1.675 357 HD11 ILE 707 HD11 ILE 707 -3.642 -0.007 -0.817 358 HD12 ILE 707 HD12 ILE 707 -3.296 -1.414 -1.824 359 HD13 ILE 707 HD13 ILE 707 -4.017 -1.629 -0.229 360 H SER 708 H SER 708 1.638 1.528 -0.280 361 HA SER 708 HA SER 708 1.632 3.658 1.782 362 HB2 SER 708 HB2 SER 708 3.774 2.480 1.526 363 HB3 SER 708 HB3 SER 708 3.775 2.844 -0.189 364 HG SER 708 HG SER 708 3.589 4.856 1.797 365 H ILE 709 H ILE 709 0.797 5.597 1.184 366 HA ILE 709 HA ILE 709 0.826 6.262 -1.703 367 HB ILE 709 HB ILE 709 -1.548 6.959 -0.000 368 HG12 ILE 709 HG12 ILE 709 -2.452 4.850 -1.445 369 HG13 ILE 709 HG13 ILE 709 -0.802 4.314 -1.131 370 HG21 ILE 709 HG21 ILE 709 -2.238 6.395 -2.678 371 HG22 ILE 709 HG22 ILE 709 -2.109 7.987 -1.932 372 HG23 ILE 709 HG23 ILE 709 -0.723 7.289 -2.769 373 HD11 ILE 709 HD11 ILE 709 -1.800 3.536 0.795 374 HD12 ILE 709 HD12 ILE 709 -1.405 5.167 1.335 375 HD13 ILE 709 HD13 ILE 709 -3.038 4.791 0.783 376 H LYS 710 H LYS 710 1.236 8.299 -2.250 377 HA LYS 710 HA LYS 710 2.250 10.112 -0.244 378 HB2 LYS 710 HB2 LYS 710 3.343 10.134 -2.373 379 HB3 LYS 710 HB3 LYS 710 1.814 10.289 -3.233 380 HG2 LYS 710 HG2 LYS 710 2.705 12.470 -3.270 381 HG3 LYS 710 HG3 LYS 710 1.545 12.510 -1.946 382 HD2 LYS 710 HD2 LYS 710 3.656 11.774 -0.520 383 HD3 LYS 710 HD3 LYS 710 4.527 12.539 -1.850 384 HE2 LYS 710 HE2 LYS 710 4.044 14.141 -0.023 385 HE3 LYS 710 HE3 LYS 710 3.249 14.607 -1.523 386 HZ1 LYS 710 HZ1 LYS 710 1.173 13.765 -0.773 387 HZ2 LYS 710 HZ2 LYS 710 1.920 12.996 0.586 388 HZ3 LYS 710 HZ3 LYS 710 1.826 14.690 0.495 389 H TYR 711 H TYR 711 1.037 11.514 0.911 390 HA TYR 711 HA TYR 711 -1.458 12.554 -0.257 391 HB2 TYR 711 HB2 TYR 711 -1.770 10.418 1.206 392 HB3 TYR 711 HB3 TYR 711 -1.457 11.503 2.560 393 HD1 TYR 711 HD2 TYR 711 -2.895 13.590 2.803 394 HD2 TYR 711 HD1 TYR 711 -3.848 10.378 0.129 395 HE1 TYR 711 HE2 TYR 711 -5.233 14.412 2.652 396 HE2 TYR 711 HE1 TYR 711 -6.185 11.189 -0.015 397 HH TYR 711 HH TYR 711 -7.481 13.119 0.337 398 H ASN 712 H ASN 712 -1.754 14.641 0.163 399 HA ASN 712 HA ASN 712 -1.249 16.784 0.881 400 HB2 ASN 712 HB2 ASN 712 -2.737 15.764 2.658 401 HB3 ASN 712 HB3 ASN 712 -1.280 15.463 3.597 402 HD21 ASN 712 HD21 ASN 712 0.208 17.616 3.604 403 HD22 ASN 712 HD22 ASN 712 -0.646 19.031 4.008 404 H VAL 713 H VAL 713 0.962 16.331 -0.096 405 HA VAL 713 HA VAL 713 3.235 16.438 -0.027 406 HB VAL 713 HB VAL 713 4.150 18.231 1.195 407 HG11 VAL 713 HG11 VAL 713 2.584 19.991 0.837 408 HG12 VAL 713 HG12 VAL 713 2.174 18.752 -0.349 409 HG13 VAL 713 HG13 VAL 713 1.208 18.925 1.117 410 HG21 VAL 713 HG21 VAL 713 3.076 17.173 3.419 411 HG22 VAL 713 HG22 VAL 713 3.578 18.860 3.340 412 HG23 VAL 713 HG23 VAL 713 1.882 18.438 3.128 413 H GLU 714 H GLU 714 1.791 14.460 1.896 414 HA GLU 714 HA GLU 714 4.283 13.493 3.131 415 HB2 GLU 714 HB2 GLU 714 1.813 14.283 4.458 416 HB3 GLU 714 HB3 GLU 714 2.225 12.598 4.791 417 HG2 GLU 714 HG2 GLU 714 4.278 14.795 4.959 418 HG3 GLU 714 HG3 GLU 714 3.260 14.382 6.334 419 H VAL 715 H VAL 715 3.713 11.103 3.992 420 HA VAL 715 HA VAL 715 2.313 9.721 1.759 421 HB VAL 715 HB VAL 715 4.766 8.790 3.267 422 HG11 VAL 715 HG11 VAL 715 3.320 6.932 2.598 423 HG12 VAL 715 HG12 VAL 715 3.199 7.584 0.966 424 HG13 VAL 715 HG13 VAL 715 4.744 6.973 1.560 425 HG21 VAL 715 HG21 VAL 715 4.341 9.920 0.489 426 HG22 VAL 715 HG22 VAL 715 5.420 10.524 1.747 427 HG23 VAL 715 HG23 VAL 715 5.773 9.002 0.935 428 H LYS 716 H LYS 716 0.930 8.084 2.245 429 HA LYS 716 HA LYS 716 0.484 7.564 5.136 430 HB2 LYS 716 HB2 LYS 716 -1.343 8.607 3.488 431 HB3 LYS 716 HB3 LYS 716 -1.605 6.907 3.109 432 HG2 LYS 716 HG2 LYS 716 -2.465 6.424 5.191 433 HG3 LYS 716 HG3 LYS 716 -1.386 7.561 6.002 434 HD2 LYS 716 HD2 LYS 716 -3.867 8.296 4.409 435 HD3 LYS 716 HD3 LYS 716 -3.701 8.356 6.149 436 HE2 LYS 716 HE2 LYS 716 -1.593 9.890 5.495 437 HE3 LYS 716 HE3 LYS 716 -2.604 10.194 4.082 438 HZ1 LYS 716 HZ1 LYS 716 -4.346 10.336 6.214 439 HZ2 LYS 716 HZ2 LYS 716 -2.921 11.110 6.771 440 HZ3 LYS 716 HZ3 LYS 716 -3.675 11.653 5.352 441 H HIS 717 H HIS 717 0.728 5.547 5.874 442 HA HIS 717 HA HIS 717 0.854 3.324 3.920 443 HB2 HIS 717 HB2 HIS 717 2.502 3.373 6.445 444 HB3 HIS 717 HB3 HIS 717 2.702 2.352 5.026 445 HD1 HIS 717 HD1 HIS 717 4.199 3.205 3.182 446 HD2 HIS 717 HD2 HIS 717 3.408 6.128 6.043 447 HE1 HIS 717 HE1 HIS 717 5.783 5.123 2.707 448 HE2 HIS 717 HE2 HIS 717 5.313 6.932 4.464 449 H ILE 718 H ILE 718 -1.026 2.240 4.298 450 HA ILE 718 HA ILE 718 -1.808 1.728 7.117 451 HB ILE 718 HB ILE 718 -3.355 2.173 4.615 452 HG12 ILE 718 HG12 ILE 718 -3.282 3.892 6.345 453 HG13 ILE 718 HG13 ILE 718 -4.909 3.232 6.225 454 HG21 ILE 718 HG21 ILE 718 -5.324 0.985 5.702 455 HG22 ILE 718 HG22 ILE 718 -4.081 -0.075 5.038 456 HG23 ILE 718 HG23 ILE 718 -4.159 0.214 6.775 457 HD11 ILE 718 HD11 ILE 718 -4.712 3.039 8.480 458 HD12 ILE 718 HD12 ILE 718 -3.847 1.558 8.080 459 HD13 ILE 718 HD13 ILE 718 -2.952 3.037 8.426 460 H LYS 719 H LYS 719 -2.092 -0.366 7.809 461 HA LYS 719 HA LYS 719 -0.656 -2.388 6.359 462 HB2 LYS 719 HB2 LYS 719 -1.632 -1.981 9.052 463 HB3 LYS 719 HB3 LYS 719 -1.997 -3.613 8.494 464 HG2 LYS 719 HG2 LYS 719 0.323 -4.011 7.921 465 HG3 LYS 719 HG3 LYS 719 0.744 -2.333 8.267 466 HD2 LYS 719 HD2 LYS 719 -0.612 -3.507 10.544 467 HD3 LYS 719 HD3 LYS 719 0.763 -4.507 10.075 468 HE2 LYS 719 HE2 LYS 719 1.375 -2.728 11.719 469 HE3 LYS 719 HE3 LYS 719 2.259 -2.588 10.197 470 HZ1 LYS 719 HZ1 LYS 719 1.555 -0.460 10.359 471 HZ2 LYS 719 HZ2 LYS 719 0.145 -1.105 9.637 472 HZ3 LYS 719 HZ3 LYS 719 0.179 -0.857 11.330 473 H ILE 720 H ILE 720 -1.375 -4.316 5.537 474 HA ILE 720 HA ILE 720 -4.233 -4.374 4.800 475 HB ILE 720 HB ILE 720 -1.761 -5.575 3.569 476 HG12 ILE 720 HG12 ILE 720 -3.984 -3.903 2.377 477 HG13 ILE 720 HG13 ILE 720 -2.494 -3.219 3.027 478 HG21 ILE 720 HG21 ILE 720 -4.636 -6.378 3.287 479 HG22 ILE 720 HG22 ILE 720 -3.594 -6.430 1.867 480 HG23 ILE 720 HG23 ILE 720 -3.192 -7.390 3.291 481 HD11 ILE 720 HD11 ILE 720 -2.906 -4.224 0.433 482 HD12 ILE 720 HD12 ILE 720 -1.373 -3.730 1.146 483 HD13 ILE 720 HD13 ILE 720 -1.892 -5.413 1.245 484 H MET 721 H MET 721 -5.524 -6.000 5.505 485 HA MET 721 HA MET 721 -4.301 -7.920 7.358 486 HB2 MET 721 HB2 MET 721 -6.467 -6.522 7.788 487 HB3 MET 721 HB3 MET 721 -7.241 -7.782 6.831 488 HG2 MET 721 HG2 MET 721 -5.946 -9.435 8.364 489 HG3 MET 721 HG3 MET 721 -5.779 -8.051 9.447 490 HE1 MET 721 HE1 MET 721 -6.590 -10.001 10.679 491 HE2 MET 721 HE2 MET 721 -7.807 -9.129 11.611 492 HE3 MET 721 HE3 MET 721 -8.239 -10.614 10.758 493 H THR 722 H THR 722 -4.612 -10.121 7.258 494 HA THR 722 HA THR 722 -5.631 -11.243 4.729 495 HB THR 722 HB THR 722 -3.638 -12.892 4.963 496 HG1 THR 722 HG1 THR 722 -1.881 -11.261 5.876 497 HG21 THR 722 HG21 THR 722 -3.110 -10.003 4.235 498 HG22 THR 722 HG22 THR 722 -2.237 -11.411 3.627 499 HG23 THR 722 HG23 THR 722 -3.929 -11.167 3.193 500 H ALA 723 H ALA 723 -7.059 -12.801 5.113 501 HA ALA 723 HA ALA 723 -6.833 -14.473 7.522 502 HB1 ALA 723 HB1 ALA 723 -9.469 -14.012 7.628 503 HB2 ALA 723 HB2 ALA 723 -8.962 -12.468 6.948 504 HB3 ALA 723 HB3 ALA 723 -8.312 -13.003 8.501 505 H GLU 724 H GLU 724 -9.527 -13.847 5.398 506 HA GLU 724 HA GLU 724 -9.886 -16.645 4.788 507 HB2 GLU 724 HB2 GLU 724 -11.352 -14.465 3.371 508 HB3 GLU 724 HB3 GLU 724 -11.968 -15.978 4.031 509 HG2 GLU 724 HG2 GLU 724 -12.826 -14.459 5.577 510 HG3 GLU 724 HG3 GLU 724 -11.296 -14.865 6.347 511 H GLY 725 H GLY 725 -7.455 -15.077 3.840 512 HA2 GLY 725 HA2 GLY 725 -6.063 -15.395 1.990 513 HA3 GLY 725 HA3 GLY 725 -7.416 -16.130 1.128 514 H LEU 726 H LEU 726 -8.491 -13.344 2.546 515 HA LEU 726 HA LEU 726 -8.385 -11.892 0.003 516 HB2 LEU 726 HB2 LEU 726 -9.958 -11.280 2.517 517 HB3 LEU 726 HB3 LEU 726 -10.152 -10.508 0.944 518 HG LEU 726 HG LEU 726 -10.380 -13.488 1.075 519 HD11 LEU 726 HD11 LEU 726 -12.624 -13.447 1.853 520 HD12 LEU 726 HD12 LEU 726 -11.735 -12.429 2.989 521 HD13 LEU 726 HD13 LEU 726 -12.719 -11.691 1.725 522 HD21 LEU 726 HD21 LEU 726 -12.058 -13.019 -0.691 523 HD22 LEU 726 HD22 LEU 726 -11.810 -11.289 -0.451 524 HD23 LEU 726 HD23 LEU 726 -10.497 -12.290 -1.070 525 H TYR 727 H TYR 727 -7.989 -9.599 0.003 526 HA TYR 727 HA TYR 727 -5.992 -8.791 2.052 527 HB2 TYR 727 HB2 TYR 727 -6.217 -7.925 -0.850 528 HB3 TYR 727 HB3 TYR 727 -5.029 -7.330 0.307 529 HD1 TYR 727 HD2 TYR 727 -6.226 -10.416 -1.420 530 HD2 TYR 727 HD1 TYR 727 -3.068 -8.558 0.825 531 HE1 TYR 727 HE2 TYR 727 -4.744 -12.357 -1.887 532 HE2 TYR 727 HE1 TYR 727 -1.594 -10.493 0.355 533 HH TYR 727 HH TYR 727 -2.256 -12.819 -1.993 534 H ARG 728 H ARG 728 -6.384 -6.990 3.208 535 HA ARG 728 HA ARG 728 -8.171 -4.936 2.179 536 HB2 ARG 728 HB2 ARG 728 -9.328 -5.021 4.543 537 HB3 ARG 728 HB3 ARG 728 -9.898 -6.020 3.211 538 HG2 ARG 728 HG2 ARG 728 -9.182 -7.967 4.180 539 HG3 ARG 728 HG3 ARG 728 -7.731 -7.218 4.842 540 HD2 ARG 728 HD2 ARG 728 -8.854 -6.412 6.742 541 HD3 ARG 728 HD3 ARG 728 -10.436 -6.535 5.983 542 HE ARG 728 HE ARG 728 -8.989 -8.667 7.315 543 HH11 ARG 728 HH21 ARG 728 -11.500 -7.807 5.086 544 HH12 ARG 728 HH22 ARG 728 -12.229 -9.385 5.137 545 HH21 ARG 728 HH11 ARG 728 -9.954 -10.687 7.356 546 HH22 ARG 728 HH12 ARG 728 -11.361 -11.025 6.381 547 H ILE 729 H ILE 729 -7.620 -2.980 2.825 548 HA ILE 729 HA ILE 729 -5.245 -2.623 4.430 549 HB ILE 729 HB ILE 729 -6.138 -0.100 4.021 550 HG12 ILE 729 HG12 ILE 729 -8.200 -1.184 2.910 551 HG13 ILE 729 HG13 ILE 729 -7.402 0.121 2.038 552 HG21 ILE 729 HG21 ILE 729 -4.984 -0.722 1.566 553 HG22 ILE 729 HG22 ILE 729 -4.131 -0.229 3.026 554 HG23 ILE 729 HG23 ILE 729 -4.339 -1.942 2.661 555 HD11 ILE 729 HD11 ILE 729 -7.974 -2.407 1.042 556 HD12 ILE 729 HD12 ILE 729 -6.863 -1.240 0.328 557 HD13 ILE 729 HD13 ILE 729 -6.249 -2.489 1.412 558 H THR 730 H THR 730 -8.630 -2.539 4.856 559 HA THR 730 HA THR 730 -8.250 -1.547 7.605 560 HB THR 730 HB THR 730 -9.420 0.037 5.959 561 HG1 THR 730 HG1 THR 730 -10.154 -0.740 8.522 562 HG21 THR 730 HG21 THR 730 -12.034 -0.941 6.265 563 HG22 THR 730 HG22 THR 730 -11.100 -0.835 4.776 564 HG23 THR 730 HG23 THR 730 -11.078 -2.315 5.718 565 H GLU 731 H GLU 731 -9.798 -2.366 9.109 566 HA GLU 731 HA GLU 731 -10.100 -5.181 8.987 567 HB2 GLU 731 HB2 GLU 731 -11.384 -4.757 11.125 568 HB3 GLU 731 HB3 GLU 731 -9.768 -4.039 11.082 569 HG2 GLU 731 HG2 GLU 731 -12.046 -2.398 10.056 570 HG3 GLU 731 HG3 GLU 731 -11.900 -2.594 11.794 571 H LYS 732 H LYS 732 -11.943 -2.777 7.543 572 HA LYS 732 HA LYS 732 -14.488 -4.142 7.900 573 HB2 LYS 732 HB2 LYS 732 -14.141 -1.714 6.206 574 HB3 LYS 732 HB3 LYS 732 -15.536 -2.229 7.151 575 HG2 LYS 732 HG2 LYS 732 -14.543 -1.577 9.189 576 HG3 LYS 732 HG3 LYS 732 -12.930 -1.525 8.485 577 HD2 LYS 732 HD2 LYS 732 -14.316 0.254 6.897 578 HD3 LYS 732 HD3 LYS 732 -15.017 0.534 8.488 579 HE2 LYS 732 HE2 LYS 732 -12.305 0.273 9.001 580 HE3 LYS 732 HE3 LYS 732 -12.358 1.191 7.496 581 HZ1 LYS 732 HZ1 LYS 732 -13.594 2.878 8.468 582 HZ2 LYS 732 HZ2 LYS 732 -14.123 1.906 9.772 583 HZ3 LYS 732 HZ3 LYS 732 -12.493 2.464 9.718 584 H LYS 733 H LYS 733 -12.059 -3.805 5.432 585 HA LYS 733 HA LYS 733 -13.950 -4.814 3.402 586 HB2 LYS 733 HB2 LYS 733 -11.900 -2.850 3.351 587 HB3 LYS 733 HB3 LYS 733 -11.452 -4.135 2.232 588 HG2 LYS 733 HG2 LYS 733 -12.821 -2.575 1.002 589 HG3 LYS 733 HG3 LYS 733 -13.808 -4.005 1.296 590 HD2 LYS 733 HD2 LYS 733 -15.167 -2.078 1.807 591 HD3 LYS 733 HD3 LYS 733 -14.740 -2.833 3.341 592 HE2 LYS 733 HE2 LYS 733 -13.223 -1.157 3.901 593 HE3 LYS 733 HE3 LYS 733 -12.962 -0.697 2.218 594 HZ1 LYS 733 HZ1 LYS 733 -15.535 -0.270 3.689 595 HZ2 LYS 733 HZ2 LYS 733 -14.290 0.916 3.523 596 HZ3 LYS 733 HZ3 LYS 733 -15.089 0.341 2.115 597 H ALA 734 H ALA 734 -12.465 -5.828 1.543 598 HA ALA 734 HA ALA 734 -10.465 -7.679 2.200 599 HB1 ALA 734 HB1 ALA 734 -11.529 -9.493 2.997 600 HB2 ALA 734 HB2 ALA 734 -12.727 -9.427 1.705 601 HB3 ALA 734 HB3 ALA 734 -12.966 -8.488 3.178 602 H PHE 735 H PHE 735 -9.497 -8.113 0.307 603 HA PHE 735 HA PHE 735 -11.160 -8.272 -2.146 604 HB2 PHE 735 HB2 PHE 735 -8.556 -6.820 -1.693 605 HB3 PHE 735 HB3 PHE 735 -9.058 -7.324 -3.311 606 HD1 PHE 735 HD2 PHE 735 -10.178 -5.389 -0.309 607 HD2 PHE 735 HD1 PHE 735 -10.641 -6.059 -4.528 608 HE1 PHE 735 HE2 PHE 735 -11.669 -3.410 -0.461 609 HE2 PHE 735 HE1 PHE 735 -12.128 -4.083 -4.682 610 HZ PHE 735 HZ PHE 735 -12.646 -2.761 -2.644 611 H ARG 736 H ARG 736 -10.355 -9.687 -3.796 612 HA ARG 736 HA ARG 736 -9.261 -12.111 -2.813 613 HB2 ARG 736 HB2 ARG 736 -9.082 -11.479 -5.722 614 HB3 ARG 736 HB3 ARG 736 -9.622 -12.953 -4.922 615 HG2 ARG 736 HG2 ARG 736 -11.633 -11.539 -4.101 616 HG3 ARG 736 HG3 ARG 736 -11.149 -10.384 -5.346 617 HD2 ARG 736 HD2 ARG 736 -11.182 -12.322 -6.991 618 HD3 ARG 736 HD3 ARG 736 -11.951 -13.275 -5.725 619 HE ARG 736 HE ARG 736 -13.914 -12.047 -6.036 620 HH11 ARG 736 HH21 ARG 736 -11.248 -10.546 -7.697 621 HH12 ARG 736 HH22 ARG 736 -12.288 -9.487 -8.608 622 HH21 ARG 736 HH11 ARG 736 -15.206 -10.660 -7.217 623 HH22 ARG 736 HH12 ARG 736 -14.499 -9.553 -8.338 624 H GLY 737 H GLY 737 -7.807 -9.247 -4.102 625 HA2 GLY 737 HA2 GLY 737 -5.172 -10.091 -3.388 626 HA3 GLY 737 HA3 GLY 737 -5.401 -10.105 -5.132 627 H LEU 738 H LEU 738 -3.614 -8.416 -3.673 628 HA LEU 738 HA LEU 738 -4.367 -5.866 -3.066 629 HB2 LEU 738 HB2 LEU 738 -1.954 -7.122 -4.177 630 HB3 LEU 738 HB3 LEU 738 -2.127 -5.428 -4.624 631 HG LEU 738 HG LEU 738 -0.871 -5.673 -2.522 632 HD11 LEU 738 HD11 LEU 738 -2.815 -3.882 -3.054 633 HD12 LEU 738 HD12 LEU 738 -3.454 -4.574 -1.566 634 HD13 LEU 738 HD13 LEU 738 -1.850 -3.839 -1.583 635 HD21 LEU 738 HD21 LEU 738 -2.073 -7.802 -1.855 636 HD22 LEU 738 HD22 LEU 738 -1.866 -6.626 -0.559 637 HD23 LEU 738 HD23 LEU 738 -3.430 -6.789 -1.356 638 H THR 739 H THR 739 -3.555 -7.023 -6.310 639 HA THR 739 HA THR 739 -4.076 -4.775 -7.804 640 HB THR 739 HB THR 739 -4.925 -7.512 -8.724 641 HG1 THR 739 HG1 THR 739 -2.305 -6.783 -9.073 642 HG21 THR 739 HG21 THR 739 -5.235 -6.021 -10.479 643 HG22 THR 739 HG22 THR 739 -3.901 -4.985 -9.969 644 HG23 THR 739 HG23 THR 739 -3.571 -6.529 -10.758 645 H GLU 740 H GLU 740 -6.432 -7.191 -6.681 646 HA GLU 740 HA GLU 740 -8.699 -6.042 -7.973 647 HB2 GLU 740 HB2 GLU 740 -8.741 -7.640 -5.405 648 HB3 GLU 740 HB3 GLU 740 -10.013 -7.513 -6.620 649 HG2 GLU 740 HG2 GLU 740 -7.560 -8.428 -7.837 650 HG3 GLU 740 HG3 GLU 740 -7.973 -9.460 -6.479 651 H LEU 741 H LEU 741 -7.005 -5.421 -5.021 652 HA LEU 741 HA LEU 741 -9.078 -3.719 -3.895 653 HB2 LEU 741 HB2 LEU 741 -7.809 -5.056 -2.362 654 HB3 LEU 741 HB3 LEU 741 -6.284 -4.559 -3.076 655 HG LEU 741 HG LEU 741 -6.940 -3.513 -0.833 656 HD11 LEU 741 HD11 LEU 741 -5.329 -2.662 -2.785 657 HD12 LEU 741 HD12 LEU 741 -6.507 -1.350 -2.859 658 HD13 LEU 741 HD13 LEU 741 -5.645 -1.675 -1.359 659 HD21 LEU 741 HD21 LEU 741 -8.379 -1.440 -1.131 660 HD22 LEU 741 HD22 LEU 741 -8.871 -2.085 -2.691 661 HD23 LEU 741 HD23 LEU 741 -9.246 -2.968 -1.215 662 H VAL 742 H VAL 742 -5.851 -3.490 -5.232 663 HA VAL 742 HA VAL 742 -5.520 -0.685 -5.120 664 HB VAL 742 HB VAL 742 -4.312 -2.855 -6.834 665 HG11 VAL 742 HG11 VAL 742 -3.873 -0.987 -8.142 666 HG12 VAL 742 HG12 VAL 742 -3.818 0.100 -6.751 667 HG13 VAL 742 HG13 VAL 742 -2.475 -1.001 -7.061 668 HG21 VAL 742 HG21 VAL 742 -3.360 -1.344 -4.394 669 HG22 VAL 742 HG22 VAL 742 -3.874 -3.033 -4.453 670 HG23 VAL 742 HG23 VAL 742 -2.405 -2.525 -5.290 671 H GLU 743 H GLU 743 -6.332 -2.789 -7.878 672 HA GLU 743 HA GLU 743 -6.761 -0.685 -9.712 673 HB2 GLU 743 HB2 GLU 743 -7.875 -3.495 -9.737 674 HB3 GLU 743 HB3 GLU 743 -7.755 -2.409 -11.127 675 HG2 GLU 743 HG2 GLU 743 -5.315 -3.073 -9.487 676 HG3 GLU 743 HG3 GLU 743 -5.852 -4.153 -10.759 677 H PHE 744 H PHE 744 -8.790 -2.049 -7.263 678 HA PHE 744 HA PHE 744 -11.259 -1.034 -8.395 679 HB2 PHE 744 HB2 PHE 744 -11.354 -3.013 -6.996 680 HB3 PHE 744 HB3 PHE 744 -10.584 -2.155 -5.661 681 HD1 PHE 744 HD1 PHE 744 -13.520 -1.762 -7.978 682 HD2 PHE 744 HD2 PHE 744 -11.959 -1.282 -4.009 683 HE1 PHE 744 HE1 PHE 744 -15.735 -0.962 -7.204 684 HE2 PHE 744 HE2 PHE 744 -14.174 -0.477 -3.233 685 HZ PHE 744 HZ PHE 744 -16.063 -0.318 -4.831 686 H TYR 745 H TYR 745 -8.877 -0.034 -6.008 687 HA TYR 745 HA TYR 745 -10.424 2.218 -5.097 688 HB2 TYR 745 HB2 TYR 745 -7.641 1.223 -4.613 689 HB3 TYR 745 HB3 TYR 745 -8.114 2.844 -4.111 690 HD1 TYR 745 HD2 TYR 745 -10.931 0.652 -4.158 691 HD2 TYR 745 HD1 TYR 745 -7.530 1.794 -1.796 692 HE1 TYR 745 HE2 TYR 745 -12.035 -0.244 -2.133 693 HE2 TYR 745 HE1 TYR 745 -8.643 0.889 0.225 694 HH TYR 745 HH TYR 745 -11.980 0.036 0.242 695 H GLN 746 H GLN 746 -8.691 1.661 -7.911 696 HA GLN 746 HA GLN 746 -7.416 4.134 -8.370 697 HB2 GLN 746 HB2 GLN 746 -8.643 2.059 -10.175 698 HB3 GLN 746 HB3 GLN 746 -8.038 3.578 -10.839 699 HG2 GLN 746 HG2 GLN 746 -5.894 3.018 -9.415 700 HG3 GLN 746 HG3 GLN 746 -6.514 1.370 -9.483 701 HE21 GLN 746 HE21 GLN 746 -5.359 0.301 -11.141 702 HE22 GLN 746 HE22 GLN 746 -5.069 0.979 -12.672 703 H GLN 747 H GLN 747 -10.733 3.098 -8.554 704 HA GLN 747 HA GLN 747 -11.590 5.835 -9.294 705 HB2 GLN 747 HB2 GLN 747 -13.143 3.248 -9.571 706 HB3 GLN 747 HB3 GLN 747 -13.633 4.839 -10.153 707 HG2 GLN 747 HG2 GLN 747 -11.109 3.428 -11.069 708 HG3 GLN 747 HG3 GLN 747 -12.642 3.339 -11.932 709 HE21 GLN 747 HE21 GLN 747 -10.018 5.547 -10.995 710 HE22 GLN 747 HE22 GLN 747 -10.431 6.760 -12.109 711 H ASN 748 H ASN 748 -11.747 3.281 -6.961 712 HA ASN 748 HA ASN 748 -13.882 4.609 -5.433 713 HB2 ASN 748 HB2 ASN 748 -14.184 2.248 -5.641 714 HB3 ASN 748 HB3 ASN 748 -12.511 1.926 -5.203 715 HD21 ASN 748 HD21 ASN 748 -11.903 2.686 -2.899 716 HD22 ASN 748 HD22 ASN 748 -13.094 2.493 -1.704 717 H SER 749 H SER 749 -13.109 6.290 -4.276 718 HA SER 749 HA SER 749 -10.630 6.918 -3.441 719 HB2 SER 749 HB2 SER 749 -13.027 8.002 -3.047 720 HB3 SER 749 HB3 SER 749 -12.783 7.330 -1.442 721 HG SER 749 HG SER 749 -10.496 8.454 -2.196 722 H LEU 750 H LEU 750 -9.205 6.414 -1.855 723 HA LEU 750 HA LEU 750 -9.255 3.824 -0.731 724 HB2 LEU 750 HB2 LEU 750 -7.609 6.259 -0.058 725 HB3 LEU 750 HB3 LEU 750 -7.330 4.670 0.649 726 HG LEU 750 HG LEU 750 -7.600 4.347 -2.180 727 HD11 LEU 750 HD11 LEU 750 -6.243 5.920 -3.123 728 HD12 LEU 750 HD12 LEU 750 -6.791 6.884 -1.755 729 HD13 LEU 750 HD13 LEU 750 -5.233 6.063 -1.684 730 HD21 LEU 750 HD21 LEU 750 -5.096 4.225 -0.482 731 HD22 LEU 750 HD22 LEU 750 -6.345 2.980 -0.442 732 HD23 LEU 750 HD23 LEU 750 -5.457 3.293 -1.933 733 H LYS 751 H LYS 751 -10.300 6.923 0.527 734 HA LYS 751 HA LYS 751 -10.402 6.436 3.228 735 HB2 LYS 751 HB2 LYS 751 -12.318 7.987 3.316 736 HB3 LYS 751 HB3 LYS 751 -10.996 8.579 2.331 737 HG2 LYS 751 HG2 LYS 751 -12.423 7.329 0.419 738 HG3 LYS 751 HG3 LYS 751 -13.734 7.780 1.519 739 HD2 LYS 751 HD2 LYS 751 -12.855 10.098 1.584 740 HD3 LYS 751 HD3 LYS 751 -11.602 9.633 0.446 741 HE2 LYS 751 HE2 LYS 751 -13.946 8.831 -0.805 742 HE3 LYS 751 HE3 LYS 751 -14.352 10.388 -0.068 743 HZ1 LYS 751 HZ1 LYS 751 -13.363 10.883 -2.146 744 HZ2 LYS 751 HZ2 LYS 751 -12.160 11.220 -0.957 745 HZ3 LYS 751 HZ3 LYS 751 -12.080 9.764 -1.888 746 H ASP 752 H ASP 752 -12.071 4.818 0.746 747 HA ASP 752 HA ASP 752 -14.382 3.868 2.094 748 HB2 ASP 752 HB2 ASP 752 -14.374 3.319 -0.175 749 HB3 ASP 752 HB3 ASP 752 -12.672 2.866 -0.159 750 H CYS 753 H CYS 753 -11.024 2.890 2.062 751 HA CYS 753 HA CYS 753 -11.518 0.960 4.263 752 HB2 CYS 753 HB2 CYS 753 -9.620 0.983 1.970 753 HB3 CYS 753 HB3 CYS 753 -9.034 0.353 3.500 754 HG CYS 753 HG CYS 753 -10.936 -1.087 1.655 755 H PHE 754 H PHE 754 -9.221 3.293 2.913 756 HA PHE 754 HA PHE 754 -7.601 3.489 5.206 757 HB2 PHE 754 HB2 PHE 754 -8.060 5.221 2.807 758 HB3 PHE 754 HB3 PHE 754 -7.067 5.795 4.145 759 HD1 PHE 754 HD2 PHE 754 -7.519 2.713 2.055 760 HD2 PHE 754 HD1 PHE 754 -4.780 5.315 4.094 761 HE1 PHE 754 HE2 PHE 754 -5.614 1.372 1.210 762 HE2 PHE 754 HE1 PHE 754 -2.876 3.981 3.242 763 HZ PHE 754 HZ PHE 754 -3.294 2.009 1.803 764 H LYS 755 H LYS 755 -7.525 5.145 6.784 765 HA LYS 755 HA LYS 755 -10.156 6.004 7.616 766 HB2 LYS 755 HB2 LYS 755 -7.760 6.853 9.145 767 HB3 LYS 755 HB3 LYS 755 -9.276 6.151 9.708 768 HG2 LYS 755 HG2 LYS 755 -6.955 4.696 8.406 769 HG3 LYS 755 HG3 LYS 755 -7.547 4.500 10.052 770 HD2 LYS 755 HD2 LYS 755 -9.808 3.848 8.856 771 HD3 LYS 755 HD3 LYS 755 -8.762 3.524 7.479 772 HE2 LYS 755 HE2 LYS 755 -7.713 1.739 8.496 773 HE3 LYS 755 HE3 LYS 755 -7.931 2.404 10.117 774 HZ1 LYS 755 HZ1 LYS 755 -10.432 2.017 9.693 775 HZ2 LYS 755 HZ2 LYS 755 -9.916 0.950 8.429 776 HZ3 LYS 755 HZ3 LYS 755 -9.452 0.653 10.050 777 H SER 756 H SER 756 -7.062 7.801 7.282 778 HA SER 756 HA SER 756 -8.603 10.270 6.943 779 HB2 SER 756 HB2 SER 756 -6.581 11.442 7.327 780 HB3 SER 756 HB3 SER 756 -6.553 10.084 8.449 781 HG SER 756 HG SER 756 -4.878 9.317 7.445 782 H LEU 757 H LEU 757 -6.705 8.040 5.115 783 HA LEU 757 HA LEU 757 -5.891 9.507 2.902 784 HB2 LEU 757 HB2 LEU 757 -5.702 6.952 3.589 785 HB3 LEU 757 HB3 LEU 757 -7.067 6.805 2.489 786 HG LEU 757 HG LEU 757 -5.146 6.451 1.165 787 HD11 LEU 757 HD11 LEU 757 -6.857 8.057 0.276 788 HD12 LEU 757 HD12 LEU 757 -5.789 9.362 0.797 789 HD13 LEU 757 HD13 LEU 757 -5.245 8.215 -0.423 790 HD21 LEU 757 HD21 LEU 757 -3.217 7.940 1.199 791 HD22 LEU 757 HD22 LEU 757 -4.019 8.973 2.379 792 HD23 LEU 757 HD23 LEU 757 -3.539 7.332 2.829 793 H ASP 758 H ASP 758 -7.258 10.985 1.921 794 HA ASP 758 HA ASP 758 -9.867 9.901 1.053 795 HB2 ASP 758 HB2 ASP 758 -9.909 11.873 2.669 796 HB3 ASP 758 HB3 ASP 758 -9.275 12.847 1.348 797 H THR 759 H THR 759 -8.529 9.009 -0.710 798 HA THR 759 HA THR 759 -8.940 10.605 -3.044 799 HB THR 759 HB THR 759 -6.752 11.561 -2.356 800 HG1 THR 759 HG1 THR 759 -6.380 11.668 -4.420 801 HG21 THR 759 HG21 THR 759 -6.064 8.683 -2.245 802 HG22 THR 759 HG22 THR 759 -4.876 9.705 -3.046 803 HG23 THR 759 HG23 THR 759 -5.350 10.045 -1.383 804 H THR 760 H THR 760 -7.329 9.287 -4.859 805 HA THR 760 HA THR 760 -8.152 6.451 -4.528 806 HB THR 760 HB THR 760 -8.555 6.411 -6.995 807 HG1 THR 760 HG1 THR 760 -8.869 8.575 -7.901 808 HG21 THR 760 HG21 THR 760 -10.117 8.006 -5.040 809 HG22 THR 760 HG22 THR 760 -10.562 8.194 -6.737 810 HG23 THR 760 HG23 THR 760 -10.595 6.597 -5.990 811 H LEU 761 H LEU 761 -6.978 5.093 -6.320 812 HA LEU 761 HA LEU 761 -4.153 5.373 -5.821 813 HB2 LEU 761 HB2 LEU 761 -5.842 3.434 -7.403 814 HB3 LEU 761 HB3 LEU 761 -4.084 3.380 -7.477 815 HG LEU 761 HG LEU 761 -5.219 1.868 -5.728 816 HD11 LEU 761 HD11 LEU 761 -3.445 2.261 -4.109 817 HD12 LEU 761 HD12 LEU 761 -2.809 2.495 -5.734 818 HD13 LEU 761 HD13 LEU 761 -3.194 3.892 -4.733 819 HD21 LEU 761 HD21 LEU 761 -6.050 2.840 -3.746 820 HD22 LEU 761 HD22 LEU 761 -5.354 4.416 -4.119 821 HD23 LEU 761 HD23 LEU 761 -6.749 3.830 -5.024 822 H GLN 762 H GLN 762 -3.567 7.331 -6.729 823 HA GLN 762 HA GLN 762 -4.181 8.178 -9.353 824 HB2 GLN 762 HB2 GLN 762 -1.812 8.926 -7.629 825 HB3 GLN 762 HB3 GLN 762 -2.476 9.866 -8.962 826 HG2 GLN 762 HG2 GLN 762 -3.657 9.346 -6.243 827 HG3 GLN 762 HG3 GLN 762 -3.424 10.877 -7.067 828 HE21 GLN 762 HE21 GLN 762 -5.713 8.549 -6.305 829 HE22 GLN 762 HE22 GLN 762 -6.921 8.983 -7.428 830 H PHE 763 H PHE 763 -0.970 7.171 -8.146 831 HA PHE 763 HA PHE 763 -0.508 5.511 -10.466 832 HB2 PHE 763 HB2 PHE 763 1.717 7.187 -10.658 833 HB3 PHE 763 HB3 PHE 763 0.376 7.088 -11.795 834 HD1 PHE 763 HD1 PHE 763 1.560 8.823 -8.715 835 HD2 PHE 763 HD2 PHE 763 -1.167 8.879 -12.033 836 HE1 PHE 763 HE1 PHE 763 0.897 11.138 -8.127 837 HE2 PHE 763 HE2 PHE 763 -1.828 11.197 -11.447 838 HZ PHE 763 HZ PHE 763 -0.797 12.326 -9.494 839 HA PRO 764 HA PRO 764 2.336 3.556 -7.757 840 HB2 PRO 764 HB2 PRO 764 4.046 2.395 -9.536 841 HB3 PRO 764 HB3 PRO 764 2.377 1.838 -9.291 842 HG2 PRO 764 HG2 PRO 764 3.517 3.502 -11.468 843 HG3 PRO 764 HG3 PRO 764 2.257 2.259 -11.532 844 HD2 PRO 764 HD2 PRO 764 1.752 4.977 -11.532 845 HD3 PRO 764 HD3 PRO 764 0.594 3.744 -11.011 846 H PHE 765 H PHE 765 4.424 3.642 -6.864 847 HA PHE 765 HA PHE 765 5.808 6.116 -7.212 848 HB2 PHE 765 HB2 PHE 765 7.025 5.505 -5.342 849 HB3 PHE 765 HB3 PHE 765 5.554 4.562 -5.116 850 HD1 PHE 765 HD1 PHE 765 5.566 2.147 -6.196 851 HD2 PHE 765 HD2 PHE 765 9.094 4.421 -5.286 852 HE1 PHE 765 HE1 PHE 765 6.904 0.063 -6.182 853 HE2 PHE 765 HE2 PHE 765 10.433 2.337 -5.273 854 HZ PHE 765 HZ PHE 765 9.338 0.157 -5.718 855 H LYS 766 H LYS 766 6.219 2.897 -8.497 856 HA LYS 766 HA LYS 766 8.938 3.118 -9.286 857 HB2 LYS 766 HB2 LYS 766 6.644 1.372 -10.105 858 HB3 LYS 766 HB3 LYS 766 8.150 1.330 -11.014 859 HG2 LYS 766 HG2 LYS 766 8.699 1.279 -8.183 860 HG3 LYS 766 HG3 LYS 766 7.579 -0.013 -8.606 861 HD2 LYS 766 HD2 LYS 766 9.785 -0.911 -8.891 862 HD3 LYS 766 HD3 LYS 766 9.169 -0.594 -10.514 863 HE2 LYS 766 HE2 LYS 766 10.376 1.519 -10.609 864 HE3 LYS 766 HE3 LYS 766 10.924 1.316 -8.941 865 HZ1 LYS 766 HZ1 LYS 766 12.167 0.389 -11.233 866 HZ2 LYS 766 HZ2 LYS 766 12.588 0.024 -9.624 867 HZ3 LYS 766 HZ3 LYS 766 11.527 -0.991 -10.475 868 H GLU 767 H GLU 767 6.026 4.471 -10.542 869 HA GLU 767 HA GLU 767 6.801 4.779 -13.241 870 HB2 GLU 767 HB2 GLU 767 4.654 5.678 -11.521 871 HB3 GLU 767 HB3 GLU 767 5.212 7.006 -12.535 872 HG2 GLU 767 HG2 GLU 767 5.052 5.426 -14.512 873 HG3 GLU 767 HG3 GLU 767 4.250 4.283 -13.444 874 H1 ASP 338 H1 ASP 338 13.965 4.885 7.104 875 H2 ASP 338 H2 ASP 338 12.770 3.715 7.460 876 H3 ASP 338 H3 ASP 338 14.050 3.325 6.404 877 HA ASP 338 HA ASP 338 15.513 2.966 8.066 878 HB2 ASP 338 HB2 ASP 338 14.029 4.848 9.909 879 HB3 ASP 338 HB3 ASP 338 15.716 4.343 9.990 880 H THR 339 H THR 339 15.292 2.157 10.527 881 HA THR 339 HA THR 339 13.531 -0.044 10.491 882 HB THR 339 HB THR 339 14.554 0.994 13.097 883 HG1 THR 339 HG1 THR 339 16.634 0.202 12.477 884 HG21 THR 339 HG21 THR 339 13.497 -1.393 12.214 885 HG22 THR 339 HG22 THR 339 15.232 -1.703 12.149 886 HG23 THR 339 HG23 THR 339 14.481 -1.198 13.662 887 H GLU 340 H GLU 340 11.793 1.921 9.926 888 HA GLU 340 HA GLU 340 10.324 2.475 12.440 889 HB2 GLU 340 HB2 GLU 340 10.852 4.460 11.104 890 HB3 GLU 340 HB3 GLU 340 10.058 3.744 9.701 891 HG2 GLU 340 HG2 GLU 340 7.909 3.774 10.811 892 HG3 GLU 340 HG3 GLU 340 8.647 4.246 12.338 893 H VAL 341 H VAL 341 9.609 1.686 9.037 894 HA VAL 341 HA VAL 341 8.139 0.205 8.087 895 HB VAL 341 HB VAL 341 8.837 -1.061 10.459 896 HG11 VAL 341 HG11 VAL 341 6.601 -0.186 11.363 897 HG12 VAL 341 HG12 VAL 341 5.829 -1.263 10.200 898 HG13 VAL 341 HG13 VAL 341 6.859 -1.925 11.467 899 HG21 VAL 341 HG21 VAL 341 7.398 -2.970 9.279 900 HG22 VAL 341 HG22 VAL 341 7.348 -1.792 7.968 901 HG23 VAL 341 HG23 VAL 341 8.899 -2.383 8.565 902 H TYR 342 H TYR 342 5.753 -0.279 7.995 903 HA TYR 342 HA TYR 342 4.299 2.139 8.412 904 HB2 TYR 342 HB2 TYR 342 2.333 0.340 7.878 905 HB3 TYR 342 HB3 TYR 342 3.307 1.128 6.645 906 HD1 TYR 342 HD2 TYR 342 4.117 -1.644 9.050 907 HD2 TYR 342 HD1 TYR 342 3.712 -0.427 4.942 908 HE1 TYR 342 HE2 TYR 342 4.961 -3.854 8.306 909 HE2 TYR 342 HE1 TYR 342 4.547 -2.631 4.217 910 HH TYR 342 HH TYR 342 4.712 -5.313 6.193 911 H GLU 343 H GLU 343 4.877 2.188 10.757 912 HA GLU 343 HA GLU 343 4.206 0.750 12.870 913 HB2 GLU 343 HB2 GLU 343 2.820 3.206 13.371 914 HB3 GLU 343 HB3 GLU 343 4.412 2.712 13.936 915 HG2 GLU 343 HG2 GLU 343 4.468 4.845 12.643 916 HG3 GLU 343 HG3 GLU 343 5.457 3.586 11.916 917 H SER 344 H SER 344 1.681 2.808 11.436 918 HA SER 344 HA SER 344 -0.371 1.330 10.744 919 HB2 SER 344 HB2 SER 344 -0.206 1.004 13.739 920 HB3 SER 344 HB3 SER 344 -1.710 0.782 12.850 921 HG SER 344 HG SER 344 0.698 -0.680 12.785 922 HA PRO 345 HA PRO 345 -1.162 5.897 11.187 923 HB2 PRO 345 HB2 PRO 345 -3.086 4.870 9.092 924 HB3 PRO 345 HB3 PRO 345 -2.193 6.404 9.124 925 HG2 PRO 345 HG2 PRO 345 -1.364 4.367 7.656 926 HG3 PRO 345 HG3 PRO 345 -0.218 5.417 8.505 927 HD2 PRO 345 HD2 PRO 345 -0.957 2.599 9.096 928 HD3 PRO 345 HD3 PRO 345 0.530 3.484 9.497 929 H PTR 346 H PTR 346 -3.794 3.438 10.789 930 HA PTR 346 HA PTR 346 -4.857 3.874 13.379 931 HB2 PTR 346 HB2 PTR 346 -6.109 5.708 13.153 932 HB3 PTR 346 HB3 PTR 346 -7.077 4.870 11.946 933 HD1 PTR 346 HD1 PTR 346 -5.420 4.592 9.629 934 HD2 PTR 346 HD2 PTR 346 -5.571 7.831 12.435 935 HE1 PTR 346 HE1 PTR 346 -4.516 6.114 7.891 936 HE2 PTR 346 HE2 PTR 346 -4.670 9.362 10.716 937 H ALA 347 H ALA 347 -7.022 2.983 13.697 938 HA ALA 347 HA ALA 347 -7.866 0.906 11.764 939 HB1 ALA 347 HB1 ALA 347 -7.917 -0.776 13.422 940 HB2 ALA 347 HB2 ALA 347 -7.750 0.388 14.736 941 HB3 ALA 347 HB3 ALA 347 -6.372 0.029 13.694 942 H ASP 348 H ASP 348 -10.163 0.328 12.054 943 HA ASP 348 HA ASP 348 -11.856 1.473 13.988 944 HB2 ASP 348 HB2 ASP 348 -12.877 3.233 12.312 945 HB3 ASP 348 HB3 ASP 348 -11.485 3.660 13.304 946 HA PRO 349 HA PRO 349 -14.715 -1.093 11.782 947 HB2 PRO 349 HB2 PRO 349 -17.081 -0.239 12.805 948 HB3 PRO 349 HB3 PRO 349 -15.888 -1.125 13.777 949 HG2 PRO 349 HG2 PRO 349 -16.486 1.788 13.706 950 HG3 PRO 349 HG3 PRO 349 -16.074 0.751 15.082 951 HD2 PRO 349 HD2 PRO 349 -14.279 2.434 13.796 952 HD3 PRO 349 HD3 PRO 349 -13.815 1.016 14.761 953 H GLU 350 H GLU 350 -17.115 -0.773 10.725 954 HA GLU 350 HA GLU 350 -16.886 1.479 8.813 955 HB2 GLU 350 HB2 GLU 350 -16.802 -1.203 8.226 956 HB3 GLU 350 HB3 GLU 350 -18.513 -0.847 8.014 957 HG2 GLU 350 HG2 GLU 350 -18.052 0.866 6.397 958 HG3 GLU 350 HG3 GLU 350 -16.333 0.844 6.760 Start of MODEL 5 1 H1 GLY 661 H1 GLY 661 2.204 -13.224 -9.547 2 H2 GLY 661 H2 GLY 661 0.900 -12.153 -9.290 3 H3 GLY 661 H3 GLY 661 2.405 -11.547 -9.814 4 HA2 GLY 661 HA2 GLY 661 0.655 -11.714 -11.598 5 HA3 GLY 661 HA3 GLY 661 2.165 -12.561 -11.951 6 H HIS 662 H HIS 662 2.215 -14.832 -11.920 7 HA HIS 662 HA HIS 662 -0.253 -16.175 -12.463 8 HB2 HIS 662 HB2 HIS 662 1.339 -18.248 -12.085 9 HB3 HIS 662 HB3 HIS 662 1.566 -17.217 -13.499 10 HD1 HIS 662 HD1 HIS 662 3.766 -16.002 -13.696 11 HD2 HIS 662 HD2 HIS 662 3.184 -17.614 -9.906 12 HE1 HIS 662 HE1 HIS 662 5.898 -15.555 -12.393 13 HE2 HIS 662 HE2 HIS 662 5.539 -16.510 -10.062 14 H MET 663 H MET 663 1.604 -15.438 -9.663 15 HA MET 663 HA MET 663 -0.385 -16.771 -7.952 16 HB2 MET 663 HB2 MET 663 2.412 -17.488 -8.217 17 HB3 MET 663 HB3 MET 663 2.058 -16.984 -6.570 18 HG2 MET 663 HG2 MET 663 0.479 -18.668 -6.253 19 HG3 MET 663 HG3 MET 663 0.162 -18.832 -7.979 20 HE1 MET 663 HE1 MET 663 0.782 -21.065 -5.642 21 HE2 MET 663 HE2 MET 663 0.146 -21.350 -7.260 22 HE3 MET 663 HE3 MET 663 1.551 -22.256 -6.683 23 H GLN 664 H GLN 664 1.169 -15.972 -5.543 24 HA GLN 664 HA GLN 664 0.119 -13.347 -5.254 25 HB2 GLN 664 HB2 GLN 664 2.009 -14.980 -3.559 26 HB3 GLN 664 HB3 GLN 664 1.494 -13.353 -3.108 27 HG2 GLN 664 HG2 GLN 664 -0.157 -14.592 -2.056 28 HG3 GLN 664 HG3 GLN 664 -0.919 -14.335 -3.624 29 HE21 GLN 664 HE21 GLN 664 -1.225 -16.632 -1.696 30 HE22 GLN 664 HE22 GLN 664 -0.834 -18.016 -2.596 31 H ASP 665 H ASP 665 2.317 -13.912 -7.368 32 HA ASP 665 HA ASP 665 4.517 -12.247 -6.567 33 HB2 ASP 665 HB2 ASP 665 4.317 -12.422 -9.422 34 HB3 ASP 665 HB3 ASP 665 5.498 -13.155 -8.351 35 H LEU 666 H LEU 666 3.127 -10.513 -5.816 36 HA LEU 666 HA LEU 666 1.648 -8.878 -7.640 37 HB2 LEU 666 HB2 LEU 666 2.805 -8.117 -4.948 38 HB3 LEU 666 HB3 LEU 666 1.488 -7.310 -5.791 39 HG LEU 666 HG LEU 666 1.373 -10.217 -4.957 40 HD11 LEU 666 HD11 LEU 666 1.136 -7.806 -3.357 41 HD12 LEU 666 HD12 LEU 666 -0.367 -8.726 -3.352 42 HD13 LEU 666 HD13 LEU 666 1.135 -9.491 -2.841 43 HD21 LEU 666 HD21 LEU 666 -1.150 -9.567 -5.136 44 HD22 LEU 666 HD22 LEU 666 -0.563 -8.196 -6.076 45 HD23 LEU 666 HD23 LEU 666 -0.246 -9.841 -6.625 46 H SER 667 H SER 667 4.978 -9.189 -6.840 47 HA SER 667 HA SER 667 6.019 -6.669 -7.238 48 HB2 SER 667 HB2 SER 667 7.316 -9.137 -8.355 49 HB3 SER 667 HB3 SER 667 8.087 -7.711 -7.660 50 HG SER 667 HG SER 667 7.611 -9.863 -6.394 51 H VAL 668 H VAL 668 4.454 -8.705 -9.536 52 HA VAL 668 HA VAL 668 5.624 -7.616 -11.895 53 HB VAL 668 HB VAL 668 3.794 -8.651 -13.097 54 HG11 VAL 668 HG11 VAL 668 4.954 -10.539 -12.686 55 HG12 VAL 668 HG12 VAL 668 5.317 -10.031 -11.034 56 HG13 VAL 668 HG13 VAL 668 3.803 -10.864 -11.384 57 HG21 VAL 668 HG21 VAL 668 2.339 -9.681 -10.770 58 HG22 VAL 668 HG22 VAL 668 2.253 -7.926 -10.893 59 HG23 VAL 668 HG23 VAL 668 1.715 -8.928 -12.237 60 H HIS 669 H HIS 669 3.374 -6.357 -9.616 61 HA HIS 669 HA HIS 669 2.130 -4.518 -11.498 62 HB2 HIS 669 HB2 HIS 669 1.963 -4.478 -8.483 63 HB3 HIS 669 HB3 HIS 669 0.876 -3.697 -9.633 64 HD1 HIS 669 HD1 HIS 669 -0.151 -5.548 -11.483 65 HD2 HIS 669 HD2 HIS 669 0.967 -6.925 -7.719 66 HE1 HIS 669 HE1 HIS 669 -1.266 -7.805 -11.192 67 HE2 HIS 669 HE2 HIS 669 -0.612 -8.653 -8.889 68 H LEU 670 H LEU 670 2.816 -2.608 -12.022 69 HA LEU 670 HA LEU 670 5.285 -1.558 -11.490 70 HB2 LEU 670 HB2 LEU 670 3.750 -0.834 -13.305 71 HB3 LEU 670 HB3 LEU 670 2.769 0.007 -12.110 72 HG LEU 670 HG LEU 670 4.707 1.429 -11.522 73 HD11 LEU 670 HD11 LEU 670 6.685 1.365 -13.082 74 HD12 LEU 670 HD12 LEU 670 6.558 -0.044 -12.023 75 HD13 LEU 670 HD13 LEU 670 6.065 -0.162 -13.714 76 HD21 LEU 670 HD21 LEU 670 4.287 1.376 -14.518 77 HD22 LEU 670 HD22 LEU 670 3.098 2.015 -13.386 78 HD23 LEU 670 HD23 LEU 670 4.685 2.769 -13.515 79 H TRP 671 H TRP 671 2.353 -1.197 -9.541 80 HA TRP 671 HA TRP 671 3.562 0.858 -7.909 81 HB2 TRP 671 HB2 TRP 671 1.497 0.301 -6.408 82 HB3 TRP 671 HB3 TRP 671 1.292 1.186 -7.912 83 HD1 TRP 671 HD1 TRP 671 -0.105 0.084 -9.803 84 HE1 TRP 671 HE1 TRP 671 -1.548 -2.073 -9.955 85 HE3 TRP 671 HE3 TRP 671 1.433 -2.286 -5.540 86 HZ2 TRP 671 HZ2 TRP 671 -1.949 -4.458 -8.461 87 HZ3 TRP 671 HZ3 TRP 671 0.496 -4.501 -4.932 88 HH2 TRP 671 HH2 TRP 671 -1.191 -5.589 -6.387 89 H TYR 672 H TYR 672 4.139 -2.382 -8.093 90 HA TYR 672 HA TYR 672 4.315 -2.829 -5.218 91 HB2 TYR 672 HB2 TYR 672 3.834 -4.541 -7.222 92 HB3 TYR 672 HB3 TYR 672 5.585 -4.727 -7.110 93 HD1 TYR 672 HD2 TYR 672 2.554 -4.520 -4.922 94 HD2 TYR 672 HD1 TYR 672 6.469 -6.180 -5.498 95 HE1 TYR 672 HE2 TYR 672 2.277 -5.893 -2.870 96 HE2 TYR 672 HE1 TYR 672 6.200 -7.546 -3.465 97 HH TYR 672 HH TYR 672 4.026 -6.967 -1.140 98 H ALA 673 H ALA 673 5.914 -2.016 -4.080 99 HA ALA 673 HA ALA 673 8.518 -1.458 -5.307 100 HB1 ALA 673 HB1 ALA 673 7.194 0.101 -3.709 101 HB2 ALA 673 HB2 ALA 673 8.927 -0.079 -3.460 102 HB3 ALA 673 HB3 ALA 673 7.791 -0.959 -2.435 103 H GLY 674 H GLY 674 7.074 -4.051 -4.000 104 HA2 GLY 674 HA2 GLY 674 7.717 -5.946 -2.832 105 HA3 GLY 674 HA3 GLY 674 9.091 -5.829 -3.912 106 HA PRO 675 HA PRO 675 11.552 -5.778 -0.251 107 HB2 PRO 675 HB2 PRO 675 13.909 -4.909 -1.348 108 HB3 PRO 675 HB3 PRO 675 13.274 -6.553 -1.546 109 HG2 PRO 675 HG2 PRO 675 13.158 -4.245 -3.425 110 HG3 PRO 675 HG3 PRO 675 13.458 -5.960 -3.759 111 HD2 PRO 675 HD2 PRO 675 11.029 -4.786 -4.189 112 HD3 PRO 675 HD3 PRO 675 11.205 -6.499 -3.749 113 H MET 676 H MET 676 10.831 -2.891 -1.996 114 HA MET 676 HA MET 676 12.397 -0.997 -0.617 115 HB2 MET 676 HB2 MET 676 10.837 -0.647 -2.637 116 HB3 MET 676 HB3 MET 676 9.545 -0.491 -1.446 117 HG2 MET 676 HG2 MET 676 10.135 1.661 -1.132 118 HG3 MET 676 HG3 MET 676 11.694 1.114 -0.521 119 HE1 MET 676 HE1 MET 676 14.205 1.824 -2.552 120 HE2 MET 676 HE2 MET 676 13.448 3.347 -2.097 121 HE3 MET 676 HE3 MET 676 13.373 1.956 -1.009 122 H GLU 677 H GLU 677 12.003 0.261 1.236 123 HA GLU 677 HA GLU 677 10.274 -1.060 3.202 124 HB2 GLU 677 HB2 GLU 677 11.521 0.624 4.757 125 HB3 GLU 677 HB3 GLU 677 12.373 -0.790 4.152 126 HG2 GLU 677 HG2 GLU 677 13.554 0.463 2.535 127 HG3 GLU 677 HG3 GLU 677 12.437 1.820 2.652 128 H ARG 678 H ARG 678 8.962 0.210 4.656 129 HA ARG 678 HA ARG 678 7.156 1.923 3.408 130 HB2 ARG 678 HB2 ARG 678 6.813 0.780 5.626 131 HB3 ARG 678 HB3 ARG 678 7.873 1.991 6.352 132 HG2 ARG 678 HG2 ARG 678 6.066 3.481 4.839 133 HG3 ARG 678 HG3 ARG 678 5.073 2.224 5.562 134 HD2 ARG 678 HD2 ARG 678 5.020 3.817 7.242 135 HD3 ARG 678 HD3 ARG 678 6.413 2.875 7.748 136 HE ARG 678 HE ARG 678 6.559 5.465 6.306 137 HH11 ARG 678 HH21 ARG 678 7.935 3.033 8.362 138 HH12 ARG 678 HH22 ARG 678 9.358 3.981 8.731 139 HH21 ARG 678 HH11 ARG 678 8.360 6.677 6.799 140 HH22 ARG 678 HH12 ARG 678 9.570 6.012 7.882 141 H ALA 679 H ALA 679 9.802 2.766 5.603 142 HA ALA 679 HA ALA 679 9.656 5.543 5.443 143 HB1 ALA 679 HB1 ALA 679 11.170 3.790 6.800 144 HB2 ALA 679 HB2 ALA 679 11.614 5.491 6.629 145 HB3 ALA 679 HB3 ALA 679 12.341 4.277 5.574 146 H GLY 680 H GLY 680 11.391 3.235 3.414 147 HA2 GLY 680 HA2 GLY 680 12.658 5.141 1.724 148 HA3 GLY 680 HA3 GLY 680 12.412 3.436 1.354 149 H ALA 681 H ALA 681 9.630 3.301 1.522 150 HA ALA 681 HA ALA 681 8.788 3.976 -1.036 151 HB1 ALA 681 HB1 ALA 681 7.505 2.402 0.179 152 HB2 ALA 681 HB2 ALA 681 6.447 3.802 0.003 153 HB3 ALA 681 HB3 ALA 681 7.277 3.508 1.528 154 H GLU 682 H GLU 682 8.485 5.836 1.957 155 HA GLU 682 HA GLU 682 6.888 7.923 0.957 156 HB2 GLU 682 HB2 GLU 682 8.939 8.459 3.064 157 HB3 GLU 682 HB3 GLU 682 7.252 8.968 2.988 158 HG2 GLU 682 HG2 GLU 682 6.775 6.380 3.174 159 HG3 GLU 682 HG3 GLU 682 8.388 6.327 3.842 160 H SER 683 H SER 683 10.357 7.400 1.024 161 HA SER 683 HA SER 683 11.298 9.898 0.295 162 HB2 SER 683 HB2 SER 683 13.301 8.819 -0.368 163 HB3 SER 683 HB3 SER 683 12.627 7.805 0.907 164 HG SER 683 HG SER 683 11.840 6.398 -0.640 165 H ILE 684 H ILE 684 10.476 7.209 -1.894 166 HA ILE 684 HA ILE 684 10.818 8.756 -4.271 167 HB ILE 684 HB ILE 684 9.018 6.341 -4.077 168 HG12 ILE 684 HG12 ILE 684 11.565 5.427 -4.770 169 HG13 ILE 684 HG13 ILE 684 11.861 6.518 -3.416 170 HG21 ILE 684 HG21 ILE 684 9.368 6.161 -6.344 171 HG22 ILE 684 HG22 ILE 684 9.633 7.897 -6.191 172 HG23 ILE 684 HG23 ILE 684 11.010 6.798 -6.246 173 HD11 ILE 684 HD11 ILE 684 10.183 4.025 -3.499 174 HD12 ILE 684 HD12 ILE 684 11.410 4.499 -2.325 175 HD13 ILE 684 HD13 ILE 684 9.831 5.284 -2.316 176 H LEU 685 H LEU 685 7.960 7.685 -2.464 177 HA LEU 685 HA LEU 685 5.985 8.906 -4.013 178 HB2 LEU 685 HB2 LEU 685 6.126 8.378 -1.041 179 HB3 LEU 685 HB3 LEU 685 4.670 8.949 -1.851 180 HG LEU 685 HG LEU 685 6.172 6.410 -2.555 181 HD11 LEU 685 HD11 LEU 685 5.077 5.614 -0.741 182 HD12 LEU 685 HD12 LEU 685 4.024 7.024 -0.643 183 HD13 LEU 685 HD13 LEU 685 3.634 5.709 -1.751 184 HD21 LEU 685 HD21 LEU 685 5.104 7.159 -4.527 185 HD22 LEU 685 HD22 LEU 685 3.955 6.024 -3.824 186 HD23 LEU 685 HD23 LEU 685 3.702 7.758 -3.640 187 H ALA 686 H ALA 686 7.633 10.209 -1.121 188 HA ALA 686 HA ALA 686 6.472 12.769 -1.191 189 HB1 ALA 686 HB1 ALA 686 8.270 13.439 0.273 190 HB2 ALA 686 HB2 ALA 686 9.270 12.087 -0.261 191 HB3 ALA 686 HB3 ALA 686 7.819 11.786 0.693 192 H ASN 687 H ASN 687 9.262 11.426 -2.884 193 HA ASN 687 HA ASN 687 10.066 13.965 -4.005 194 HB2 ASN 687 HB2 ASN 687 11.587 11.966 -3.541 195 HB3 ASN 687 HB3 ASN 687 10.898 11.238 -4.989 196 HD21 ASN 687 HD21 ASN 687 10.651 13.867 -6.418 197 HD22 ASN 687 HD22 ASN 687 12.243 14.297 -6.829 198 H ARG 688 H ARG 688 8.120 11.199 -5.092 199 HA ARG 688 HA ARG 688 8.006 11.942 -7.828 200 HB2 ARG 688 HB2 ARG 688 7.175 9.776 -6.426 201 HB3 ARG 688 HB3 ARG 688 5.632 10.583 -6.687 202 HG2 ARG 688 HG2 ARG 688 5.791 9.323 -8.629 203 HG3 ARG 688 HG3 ARG 688 6.531 10.835 -9.159 204 HD2 ARG 688 HD2 ARG 688 8.765 9.882 -8.503 205 HD3 ARG 688 HD3 ARG 688 7.955 8.353 -8.186 206 HE ARG 688 HE ARG 688 7.886 7.973 -10.502 207 HH11 ARG 688 HH21 ARG 688 8.446 11.308 -9.791 208 HH12 ARG 688 HH22 ARG 688 8.623 11.769 -11.446 209 HH21 ARG 688 HH11 ARG 688 8.084 8.565 -12.655 210 HH22 ARG 688 HH12 ARG 688 8.420 10.225 -13.061 211 H SER 689 H SER 689 5.104 11.981 -5.795 212 HA SER 689 HA SER 689 4.551 14.721 -5.850 213 HB2 SER 689 HB2 SER 689 3.788 13.226 -8.317 214 HB3 SER 689 HB3 SER 689 2.694 14.463 -7.706 215 HG SER 689 HG SER 689 5.489 14.826 -8.128 216 H ASP 690 H ASP 690 2.544 15.243 -4.960 217 HA ASP 690 HA ASP 690 1.378 13.412 -3.224 218 HB2 ASP 690 HB2 ASP 690 0.534 16.069 -4.314 219 HB3 ASP 690 HB3 ASP 690 -0.577 15.143 -3.306 220 H GLY 691 H GLY 691 0.049 11.787 -3.472 221 HA2 GLY 691 HA2 GLY 691 -2.068 10.921 -4.385 222 HA3 GLY 691 HA3 GLY 691 -1.586 11.597 -5.942 223 H THR 692 H THR 692 1.236 10.833 -5.507 224 HA THR 692 HA THR 692 1.314 8.377 -6.856 225 HB THR 692 HB THR 692 3.509 9.381 -5.034 226 HG1 THR 692 HG1 THR 692 2.969 11.142 -6.231 227 HG21 THR 692 HG21 THR 692 3.669 8.053 -7.745 228 HG22 THR 692 HG22 THR 692 4.970 8.288 -6.579 229 HG23 THR 692 HG23 THR 692 3.677 7.140 -6.238 230 H PHE 693 H PHE 693 1.758 6.238 -6.172 231 HA PHE 693 HA PHE 693 1.737 5.712 -3.284 232 HB2 PHE 693 HB2 PHE 693 -0.196 4.342 -3.315 233 HB3 PHE 693 HB3 PHE 693 -0.646 5.810 -4.180 234 HD1 PHE 693 HD1 PHE 693 -0.730 5.825 -6.680 235 HD2 PHE 693 HD2 PHE 693 -0.065 2.220 -4.441 236 HE1 PHE 693 HE1 PHE 693 -1.296 4.478 -8.684 237 HE2 PHE 693 HE2 PHE 693 -0.632 0.875 -6.444 238 HZ PHE 693 HZ PHE 693 -1.245 2.001 -8.566 239 H LEU 694 H LEU 694 1.835 3.272 -2.862 240 HA LEU 694 HA LEU 694 2.835 1.502 -4.844 241 HB2 LEU 694 HB2 LEU 694 5.166 1.400 -4.302 242 HB3 LEU 694 HB3 LEU 694 4.780 3.078 -4.652 243 HG LEU 694 HG LEU 694 4.334 3.172 -2.040 244 HD11 LEU 694 HD11 LEU 694 5.484 0.561 -2.425 245 HD12 LEU 694 HD12 LEU 694 6.603 1.548 -1.492 246 HD13 LEU 694 HD13 LEU 694 4.952 1.314 -0.923 247 HD21 LEU 694 HD21 LEU 694 6.372 3.998 -3.716 248 HD22 LEU 694 HD22 LEU 694 6.193 4.457 -2.032 249 HD23 LEU 694 HD23 LEU 694 7.230 3.103 -2.472 250 H VAL 695 H VAL 695 3.929 -0.441 -3.800 251 HA VAL 695 HA VAL 695 3.051 -0.909 -1.025 252 HB VAL 695 HB VAL 695 2.483 -2.988 -3.128 253 HG11 VAL 695 HG11 VAL 695 2.468 -3.095 -0.404 254 HG12 VAL 695 HG12 VAL 695 0.810 -2.577 -0.708 255 HG13 VAL 695 HG13 VAL 695 1.408 -4.075 -1.419 256 HG21 VAL 695 HG21 VAL 695 0.138 -2.135 -3.149 257 HG22 VAL 695 HG22 VAL 695 0.659 -0.748 -2.194 258 HG23 VAL 695 HG23 VAL 695 1.271 -0.969 -3.832 259 H ARG 696 H ARG 696 4.300 -2.444 0.090 260 HA ARG 696 HA ARG 696 6.606 -3.525 -1.416 261 HB2 ARG 696 HB2 ARG 696 8.114 -2.872 0.257 262 HB3 ARG 696 HB3 ARG 696 7.082 -1.467 0.024 263 HG2 ARG 696 HG2 ARG 696 6.885 -1.552 2.301 264 HG3 ARG 696 HG3 ARG 696 5.681 -2.789 1.956 265 HD2 ARG 696 HD2 ARG 696 6.933 -4.244 3.131 266 HD3 ARG 696 HD3 ARG 696 8.137 -4.127 1.853 267 HE ARG 696 HE ARG 696 8.335 -2.028 3.851 268 HH11 ARG 696 HH21 ARG 696 9.155 -5.237 2.929 269 HH12 ARG 696 HH22 ARG 696 10.615 -5.281 3.871 270 HH21 ARG 696 HH11 ARG 696 10.293 -2.056 5.075 271 HH22 ARG 696 HH12 ARG 696 11.313 -3.475 4.983 272 H GLN 697 H GLN 697 7.727 -5.310 -0.372 273 HA GLN 697 HA GLN 697 5.917 -6.998 1.268 274 HB2 GLN 697 HB2 GLN 697 6.553 -7.527 -1.312 275 HB3 GLN 697 HB3 GLN 697 7.898 -8.328 -0.504 276 HG2 GLN 697 HG2 GLN 697 5.366 -8.885 0.839 277 HG3 GLN 697 HG3 GLN 697 5.308 -9.355 -0.856 278 HE21 GLN 697 HE21 GLN 697 5.392 -11.659 -0.324 279 HE22 GLN 697 HE22 GLN 697 6.816 -12.371 0.261 280 H ARG 698 H ARG 698 8.090 -9.072 1.333 281 HA ARG 698 HA ARG 698 9.573 -9.670 3.016 282 HB2 ARG 698 HB2 ARG 698 10.909 -8.733 1.045 283 HB3 ARG 698 HB3 ARG 698 11.107 -7.271 2.013 284 HG2 ARG 698 HG2 ARG 698 11.871 -8.930 3.893 285 HG3 ARG 698 HG3 ARG 698 12.130 -10.049 2.556 286 HD2 ARG 698 HD2 ARG 698 14.041 -9.014 1.986 287 HD3 ARG 698 HD3 ARG 698 13.229 -7.453 1.903 288 HE ARG 698 HE ARG 698 14.723 -8.520 4.169 289 HH11 ARG 698 HH21 ARG 698 12.437 -6.212 3.016 290 HH12 ARG 698 HH22 ARG 698 12.721 -5.084 4.316 291 HH21 ARG 698 HH11 ARG 698 15.063 -7.111 5.866 292 HH22 ARG 698 HH12 ARG 698 14.158 -5.607 5.933 293 H VAL 699 H VAL 699 7.791 -8.730 4.487 294 HA VAL 699 HA VAL 699 8.342 -6.274 5.865 295 HB VAL 699 HB VAL 699 6.628 -8.383 7.097 296 HG11 VAL 699 HG11 VAL 699 5.150 -6.382 7.398 297 HG12 VAL 699 HG12 VAL 699 6.741 -6.184 8.131 298 HG13 VAL 699 HG13 VAL 699 6.375 -5.401 6.592 299 HG21 VAL 699 HG21 VAL 699 4.973 -7.083 5.250 300 HG22 VAL 699 HG22 VAL 699 6.395 -7.528 4.314 301 HG23 VAL 699 HG23 VAL 699 5.487 -8.766 5.183 302 H LYS 700 H LYS 700 8.704 -6.153 8.205 303 HA LYS 700 HA LYS 700 11.030 -7.598 8.975 304 HB2 LYS 700 HB2 LYS 700 10.453 -5.257 9.685 305 HB3 LYS 700 HB3 LYS 700 9.230 -5.944 10.754 306 HG2 LYS 700 HG2 LYS 700 11.600 -7.418 11.231 307 HG3 LYS 700 HG3 LYS 700 12.086 -5.725 11.171 308 HD2 LYS 700 HD2 LYS 700 11.084 -5.268 13.146 309 HD3 LYS 700 HD3 LYS 700 9.602 -6.095 12.670 310 HE2 LYS 700 HE2 LYS 700 12.114 -7.510 13.611 311 HE3 LYS 700 HE3 LYS 700 10.727 -7.153 14.643 312 HZ1 LYS 700 HZ1 LYS 700 9.858 -9.055 13.919 313 HZ2 LYS 700 HZ2 LYS 700 9.669 -8.338 12.378 314 HZ3 LYS 700 HZ3 LYS 700 11.077 -9.263 12.725 315 H ASP 701 H ASP 701 9.837 -9.736 8.556 316 HA ASP 701 HA ASP 701 9.109 -11.741 9.411 317 HB2 ASP 701 HB2 ASP 701 9.372 -10.707 12.210 318 HB3 ASP 701 HB3 ASP 701 9.784 -12.290 11.559 319 H ALA 702 H ALA 702 7.316 -9.176 9.311 320 HA ALA 702 HA ALA 702 5.100 -10.222 10.965 321 HB1 ALA 702 HB1 ALA 702 5.761 -7.470 9.932 322 HB2 ALA 702 HB2 ALA 702 5.429 -7.979 11.588 323 HB3 ALA 702 HB3 ALA 702 4.116 -7.885 10.414 324 H ALA 703 H ALA 703 3.982 -11.629 9.738 325 HA ALA 703 HA ALA 703 3.757 -11.552 6.922 326 HB1 ALA 703 HB1 ALA 703 1.768 -13.118 7.379 327 HB2 ALA 703 HB2 ALA 703 2.183 -12.945 9.085 328 HB3 ALA 703 HB3 ALA 703 3.352 -13.637 7.959 329 H GLU 704 H GLU 704 3.286 -9.002 7.436 330 HA GLU 704 HA GLU 704 0.424 -8.664 6.768 331 HB2 GLU 704 HB2 GLU 704 1.799 -7.688 9.134 332 HB3 GLU 704 HB3 GLU 704 1.131 -6.360 8.185 333 HG2 GLU 704 HG2 GLU 704 -1.003 -7.934 8.078 334 HG3 GLU 704 HG3 GLU 704 -0.294 -8.629 9.535 335 H PHE 705 H PHE 705 0.145 -7.464 4.993 336 HA PHE 705 HA PHE 705 2.468 -6.035 3.873 337 HB2 PHE 705 HB2 PHE 705 -0.127 -6.492 2.423 338 HB3 PHE 705 HB3 PHE 705 1.500 -6.320 1.763 339 HD1 PHE 705 HD2 PHE 705 3.162 -8.164 2.038 340 HD2 PHE 705 HD1 PHE 705 -0.950 -8.615 3.179 341 HE1 PHE 705 HE2 PHE 705 3.449 -10.624 2.096 342 HE2 PHE 705 HE1 PHE 705 -0.662 -11.077 3.241 343 HZ PHE 705 HZ PHE 705 1.538 -12.080 2.699 344 H ALA 706 H ALA 706 1.786 -4.024 2.528 345 HA ALA 706 HA ALA 706 -0.460 -2.519 3.516 346 HB1 ALA 706 HB1 ALA 706 2.057 -1.125 4.176 347 HB2 ALA 706 HB2 ALA 706 1.633 -2.475 5.229 348 HB3 ALA 706 HB3 ALA 706 0.518 -1.129 5.026 349 H ILE 707 H ILE 707 -0.864 -0.676 2.361 350 HA ILE 707 HA ILE 707 0.774 -0.315 -0.065 351 HB ILE 707 HB ILE 707 -2.028 0.675 0.539 352 HG12 ILE 707 HG12 ILE 707 -1.274 -1.508 -1.401 353 HG13 ILE 707 HG13 ILE 707 -1.576 -1.877 0.296 354 HG21 ILE 707 HG21 ILE 707 -1.492 2.063 -1.185 355 HG22 ILE 707 HG22 ILE 707 -0.100 1.095 -1.664 356 HG23 ILE 707 HG23 ILE 707 -1.718 0.627 -2.181 357 HD11 ILE 707 HD11 ILE 707 -3.601 -0.139 -0.961 358 HD12 ILE 707 HD12 ILE 707 -3.514 -1.773 -1.622 359 HD13 ILE 707 HD13 ILE 707 -3.808 -1.533 0.100 360 H SER 708 H SER 708 1.767 1.586 -0.501 361 HA SER 708 HA SER 708 1.598 3.669 1.600 362 HB2 SER 708 HB2 SER 708 3.798 2.661 1.415 363 HB3 SER 708 HB3 SER 708 3.819 2.948 -0.315 364 HG SER 708 HG SER 708 3.582 4.960 1.674 365 H ILE 709 H ILE 709 0.561 5.477 1.030 366 HA ILE 709 HA ILE 709 0.601 6.268 -1.826 367 HB ILE 709 HB ILE 709 -1.751 6.852 -0.050 368 HG12 ILE 709 HG12 ILE 709 -2.628 4.736 -1.498 369 HG13 ILE 709 HG13 ILE 709 -0.952 4.247 -1.249 370 HG21 ILE 709 HG21 ILE 709 -1.010 7.429 -2.732 371 HG22 ILE 709 HG22 ILE 709 -2.310 6.240 -2.812 372 HG23 ILE 709 HG23 ILE 709 -2.555 7.756 -1.948 373 HD11 ILE 709 HD11 ILE 709 -1.552 5.087 1.252 374 HD12 ILE 709 HD12 ILE 709 -3.149 4.555 0.727 375 HD13 ILE 709 HD13 ILE 709 -1.796 3.426 0.717 376 H LYS 710 H LYS 710 1.063 8.313 -2.288 377 HA LYS 710 HA LYS 710 2.004 10.068 -0.190 378 HB2 LYS 710 HB2 LYS 710 3.120 9.935 -2.383 379 HB3 LYS 710 HB3 LYS 710 1.659 10.527 -3.164 380 HG2 LYS 710 HG2 LYS 710 3.008 12.453 -2.917 381 HG3 LYS 710 HG3 LYS 710 1.858 12.559 -1.584 382 HD2 LYS 710 HD2 LYS 710 3.606 11.384 -0.153 383 HD3 LYS 710 HD3 LYS 710 4.740 11.652 -1.474 384 HE2 LYS 710 HE2 LYS 710 3.195 13.785 0.021 385 HE3 LYS 710 HE3 LYS 710 4.929 13.475 0.148 386 HZ1 LYS 710 HZ1 LYS 710 4.568 13.744 -2.511 387 HZ2 LYS 710 HZ2 LYS 710 3.427 14.879 -1.910 388 HZ3 LYS 710 HZ3 LYS 710 5.083 14.991 -1.482 389 H TYR 711 H TYR 711 0.868 11.584 0.864 390 HA TYR 711 HA TYR 711 -1.499 12.796 -0.406 391 HB2 TYR 711 HB2 TYR 711 -1.948 10.688 1.189 392 HB3 TYR 711 HB3 TYR 711 -1.823 11.931 2.430 393 HD1 TYR 711 HD2 TYR 711 -3.019 14.294 1.284 394 HD2 TYR 711 HD1 TYR 711 -4.169 10.190 0.810 395 HE1 TYR 711 HE2 TYR 711 -5.339 15.005 0.768 396 HE2 TYR 711 HE1 TYR 711 -6.489 10.903 0.291 397 HH TYR 711 HH TYR 711 -7.780 12.734 -0.349 398 H ASN 712 H ASN 712 -1.342 14.936 -0.177 399 HA ASN 712 HA ASN 712 -0.625 16.998 0.552 400 HB2 ASN 712 HB2 ASN 712 -1.826 15.592 2.848 401 HB3 ASN 712 HB3 ASN 712 -0.807 16.964 3.277 402 HD21 ASN 712 HD21 ASN 712 -3.949 16.166 2.413 403 HD22 ASN 712 HD22 ASN 712 -4.449 17.687 1.853 404 H VAL 713 H VAL 713 1.531 16.308 -0.202 405 HA VAL 713 HA VAL 713 3.791 16.029 0.030 406 HB VAL 713 HB VAL 713 4.886 17.657 1.433 407 HG11 VAL 713 HG11 VAL 713 2.254 18.583 0.256 408 HG12 VAL 713 HG12 VAL 713 3.499 19.692 0.828 409 HG13 VAL 713 HG13 VAL 713 3.842 18.600 -0.512 410 HG21 VAL 713 HG21 VAL 713 3.387 17.129 3.459 411 HG22 VAL 713 HG22 VAL 713 3.816 18.821 3.215 412 HG23 VAL 713 HG23 VAL 713 2.220 18.240 2.743 413 H GLU 714 H GLU 714 1.942 14.349 1.855 414 HA GLU 714 HA GLU 714 4.143 13.147 3.396 415 HB2 GLU 714 HB2 GLU 714 1.597 14.202 4.371 416 HB3 GLU 714 HB3 GLU 714 1.850 12.513 4.822 417 HG2 GLU 714 HG2 GLU 714 3.914 14.692 5.200 418 HG3 GLU 714 HG3 GLU 714 2.813 14.159 6.467 419 H VAL 715 H VAL 715 3.371 10.843 4.148 420 HA VAL 715 HA VAL 715 1.913 9.584 1.890 421 HB VAL 715 HB VAL 715 4.493 8.675 3.184 422 HG11 VAL 715 HG11 VAL 715 2.694 7.241 1.201 423 HG12 VAL 715 HG12 VAL 715 4.310 6.716 1.672 424 HG13 VAL 715 HG13 VAL 715 3.010 6.738 2.861 425 HG21 VAL 715 HG21 VAL 715 5.351 8.860 0.915 426 HG22 VAL 715 HG22 VAL 715 3.758 9.276 0.306 427 HG23 VAL 715 HG23 VAL 715 4.614 10.387 1.373 428 H LYS 716 H LYS 716 0.641 7.807 2.350 429 HA LYS 716 HA LYS 716 0.209 7.303 5.244 430 HB2 LYS 716 HB2 LYS 716 -1.630 8.291 3.512 431 HB3 LYS 716 HB3 LYS 716 -1.923 6.565 3.332 432 HG2 LYS 716 HG2 LYS 716 -2.635 6.300 5.524 433 HG3 LYS 716 HG3 LYS 716 -1.630 7.622 6.117 434 HD2 LYS 716 HD2 LYS 716 -4.157 7.938 4.464 435 HD3 LYS 716 HD3 LYS 716 -4.035 8.209 6.183 436 HE2 LYS 716 HE2 LYS 716 -2.699 9.801 3.981 437 HE3 LYS 716 HE3 LYS 716 -3.902 10.365 5.137 438 HZ1 LYS 716 HZ1 LYS 716 -1.138 10.417 5.421 439 HZ2 LYS 716 HZ2 LYS 716 -2.314 10.847 6.576 440 HZ3 LYS 716 HZ3 LYS 716 -1.708 9.264 6.532 441 H HIS 717 H HIS 717 0.652 5.338 5.958 442 HA HIS 717 HA HIS 717 0.689 3.087 4.034 443 HB2 HIS 717 HB2 HIS 717 2.411 3.233 6.514 444 HB3 HIS 717 HB3 HIS 717 2.546 2.113 5.166 445 HD1 HIS 717 HD1 HIS 717 3.945 2.830 3.184 446 HD2 HIS 717 HD2 HIS 717 3.427 5.900 5.946 447 HE1 HIS 717 HE1 HIS 717 5.602 4.653 2.557 448 HE2 HIS 717 HE2 HIS 717 5.263 6.557 4.232 449 H ILE 718 H ILE 718 -1.161 1.977 4.482 450 HA ILE 718 HA ILE 718 -1.838 1.494 7.326 451 HB ILE 718 HB ILE 718 -3.476 1.829 4.856 452 HG12 ILE 718 HG12 ILE 718 -3.499 3.590 6.518 453 HG13 ILE 718 HG13 ILE 718 -5.067 2.795 6.518 454 HG21 ILE 718 HG21 ILE 718 -4.185 -0.093 7.087 455 HG22 ILE 718 HG22 ILE 718 -5.356 0.554 5.940 456 HG23 ILE 718 HG23 ILE 718 -4.036 -0.466 5.371 457 HD11 ILE 718 HD11 ILE 718 -3.178 3.065 8.675 458 HD12 ILE 718 HD12 ILE 718 -4.826 2.451 8.720 459 HD13 ILE 718 HD13 ILE 718 -3.491 1.358 8.362 460 H LYS 719 H LYS 719 -1.616 -0.540 8.095 461 HA LYS 719 HA LYS 719 -0.376 -2.536 6.457 462 HB2 LYS 719 HB2 LYS 719 -0.799 -3.935 8.640 463 HB3 LYS 719 HB3 LYS 719 0.392 -2.636 8.635 464 HG2 LYS 719 HG2 LYS 719 -0.825 -1.345 10.059 465 HG3 LYS 719 HG3 LYS 719 -2.351 -1.747 9.270 466 HD2 LYS 719 HD2 LYS 719 -1.133 -4.019 10.685 467 HD3 LYS 719 HD3 LYS 719 -1.554 -2.678 11.745 468 HE2 LYS 719 HE2 LYS 719 -3.487 -4.103 11.609 469 HE3 LYS 719 HE3 LYS 719 -3.840 -2.657 10.661 470 HZ1 LYS 719 HZ1 LYS 719 -4.392 -4.825 9.565 471 HZ2 LYS 719 HZ2 LYS 719 -3.385 -3.806 8.639 472 HZ3 LYS 719 HZ3 LYS 719 -2.714 -5.162 9.470 473 H ILE 720 H ILE 720 -1.322 -3.836 5.134 474 HA ILE 720 HA ILE 720 -4.132 -4.251 5.001 475 HB ILE 720 HB ILE 720 -1.781 -5.555 3.630 476 HG12 ILE 720 HG12 ILE 720 -3.993 -3.803 2.537 477 HG13 ILE 720 HG13 ILE 720 -2.464 -3.157 3.131 478 HG21 ILE 720 HG21 ILE 720 -3.302 -6.781 2.243 479 HG22 ILE 720 HG22 ILE 720 -3.801 -7.106 3.900 480 HG23 ILE 720 HG23 ILE 720 -4.699 -5.948 2.921 481 HD11 ILE 720 HD11 ILE 720 -2.664 -3.658 0.599 482 HD12 ILE 720 HD12 ILE 720 -1.218 -4.218 1.438 483 HD13 ILE 720 HD13 ILE 720 -2.518 -5.350 1.068 484 H MET 721 H MET 721 -5.376 -5.851 5.674 485 HA MET 721 HA MET 721 -4.166 -7.855 7.474 486 HB2 MET 721 HB2 MET 721 -6.414 -6.185 7.720 487 HB3 MET 721 HB3 MET 721 -7.063 -7.801 7.442 488 HG2 MET 721 HG2 MET 721 -5.833 -8.700 9.305 489 HG3 MET 721 HG3 MET 721 -4.901 -7.213 9.482 490 HE1 MET 721 HE1 MET 721 -6.662 -6.844 12.661 491 HE2 MET 721 HE2 MET 721 -6.812 -8.512 12.114 492 HE3 MET 721 HE3 MET 721 -5.336 -7.591 11.772 493 H THR 722 H THR 722 -5.322 -9.991 7.472 494 HA THR 722 HA THR 722 -6.610 -10.838 5.034 495 HB THR 722 HB THR 722 -4.136 -10.826 4.458 496 HG1 THR 722 HG1 THR 722 -5.633 -12.124 3.364 497 HG21 THR 722 HG21 THR 722 -3.632 -11.745 6.867 498 HG22 THR 722 HG22 THR 722 -3.963 -13.313 6.130 499 HG23 THR 722 HG23 THR 722 -2.662 -12.301 5.503 500 H ALA 723 H ALA 723 -7.193 -13.131 5.122 501 HA ALA 723 HA ALA 723 -6.915 -14.626 7.532 502 HB1 ALA 723 HB1 ALA 723 -9.509 -14.403 7.961 503 HB2 ALA 723 HB2 ALA 723 -9.291 -12.842 7.174 504 HB3 ALA 723 HB3 ALA 723 -8.397 -13.218 8.650 505 H GLU 724 H GLU 724 -9.706 -14.025 5.537 506 HA GLU 724 HA GLU 724 -10.080 -16.803 4.882 507 HB2 GLU 724 HB2 GLU 724 -11.524 -14.570 3.526 508 HB3 GLU 724 HB3 GLU 724 -12.159 -16.095 4.137 509 HG2 GLU 724 HG2 GLU 724 -12.983 -14.637 5.752 510 HG3 GLU 724 HG3 GLU 724 -11.434 -15.050 6.482 511 H GLY 725 H GLY 725 -7.570 -15.689 3.998 512 HA2 GLY 725 HA2 GLY 725 -6.198 -15.851 2.140 513 HA3 GLY 725 HA3 GLY 725 -7.556 -16.568 1.273 514 H LEU 726 H LEU 726 -8.140 -13.573 2.823 515 HA LEU 726 HA LEU 726 -8.141 -12.206 0.201 516 HB2 LEU 726 HB2 LEU 726 -9.728 -11.600 2.706 517 HB3 LEU 726 HB3 LEU 726 -9.844 -10.723 1.180 518 HG LEU 726 HG LEU 726 -10.209 -13.687 1.114 519 HD11 LEU 726 HD11 LEU 726 -12.557 -11.925 1.742 520 HD12 LEU 726 HD12 LEU 726 -12.386 -13.666 1.956 521 HD13 LEU 726 HD13 LEU 726 -11.569 -12.558 3.059 522 HD21 LEU 726 HD21 LEU 726 -10.236 -12.039 -0.873 523 HD22 LEU 726 HD22 LEU 726 -11.564 -13.193 -0.762 524 HD23 LEU 726 HD23 LEU 726 -11.803 -11.521 -0.254 525 H TYR 727 H TYR 727 -8.031 -9.768 0.472 526 HA TYR 727 HA TYR 727 -5.911 -8.995 2.402 527 HB2 TYR 727 HB2 TYR 727 -6.159 -8.149 -0.505 528 HB3 TYR 727 HB3 TYR 727 -4.961 -7.545 0.636 529 HD1 TYR 727 HD2 TYR 727 -6.144 -10.565 -1.172 530 HD2 TYR 727 HD1 TYR 727 -3.022 -8.837 1.218 531 HE1 TYR 727 HE2 TYR 727 -4.675 -12.493 -1.695 532 HE2 TYR 727 HE1 TYR 727 -1.555 -10.765 0.692 533 HH TYR 727 HH TYR 727 -2.750 -13.613 -0.835 534 H ARG 728 H ARG 728 -6.224 -7.068 3.419 535 HA ARG 728 HA ARG 728 -8.110 -5.128 2.369 536 HB2 ARG 728 HB2 ARG 728 -9.227 -5.208 4.782 537 HB3 ARG 728 HB3 ARG 728 -9.826 -6.164 3.431 538 HG2 ARG 728 HG2 ARG 728 -9.038 -8.149 4.295 539 HG3 ARG 728 HG3 ARG 728 -7.643 -7.382 5.045 540 HD2 ARG 728 HD2 ARG 728 -8.850 -6.718 6.934 541 HD3 ARG 728 HD3 ARG 728 -10.399 -6.825 6.111 542 HE ARG 728 HE ARG 728 -8.910 -9.032 7.310 543 HH11 ARG 728 HH21 ARG 728 -11.503 -8.014 5.236 544 HH12 ARG 728 HH22 ARG 728 -12.316 -9.549 5.328 545 HH21 ARG 728 HH11 ARG 728 -9.992 -10.991 7.401 546 HH22 ARG 728 HH12 ARG 728 -11.469 -11.238 6.508 547 H ILE 729 H ILE 729 -7.520 -3.160 2.877 548 HA ILE 729 HA ILE 729 -5.206 -2.698 4.493 549 HB ILE 729 HB ILE 729 -6.219 -0.209 4.101 550 HG12 ILE 729 HG12 ILE 729 -8.212 -1.440 2.975 551 HG13 ILE 729 HG13 ILE 729 -7.513 -0.050 2.150 552 HG21 ILE 729 HG21 ILE 729 -4.666 -1.969 2.189 553 HG22 ILE 729 HG22 ILE 729 -4.871 -0.237 1.956 554 HG23 ILE 729 HG23 ILE 729 -4.019 -0.839 3.374 555 HD11 ILE 729 HD11 ILE 729 -7.923 -2.533 1.034 556 HD12 ILE 729 HD12 ILE 729 -6.819 -1.309 0.410 557 HD13 ILE 729 HD13 ILE 729 -6.213 -2.591 1.458 558 H THR 730 H THR 730 -8.652 -2.502 4.936 559 HA THR 730 HA THR 730 -8.202 -1.725 7.755 560 HB THR 730 HB THR 730 -9.321 0.056 6.338 561 HG1 THR 730 HG1 THR 730 -10.191 -1.036 8.728 562 HG21 THR 730 HG21 THR 730 -11.545 -1.999 6.287 563 HG22 THR 730 HG22 THR 730 -11.690 -0.324 5.758 564 HG23 THR 730 HG23 THR 730 -10.621 -1.430 4.896 565 H GLU 731 H GLU 731 -9.294 -2.885 9.262 566 HA GLU 731 HA GLU 731 -9.852 -5.565 8.855 567 HB2 GLU 731 HB2 GLU 731 -10.923 -5.435 11.089 568 HB3 GLU 731 HB3 GLU 731 -9.387 -4.562 11.041 569 HG2 GLU 731 HG2 GLU 731 -11.919 -3.086 10.395 570 HG3 GLU 731 HG3 GLU 731 -11.523 -3.403 12.074 571 H LYS 732 H LYS 732 -11.707 -2.983 7.798 572 HA LYS 732 HA LYS 732 -14.253 -4.362 8.100 573 HB2 LYS 732 HB2 LYS 732 -13.803 -1.653 6.892 574 HB3 LYS 732 HB3 LYS 732 -15.283 -2.307 7.607 575 HG2 LYS 732 HG2 LYS 732 -14.069 -2.518 9.790 576 HG3 LYS 732 HG3 LYS 732 -12.693 -1.706 9.053 577 HD2 LYS 732 HD2 LYS 732 -14.941 -0.106 8.452 578 HD3 LYS 732 HD3 LYS 732 -15.088 -0.547 10.155 579 HE2 LYS 732 HE2 LYS 732 -12.352 0.034 9.675 580 HE3 LYS 732 HE3 LYS 732 -13.297 1.343 8.959 581 HZ1 LYS 732 HZ1 LYS 732 -14.620 1.089 11.224 582 HZ2 LYS 732 HZ2 LYS 732 -13.087 0.494 11.754 583 HZ3 LYS 732 HZ3 LYS 732 -13.206 2.081 11.103 584 H LYS 733 H LYS 733 -11.840 -4.385 5.775 585 HA LYS 733 HA LYS 733 -13.829 -4.927 3.629 586 HB2 LYS 733 HB2 LYS 733 -12.006 -2.886 3.605 587 HB3 LYS 733 HB3 LYS 733 -11.146 -4.152 2.735 588 HG2 LYS 733 HG2 LYS 733 -12.412 -2.921 1.099 589 HG3 LYS 733 HG3 LYS 733 -13.235 -4.462 1.318 590 HD2 LYS 733 HD2 LYS 733 -14.849 -2.600 1.286 591 HD3 LYS 733 HD3 LYS 733 -14.836 -3.381 2.868 592 HE2 LYS 733 HE2 LYS 733 -14.220 -1.458 3.860 593 HE3 LYS 733 HE3 LYS 733 -12.831 -1.319 2.782 594 HZ1 LYS 733 HZ1 LYS 733 -15.593 -0.492 2.088 595 HZ2 LYS 733 HZ2 LYS 733 -14.347 0.569 2.583 596 HZ3 LYS 733 HZ3 LYS 733 -14.198 -0.290 1.107 597 H ALA 734 H ALA 734 -12.328 -5.956 1.710 598 HA ALA 734 HA ALA 734 -10.393 -7.859 2.397 599 HB1 ALA 734 HB1 ALA 734 -11.522 -9.585 3.264 600 HB2 ALA 734 HB2 ALA 734 -12.577 -9.631 1.852 601 HB3 ALA 734 HB3 ALA 734 -12.997 -8.619 3.233 602 H PHE 735 H PHE 735 -9.370 -8.213 0.545 603 HA PHE 735 HA PHE 735 -10.951 -8.429 -1.957 604 HB2 PHE 735 HB2 PHE 735 -8.351 -6.996 -1.421 605 HB3 PHE 735 HB3 PHE 735 -8.774 -7.537 -3.050 606 HD1 PHE 735 HD2 PHE 735 -10.160 -5.599 -0.144 607 HD2 PHE 735 HD1 PHE 735 -10.140 -6.193 -4.399 608 HE1 PHE 735 HE2 PHE 735 -11.608 -3.599 -0.427 609 HE2 PHE 735 HE1 PHE 735 -11.576 -4.196 -4.690 610 HZ PHE 735 HZ PHE 735 -12.320 -2.905 -2.701 611 H ARG 736 H ARG 736 -10.020 -9.848 -3.577 612 HA ARG 736 HA ARG 736 -8.974 -12.263 -2.446 613 HB2 ARG 736 HB2 ARG 736 -9.516 -11.350 -5.258 614 HB3 ARG 736 HB3 ARG 736 -8.850 -12.944 -4.889 615 HG2 ARG 736 HG2 ARG 736 -10.787 -13.415 -3.426 616 HG3 ARG 736 HG3 ARG 736 -11.458 -11.828 -3.810 617 HD2 ARG 736 HD2 ARG 736 -10.796 -13.871 -5.936 618 HD3 ARG 736 HD3 ARG 736 -12.376 -13.787 -5.162 619 HE ARG 736 HE ARG 736 -12.797 -11.779 -6.299 620 HH11 ARG 736 HH21 ARG 736 -9.563 -12.868 -6.789 621 HH12 ARG 736 HH22 ARG 736 -9.164 -11.624 -7.943 622 HH21 ARG 736 HH11 ARG 736 -12.303 -10.195 -7.807 623 HH22 ARG 736 HH12 ARG 736 -10.700 -10.091 -8.483 624 H GLY 737 H GLY 737 -7.547 -9.477 -3.932 625 HA2 GLY 737 HA2 GLY 737 -4.895 -10.321 -3.255 626 HA3 GLY 737 HA3 GLY 737 -5.179 -10.403 -4.990 627 H LEU 738 H LEU 738 -3.477 -8.623 -3.253 628 HA LEU 738 HA LEU 738 -4.168 -6.054 -2.886 629 HB2 LEU 738 HB2 LEU 738 -1.740 -7.399 -3.872 630 HB3 LEU 738 HB3 LEU 738 -1.850 -5.704 -4.329 631 HG LEU 738 HG LEU 738 -0.687 -6.008 -2.168 632 HD11 LEU 738 HD11 LEU 738 -2.510 -4.123 -2.814 633 HD12 LEU 738 HD12 LEU 738 -3.231 -4.749 -1.333 634 HD13 LEU 738 HD13 LEU 738 -1.590 -4.104 -1.314 635 HD21 LEU 738 HD21 LEU 738 -2.396 -8.017 -1.666 636 HD22 LEU 738 HD22 LEU 738 -1.589 -7.129 -0.375 637 HD23 LEU 738 HD23 LEU 738 -3.245 -6.724 -0.820 638 H THR 739 H THR 739 -3.283 -7.421 -6.012 639 HA THR 739 HA THR 739 -3.609 -5.232 -7.654 640 HB THR 739 HB THR 739 -4.439 -8.028 -8.418 641 HG1 THR 739 HG1 THR 739 -1.839 -6.939 -8.498 642 HG21 THR 739 HG21 THR 739 -4.823 -6.328 -10.127 643 HG22 THR 739 HG22 THR 739 -3.179 -5.720 -9.923 644 HG23 THR 739 HG23 THR 739 -3.448 -7.329 -10.591 645 H GLU 740 H GLU 740 -6.166 -7.404 -6.457 646 HA GLU 740 HA GLU 740 -8.177 -6.104 -8.079 647 HB2 GLU 740 HB2 GLU 740 -8.922 -7.699 -5.661 648 HB3 GLU 740 HB3 GLU 740 -9.679 -7.659 -7.248 649 HG2 GLU 740 HG2 GLU 740 -6.976 -8.659 -7.463 650 HG3 GLU 740 HG3 GLU 740 -7.847 -9.572 -6.254 651 H LEU 741 H LEU 741 -6.678 -5.597 -5.056 652 HA LEU 741 HA LEU 741 -8.810 -3.947 -3.954 653 HB2 LEU 741 HB2 LEU 741 -7.558 -5.346 -2.428 654 HB3 LEU 741 HB3 LEU 741 -6.029 -4.709 -3.015 655 HG LEU 741 HG LEU 741 -6.997 -3.816 -0.768 656 HD11 LEU 741 HD11 LEU 741 -6.383 -1.483 -2.471 657 HD12 LEU 741 HD12 LEU 741 -5.528 -2.110 -1.063 658 HD13 LEU 741 HD13 LEU 741 -5.251 -2.824 -2.651 659 HD21 LEU 741 HD21 LEU 741 -8.389 -1.797 -2.492 660 HD22 LEU 741 HD22 LEU 741 -9.228 -3.308 -2.154 661 HD23 LEU 741 HD23 LEU 741 -8.721 -2.268 -0.830 662 H VAL 742 H VAL 742 -5.504 -3.625 -5.063 663 HA VAL 742 HA VAL 742 -5.263 -0.808 -4.859 664 HB VAL 742 HB VAL 742 -3.834 -2.882 -6.527 665 HG11 VAL 742 HG11 VAL 742 -3.593 0.042 -6.415 666 HG12 VAL 742 HG12 VAL 742 -2.075 -0.810 -6.132 667 HG13 VAL 742 HG13 VAL 742 -2.986 -1.100 -7.616 668 HG21 VAL 742 HG21 VAL 742 -3.210 -1.561 -3.873 669 HG22 VAL 742 HG22 VAL 742 -3.672 -3.246 -4.130 670 HG23 VAL 742 HG23 VAL 742 -2.125 -2.652 -4.737 671 H GLU 743 H GLU 743 -5.645 -2.870 -7.704 672 HA GLU 743 HA GLU 743 -5.918 -0.762 -9.549 673 HB2 GLU 743 HB2 GLU 743 -6.918 -3.593 -9.832 674 HB3 GLU 743 HB3 GLU 743 -6.488 -2.480 -11.135 675 HG2 GLU 743 HG2 GLU 743 -4.454 -3.152 -9.016 676 HG3 GLU 743 HG3 GLU 743 -4.740 -4.280 -10.324 677 H PHE 744 H PHE 744 -8.206 -2.307 -7.454 678 HA PHE 744 HA PHE 744 -10.554 -1.463 -8.919 679 HB2 PHE 744 HB2 PHE 744 -10.755 -3.419 -7.569 680 HB3 PHE 744 HB3 PHE 744 -10.083 -2.602 -6.164 681 HD1 PHE 744 HD1 PHE 744 -12.893 -2.099 -8.614 682 HD2 PHE 744 HD2 PHE 744 -11.573 -1.918 -4.534 683 HE1 PHE 744 HE1 PHE 744 -15.166 -1.402 -7.909 684 HE2 PHE 744 HE2 PHE 744 -13.844 -1.220 -3.825 685 HZ PHE 744 HZ PHE 744 -15.642 -0.960 -5.515 686 H TYR 745 H TYR 745 -8.645 -0.306 -6.195 687 HA TYR 745 HA TYR 745 -10.473 1.762 -5.458 688 HB2 TYR 745 HB2 TYR 745 -7.679 1.018 -4.740 689 HB3 TYR 745 HB3 TYR 745 -8.226 2.657 -4.380 690 HD1 TYR 745 HD2 TYR 745 -10.767 0.047 -4.498 691 HD2 TYR 745 HD1 TYR 745 -7.985 2.099 -1.954 692 HE1 TYR 745 HE2 TYR 745 -11.997 -0.759 -2.505 693 HE2 TYR 745 HE1 TYR 745 -9.217 1.292 0.033 694 HH TYR 745 HH TYR 745 -12.317 0.008 -0.104 695 H GLN 746 H GLN 746 -8.177 1.447 -7.983 696 HA GLN 746 HA GLN 746 -7.298 4.026 -8.443 697 HB2 GLN 746 HB2 GLN 746 -8.231 1.892 -10.366 698 HB3 GLN 746 HB3 GLN 746 -7.552 3.427 -10.918 699 HG2 GLN 746 HG2 GLN 746 -5.471 2.998 -9.767 700 HG3 GLN 746 HG3 GLN 746 -6.141 1.571 -8.977 701 HE21 GLN 746 HE21 GLN 746 -7.272 0.083 -10.934 702 HE22 GLN 746 HE22 GLN 746 -6.150 -0.268 -12.165 703 H GLN 747 H GLN 747 -10.462 2.619 -9.015 704 HA GLN 747 HA GLN 747 -11.524 5.223 -9.919 705 HB2 GLN 747 HB2 GLN 747 -12.714 2.442 -10.053 706 HB3 GLN 747 HB3 GLN 747 -13.488 3.912 -10.650 707 HG2 GLN 747 HG2 GLN 747 -11.449 4.285 -12.101 708 HG3 GLN 747 HG3 GLN 747 -10.903 2.676 -11.634 709 HE21 GLN 747 HE21 GLN 747 -11.155 1.776 -13.771 710 HE22 GLN 747 HE22 GLN 747 -12.684 1.544 -14.469 711 H ASN 748 H ASN 748 -11.282 3.266 -7.192 712 HA ASN 748 HA ASN 748 -13.619 4.595 -5.946 713 HB2 ASN 748 HB2 ASN 748 -13.904 2.130 -6.128 714 HB3 ASN 748 HB3 ASN 748 -12.431 1.916 -5.181 715 HD21 ASN 748 HD21 ASN 748 -13.784 0.871 -3.483 716 HD22 ASN 748 HD22 ASN 748 -14.716 1.831 -2.435 717 H SER 749 H SER 749 -12.943 6.161 -4.648 718 HA SER 749 HA SER 749 -10.451 6.779 -3.808 719 HB2 SER 749 HB2 SER 749 -12.842 7.862 -3.399 720 HB3 SER 749 HB3 SER 749 -12.614 7.134 -1.817 721 HG SER 749 HG SER 749 -10.314 8.269 -2.506 722 H LEU 750 H LEU 750 -9.061 6.258 -2.182 723 HA LEU 750 HA LEU 750 -9.125 3.635 -1.148 724 HB2 LEU 750 HB2 LEU 750 -7.499 6.046 -0.383 725 HB3 LEU 750 HB3 LEU 750 -7.260 4.463 0.349 726 HG LEU 750 HG LEU 750 -7.413 4.175 -2.513 727 HD11 LEU 750 HD11 LEU 750 -5.556 5.520 -3.204 728 HD12 LEU 750 HD12 LEU 750 -6.680 6.584 -2.358 729 HD13 LEU 750 HD13 LEU 750 -5.225 6.015 -1.543 730 HD21 LEU 750 HD21 LEU 750 -4.946 3.911 -0.790 731 HD22 LEU 750 HD22 LEU 750 -6.277 2.762 -0.653 732 HD23 LEU 750 HD23 LEU 750 -5.422 2.940 -2.185 733 H LYS 751 H LYS 751 -10.290 6.666 0.152 734 HA LYS 751 HA LYS 751 -10.497 6.075 2.835 735 HB2 LYS 751 HB2 LYS 751 -12.439 7.568 2.908 736 HB3 LYS 751 HB3 LYS 751 -11.124 8.241 1.963 737 HG2 LYS 751 HG2 LYS 751 -12.463 7.022 -0.015 738 HG3 LYS 751 HG3 LYS 751 -13.815 7.338 1.081 739 HD2 LYS 751 HD2 LYS 751 -13.190 9.691 1.237 740 HD3 LYS 751 HD3 LYS 751 -11.766 9.397 0.253 741 HE2 LYS 751 HE2 LYS 751 -13.905 8.457 -1.288 742 HE3 LYS 751 HE3 LYS 751 -14.460 9.983 -0.589 743 HZ1 LYS 751 HZ1 LYS 751 -13.268 10.561 -2.527 744 HZ2 LYS 751 HZ2 LYS 751 -12.214 10.917 -1.210 745 HZ3 LYS 751 HZ3 LYS 751 -11.976 9.490 -2.154 746 H ASP 752 H ASP 752 -11.988 4.562 0.176 747 HA ASP 752 HA ASP 752 -14.346 3.481 1.217 748 HB2 ASP 752 HB2 ASP 752 -13.634 3.165 -1.116 749 HB3 ASP 752 HB3 ASP 752 -12.261 2.202 -0.588 750 H CYS 753 H CYS 753 -10.980 2.597 1.631 751 HA CYS 753 HA CYS 753 -11.684 0.680 3.790 752 HB2 CYS 753 HB2 CYS 753 -9.526 0.692 1.735 753 HB3 CYS 753 HB3 CYS 753 -9.158 0.063 3.329 754 HG CYS 753 HG CYS 753 -11.053 -1.245 1.289 755 H PHE 754 H PHE 754 -9.215 2.979 2.647 756 HA PHE 754 HA PHE 754 -7.816 3.228 5.050 757 HB2 PHE 754 HB2 PHE 754 -8.179 4.957 2.647 758 HB3 PHE 754 HB3 PHE 754 -7.410 5.642 4.077 759 HD1 PHE 754 HD2 PHE 754 -7.248 2.747 1.724 760 HD2 PHE 754 HD1 PHE 754 -5.142 5.175 4.572 761 HE1 PHE 754 HE2 PHE 754 -5.128 1.620 1.120 762 HE2 PHE 754 HE1 PHE 754 -3.020 4.048 3.965 763 HZ PHE 754 HZ PHE 754 -3.013 2.269 2.237 764 H LYS 755 H LYS 755 -7.844 4.925 6.623 765 HA LYS 755 HA LYS 755 -10.555 5.591 7.404 766 HB2 LYS 755 HB2 LYS 755 -8.283 6.633 8.992 767 HB3 LYS 755 HB3 LYS 755 -9.742 5.794 9.515 768 HG2 LYS 755 HG2 LYS 755 -7.289 4.531 8.246 769 HG3 LYS 755 HG3 LYS 755 -7.816 4.358 9.912 770 HD2 LYS 755 HD2 LYS 755 -10.019 3.409 8.891 771 HD3 LYS 755 HD3 LYS 755 -9.062 3.199 7.426 772 HE2 LYS 755 HE2 LYS 755 -7.875 1.460 8.293 773 HE3 LYS 755 HE3 LYS 755 -7.731 2.227 9.875 774 HZ1 LYS 755 HZ1 LYS 755 -9.100 0.314 10.142 775 HZ2 LYS 755 HZ2 LYS 755 -10.139 1.679 10.237 776 HZ3 LYS 755 HZ3 LYS 755 -10.080 0.715 8.797 777 H SER 756 H SER 756 -7.577 7.579 7.181 778 HA SER 756 HA SER 756 -9.242 9.943 6.731 779 HB2 SER 756 HB2 SER 756 -7.536 11.123 7.612 780 HB3 SER 756 HB3 SER 756 -6.871 9.564 8.091 781 HG SER 756 HG SER 756 -5.382 10.815 6.863 782 H LEU 757 H LEU 757 -6.822 7.997 5.088 783 HA LEU 757 HA LEU 757 -6.128 9.347 2.858 784 HB2 LEU 757 HB2 LEU 757 -5.906 6.798 3.584 785 HB3 LEU 757 HB3 LEU 757 -7.202 6.612 2.411 786 HG LEU 757 HG LEU 757 -5.157 6.289 1.232 787 HD11 LEU 757 HD11 LEU 757 -6.913 7.771 0.187 788 HD12 LEU 757 HD12 LEU 757 -5.928 9.141 0.687 789 HD13 LEU 757 HD13 LEU 757 -5.278 7.962 -0.444 790 HD21 LEU 757 HD21 LEU 757 -3.402 8.073 1.239 791 HD22 LEU 757 HD22 LEU 757 -4.286 8.865 2.539 792 HD23 LEU 757 HD23 LEU 757 -3.603 7.259 2.792 793 H ASP 758 H ASP 758 -7.457 10.765 1.833 794 HA ASP 758 HA ASP 758 -10.000 9.666 0.809 795 HB2 ASP 758 HB2 ASP 758 -10.069 11.627 2.487 796 HB3 ASP 758 HB3 ASP 758 -9.480 12.615 1.152 797 H THR 759 H THR 759 -8.552 8.841 -0.912 798 HA THR 759 HA THR 759 -8.802 10.522 -3.217 799 HB THR 759 HB THR 759 -6.660 11.417 -2.288 800 HG1 THR 759 HG1 THR 759 -5.913 11.556 -4.280 801 HG21 THR 759 HG21 THR 759 -6.071 8.558 -2.174 802 HG22 THR 759 HG22 THR 759 -4.828 9.463 -3.034 803 HG23 THR 759 HG23 THR 759 -5.253 9.904 -1.381 804 H THR 760 H THR 760 -7.011 9.233 -4.921 805 HA THR 760 HA THR 760 -7.833 6.383 -4.739 806 HB THR 760 HB THR 760 -8.134 6.447 -7.238 807 HG1 THR 760 HG1 THR 760 -8.647 8.797 -7.816 808 HG21 THR 760 HG21 THR 760 -9.881 8.118 -5.428 809 HG22 THR 760 HG22 THR 760 -10.323 7.757 -7.098 810 HG23 THR 760 HG23 THR 760 -10.120 6.445 -5.938 811 H LEU 761 H LEU 761 -6.627 5.076 -6.474 812 HA LEU 761 HA LEU 761 -3.812 5.362 -6.014 813 HB2 LEU 761 HB2 LEU 761 -5.442 3.525 -7.789 814 HB3 LEU 761 HB3 LEU 761 -3.688 3.433 -7.673 815 HG LEU 761 HG LEU 761 -4.733 1.808 -6.152 816 HD11 LEU 761 HD11 LEU 761 -2.629 3.078 -5.512 817 HD12 LEU 761 HD12 LEU 761 -3.647 4.101 -4.503 818 HD13 LEU 761 HD13 LEU 761 -3.522 2.373 -4.168 819 HD21 LEU 761 HD21 LEU 761 -6.835 3.202 -5.852 820 HD22 LEU 761 HD22 LEU 761 -6.201 2.459 -4.384 821 HD23 LEU 761 HD23 LEU 761 -5.928 4.170 -4.694 822 H GLN 762 H GLN 762 -3.389 7.451 -6.831 823 HA GLN 762 HA GLN 762 -4.024 8.317 -9.434 824 HB2 GLN 762 HB2 GLN 762 -1.837 9.185 -7.542 825 HB3 GLN 762 HB3 GLN 762 -2.312 10.060 -8.996 826 HG2 GLN 762 HG2 GLN 762 -4.609 9.358 -7.323 827 HG3 GLN 762 HG3 GLN 762 -3.447 10.372 -6.475 828 HE21 GLN 762 HE21 GLN 762 -5.769 10.287 -9.094 829 HE22 GLN 762 HE22 GLN 762 -5.661 11.933 -9.487 830 H PHE 763 H PHE 763 -0.760 7.438 -8.240 831 HA PHE 763 HA PHE 763 -0.248 5.981 -10.696 832 HB2 PHE 763 HB2 PHE 763 1.985 7.695 -10.571 833 HB3 PHE 763 HB3 PHE 763 0.749 7.633 -11.824 834 HD1 PHE 763 HD2 PHE 763 1.726 9.260 -8.631 835 HD2 PHE 763 HD1 PHE 763 -0.957 9.313 -11.984 836 HE1 PHE 763 HE2 PHE 763 0.922 11.505 -7.952 837 HE2 PHE 763 HE1 PHE 763 -1.758 11.561 -11.307 838 HZ PHE 763 HZ PHE 763 -0.819 12.657 -9.291 839 HA PRO 764 HA PRO 764 2.323 3.668 -7.987 840 HB2 PRO 764 HB2 PRO 764 3.927 2.456 -9.865 841 HB3 PRO 764 HB3 PRO 764 2.261 1.956 -9.515 842 HG2 PRO 764 HG2 PRO 764 3.324 3.565 -11.766 843 HG3 PRO 764 HG3 PRO 764 1.990 2.401 -11.735 844 HD2 PRO 764 HD2 PRO 764 1.639 5.133 -11.740 845 HD3 PRO 764 HD3 PRO 764 0.457 3.982 -11.089 846 H PHE 765 H PHE 765 4.169 4.040 -6.859 847 HA PHE 765 HA PHE 765 5.761 6.290 -7.300 848 HB2 PHE 765 HB2 PHE 765 7.001 5.596 -5.473 849 HB3 PHE 765 HB3 PHE 765 5.504 4.695 -5.231 850 HD1 PHE 765 HD1 PHE 765 5.424 2.354 -6.550 851 HD2 PHE 765 HD2 PHE 765 9.003 4.405 -5.362 852 HE1 PHE 765 HE1 PHE 765 6.678 0.240 -6.690 853 HE2 PHE 765 HE2 PHE 765 10.266 2.277 -5.498 854 HZ PHE 765 HZ PHE 765 9.105 0.192 -6.161 855 H LYS 766 H LYS 766 6.028 3.075 -8.620 856 HA LYS 766 HA LYS 766 8.714 3.140 -9.430 857 HB2 LYS 766 HB2 LYS 766 6.292 1.585 -10.058 858 HB3 LYS 766 HB3 LYS 766 7.590 1.525 -11.240 859 HG2 LYS 766 HG2 LYS 766 8.554 1.319 -8.493 860 HG3 LYS 766 HG3 LYS 766 7.460 0.017 -8.938 861 HD2 LYS 766 HD2 LYS 766 9.762 -0.603 -9.515 862 HD3 LYS 766 HD3 LYS 766 8.821 -0.383 -10.990 863 HE2 LYS 766 HE2 LYS 766 10.320 1.957 -9.840 864 HE3 LYS 766 HE3 LYS 766 11.194 0.743 -10.769 865 HZ1 LYS 766 HZ1 LYS 766 9.357 2.781 -11.689 866 HZ2 LYS 766 HZ2 LYS 766 10.529 1.890 -12.549 867 HZ3 LYS 766 HZ3 LYS 766 8.996 1.225 -12.287 868 H GLU 767 H GLU 767 5.866 4.636 -10.725 869 HA GLU 767 HA GLU 767 6.791 4.932 -13.388 870 HB2 GLU 767 HB2 GLU 767 4.479 5.644 -11.876 871 HB3 GLU 767 HB3 GLU 767 5.079 7.106 -12.654 872 HG2 GLU 767 HG2 GLU 767 5.268 5.642 -14.782 873 HG3 GLU 767 HG3 GLU 767 4.209 4.523 -13.936 874 H1 ASP 338 H1 ASP 338 15.506 -4.289 8.942 875 H2 ASP 338 H2 ASP 338 17.165 -4.060 9.236 876 H3 ASP 338 H3 ASP 338 16.575 -5.611 8.830 877 HA ASP 338 HA ASP 338 17.410 -3.493 7.123 878 HB2 ASP 338 HB2 ASP 338 16.937 -5.533 5.481 879 HB3 ASP 338 HB3 ASP 338 18.296 -5.571 6.601 880 H THR 339 H THR 339 16.231 -2.166 5.903 881 HA THR 339 HA THR 339 14.475 -1.194 4.795 882 HB THR 339 HB THR 339 13.099 -2.506 3.482 883 HG1 THR 339 HG1 THR 339 12.824 -3.891 5.834 884 HG21 THR 339 HG21 THR 339 14.376 -4.358 2.691 885 HG22 THR 339 HG22 THR 339 15.545 -3.183 3.292 886 HG23 THR 339 HG23 THR 339 15.137 -4.598 4.262 887 H GLU 340 H GLU 340 13.420 0.172 6.083 888 HA GLU 340 HA GLU 340 12.072 -0.543 8.480 889 HB2 GLU 340 HB2 GLU 340 12.898 1.747 7.902 890 HB3 GLU 340 HB3 GLU 340 11.586 1.880 6.732 891 HG2 GLU 340 HG2 GLU 340 9.929 1.906 8.398 892 HG3 GLU 340 HG3 GLU 340 10.983 1.153 9.591 893 H VAL 341 H VAL 341 9.663 -0.099 8.817 894 HA VAL 341 HA VAL 341 8.095 -0.912 6.471 895 HB VAL 341 HB VAL 341 6.828 -2.548 7.826 896 HG11 VAL 341 HG11 VAL 341 9.806 -2.855 7.513 897 HG12 VAL 341 HG12 VAL 341 8.844 -4.149 8.219 898 HG13 VAL 341 HG13 VAL 341 8.509 -3.599 6.578 899 HG21 VAL 341 HG21 VAL 341 7.888 -1.206 9.991 900 HG22 VAL 341 HG22 VAL 341 7.101 -2.781 10.068 901 HG23 VAL 341 HG23 VAL 341 8.857 -2.679 9.957 902 H TYR 342 H TYR 342 5.674 -1.123 7.362 903 HA TYR 342 HA TYR 342 4.930 1.589 8.101 904 HB2 TYR 342 HB2 TYR 342 2.576 0.313 7.761 905 HB3 TYR 342 HB3 TYR 342 3.518 0.959 6.420 906 HD1 TYR 342 HD2 TYR 342 3.170 -2.138 8.511 907 HD2 TYR 342 HD1 TYR 342 4.188 -0.485 4.672 908 HE1 TYR 342 HE2 TYR 342 3.417 -4.426 7.583 909 HE2 TYR 342 HE1 TYR 342 4.441 -2.769 3.762 910 HH TYR 342 HH TYR 342 3.548 -5.630 5.625 911 H GLU 343 H GLU 343 3.600 2.139 9.837 912 HA GLU 343 HA GLU 343 3.697 0.221 12.077 913 HB2 GLU 343 HB2 GLU 343 2.817 2.617 13.146 914 HB3 GLU 343 HB3 GLU 343 4.478 2.033 13.162 915 HG2 GLU 343 HG2 GLU 343 4.247 4.364 12.260 916 HG3 GLU 343 HG3 GLU 343 4.987 3.243 11.121 917 H SER 344 H SER 344 1.378 2.909 11.648 918 HA SER 344 HA SER 344 -0.818 1.458 10.766 919 HB2 SER 344 HB2 SER 344 -1.130 -0.032 12.433 920 HB3 SER 344 HB3 SER 344 -0.122 0.871 13.558 921 HG SER 344 HG SER 344 -1.993 2.410 13.577 922 HA PRO 345 HA PRO 345 -1.425 6.070 11.212 923 HB2 PRO 345 HB2 PRO 345 -3.281 5.111 9.029 924 HB3 PRO 345 HB3 PRO 345 -2.354 6.621 9.110 925 HG2 PRO 345 HG2 PRO 345 -1.525 4.605 7.619 926 HG3 PRO 345 HG3 PRO 345 -0.373 5.579 8.552 927 HD2 PRO 345 HD2 PRO 345 -1.304 2.789 9.052 928 HD3 PRO 345 HD3 PRO 345 0.240 3.558 9.474 929 H PTR 346 H PTR 346 -3.716 3.368 10.882 930 HA PTR 346 HA PTR 346 -5.023 3.814 13.325 931 HB2 PTR 346 HB2 PTR 346 -6.608 5.321 12.923 932 HB3 PTR 346 HB3 PTR 346 -7.277 4.278 11.678 933 HD1 PTR 346 HD1 PTR 346 -5.530 4.311 9.452 934 HD2 PTR 346 HD2 PTR 346 -6.342 7.479 12.228 935 HE1 PTR 346 HE1 PTR 346 -4.852 5.972 7.734 936 HE2 PTR 346 HE2 PTR 346 -5.668 9.144 10.532 937 H ALA 347 H ALA 347 -6.807 2.402 13.707 938 HA ALA 347 HA ALA 347 -7.532 0.370 11.756 939 HB1 ALA 347 HB1 ALA 347 -5.956 -0.332 14.252 940 HB2 ALA 347 HB2 ALA 347 -5.431 -0.564 12.585 941 HB3 ALA 347 HB3 ALA 347 -6.784 -1.499 13.222 942 H ASP 348 H ASP 348 -9.449 1.665 12.290 943 HA ASP 348 HA ASP 348 -10.634 1.366 14.914 944 HB2 ASP 348 HB2 ASP 348 -12.551 2.580 13.737 945 HB3 ASP 348 HB3 ASP 348 -11.023 3.449 13.839 946 HA PRO 349 HA PRO 349 -12.229 -2.744 13.841 947 HB2 PRO 349 HB2 PRO 349 -13.957 -1.957 16.166 948 HB3 PRO 349 HB3 PRO 349 -13.121 -3.492 15.855 949 HG2 PRO 349 HG2 PRO 349 -12.166 -1.725 17.603 950 HG3 PRO 349 HG3 PRO 349 -11.093 -2.693 16.579 951 HD2 PRO 349 HD2 PRO 349 -11.733 0.205 16.407 952 HD3 PRO 349 HD3 PRO 349 -10.284 -0.670 15.865 953 H GLU 350 H GLU 350 -14.419 -0.142 14.893 954 HA GLU 350 HA GLU 350 -16.353 -0.927 12.805 955 HB2 GLU 350 HB2 GLU 350 -16.756 0.778 15.279 956 HB3 GLU 350 HB3 GLU 350 -18.009 0.317 14.126 957 HG2 GLU 350 HG2 GLU 350 -18.161 -1.812 14.941 958 HG3 GLU 350 HG3 GLU 350 -16.428 -1.934 15.225 Start of MODEL 6 1 H1 GLY 661 H1 GLY 661 6.129 -15.503 -9.622 2 H2 GLY 661 H2 GLY 661 6.705 -15.946 -11.167 3 H3 GLY 661 H3 GLY 661 7.543 -14.790 -10.246 4 HA2 GLY 661 HA2 GLY 661 8.306 -17.316 -10.371 5 HA3 GLY 661 HA3 GLY 661 8.558 -16.313 -8.943 6 H HIS 662 H HIS 662 6.896 -16.352 -7.274 7 HA HIS 662 HA HIS 662 5.994 -19.061 -6.739 8 HB2 HIS 662 HB2 HIS 662 6.976 -17.368 -5.053 9 HB3 HIS 662 HB3 HIS 662 5.378 -16.618 -5.080 10 HD1 HIS 662 HD1 HIS 662 3.512 -18.906 -5.160 11 HD2 HIS 662 HD2 HIS 662 6.941 -18.982 -2.790 12 HE1 HIS 662 HE1 HIS 662 3.102 -20.654 -3.357 13 HE2 HIS 662 HE2 HIS 662 5.182 -20.699 -1.896 14 H MET 663 H MET 663 4.749 -17.535 -8.969 15 HA MET 663 HA MET 663 2.658 -17.330 -9.892 16 HB2 MET 663 HB2 MET 663 2.306 -19.569 -8.784 17 HB3 MET 663 HB3 MET 663 1.618 -18.700 -7.409 18 HG2 MET 663 HG2 MET 663 0.163 -17.536 -9.302 19 HG3 MET 663 HG3 MET 663 0.534 -19.014 -10.185 20 HE1 MET 663 HE1 MET 663 -1.765 -18.951 -10.424 21 HE2 MET 663 HE2 MET 663 -1.975 -20.644 -9.999 22 HE3 MET 663 HE3 MET 663 -3.011 -19.419 -9.272 23 H GLN 664 H GLN 664 2.684 -16.680 -6.426 24 HA GLN 664 HA GLN 664 0.730 -14.515 -6.810 25 HB2 GLN 664 HB2 GLN 664 0.891 -16.393 -4.860 26 HB3 GLN 664 HB3 GLN 664 1.758 -15.063 -4.095 27 HG2 GLN 664 HG2 GLN 664 -0.490 -14.661 -3.500 28 HG3 GLN 664 HG3 GLN 664 -0.236 -13.593 -4.879 29 HE21 GLN 664 HE21 GLN 664 -1.208 -17.047 -4.361 30 HE22 GLN 664 HE22 GLN 664 -2.433 -17.011 -5.533 31 H ASP 665 H ASP 665 3.635 -14.363 -7.633 32 HA ASP 665 HA ASP 665 4.980 -12.624 -5.834 33 HB2 ASP 665 HB2 ASP 665 5.437 -12.531 -8.790 34 HB3 ASP 665 HB3 ASP 665 6.605 -12.434 -7.476 35 H LEU 666 H LEU 666 3.371 -11.101 -5.226 36 HA LEU 666 HA LEU 666 1.860 -9.456 -6.876 37 HB2 LEU 666 HB2 LEU 666 3.174 -8.601 -4.284 38 HB3 LEU 666 HB3 LEU 666 1.748 -7.882 -5.021 39 HG LEU 666 HG LEU 666 1.926 -10.748 -4.031 40 HD11 LEU 666 HD11 LEU 666 1.984 -9.158 -2.174 41 HD12 LEU 666 HD12 LEU 666 0.608 -8.289 -2.849 42 HD13 LEU 666 HD13 LEU 666 0.402 -9.930 -2.243 43 HD21 LEU 666 HD21 LEU 666 -0.735 -9.728 -4.307 44 HD22 LEU 666 HD22 LEU 666 0.120 -9.432 -5.818 45 HD23 LEU 666 HD23 LEU 666 0.010 -11.070 -5.175 46 H SER 667 H SER 667 5.257 -9.476 -6.311 47 HA SER 667 HA SER 667 6.083 -6.909 -6.844 48 HB2 SER 667 HB2 SER 667 7.987 -8.318 -8.115 49 HB3 SER 667 HB3 SER 667 7.857 -8.244 -6.359 50 HG SER 667 HG SER 667 7.433 -10.338 -8.066 51 H VAL 668 H VAL 668 4.483 -9.113 -8.946 52 HA VAL 668 HA VAL 668 5.368 -8.106 -11.450 53 HB VAL 668 HB VAL 668 3.400 -9.217 -12.377 54 HG11 VAL 668 HG11 VAL 668 5.217 -10.490 -10.447 55 HG12 VAL 668 HG12 VAL 668 3.732 -11.401 -10.712 56 HG13 VAL 668 HG13 VAL 668 4.775 -10.997 -12.075 57 HG21 VAL 668 HG21 VAL 668 1.567 -8.797 -11.023 58 HG22 VAL 668 HG22 VAL 668 1.975 -10.419 -10.464 59 HG23 VAL 668 HG23 VAL 668 2.483 -9.011 -9.533 60 H HIS 669 H HIS 669 3.205 -6.852 -9.057 61 HA HIS 669 HA HIS 669 1.778 -5.112 -10.883 62 HB2 HIS 669 HB2 HIS 669 1.856 -4.920 -7.869 63 HB3 HIS 669 HB3 HIS 669 0.622 -4.300 -8.967 64 HD1 HIS 669 HD1 HIS 669 -0.274 -6.431 -10.668 65 HD2 HIS 669 HD2 HIS 669 0.977 -7.314 -6.791 66 HE1 HIS 669 HE1 HIS 669 -1.276 -8.686 -10.093 67 HE2 HIS 669 HE2 HIS 669 -0.531 -9.238 -7.730 68 H LEU 670 H LEU 670 2.415 -3.245 -11.588 69 HA LEU 670 HA LEU 670 4.877 -2.105 -11.290 70 HB2 LEU 670 HB2 LEU 670 3.275 -1.499 -13.048 71 HB3 LEU 670 HB3 LEU 670 2.263 -0.685 -11.858 72 HG LEU 670 HG LEU 670 4.074 0.914 -11.386 73 HD11 LEU 670 HD11 LEU 670 5.569 -0.692 -13.476 74 HD12 LEU 670 HD12 LEU 670 6.074 0.904 -12.912 75 HD13 LEU 670 HD13 LEU 670 6.030 -0.459 -11.789 76 HD21 LEU 670 HD21 LEU 670 3.532 0.575 -14.351 77 HD22 LEU 670 HD22 LEU 670 2.492 1.425 -13.209 78 HD23 LEU 670 HD23 LEU 670 4.098 2.052 -13.576 79 H TRP 671 H TRP 671 2.115 -1.714 -9.117 80 HA TRP 671 HA TRP 671 3.486 0.444 -7.721 81 HB2 TRP 671 HB2 TRP 671 1.437 0.003 -6.085 82 HB3 TRP 671 HB3 TRP 671 1.285 0.968 -7.545 83 HD1 TRP 671 HD1 TRP 671 -0.381 0.168 -9.324 84 HE1 TRP 671 HE1 TRP 671 -1.957 -1.881 -9.565 85 HE3 TRP 671 HE3 TRP 671 1.371 -2.712 -5.484 86 HZ2 TRP 671 HZ2 TRP 671 -2.360 -4.394 -8.295 87 HZ3 TRP 671 HZ3 TRP 671 0.366 -4.931 -5.022 88 HH2 TRP 671 HH2 TRP 671 -1.497 -5.776 -6.423 89 H TYR 672 H TYR 672 3.966 -2.782 -7.752 90 HA TYR 672 HA TYR 672 4.211 -3.126 -4.857 91 HB2 TYR 672 HB2 TYR 672 3.604 -4.915 -6.745 92 HB3 TYR 672 HB3 TYR 672 5.355 -5.127 -6.733 93 HD1 TYR 672 HD2 TYR 672 2.365 -5.003 -4.505 94 HD2 TYR 672 HD1 TYR 672 6.417 -6.335 -4.983 95 HE1 TYR 672 HE2 TYR 672 2.193 -6.289 -2.392 96 HE2 TYR 672 HE1 TYR 672 6.245 -7.615 -2.868 97 HH TYR 672 HH TYR 672 3.817 -7.130 -0.636 98 H ALA 673 H ALA 673 5.851 -2.170 -3.879 99 HA ALA 673 HA ALA 673 8.452 -1.909 -5.227 100 HB1 ALA 673 HB1 ALA 673 7.852 -0.891 -2.472 101 HB2 ALA 673 HB2 ALA 673 7.176 -0.062 -3.871 102 HB3 ALA 673 HB3 ALA 673 8.922 -0.216 -3.701 103 H GLY 674 H GLY 674 6.896 -4.166 -3.521 104 HA2 GLY 674 HA2 GLY 674 7.461 -5.739 -1.867 105 HA3 GLY 674 HA3 GLY 674 8.605 -6.111 -3.138 106 HA PRO 675 HA PRO 675 11.982 -5.771 -0.350 107 HB2 PRO 675 HB2 PRO 675 13.290 -4.136 -2.475 108 HB3 PRO 675 HB3 PRO 675 13.889 -5.575 -1.628 109 HG2 PRO 675 HG2 PRO 675 12.994 -5.723 -4.120 110 HG3 PRO 675 HG3 PRO 675 12.682 -7.019 -2.950 111 HD2 PRO 675 HD2 PRO 675 10.808 -4.953 -4.015 112 HD3 PRO 675 HD3 PRO 675 10.479 -6.623 -3.500 113 H MET 676 H MET 676 10.661 -2.884 -1.801 114 HA MET 676 HA MET 676 12.126 -0.902 -0.478 115 HB2 MET 676 HB2 MET 676 10.230 -0.782 -2.298 116 HB3 MET 676 HB3 MET 676 9.188 -0.540 -0.897 117 HG2 MET 676 HG2 MET 676 9.776 1.646 -1.053 118 HG3 MET 676 HG3 MET 676 11.326 1.150 -0.375 119 HE1 MET 676 HE1 MET 676 12.764 3.126 -1.594 120 HE2 MET 676 HE2 MET 676 13.332 1.499 -1.246 121 HE3 MET 676 HE3 MET 676 13.727 2.258 -2.791 122 H GLU 677 H GLU 677 11.641 0.400 1.319 123 HA GLU 677 HA GLU 677 10.202 -0.993 3.492 124 HB2 GLU 677 HB2 GLU 677 11.683 0.546 4.950 125 HB3 GLU 677 HB3 GLU 677 12.456 -0.831 4.166 126 HG2 GLU 677 HG2 GLU 677 13.129 0.690 2.284 127 HG3 GLU 677 HG3 GLU 677 12.478 2.037 3.193 128 H ARG 678 H ARG 678 9.092 0.434 5.056 129 HA ARG 678 HA ARG 678 7.286 2.191 3.902 130 HB2 ARG 678 HB2 ARG 678 7.102 1.256 6.212 131 HB3 ARG 678 HB3 ARG 678 8.333 2.402 6.736 132 HG2 ARG 678 HG2 ARG 678 6.458 3.940 5.307 133 HG3 ARG 678 HG3 ARG 678 5.496 2.845 6.294 134 HD2 ARG 678 HD2 ARG 678 6.095 3.872 8.227 135 HD3 ARG 678 HD3 ARG 678 7.776 4.039 7.729 136 HE ARG 678 HE ARG 678 6.497 5.869 6.172 137 HH11 ARG 678 HH21 ARG 678 6.655 5.261 9.592 138 HH12 ARG 678 HH22 ARG 678 6.218 6.903 9.992 139 HH21 ARG 678 HH11 ARG 678 6.003 7.944 6.701 140 HH22 ARG 678 HH12 ARG 678 5.864 8.415 8.374 141 H ALA 679 H ALA 679 10.010 3.236 5.941 142 HA ALA 679 HA ALA 679 10.001 5.941 5.438 143 HB1 ALA 679 HB1 ALA 679 11.798 4.048 6.556 144 HB2 ALA 679 HB2 ALA 679 11.828 5.801 6.737 145 HB3 ALA 679 HB3 ALA 679 12.724 5.032 5.427 146 H GLY 680 H GLY 680 11.417 3.368 3.519 147 HA2 GLY 680 HA2 GLY 680 12.691 5.001 1.578 148 HA3 GLY 680 HA3 GLY 680 12.294 3.294 1.391 149 H ALA 681 H ALA 681 9.622 3.207 1.590 150 HA ALA 681 HA ALA 681 8.667 3.869 -0.926 151 HB1 ALA 681 HB1 ALA 681 6.365 3.734 0.207 152 HB2 ALA 681 HB2 ALA 681 7.252 3.441 1.703 153 HB3 ALA 681 HB3 ALA 681 7.408 2.320 0.352 154 H GLU 682 H GLU 682 8.703 5.815 2.012 155 HA GLU 682 HA GLU 682 7.025 7.892 1.061 156 HB2 GLU 682 HB2 GLU 682 9.206 8.381 3.061 157 HB3 GLU 682 HB3 GLU 682 7.569 9.039 3.013 158 HG2 GLU 682 HG2 GLU 682 6.863 6.525 3.305 159 HG3 GLU 682 HG3 GLU 682 8.488 6.337 3.926 160 H SER 683 H SER 683 10.471 7.280 0.874 161 HA SER 683 HA SER 683 11.415 9.776 0.100 162 HB2 SER 683 HB2 SER 683 13.318 8.625 -0.803 163 HB3 SER 683 HB3 SER 683 12.789 7.731 0.621 164 HG SER 683 HG SER 683 11.746 6.257 -0.726 165 H ILE 684 H ILE 684 10.545 7.092 -2.062 166 HA ILE 684 HA ILE 684 10.697 8.608 -4.449 167 HB ILE 684 HB ILE 684 8.851 6.250 -4.056 168 HG12 ILE 684 HG12 ILE 684 11.377 5.382 -5.024 169 HG13 ILE 684 HG13 ILE 684 11.694 6.343 -3.580 170 HG21 ILE 684 HG21 ILE 684 8.590 6.842 -6.254 171 HG22 ILE 684 HG22 ILE 684 10.140 7.681 -6.322 172 HG23 ILE 684 HG23 ILE 684 10.082 5.923 -6.444 173 HD11 ILE 684 HD11 ILE 684 9.509 4.268 -3.590 174 HD12 ILE 684 HD12 ILE 684 11.184 3.812 -3.280 175 HD13 ILE 684 HD13 ILE 684 10.371 4.956 -2.214 176 H LEU 685 H LEU 685 7.956 7.636 -2.441 177 HA LEU 685 HA LEU 685 5.922 8.914 -3.857 178 HB2 LEU 685 HB2 LEU 685 6.238 8.299 -0.919 179 HB3 LEU 685 HB3 LEU 685 4.753 8.959 -1.600 180 HG LEU 685 HG LEU 685 6.098 6.395 -2.510 181 HD11 LEU 685 HD11 LEU 685 3.878 6.996 -0.593 182 HD12 LEU 685 HD12 LEU 685 3.774 5.541 -1.581 183 HD13 LEU 685 HD13 LEU 685 5.143 5.770 -0.493 184 HD21 LEU 685 HD21 LEU 685 3.521 6.360 -3.432 185 HD22 LEU 685 HD22 LEU 685 3.910 8.072 -3.564 186 HD23 LEU 685 HD23 LEU 685 4.908 6.875 -4.387 187 H ALA 686 H ALA 686 7.757 10.191 -1.040 188 HA ALA 686 HA ALA 686 6.641 12.762 -1.026 189 HB1 ALA 686 HB1 ALA 686 9.215 11.576 -0.087 190 HB2 ALA 686 HB2 ALA 686 7.972 12.428 0.825 191 HB3 ALA 686 HB3 ALA 686 9.106 13.332 -0.177 192 H ASN 687 H ASN 687 9.242 11.389 -2.966 193 HA ASN 687 HA ASN 687 10.009 13.863 -4.213 194 HB2 ASN 687 HB2 ASN 687 11.730 12.368 -4.444 195 HB3 ASN 687 HB3 ASN 687 10.652 10.978 -4.535 196 HD21 ASN 687 HD21 ASN 687 11.404 13.910 -6.505 197 HD22 ASN 687 HD22 ASN 687 11.330 13.096 -7.992 198 H ARG 688 H ARG 688 7.814 11.215 -4.989 199 HA ARG 688 HA ARG 688 7.153 12.100 -7.617 200 HB2 ARG 688 HB2 ARG 688 6.620 9.861 -6.036 201 HB3 ARG 688 HB3 ARG 688 5.042 10.605 -6.285 202 HG2 ARG 688 HG2 ARG 688 5.402 9.107 -8.133 203 HG3 ARG 688 HG3 ARG 688 5.612 10.742 -8.755 204 HD2 ARG 688 HD2 ARG 688 8.142 10.315 -8.068 205 HD3 ARG 688 HD3 ARG 688 7.671 8.628 -8.247 206 HE ARG 688 HE ARG 688 7.606 10.673 -10.385 207 HH11 ARG 688 HH21 ARG 688 7.457 7.364 -9.362 208 HH12 ARG 688 HH22 ARG 688 7.483 6.746 -10.992 209 HH21 ARG 688 HH11 ARG 688 7.555 9.830 -12.465 210 HH22 ARG 688 HH12 ARG 688 7.457 8.112 -12.711 211 H SER 689 H SER 689 4.376 12.112 -7.658 212 HA SER 689 HA SER 689 3.852 14.775 -6.532 213 HB2 SER 689 HB2 SER 689 3.011 13.324 -8.919 214 HB3 SER 689 HB3 SER 689 1.648 14.047 -8.067 215 HG SER 689 HG SER 689 3.104 15.312 -9.678 216 H ASP 690 H ASP 690 1.982 15.244 -5.307 217 HA ASP 690 HA ASP 690 1.255 13.329 -3.406 218 HB2 ASP 690 HB2 ASP 690 0.576 16.077 -3.969 219 HB3 ASP 690 HB3 ASP 690 -0.868 15.176 -3.516 220 H GLY 691 H GLY 691 0.040 11.614 -3.534 221 HA2 GLY 691 HA2 GLY 691 -2.251 10.762 -4.129 222 HA3 GLY 691 HA3 GLY 691 -1.931 11.405 -5.739 223 H THR 692 H THR 692 0.932 10.692 -5.498 224 HA THR 692 HA THR 692 0.992 8.242 -6.847 225 HB THR 692 HB THR 692 3.230 9.315 -5.117 226 HG1 THR 692 HG1 THR 692 2.596 11.020 -6.366 227 HG21 THR 692 HG21 THR 692 3.260 7.011 -6.390 228 HG22 THR 692 HG22 THR 692 3.504 8.024 -7.812 229 HG23 THR 692 HG23 THR 692 4.659 8.077 -6.481 230 H PHE 693 H PHE 693 1.293 6.104 -6.209 231 HA PHE 693 HA PHE 693 1.466 5.581 -3.310 232 HB2 PHE 693 HB2 PHE 693 -0.429 4.148 -3.298 233 HB3 PHE 693 HB3 PHE 693 -0.943 5.626 -4.111 234 HD1 PHE 693 HD1 PHE 693 -1.180 5.696 -6.577 235 HD2 PHE 693 HD2 PHE 693 -0.213 2.061 -4.504 236 HE1 PHE 693 HE1 PHE 693 -1.774 4.387 -8.597 237 HE2 PHE 693 HE2 PHE 693 -0.811 0.755 -6.522 238 HZ PHE 693 HZ PHE 693 -1.588 1.914 -8.570 239 H LEU 694 H LEU 694 1.658 3.214 -2.834 240 HA LEU 694 HA LEU 694 2.580 1.393 -4.806 241 HB2 LEU 694 HB2 LEU 694 4.924 1.328 -4.370 242 HB3 LEU 694 HB3 LEU 694 4.510 2.998 -4.724 243 HG LEU 694 HG LEU 694 4.195 3.132 -2.092 244 HD11 LEU 694 HD11 LEU 694 6.422 1.610 -1.459 245 HD12 LEU 694 HD12 LEU 694 4.754 1.166 -1.105 246 HD13 LEU 694 HD13 LEU 694 5.537 0.559 -2.564 247 HD21 LEU 694 HD21 LEU 694 6.597 3.818 -1.936 248 HD22 LEU 694 HD22 LEU 694 6.866 3.112 -3.530 249 HD23 LEU 694 HD23 LEU 694 5.784 4.491 -3.346 250 H VAL 695 H VAL 695 3.625 -0.529 -3.818 251 HA VAL 695 HA VAL 695 2.740 -0.966 -1.019 252 HB VAL 695 HB VAL 695 2.546 -3.046 -3.210 253 HG11 VAL 695 HG11 VAL 695 1.259 -2.891 -0.466 254 HG12 VAL 695 HG12 VAL 695 1.232 -4.263 -1.574 255 HG13 VAL 695 HG13 VAL 695 2.743 -3.782 -0.802 256 HG21 VAL 695 HG21 VAL 695 0.951 -1.373 -3.824 257 HG22 VAL 695 HG22 VAL 695 0.034 -2.586 -2.932 258 HG23 VAL 695 HG23 VAL 695 0.506 -1.081 -2.144 259 H ARG 696 H ARG 696 4.092 -2.288 0.231 260 HA ARG 696 HA ARG 696 6.552 -3.234 -1.098 261 HB2 ARG 696 HB2 ARG 696 7.922 -2.366 0.745 262 HB3 ARG 696 HB3 ARG 696 7.104 -1.071 -0.121 263 HG2 ARG 696 HG2 ARG 696 5.907 -0.461 1.702 264 HG3 ARG 696 HG3 ARG 696 5.525 -2.130 2.117 265 HD2 ARG 696 HD2 ARG 696 8.353 -1.390 2.530 266 HD3 ARG 696 HD3 ARG 696 7.223 -0.524 3.554 267 HE ARG 696 HE ARG 696 6.601 -2.561 4.559 268 HH11 ARG 696 HH21 ARG 696 9.079 -2.972 2.166 269 HH12 ARG 696 HH22 ARG 696 9.246 -4.667 2.491 270 HH21 ARG 696 HH11 ARG 696 6.793 -4.752 4.932 271 HH22 ARG 696 HH12 ARG 696 7.985 -5.678 4.042 272 H GLN 697 H GLN 697 7.796 -4.782 0.179 273 HA GLN 697 HA GLN 697 6.186 -6.220 2.195 274 HB2 GLN 697 HB2 GLN 697 5.750 -7.178 -0.046 275 HB3 GLN 697 HB3 GLN 697 7.471 -7.499 -0.225 276 HG2 GLN 697 HG2 GLN 697 7.389 -8.925 1.813 277 HG3 GLN 697 HG3 GLN 697 5.648 -8.654 1.906 278 HE21 GLN 697 HE21 GLN 697 4.949 -8.831 -0.854 279 HE22 GLN 697 HE22 GLN 697 5.287 -10.411 -1.388 280 H ARG 698 H ARG 698 9.281 -6.133 0.454 281 HA ARG 698 HA ARG 698 11.424 -5.971 1.386 282 HB2 ARG 698 HB2 ARG 698 10.232 -5.484 3.663 283 HB3 ARG 698 HB3 ARG 698 10.498 -7.197 3.974 284 HG2 ARG 698 HG2 ARG 698 12.363 -5.845 4.855 285 HG3 ARG 698 HG3 ARG 698 12.918 -6.896 3.553 286 HD2 ARG 698 HD2 ARG 698 13.430 -5.146 2.198 287 HD3 ARG 698 HD3 ARG 698 11.956 -4.276 2.621 288 HE ARG 698 HE ARG 698 13.836 -4.272 4.782 289 HH11 ARG 698 HH21 ARG 698 13.110 -2.843 1.704 290 HH12 ARG 698 HH22 ARG 698 13.863 -1.326 2.113 291 HH21 ARG 698 HH11 ARG 698 14.802 -2.307 5.270 292 HH22 ARG 698 HH12 ARG 698 14.807 -1.001 4.109 293 H VAL 699 H VAL 699 11.746 -8.393 3.493 294 HA VAL 699 HA VAL 699 12.279 -10.335 1.348 295 HB VAL 699 HB VAL 699 13.098 -10.260 4.267 296 HG11 VAL 699 HG11 VAL 699 13.497 -12.325 2.097 297 HG12 VAL 699 HG12 VAL 699 14.618 -12.183 3.452 298 HG13 VAL 699 HG13 VAL 699 12.922 -12.570 3.747 299 HG21 VAL 699 HG21 VAL 699 14.144 -8.984 1.988 300 HG22 VAL 699 HG22 VAL 699 14.953 -9.194 3.541 301 HG23 VAL 699 HG23 VAL 699 15.194 -10.375 2.254 302 H LYS 700 H LYS 700 11.250 -10.756 4.699 303 HA LYS 700 HA LYS 700 8.683 -11.861 4.068 304 HB2 LYS 700 HB2 LYS 700 10.772 -13.671 3.768 305 HB3 LYS 700 HB3 LYS 700 10.200 -13.980 5.406 306 HG2 LYS 700 HG2 LYS 700 8.702 -15.321 4.300 307 HG3 LYS 700 HG3 LYS 700 7.815 -13.804 4.160 308 HD2 LYS 700 HD2 LYS 700 9.800 -14.089 2.034 309 HD3 LYS 700 HD3 LYS 700 8.663 -15.436 2.045 310 HE2 LYS 700 HE2 LYS 700 7.084 -14.136 1.113 311 HE3 LYS 700 HE3 LYS 700 7.190 -13.006 2.464 312 HZ1 LYS 700 HZ1 LYS 700 8.775 -13.002 -0.039 313 HZ2 LYS 700 HZ2 LYS 700 7.735 -11.774 0.543 314 HZ3 LYS 700 HZ3 LYS 700 9.228 -12.086 1.330 315 H ASP 701 H ASP 701 10.473 -10.085 5.801 316 HA ASP 701 HA ASP 701 10.182 -10.894 8.511 317 HB2 ASP 701 HB2 ASP 701 10.559 -8.254 8.700 318 HB3 ASP 701 HB3 ASP 701 11.870 -9.346 8.259 319 H ALA 702 H ALA 702 8.713 -10.193 10.060 320 HA ALA 702 HA ALA 702 6.683 -9.569 10.927 321 HB1 ALA 702 HB1 ALA 702 7.602 -7.353 9.918 322 HB2 ALA 702 HB2 ALA 702 5.902 -7.440 10.377 323 HB3 ALA 702 HB3 ALA 702 6.369 -7.597 8.684 324 H ALA 703 H ALA 703 6.625 -9.814 7.380 325 HA ALA 703 HA ALA 703 5.205 -10.975 5.977 326 HB1 ALA 703 HB1 ALA 703 4.965 -12.372 8.426 327 HB2 ALA 703 HB2 ALA 703 4.496 -12.931 6.822 328 HB3 ALA 703 HB3 ALA 703 3.320 -12.107 7.846 329 H GLU 704 H GLU 704 4.623 -8.406 7.683 330 HA GLU 704 HA GLU 704 1.745 -8.145 7.287 331 HB2 GLU 704 HB2 GLU 704 3.097 -7.273 9.313 332 HB3 GLU 704 HB3 GLU 704 3.601 -5.972 8.234 333 HG2 GLU 704 HG2 GLU 704 1.249 -5.389 7.811 334 HG3 GLU 704 HG3 GLU 704 0.722 -6.719 8.840 335 H PHE 705 H PHE 705 0.855 -7.240 5.547 336 HA PHE 705 HA PHE 705 2.609 -5.888 3.594 337 HB2 PHE 705 HB2 PHE 705 -0.226 -6.897 3.238 338 HB3 PHE 705 HB3 PHE 705 0.827 -6.258 1.975 339 HD1 PHE 705 HD1 PHE 705 0.451 -9.031 4.442 340 HD2 PHE 705 HD2 PHE 705 2.418 -7.637 0.896 341 HE1 PHE 705 HE1 PHE 705 1.384 -11.298 4.074 342 HE2 PHE 705 HE2 PHE 705 3.359 -9.903 0.523 343 HZ PHE 705 HZ PHE 705 2.840 -11.737 2.112 344 H ALA 706 H ALA 706 1.961 -3.891 2.666 345 HA ALA 706 HA ALA 706 -0.343 -2.489 3.676 346 HB1 ALA 706 HB1 ALA 706 1.884 -2.358 5.303 347 HB2 ALA 706 HB2 ALA 706 0.578 -1.179 5.265 348 HB3 ALA 706 HB3 ALA 706 2.028 -0.905 4.316 349 H ILE 707 H ILE 707 -0.827 -0.675 2.512 350 HA ILE 707 HA ILE 707 0.784 -0.283 0.072 351 HB ILE 707 HB ILE 707 -1.990 0.760 0.699 352 HG12 ILE 707 HG12 ILE 707 -1.214 -1.622 -1.006 353 HG13 ILE 707 HG13 ILE 707 -1.765 -1.763 0.662 354 HG21 ILE 707 HG21 ILE 707 -1.812 0.604 -1.995 355 HG22 ILE 707 HG22 ILE 707 -1.362 2.052 -1.097 356 HG23 ILE 707 HG23 ILE 707 -0.120 0.913 -1.616 357 HD11 ILE 707 HD11 ILE 707 -3.481 -0.079 -1.043 358 HD12 ILE 707 HD12 ILE 707 -3.424 -1.777 -1.515 359 HD13 ILE 707 HD13 ILE 707 -3.922 -1.331 0.117 360 H SER 708 H SER 708 1.833 1.595 -0.331 361 HA SER 708 HA SER 708 1.620 3.709 1.741 362 HB2 SER 708 HB2 SER 708 3.951 3.033 -0.070 363 HB3 SER 708 HB3 SER 708 3.926 4.313 1.140 364 HG SER 708 HG SER 708 3.549 1.522 1.621 365 H ILE 709 H ILE 709 0.601 5.495 1.100 366 HA ILE 709 HA ILE 709 0.738 6.230 -1.766 367 HB ILE 709 HB ILE 709 -1.606 6.839 0.029 368 HG12 ILE 709 HG12 ILE 709 -2.454 4.867 -1.701 369 HG13 ILE 709 HG13 ILE 709 -0.834 4.312 -1.283 370 HG21 ILE 709 HG21 ILE 709 -2.379 6.580 -2.650 371 HG22 ILE 709 HG22 ILE 709 -2.150 8.091 -1.771 372 HG23 ILE 709 HG23 ILE 709 -0.831 7.417 -2.726 373 HD11 ILE 709 HD11 ILE 709 -1.409 4.612 1.136 374 HD12 ILE 709 HD12 ILE 709 -3.059 5.008 0.656 375 HD13 ILE 709 HD13 ILE 709 -2.408 3.402 0.332 376 H LYS 710 H LYS 710 1.176 8.263 -2.307 377 HA LYS 710 HA LYS 710 2.244 10.046 -0.293 378 HB2 LYS 710 HB2 LYS 710 3.344 9.896 -2.444 379 HB3 LYS 710 HB3 LYS 710 1.851 10.295 -3.285 380 HG2 LYS 710 HG2 LYS 710 3.088 12.321 -3.231 381 HG3 LYS 710 HG3 LYS 710 1.881 12.479 -1.959 382 HD2 LYS 710 HD2 LYS 710 3.771 11.413 -0.457 383 HD3 LYS 710 HD3 LYS 710 4.827 12.050 -1.715 384 HE2 LYS 710 HE2 LYS 710 4.524 13.689 0.100 385 HE3 LYS 710 HE3 LYS 710 3.839 14.291 -1.406 386 HZ1 LYS 710 HZ1 LYS 710 1.650 13.723 -0.726 387 HZ2 LYS 710 HZ2 LYS 710 2.252 12.852 0.646 388 HZ3 LYS 710 HZ3 LYS 710 2.394 14.543 0.567 389 H TYR 711 H TYR 711 1.063 11.457 0.859 390 HA TYR 711 HA TYR 711 -1.274 12.747 -0.396 391 HB2 TYR 711 HB2 TYR 711 -1.756 10.605 1.116 392 HB3 TYR 711 HB3 TYR 711 -1.572 11.780 2.416 393 HD1 TYR 711 HD2 TYR 711 -2.760 14.200 1.607 394 HD2 TYR 711 HD1 TYR 711 -3.975 10.223 0.573 395 HE1 TYR 711 HE2 TYR 711 -5.060 15.018 1.180 396 HE2 TYR 711 HE1 TYR 711 -6.278 11.044 0.144 397 HH TYR 711 HH TYR 711 -7.558 12.916 -0.180 398 H ASN 712 H ASN 712 -1.300 14.858 0.005 399 HA ASN 712 HA ASN 712 -0.600 16.919 0.782 400 HB2 ASN 712 HB2 ASN 712 -2.283 15.886 2.498 401 HB3 ASN 712 HB3 ASN 712 -0.869 15.770 3.540 402 HD21 ASN 712 HD21 ASN 712 0.171 17.798 4.193 403 HD22 ASN 712 HD22 ASN 712 -0.649 19.276 4.041 404 H VAL 713 H VAL 713 1.601 16.356 -0.030 405 HA VAL 713 HA VAL 713 3.868 16.089 0.201 406 HB VAL 713 HB VAL 713 4.890 17.836 1.385 407 HG11 VAL 713 HG11 VAL 713 3.222 18.617 -0.277 408 HG12 VAL 713 HG12 VAL 713 2.004 18.693 0.997 409 HG13 VAL 713 HG13 VAL 713 3.407 19.760 1.052 410 HG21 VAL 713 HG21 VAL 713 2.520 17.764 3.282 411 HG22 VAL 713 HG22 VAL 713 4.163 17.246 3.650 412 HG23 VAL 713 HG23 VAL 713 3.820 18.946 3.343 413 H GLU 714 H GLU 714 2.120 14.285 1.908 414 HA GLU 714 HA GLU 714 4.305 13.133 3.487 415 HB2 GLU 714 HB2 GLU 714 1.792 14.203 4.470 416 HB3 GLU 714 HB3 GLU 714 1.922 12.478 4.819 417 HG2 GLU 714 HG2 GLU 714 4.276 14.267 5.298 418 HG3 GLU 714 HG3 GLU 714 2.972 14.219 6.481 419 H VAL 715 H VAL 715 3.490 10.817 4.208 420 HA VAL 715 HA VAL 715 2.069 9.569 1.920 421 HB VAL 715 HB VAL 715 4.625 8.634 3.239 422 HG11 VAL 715 HG11 VAL 715 3.192 6.694 2.883 423 HG12 VAL 715 HG12 VAL 715 2.800 7.242 1.254 424 HG13 VAL 715 HG13 VAL 715 4.437 6.713 1.634 425 HG21 VAL 715 HG21 VAL 715 5.572 8.939 1.051 426 HG22 VAL 715 HG22 VAL 715 3.991 9.200 0.333 427 HG23 VAL 715 HG23 VAL 715 4.681 10.408 1.415 428 H LYS 716 H LYS 716 0.763 7.824 2.388 429 HA LYS 716 HA LYS 716 0.349 7.309 5.282 430 HB2 LYS 716 HB2 LYS 716 -1.458 8.347 3.496 431 HB3 LYS 716 HB3 LYS 716 -1.846 6.631 3.454 432 HG2 LYS 716 HG2 LYS 716 -2.608 6.597 5.613 433 HG3 LYS 716 HG3 LYS 716 -1.405 7.760 6.160 434 HD2 LYS 716 HD2 LYS 716 -3.835 8.474 4.486 435 HD3 LYS 716 HD3 LYS 716 -3.744 8.674 6.218 436 HE2 LYS 716 HE2 LYS 716 -2.047 10.074 4.132 437 HE3 LYS 716 HE3 LYS 716 -3.246 10.809 5.192 438 HZ1 LYS 716 HZ1 LYS 716 -0.616 10.693 5.730 439 HZ2 LYS 716 HZ2 LYS 716 -1.834 10.852 6.908 440 HZ3 LYS 716 HZ3 LYS 716 -1.181 9.326 6.570 441 H HIS 717 H HIS 717 1.108 5.356 5.849 442 HA HIS 717 HA HIS 717 0.839 3.150 3.900 443 HB2 HIS 717 HB2 HIS 717 2.609 2.987 6.328 444 HB3 HIS 717 HB3 HIS 717 2.711 2.077 4.824 445 HD1 HIS 717 HD1 HIS 717 4.131 3.029 2.949 446 HD2 HIS 717 HD2 HIS 717 3.602 5.743 6.096 447 HE1 HIS 717 HE1 HIS 717 5.824 4.903 2.620 448 HE2 HIS 717 HE2 HIS 717 5.464 6.598 4.499 449 H ILE 718 H ILE 718 -1.031 2.130 4.319 450 HA ILE 718 HA ILE 718 -1.752 1.572 7.144 451 HB ILE 718 HB ILE 718 -3.339 2.054 4.664 452 HG12 ILE 718 HG12 ILE 718 -3.350 3.757 6.392 453 HG13 ILE 718 HG13 ILE 718 -4.935 3.005 6.327 454 HG21 ILE 718 HG21 ILE 718 -4.055 -0.194 5.032 455 HG22 ILE 718 HG22 ILE 718 -4.106 0.036 6.778 456 HG23 ILE 718 HG23 ILE 718 -5.291 0.836 5.748 457 HD11 ILE 718 HD11 ILE 718 -3.584 1.411 8.137 458 HD12 ILE 718 HD12 ILE 718 -2.982 3.027 8.497 459 HD13 ILE 718 HD13 ILE 718 -4.710 2.701 8.544 460 H LYS 719 H LYS 719 -1.739 -0.537 7.822 461 HA LYS 719 HA LYS 719 -0.474 -2.468 6.132 462 HB2 LYS 719 HB2 LYS 719 -0.444 -3.893 8.029 463 HB3 LYS 719 HB3 LYS 719 -0.178 -2.261 8.637 464 HG2 LYS 719 HG2 LYS 719 -2.586 -2.094 9.213 465 HG3 LYS 719 HG3 LYS 719 -2.827 -3.745 8.640 466 HD2 LYS 719 HD2 LYS 719 -2.533 -4.007 10.970 467 HD3 LYS 719 HD3 LYS 719 -0.945 -4.386 10.306 468 HE2 LYS 719 HE2 LYS 719 -1.197 -1.536 10.759 469 HE3 LYS 719 HE3 LYS 719 -1.550 -2.428 12.240 470 HZ1 LYS 719 HZ1 LYS 719 0.552 -3.249 12.357 471 HZ2 LYS 719 HZ2 LYS 719 0.784 -3.288 10.654 472 HZ3 LYS 719 HZ3 LYS 719 0.909 -1.803 11.513 473 H ILE 720 H ILE 720 -1.236 -4.406 5.367 474 HA ILE 720 HA ILE 720 -4.145 -4.428 4.905 475 HB ILE 720 HB ILE 720 -1.827 -5.661 3.425 476 HG12 ILE 720 HG12 ILE 720 -4.040 -3.834 2.463 477 HG13 ILE 720 HG13 ILE 720 -2.523 -3.224 3.121 478 HG21 ILE 720 HG21 ILE 720 -3.616 -7.331 3.462 479 HG22 ILE 720 HG22 ILE 720 -4.808 -6.105 3.039 480 HG23 ILE 720 HG23 ILE 720 -3.575 -6.574 1.870 481 HD11 ILE 720 HD11 ILE 720 -2.673 -3.519 0.565 482 HD12 ILE 720 HD12 ILE 720 -1.247 -4.169 1.372 483 HD13 ILE 720 HD13 ILE 720 -2.556 -5.247 0.888 484 H MET 721 H MET 721 -5.396 -5.955 5.709 485 HA MET 721 HA MET 721 -4.141 -8.103 7.294 486 HB2 MET 721 HB2 MET 721 -6.174 -6.321 7.872 487 HB3 MET 721 HB3 MET 721 -7.044 -7.798 7.454 488 HG2 MET 721 HG2 MET 721 -5.218 -8.931 9.003 489 HG3 MET 721 HG3 MET 721 -5.102 -7.310 9.686 490 HE1 MET 721 HE1 MET 721 -7.139 -8.075 12.487 491 HE2 MET 721 HE2 MET 721 -6.145 -9.413 11.917 492 HE3 MET 721 HE3 MET 721 -5.579 -7.745 11.739 493 H THR 722 H THR 722 -5.377 -10.170 7.349 494 HA THR 722 HA THR 722 -6.889 -10.871 4.980 495 HB THR 722 HB THR 722 -4.418 -11.025 4.356 496 HG1 THR 722 HG1 THR 722 -6.134 -12.135 3.300 497 HG21 THR 722 HG21 THR 722 -3.829 -12.024 6.635 498 HG22 THR 722 HG22 THR 722 -4.527 -13.532 6.038 499 HG23 THR 722 HG23 THR 722 -3.129 -12.826 5.226 500 H ALA 723 H ALA 723 -7.635 -13.150 5.080 501 HA ALA 723 HA ALA 723 -7.400 -14.626 7.514 502 HB1 ALA 723 HB1 ALA 723 -9.863 -12.932 7.082 503 HB2 ALA 723 HB2 ALA 723 -8.762 -12.881 8.464 504 HB3 ALA 723 HB3 ALA 723 -9.801 -14.286 8.212 505 H GLU 724 H GLU 724 -10.105 -13.877 5.423 506 HA GLU 724 HA GLU 724 -10.653 -16.671 4.881 507 HB2 GLU 724 HB2 GLU 724 -12.043 -14.423 3.500 508 HB3 GLU 724 HB3 GLU 724 -12.722 -15.894 4.192 509 HG2 GLU 724 HG2 GLU 724 -13.443 -14.311 5.749 510 HG3 GLU 724 HG3 GLU 724 -11.915 -14.800 6.476 511 H GLY 725 H GLY 725 -8.124 -15.532 3.900 512 HA2 GLY 725 HA2 GLY 725 -6.820 -15.848 2.000 513 HA3 GLY 725 HA3 GLY 725 -8.250 -16.461 1.170 514 H LEU 726 H LEU 726 -8.730 -13.495 2.745 515 HA LEU 726 HA LEU 726 -8.634 -12.060 0.161 516 HB2 LEU 726 HB2 LEU 726 -10.188 -11.386 2.670 517 HB3 LEU 726 HB3 LEU 726 -10.305 -10.560 1.116 518 HG LEU 726 HG LEU 726 -10.767 -13.519 1.198 519 HD11 LEU 726 HD11 LEU 726 -13.008 -11.580 1.737 520 HD12 LEU 726 HD12 LEU 726 -12.985 -13.328 1.962 521 HD13 LEU 726 HD13 LEU 726 -12.090 -12.284 3.068 522 HD21 LEU 726 HD21 LEU 726 -12.137 -11.288 -0.329 523 HD22 LEU 726 HD22 LEU 726 -10.702 -12.127 -0.914 524 HD23 LEU 726 HD23 LEU 726 -12.205 -13.016 -0.675 525 H TYR 727 H TYR 727 -8.296 -9.676 0.394 526 HA TYR 727 HA TYR 727 -6.172 -9.070 2.390 527 HB2 TYR 727 HB2 TYR 727 -6.430 -8.080 -0.468 528 HB3 TYR 727 HB3 TYR 727 -5.177 -7.593 0.672 529 HD1 TYR 727 HD2 TYR 727 -6.634 -10.569 -1.063 530 HD2 TYR 727 HD1 TYR 727 -3.232 -8.914 0.975 531 HE1 TYR 727 HE2 TYR 727 -5.290 -12.561 -1.683 532 HE2 TYR 727 HE1 TYR 727 -1.895 -10.907 0.351 533 HH TYR 727 HH TYR 727 -3.102 -13.716 -0.554 534 H ARG 728 H ARG 728 -6.365 -7.139 3.503 535 HA ARG 728 HA ARG 728 -8.222 -5.113 2.555 536 HB2 ARG 728 HB2 ARG 728 -9.300 -5.170 4.949 537 HB3 ARG 728 HB3 ARG 728 -9.894 -6.211 3.658 538 HG2 ARG 728 HG2 ARG 728 -9.011 -8.129 4.595 539 HG3 ARG 728 HG3 ARG 728 -7.668 -7.270 5.342 540 HD2 ARG 728 HD2 ARG 728 -8.898 -6.672 7.208 541 HD3 ARG 728 HD3 ARG 728 -10.428 -6.686 6.342 542 HE ARG 728 HE ARG 728 -9.121 -8.969 7.595 543 HH11 ARG 728 HH21 ARG 728 -11.540 -7.828 5.384 544 HH12 ARG 728 HH22 ARG 728 -12.392 -9.343 5.379 545 HH21 ARG 728 HH11 ARG 728 -10.256 -10.901 7.563 546 HH22 ARG 728 HH12 ARG 728 -11.678 -11.080 6.568 547 H ILE 729 H ILE 729 -7.622 -3.155 3.098 548 HA ILE 729 HA ILE 729 -5.251 -2.734 4.699 549 HB ILE 729 HB ILE 729 -6.119 -0.239 4.214 550 HG12 ILE 729 HG12 ILE 729 -8.232 -1.332 3.210 551 HG13 ILE 729 HG13 ILE 729 -7.463 -0.034 2.299 552 HG21 ILE 729 HG21 ILE 729 -4.007 -1.385 3.425 553 HG22 ILE 729 HG22 ILE 729 -4.901 -1.888 1.997 554 HG23 ILE 729 HG23 ILE 729 -4.672 -0.176 2.334 555 HD11 ILE 729 HD11 ILE 729 -8.123 -2.495 1.282 556 HD12 ILE 729 HD12 ILE 729 -6.912 -1.417 0.591 557 HD13 ILE 729 HD13 ILE 729 -6.420 -2.718 1.673 558 H THR 730 H THR 730 -8.412 -3.204 5.395 559 HA THR 730 HA THR 730 -8.132 -2.009 8.026 560 HB THR 730 HB THR 730 -9.112 -0.314 6.318 561 HG1 THR 730 HG1 THR 730 -10.150 -0.987 8.877 562 HG21 THR 730 HG21 THR 730 -11.469 -0.480 5.890 563 HG22 THR 730 HG22 THR 730 -10.708 -1.978 5.356 564 HG23 THR 730 HG23 THR 730 -11.600 -1.932 6.873 565 H GLU 731 H GLU 731 -9.238 -3.090 9.534 566 HA GLU 731 HA GLU 731 -10.012 -5.716 9.213 567 HB2 GLU 731 HB2 GLU 731 -11.027 -5.471 11.433 568 HB3 GLU 731 HB3 GLU 731 -9.504 -4.574 11.363 569 HG2 GLU 731 HG2 GLU 731 -12.110 -3.209 10.710 570 HG3 GLU 731 HG3 GLU 731 -11.582 -3.378 12.375 571 H LYS 732 H LYS 732 -11.701 -2.899 8.325 572 HA LYS 732 HA LYS 732 -14.326 -4.132 8.410 573 HB2 LYS 732 HB2 LYS 732 -13.679 -1.401 7.350 574 HB3 LYS 732 HB3 LYS 732 -15.199 -1.993 8.028 575 HG2 LYS 732 HG2 LYS 732 -13.971 -2.392 10.202 576 HG3 LYS 732 HG3 LYS 732 -12.592 -1.558 9.498 577 HD2 LYS 732 HD2 LYS 732 -15.079 -0.056 9.169 578 HD3 LYS 732 HD3 LYS 732 -14.677 -0.346 10.863 579 HE2 LYS 732 HE2 LYS 732 -12.238 0.307 9.673 580 HE3 LYS 732 HE3 LYS 732 -13.395 1.430 8.954 581 HZ1 LYS 732 HZ1 LYS 732 -14.221 1.860 11.276 582 HZ2 LYS 732 HZ2 LYS 732 -12.855 0.971 11.842 583 HZ3 LYS 732 HZ3 LYS 732 -12.611 2.425 10.953 584 H LYS 733 H LYS 733 -11.871 -4.296 6.145 585 HA LYS 733 HA LYS 733 -13.866 -4.583 3.959 586 HB2 LYS 733 HB2 LYS 733 -11.910 -2.643 4.031 587 HB3 LYS 733 HB3 LYS 733 -11.184 -3.900 3.032 588 HG2 LYS 733 HG2 LYS 733 -12.413 -2.545 1.507 589 HG3 LYS 733 HG3 LYS 733 -13.428 -3.963 1.768 590 HD2 LYS 733 HD2 LYS 733 -14.851 -2.016 1.919 591 HD3 LYS 733 HD3 LYS 733 -14.653 -2.648 3.555 592 HE2 LYS 733 HE2 LYS 733 -13.135 -0.940 4.156 593 HE3 LYS 733 HE3 LYS 733 -12.817 -0.517 2.475 594 HZ1 LYS 733 HZ1 LYS 733 -14.298 1.041 3.735 595 HZ2 LYS 733 HZ2 LYS 733 -14.924 0.470 2.233 596 HZ3 LYS 733 HZ3 LYS 733 -15.487 -0.195 3.715 597 H ALA 734 H ALA 734 -12.524 -5.637 1.978 598 HA ALA 734 HA ALA 734 -10.643 -7.659 2.560 599 HB1 ALA 734 HB1 ALA 734 -11.863 -9.559 2.966 600 HB2 ALA 734 HB2 ALA 734 -13.272 -8.969 2.083 601 HB3 ALA 734 HB3 ALA 734 -12.944 -8.381 3.710 602 H PHE 735 H PHE 735 -9.692 -8.129 0.676 603 HA PHE 735 HA PHE 735 -11.327 -8.137 -1.802 604 HB2 PHE 735 HB2 PHE 735 -8.659 -6.829 -1.294 605 HB3 PHE 735 HB3 PHE 735 -9.133 -7.321 -2.928 606 HD1 PHE 735 HD2 PHE 735 -10.309 -5.336 0.032 607 HD2 PHE 735 HD1 PHE 735 -10.551 -5.954 -4.210 608 HE1 PHE 735 HE2 PHE 735 -11.691 -3.286 -0.187 609 HE2 PHE 735 HE1 PHE 735 -11.927 -3.907 -4.434 610 HZ PHE 735 HZ PHE 735 -12.505 -2.577 -2.417 611 H ARG 736 H ARG 736 -10.534 -9.553 -3.480 612 HA ARG 736 HA ARG 736 -9.578 -12.051 -2.506 613 HB2 ARG 736 HB2 ARG 736 -9.645 -11.110 -5.368 614 HB3 ARG 736 HB3 ARG 736 -9.654 -12.775 -4.790 615 HG2 ARG 736 HG2 ARG 736 -11.827 -12.246 -3.593 616 HG3 ARG 736 HG3 ARG 736 -11.841 -10.704 -4.457 617 HD2 ARG 736 HD2 ARG 736 -11.930 -13.484 -5.623 618 HD3 ARG 736 HD3 ARG 736 -13.128 -12.198 -5.802 619 HE ARG 736 HE ARG 736 -11.001 -10.994 -6.901 620 HH11 ARG 736 HH21 ARG 736 -12.253 -14.202 -7.306 621 HH12 ARG 736 HH22 ARG 736 -11.490 -14.444 -8.836 622 HH21 ARG 736 HH11 ARG 736 -9.959 -11.327 -8.837 623 HH22 ARG 736 HH12 ARG 736 -10.204 -12.819 -9.711 624 H GLY 737 H GLY 737 -7.994 -9.232 -3.771 625 HA2 GLY 737 HA2 GLY 737 -5.404 -10.211 -3.075 626 HA3 GLY 737 HA3 GLY 737 -5.643 -10.233 -4.817 627 H LEU 738 H LEU 738 -3.760 -8.643 -3.349 628 HA LEU 738 HA LEU 738 -4.332 -6.036 -2.792 629 HB2 LEU 738 HB2 LEU 738 -2.015 -7.480 -3.897 630 HB3 LEU 738 HB3 LEU 738 -2.062 -5.779 -4.347 631 HG LEU 738 HG LEU 738 -0.822 -6.109 -2.253 632 HD11 LEU 738 HD11 LEU 738 -2.556 -4.155 -2.764 633 HD12 LEU 738 HD12 LEU 738 -3.344 -4.823 -1.335 634 HD13 LEU 738 HD13 LEU 738 -1.680 -4.244 -1.239 635 HD21 LEU 738 HD21 LEU 738 -1.805 -7.038 -0.301 636 HD22 LEU 738 HD22 LEU 738 -3.423 -6.994 -1.002 637 HD23 LEU 738 HD23 LEU 738 -2.230 -8.148 -1.604 638 H THR 739 H THR 739 -3.678 -7.371 -5.998 639 HA THR 739 HA THR 739 -4.000 -5.118 -7.560 640 HB THR 739 HB THR 739 -5.023 -7.793 -8.460 641 HG1 THR 739 HG1 THR 739 -2.301 -7.195 -8.514 642 HG21 THR 739 HG21 THR 739 -3.646 -5.413 -9.672 643 HG22 THR 739 HG22 THR 739 -3.485 -6.997 -10.429 644 HG23 THR 739 HG23 THR 739 -5.080 -6.273 -10.233 645 H GLU 740 H GLU 740 -6.544 -7.260 -6.290 646 HA GLU 740 HA GLU 740 -8.614 -5.905 -7.770 647 HB2 GLU 740 HB2 GLU 740 -9.206 -7.454 -5.269 648 HB3 GLU 740 HB3 GLU 740 -10.117 -7.377 -6.773 649 HG2 GLU 740 HG2 GLU 740 -7.671 -8.483 -7.519 650 HG3 GLU 740 HG3 GLU 740 -8.011 -9.233 -5.972 651 H LEU 741 H LEU 741 -6.962 -5.472 -4.792 652 HA LEU 741 HA LEU 741 -8.969 -3.725 -3.625 653 HB2 LEU 741 HB2 LEU 741 -7.725 -5.198 -2.162 654 HB3 LEU 741 HB3 LEU 741 -6.190 -4.610 -2.786 655 HG LEU 741 HG LEU 741 -7.083 -3.715 -0.498 656 HD11 LEU 741 HD11 LEU 741 -6.381 -1.371 -2.127 657 HD12 LEU 741 HD12 LEU 741 -5.497 -2.128 -0.804 658 HD13 LEU 741 HD13 LEU 741 -5.344 -2.763 -2.443 659 HD21 LEU 741 HD21 LEU 741 -9.300 -3.066 -1.876 660 HD22 LEU 741 HD22 LEU 741 -8.746 -2.108 -0.511 661 HD23 LEU 741 HD23 LEU 741 -8.386 -1.587 -2.152 662 H VAL 742 H VAL 742 -5.689 -3.532 -4.846 663 HA VAL 742 HA VAL 742 -5.324 -0.730 -4.627 664 HB VAL 742 HB VAL 742 -4.080 -2.847 -6.385 665 HG11 VAL 742 HG11 VAL 742 -2.185 -1.037 -6.388 666 HG12 VAL 742 HG12 VAL 742 -3.524 -0.909 -7.532 667 HG13 VAL 742 HG13 VAL 742 -3.511 0.081 -6.070 668 HG21 VAL 742 HG21 VAL 742 -3.794 -3.181 -3.983 669 HG22 VAL 742 HG22 VAL 742 -2.261 -2.706 -4.720 670 HG23 VAL 742 HG23 VAL 742 -3.200 -1.526 -3.805 671 H GLU 743 H GLU 743 -5.966 -2.742 -7.454 672 HA GLU 743 HA GLU 743 -6.253 -0.595 -9.253 673 HB2 GLU 743 HB2 GLU 743 -7.395 -3.371 -9.526 674 HB3 GLU 743 HB3 GLU 743 -6.966 -2.255 -10.831 675 HG2 GLU 743 HG2 GLU 743 -4.917 -3.173 -8.801 676 HG3 GLU 743 HG3 GLU 743 -5.262 -4.117 -10.234 677 H PHE 744 H PHE 744 -8.479 -2.087 -7.053 678 HA PHE 744 HA PHE 744 -10.859 -1.076 -8.345 679 HB2 PHE 744 HB2 PHE 744 -11.066 -3.040 -6.972 680 HB3 PHE 744 HB3 PHE 744 -10.335 -2.222 -5.594 681 HD1 PHE 744 HD1 PHE 744 -13.169 -1.680 -8.007 682 HD2 PHE 744 HD2 PHE 744 -11.765 -1.428 -3.962 683 HE1 PHE 744 HE1 PHE 744 -15.402 -0.877 -7.284 684 HE2 PHE 744 HE2 PHE 744 -13.996 -0.622 -3.231 685 HZ PHE 744 HZ PHE 744 -15.816 -0.347 -4.896 686 H TYR 745 H TYR 745 -8.706 -0.053 -5.743 687 HA TYR 745 HA TYR 745 -10.345 2.162 -4.942 688 HB2 TYR 745 HB2 TYR 745 -7.526 1.313 -4.345 689 HB3 TYR 745 HB3 TYR 745 -8.154 2.866 -3.799 690 HD1 TYR 745 HD2 TYR 745 -10.885 0.656 -4.034 691 HD2 TYR 745 HD1 TYR 745 -7.495 1.546 -1.551 692 HE1 TYR 745 HE2 TYR 745 -12.003 -0.430 -2.118 693 HE2 TYR 745 HE1 TYR 745 -8.625 0.449 0.365 694 HH TYR 745 HH TYR 745 -11.911 -0.240 0.384 695 H GLN 746 H GLN 746 -8.380 1.649 -7.627 696 HA GLN 746 HA GLN 746 -7.192 4.141 -8.095 697 HB2 GLN 746 HB2 GLN 746 -8.375 2.069 -9.942 698 HB3 GLN 746 HB3 GLN 746 -7.666 3.560 -10.568 699 HG2 GLN 746 HG2 GLN 746 -5.521 3.041 -9.662 700 HG3 GLN 746 HG3 GLN 746 -6.179 1.758 -8.646 701 HE21 GLN 746 HE21 GLN 746 -4.300 0.605 -9.933 702 HE22 GLN 746 HE22 GLN 746 -4.773 -0.176 -11.368 703 H GLN 747 H GLN 747 -10.501 3.063 -8.415 704 HA GLN 747 HA GLN 747 -11.340 5.795 -9.193 705 HB2 GLN 747 HB2 GLN 747 -12.866 3.196 -9.511 706 HB3 GLN 747 HB3 GLN 747 -13.357 4.784 -10.106 707 HG2 GLN 747 HG2 GLN 747 -10.773 3.434 -10.937 708 HG3 GLN 747 HG3 GLN 747 -12.275 3.273 -11.841 709 HE21 GLN 747 HE21 GLN 747 -9.720 5.552 -10.932 710 HE22 GLN 747 HE22 GLN 747 -10.172 6.752 -12.044 711 H ASN 748 H ASN 748 -11.585 3.249 -6.859 712 HA ASN 748 HA ASN 748 -13.755 4.598 -5.402 713 HB2 ASN 748 HB2 ASN 748 -14.075 2.241 -5.590 714 HB3 ASN 748 HB3 ASN 748 -12.412 1.905 -5.122 715 HD21 ASN 748 HD21 ASN 748 -11.858 2.805 -2.804 716 HD22 ASN 748 HD22 ASN 748 -13.067 2.583 -1.632 717 H SER 749 H SER 749 -12.994 6.292 -4.260 718 HA SER 749 HA SER 749 -10.549 6.941 -3.372 719 HB2 SER 749 HB2 SER 749 -12.990 7.971 -3.015 720 HB3 SER 749 HB3 SER 749 -12.714 7.348 -1.397 721 HG SER 749 HG SER 749 -10.465 8.504 -2.159 722 H LEU 750 H LEU 750 -9.138 6.442 -1.782 723 HA LEU 750 HA LEU 750 -9.177 3.858 -0.641 724 HB2 LEU 750 HB2 LEU 750 -7.547 6.313 -0.034 725 HB3 LEU 750 HB3 LEU 750 -7.278 4.771 0.771 726 HG LEU 750 HG LEU 750 -7.490 4.260 -2.029 727 HD11 LEU 750 HD11 LEU 750 -6.512 6.015 -3.018 728 HD12 LEU 750 HD12 LEU 750 -6.424 6.845 -1.472 729 HD13 LEU 750 HD13 LEU 750 -5.095 5.812 -1.991 730 HD21 LEU 750 HD21 LEU 750 -5.242 4.198 -0.004 731 HD22 LEU 750 HD22 LEU 750 -6.244 2.850 -0.540 732 HD23 LEU 750 HD23 LEU 750 -5.073 3.573 -1.643 733 H LYS 751 H LYS 751 -10.214 6.967 0.607 734 HA LYS 751 HA LYS 751 -10.331 6.512 3.303 735 HB2 LYS 751 HB2 LYS 751 -12.290 8.032 3.354 736 HB3 LYS 751 HB3 LYS 751 -10.945 8.638 2.405 737 HG2 LYS 751 HG2 LYS 751 -12.316 7.354 0.462 738 HG3 LYS 751 HG3 LYS 751 -13.653 7.831 1.518 739 HD2 LYS 751 HD2 LYS 751 -12.699 10.143 1.591 740 HD3 LYS 751 HD3 LYS 751 -11.489 9.636 0.423 741 HE2 LYS 751 HE2 LYS 751 -13.858 8.883 -0.781 742 HE3 LYS 751 HE3 LYS 751 -14.255 10.427 -0.013 743 HZ1 LYS 751 HZ1 LYS 751 -12.072 11.271 -0.925 744 HZ2 LYS 751 HZ2 LYS 751 -12.031 9.830 -1.895 745 HZ3 LYS 751 HZ3 LYS 751 -13.303 10.968 -2.093 746 H ASP 752 H ASP 752 -11.978 4.855 0.838 747 HA ASP 752 HA ASP 752 -14.283 3.896 2.176 748 HB2 ASP 752 HB2 ASP 752 -14.246 3.310 -0.078 749 HB3 ASP 752 HB3 ASP 752 -12.536 2.889 -0.044 750 H CYS 753 H CYS 753 -10.921 2.875 2.160 751 HA CYS 753 HA CYS 753 -11.431 0.993 4.408 752 HB2 CYS 753 HB2 CYS 753 -9.562 0.957 2.096 753 HB3 CYS 753 HB3 CYS 753 -8.946 0.370 3.632 754 HG CYS 753 HG CYS 753 -10.823 -1.156 1.861 755 H PHE 754 H PHE 754 -9.215 3.369 3.019 756 HA PHE 754 HA PHE 754 -7.548 3.533 5.307 757 HB2 PHE 754 HB2 PHE 754 -7.972 5.268 2.898 758 HB3 PHE 754 HB3 PHE 754 -6.898 5.751 4.208 759 HD1 PHE 754 HD2 PHE 754 -7.627 2.759 2.062 760 HD2 PHE 754 HD1 PHE 754 -4.667 5.097 4.115 761 HE1 PHE 754 HE2 PHE 754 -5.840 1.306 1.143 762 HE2 PHE 754 HE1 PHE 754 -2.881 3.652 3.188 763 HZ PHE 754 HZ PHE 754 -3.469 1.757 1.705 764 H LYS 755 H LYS 755 -7.469 5.278 6.864 765 HA LYS 755 HA LYS 755 -10.124 6.185 7.578 766 HB2 LYS 755 HB2 LYS 755 -7.791 7.014 9.205 767 HB3 LYS 755 HB3 LYS 755 -9.344 6.343 9.702 768 HG2 LYS 755 HG2 LYS 755 -6.996 4.831 8.524 769 HG3 LYS 755 HG3 LYS 755 -7.649 4.678 10.148 770 HD2 LYS 755 HD2 LYS 755 -9.804 3.863 9.130 771 HD3 LYS 755 HD3 LYS 755 -9.003 3.861 7.565 772 HE2 LYS 755 HE2 LYS 755 -7.184 2.453 8.983 773 HE3 LYS 755 HE3 LYS 755 -8.658 2.009 9.853 774 HZ1 LYS 755 HZ1 LYS 755 -9.116 1.973 7.031 775 HZ2 LYS 755 HZ2 LYS 755 -7.778 0.986 7.437 776 HZ3 LYS 755 HZ3 LYS 755 -9.297 0.693 8.174 777 H SER 756 H SER 756 -7.011 7.972 7.472 778 HA SER 756 HA SER 756 -8.502 10.443 7.029 779 HB2 SER 756 HB2 SER 756 -5.504 10.250 7.134 780 HB3 SER 756 HB3 SER 756 -6.542 11.597 7.592 781 HG SER 756 HG SER 756 -5.729 9.425 9.041 782 H LEU 757 H LEU 757 -6.841 8.097 5.233 783 HA LEU 757 HA LEU 757 -5.843 9.563 3.041 784 HB2 LEU 757 HB2 LEU 757 -5.659 7.024 3.765 785 HB3 LEU 757 HB3 LEU 757 -7.039 6.857 2.689 786 HG LEU 757 HG LEU 757 -5.149 6.445 1.341 787 HD11 LEU 757 HD11 LEU 757 -6.802 8.027 0.373 788 HD12 LEU 757 HD12 LEU 757 -5.807 9.359 0.953 789 HD13 LEU 757 HD13 LEU 757 -5.170 8.252 -0.256 790 HD21 LEU 757 HD21 LEU 757 -3.179 7.850 1.334 791 HD22 LEU 757 HD22 LEU 757 -3.949 8.988 2.436 792 HD23 LEU 757 HD23 LEU 757 -3.531 7.364 2.997 793 H ASP 758 H ASP 758 -7.180 11.018 2.004 794 HA ASP 758 HA ASP 758 -9.792 9.957 1.127 795 HB2 ASP 758 HB2 ASP 758 -9.799 11.953 2.727 796 HB3 ASP 758 HB3 ASP 758 -9.167 12.898 1.380 797 H THR 759 H THR 759 -8.506 9.025 -0.625 798 HA THR 759 HA THR 759 -8.835 10.591 -2.977 799 HB THR 759 HB THR 759 -6.649 11.537 -2.233 800 HG1 THR 759 HG1 THR 759 -6.053 11.577 -4.274 801 HG21 THR 759 HG21 THR 759 -6.028 8.692 -2.000 802 HG22 THR 759 HG22 THR 759 -4.853 9.552 -2.985 803 HG23 THR 759 HG23 THR 759 -5.172 10.079 -1.335 804 H THR 760 H THR 760 -7.237 9.254 -4.757 805 HA THR 760 HA THR 760 -8.030 6.417 -4.385 806 HB THR 760 HB THR 760 -8.396 6.388 -6.894 807 HG1 THR 760 HG1 THR 760 -8.942 8.570 -7.672 808 HG21 THR 760 HG21 THR 760 -10.130 8.127 -5.130 809 HG22 THR 760 HG22 THR 760 -10.632 7.508 -6.704 810 HG23 THR 760 HG23 THR 760 -10.280 6.388 -5.387 811 H LEU 761 H LEU 761 -6.852 5.019 -6.119 812 HA LEU 761 HA LEU 761 -4.032 5.381 -5.685 813 HB2 LEU 761 HB2 LEU 761 -5.653 3.375 -7.265 814 HB3 LEU 761 HB3 LEU 761 -3.895 3.351 -7.245 815 HG LEU 761 HG LEU 761 -5.024 1.839 -5.535 816 HD11 LEU 761 HD11 LEU 761 -2.966 3.910 -4.973 817 HD12 LEU 761 HD12 LEU 761 -3.580 2.997 -3.598 818 HD13 LEU 761 HD13 LEU 761 -2.833 2.151 -4.951 819 HD21 LEU 761 HD21 LEU 761 -6.788 3.590 -4.979 820 HD22 LEU 761 HD22 LEU 761 -6.027 2.807 -3.596 821 HD23 LEU 761 HD23 LEU 761 -5.535 4.432 -4.069 822 H GLN 762 H GLN 762 -3.718 7.440 -6.623 823 HA GLN 762 HA GLN 762 -4.345 8.240 -9.213 824 HB2 GLN 762 HB2 GLN 762 -1.897 8.985 -7.597 825 HB3 GLN 762 HB3 GLN 762 -2.601 9.919 -8.912 826 HG2 GLN 762 HG2 GLN 762 -3.685 9.437 -6.148 827 HG3 GLN 762 HG3 GLN 762 -3.477 10.958 -6.999 828 HE21 GLN 762 HE21 GLN 762 -5.733 8.596 -6.165 829 HE22 GLN 762 HE22 GLN 762 -6.982 9.040 -7.238 830 H PHE 763 H PHE 763 -1.104 7.226 -8.150 831 HA PHE 763 HA PHE 763 -0.763 5.574 -10.499 832 HB2 PHE 763 HB2 PHE 763 1.501 7.209 -10.723 833 HB3 PHE 763 HB3 PHE 763 0.141 7.123 -11.840 834 HD1 PHE 763 HD1 PHE 763 1.431 8.874 -8.815 835 HD2 PHE 763 HD2 PHE 763 -1.421 8.914 -12.027 836 HE1 PHE 763 HE1 PHE 763 0.805 11.200 -8.228 837 HE2 PHE 763 HE2 PHE 763 -2.046 11.241 -11.442 838 HZ PHE 763 HZ PHE 763 -0.934 12.385 -9.543 839 HA PRO 764 HA PRO 764 2.031 3.494 -7.832 840 HB2 PRO 764 HB2 PRO 764 3.570 2.195 -9.688 841 HB3 PRO 764 HB3 PRO 764 1.906 1.718 -9.295 842 HG2 PRO 764 HG2 PRO 764 2.936 3.270 -11.610 843 HG3 PRO 764 HG3 PRO 764 1.638 2.066 -11.540 844 HD2 PRO 764 HD2 PRO 764 1.186 4.775 -11.618 845 HD3 PRO 764 HD3 PRO 764 0.059 3.610 -10.894 846 H PHE 765 H PHE 765 4.049 3.741 -6.904 847 HA PHE 765 HA PHE 765 5.543 6.070 -7.440 848 HB2 PHE 765 HB2 PHE 765 6.933 5.389 -5.701 849 HB3 PHE 765 HB3 PHE 765 5.444 4.522 -5.332 850 HD1 PHE 765 HD1 PHE 765 5.210 2.114 -6.308 851 HD2 PHE 765 HD2 PHE 765 8.944 4.202 -5.972 852 HE1 PHE 765 HE1 PHE 765 6.418 -0.037 -6.424 853 HE2 PHE 765 HE2 PHE 765 10.161 2.042 -6.096 854 HZ PHE 765 HZ PHE 765 8.896 -0.080 -6.311 855 H LYS 766 H LYS 766 5.722 2.861 -8.748 856 HA LYS 766 HA LYS 766 8.375 2.965 -9.778 857 HB2 LYS 766 HB2 LYS 766 5.968 1.251 -10.298 858 HB3 LYS 766 HB3 LYS 766 7.406 1.100 -11.312 859 HG2 LYS 766 HG2 LYS 766 8.166 1.202 -8.517 860 HG3 LYS 766 HG3 LYS 766 6.987 -0.078 -8.776 861 HD2 LYS 766 HD2 LYS 766 9.131 -1.062 -9.154 862 HD3 LYS 766 HD3 LYS 766 8.410 -0.836 -10.746 863 HE2 LYS 766 HE2 LYS 766 10.630 -0.022 -10.957 864 HE3 LYS 766 HE3 LYS 766 9.618 1.417 -10.814 865 HZ1 LYS 766 HZ1 LYS 766 10.323 0.531 -8.236 866 HZ2 LYS 766 HZ2 LYS 766 11.737 0.649 -9.168 867 HZ3 LYS 766 HZ3 LYS 766 10.718 1.992 -8.996 868 H GLU 767 H GLU 767 5.398 4.343 -10.847 869 HA GLU 767 HA GLU 767 5.942 4.430 -13.621 870 HB2 GLU 767 HB2 GLU 767 3.959 5.483 -11.789 871 HB3 GLU 767 HB3 GLU 767 4.411 6.702 -12.978 872 HG2 GLU 767 HG2 GLU 767 3.998 5.094 -14.788 873 HG3 GLU 767 HG3 GLU 767 3.564 3.866 -13.614 874 H1 ASP 338 H1 ASP 338 16.480 3.592 11.195 875 H2 ASP 338 H2 ASP 338 14.942 4.329 11.297 876 H3 ASP 338 H3 ASP 338 16.341 5.220 11.677 877 HA ASP 338 HA ASP 338 15.841 5.958 9.553 878 HB2 ASP 338 HB2 ASP 338 17.518 4.650 8.072 879 HB3 ASP 338 HB3 ASP 338 18.148 5.433 9.517 880 H THR 339 H THR 339 15.999 2.387 9.246 881 HA THR 339 HA THR 339 14.260 2.346 6.973 882 HB THR 339 HB THR 339 14.419 -0.013 7.046 883 HG1 THR 339 HG1 THR 339 13.821 0.002 9.364 884 HG21 THR 339 HG21 THR 339 16.864 1.436 7.973 885 HG22 THR 339 HG22 THR 339 16.909 -0.323 7.926 886 HG23 THR 339 HG23 THR 339 16.568 0.591 6.456 887 H GLU 340 H GLU 340 12.681 3.797 8.148 888 HA GLU 340 HA GLU 340 11.032 2.943 10.231 889 HB2 GLU 340 HB2 GLU 340 11.155 5.156 8.618 890 HB3 GLU 340 HB3 GLU 340 9.654 4.410 8.078 891 HG2 GLU 340 HG2 GLU 340 10.361 5.066 10.956 892 HG3 GLU 340 HG3 GLU 340 9.251 5.982 9.942 893 H VAL 341 H VAL 341 8.914 2.006 10.239 894 HA VAL 341 HA VAL 341 8.299 0.342 7.858 895 HB VAL 341 HB VAL 341 9.353 -0.999 9.669 896 HG11 VAL 341 HG11 VAL 341 7.135 0.257 11.230 897 HG12 VAL 341 HG12 VAL 341 7.561 -1.410 11.607 898 HG13 VAL 341 HG13 VAL 341 8.777 -0.139 11.731 899 HG21 VAL 341 HG21 VAL 341 6.469 -1.819 9.572 900 HG22 VAL 341 HG22 VAL 341 7.384 -1.745 8.067 901 HG23 VAL 341 HG23 VAL 341 7.917 -2.804 9.373 902 H TYR 342 H TYR 342 6.119 -0.059 7.428 903 HA TYR 342 HA TYR 342 4.314 2.022 8.089 904 HB2 TYR 342 HB2 TYR 342 2.618 0.345 7.030 905 HB3 TYR 342 HB3 TYR 342 3.877 1.056 6.028 906 HD1 TYR 342 HD2 TYR 342 4.576 -1.594 8.548 907 HD2 TYR 342 HD1 TYR 342 3.923 -0.706 4.396 908 HE1 TYR 342 HE2 TYR 342 5.392 -3.850 7.933 909 HE2 TYR 342 HE1 TYR 342 4.721 -2.958 3.792 910 HH TYR 342 HH TYR 342 4.831 -5.438 5.537 911 H GLU 343 H GLU 343 4.692 1.740 10.488 912 HA GLU 343 HA GLU 343 3.848 -0.272 12.116 913 HB2 GLU 343 HB2 GLU 343 4.811 1.775 12.973 914 HB3 GLU 343 HB3 GLU 343 3.399 2.699 12.469 915 HG2 GLU 343 HG2 GLU 343 2.883 0.356 14.235 916 HG3 GLU 343 HG3 GLU 343 3.704 1.724 14.976 917 H SER 344 H SER 344 1.540 2.422 11.959 918 HA SER 344 HA SER 344 -0.614 1.045 10.764 919 HB2 SER 344 HB2 SER 344 -0.066 -0.187 13.098 920 HB3 SER 344 HB3 SER 344 -1.139 1.075 13.688 921 HG SER 344 HG SER 344 -2.761 0.259 12.529 922 HA PRO 345 HA PRO 345 -1.058 5.690 11.299 923 HB2 PRO 345 HB2 PRO 345 -3.004 4.835 9.144 924 HB3 PRO 345 HB3 PRO 345 -2.023 6.311 9.228 925 HG2 PRO 345 HG2 PRO 345 -1.305 4.252 7.711 926 HG3 PRO 345 HG3 PRO 345 -0.108 5.231 8.574 927 HD2 PRO 345 HD2 PRO 345 -0.959 2.439 9.105 928 HD3 PRO 345 HD3 PRO 345 0.545 3.267 9.563 929 H PTR 346 H PTR 346 -3.559 3.170 10.945 930 HA PTR 346 HA PTR 346 -4.738 3.649 13.460 931 HB2 PTR 346 HB2 PTR 346 -6.245 5.256 13.119 932 HB3 PTR 346 HB3 PTR 346 -6.989 4.295 11.850 933 HD1 PTR 346 HD1 PTR 346 -5.294 4.278 9.608 934 HD2 PTR 346 HD2 PTR 346 -5.795 7.421 12.483 935 HE1 PTR 346 HE1 PTR 346 -4.547 5.929 7.912 936 HE2 PTR 346 HE2 PTR 346 -5.048 9.079 10.807 937 H ALA 347 H ALA 347 -6.786 2.420 13.761 938 HA ALA 347 HA ALA 347 -7.489 0.372 11.809 939 HB1 ALA 347 HB1 ALA 347 -5.712 -0.176 14.135 940 HB2 ALA 347 HB2 ALA 347 -5.820 -0.996 12.577 941 HB3 ALA 347 HB3 ALA 347 -7.008 -1.335 13.835 942 H ASP 348 H ASP 348 -9.190 2.162 12.515 943 HA ASP 348 HA ASP 348 -10.608 1.868 14.940 944 HB2 ASP 348 HB2 ASP 348 -12.482 2.861 13.280 945 HB3 ASP 348 HB3 ASP 348 -11.173 3.840 13.933 946 HA PRO 349 HA PRO 349 -12.603 -1.965 13.618 947 HB2 PRO 349 HB2 PRO 349 -12.990 -3.004 16.072 948 HB3 PRO 349 HB3 PRO 349 -11.381 -2.949 15.324 949 HG2 PRO 349 HG2 PRO 349 -12.517 -1.276 17.488 950 HG3 PRO 349 HG3 PRO 349 -10.844 -1.783 17.208 951 HD2 PRO 349 HD2 PRO 349 -11.985 0.734 16.534 952 HD3 PRO 349 HD3 PRO 349 -10.381 0.132 16.061 953 H GLU 350 H GLU 350 -14.676 -1.905 12.946 954 HA GLU 350 HA GLU 350 -16.762 -0.956 14.822 955 HB2 GLU 350 HB2 GLU 350 -16.399 -0.430 11.887 956 HB3 GLU 350 HB3 GLU 350 -18.019 -0.459 12.577 957 HG2 GLU 350 HG2 GLU 350 -17.585 1.750 12.988 958 HG3 GLU 350 HG3 GLU 350 -16.762 1.107 14.405 Start of MODEL 7 1 H1 GLY 661 H1 GLY 661 2.505 -12.282 -11.441 2 H2 GLY 661 H2 GLY 661 2.421 -13.609 -10.367 3 H3 GLY 661 H3 GLY 661 1.115 -13.258 -11.410 4 HA2 GLY 661 HA2 GLY 661 2.294 -13.922 -13.324 5 HA3 GLY 661 HA3 GLY 661 3.813 -13.957 -12.431 6 H HIS 662 H HIS 662 4.261 -15.697 -11.032 7 HA HIS 662 HA HIS 662 2.910 -18.178 -11.708 8 HB2 HIS 662 HB2 HIS 662 5.391 -17.964 -11.460 9 HB3 HIS 662 HB3 HIS 662 5.155 -17.654 -9.743 10 HD1 HIS 662 HD1 HIS 662 2.732 -19.821 -9.565 11 HD2 HIS 662 HD2 HIS 662 6.619 -20.465 -10.959 12 HE1 HIS 662 HE1 HIS 662 3.204 -22.309 -9.297 13 HE2 HIS 662 HE2 HIS 662 5.567 -22.709 -10.142 14 H MET 663 H MET 663 2.864 -15.822 -9.189 15 HA MET 663 HA MET 663 0.637 -17.111 -7.903 16 HB2 MET 663 HB2 MET 663 3.112 -17.943 -7.019 17 HB3 MET 663 HB3 MET 663 2.716 -16.677 -5.869 18 HG2 MET 663 HG2 MET 663 0.444 -17.759 -5.606 19 HG3 MET 663 HG3 MET 663 1.057 -19.101 -6.571 20 HE1 MET 663 HE1 MET 663 -0.183 -19.500 -3.945 21 HE2 MET 663 HE2 MET 663 0.635 -20.875 -4.689 22 HE3 MET 663 HE3 MET 663 0.906 -20.495 -2.984 23 H GLN 664 H GLN 664 2.340 -15.240 -5.646 24 HA GLN 664 HA GLN 664 0.597 -12.966 -6.242 25 HB2 GLN 664 HB2 GLN 664 1.367 -14.203 -3.853 26 HB3 GLN 664 HB3 GLN 664 2.251 -12.678 -3.863 27 HG2 GLN 664 HG2 GLN 664 0.166 -12.141 -2.868 28 HG3 GLN 664 HG3 GLN 664 0.014 -11.587 -4.533 29 HE21 GLN 664 HE21 GLN 664 -1.562 -13.391 -2.160 30 HE22 GLN 664 HE22 GLN 664 -2.580 -14.295 -3.184 31 H ASP 665 H ASP 665 2.805 -13.485 -7.978 32 HA ASP 665 HA ASP 665 5.028 -11.803 -7.379 33 HB2 ASP 665 HB2 ASP 665 4.536 -12.073 -10.216 34 HB3 ASP 665 HB3 ASP 665 5.872 -12.676 -9.258 35 H LEU 666 H LEU 666 3.104 -10.250 -6.637 36 HA LEU 666 HA LEU 666 1.826 -8.550 -8.463 37 HB2 LEU 666 HB2 LEU 666 2.946 -7.810 -5.755 38 HB3 LEU 666 HB3 LEU 666 1.684 -6.945 -6.618 39 HG LEU 666 HG LEU 666 1.327 -9.870 -6.014 40 HD11 LEU 666 HD11 LEU 666 0.188 -9.162 -3.884 41 HD12 LEU 666 HD12 LEU 666 1.940 -8.968 -3.858 42 HD13 LEU 666 HD13 LEU 666 0.902 -7.565 -4.101 43 HD21 LEU 666 HD21 LEU 666 -0.473 -7.470 -6.406 44 HD22 LEU 666 HD22 LEU 666 -0.348 -8.902 -7.428 45 HD23 LEU 666 HD23 LEU 666 -1.069 -9.023 -5.825 46 H SER 667 H SER 667 5.134 -8.922 -7.753 47 HA SER 667 HA SER 667 6.318 -6.451 -8.074 48 HB2 SER 667 HB2 SER 667 7.175 -9.120 -8.127 49 HB3 SER 667 HB3 SER 667 7.713 -8.442 -9.655 50 HG SER 667 HG SER 667 9.008 -7.095 -8.612 51 H VAL 668 H VAL 668 4.559 -8.286 -10.387 52 HA VAL 668 HA VAL 668 5.601 -7.125 -12.755 53 HB VAL 668 HB VAL 668 3.552 -7.980 -13.817 54 HG11 VAL 668 HG11 VAL 668 3.762 -10.365 -12.482 55 HG12 VAL 668 HG12 VAL 668 4.883 -9.822 -13.730 56 HG13 VAL 668 HG13 VAL 668 5.270 -9.577 -12.026 57 HG21 VAL 668 HG21 VAL 668 1.902 -9.186 -12.316 58 HG22 VAL 668 HG22 VAL 668 2.698 -8.422 -10.940 59 HG23 VAL 668 HG23 VAL 668 1.888 -7.430 -12.152 60 H HIS 669 H HIS 669 3.708 -5.821 -10.240 61 HA HIS 669 HA HIS 669 2.431 -3.832 -11.979 62 HB2 HIS 669 HB2 HIS 669 2.230 -4.129 -8.981 63 HB3 HIS 669 HB3 HIS 669 1.217 -3.125 -10.021 64 HD1 HIS 669 HD1 HIS 669 0.156 -4.689 -12.147 65 HD2 HIS 669 HD2 HIS 669 1.001 -6.525 -8.503 66 HE1 HIS 669 HE1 HIS 669 -1.196 -6.832 -12.104 67 HE2 HIS 669 HE2 HIS 669 -0.738 -7.938 -9.861 68 H LEU 670 H LEU 670 2.977 -1.817 -12.156 69 HA LEU 670 HA LEU 670 5.515 -0.858 -11.546 70 HB2 LEU 670 HB2 LEU 670 4.035 -0.027 -13.350 71 HB3 LEU 670 HB3 LEU 670 2.992 0.708 -12.139 72 HG LEU 670 HG LEU 670 4.868 2.133 -11.389 73 HD11 LEU 670 HD11 LEU 670 6.777 0.734 -11.911 74 HD12 LEU 670 HD12 LEU 670 6.354 0.724 -13.624 75 HD13 LEU 670 HD13 LEU 670 6.909 2.220 -12.863 76 HD21 LEU 670 HD21 LEU 670 4.877 3.598 -13.286 77 HD22 LEU 670 HD22 LEU 670 4.576 2.264 -14.396 78 HD23 LEU 670 HD23 LEU 670 3.312 2.783 -13.283 79 H TRP 671 H TRP 671 2.648 -0.954 -9.535 80 HA TRP 671 HA TRP 671 3.776 1.084 -7.768 81 HB2 TRP 671 HB2 TRP 671 1.667 0.495 -6.371 82 HB3 TRP 671 HB3 TRP 671 1.503 1.451 -7.834 83 HD1 TRP 671 HD1 TRP 671 0.049 0.509 -9.738 84 HE1 TRP 671 HE1 TRP 671 -1.417 -1.625 -10.007 85 HE3 TRP 671 HE3 TRP 671 1.686 -2.181 -5.710 86 HZ2 TRP 671 HZ2 TRP 671 -1.776 -4.134 -8.699 87 HZ3 TRP 671 HZ3 TRP 671 0.770 -4.439 -5.251 88 HH2 TRP 671 HH2 TRP 671 -0.957 -5.416 -6.736 89 H TYR 672 H TYR 672 4.356 -2.088 -8.235 90 HA TYR 672 HA TYR 672 4.400 -2.906 -5.445 91 HB2 TYR 672 HB2 TYR 672 4.097 -4.377 -7.604 92 HB3 TYR 672 HB3 TYR 672 5.860 -4.386 -7.593 93 HD1 TYR 672 HD2 TYR 672 2.973 -4.811 -5.233 94 HD2 TYR 672 HD1 TYR 672 6.952 -6.013 -6.322 95 HE1 TYR 672 HE2 TYR 672 2.938 -6.551 -3.451 96 HE2 TYR 672 HE1 TYR 672 6.919 -7.747 -4.554 97 HH TYR 672 HH TYR 672 5.757 -8.188 -2.424 98 H ALA 673 H ALA 673 5.878 -2.142 -4.101 99 HA ALA 673 HA ALA 673 8.535 -1.370 -5.105 100 HB1 ALA 673 HB1 ALA 673 7.581 -1.054 -2.272 101 HB2 ALA 673 HB2 ALA 673 7.030 0.049 -3.531 102 HB3 ALA 673 HB3 ALA 673 8.748 -0.078 -3.165 103 H GLY 674 H GLY 674 7.067 -4.065 -4.066 104 HA2 GLY 674 HA2 GLY 674 7.661 -5.984 -2.890 105 HA3 GLY 674 HA3 GLY 674 9.041 -5.845 -3.959 106 HA PRO 675 HA PRO 675 11.502 -5.982 -0.304 107 HB2 PRO 675 HB2 PRO 675 13.837 -4.977 -1.367 108 HB3 PRO 675 HB3 PRO 675 13.270 -6.642 -1.593 109 HG2 PRO 675 HG2 PRO 675 13.071 -4.309 -3.431 110 HG3 PRO 675 HG3 PRO 675 13.407 -6.009 -3.794 111 HD2 PRO 675 HD2 PRO 675 10.961 -4.892 -4.207 112 HD3 PRO 675 HD3 PRO 675 11.163 -6.602 -3.767 113 H MET 676 H MET 676 10.723 -3.023 -1.894 114 HA MET 676 HA MET 676 12.254 -1.181 -0.423 115 HB2 MET 676 HB2 MET 676 10.798 -0.633 -2.387 116 HB3 MET 676 HB3 MET 676 9.398 -0.796 -1.327 117 HG2 MET 676 HG2 MET 676 10.202 1.582 -1.582 118 HG3 MET 676 HG3 MET 676 10.163 1.016 0.083 119 HE1 MET 676 HE1 MET 676 11.842 2.110 -2.877 120 HE2 MET 676 HE2 MET 676 13.543 2.368 -2.506 121 HE3 MET 676 HE3 MET 676 12.972 0.766 -2.996 122 H GLU 677 H GLU 677 11.613 0.173 1.372 123 HA GLU 677 HA GLU 677 9.961 -1.281 3.351 124 HB2 GLU 677 HB2 GLU 677 11.314 -0.055 5.045 125 HB3 GLU 677 HB3 GLU 677 12.286 -1.112 4.021 126 HG2 GLU 677 HG2 GLU 677 13.397 0.624 3.062 127 HG3 GLU 677 HG3 GLU 677 11.945 1.610 2.945 128 H ARG 678 H ARG 678 8.993 0.224 5.055 129 HA ARG 678 HA ARG 678 7.164 1.978 3.852 130 HB2 ARG 678 HB2 ARG 678 7.020 0.862 6.160 131 HB3 ARG 678 HB3 ARG 678 8.002 2.209 6.739 132 HG2 ARG 678 HG2 ARG 678 6.106 3.528 5.268 133 HG3 ARG 678 HG3 ARG 678 5.171 2.173 5.890 134 HD2 ARG 678 HD2 ARG 678 4.920 3.618 7.664 135 HD3 ARG 678 HD3 ARG 678 6.428 2.846 8.153 136 HE ARG 678 HE ARG 678 6.841 5.166 6.486 137 HH11 ARG 678 HH21 ARG 678 6.060 4.123 9.696 138 HH12 ARG 678 HH22 ARG 678 6.958 5.416 10.446 139 HH21 ARG 678 HH11 ARG 678 7.918 6.880 7.466 140 HH22 ARG 678 HH12 ARG 678 8.009 6.925 9.226 141 H ALA 679 H ALA 679 9.785 2.944 6.093 142 HA ALA 679 HA ALA 679 9.688 5.677 5.647 143 HB1 ALA 679 HB1 ALA 679 11.207 4.105 7.213 144 HB2 ALA 679 HB2 ALA 679 11.623 5.782 6.862 145 HB3 ALA 679 HB3 ALA 679 12.389 4.475 5.958 146 H GLY 680 H GLY 680 11.457 3.190 3.868 147 HA2 GLY 680 HA2 GLY 680 12.807 4.909 2.064 148 HA3 GLY 680 HA3 GLY 680 12.472 3.201 1.794 149 H ALA 681 H ALA 681 9.727 3.147 1.861 150 HA ALA 681 HA ALA 681 8.942 3.779 -0.721 151 HB1 ALA 681 HB1 ALA 681 7.567 2.272 0.473 152 HB2 ALA 681 HB2 ALA 681 6.573 3.724 0.317 153 HB3 ALA 681 HB3 ALA 681 7.397 3.379 1.833 154 H GLU 682 H GLU 682 8.725 5.685 2.228 155 HA GLU 682 HA GLU 682 7.146 7.797 1.240 156 HB2 GLU 682 HB2 GLU 682 9.265 8.242 3.322 157 HB3 GLU 682 HB3 GLU 682 7.626 8.894 3.244 158 HG2 GLU 682 HG2 GLU 682 6.948 6.349 3.441 159 HG3 GLU 682 HG3 GLU 682 8.541 6.186 4.142 160 H SER 683 H SER 683 10.624 7.257 1.313 161 HA SER 683 HA SER 683 11.635 9.687 0.570 162 HB2 SER 683 HB2 SER 683 13.525 8.526 -0.315 163 HB3 SER 683 HB3 SER 683 12.910 7.543 1.012 164 HG SER 683 HG SER 683 11.934 6.180 -0.454 165 H ILE 684 H ILE 684 10.423 7.173 -1.601 166 HA ILE 684 HA ILE 684 10.705 8.797 -3.962 167 HB ILE 684 HB ILE 684 8.917 6.381 -3.694 168 HG12 ILE 684 HG12 ILE 684 11.407 5.535 -4.674 169 HG13 ILE 684 HG13 ILE 684 11.795 6.551 -3.285 170 HG21 ILE 684 HG21 ILE 684 10.019 6.123 -6.084 171 HG22 ILE 684 HG22 ILE 684 8.664 7.225 -5.845 172 HG23 ILE 684 HG23 ILE 684 10.312 7.852 -5.907 173 HD11 ILE 684 HD11 ILE 684 11.468 4.402 -2.350 174 HD12 ILE 684 HD12 ILE 684 9.947 5.242 -2.047 175 HD13 ILE 684 HD13 ILE 684 10.063 4.082 -3.369 176 H LEU 685 H LEU 685 7.945 7.690 -2.005 177 HA LEU 685 HA LEU 685 5.955 9.026 -3.452 178 HB2 LEU 685 HB2 LEU 685 6.078 8.179 -0.557 179 HB3 LEU 685 HB3 LEU 685 4.623 8.825 -1.319 180 HG LEU 685 HG LEU 685 6.150 6.468 -2.453 181 HD11 LEU 685 HD11 LEU 685 3.686 6.402 -0.694 182 HD12 LEU 685 HD12 LEU 685 4.501 5.017 -1.406 183 HD13 LEU 685 HD13 LEU 685 5.311 5.959 -0.160 184 HD21 LEU 685 HD21 LEU 685 4.517 7.872 -3.860 185 HD22 LEU 685 HD22 LEU 685 4.219 6.138 -3.806 186 HD23 LEU 685 HD23 LEU 685 3.252 7.231 -2.820 187 H ALA 686 H ALA 686 7.780 10.143 -0.555 188 HA ALA 686 HA ALA 686 6.507 12.630 -0.283 189 HB1 ALA 686 HB1 ALA 686 9.192 13.147 0.277 190 HB2 ALA 686 HB2 ALA 686 9.000 11.434 0.630 191 HB3 ALA 686 HB3 ALA 686 7.969 12.616 1.428 192 H ASN 687 H ASN 687 9.101 11.589 -2.420 193 HA ASN 687 HA ASN 687 9.624 14.161 -3.574 194 HB2 ASN 687 HB2 ASN 687 11.438 12.851 -4.008 195 HB3 ASN 687 HB3 ASN 687 10.496 11.365 -3.990 196 HD21 ASN 687 HD21 ASN 687 10.978 14.278 -6.061 197 HD22 ASN 687 HD22 ASN 687 10.802 13.439 -7.523 198 H ARG 688 H ARG 688 7.555 11.426 -4.402 199 HA ARG 688 HA ARG 688 6.790 12.439 -6.963 200 HB2 ARG 688 HB2 ARG 688 6.341 10.070 -5.398 201 HB3 ARG 688 HB3 ARG 688 4.812 10.660 -6.037 202 HG2 ARG 688 HG2 ARG 688 5.699 9.229 -7.735 203 HG3 ARG 688 HG3 ARG 688 6.000 10.872 -8.301 204 HD2 ARG 688 HD2 ARG 688 8.286 10.757 -7.361 205 HD3 ARG 688 HD3 ARG 688 7.985 9.099 -6.854 206 HE ARG 688 HE ARG 688 7.473 8.885 -9.485 207 HH11 ARG 688 HH21 ARG 688 10.020 10.539 -7.769 208 HH12 ARG 688 HH22 ARG 688 11.157 10.350 -9.065 209 HH21 ARG 688 HH11 ARG 688 8.945 8.652 -11.141 210 HH22 ARG 688 HH12 ARG 688 10.552 9.291 -10.962 211 H SER 689 H SER 689 4.397 12.714 -7.460 212 HA SER 689 HA SER 689 3.483 14.978 -5.947 213 HB2 SER 689 HB2 SER 689 3.282 14.507 -8.514 214 HB3 SER 689 HB3 SER 689 1.816 13.645 -8.052 215 HG SER 689 HG SER 689 1.700 16.019 -8.536 216 H ASP 690 H ASP 690 1.267 15.233 -5.218 217 HA ASP 690 HA ASP 690 0.537 13.353 -3.267 218 HB2 ASP 690 HB2 ASP 690 -0.291 15.936 -4.093 219 HB3 ASP 690 HB3 ASP 690 -1.732 14.925 -4.045 220 H GLY 691 H GLY 691 -0.434 11.454 -3.433 221 HA2 GLY 691 HA2 GLY 691 -2.472 10.260 -4.188 222 HA3 GLY 691 HA3 GLY 691 -2.185 10.946 -5.786 223 H THR 692 H THR 692 0.765 10.576 -5.348 224 HA THR 692 HA THR 692 1.174 8.186 -6.731 225 HB THR 692 HB THR 692 3.144 9.401 -4.786 226 HG1 THR 692 HG1 THR 692 2.508 11.108 -6.001 227 HG21 THR 692 HG21 THR 692 4.766 8.277 -5.974 228 HG22 THR 692 HG22 THR 692 3.424 7.165 -6.242 229 HG23 THR 692 HG23 THR 692 3.853 8.343 -7.482 230 H PHE 693 H PHE 693 1.446 6.058 -6.106 231 HA PHE 693 HA PHE 693 1.547 5.496 -3.212 232 HB2 PHE 693 HB2 PHE 693 -0.352 4.065 -3.254 233 HB3 PHE 693 HB3 PHE 693 -0.846 5.552 -4.060 234 HD1 PHE 693 HD1 PHE 693 -0.905 5.661 -6.566 235 HD2 PHE 693 HD2 PHE 693 -0.239 1.984 -4.446 236 HE1 PHE 693 HE1 PHE 693 -1.455 4.381 -8.616 237 HE2 PHE 693 HE2 PHE 693 -0.790 0.707 -6.496 238 HZ PHE 693 HZ PHE 693 -1.396 1.902 -8.581 239 H LEU 694 H LEU 694 1.855 3.177 -2.725 240 HA LEU 694 HA LEU 694 2.823 1.418 -4.778 241 HB2 LEU 694 HB2 LEU 694 5.134 1.309 -4.169 242 HB3 LEU 694 HB3 LEU 694 4.744 2.992 -4.489 243 HG LEU 694 HG LEU 694 4.239 3.059 -1.903 244 HD11 LEU 694 HD11 LEU 694 5.376 0.425 -2.282 245 HD12 LEU 694 HD12 LEU 694 6.426 1.393 -1.250 246 HD13 LEU 694 HD13 LEU 694 4.736 1.154 -0.810 247 HD21 LEU 694 HD21 LEU 694 6.831 3.403 -1.617 248 HD22 LEU 694 HD22 LEU 694 6.861 3.163 -3.354 249 HD23 LEU 694 HD23 LEU 694 5.924 4.482 -2.666 250 H VAL 695 H VAL 695 3.837 -0.550 -3.822 251 HA VAL 695 HA VAL 695 2.918 -1.130 -1.082 252 HB VAL 695 HB VAL 695 2.383 -3.047 -3.349 253 HG11 VAL 695 HG11 VAL 695 2.349 -4.137 -1.241 254 HG12 VAL 695 HG12 VAL 695 1.560 -2.770 -0.453 255 HG13 VAL 695 HG13 VAL 695 0.654 -3.783 -1.577 256 HG21 VAL 695 HG21 VAL 695 0.606 -0.877 -2.198 257 HG22 VAL 695 HG22 VAL 695 1.086 -1.076 -3.884 258 HG23 VAL 695 HG23 VAL 695 -0.010 -2.238 -3.134 259 H ARG 696 H ARG 696 4.122 -2.675 -0.010 260 HA ARG 696 HA ARG 696 6.358 -3.921 -1.474 261 HB2 ARG 696 HB2 ARG 696 7.815 -3.367 0.524 262 HB3 ARG 696 HB3 ARG 696 7.379 -2.000 -0.495 263 HG2 ARG 696 HG2 ARG 696 6.285 -0.982 1.194 264 HG3 ARG 696 HG3 ARG 696 5.375 -2.444 1.560 265 HD2 ARG 696 HD2 ARG 696 8.244 -2.057 2.423 266 HD3 ARG 696 HD3 ARG 696 6.887 -1.579 3.422 267 HE ARG 696 HE ARG 696 6.278 -3.890 3.660 268 HH11 ARG 696 HH21 ARG 696 9.218 -3.408 1.827 269 HH12 ARG 696 HH22 ARG 696 9.719 -5.057 2.054 270 HH21 ARG 696 HH11 ARG 696 6.965 -5.919 3.945 271 HH22 ARG 696 HH12 ARG 696 8.461 -6.465 3.263 272 H GLN 697 H GLN 697 6.832 -5.940 -0.882 273 HA GLN 697 HA GLN 697 6.655 -7.224 1.523 274 HB2 GLN 697 HB2 GLN 697 4.497 -8.527 1.306 275 HB3 GLN 697 HB3 GLN 697 4.295 -6.831 1.731 276 HG2 GLN 697 HG2 GLN 697 3.022 -6.508 -0.095 277 HG3 GLN 697 HG3 GLN 697 4.342 -7.042 -1.130 278 HE21 GLN 697 HE21 GLN 697 3.956 -8.926 -2.286 279 HE22 GLN 697 HE22 GLN 697 2.758 -10.074 -1.892 280 H ARG 698 H ARG 698 6.944 -9.540 1.336 281 HA ARG 698 HA ARG 698 6.839 -10.898 -1.153 282 HB2 ARG 698 HB2 ARG 698 8.670 -9.418 -1.773 283 HB3 ARG 698 HB3 ARG 698 9.557 -9.859 -0.316 284 HG2 ARG 698 HG2 ARG 698 10.347 -11.071 -2.364 285 HG3 ARG 698 HG3 ARG 698 9.795 -12.150 -1.087 286 HD2 ARG 698 HD2 ARG 698 7.572 -12.296 -2.221 287 HD3 ARG 698 HD3 ARG 698 8.203 -11.291 -3.523 288 HE ARG 698 HE ARG 698 9.282 -13.166 -4.347 289 HH11 ARG 698 HH21 ARG 698 8.447 -13.638 -1.004 290 HH12 ARG 698 HH22 ARG 698 9.022 -15.279 -0.987 291 HH21 ARG 698 HH11 ARG 698 10.003 -15.279 -4.290 292 HH22 ARG 698 HH12 ARG 698 9.895 -16.197 -2.830 293 H VAL 699 H VAL 699 7.800 -10.682 2.146 294 HA VAL 699 HA VAL 699 8.899 -13.316 2.412 295 HB VAL 699 HB VAL 699 9.343 -11.378 3.967 296 HG11 VAL 699 HG11 VAL 699 6.890 -10.709 4.055 297 HG12 VAL 699 HG12 VAL 699 6.637 -12.087 5.121 298 HG13 VAL 699 HG13 VAL 699 7.706 -10.777 5.615 299 HG21 VAL 699 HG21 VAL 699 8.274 -13.388 5.818 300 HG22 VAL 699 HG22 VAL 699 9.191 -14.103 4.494 301 HG23 VAL 699 HG23 VAL 699 9.943 -12.898 5.539 302 H LYS 700 H LYS 700 7.904 -15.105 3.535 303 HA LYS 700 HA LYS 700 5.034 -15.305 2.944 304 HB2 LYS 700 HB2 LYS 700 6.370 -17.065 1.994 305 HB3 LYS 700 HB3 LYS 700 7.139 -17.394 3.547 306 HG2 LYS 700 HG2 LYS 700 4.952 -18.072 4.485 307 HG3 LYS 700 HG3 LYS 700 4.186 -17.750 2.930 308 HD2 LYS 700 HD2 LYS 700 4.814 -19.764 2.134 309 HD3 LYS 700 HD3 LYS 700 6.495 -19.465 2.572 310 HE2 LYS 700 HE2 LYS 700 4.550 -20.164 4.748 311 HE3 LYS 700 HE3 LYS 700 5.147 -21.453 3.700 312 HZ1 LYS 700 HZ1 LYS 700 6.435 -20.563 5.896 313 HZ2 LYS 700 HZ2 LYS 700 7.214 -21.301 4.558 314 HZ3 LYS 700 HZ3 LYS 700 7.167 -19.605 4.692 315 H ASP 701 H ASP 701 6.856 -17.023 5.441 316 HA ASP 701 HA ASP 701 4.764 -17.058 7.306 317 HB2 ASP 701 HB2 ASP 701 7.662 -17.220 8.095 318 HB3 ASP 701 HB3 ASP 701 6.288 -18.124 8.731 319 H ALA 702 H ALA 702 4.686 -14.476 6.614 320 HA ALA 702 HA ALA 702 4.772 -13.104 9.080 321 HB1 ALA 702 HB1 ALA 702 6.630 -11.691 8.935 322 HB2 ALA 702 HB2 ALA 702 6.845 -11.986 7.212 323 HB3 ALA 702 HB3 ALA 702 7.284 -13.231 8.378 324 H ALA 703 H ALA 703 4.978 -12.801 5.562 325 HA ALA 703 HA ALA 703 3.845 -11.501 4.050 326 HB1 ALA 703 HB1 ALA 703 1.822 -11.732 6.276 327 HB2 ALA 703 HB2 ALA 703 1.867 -12.603 4.743 328 HB3 ALA 703 HB3 ALA 703 1.469 -10.886 4.771 329 H GLU 704 H GLU 704 2.550 -9.922 6.946 330 HA GLU 704 HA GLU 704 2.453 -7.682 7.495 331 HB2 GLU 704 HB2 GLU 704 5.156 -8.615 7.515 332 HB3 GLU 704 HB3 GLU 704 5.155 -6.936 6.979 333 HG2 GLU 704 HG2 GLU 704 3.529 -7.792 9.371 334 HG3 GLU 704 HG3 GLU 704 5.236 -7.401 9.537 335 H PHE 705 H PHE 705 1.198 -7.537 5.360 336 HA PHE 705 HA PHE 705 2.632 -5.903 3.376 337 HB2 PHE 705 HB2 PHE 705 0.134 -6.262 2.311 338 HB3 PHE 705 HB3 PHE 705 1.525 -7.286 1.982 339 HD1 PHE 705 HD2 PHE 705 -0.776 -6.957 4.945 340 HD2 PHE 705 HD1 PHE 705 0.878 -9.517 1.920 341 HE1 PHE 705 HE2 PHE 705 -1.974 -8.890 5.926 342 HE2 PHE 705 HE1 PHE 705 -0.324 -11.451 2.903 343 HZ PHE 705 HZ PHE 705 -1.741 -11.137 4.905 344 H ALA 706 H ALA 706 1.940 -3.927 2.710 345 HA ALA 706 HA ALA 706 -0.372 -2.600 3.811 346 HB1 ALA 706 HB1 ALA 706 2.042 -2.499 5.298 347 HB2 ALA 706 HB2 ALA 706 0.573 -1.570 5.567 348 HB3 ALA 706 HB3 ALA 706 1.840 -0.923 4.538 349 H ILE 707 H ILE 707 -0.809 -0.638 2.731 350 HA ILE 707 HA ILE 707 0.793 -0.252 0.278 351 HB ILE 707 HB ILE 707 -1.975 0.814 0.863 352 HG12 ILE 707 HG12 ILE 707 -1.109 -1.742 -0.529 353 HG13 ILE 707 HG13 ILE 707 -2.021 -1.631 0.976 354 HG21 ILE 707 HG21 ILE 707 -1.027 0.217 -1.883 355 HG22 ILE 707 HG22 ILE 707 -1.966 1.583 -1.290 356 HG23 ILE 707 HG23 ILE 707 -0.215 1.562 -1.080 357 HD11 ILE 707 HD11 ILE 707 -2.918 -0.820 -1.793 358 HD12 ILE 707 HD12 ILE 707 -3.623 -2.050 -0.744 359 HD13 ILE 707 HD13 ILE 707 -3.783 -0.343 -0.333 360 H SER 708 H SER 708 1.774 1.642 -0.192 361 HA SER 708 HA SER 708 1.569 3.798 1.837 362 HB2 SER 708 HB2 SER 708 3.897 3.169 0.013 363 HB3 SER 708 HB3 SER 708 3.859 4.386 1.286 364 HG SER 708 HG SER 708 3.556 1.567 1.594 365 H ILE 709 H ILE 709 0.571 5.576 1.164 366 HA ILE 709 HA ILE 709 0.714 6.274 -1.712 367 HB ILE 709 HB ILE 709 -1.647 6.902 0.053 368 HG12 ILE 709 HG12 ILE 709 -2.497 4.875 -1.593 369 HG13 ILE 709 HG13 ILE 709 -0.864 4.340 -1.195 370 HG21 ILE 709 HG21 ILE 709 -2.505 7.847 -1.807 371 HG22 ILE 709 HG22 ILE 709 -0.897 7.723 -2.515 372 HG23 ILE 709 HG23 ILE 709 -2.088 6.453 -2.797 373 HD11 ILE 709 HD11 ILE 709 -1.798 3.526 0.705 374 HD12 ILE 709 HD12 ILE 709 -1.798 5.204 1.252 375 HD13 ILE 709 HD13 ILE 709 -3.248 4.514 0.519 376 H LYS 710 H LYS 710 1.072 8.333 -2.267 377 HA LYS 710 HA LYS 710 2.072 10.171 -0.246 378 HB2 LYS 710 HB2 LYS 710 3.185 10.058 -2.413 379 HB3 LYS 710 HB3 LYS 710 1.686 10.451 -3.239 380 HG2 LYS 710 HG2 LYS 710 2.954 12.487 -3.107 381 HG3 LYS 710 HG3 LYS 710 1.649 12.624 -1.933 382 HD2 LYS 710 HD2 LYS 710 3.081 12.299 -0.107 383 HD3 LYS 710 HD3 LYS 710 4.325 11.536 -1.092 384 HE2 LYS 710 HE2 LYS 710 3.524 14.408 -1.538 385 HE3 LYS 710 HE3 LYS 710 4.731 13.975 -0.325 386 HZ1 LYS 710 HZ1 LYS 710 4.909 13.857 -3.249 387 HZ2 LYS 710 HZ2 LYS 710 6.141 14.129 -2.083 388 HZ3 LYS 710 HZ3 LYS 710 5.592 12.542 -2.403 389 H TYR 711 H TYR 711 0.720 11.385 0.926 390 HA TYR 711 HA TYR 711 -1.625 12.608 -0.406 391 HB2 TYR 711 HB2 TYR 711 -2.024 10.467 1.100 392 HB3 TYR 711 HB3 TYR 711 -1.871 11.633 2.412 393 HD1 TYR 711 HD2 TYR 711 -3.121 14.045 1.506 394 HD2 TYR 711 HD1 TYR 711 -4.249 9.985 0.702 395 HE1 TYR 711 HE2 TYR 711 -5.455 14.775 1.108 396 HE2 TYR 711 HE1 TYR 711 -6.582 10.714 0.304 397 HH TYR 711 HH TYR 711 -7.902 12.578 -0.133 398 H ASN 712 H ASN 712 -1.566 14.737 -0.172 399 HA ASN 712 HA ASN 712 -1.120 16.830 0.668 400 HB2 ASN 712 HB2 ASN 712 -2.626 15.902 2.471 401 HB3 ASN 712 HB3 ASN 712 -1.178 15.491 3.379 402 HD21 ASN 712 HD21 ASN 712 0.446 17.522 3.431 403 HD22 ASN 712 HD22 ASN 712 -0.304 18.994 3.848 404 H VAL 713 H VAL 713 1.067 15.986 -0.351 405 HA VAL 713 HA VAL 713 3.360 15.927 -0.281 406 HB VAL 713 HB VAL 713 4.412 17.780 0.735 407 HG11 VAL 713 HG11 VAL 713 1.554 18.724 0.478 408 HG12 VAL 713 HG12 VAL 713 3.034 19.594 0.070 409 HG13 VAL 713 HG13 VAL 713 2.505 18.238 -0.926 410 HG21 VAL 713 HG21 VAL 713 3.287 17.158 3.055 411 HG22 VAL 713 HG22 VAL 713 3.788 18.814 2.730 412 HG23 VAL 713 HG23 VAL 713 2.097 18.359 2.560 413 H GLU 714 H GLU 714 1.754 14.229 1.637 414 HA GLU 714 HA GLU 714 4.049 13.301 3.226 415 HB2 GLU 714 HB2 GLU 714 1.468 14.263 4.208 416 HB3 GLU 714 HB3 GLU 714 1.858 12.638 4.779 417 HG2 GLU 714 HG2 GLU 714 3.832 14.921 4.874 418 HG3 GLU 714 HG3 GLU 714 2.747 14.555 6.211 419 H VAL 715 H VAL 715 3.641 11.014 4.055 420 HA VAL 715 HA VAL 715 2.242 9.514 1.910 421 HB VAL 715 HB VAL 715 4.509 8.435 3.576 422 HG11 VAL 715 HG11 VAL 715 2.736 7.177 1.929 423 HG12 VAL 715 HG12 VAL 715 3.992 7.623 0.779 424 HG13 VAL 715 HG13 VAL 715 4.391 6.630 2.174 425 HG21 VAL 715 HG21 VAL 715 5.689 10.117 2.523 426 HG22 VAL 715 HG22 VAL 715 5.686 8.929 1.222 427 HG23 VAL 715 HG23 VAL 715 4.526 10.252 1.204 428 H LYS 716 H LYS 716 0.826 7.943 2.390 429 HA LYS 716 HA LYS 716 0.281 7.454 5.269 430 HB2 LYS 716 HB2 LYS 716 -1.457 8.689 3.729 431 HB3 LYS 716 HB3 LYS 716 -1.790 7.070 3.129 432 HG2 LYS 716 HG2 LYS 716 -2.617 6.311 5.195 433 HG3 LYS 716 HG3 LYS 716 -1.716 7.526 6.104 434 HD2 LYS 716 HD2 LYS 716 -4.176 7.990 4.391 435 HD3 LYS 716 HD3 LYS 716 -4.078 8.115 6.127 436 HE2 LYS 716 HE2 LYS 716 -3.027 9.995 4.031 437 HE3 LYS 716 HE3 LYS 716 -3.953 10.357 5.485 438 HZ1 LYS 716 HZ1 LYS 716 -1.547 9.170 6.277 439 HZ2 LYS 716 HZ2 LYS 716 -1.164 10.386 5.154 440 HZ3 LYS 716 HZ3 LYS 716 -2.067 10.763 6.544 441 H HIS 717 H HIS 717 1.101 5.502 5.777 442 HA HIS 717 HA HIS 717 0.805 3.298 3.837 443 HB2 HIS 717 HB2 HIS 717 2.453 3.100 6.346 444 HB3 HIS 717 HB3 HIS 717 2.590 2.163 4.862 445 HD1 HIS 717 HD1 HIS 717 4.076 3.067 3.002 446 HD2 HIS 717 HD2 HIS 717 3.579 5.766 6.170 447 HE1 HIS 717 HE1 HIS 717 5.835 4.889 2.719 448 HE2 HIS 717 HE2 HIS 717 5.482 6.589 4.604 449 H ILE 718 H ILE 718 -1.008 2.152 4.179 450 HA ILE 718 HA ILE 718 -1.922 1.820 6.975 451 HB ILE 718 HB ILE 718 -3.317 2.204 4.408 452 HG12 ILE 718 HG12 ILE 718 -3.411 3.801 6.293 453 HG13 ILE 718 HG13 ILE 718 -5.004 3.195 5.859 454 HG21 ILE 718 HG21 ILE 718 -4.312 0.172 6.423 455 HG22 ILE 718 HG22 ILE 718 -5.304 0.878 5.152 456 HG23 ILE 718 HG23 ILE 718 -3.925 -0.133 4.733 457 HD11 ILE 718 HD11 ILE 718 -3.868 3.161 8.400 458 HD12 ILE 718 HD12 ILE 718 -5.300 2.273 7.889 459 HD13 ILE 718 HD13 ILE 718 -3.722 1.496 7.847 460 H LYS 719 H LYS 719 -2.295 -0.211 7.791 461 HA LYS 719 HA LYS 719 -0.720 -2.316 6.662 462 HB2 LYS 719 HB2 LYS 719 -1.231 -1.707 9.160 463 HB3 LYS 719 HB3 LYS 719 -2.635 -2.748 8.923 464 HG2 LYS 719 HG2 LYS 719 -0.835 -4.134 9.754 465 HG3 LYS 719 HG3 LYS 719 -1.067 -4.528 8.050 466 HD2 LYS 719 HD2 LYS 719 1.114 -4.067 7.714 467 HD3 LYS 719 HD3 LYS 719 0.751 -2.380 8.067 468 HE2 LYS 719 HE2 LYS 719 1.242 -2.695 10.413 469 HE3 LYS 719 HE3 LYS 719 1.400 -4.441 10.193 470 HZ1 LYS 719 HZ1 LYS 719 3.574 -3.937 9.972 471 HZ2 LYS 719 HZ2 LYS 719 3.110 -3.578 8.370 472 HZ3 LYS 719 HZ3 LYS 719 3.259 -2.298 9.501 473 H ILE 720 H ILE 720 -1.283 -4.115 5.605 474 HA ILE 720 HA ILE 720 -4.086 -4.327 4.758 475 HB ILE 720 HB ILE 720 -1.524 -5.530 3.710 476 HG12 ILE 720 HG12 ILE 720 -3.691 -3.834 2.440 477 HG13 ILE 720 HG13 ILE 720 -2.160 -3.209 3.047 478 HG21 ILE 720 HG21 ILE 720 -3.056 -7.337 3.513 479 HG22 ILE 720 HG22 ILE 720 -4.401 -6.258 3.146 480 HG23 ILE 720 HG23 ILE 720 -3.132 -6.524 1.951 481 HD11 ILE 720 HD11 ILE 720 -1.176 -3.731 1.097 482 HD12 ILE 720 HD12 ILE 720 -1.590 -5.428 1.341 483 HD13 ILE 720 HD13 ILE 720 -2.709 -4.360 0.497 484 H MET 721 H MET 721 -5.369 -5.952 5.335 485 HA MET 721 HA MET 721 -4.299 -7.864 7.313 486 HB2 MET 721 HB2 MET 721 -6.466 -6.224 7.469 487 HB3 MET 721 HB3 MET 721 -7.215 -7.690 6.834 488 HG2 MET 721 HG2 MET 721 -6.729 -8.921 8.733 489 HG3 MET 721 HG3 MET 721 -5.285 -7.981 9.101 490 HE1 MET 721 HE1 MET 721 -5.305 -7.285 11.246 491 HE2 MET 721 HE2 MET 721 -6.651 -6.717 12.233 492 HE3 MET 721 HE3 MET 721 -6.598 -8.397 11.683 493 H THR 722 H THR 722 -5.294 -10.019 7.293 494 HA THR 722 HA THR 722 -6.284 -11.034 4.765 495 HB THR 722 HB THR 722 -3.720 -10.981 4.635 496 HG1 THR 722 HG1 THR 722 -5.032 -12.267 3.300 497 HG21 THR 722 HG21 THR 722 -2.566 -12.793 5.801 498 HG22 THR 722 HG22 THR 722 -3.362 -11.744 6.976 499 HG23 THR 722 HG23 THR 722 -4.076 -13.301 6.553 500 H ALA 723 H ALA 723 -6.548 -13.482 4.963 501 HA ALA 723 HA ALA 723 -6.714 -14.736 7.465 502 HB1 ALA 723 HB1 ALA 723 -8.700 -12.767 7.138 503 HB2 ALA 723 HB2 ALA 723 -8.650 -14.022 8.376 504 HB3 ALA 723 HB3 ALA 723 -9.515 -14.305 6.863 505 H GLU 724 H GLU 724 -9.228 -14.460 5.052 506 HA GLU 724 HA GLU 724 -9.212 -17.300 4.495 507 HB2 GLU 724 HB2 GLU 724 -10.724 -15.382 2.805 508 HB3 GLU 724 HB3 GLU 724 -11.261 -16.892 3.531 509 HG2 GLU 724 HG2 GLU 724 -12.429 -15.382 4.849 510 HG3 GLU 724 HG3 GLU 724 -10.948 -15.511 5.790 511 H GLY 725 H GLY 725 -6.750 -15.962 3.911 512 HA2 GLY 725 HA2 GLY 725 -5.136 -15.994 2.248 513 HA3 GLY 725 HA3 GLY 725 -6.291 -16.856 1.231 514 H LEU 726 H LEU 726 -7.458 -13.959 2.585 515 HA LEU 726 HA LEU 726 -7.362 -12.630 -0.038 516 HB2 LEU 726 HB2 LEU 726 -9.029 -12.016 2.415 517 HB3 LEU 726 HB3 LEU 726 -9.191 -11.248 0.838 518 HG LEU 726 HG LEU 726 -9.493 -14.231 1.255 519 HD11 LEU 726 HD11 LEU 726 -11.319 -12.024 1.866 520 HD12 LEU 726 HD12 LEU 726 -12.009 -13.189 0.739 521 HD13 LEU 726 HD13 LEU 726 -11.428 -13.721 2.314 522 HD21 LEU 726 HD21 LEU 726 -10.775 -13.957 -0.916 523 HD22 LEU 726 HD22 LEU 726 -10.174 -12.301 -0.977 524 HD23 LEU 726 HD23 LEU 726 -9.043 -13.651 -1.037 525 H TYR 727 H TYR 727 -7.392 -10.181 0.130 526 HA TYR 727 HA TYR 727 -5.396 -9.205 2.109 527 HB2 TYR 727 HB2 TYR 727 -5.619 -8.421 -0.819 528 HB3 TYR 727 HB3 TYR 727 -4.499 -7.724 0.350 529 HD1 TYR 727 HD2 TYR 727 -5.351 -10.774 -1.568 530 HD2 TYR 727 HD1 TYR 727 -2.546 -8.930 1.116 531 HE1 TYR 727 HE2 TYR 727 -3.714 -12.588 -2.021 532 HE2 TYR 727 HE1 TYR 727 -0.914 -10.738 0.657 533 HH TYR 727 HH TYR 727 -0.579 -12.703 -0.334 534 H ARG 728 H ARG 728 -5.946 -7.306 3.117 535 HA ARG 728 HA ARG 728 -7.984 -5.568 1.968 536 HB2 ARG 728 HB2 ARG 728 -8.971 -5.831 4.522 537 HB3 ARG 728 HB3 ARG 728 -9.653 -6.576 3.079 538 HG2 ARG 728 HG2 ARG 728 -8.653 -8.657 3.509 539 HG3 ARG 728 HG3 ARG 728 -7.407 -7.949 4.531 540 HD2 ARG 728 HD2 ARG 728 -8.744 -8.861 6.169 541 HD3 ARG 728 HD3 ARG 728 -9.506 -7.278 6.023 542 HE ARG 728 HE ARG 728 -11.340 -8.272 4.958 543 HH11 ARG 728 HH21 ARG 728 -8.757 -10.573 5.311 544 HH12 ARG 728 HH22 ARG 728 -9.776 -11.961 5.016 545 HH21 ARG 728 HH11 ARG 728 -12.624 -10.069 4.619 546 HH22 ARG 728 HH12 ARG 728 -11.945 -11.680 4.635 547 H ILE 729 H ILE 729 -7.493 -3.513 2.397 548 HA ILE 729 HA ILE 729 -5.299 -2.862 4.134 549 HB ILE 729 HB ILE 729 -6.287 -0.445 3.580 550 HG12 ILE 729 HG12 ILE 729 -8.307 -1.737 2.518 551 HG13 ILE 729 HG13 ILE 729 -7.647 -0.327 1.692 552 HG21 ILE 729 HG21 ILE 729 -5.001 -0.593 1.386 553 HG22 ILE 729 HG22 ILE 729 -4.119 -1.049 2.840 554 HG23 ILE 729 HG23 ILE 729 -4.745 -2.293 1.762 555 HD11 ILE 729 HD11 ILE 729 -6.918 -1.551 -0.056 556 HD12 ILE 729 HD12 ILE 729 -6.313 -2.846 0.973 557 HD13 ILE 729 HD13 ILE 729 -8.020 -2.788 0.543 558 H THR 730 H THR 730 -8.239 -3.782 4.983 559 HA THR 730 HA THR 730 -8.118 -2.402 7.509 560 HB THR 730 HB THR 730 -9.258 -0.737 6.027 561 HG1 THR 730 HG1 THR 730 -10.026 -1.677 8.409 562 HG21 THR 730 HG21 THR 730 -11.138 -1.227 4.831 563 HG22 THR 730 HG22 THR 730 -10.448 -2.848 4.859 564 HG23 THR 730 HG23 THR 730 -11.712 -2.405 6.006 565 H GLU 731 H GLU 731 -9.632 -3.169 9.023 566 HA GLU 731 HA GLU 731 -10.076 -5.970 8.894 567 HB2 GLU 731 HB2 GLU 731 -10.904 -5.668 11.124 568 HB3 GLU 731 HB3 GLU 731 -9.597 -4.492 10.927 569 HG2 GLU 731 HG2 GLU 731 -12.395 -3.656 10.245 570 HG3 GLU 731 HG3 GLU 731 -11.939 -3.750 11.930 571 H LYS 732 H LYS 732 -11.736 -3.406 7.549 572 HA LYS 732 HA LYS 732 -14.353 -4.693 7.787 573 HB2 LYS 732 HB2 LYS 732 -13.824 -1.939 6.698 574 HB3 LYS 732 HB3 LYS 732 -15.324 -2.590 7.370 575 HG2 LYS 732 HG2 LYS 732 -14.385 -2.697 9.583 576 HG3 LYS 732 HG3 LYS 732 -12.774 -2.365 8.978 577 HD2 LYS 732 HD2 LYS 732 -14.481 -0.235 8.127 578 HD3 LYS 732 HD3 LYS 732 -14.720 -0.483 9.858 579 HE2 LYS 732 HE2 LYS 732 -11.908 -0.641 9.023 580 HE3 LYS 732 HE3 LYS 732 -12.631 0.942 8.748 581 HZ1 LYS 732 HZ1 LYS 732 -12.074 1.256 10.889 582 HZ2 LYS 732 HZ2 LYS 732 -13.515 0.382 11.211 583 HZ3 LYS 732 HZ3 LYS 732 -12.009 -0.441 11.243 584 H LYS 733 H LYS 733 -11.846 -4.721 5.569 585 HA LYS 733 HA LYS 733 -13.748 -5.138 3.322 586 HB2 LYS 733 HB2 LYS 733 -11.775 -3.196 3.434 587 HB3 LYS 733 HB3 LYS 733 -11.038 -4.482 2.480 588 HG2 LYS 733 HG2 LYS 733 -12.239 -3.070 0.938 589 HG3 LYS 733 HG3 LYS 733 -13.181 -4.548 1.111 590 HD2 LYS 733 HD2 LYS 733 -14.952 -3.388 1.876 591 HD3 LYS 733 HD3 LYS 733 -13.975 -2.659 3.149 592 HE2 LYS 733 HE2 LYS 733 -13.091 -1.141 1.193 593 HE3 LYS 733 HE3 LYS 733 -14.580 -1.634 0.395 594 HZ1 LYS 733 HZ1 LYS 733 -14.183 0.091 2.719 595 HZ2 LYS 733 HZ2 LYS 733 -15.400 0.143 1.509 596 HZ3 LYS 733 HZ3 LYS 733 -15.511 -0.983 2.796 597 H ALA 734 H ALA 734 -12.120 -6.166 1.459 598 HA ALA 734 HA ALA 734 -10.363 -8.216 2.249 599 HB1 ALA 734 HB1 ALA 734 -12.825 -8.899 3.098 600 HB2 ALA 734 HB2 ALA 734 -11.628 -10.082 2.574 601 HB3 ALA 734 HB3 ALA 734 -12.889 -9.552 1.462 602 H PHE 735 H PHE 735 -9.215 -8.770 0.462 603 HA PHE 735 HA PHE 735 -10.612 -8.842 -2.141 604 HB2 PHE 735 HB2 PHE 735 -8.091 -7.308 -1.516 605 HB3 PHE 735 HB3 PHE 735 -8.443 -7.878 -3.143 606 HD1 PHE 735 HD2 PHE 735 -10.077 -6.046 -0.308 607 HD2 PHE 735 HD1 PHE 735 -9.760 -6.587 -4.554 608 HE1 PHE 735 HE2 PHE 735 -11.648 -4.163 -0.665 609 HE2 PHE 735 HE1 PHE 735 -11.327 -4.701 -4.914 610 HZ PHE 735 HZ PHE 735 -12.277 -3.495 -2.963 611 H ARG 736 H ARG 736 -9.651 -10.157 -3.730 612 HA ARG 736 HA ARG 736 -8.532 -12.587 -2.714 613 HB2 ARG 736 HB2 ARG 736 -9.588 -11.559 -5.255 614 HB3 ARG 736 HB3 ARG 736 -8.263 -12.703 -5.459 615 HG2 ARG 736 HG2 ARG 736 -10.430 -13.334 -3.499 616 HG3 ARG 736 HG3 ARG 736 -10.746 -13.568 -5.218 617 HD2 ARG 736 HD2 ARG 736 -9.689 -15.530 -3.783 618 HD3 ARG 736 HD3 ARG 736 -9.138 -15.239 -5.431 619 HE ARG 736 HE ARG 736 -7.233 -14.028 -4.493 620 HH11 ARG 736 HH21 ARG 736 -9.000 -16.092 -2.350 621 HH12 ARG 736 HH22 ARG 736 -7.839 -15.953 -1.079 622 HH21 ARG 736 HH11 ARG 736 -5.792 -13.815 -2.862 623 HH22 ARG 736 HH12 ARG 736 -6.029 -14.654 -1.345 624 H GLY 737 H GLY 737 -7.224 -9.717 -4.110 625 HA2 GLY 737 HA2 GLY 737 -4.524 -10.510 -3.514 626 HA3 GLY 737 HA3 GLY 737 -4.843 -10.493 -5.242 627 H LEU 738 H LEU 738 -3.060 -8.823 -3.619 628 HA LEU 738 HA LEU 738 -3.830 -6.268 -3.051 629 HB2 LEU 738 HB2 LEU 738 -1.372 -7.573 -3.953 630 HB3 LEU 738 HB3 LEU 738 -1.473 -5.902 -4.498 631 HG LEU 738 HG LEU 738 -0.381 -5.930 -2.346 632 HD11 LEU 738 HD11 LEU 738 -2.414 -4.312 -2.943 633 HD12 LEU 738 HD12 LEU 738 -3.124 -5.099 -1.534 634 HD13 LEU 738 HD13 LEU 738 -1.592 -4.237 -1.388 635 HD21 LEU 738 HD21 LEU 738 -2.750 -7.622 -1.543 636 HD22 LEU 738 HD22 LEU 738 -1.033 -8.008 -1.411 637 HD23 LEU 738 HD23 LEU 738 -1.750 -6.794 -0.351 638 H THR 739 H THR 739 -2.895 -7.492 -6.233 639 HA THR 739 HA THR 739 -3.274 -5.181 -7.731 640 HB THR 739 HB THR 739 -3.757 -8.018 -8.644 641 HG1 THR 739 HG1 THR 739 -1.410 -6.445 -8.453 642 HG21 THR 739 HG21 THR 739 -4.470 -6.251 -10.233 643 HG22 THR 739 HG22 THR 739 -2.860 -5.538 -10.138 644 HG23 THR 739 HG23 THR 739 -3.074 -7.146 -10.829 645 H GLU 740 H GLU 740 -5.698 -7.510 -6.612 646 HA GLU 740 HA GLU 740 -7.736 -6.337 -8.315 647 HB2 GLU 740 HB2 GLU 740 -8.370 -8.099 -5.966 648 HB3 GLU 740 HB3 GLU 740 -9.141 -8.029 -7.551 649 HG2 GLU 740 HG2 GLU 740 -6.393 -9.166 -6.942 650 HG3 GLU 740 HG3 GLU 740 -7.830 -10.085 -7.369 651 H LEU 741 H LEU 741 -6.313 -5.792 -5.289 652 HA LEU 741 HA LEU 741 -8.549 -4.291 -4.174 653 HB2 LEU 741 HB2 LEU 741 -7.251 -5.647 -2.652 654 HB3 LEU 741 HB3 LEU 741 -5.748 -4.927 -3.208 655 HG LEU 741 HG LEU 741 -6.718 -4.110 -0.968 656 HD11 LEU 741 HD11 LEU 741 -6.354 -1.759 -2.767 657 HD12 LEU 741 HD12 LEU 741 -5.540 -2.160 -1.261 658 HD13 LEU 741 HD13 LEU 741 -5.062 -2.957 -2.754 659 HD21 LEU 741 HD21 LEU 741 -8.327 -2.139 -1.370 660 HD22 LEU 741 HD22 LEU 741 -8.644 -2.853 -2.941 661 HD23 LEU 741 HD23 LEU 741 -9.014 -3.755 -1.477 662 H VAL 742 H VAL 742 -5.241 -3.771 -5.241 663 HA VAL 742 HA VAL 742 -5.077 -0.970 -4.972 664 HB VAL 742 HB VAL 742 -3.713 -2.882 -6.877 665 HG11 VAL 742 HG11 VAL 742 -1.902 -1.027 -6.690 666 HG12 VAL 742 HG12 VAL 742 -3.263 -0.784 -7.785 667 HG13 VAL 742 HG13 VAL 742 -3.244 0.008 -6.207 668 HG21 VAL 742 HG21 VAL 742 -2.215 -3.349 -5.211 669 HG22 VAL 742 HG22 VAL 742 -2.388 -1.767 -4.454 670 HG23 VAL 742 HG23 VAL 742 -3.618 -3.007 -4.204 671 H GLU 743 H GLU 743 -5.542 -2.889 -7.876 672 HA GLU 743 HA GLU 743 -6.017 -0.707 -9.596 673 HB2 GLU 743 HB2 GLU 743 -6.869 -3.580 -9.956 674 HB3 GLU 743 HB3 GLU 743 -6.544 -2.395 -11.230 675 HG2 GLU 743 HG2 GLU 743 -4.426 -3.164 -9.204 676 HG3 GLU 743 HG3 GLU 743 -4.665 -4.096 -10.664 677 H PHE 744 H PHE 744 -8.048 -2.450 -7.414 678 HA PHE 744 HA PHE 744 -10.555 -1.778 -8.649 679 HB2 PHE 744 HB2 PHE 744 -10.593 -3.650 -7.216 680 HB3 PHE 744 HB3 PHE 744 -9.733 -2.806 -5.937 681 HD1 PHE 744 HD2 PHE 744 -12.893 -2.476 -7.951 682 HD2 PHE 744 HD1 PHE 744 -10.966 -1.959 -4.146 683 HE1 PHE 744 HE2 PHE 744 -15.047 -1.757 -6.956 684 HE2 PHE 744 HE1 PHE 744 -13.124 -1.244 -3.143 685 HZ PHE 744 HZ PHE 744 -15.164 -1.141 -4.556 686 H TYR 745 H TYR 745 -8.504 -0.401 -6.128 687 HA TYR 745 HA TYR 745 -10.443 1.640 -5.485 688 HB2 TYR 745 HB2 TYR 745 -7.748 0.872 -4.506 689 HB3 TYR 745 HB3 TYR 745 -8.228 2.557 -4.285 690 HD1 TYR 745 HD1 TYR 745 -11.162 2.275 -3.923 691 HD2 TYR 745 HD2 TYR 745 -7.937 -0.057 -2.330 692 HE1 TYR 745 HE1 TYR 745 -12.578 1.635 -2.019 693 HE2 TYR 745 HE2 TYR 745 -9.373 -0.700 -0.406 694 HH TYR 745 HH TYR 745 -12.802 0.262 -0.285 695 H GLN 746 H GLN 746 -8.252 1.289 -8.002 696 HA GLN 746 HA GLN 746 -7.203 3.848 -8.377 697 HB2 GLN 746 HB2 GLN 746 -8.129 1.731 -10.298 698 HB3 GLN 746 HB3 GLN 746 -7.567 3.298 -10.885 699 HG2 GLN 746 HG2 GLN 746 -5.422 3.004 -9.774 700 HG3 GLN 746 HG3 GLN 746 -5.977 1.506 -9.022 701 HE21 GLN 746 HE21 GLN 746 -4.147 0.417 -10.173 702 HE22 GLN 746 HE22 GLN 746 -4.331 -0.002 -11.807 703 H GLN 747 H GLN 747 -10.451 2.634 -9.034 704 HA GLN 747 HA GLN 747 -11.289 5.346 -9.882 705 HB2 GLN 747 HB2 GLN 747 -12.680 2.685 -10.291 706 HB3 GLN 747 HB3 GLN 747 -13.240 4.248 -10.890 707 HG2 GLN 747 HG2 GLN 747 -10.572 2.995 -11.615 708 HG3 GLN 747 HG3 GLN 747 -12.015 2.916 -12.623 709 HE21 GLN 747 HE21 GLN 747 -9.683 5.227 -11.189 710 HE22 GLN 747 HE22 GLN 747 -9.968 6.448 -12.334 711 H ASN 748 H ASN 748 -11.157 3.541 -7.179 712 HA ASN 748 HA ASN 748 -13.623 4.753 -6.067 713 HB2 ASN 748 HB2 ASN 748 -13.963 2.344 -6.297 714 HB3 ASN 748 HB3 ASN 748 -12.453 2.022 -5.455 715 HD21 ASN 748 HD21 ASN 748 -13.907 0.803 -3.894 716 HD22 ASN 748 HD22 ASN 748 -14.690 1.686 -2.675 717 H SER 749 H SER 749 -13.233 6.098 -4.431 718 HA SER 749 HA SER 749 -10.712 6.811 -3.574 719 HB2 SER 749 HB2 SER 749 -13.148 7.826 -3.214 720 HB3 SER 749 HB3 SER 749 -12.945 7.063 -1.645 721 HG SER 749 HG SER 749 -10.669 8.317 -2.348 722 H LEU 750 H LEU 750 -9.340 6.182 -1.985 723 HA LEU 750 HA LEU 750 -9.507 3.516 -1.016 724 HB2 LEU 750 HB2 LEU 750 -7.732 5.819 -0.219 725 HB3 LEU 750 HB3 LEU 750 -7.531 4.173 0.374 726 HG LEU 750 HG LEU 750 -7.842 4.141 -2.495 727 HD11 LEU 750 HD11 LEU 750 -5.470 5.722 -1.506 728 HD12 LEU 750 HD12 LEU 750 -5.970 5.446 -3.175 729 HD13 LEU 750 HD13 LEU 750 -6.931 6.485 -2.126 730 HD21 LEU 750 HD21 LEU 750 -5.686 2.955 -2.340 731 HD22 LEU 750 HD22 LEU 750 -5.503 3.495 -0.673 732 HD23 LEU 750 HD23 LEU 750 -6.801 2.381 -1.100 733 H LYS 751 H LYS 751 -10.466 6.588 0.377 734 HA LYS 751 HA LYS 751 -10.573 5.998 3.062 735 HB2 LYS 751 HB2 LYS 751 -12.456 7.571 3.228 736 HB3 LYS 751 HB3 LYS 751 -11.151 8.192 2.234 737 HG2 LYS 751 HG2 LYS 751 -12.632 7.011 0.310 738 HG3 LYS 751 HG3 LYS 751 -13.912 7.431 1.457 739 HD2 LYS 751 HD2 LYS 751 -13.054 9.742 1.565 740 HD3 LYS 751 HD3 LYS 751 -11.791 9.316 0.420 741 HE2 LYS 751 HE2 LYS 751 -14.117 8.537 -0.871 742 HE3 LYS 751 HE3 LYS 751 -14.547 10.064 -0.088 743 HZ1 LYS 751 HZ1 LYS 751 -13.547 10.649 -2.128 744 HZ2 LYS 751 HZ2 LYS 751 -12.342 10.936 -0.928 745 HZ3 LYS 751 HZ3 LYS 751 -12.266 9.522 -1.918 746 H ASP 752 H ASP 752 -12.276 4.521 0.513 747 HA ASP 752 HA ASP 752 -14.568 3.560 1.928 748 HB2 ASP 752 HB2 ASP 752 -14.665 3.409 -0.426 749 HB3 ASP 752 HB3 ASP 752 -13.073 2.673 -0.530 750 H CYS 753 H CYS 753 -11.225 2.644 1.765 751 HA CYS 753 HA CYS 753 -11.709 0.376 3.629 752 HB2 CYS 753 HB2 CYS 753 -9.824 0.717 1.361 753 HB3 CYS 753 HB3 CYS 753 -9.198 -0.054 2.806 754 HG CYS 753 HG CYS 753 -11.181 -1.310 0.874 755 H PHE 754 H PHE 754 -9.577 2.991 2.647 756 HA PHE 754 HA PHE 754 -7.909 2.862 4.938 757 HB2 PHE 754 HB2 PHE 754 -8.354 4.884 2.772 758 HB3 PHE 754 HB3 PHE 754 -7.281 5.219 4.131 759 HD1 PHE 754 HD2 PHE 754 -8.006 2.332 1.832 760 HD2 PHE 754 HD1 PHE 754 -5.026 4.745 3.769 761 HE1 PHE 754 HE2 PHE 754 -6.222 0.996 0.755 762 HE2 PHE 754 HE1 PHE 754 -3.243 3.410 2.688 763 HZ PHE 754 HZ PHE 754 -3.842 1.534 1.185 764 H LYS 755 H LYS 755 -7.696 4.591 6.547 765 HA LYS 755 HA LYS 755 -10.312 5.231 7.635 766 HB2 LYS 755 HB2 LYS 755 -7.808 6.148 8.958 767 HB3 LYS 755 HB3 LYS 755 -9.255 5.417 9.654 768 HG2 LYS 755 HG2 LYS 755 -7.039 4.027 8.129 769 HG3 LYS 755 HG3 LYS 755 -7.520 3.760 9.801 770 HD2 LYS 755 HD2 LYS 755 -9.846 3.128 8.759 771 HD3 LYS 755 HD3 LYS 755 -8.922 2.908 7.277 772 HE2 LYS 755 HE2 LYS 755 -9.113 0.787 8.491 773 HE3 LYS 755 HE3 LYS 755 -7.431 1.323 8.429 774 HZ1 LYS 755 HZ1 LYS 755 -8.914 2.351 10.695 775 HZ2 LYS 755 HZ2 LYS 755 -8.757 0.641 10.676 776 HZ3 LYS 755 HZ3 LYS 755 -7.358 1.617 10.625 777 H SER 756 H SER 756 -7.366 7.204 7.189 778 HA SER 756 HA SER 756 -9.068 9.582 6.962 779 HB2 SER 756 HB2 SER 756 -7.153 10.861 7.435 780 HB3 SER 756 HB3 SER 756 -6.946 9.420 8.430 781 HG SER 756 HG SER 756 -5.179 9.088 7.367 782 H LEU 757 H LEU 757 -6.811 7.639 5.157 783 HA LEU 757 HA LEU 757 -6.111 9.058 2.956 784 HB2 LEU 757 HB2 LEU 757 -5.934 6.491 3.603 785 HB3 LEU 757 HB3 LEU 757 -7.285 6.364 2.485 786 HG LEU 757 HG LEU 757 -5.333 6.020 1.185 787 HD11 LEU 757 HD11 LEU 757 -7.041 7.596 0.259 788 HD12 LEU 757 HD12 LEU 757 -6.028 8.924 0.825 789 HD13 LEU 757 HD13 LEU 757 -5.415 7.809 -0.391 790 HD21 LEU 757 HD21 LEU 757 -4.242 8.571 2.373 791 HD22 LEU 757 HD22 LEU 757 -3.755 6.944 2.870 792 HD23 LEU 757 HD23 LEU 757 -3.420 7.513 1.233 793 H ASP 758 H ASP 758 -7.439 10.543 1.980 794 HA ASP 758 HA ASP 758 -10.032 9.531 1.010 795 HB2 ASP 758 HB2 ASP 758 -10.053 11.450 2.705 796 HB3 ASP 758 HB3 ASP 758 -9.394 12.451 1.415 797 H THR 759 H THR 759 -8.694 8.670 -0.761 798 HA THR 759 HA THR 759 -8.953 10.333 -3.058 799 HB THR 759 HB THR 759 -6.808 11.258 -2.143 800 HG1 THR 759 HG1 THR 759 -6.031 11.396 -4.144 801 HG21 THR 759 HG21 THR 759 -6.161 8.408 -2.113 802 HG22 THR 759 HG22 THR 759 -4.958 9.362 -2.973 803 HG23 THR 759 HG23 THR 759 -5.355 9.749 -1.301 804 H THR 760 H THR 760 -7.139 9.043 -4.777 805 HA THR 760 HA THR 760 -7.905 6.184 -4.554 806 HB THR 760 HB THR 760 -8.254 6.220 -7.056 807 HG1 THR 760 HG1 THR 760 -8.861 8.852 -7.090 808 HG21 THR 760 HG21 THR 760 -10.506 7.263 -6.899 809 HG22 THR 760 HG22 THR 760 -10.158 6.181 -5.551 810 HG23 THR 760 HG23 THR 760 -10.054 7.927 -5.327 811 H LEU 761 H LEU 761 -6.677 4.809 -6.145 812 HA LEU 761 HA LEU 761 -3.870 5.211 -5.831 813 HB2 LEU 761 HB2 LEU 761 -5.487 3.300 -7.542 814 HB3 LEU 761 HB3 LEU 761 -3.730 3.280 -7.497 815 HG LEU 761 HG LEU 761 -4.584 1.614 -5.943 816 HD11 LEU 761 HD11 LEU 761 -2.987 2.127 -4.442 817 HD12 LEU 761 HD12 LEU 761 -2.828 3.678 -5.259 818 HD13 LEU 761 HD13 LEU 761 -3.890 3.526 -3.863 819 HD21 LEU 761 HD21 LEU 761 -6.132 2.088 -4.220 820 HD22 LEU 761 HD22 LEU 761 -5.955 3.828 -4.424 821 HD23 LEU 761 HD23 LEU 761 -6.791 2.879 -5.650 822 H GLN 762 H GLN 762 -3.682 7.368 -6.698 823 HA GLN 762 HA GLN 762 -4.370 8.082 -9.333 824 HB2 GLN 762 HB2 GLN 762 -2.326 9.174 -7.401 825 HB3 GLN 762 HB3 GLN 762 -2.616 9.898 -8.980 826 HG2 GLN 762 HG2 GLN 762 -5.174 9.509 -7.865 827 HG3 GLN 762 HG3 GLN 762 -4.183 10.140 -6.551 828 HE21 GLN 762 HE21 GLN 762 -2.871 12.188 -7.146 829 HE22 GLN 762 HE22 GLN 762 -3.599 13.281 -8.219 830 H PHE 763 H PHE 763 -1.063 7.454 -8.117 831 HA PHE 763 HA PHE 763 -0.466 5.952 -10.538 832 HB2 PHE 763 HB2 PHE 763 1.724 7.689 -10.426 833 HB3 PHE 763 HB3 PHE 763 0.464 7.656 -11.655 834 HD1 PHE 763 HD1 PHE 763 1.477 9.201 -8.430 835 HD2 PHE 763 HD2 PHE 763 -1.202 9.368 -11.779 836 HE1 PHE 763 HE1 PHE 763 0.709 11.443 -7.701 837 HE2 PHE 763 HE2 PHE 763 -1.971 11.611 -11.053 838 HZ PHE 763 HZ PHE 763 -1.015 12.649 -9.013 839 HA PRO 764 HA PRO 764 2.211 3.773 -7.829 840 HB2 PRO 764 HB2 PRO 764 4.016 2.769 -9.628 841 HB3 PRO 764 HB3 PRO 764 2.363 2.145 -9.440 842 HG2 PRO 764 HG2 PRO 764 3.491 3.931 -11.518 843 HG3 PRO 764 HG3 PRO 764 2.233 2.691 -11.649 844 HD2 PRO 764 HD2 PRO 764 1.736 5.409 -11.539 845 HD3 PRO 764 HD3 PRO 764 0.565 4.154 -11.094 846 H PHE 765 H PHE 765 4.187 3.916 -6.747 847 HA PHE 765 HA PHE 765 5.569 6.390 -6.879 848 HB2 PHE 765 HB2 PHE 765 6.794 5.639 -5.065 849 HB3 PHE 765 HB3 PHE 765 5.346 4.644 -4.934 850 HD1 PHE 765 HD1 PHE 765 5.416 2.353 -6.265 851 HD2 PHE 765 HD2 PHE 765 8.885 4.607 -5.119 852 HE1 PHE 765 HE1 PHE 765 6.809 0.323 -6.500 853 HE2 PHE 765 HE2 PHE 765 10.283 2.572 -5.352 854 HZ PHE 765 HZ PHE 765 9.245 0.428 -6.041 855 H LYS 766 H LYS 766 6.089 3.348 -8.497 856 HA LYS 766 HA LYS 766 8.832 3.670 -9.116 857 HB2 LYS 766 HB2 LYS 766 6.587 2.078 -10.295 858 HB3 LYS 766 HB3 LYS 766 8.130 2.164 -11.134 859 HG2 LYS 766 HG2 LYS 766 8.645 1.684 -8.356 860 HG3 LYS 766 HG3 LYS 766 7.440 0.522 -8.903 861 HD2 LYS 766 HD2 LYS 766 9.612 -0.448 -9.315 862 HD3 LYS 766 HD3 LYS 766 8.937 0.019 -10.876 863 HE2 LYS 766 HE2 LYS 766 10.490 2.145 -9.539 864 HE3 LYS 766 HE3 LYS 766 11.439 0.729 -9.998 865 HZ1 LYS 766 HZ1 LYS 766 10.261 2.748 -11.657 866 HZ2 LYS 766 HZ2 LYS 766 11.463 1.608 -12.032 867 HZ3 LYS 766 HZ3 LYS 766 9.829 1.183 -12.152 868 H GLU 767 H GLU 767 5.919 5.058 -10.393 869 HA GLU 767 HA GLU 767 6.938 5.866 -12.903 870 HB2 GLU 767 HB2 GLU 767 4.493 6.061 -11.476 871 HB3 GLU 767 HB3 GLU 767 4.960 7.705 -11.907 872 HG2 GLU 767 HG2 GLU 767 5.387 6.829 -14.254 873 HG3 GLU 767 HG3 GLU 767 4.584 5.349 -13.762 874 H1 ASP 338 H1 ASP 338 14.122 2.915 7.644 875 H2 ASP 338 H2 ASP 338 14.516 2.297 6.101 876 H3 ASP 338 H3 ASP 338 15.733 2.521 7.279 877 HA ASP 338 HA ASP 338 13.827 0.352 6.978 878 HB2 ASP 338 HB2 ASP 338 15.697 -0.902 7.884 879 HB3 ASP 338 HB3 ASP 338 16.345 0.239 6.703 880 H THR 339 H THR 339 14.151 -1.035 9.255 881 HA THR 339 HA THR 339 13.323 -1.328 11.371 882 HB THR 339 HB THR 339 14.338 1.504 11.713 883 HG1 THR 339 HG1 THR 339 15.979 0.110 11.071 884 HG21 THR 339 HG21 THR 339 12.710 0.211 13.454 885 HG22 THR 339 HG22 THR 339 14.272 -0.431 13.960 886 HG23 THR 339 HG23 THR 339 13.991 1.309 13.964 887 H GLU 340 H GLU 340 12.473 1.983 10.306 888 HA GLU 340 HA GLU 340 9.981 1.953 11.754 889 HB2 GLU 340 HB2 GLU 340 11.416 3.995 11.116 890 HB3 GLU 340 HB3 GLU 340 10.674 3.857 9.522 891 HG2 GLU 340 HG2 GLU 340 8.442 4.036 10.513 892 HG3 GLU 340 HG3 GLU 340 9.138 4.094 12.128 893 H VAL 341 H VAL 341 9.350 -0.187 10.722 894 HA VAL 341 HA VAL 341 8.432 -0.146 7.986 895 HB VAL 341 HB VAL 341 7.439 -2.340 8.520 896 HG11 VAL 341 HG11 VAL 341 9.549 -2.999 8.064 897 HG12 VAL 341 HG12 VAL 341 10.236 -1.607 8.901 898 HG13 VAL 341 HG13 VAL 341 9.816 -3.061 9.805 899 HG21 VAL 341 HG21 VAL 341 8.339 -1.676 11.342 900 HG22 VAL 341 HG22 VAL 341 6.673 -1.869 10.798 901 HG23 VAL 341 HG23 VAL 341 7.761 -3.255 10.815 902 H TYR 342 H TYR 342 6.187 -0.355 7.327 903 HA TYR 342 HA TYR 342 4.516 1.628 8.250 904 HB2 TYR 342 HB2 TYR 342 2.642 -0.063 7.323 905 HB3 TYR 342 HB3 TYR 342 3.676 0.896 6.276 906 HD1 TYR 342 HD2 TYR 342 4.739 -2.093 8.264 907 HD2 TYR 342 HD1 TYR 342 3.792 -0.511 4.381 908 HE1 TYR 342 HE2 TYR 342 5.563 -4.179 7.209 909 HE2 TYR 342 HE1 TYR 342 4.613 -2.592 3.341 910 HH TYR 342 HH TYR 342 4.968 -5.395 4.846 911 H GLU 343 H GLU 343 4.060 1.902 10.285 912 HA GLU 343 HA GLU 343 3.560 -0.187 12.155 913 HB2 GLU 343 HB2 GLU 343 2.662 1.866 13.517 914 HB3 GLU 343 HB3 GLU 343 4.381 1.755 13.137 915 HG2 GLU 343 HG2 GLU 343 2.552 3.152 11.205 916 HG3 GLU 343 HG3 GLU 343 3.064 3.995 12.661 917 H SER 344 H SER 344 1.232 2.426 11.876 918 HA SER 344 HA SER 344 -0.893 1.074 10.648 919 HB2 SER 344 HB2 SER 344 -0.642 0.625 13.608 920 HB3 SER 344 HB3 SER 344 -2.222 0.654 12.835 921 HG SER 344 HG SER 344 -0.069 -0.907 11.835 922 HA PRO 345 HA PRO 345 -1.354 5.650 11.183 923 HB2 PRO 345 HB2 PRO 345 -3.352 4.833 9.076 924 HB3 PRO 345 HB3 PRO 345 -2.327 6.276 9.127 925 HG2 PRO 345 HG2 PRO 345 -1.692 4.234 7.601 926 HG3 PRO 345 HG3 PRO 345 -0.443 5.105 8.507 927 HD2 PRO 345 HD2 PRO 345 -1.580 2.391 9.015 928 HD3 PRO 345 HD3 PRO 345 0.043 3.019 9.368 929 H PTR 346 H PTR 346 -4.013 3.289 10.778 930 HA PTR 346 HA PTR 346 -5.153 3.934 13.316 931 HB2 PTR 346 HB2 PTR 346 -6.670 5.501 12.833 932 HB3 PTR 346 HB3 PTR 346 -7.326 4.525 11.528 933 HD1 PTR 346 HD1 PTR 346 -5.607 4.440 9.380 934 HD2 PTR 346 HD2 PTR 346 -5.951 7.609 12.250 935 HE1 PTR 346 HE1 PTR 346 -4.652 6.020 7.723 936 HE2 PTR 346 HE2 PTR 346 -4.991 9.198 10.613 937 H ALA 347 H ALA 347 -6.478 2.400 14.033 938 HA ALA 347 HA ALA 347 -7.515 0.316 12.170 939 HB1 ALA 347 HB1 ALA 347 -6.252 -0.049 14.917 940 HB2 ALA 347 HB2 ALA 347 -5.615 -0.640 13.382 941 HB3 ALA 347 HB3 ALA 347 -7.108 -1.317 14.037 942 H ASP 348 H ASP 348 -8.768 2.641 12.891 943 HA ASP 348 HA ASP 348 -10.295 3.297 14.818 944 HB2 ASP 348 HB2 ASP 348 -12.327 2.813 12.970 945 HB3 ASP 348 HB3 ASP 348 -11.332 4.261 13.084 946 HA PRO 349 HA PRO 349 -11.689 -0.802 16.354 947 HB2 PRO 349 HB2 PRO 349 -12.023 0.116 18.952 948 HB3 PRO 349 HB3 PRO 349 -10.530 -0.604 18.324 949 HG2 PRO 349 HG2 PRO 349 -11.214 2.233 18.799 950 HG3 PRO 349 HG3 PRO 349 -9.649 1.414 18.899 951 HD2 PRO 349 HD2 PRO 349 -10.384 3.045 16.806 952 HD3 PRO 349 HD3 PRO 349 -9.188 1.741 16.666 953 H GLU 350 H GLU 350 -13.092 2.266 16.091 954 HA GLU 350 HA GLU 350 -15.794 1.176 16.525 955 HB2 GLU 350 HB2 GLU 350 -14.724 3.780 17.636 956 HB3 GLU 350 HB3 GLU 350 -16.439 3.383 17.550 957 HG2 GLU 350 HG2 GLU 350 -16.317 2.012 19.347 958 HG3 GLU 350 HG3 GLU 350 -14.856 1.233 18.754 Start of MODEL 8 1 H1 GLY 661 H1 GLY 661 6.332 -15.785 -10.182 2 H2 GLY 661 H2 GLY 661 6.940 -14.213 -9.978 3 H3 GLY 661 H3 GLY 661 6.425 -15.112 -8.622 4 HA2 GLY 661 HA2 GLY 661 8.656 -16.004 -10.373 5 HA3 GLY 661 HA3 GLY 661 8.912 -14.974 -8.963 6 H HIS 662 H HIS 662 8.207 -15.781 -6.860 7 HA HIS 662 HA HIS 662 8.770 -18.614 -6.560 8 HB2 HIS 662 HB2 HIS 662 7.847 -16.726 -4.388 9 HB3 HIS 662 HB3 HIS 662 8.805 -18.195 -4.214 10 HD1 HIS 662 HD1 HIS 662 9.056 -14.721 -5.772 11 HD2 HIS 662 HD2 HIS 662 11.542 -17.748 -4.290 12 HE1 HIS 662 HE1 HIS 662 11.437 -13.813 -5.821 13 HE2 HIS 662 HE2 HIS 662 12.955 -15.643 -4.925 14 H MET 663 H MET 663 6.017 -16.489 -6.591 15 HA MET 663 HA MET 663 4.085 -18.380 -7.135 16 HB2 MET 663 HB2 MET 663 4.863 -18.405 -4.325 17 HB3 MET 663 HB3 MET 663 3.143 -18.072 -4.526 18 HG2 MET 663 HG2 MET 663 3.597 -20.119 -6.339 19 HG3 MET 663 HG3 MET 663 4.614 -20.565 -4.968 20 HE1 MET 663 HE1 MET 663 3.101 -22.521 -5.410 21 HE2 MET 663 HE2 MET 663 1.658 -22.821 -4.448 22 HE3 MET 663 HE3 MET 663 1.518 -22.057 -6.032 23 H GLN 664 H GLN 664 3.705 -16.211 -4.430 24 HA GLN 664 HA GLN 664 1.856 -14.562 -6.010 25 HB2 GLN 664 HB2 GLN 664 1.178 -15.566 -3.796 26 HB3 GLN 664 HB3 GLN 664 2.359 -14.514 -3.021 27 HG2 GLN 664 HG2 GLN 664 0.767 -12.915 -4.794 28 HG3 GLN 664 HG3 GLN 664 -0.321 -13.889 -3.809 29 HE21 GLN 664 HE21 GLN 664 2.769 -12.114 -3.223 30 HE22 GLN 664 HE22 GLN 664 2.215 -11.352 -1.803 31 H ASP 665 H ASP 665 4.414 -14.140 -6.799 32 HA ASP 665 HA ASP 665 5.741 -12.070 -5.328 33 HB2 ASP 665 HB2 ASP 665 6.114 -12.617 -8.258 34 HB3 ASP 665 HB3 ASP 665 7.292 -12.036 -7.084 35 H LEU 666 H LEU 666 3.859 -10.706 -5.030 36 HA LEU 666 HA LEU 666 2.407 -9.376 -6.991 37 HB2 LEU 666 HB2 LEU 666 3.357 -8.254 -4.348 38 HB3 LEU 666 HB3 LEU 666 2.024 -7.627 -5.309 39 HG LEU 666 HG LEU 666 2.128 -10.457 -4.235 40 HD11 LEU 666 HD11 LEU 666 2.051 -8.799 -2.399 41 HD12 LEU 666 HD12 LEU 666 0.654 -8.038 -3.159 42 HD13 LEU 666 HD13 LEU 666 0.531 -9.683 -2.535 43 HD21 LEU 666 HD21 LEU 666 0.672 -10.270 -6.146 44 HD22 LEU 666 HD22 LEU 666 -0.354 -10.281 -4.713 45 HD23 LEU 666 HD23 LEU 666 -0.016 -8.763 -5.542 46 H SER 667 H SER 667 5.724 -9.058 -6.193 47 HA SER 667 HA SER 667 6.428 -6.474 -6.790 48 HB2 SER 667 HB2 SER 667 8.530 -7.561 -7.823 49 HB3 SER 667 HB3 SER 667 8.166 -7.914 -6.135 50 HG SER 667 HG SER 667 6.968 -9.579 -8.003 51 H VAL 668 H VAL 668 4.995 -8.765 -8.894 52 HA VAL 668 HA VAL 668 5.926 -7.745 -11.377 53 HB VAL 668 HB VAL 668 4.020 -8.973 -12.346 54 HG11 VAL 668 HG11 VAL 668 4.528 -11.224 -11.138 55 HG12 VAL 668 HG12 VAL 668 5.858 -10.387 -11.941 56 HG13 VAL 668 HG13 VAL 668 5.677 -10.280 -10.190 57 HG21 VAL 668 HG21 VAL 668 2.126 -9.276 -11.158 58 HG22 VAL 668 HG22 VAL 668 3.011 -10.226 -9.964 59 HG23 VAL 668 HG23 VAL 668 2.874 -8.477 -9.776 60 H HIS 669 H HIS 669 3.590 -6.637 -9.071 61 HA HIS 669 HA HIS 669 2.157 -4.976 -10.981 62 HB2 HIS 669 HB2 HIS 669 2.024 -4.882 -7.963 63 HB3 HIS 669 HB3 HIS 669 0.835 -4.267 -9.113 64 HD1 HIS 669 HD1 HIS 669 0.132 -6.349 -10.952 65 HD2 HIS 669 HD2 HIS 669 1.226 -7.367 -7.062 66 HE1 HIS 669 HE1 HIS 669 -0.756 -8.689 -10.552 67 HE2 HIS 669 HE2 HIS 669 -0.105 -9.324 -8.180 68 H LEU 670 H LEU 670 2.731 -3.037 -11.607 69 HA LEU 670 HA LEU 670 5.099 -1.776 -11.110 70 HB2 LEU 670 HB2 LEU 670 3.460 -1.231 -12.920 71 HB3 LEU 670 HB3 LEU 670 2.490 -0.372 -11.729 72 HG LEU 670 HG LEU 670 4.387 1.155 -11.285 73 HD11 LEU 670 HD11 LEU 670 5.739 -0.472 -13.455 74 HD12 LEU 670 HD12 LEU 670 6.320 1.098 -12.888 75 HD13 LEU 670 HD13 LEU 670 6.277 -0.283 -11.785 76 HD21 LEU 670 HD21 LEU 670 3.933 0.962 -14.267 77 HD22 LEU 670 HD22 LEU 670 2.689 1.536 -13.158 78 HD23 LEU 670 HD23 LEU 670 4.213 2.412 -13.304 79 H TRP 671 H TRP 671 2.188 -1.606 -9.114 80 HA TRP 671 HA TRP 671 3.345 0.545 -7.525 81 HB2 TRP 671 HB2 TRP 671 1.223 0.012 -6.078 82 HB3 TRP 671 HB3 TRP 671 1.075 0.897 -7.589 83 HD1 TRP 671 HD1 TRP 671 -0.294 -0.179 -9.503 84 HE1 TRP 671 HE1 TRP 671 -1.686 -2.361 -9.731 85 HE3 TRP 671 HE3 TRP 671 1.195 -2.595 -5.249 86 HZ2 TRP 671 HZ2 TRP 671 -2.063 -4.779 -8.294 87 HZ3 TRP 671 HZ3 TRP 671 0.289 -4.840 -4.704 88 HH2 TRP 671 HH2 TRP 671 -1.334 -5.935 -6.226 89 H TYR 672 H TYR 672 3.996 -2.633 -7.703 90 HA TYR 672 HA TYR 672 4.225 -3.002 -4.782 91 HB2 TYR 672 HB2 TYR 672 3.340 -4.768 -6.581 92 HB3 TYR 672 HB3 TYR 672 5.058 -5.140 -6.674 93 HD1 TYR 672 HD2 TYR 672 2.166 -4.855 -4.394 94 HD2 TYR 672 HD1 TYR 672 6.198 -6.239 -4.853 95 HE1 TYR 672 HE2 TYR 672 1.985 -6.087 -2.248 96 HE2 TYR 672 HE1 TYR 672 6.020 -7.469 -2.707 97 HH TYR 672 HH TYR 672 4.184 -6.941 -0.444 98 H ALA 673 H ALA 673 6.012 -2.120 -3.980 99 HA ALA 673 HA ALA 673 8.449 -1.938 -5.543 100 HB1 ALA 673 HB1 ALA 673 7.640 -0.178 -3.919 101 HB2 ALA 673 HB2 ALA 673 9.314 -0.682 -3.695 102 HB3 ALA 673 HB3 ALA 673 8.054 -1.291 -2.619 103 H GLY 674 H GLY 674 7.020 -4.217 -3.488 104 HA2 GLY 674 HA2 GLY 674 7.720 -6.232 -2.637 105 HA3 GLY 674 HA3 GLY 674 9.065 -6.125 -3.762 106 HA PRO 675 HA PRO 675 11.484 -5.991 -0.006 107 HB2 PRO 675 HB2 PRO 675 13.917 -5.613 -1.237 108 HB3 PRO 675 HB3 PRO 675 13.103 -7.185 -1.122 109 HG2 PRO 675 HG2 PRO 675 13.205 -5.270 -3.401 110 HG3 PRO 675 HG3 PRO 675 13.308 -7.040 -3.405 111 HD2 PRO 675 HD2 PRO 675 11.020 -5.712 -4.066 112 HD3 PRO 675 HD3 PRO 675 11.006 -7.310 -3.281 113 H MET 676 H MET 676 10.072 -3.704 -0.433 114 HA MET 676 HA MET 676 12.086 -1.533 -0.203 115 HB2 MET 676 HB2 MET 676 10.497 -1.319 -2.110 116 HB3 MET 676 HB3 MET 676 9.169 -1.291 -0.953 117 HG2 MET 676 HG2 MET 676 9.610 0.851 -0.299 118 HG3 MET 676 HG3 MET 676 11.357 0.614 -0.372 119 HE1 MET 676 HE1 MET 676 12.812 1.690 -2.192 120 HE2 MET 676 HE2 MET 676 12.497 0.011 -2.624 121 HE3 MET 676 HE3 MET 676 12.441 1.272 -3.862 122 H GLU 677 H GLU 677 11.827 -0.014 1.417 123 HA GLU 677 HA GLU 677 10.247 -0.956 3.712 124 HB2 GLU 677 HB2 GLU 677 11.851 0.761 4.899 125 HB3 GLU 677 HB3 GLU 677 12.413 -0.849 4.483 126 HG2 GLU 677 HG2 GLU 677 13.343 0.061 2.352 127 HG3 GLU 677 HG3 GLU 677 12.880 1.673 2.885 128 H ARG 678 H ARG 678 9.254 0.658 5.065 129 HA ARG 678 HA ARG 678 7.588 2.414 3.672 130 HB2 ARG 678 HB2 ARG 678 6.918 1.711 5.842 131 HB3 ARG 678 HB3 ARG 678 8.425 2.265 6.566 132 HG2 ARG 678 HG2 ARG 678 6.756 4.293 5.150 133 HG3 ARG 678 HG3 ARG 678 6.183 3.718 6.713 134 HD2 ARG 678 HD2 ARG 678 8.653 4.157 7.475 135 HD3 ARG 678 HD3 ARG 678 8.720 5.185 6.049 136 HE ARG 678 HE ARG 678 7.369 6.720 7.124 137 HH11 ARG 678 HH21 ARG 678 7.201 3.614 8.662 138 HH12 ARG 678 HH22 ARG 678 6.347 4.211 10.070 139 HH21 ARG 678 HH11 ARG 678 6.222 7.463 8.924 140 HH22 ARG 678 HH12 ARG 678 5.775 6.361 10.210 141 H ALA 679 H ALA 679 10.404 3.185 5.724 142 HA ALA 679 HA ALA 679 10.586 5.918 5.316 143 HB1 ALA 679 HB1 ALA 679 13.031 5.624 5.702 144 HB2 ALA 679 HB2 ALA 679 12.815 3.883 5.515 145 HB3 ALA 679 HB3 ALA 679 12.044 4.726 6.857 146 H GLY 680 H GLY 680 11.601 3.293 3.234 147 HA2 GLY 680 HA2 GLY 680 12.893 4.953 1.273 148 HA3 GLY 680 HA3 GLY 680 12.467 3.253 1.086 149 H ALA 681 H ALA 681 9.777 3.267 1.537 150 HA ALA 681 HA ALA 681 8.671 3.948 -0.927 151 HB1 ALA 681 HB1 ALA 681 7.543 2.389 0.512 152 HB2 ALA 681 HB2 ALA 681 6.460 3.760 0.269 153 HB3 ALA 681 HB3 ALA 681 7.363 3.603 1.776 154 H GLU 682 H GLU 682 8.658 5.803 2.109 155 HA GLU 682 HA GLU 682 7.071 7.937 1.183 156 HB2 GLU 682 HB2 GLU 682 9.270 8.361 3.190 157 HB3 GLU 682 HB3 GLU 682 7.651 9.066 3.151 158 HG2 GLU 682 HG2 GLU 682 6.997 6.458 3.371 159 HG3 GLU 682 HG3 GLU 682 8.537 6.425 4.187 160 H SER 683 H SER 683 10.482 7.226 0.910 161 HA SER 683 HA SER 683 11.416 9.746 0.124 162 HB2 SER 683 HB2 SER 683 13.380 8.653 -0.585 163 HB3 SER 683 HB3 SER 683 12.761 7.642 0.717 164 HG SER 683 HG SER 683 11.896 6.241 -0.807 165 H ILE 684 H ILE 684 10.579 6.983 -1.980 166 HA ILE 684 HA ILE 684 10.759 8.449 -4.398 167 HB ILE 684 HB ILE 684 8.890 6.112 -3.997 168 HG12 ILE 684 HG12 ILE 684 11.381 5.152 -4.903 169 HG13 ILE 684 HG13 ILE 684 11.758 6.199 -3.534 170 HG21 ILE 684 HG21 ILE 684 9.077 5.833 -6.287 171 HG22 ILE 684 HG22 ILE 684 9.297 7.579 -6.191 172 HG23 ILE 684 HG23 ILE 684 10.699 6.521 -6.344 173 HD11 ILE 684 HD11 ILE 684 11.340 4.083 -2.555 174 HD12 ILE 684 HD12 ILE 684 9.843 4.983 -2.311 175 HD13 ILE 684 HD13 ILE 684 9.951 3.782 -3.598 176 H LEU 685 H LEU 685 8.016 7.611 -2.321 177 HA LEU 685 HA LEU 685 6.006 8.865 -3.833 178 HB2 LEU 685 HB2 LEU 685 6.240 8.377 -0.858 179 HB3 LEU 685 HB3 LEU 685 4.774 8.968 -1.640 180 HG LEU 685 HG LEU 685 6.191 6.388 -2.371 181 HD11 LEU 685 HD11 LEU 685 5.118 6.393 -0.100 182 HD12 LEU 685 HD12 LEU 685 3.583 6.772 -0.883 183 HD13 LEU 685 HD13 LEU 685 4.395 5.247 -1.225 184 HD21 LEU 685 HD21 LEU 685 5.000 7.152 -4.278 185 HD22 LEU 685 HD22 LEU 685 3.906 6.010 -3.501 186 HD23 LEU 685 HD23 LEU 685 3.657 7.743 -3.300 187 H ALA 686 H ALA 686 7.817 10.145 -1.011 188 HA ALA 686 HA ALA 686 6.801 12.747 -1.051 189 HB1 ALA 686 HB1 ALA 686 8.911 13.383 0.077 190 HB2 ALA 686 HB2 ALA 686 9.606 11.822 -0.364 191 HB3 ALA 686 HB3 ALA 686 8.238 11.896 0.748 192 H ASN 687 H ASN 687 9.386 11.268 -2.955 193 HA ASN 687 HA ASN 687 10.196 13.709 -4.238 194 HB2 ASN 687 HB2 ASN 687 11.584 11.582 -3.961 195 HB3 ASN 687 HB3 ASN 687 10.642 10.915 -5.291 196 HD21 ASN 687 HD21 ASN 687 10.434 13.609 -6.655 197 HD22 ASN 687 HD22 ASN 687 11.979 13.877 -7.310 198 H ARG 688 H ARG 688 7.835 11.189 -4.944 199 HA ARG 688 HA ARG 688 7.380 12.070 -7.658 200 HB2 ARG 688 HB2 ARG 688 6.781 9.783 -6.215 201 HB3 ARG 688 HB3 ARG 688 5.207 10.553 -6.407 202 HG2 ARG 688 HG2 ARG 688 5.306 9.373 -8.399 203 HG3 ARG 688 HG3 ARG 688 6.068 10.878 -8.913 204 HD2 ARG 688 HD2 ARG 688 8.298 9.885 -8.389 205 HD3 ARG 688 HD3 ARG 688 7.499 8.371 -7.982 206 HE ARG 688 HE ARG 688 7.067 7.987 -10.283 207 HH11 ARG 688 HH21 ARG 688 8.446 11.110 -9.699 208 HH12 ARG 688 HH22 ARG 688 8.807 11.400 -11.363 209 HH21 ARG 688 HH11 ARG 688 7.529 8.355 -12.427 210 HH22 ARG 688 HH12 ARG 688 8.289 9.845 -12.906 211 H SER 689 H SER 689 4.424 11.908 -7.448 212 HA SER 689 HA SER 689 3.973 14.642 -6.391 213 HB2 SER 689 HB2 SER 689 3.580 13.956 -8.910 214 HB3 SER 689 HB3 SER 689 2.060 13.327 -8.272 215 HG SER 689 HG SER 689 2.428 15.746 -8.935 216 H ASP 690 H ASP 690 1.921 15.105 -5.379 217 HA ASP 690 HA ASP 690 1.174 13.208 -3.454 218 HB2 ASP 690 HB2 ASP 690 0.620 15.890 -3.905 219 HB3 ASP 690 HB3 ASP 690 -0.950 15.107 -4.068 220 H GLY 691 H GLY 691 -0.159 11.546 -3.469 221 HA2 GLY 691 HA2 GLY 691 -2.286 10.547 -4.229 222 HA3 GLY 691 HA3 GLY 691 -1.922 11.184 -5.833 223 H THR 692 H THR 692 0.948 10.585 -5.537 224 HA THR 692 HA THR 692 1.129 8.105 -6.806 225 HB THR 692 HB THR 692 3.280 9.277 -5.025 226 HG1 THR 692 HG1 THR 692 2.689 10.933 -6.338 227 HG21 THR 692 HG21 THR 692 3.556 7.816 -7.653 228 HG22 THR 692 HG22 THR 692 4.799 8.129 -6.442 229 HG23 THR 692 HG23 THR 692 3.520 6.962 -6.109 230 H PHE 693 H PHE 693 1.467 5.986 -6.091 231 HA PHE 693 HA PHE 693 1.569 5.541 -3.184 232 HB2 PHE 693 HB2 PHE 693 -0.358 4.142 -3.154 233 HB3 PHE 693 HB3 PHE 693 -0.832 5.619 -3.994 234 HD1 PHE 693 HD1 PHE 693 -0.963 5.653 -6.498 235 HD2 PHE 693 HD2 PHE 693 -0.274 2.030 -4.293 236 HE1 PHE 693 HE1 PHE 693 -1.566 4.319 -8.500 237 HE2 PHE 693 HE2 PHE 693 -0.878 0.701 -6.294 238 HZ PHE 693 HZ PHE 693 -1.521 1.842 -8.398 239 H LEU 694 H LEU 694 1.636 3.122 -2.688 240 HA LEU 694 HA LEU 694 2.569 1.275 -4.625 241 HB2 LEU 694 HB2 LEU 694 4.917 1.145 -4.105 242 HB3 LEU 694 HB3 LEU 694 4.542 2.798 -4.564 243 HG LEU 694 HG LEU 694 4.148 3.013 -1.918 244 HD11 LEU 694 HD11 LEU 694 6.546 1.213 -1.963 245 HD12 LEU 694 HD12 LEU 694 5.477 1.611 -0.620 246 HD13 LEU 694 HD13 LEU 694 4.946 0.484 -1.864 247 HD21 LEU 694 HD21 LEU 694 5.645 4.439 -3.196 248 HD22 LEU 694 HD22 LEU 694 6.511 3.835 -1.791 249 HD23 LEU 694 HD23 LEU 694 6.802 3.123 -3.372 250 H VAL 695 H VAL 695 3.645 -0.643 -3.581 251 HA VAL 695 HA VAL 695 2.778 -1.078 -0.791 252 HB VAL 695 HB VAL 695 2.383 -3.209 -2.888 253 HG11 VAL 695 HG11 VAL 695 0.509 -3.348 -0.791 254 HG12 VAL 695 HG12 VAL 695 1.927 -4.372 -0.998 255 HG13 VAL 695 HG13 VAL 695 2.030 -2.916 -0.009 256 HG21 VAL 695 HG21 VAL 695 -0.041 -2.521 -2.841 257 HG22 VAL 695 HG22 VAL 695 0.440 -1.070 -1.963 258 HG23 VAL 695 HG23 VAL 695 1.008 -1.331 -3.611 259 H ARG 696 H ARG 696 4.082 -2.572 0.369 260 HA ARG 696 HA ARG 696 6.510 -3.457 -1.082 261 HB2 ARG 696 HB2 ARG 696 7.556 -2.848 1.327 262 HB3 ARG 696 HB3 ARG 696 7.514 -1.722 -0.027 263 HG2 ARG 696 HG2 ARG 696 6.639 -0.562 1.891 264 HG3 ARG 696 HG3 ARG 696 5.280 -0.905 0.830 265 HD2 ARG 696 HD2 ARG 696 4.635 -1.455 3.089 266 HD3 ARG 696 HD3 ARG 696 4.817 -2.954 2.192 267 HE ARG 696 HE ARG 696 6.954 -1.915 3.971 268 HH11 ARG 696 HH21 ARG 696 5.055 -4.531 2.695 269 HH12 ARG 696 HH22 ARG 696 5.689 -5.690 3.829 270 HH21 ARG 696 HH11 ARG 696 7.790 -3.492 5.372 271 HH22 ARG 696 HH12 ARG 696 7.217 -5.130 5.258 272 H GLN 697 H GLN 697 7.808 -5.016 -0.008 273 HA GLN 697 HA GLN 697 6.463 -6.698 2.007 274 HB2 GLN 697 HB2 GLN 697 6.335 -7.382 -0.623 275 HB3 GLN 697 HB3 GLN 697 7.866 -8.133 -0.186 276 HG2 GLN 697 HG2 GLN 697 5.592 -8.521 1.703 277 HG3 GLN 697 HG3 GLN 697 5.489 -9.361 0.162 278 HE21 GLN 697 HE21 GLN 697 8.747 -8.855 1.150 279 HE22 GLN 697 HE22 GLN 697 9.024 -10.408 1.775 280 H ARG 698 H ARG 698 7.943 -6.173 3.591 281 HA ARG 698 HA ARG 698 10.781 -6.054 3.042 282 HB2 ARG 698 HB2 ARG 698 9.747 -4.573 4.701 283 HB3 ARG 698 HB3 ARG 698 9.269 -5.968 5.665 284 HG2 ARG 698 HG2 ARG 698 11.246 -5.506 6.742 285 HG3 ARG 698 HG3 ARG 698 11.903 -6.498 5.443 286 HD2 ARG 698 HD2 ARG 698 13.250 -4.691 5.112 287 HD3 ARG 698 HD3 ARG 698 11.866 -4.091 4.203 288 HE ARG 698 HE ARG 698 11.359 -3.254 6.760 289 HH11 ARG 698 HH21 ARG 698 14.045 -3.008 4.611 290 HH12 ARG 698 HH22 ARG 698 14.549 -1.441 5.186 291 HH21 ARG 698 HH11 ARG 698 12.022 -1.222 7.538 292 HH22 ARG 698 HH12 ARG 698 13.477 -0.500 6.886 293 H VAL 699 H VAL 699 9.340 -7.843 5.748 294 HA VAL 699 HA VAL 699 10.906 -10.221 4.915 295 HB VAL 699 HB VAL 699 10.526 -9.109 7.713 296 HG11 VAL 699 HG11 VAL 699 12.354 -11.150 7.895 297 HG12 VAL 699 HG12 VAL 699 10.648 -11.308 8.306 298 HG13 VAL 699 HG13 VAL 699 11.221 -11.804 6.713 299 HG21 VAL 699 HG21 VAL 699 12.398 -8.451 5.790 300 HG22 VAL 699 HG22 VAL 699 12.630 -8.282 7.529 301 HG23 VAL 699 HG23 VAL 699 13.218 -9.720 6.696 302 H LYS 700 H LYS 700 9.013 -10.219 7.827 303 HA LYS 700 HA LYS 700 6.602 -11.227 6.585 304 HB2 LYS 700 HB2 LYS 700 8.651 -13.078 7.677 305 HB3 LYS 700 HB3 LYS 700 6.983 -13.404 8.141 306 HG2 LYS 700 HG2 LYS 700 7.973 -13.085 5.292 307 HG3 LYS 700 HG3 LYS 700 7.599 -14.613 6.070 308 HD2 LYS 700 HD2 LYS 700 5.488 -14.353 5.292 309 HD3 LYS 700 HD3 LYS 700 5.304 -13.119 6.529 310 HE2 LYS 700 HE2 LYS 700 4.825 -12.614 3.940 311 HE3 LYS 700 HE3 LYS 700 5.467 -11.387 5.025 312 HZ1 LYS 700 HZ1 LYS 700 7.226 -13.183 3.459 313 HZ2 LYS 700 HZ2 LYS 700 6.668 -11.697 2.828 314 HZ3 LYS 700 HZ3 LYS 700 7.640 -11.717 4.239 315 H ASP 701 H ASP 701 7.594 -9.204 8.578 316 HA ASP 701 HA ASP 701 6.795 -9.885 11.191 317 HB2 ASP 701 HB2 ASP 701 6.489 -7.111 10.076 318 HB3 ASP 701 HB3 ASP 701 7.059 -7.612 11.667 319 H ALA 702 H ALA 702 4.838 -11.143 10.013 320 HA ALA 702 HA ALA 702 2.554 -11.402 9.840 321 HB1 ALA 702 HB1 ALA 702 1.243 -9.688 11.368 322 HB2 ALA 702 HB2 ALA 702 2.858 -9.328 11.984 323 HB3 ALA 702 HB3 ALA 702 2.217 -10.968 12.092 324 H ALA 703 H ALA 703 2.179 -7.960 10.414 325 HA ALA 703 HA ALA 703 0.670 -7.602 8.017 326 HB1 ALA 703 HB1 ALA 703 0.540 -5.288 8.661 327 HB2 ALA 703 HB2 ALA 703 1.936 -5.446 9.726 328 HB3 ALA 703 HB3 ALA 703 0.417 -6.248 10.135 329 H GLU 704 H GLU 704 2.811 -8.765 7.055 330 HA GLU 704 HA GLU 704 4.951 -7.011 6.322 331 HB2 GLU 704 HB2 GLU 704 5.126 -9.501 6.442 332 HB3 GLU 704 HB3 GLU 704 4.117 -9.601 4.999 333 HG2 GLU 704 HG2 GLU 704 6.651 -9.680 4.613 334 HG3 GLU 704 HG3 GLU 704 5.755 -8.511 3.654 335 H PHE 705 H PHE 705 1.790 -6.989 5.363 336 HA PHE 705 HA PHE 705 2.510 -5.800 2.755 337 HB2 PHE 705 HB2 PHE 705 -0.177 -7.051 3.260 338 HB3 PHE 705 HB3 PHE 705 0.588 -6.638 1.724 339 HD1 PHE 705 HD2 PHE 705 2.448 -8.013 0.832 340 HD2 PHE 705 HD1 PHE 705 0.354 -9.107 4.423 341 HE1 PHE 705 HE2 PHE 705 3.390 -10.301 0.689 342 HE2 PHE 705 HE1 PHE 705 1.297 -11.393 4.275 343 HZ PHE 705 HZ PHE 705 2.815 -11.989 2.409 344 H ALA 706 H ALA 706 2.006 -3.782 2.519 345 HA ALA 706 HA ALA 706 -0.336 -2.576 3.731 346 HB1 ALA 706 HB1 ALA 706 1.685 -2.565 5.416 347 HB2 ALA 706 HB2 ALA 706 0.737 -1.097 5.180 348 HB3 ALA 706 HB3 ALA 706 2.284 -1.282 4.369 349 H ILE 707 H ILE 707 -0.960 -0.763 2.591 350 HA ILE 707 HA ILE 707 0.609 -0.236 0.169 351 HB ILE 707 HB ILE 707 -2.153 0.775 0.869 352 HG12 ILE 707 HG12 ILE 707 -1.321 -1.645 -0.767 353 HG13 ILE 707 HG13 ILE 707 -2.051 -1.707 0.834 354 HG21 ILE 707 HG21 ILE 707 -0.391 0.796 -1.571 355 HG22 ILE 707 HG22 ILE 707 -2.143 0.779 -1.760 356 HG23 ILE 707 HG23 ILE 707 -1.365 2.101 -0.892 357 HD11 ILE 707 HD11 ILE 707 -3.302 -0.642 -1.707 358 HD12 ILE 707 HD12 ILE 707 -3.809 -2.047 -0.768 359 HD13 ILE 707 HD13 ILE 707 -4.013 -0.426 -0.105 360 H SER 708 H SER 708 1.503 1.667 -0.324 361 HA SER 708 HA SER 708 1.420 3.773 1.763 362 HB2 SER 708 HB2 SER 708 3.594 2.630 1.611 363 HB3 SER 708 HB3 SER 708 3.677 3.017 -0.102 364 HG SER 708 HG SER 708 3.845 4.700 2.141 365 H ILE 709 H ILE 709 0.523 5.626 1.126 366 HA ILE 709 HA ILE 709 0.616 6.311 -1.755 367 HB ILE 709 HB ILE 709 -1.702 7.062 0.010 368 HG12 ILE 709 HG12 ILE 709 -2.691 5.014 -1.471 369 HG13 ILE 709 HG13 ILE 709 -1.050 4.427 -1.208 370 HG21 ILE 709 HG21 ILE 709 -2.411 8.059 -1.882 371 HG22 ILE 709 HG22 ILE 709 -0.914 7.588 -2.684 372 HG23 ILE 709 HG23 ILE 709 -2.322 6.525 -2.747 373 HD11 ILE 709 HD11 ILE 709 -3.251 4.458 0.632 374 HD12 ILE 709 HD12 ILE 709 -1.633 3.795 0.870 375 HD13 ILE 709 HD13 ILE 709 -1.965 5.479 1.272 376 H LYS 710 H LYS 710 1.034 8.354 -2.308 377 HA LYS 710 HA LYS 710 2.177 10.120 -0.305 378 HB2 LYS 710 HB2 LYS 710 3.272 9.863 -2.470 379 HB3 LYS 710 HB3 LYS 710 1.810 10.373 -3.303 380 HG2 LYS 710 HG2 LYS 710 3.208 12.300 -3.232 381 HG3 LYS 710 HG3 LYS 710 1.986 12.545 -1.993 382 HD2 LYS 710 HD2 LYS 710 3.776 11.357 -0.445 383 HD3 LYS 710 HD3 LYS 710 4.893 11.947 -1.675 384 HE2 LYS 710 HE2 LYS 710 4.612 13.583 0.159 385 HE3 LYS 710 HE3 LYS 710 4.034 14.230 -1.374 386 HZ1 LYS 710 HZ1 LYS 710 2.269 12.875 0.589 387 HZ2 LYS 710 HZ2 LYS 710 2.520 14.555 0.541 388 HZ3 LYS 710 HZ3 LYS 710 1.787 13.802 -0.797 389 H TYR 711 H TYR 711 1.018 11.596 0.799 390 HA TYR 711 HA TYR 711 -1.178 13.033 -0.535 391 HB2 TYR 711 HB2 TYR 711 -1.787 10.838 0.985 392 HB3 TYR 711 HB3 TYR 711 -1.838 12.111 2.198 393 HD1 TYR 711 HD2 TYR 711 -2.760 14.375 0.309 394 HD2 TYR 711 HD1 TYR 711 -4.100 10.333 0.873 395 HE1 TYR 711 HE2 TYR 711 -5.022 15.014 -0.478 396 HE2 TYR 711 HE1 TYR 711 -6.361 10.966 0.090 397 HH TYR 711 HH TYR 711 -7.682 12.625 -0.693 398 H ASN 712 H ASN 712 -0.982 15.150 -0.097 399 HA ASN 712 HA ASN 712 -0.333 17.123 0.909 400 HB2 ASN 712 HB2 ASN 712 -2.011 16.340 2.560 401 HB3 ASN 712 HB3 ASN 712 -0.725 15.539 3.456 402 HD21 ASN 712 HD21 ASN 712 0.606 16.823 4.819 403 HD22 ASN 712 HD22 ASN 712 0.397 18.507 4.985 404 H VAL 713 H VAL 713 1.861 16.391 -0.041 405 HA VAL 713 HA VAL 713 4.131 16.046 0.170 406 HB VAL 713 HB VAL 713 5.232 17.697 1.486 407 HG11 VAL 713 HG11 VAL 713 2.594 18.424 0.315 408 HG12 VAL 713 HG12 VAL 713 3.365 19.641 1.327 409 HG13 VAL 713 HG13 VAL 713 4.206 19.011 -0.089 410 HG21 VAL 713 HG21 VAL 713 4.361 18.704 3.449 411 HG22 VAL 713 HG22 VAL 713 2.719 18.166 3.102 412 HG23 VAL 713 HG23 VAL 713 3.939 17.003 3.622 413 H GLU 714 H GLU 714 2.247 14.349 1.876 414 HA GLU 714 HA GLU 714 4.356 13.094 3.504 415 HB2 GLU 714 HB2 GLU 714 1.510 13.737 4.290 416 HB3 GLU 714 HB3 GLU 714 2.441 12.480 5.102 417 HG2 GLU 714 HG2 GLU 714 3.494 14.028 6.349 418 HG3 GLU 714 HG3 GLU 714 4.091 14.815 4.893 419 H VAL 715 H VAL 715 3.489 10.818 4.171 420 HA VAL 715 HA VAL 715 2.095 9.600 1.869 421 HB VAL 715 HB VAL 715 4.610 8.678 3.260 422 HG11 VAL 715 HG11 VAL 715 2.935 7.191 1.216 423 HG12 VAL 715 HG12 VAL 715 4.466 6.652 1.900 424 HG13 VAL 715 HG13 VAL 715 3.039 6.774 2.926 425 HG21 VAL 715 HG21 VAL 715 4.206 8.873 0.307 426 HG22 VAL 715 HG22 VAL 715 4.440 10.362 1.219 427 HG23 VAL 715 HG23 VAL 715 5.671 9.108 1.255 428 H LYS 716 H LYS 716 0.700 7.935 2.312 429 HA LYS 716 HA LYS 716 0.167 7.453 5.189 430 HB2 LYS 716 HB2 LYS 716 -1.587 8.473 3.478 431 HB3 LYS 716 HB3 LYS 716 -1.824 6.776 3.068 432 HG2 LYS 716 HG2 LYS 716 -2.745 6.255 5.118 433 HG3 LYS 716 HG3 LYS 716 -1.749 7.430 5.974 434 HD2 LYS 716 HD2 LYS 716 -4.205 8.030 4.296 435 HD3 LYS 716 HD3 LYS 716 -4.061 8.179 6.029 436 HE2 LYS 716 HE2 LYS 716 -1.984 9.754 5.263 437 HE3 LYS 716 HE3 LYS 716 -3.064 9.979 3.889 438 HZ1 LYS 716 HZ1 LYS 716 -3.300 10.957 6.572 439 HZ2 LYS 716 HZ2 LYS 716 -4.102 11.464 5.166 440 HZ3 LYS 716 HZ3 LYS 716 -4.728 10.154 6.068 441 H HIS 717 H HIS 717 0.992 5.565 5.860 442 HA HIS 717 HA HIS 717 1.004 3.271 3.990 443 HB2 HIS 717 HB2 HIS 717 2.505 3.458 6.608 444 HB3 HIS 717 HB3 HIS 717 2.754 2.307 5.301 445 HD1 HIS 717 HD1 HIS 717 4.363 2.959 3.474 446 HD2 HIS 717 HD2 HIS 717 3.437 6.160 5.975 447 HE1 HIS 717 HE1 HIS 717 5.963 4.839 2.873 448 HE2 HIS 717 HE2 HIS 717 5.384 6.818 4.396 449 H ILE 718 H ILE 718 -0.876 2.178 4.252 450 HA ILE 718 HA ILE 718 -1.807 1.624 7.021 451 HB ILE 718 HB ILE 718 -3.203 2.084 4.442 452 HG12 ILE 718 HG12 ILE 718 -3.353 3.749 6.195 453 HG13 ILE 718 HG13 ILE 718 -4.926 2.986 6.000 454 HG21 ILE 718 HG21 ILE 718 -3.947 -0.149 4.661 455 HG22 ILE 718 HG22 ILE 718 -4.011 -0.044 6.419 456 HG23 ILE 718 HG23 ILE 718 -5.208 0.802 5.442 457 HD11 ILE 718 HD11 ILE 718 -3.975 1.349 7.867 458 HD12 ILE 718 HD12 ILE 718 -2.973 2.749 8.243 459 HD13 ILE 718 HD13 ILE 718 -4.727 2.882 8.292 460 H LYS 719 H LYS 719 -1.661 -0.401 7.746 461 HA LYS 719 HA LYS 719 -0.322 -2.397 6.195 462 HB2 LYS 719 HB2 LYS 719 -0.802 -3.842 8.236 463 HB3 LYS 719 HB3 LYS 719 0.151 -2.390 8.521 464 HG2 LYS 719 HG2 LYS 719 -1.382 -2.171 10.238 465 HG3 LYS 719 HG3 LYS 719 -2.265 -1.330 8.969 466 HD2 LYS 719 HD2 LYS 719 -2.949 -4.006 8.575 467 HD3 LYS 719 HD3 LYS 719 -2.910 -3.841 10.328 468 HE2 LYS 719 HE2 LYS 719 -4.972 -2.928 10.183 469 HE3 LYS 719 HE3 LYS 719 -4.207 -1.518 9.448 470 HZ1 LYS 719 HZ1 LYS 719 -5.709 -2.120 7.819 471 HZ2 LYS 719 HZ2 LYS 719 -4.316 -2.960 7.305 472 HZ3 LYS 719 HZ3 LYS 719 -5.548 -3.786 8.141 473 H ILE 720 H ILE 720 -1.078 -4.378 5.449 474 HA ILE 720 HA ILE 720 -3.987 -4.395 4.969 475 HB ILE 720 HB ILE 720 -1.659 -5.621 3.505 476 HG12 ILE 720 HG12 ILE 720 -3.932 -3.814 2.627 477 HG13 ILE 720 HG13 ILE 720 -2.332 -3.239 3.092 478 HG21 ILE 720 HG21 ILE 720 -4.495 -6.475 3.601 479 HG22 ILE 720 HG22 ILE 720 -3.834 -6.250 1.985 480 HG23 ILE 720 HG23 ILE 720 -3.067 -7.377 3.101 481 HD11 ILE 720 HD11 ILE 720 -2.058 -5.371 1.186 482 HD12 ILE 720 HD12 ILE 720 -3.161 -4.153 0.550 483 HD13 ILE 720 HD13 ILE 720 -1.533 -3.696 1.045 484 H MET 721 H MET 721 -5.277 -5.937 5.689 485 HA MET 721 HA MET 721 -4.102 -8.053 7.376 486 HB2 MET 721 HB2 MET 721 -6.131 -6.325 7.907 487 HB3 MET 721 HB3 MET 721 -7.033 -7.693 7.273 488 HG2 MET 721 HG2 MET 721 -6.819 -8.720 9.265 489 HG3 MET 721 HG3 MET 721 -5.075 -8.773 9.021 490 HE1 MET 721 HE1 MET 721 -5.522 -9.030 11.543 491 HE2 MET 721 HE2 MET 721 -3.964 -8.215 11.416 492 HE3 MET 721 HE3 MET 721 -5.154 -7.678 12.612 493 H THR 722 H THR 722 -5.694 -10.077 7.368 494 HA THR 722 HA THR 722 -6.677 -10.739 4.719 495 HB THR 722 HB THR 722 -4.231 -11.199 4.569 496 HG1 THR 722 HG1 THR 722 -5.629 -12.386 3.313 497 HG21 THR 722 HG21 THR 722 -3.176 -12.776 5.938 498 HG22 THR 722 HG22 THR 722 -4.222 -11.939 7.084 499 HG23 THR 722 HG23 THR 722 -4.701 -13.508 6.436 500 H ALA 723 H ALA 723 -7.042 -13.244 4.722 501 HA ALA 723 HA ALA 723 -7.913 -14.413 7.168 502 HB1 ALA 723 HB1 ALA 723 -9.977 -13.249 5.284 503 HB2 ALA 723 HB2 ALA 723 -9.786 -12.918 7.004 504 HB3 ALA 723 HB3 ALA 723 -10.353 -14.499 6.474 505 H GLU 724 H GLU 724 -10.016 -15.207 4.694 506 HA GLU 724 HA GLU 724 -8.780 -17.741 4.212 507 HB2 GLU 724 HB2 GLU 724 -10.927 -16.538 2.499 508 HB3 GLU 724 HB3 GLU 724 -10.703 -18.227 2.964 509 HG2 GLU 724 HG2 GLU 724 -11.622 -15.941 4.737 510 HG3 GLU 724 HG3 GLU 724 -12.550 -17.365 4.270 511 H GLY 725 H GLY 725 -6.803 -16.144 3.646 512 HA2 GLY 725 HA2 GLY 725 -5.218 -15.681 2.019 513 HA3 GLY 725 HA3 GLY 725 -6.197 -16.620 0.893 514 H LEU 726 H LEU 726 -7.505 -13.918 2.663 515 HA LEU 726 HA LEU 726 -7.848 -12.440 0.133 516 HB2 LEU 726 HB2 LEU 726 -9.317 -12.230 2.777 517 HB3 LEU 726 HB3 LEU 726 -9.638 -11.222 1.368 518 HG LEU 726 HG LEU 726 -9.610 -14.107 0.785 519 HD11 LEU 726 HD11 LEU 726 -11.760 -12.912 2.561 520 HD12 LEU 726 HD12 LEU 726 -11.843 -14.496 1.788 521 HD13 LEU 726 HD13 LEU 726 -10.625 -14.180 3.021 522 HD21 LEU 726 HD21 LEU 726 -10.332 -12.173 -0.711 523 HD22 LEU 726 HD22 LEU 726 -11.468 -13.516 -0.596 524 HD23 LEU 726 HD23 LEU 726 -11.760 -12.035 0.315 525 H TYR 727 H TYR 727 -7.810 -10.010 0.359 526 HA TYR 727 HA TYR 727 -5.761 -9.151 2.341 527 HB2 TYR 727 HB2 TYR 727 -5.963 -8.314 -0.563 528 HB3 TYR 727 HB3 TYR 727 -4.805 -7.683 0.607 529 HD1 TYR 727 HD2 TYR 727 -5.879 -10.715 -1.239 530 HD2 TYR 727 HD1 TYR 727 -2.865 -8.947 1.259 531 HE1 TYR 727 HE2 TYR 727 -4.362 -12.622 -1.715 532 HE2 TYR 727 HE1 TYR 727 -1.350 -10.853 0.781 533 HH TYR 727 HH TYR 727 -1.108 -12.566 -1.191 534 H ARG 728 H ARG 728 -6.121 -7.251 3.381 535 HA ARG 728 HA ARG 728 -8.105 -5.359 2.377 536 HB2 ARG 728 HB2 ARG 728 -9.046 -5.482 4.872 537 HB3 ARG 728 HB3 ARG 728 -9.685 -6.478 3.568 538 HG2 ARG 728 HG2 ARG 728 -8.523 -8.397 4.268 539 HG3 ARG 728 HG3 ARG 728 -7.340 -7.459 5.172 540 HD2 ARG 728 HD2 ARG 728 -8.963 -6.951 6.894 541 HD3 ARG 728 HD3 ARG 728 -10.250 -7.683 5.947 542 HE ARG 728 HE ARG 728 -8.028 -9.455 6.578 543 HH11 ARG 728 HH21 ARG 728 -11.157 -8.276 7.429 544 HH12 ARG 728 HH22 ARG 728 -11.551 -9.652 8.400 545 HH21 ARG 728 HH11 ARG 728 -8.528 -11.243 7.833 546 HH22 ARG 728 HH12 ARG 728 -10.071 -11.322 8.632 547 H ILE 729 H ILE 729 -7.573 -3.337 2.862 548 HA ILE 729 HA ILE 729 -5.196 -2.801 4.405 549 HB ILE 729 HB ILE 729 -6.222 -0.338 3.942 550 HG12 ILE 729 HG12 ILE 729 -8.251 -1.520 2.890 551 HG13 ILE 729 HG13 ILE 729 -7.503 -0.229 1.959 552 HG21 ILE 729 HG21 ILE 729 -4.926 -1.802 1.656 553 HG22 ILE 729 HG22 ILE 729 -4.645 -0.165 2.233 554 HG23 ILE 729 HG23 ILE 729 -4.043 -1.539 3.156 555 HD11 ILE 729 HD11 ILE 729 -6.870 -1.636 0.310 556 HD12 ILE 729 HD12 ILE 729 -6.347 -2.886 1.437 557 HD13 ILE 729 HD13 ILE 729 -8.051 -2.742 1.003 558 H THR 730 H THR 730 -8.630 -2.705 4.870 559 HA THR 730 HA THR 730 -8.157 -1.772 7.632 560 HB THR 730 HB THR 730 -9.309 -0.064 6.166 561 HG1 THR 730 HG1 THR 730 -10.132 -1.076 8.611 562 HG21 THR 730 HG21 THR 730 -10.682 -1.456 4.786 563 HG22 THR 730 HG22 THR 730 -11.451 -2.198 6.183 564 HG23 THR 730 HG23 THR 730 -11.768 -0.509 5.801 565 H GLU 731 H GLU 731 -9.361 -2.721 9.215 566 HA GLU 731 HA GLU 731 -9.870 -5.465 9.012 567 HB2 GLU 731 HB2 GLU 731 -10.822 -5.182 11.258 568 HB3 GLU 731 HB3 GLU 731 -9.365 -4.199 11.093 569 HG2 GLU 731 HG2 GLU 731 -11.995 -2.962 10.389 570 HG3 GLU 731 HG3 GLU 731 -11.600 -3.159 12.086 571 H LYS 732 H LYS 732 -11.648 -2.920 7.810 572 HA LYS 732 HA LYS 732 -14.273 -4.129 8.145 573 HB2 LYS 732 HB2 LYS 732 -13.790 -1.653 6.558 574 HB3 LYS 732 HB3 LYS 732 -15.164 -2.081 7.577 575 HG2 LYS 732 HG2 LYS 732 -12.540 -1.867 8.952 576 HG3 LYS 732 HG3 LYS 732 -13.216 -0.376 8.352 577 HD2 LYS 732 HD2 LYS 732 -15.055 -0.467 9.759 578 HD3 LYS 732 HD3 LYS 732 -15.012 -2.228 9.858 579 HE2 LYS 732 HE2 LYS 732 -13.576 -2.214 11.616 580 HE3 LYS 732 HE3 LYS 732 -12.599 -0.920 10.922 581 HZ1 LYS 732 HZ1 LYS 732 -14.015 0.721 11.733 582 HZ2 LYS 732 HZ2 LYS 732 -15.298 -0.413 12.070 583 HZ3 LYS 732 HZ3 LYS 732 -13.874 -0.400 13.030 584 H LYS 733 H LYS 733 -11.777 -4.260 5.813 585 HA LYS 733 HA LYS 733 -13.746 -5.006 3.713 586 HB2 LYS 733 HB2 LYS 733 -11.806 -3.007 3.617 587 HB3 LYS 733 HB3 LYS 733 -11.129 -4.330 2.670 588 HG2 LYS 733 HG2 LYS 733 -12.429 -3.073 1.119 589 HG3 LYS 733 HG3 LYS 733 -13.427 -4.470 1.517 590 HD2 LYS 733 HD2 LYS 733 -14.874 -2.562 1.624 591 HD3 LYS 733 HD3 LYS 733 -14.541 -3.015 3.297 592 HE2 LYS 733 HE2 LYS 733 -13.034 -1.220 3.604 593 HE3 LYS 733 HE3 LYS 733 -12.846 -0.972 1.869 594 HZ1 LYS 733 HZ1 LYS 733 -14.894 0.047 1.670 595 HZ2 LYS 733 HZ2 LYS 733 -15.485 -0.635 3.132 596 HZ3 LYS 733 HZ3 LYS 733 -14.336 0.629 3.191 597 H ALA 734 H ALA 734 -12.259 -6.124 1.863 598 HA ALA 734 HA ALA 734 -10.310 -7.997 2.601 599 HB1 ALA 734 HB1 ALA 734 -13.086 -8.776 3.187 600 HB2 ALA 734 HB2 ALA 734 -11.574 -9.440 3.807 601 HB3 ALA 734 HB3 ALA 734 -12.187 -9.959 2.236 602 H PHE 735 H PHE 735 -9.337 -8.559 0.720 603 HA PHE 735 HA PHE 735 -11.005 -8.732 -1.723 604 HB2 PHE 735 HB2 PHE 735 -8.415 -7.274 -1.286 605 HB3 PHE 735 HB3 PHE 735 -8.807 -7.919 -2.875 606 HD1 PHE 735 HD2 PHE 735 -10.281 -5.857 -0.121 607 HD2 PHE 735 HD1 PHE 735 -10.167 -6.705 -4.329 608 HE1 PHE 735 HE2 PHE 735 -11.784 -3.929 -0.555 609 HE2 PHE 735 HE1 PHE 735 -11.659 -4.776 -4.767 610 HZ PHE 735 HZ PHE 735 -12.477 -3.395 -2.871 611 H ARG 736 H ARG 736 -10.177 -10.091 -3.386 612 HA ARG 736 HA ARG 736 -9.177 -12.567 -2.452 613 HB2 ARG 736 HB2 ARG 736 -10.179 -11.431 -4.922 614 HB3 ARG 736 HB3 ARG 736 -8.785 -12.470 -5.227 615 HG2 ARG 736 HG2 ARG 736 -10.961 -13.348 -3.369 616 HG3 ARG 736 HG3 ARG 736 -11.142 -13.551 -5.111 617 HD2 ARG 736 HD2 ARG 736 -9.782 -15.344 -5.093 618 HD3 ARG 736 HD3 ARG 736 -8.506 -14.411 -4.318 619 HE ARG 736 HE ARG 736 -10.556 -16.025 -2.948 620 HH11 ARG 736 HH21 ARG 736 -7.720 -14.021 -2.809 621 HH12 ARG 736 HH22 ARG 736 -7.312 -14.499 -1.188 622 HH21 ARG 736 HH11 ARG 736 -10.033 -16.627 -0.887 623 HH22 ARG 736 HH12 ARG 736 -8.638 -15.982 -0.095 624 H GLY 737 H GLY 737 -7.697 -9.771 -3.861 625 HA2 GLY 737 HA2 GLY 737 -5.043 -10.620 -3.133 626 HA3 GLY 737 HA3 GLY 737 -5.309 -10.651 -4.870 627 H LEU 738 H LEU 738 -3.502 -8.950 -3.336 628 HA LEU 738 HA LEU 738 -4.242 -6.368 -2.833 629 HB2 LEU 738 HB2 LEU 738 -1.804 -7.703 -3.785 630 HB3 LEU 738 HB3 LEU 738 -1.918 -6.024 -4.304 631 HG LEU 738 HG LEU 738 -0.760 -6.205 -2.146 632 HD11 LEU 738 HD11 LEU 738 -2.540 -4.358 -2.807 633 HD12 LEU 738 HD12 LEU 738 -3.412 -5.033 -1.431 634 HD13 LEU 738 HD13 LEU 738 -1.792 -4.370 -1.215 635 HD21 LEU 738 HD21 LEU 738 -3.326 -7.581 -1.340 636 HD22 LEU 738 HD22 LEU 738 -1.673 -8.179 -1.191 637 HD23 LEU 738 HD23 LEU 738 -2.234 -6.868 -0.156 638 H THR 739 H THR 739 -3.308 -7.664 -5.981 639 HA THR 739 HA THR 739 -3.698 -5.449 -7.577 640 HB THR 739 HB THR 739 -4.410 -8.248 -8.441 641 HG1 THR 739 HG1 THR 739 -1.810 -7.399 -8.685 642 HG21 THR 739 HG21 THR 739 -3.226 -7.440 -10.519 643 HG22 THR 739 HG22 THR 739 -4.725 -6.585 -10.157 644 HG23 THR 739 HG23 THR 739 -3.170 -5.835 -9.791 645 H GLU 740 H GLU 740 -6.153 -7.711 -6.371 646 HA GLU 740 HA GLU 740 -8.214 -6.506 -8.006 647 HB2 GLU 740 HB2 GLU 740 -8.830 -8.183 -5.592 648 HB3 GLU 740 HB3 GLU 740 -9.651 -8.128 -7.150 649 HG2 GLU 740 HG2 GLU 740 -6.908 -9.328 -6.633 650 HG3 GLU 740 HG3 GLU 740 -8.394 -10.232 -6.902 651 H LEU 741 H LEU 741 -6.730 -5.924 -4.986 652 HA LEU 741 HA LEU 741 -8.935 -4.354 -3.910 653 HB2 LEU 741 HB2 LEU 741 -7.703 -5.647 -2.309 654 HB3 LEU 741 HB3 LEU 741 -6.161 -5.075 -2.926 655 HG LEU 741 HG LEU 741 -6.992 -4.063 -0.717 656 HD11 LEU 741 HD11 LEU 741 -5.725 -2.204 -1.151 657 HD12 LEU 741 HD12 LEU 741 -5.344 -3.104 -2.615 658 HD13 LEU 741 HD13 LEU 741 -6.569 -1.835 -2.651 659 HD21 LEU 741 HD21 LEU 741 -9.123 -3.171 -2.562 660 HD22 LEU 741 HD22 LEU 741 -9.134 -3.319 -0.812 661 HD23 LEU 741 HD23 LEU 741 -8.435 -1.894 -1.571 662 H VAL 742 H VAL 742 -5.624 -3.925 -4.962 663 HA VAL 742 HA VAL 742 -5.455 -1.109 -4.758 664 HB VAL 742 HB VAL 742 -3.980 -3.145 -6.432 665 HG11 VAL 742 HG11 VAL 742 -2.207 -1.205 -6.303 666 HG12 VAL 742 HG12 VAL 742 -3.455 -1.188 -7.553 667 HG13 VAL 742 HG13 VAL 742 -3.633 -0.185 -6.111 668 HG21 VAL 742 HG21 VAL 742 -3.818 -3.445 -4.007 669 HG22 VAL 742 HG22 VAL 742 -2.276 -2.902 -4.673 670 HG23 VAL 742 HG23 VAL 742 -3.317 -1.760 -3.821 671 H GLU 743 H GLU 743 -5.757 -3.146 -7.626 672 HA GLU 743 HA GLU 743 -6.058 -1.039 -9.455 673 HB2 GLU 743 HB2 GLU 743 -7.037 -3.877 -9.754 674 HB3 GLU 743 HB3 GLU 743 -6.589 -2.761 -11.050 675 HG2 GLU 743 HG2 GLU 743 -4.585 -3.444 -8.905 676 HG3 GLU 743 HG3 GLU 743 -4.857 -4.565 -10.219 677 H PHE 744 H PHE 744 -8.330 -2.643 -7.391 678 HA PHE 744 HA PHE 744 -10.694 -1.844 -8.836 679 HB2 PHE 744 HB2 PHE 744 -10.867 -3.776 -7.469 680 HB3 PHE 744 HB3 PHE 744 -10.170 -2.954 -6.081 681 HD1 PHE 744 HD2 PHE 744 -13.031 -2.429 -8.474 682 HD2 PHE 744 HD1 PHE 744 -11.639 -2.312 -4.416 683 HE1 PHE 744 HE2 PHE 744 -15.290 -1.738 -7.720 684 HE2 PHE 744 HE1 PHE 744 -13.898 -1.621 -3.654 685 HZ PHE 744 HZ PHE 744 -15.723 -1.332 -5.312 686 H TYR 745 H TYR 745 -8.786 -0.618 -6.156 687 HA TYR 745 HA TYR 745 -10.629 1.411 -5.364 688 HB2 TYR 745 HB2 TYR 745 -7.744 0.827 -4.822 689 HB3 TYR 745 HB3 TYR 745 -8.433 2.380 -4.340 690 HD1 TYR 745 HD2 TYR 745 -10.829 -0.300 -4.484 691 HD2 TYR 745 HD1 TYR 745 -7.878 1.556 -1.976 692 HE1 TYR 745 HE2 TYR 745 -11.875 -1.327 -2.495 693 HE2 TYR 745 HE1 TYR 745 -8.932 0.519 0.012 694 HH TYR 745 HH TYR 745 -11.946 -0.573 0.076 695 H GLN 746 H GLN 746 -8.323 1.161 -7.908 696 HA GLN 746 HA GLN 746 -7.583 3.760 -8.425 697 HB2 GLN 746 HB2 GLN 746 -8.476 1.599 -10.339 698 HB3 GLN 746 HB3 GLN 746 -7.753 3.123 -10.865 699 HG2 GLN 746 HG2 GLN 746 -5.711 2.652 -9.669 700 HG3 GLN 746 HG3 GLN 746 -6.429 1.248 -8.881 701 HE21 GLN 746 HE21 GLN 746 -7.549 -0.232 -10.850 702 HE22 GLN 746 HE22 GLN 746 -6.409 -0.620 -12.054 703 H GLN 747 H GLN 747 -10.716 2.267 -8.804 704 HA GLN 747 HA GLN 747 -11.864 4.815 -9.779 705 HB2 GLN 747 HB2 GLN 747 -13.026 2.016 -9.902 706 HB3 GLN 747 HB3 GLN 747 -13.748 3.474 -10.587 707 HG2 GLN 747 HG2 GLN 747 -11.689 3.753 -12.002 708 HG3 GLN 747 HG3 GLN 747 -11.123 2.194 -11.409 709 HE21 GLN 747 HE21 GLN 747 -11.941 0.330 -12.440 710 HE22 GLN 747 HE22 GLN 747 -13.164 0.362 -13.616 711 H ASN 748 H ASN 748 -11.220 3.583 -6.951 712 HA ASN 748 HA ASN 748 -13.708 4.569 -5.735 713 HB2 ASN 748 HB2 ASN 748 -14.261 2.305 -5.648 714 HB3 ASN 748 HB3 ASN 748 -12.588 1.800 -5.433 715 HD21 ASN 748 HD21 ASN 748 -12.302 0.997 -3.361 716 HD22 ASN 748 HD22 ASN 748 -13.019 1.631 -1.961 717 H SER 749 H SER 749 -13.110 6.112 -4.383 718 HA SER 749 HA SER 749 -10.606 6.812 -3.567 719 HB2 SER 749 HB2 SER 749 -13.053 7.817 -3.175 720 HB3 SER 749 HB3 SER 749 -12.777 7.150 -1.577 721 HG SER 749 HG SER 749 -10.543 8.369 -2.338 722 H LEU 750 H LEU 750 -9.171 6.204 -2.026 723 HA LEU 750 HA LEU 750 -9.292 3.594 -0.962 724 HB2 LEU 750 HB2 LEU 750 -7.563 5.961 -0.263 725 HB3 LEU 750 HB3 LEU 750 -7.351 4.371 0.467 726 HG LEU 750 HG LEU 750 -7.612 4.081 -2.389 727 HD11 LEU 750 HD11 LEU 750 -5.293 5.235 -2.759 728 HD12 LEU 750 HD12 LEU 750 -6.764 6.206 -2.802 729 HD13 LEU 750 HD13 LEU 750 -5.761 6.198 -1.357 730 HD21 LEU 750 HD21 LEU 750 -6.500 2.582 -0.638 731 HD22 LEU 750 HD22 LEU 750 -5.595 2.827 -2.131 732 HD23 LEU 750 HD23 LEU 750 -5.146 3.712 -0.674 733 H LYS 751 H LYS 751 -10.336 6.663 0.346 734 HA LYS 751 HA LYS 751 -10.472 6.110 3.042 735 HB2 LYS 751 HB2 LYS 751 -12.375 7.665 3.154 736 HB3 LYS 751 HB3 LYS 751 -11.052 8.285 2.184 737 HG2 LYS 751 HG2 LYS 751 -12.467 7.097 0.235 738 HG3 LYS 751 HG3 LYS 751 -13.786 7.490 1.348 739 HD2 LYS 751 HD2 LYS 751 -12.943 9.817 1.499 740 HD3 LYS 751 HD3 LYS 751 -11.675 9.413 0.353 741 HE2 LYS 751 HE2 LYS 751 -14.005 8.622 -0.940 742 HE3 LYS 751 HE3 LYS 751 -14.435 10.147 -0.152 743 HZ1 LYS 751 HZ1 LYS 751 -12.164 9.609 -1.997 744 HZ2 LYS 751 HZ2 LYS 751 -13.443 10.741 -2.195 745 HZ3 LYS 751 HZ3 LYS 751 -12.238 11.027 -1.001 746 H ASP 752 H ASP 752 -12.103 4.585 0.467 747 HA ASP 752 HA ASP 752 -14.446 3.613 1.720 748 HB2 ASP 752 HB2 ASP 752 -14.416 3.015 -0.512 749 HB3 ASP 752 HB3 ASP 752 -12.683 2.718 -0.517 750 H CYS 753 H CYS 753 -11.097 2.584 1.768 751 HA CYS 753 HA CYS 753 -11.661 0.626 3.926 752 HB2 CYS 753 HB2 CYS 753 -9.731 0.709 1.696 753 HB3 CYS 753 HB3 CYS 753 -9.077 0.192 3.237 754 HG CYS 753 HG CYS 753 -10.896 -1.469 1.492 755 H PHE 754 H PHE 754 -9.329 3.029 2.763 756 HA PHE 754 HA PHE 754 -7.801 3.144 5.099 757 HB2 PHE 754 HB2 PHE 754 -8.254 5.025 2.820 758 HB3 PHE 754 HB3 PHE 754 -7.277 5.518 4.202 759 HD1 PHE 754 HD2 PHE 754 -7.694 2.546 1.946 760 HD2 PHE 754 HD1 PHE 754 -4.985 5.085 4.102 761 HE1 PHE 754 HE2 PHE 754 -5.774 1.274 1.036 762 HE2 PHE 754 HE1 PHE 754 -3.066 3.819 3.186 763 HZ PHE 754 HZ PHE 754 -3.462 1.913 1.655 764 H LYS 755 H LYS 755 -7.721 4.769 6.737 765 HA LYS 755 HA LYS 755 -10.365 5.506 7.660 766 HB2 LYS 755 HB2 LYS 755 -7.995 6.441 9.172 767 HB3 LYS 755 HB3 LYS 755 -9.448 5.621 9.737 768 HG2 LYS 755 HG2 LYS 755 -7.091 4.336 8.319 769 HG3 LYS 755 HG3 LYS 755 -7.527 4.139 10.011 770 HD2 LYS 755 HD2 LYS 755 -9.856 3.355 8.909 771 HD3 LYS 755 HD3 LYS 755 -8.773 2.933 7.582 772 HE2 LYS 755 HE2 LYS 755 -7.643 1.325 8.812 773 HE3 LYS 755 HE3 LYS 755 -7.966 2.131 10.348 774 HZ1 LYS 755 HZ1 LYS 755 -9.271 0.074 10.122 775 HZ2 LYS 755 HZ2 LYS 755 -10.301 1.444 10.240 776 HZ3 LYS 755 HZ3 LYS 755 -10.024 0.676 8.710 777 H SER 756 H SER 756 -7.322 7.363 7.212 778 HA SER 756 HA SER 756 -8.919 9.815 6.949 779 HB2 SER 756 HB2 SER 756 -6.961 11.028 7.388 780 HB3 SER 756 HB3 SER 756 -6.792 9.600 8.405 781 HG SER 756 HG SER 756 -5.104 9.054 7.292 782 H LEU 757 H LEU 757 -6.673 7.815 5.145 783 HA LEU 757 HA LEU 757 -6.010 9.228 2.925 784 HB2 LEU 757 HB2 LEU 757 -5.821 6.666 3.563 785 HB3 LEU 757 HB3 LEU 757 -7.193 6.534 2.473 786 HG LEU 757 HG LEU 757 -5.299 6.194 1.108 787 HD11 LEU 757 HD11 LEU 757 -5.332 8.046 -0.412 788 HD12 LEU 757 HD12 LEU 757 -6.961 7.825 0.226 789 HD13 LEU 757 HD13 LEU 757 -5.937 9.126 0.838 790 HD21 LEU 757 HD21 LEU 757 -3.666 7.025 2.785 791 HD22 LEU 757 HD22 LEU 757 -3.338 7.618 1.155 792 HD23 LEU 757 HD23 LEU 757 -4.102 8.677 2.335 793 H ASP 758 H ASP 758 -7.286 10.652 1.817 794 HA ASP 758 HA ASP 758 -9.927 9.633 0.964 795 HB2 ASP 758 HB2 ASP 758 -9.910 11.606 2.599 796 HB3 ASP 758 HB3 ASP 758 -9.282 12.566 1.264 797 H THR 759 H THR 759 -8.565 8.729 -0.807 798 HA THR 759 HA THR 759 -8.890 10.345 -3.141 799 HB THR 759 HB THR 759 -6.725 11.278 -2.254 800 HG1 THR 759 HG1 THR 759 -5.911 11.351 -4.276 801 HG21 THR 759 HG21 THR 759 -6.086 8.446 -2.184 802 HG22 THR 759 HG22 THR 759 -4.929 9.332 -3.171 803 HG23 THR 759 HG23 THR 759 -5.200 9.805 -1.496 804 H THR 760 H THR 760 -7.248 9.066 -4.934 805 HA THR 760 HA THR 760 -7.997 6.209 -4.624 806 HB THR 760 HB THR 760 -8.307 6.242 -7.152 807 HG1 THR 760 HG1 THR 760 -8.964 8.507 -7.753 808 HG21 THR 760 HG21 THR 760 -10.136 7.879 -5.382 809 HG22 THR 760 HG22 THR 760 -10.582 7.238 -6.966 810 HG23 THR 760 HG23 THR 760 -10.204 6.134 -5.644 811 H LEU 761 H LEU 761 -6.835 4.835 -6.318 812 HA LEU 761 HA LEU 761 -4.011 5.116 -5.923 813 HB2 LEU 761 HB2 LEU 761 -5.685 3.266 -7.651 814 HB3 LEU 761 HB3 LEU 761 -3.931 3.161 -7.558 815 HG LEU 761 HG LEU 761 -4.991 1.568 -5.996 816 HD11 LEU 761 HD11 LEU 761 -3.619 2.059 -4.150 817 HD12 LEU 761 HD12 LEU 761 -2.847 2.929 -5.472 818 HD13 LEU 761 HD13 LEU 761 -3.853 3.800 -4.320 819 HD21 LEU 761 HD21 LEU 761 -6.388 2.281 -4.199 820 HD22 LEU 761 HD22 LEU 761 -6.063 3.981 -4.521 821 HD23 LEU 761 HD23 LEU 761 -7.041 3.043 -5.649 822 H GLN 762 H GLN 762 -3.610 7.199 -6.781 823 HA GLN 762 HA GLN 762 -4.280 8.023 -9.392 824 HB2 GLN 762 HB2 GLN 762 -2.094 8.913 -7.507 825 HB3 GLN 762 HB3 GLN 762 -2.481 9.738 -9.015 826 HG2 GLN 762 HG2 GLN 762 -4.764 9.148 -7.195 827 HG3 GLN 762 HG3 GLN 762 -3.642 10.400 -6.680 828 HE21 GLN 762 HE21 GLN 762 -6.216 9.661 -8.884 829 HE22 GLN 762 HE22 GLN 762 -6.218 11.153 -9.694 830 H PHE 763 H PHE 763 -1.006 7.161 -8.235 831 HA PHE 763 HA PHE 763 -0.534 5.609 -10.640 832 HB2 PHE 763 HB2 PHE 763 1.712 7.301 -10.624 833 HB3 PHE 763 HB3 PHE 763 0.441 7.230 -11.841 834 HD1 PHE 763 HD1 PHE 763 1.458 8.879 -8.661 835 HD2 PHE 763 HD2 PHE 763 -1.170 8.974 -12.058 836 HE1 PHE 763 HE1 PHE 763 0.711 11.155 -8.019 837 HE2 PHE 763 HE2 PHE 763 -1.914 11.250 -11.417 838 HZ PHE 763 HZ PHE 763 -0.974 12.341 -9.397 839 HA PRO 764 HA PRO 764 1.994 3.388 -7.805 840 HB2 PRO 764 HB2 PRO 764 3.616 2.103 -9.638 841 HB3 PRO 764 HB3 PRO 764 1.967 1.592 -9.232 842 HG2 PRO 764 HG2 PRO 764 2.957 3.099 -11.583 843 HG3 PRO 764 HG3 PRO 764 1.647 1.913 -11.465 844 HD2 PRO 764 HD2 PRO 764 1.222 4.620 -11.625 845 HD3 PRO 764 HD3 PRO 764 0.094 3.494 -10.840 846 H PHE 765 H PHE 765 3.835 3.817 -6.682 847 HA PHE 765 HA PHE 765 5.414 6.048 -7.139 848 HB2 PHE 765 HB2 PHE 765 6.758 5.311 -5.384 849 HB3 PHE 765 HB3 PHE 765 5.248 4.452 -5.083 850 HD1 PHE 765 HD1 PHE 765 5.050 2.139 -6.467 851 HD2 PHE 765 HD2 PHE 765 8.717 4.059 -5.322 852 HE1 PHE 765 HE1 PHE 765 6.239 -0.009 -6.683 853 HE2 PHE 765 HE2 PHE 765 9.913 1.898 -5.537 854 HZ PHE 765 HZ PHE 765 8.675 -0.135 -6.218 855 H LYS 766 H LYS 766 5.761 2.831 -8.467 856 HA LYS 766 HA LYS 766 8.413 3.025 -9.393 857 HB2 LYS 766 HB2 LYS 766 6.044 1.339 -9.932 858 HB3 LYS 766 HB3 LYS 766 7.327 1.322 -11.131 859 HG2 LYS 766 HG2 LYS 766 8.371 1.200 -8.420 860 HG3 LYS 766 HG3 LYS 766 7.285 -0.138 -8.775 861 HD2 LYS 766 HD2 LYS 766 9.549 -0.761 -9.429 862 HD3 LYS 766 HD3 LYS 766 8.568 -0.560 -10.881 863 HE2 LYS 766 HE2 LYS 766 10.093 1.800 -9.805 864 HE3 LYS 766 HE3 LYS 766 10.950 0.572 -10.735 865 HZ1 LYS 766 HZ1 LYS 766 8.664 1.062 -12.166 866 HZ2 LYS 766 HZ2 LYS 766 9.149 2.613 -11.658 867 HZ3 LYS 766 HZ3 LYS 766 10.217 1.623 -12.541 868 H GLU 767 H GLU 767 5.437 4.340 -10.548 869 HA GLU 767 HA GLU 767 6.287 4.704 -13.254 870 HB2 GLU 767 HB2 GLU 767 3.873 4.955 -11.808 871 HB3 GLU 767 HB3 GLU 767 4.235 6.564 -12.425 872 HG2 GLU 767 HG2 GLU 767 4.800 5.114 -14.628 873 HG3 GLU 767 HG3 GLU 767 3.578 4.074 -13.906 874 H1 ASP 338 H1 ASP 338 13.812 2.569 6.739 875 H2 ASP 338 H2 ASP 338 14.683 2.466 5.258 876 H3 ASP 338 H3 ASP 338 14.853 3.847 6.263 877 HA ASP 338 HA ASP 338 16.591 1.856 6.236 878 HB2 ASP 338 HB2 ASP 338 15.828 3.272 8.799 879 HB3 ASP 338 HB3 ASP 338 17.438 2.835 8.233 880 H THR 339 H THR 339 16.355 1.462 9.342 881 HA THR 339 HA THR 339 15.333 -1.240 9.191 882 HB THR 339 HB THR 339 15.803 -1.016 11.772 883 HG1 THR 339 HG1 THR 339 16.931 0.739 12.320 884 HG21 THR 339 HG21 THR 339 18.103 -1.569 11.381 885 HG22 THR 339 HG22 THR 339 17.190 -2.209 10.018 886 HG23 THR 339 HG23 THR 339 18.114 -0.716 9.836 887 H GLU 340 H GLU 340 13.463 1.062 8.756 888 HA GLU 340 HA GLU 340 11.612 0.607 11.018 889 HB2 GLU 340 HB2 GLU 340 10.941 2.776 10.854 890 HB3 GLU 340 HB3 GLU 340 12.515 2.982 10.100 891 HG2 GLU 340 HG2 GLU 340 9.831 2.692 8.727 892 HG3 GLU 340 HG3 GLU 340 10.942 4.046 8.644 893 H VAL 341 H VAL 341 9.262 1.298 9.990 894 HA VAL 341 HA VAL 341 8.723 0.056 7.444 895 HB VAL 341 HB VAL 341 7.135 -1.637 8.350 896 HG11 VAL 341 HG11 VAL 341 9.589 -2.125 7.809 897 HG12 VAL 341 HG12 VAL 341 9.868 -2.086 9.551 898 HG13 VAL 341 HG13 VAL 341 8.769 -3.278 8.860 899 HG21 VAL 341 HG21 VAL 341 7.996 -2.080 10.939 900 HG22 VAL 341 HG22 VAL 341 7.917 -0.322 10.860 901 HG23 VAL 341 HG23 VAL 341 6.485 -1.286 10.497 902 H TYR 342 H TYR 342 5.927 -0.490 8.583 903 HA TYR 342 HA TYR 342 4.959 2.306 8.499 904 HB2 TYR 342 HB2 TYR 342 2.786 0.952 7.757 905 HB3 TYR 342 HB3 TYR 342 4.034 1.394 6.596 906 HD1 TYR 342 HD2 TYR 342 4.280 -1.260 9.219 907 HD2 TYR 342 HD1 TYR 342 3.862 -0.411 5.018 908 HE1 TYR 342 HE2 TYR 342 4.658 -3.645 8.695 909 HE2 TYR 342 HE1 TYR 342 4.233 -2.807 4.524 910 HH TYR 342 HH TYR 342 4.008 -5.207 6.765 911 H GLU 343 H GLU 343 5.137 2.482 10.843 912 HA GLU 343 HA GLU 343 4.358 0.986 12.886 913 HB2 GLU 343 HB2 GLU 343 3.144 3.117 13.824 914 HB3 GLU 343 HB3 GLU 343 4.881 3.144 13.529 915 HG2 GLU 343 HG2 GLU 343 3.085 3.935 11.269 916 HG3 GLU 343 HG3 GLU 343 3.276 5.073 12.600 917 H SER 344 H SER 344 1.732 3.161 12.000 918 HA SER 344 HA SER 344 -0.201 1.411 11.066 919 HB2 SER 344 HB2 SER 344 0.102 1.325 14.055 920 HB3 SER 344 HB3 SER 344 -1.487 1.121 13.322 921 HG SER 344 HG SER 344 0.863 -0.353 12.643 922 HA PRO 345 HA PRO 345 -1.277 5.924 11.080 923 HB2 PRO 345 HB2 PRO 345 -3.178 4.657 9.110 924 HB3 PRO 345 HB3 PRO 345 -2.319 6.207 8.990 925 HG2 PRO 345 HG2 PRO 345 -1.451 4.107 7.681 926 HG3 PRO 345 HG3 PRO 345 -0.309 5.194 8.486 927 HD2 PRO 345 HD2 PRO 345 -1.166 2.442 9.289 928 HD3 PRO 345 HD3 PRO 345 0.400 3.251 9.525 929 H PTR 346 H PTR 346 -3.810 3.366 10.838 930 HA PTR 346 HA PTR 346 -4.900 3.948 13.396 931 HB2 PTR 346 HB2 PTR 346 -6.282 5.654 13.012 932 HB3 PTR 346 HB3 PTR 346 -7.136 4.691 11.814 933 HD1 PTR 346 HD1 PTR 346 -5.502 4.410 9.544 934 HD2 PTR 346 HD2 PTR 346 -5.678 7.734 12.249 935 HE1 PTR 346 HE1 PTR 346 -4.604 5.888 7.760 936 HE2 PTR 346 HE2 PTR 346 -4.783 9.220 10.486 937 H ALA 347 H ALA 347 -6.727 2.765 13.950 938 HA ALA 347 HA ALA 347 -7.809 0.758 12.102 939 HB1 ALA 347 HB1 ALA 347 -7.029 -0.259 14.789 940 HB2 ALA 347 HB2 ALA 347 -5.716 -0.024 13.634 941 HB3 ALA 347 HB3 ALA 347 -7.061 -1.093 13.235 942 H ASP 348 H ASP 348 -9.944 0.201 12.682 943 HA ASP 348 HA ASP 348 -10.951 1.405 15.184 944 HB2 ASP 348 HB2 ASP 348 -12.991 2.145 13.846 945 HB3 ASP 348 HB3 ASP 348 -11.513 3.060 13.591 946 HA PRO 349 HA PRO 349 -12.503 -2.989 14.214 947 HB2 PRO 349 HB2 PRO 349 -11.475 -4.119 16.518 948 HB3 PRO 349 HB3 PRO 349 -10.648 -4.126 14.948 949 HG2 PRO 349 HG2 PRO 349 -10.254 -2.319 17.287 950 HG3 PRO 349 HG3 PRO 349 -9.048 -3.058 16.218 951 HD2 PRO 349 HD2 PRO 349 -9.777 -0.468 15.941 952 HD3 PRO 349 HD3 PRO 349 -9.376 -1.478 14.531 953 H GLU 350 H GLU 350 -14.644 -2.562 14.624 954 HA GLU 350 HA GLU 350 -15.467 -1.810 17.347 955 HB2 GLU 350 HB2 GLU 350 -17.680 -1.421 16.326 956 HB3 GLU 350 HB3 GLU 350 -16.417 -0.513 15.497 957 HG2 GLU 350 HG2 GLU 350 -17.203 -3.253 14.518 958 HG3 GLU 350 HG3 GLU 350 -18.159 -1.844 14.068 Start of MODEL 9 1 H1 GLY 661 H1 GLY 661 4.674 -13.943 -9.235 2 H2 GLY 661 H2 GLY 661 3.845 -13.582 -10.683 3 H3 GLY 661 H3 GLY 661 4.889 -12.431 -9.990 4 HA2 GLY 661 HA2 GLY 661 5.755 -13.740 -11.991 5 HA3 GLY 661 HA3 GLY 661 6.806 -13.608 -10.579 6 H HIS 662 H HIS 662 7.080 -15.421 -9.200 7 HA HIS 662 HA HIS 662 6.712 -17.987 -10.521 8 HB2 HIS 662 HB2 HIS 662 8.776 -17.332 -9.237 9 HB3 HIS 662 HB3 HIS 662 7.813 -17.397 -7.764 10 HD1 HIS 662 HD1 HIS 662 6.114 -19.948 -8.752 11 HD2 HIS 662 HD2 HIS 662 10.276 -19.637 -8.593 12 HE1 HIS 662 HE1 HIS 662 7.017 -22.319 -8.554 13 HE2 HIS 662 HE2 HIS 662 9.548 -22.141 -8.460 14 H MET 663 H MET 663 5.134 -16.070 -8.128 15 HA MET 663 HA MET 663 2.922 -17.905 -7.930 16 HB2 MET 663 HB2 MET 663 4.600 -18.879 -6.335 17 HB3 MET 663 HB3 MET 663 4.511 -17.384 -5.412 18 HG2 MET 663 HG2 MET 663 1.877 -17.917 -5.624 19 HG3 MET 663 HG3 MET 663 2.510 -19.562 -5.687 20 HE1 MET 663 HE1 MET 663 0.767 -19.450 -3.568 21 HE2 MET 663 HE2 MET 663 2.003 -20.705 -3.573 22 HE3 MET 663 HE3 MET 663 1.646 -19.824 -2.085 23 H GLN 664 H GLN 664 3.431 -16.121 -5.075 24 HA GLN 664 HA GLN 664 1.440 -14.149 -5.930 25 HB2 GLN 664 HB2 GLN 664 1.482 -15.551 -3.670 26 HB3 GLN 664 HB3 GLN 664 2.500 -14.213 -3.136 27 HG2 GLN 664 HG2 GLN 664 0.251 -13.144 -4.587 28 HG3 GLN 664 HG3 GLN 664 -0.346 -14.259 -3.363 29 HE21 GLN 664 HE21 GLN 664 2.498 -12.053 -3.290 30 HE22 GLN 664 HE22 GLN 664 1.983 -11.217 -1.897 31 H ASP 665 H ASP 665 4.138 -13.976 -6.953 32 HA ASP 665 HA ASP 665 5.557 -11.917 -5.556 33 HB2 ASP 665 HB2 ASP 665 6.056 -11.971 -8.418 34 HB3 ASP 665 HB3 ASP 665 7.152 -12.295 -7.088 35 H LEU 666 H LEU 666 3.813 -10.470 -5.141 36 HA LEU 666 HA LEU 666 2.249 -9.205 -7.109 37 HB2 LEU 666 HB2 LEU 666 3.182 -8.028 -4.481 38 HB3 LEU 666 HB3 LEU 666 1.779 -7.521 -5.413 39 HG LEU 666 HG LEU 666 2.158 -10.265 -4.171 40 HD11 LEU 666 HD11 LEU 666 0.699 -9.611 -2.467 41 HD12 LEU 666 HD12 LEU 666 1.670 -8.160 -2.698 42 HD13 LEU 666 HD13 LEU 666 0.058 -8.263 -3.401 43 HD21 LEU 666 HD21 LEU 666 -0.241 -9.036 -5.567 44 HD22 LEU 666 HD22 LEU 666 0.806 -10.270 -6.263 45 HD23 LEU 666 HD23 LEU 666 -0.173 -10.641 -4.847 46 H SER 667 H SER 667 5.565 -8.947 -6.387 47 HA SER 667 HA SER 667 6.298 -6.354 -6.953 48 HB2 SER 667 HB2 SER 667 8.346 -7.507 -8.061 49 HB3 SER 667 HB3 SER 667 8.036 -7.786 -6.349 50 HG SER 667 HG SER 667 8.159 -9.573 -8.309 51 H VAL 668 H VAL 668 4.895 -8.692 -9.067 52 HA VAL 668 HA VAL 668 5.746 -7.641 -11.556 53 HB VAL 668 HB VAL 668 3.847 -8.847 -12.514 54 HG11 VAL 668 HG11 VAL 668 5.583 -10.352 -12.070 55 HG12 VAL 668 HG12 VAL 668 5.436 -10.164 -10.323 56 HG13 VAL 668 HG13 VAL 668 4.230 -11.089 -11.216 57 HG21 VAL 668 HG21 VAL 668 2.529 -10.122 -10.493 58 HG22 VAL 668 HG22 VAL 668 2.838 -8.559 -9.738 59 HG23 VAL 668 HG23 VAL 668 1.946 -8.642 -11.256 60 H HIS 669 H HIS 669 3.390 -6.581 -9.220 61 HA HIS 669 HA HIS 669 1.974 -4.870 -11.082 62 HB2 HIS 669 HB2 HIS 669 1.898 -4.795 -8.061 63 HB3 HIS 669 HB3 HIS 669 0.712 -4.125 -9.180 64 HD1 HIS 669 HD1 HIS 669 -0.105 -6.163 -11.026 65 HD2 HIS 669 HD2 HIS 669 1.007 -7.247 -7.162 66 HE1 HIS 669 HE1 HIS 669 -1.106 -8.454 -10.615 67 HE2 HIS 669 HE2 HIS 669 -0.443 -9.131 -8.258 68 H LEU 670 H LEU 670 2.594 -2.959 -11.735 69 HA LEU 670 HA LEU 670 4.979 -1.727 -11.247 70 HB2 LEU 670 HB2 LEU 670 3.411 -1.164 -13.085 71 HB3 LEU 670 HB3 LEU 670 2.377 -0.337 -11.924 72 HG LEU 670 HG LEU 670 4.247 1.210 -11.383 73 HD11 LEU 670 HD11 LEU 670 6.203 1.225 -12.963 74 HD12 LEU 670 HD12 LEU 670 6.168 -0.178 -11.886 75 HD13 LEU 670 HD13 LEU 670 5.659 -0.342 -13.568 76 HD21 LEU 670 HD21 LEU 670 2.579 1.653 -13.246 77 HD22 LEU 670 HD22 LEU 670 4.116 2.507 -13.395 78 HD23 LEU 670 HD23 LEU 670 3.805 1.074 -14.372 79 H TRP 671 H TRP 671 2.108 -1.566 -9.212 80 HA TRP 671 HA TRP 671 3.283 0.625 -7.680 81 HB2 TRP 671 HB2 TRP 671 1.164 0.144 -6.209 82 HB3 TRP 671 HB3 TRP 671 1.022 1.018 -7.727 83 HD1 TRP 671 HD1 TRP 671 -0.454 -0.004 -9.569 84 HE1 TRP 671 HE1 TRP 671 -1.879 -2.168 -9.776 85 HE3 TRP 671 HE3 TRP 671 1.180 -2.506 -5.425 86 HZ2 TRP 671 HZ2 TRP 671 -2.226 -4.606 -8.362 87 HZ3 TRP 671 HZ3 TRP 671 0.275 -4.748 -4.875 88 HH2 TRP 671 HH2 TRP 671 -1.424 -5.803 -6.343 89 H TYR 672 H TYR 672 3.883 -2.573 -7.811 90 HA TYR 672 HA TYR 672 4.085 -2.905 -4.885 91 HB2 TYR 672 HB2 TYR 672 3.219 -4.698 -6.638 92 HB3 TYR 672 HB3 TYR 672 4.940 -5.047 -6.772 93 HD1 TYR 672 HD2 TYR 672 2.128 -4.725 -4.383 94 HD2 TYR 672 HD1 TYR 672 6.108 -6.187 -5.017 95 HE1 TYR 672 HE2 TYR 672 2.015 -5.955 -2.233 96 HE2 TYR 672 HE1 TYR 672 5.997 -7.417 -2.860 97 HH TYR 672 HH TYR 672 4.091 -6.791 -0.504 98 H ALA 673 H ALA 673 5.862 -2.071 -4.017 99 HA ALA 673 HA ALA 673 8.335 -1.864 -5.534 100 HB1 ALA 673 HB1 ALA 673 7.896 -1.220 -2.622 101 HB2 ALA 673 HB2 ALA 673 7.451 -0.115 -3.919 102 HB3 ALA 673 HB3 ALA 673 9.138 -0.577 -3.697 103 H GLY 674 H GLY 674 6.871 -4.204 -3.628 104 HA2 GLY 674 HA2 GLY 674 7.576 -6.212 -2.770 105 HA3 GLY 674 HA3 GLY 674 9.003 -6.021 -3.771 106 HA PRO 675 HA PRO 675 11.043 -5.971 0.203 107 HB2 PRO 675 HB2 PRO 675 13.583 -5.622 -0.782 108 HB3 PRO 675 HB3 PRO 675 12.729 -7.178 -0.780 109 HG2 PRO 675 HG2 PRO 675 13.084 -5.218 -2.997 110 HG3 PRO 675 HG3 PRO 675 13.164 -6.989 -3.030 111 HD2 PRO 675 HD2 PRO 675 10.963 -5.614 -3.875 112 HD3 PRO 675 HD3 PRO 675 10.859 -7.230 -3.132 113 H MET 676 H MET 676 9.806 -3.485 -0.715 114 HA MET 676 HA MET 676 11.887 -1.468 -0.170 115 HB2 MET 676 HB2 MET 676 10.309 -1.137 -2.082 116 HB3 MET 676 HB3 MET 676 8.990 -1.034 -0.917 117 HG2 MET 676 HG2 MET 676 10.001 1.202 -1.664 118 HG3 MET 676 HG3 MET 676 9.887 0.947 0.074 119 HE1 MET 676 HE1 MET 676 13.473 1.251 -2.647 120 HE2 MET 676 HE2 MET 676 12.648 -0.303 -2.740 121 HE3 MET 676 HE3 MET 676 11.753 1.196 -3.020 122 H GLU 677 H GLU 677 11.497 0.188 1.411 123 HA GLU 677 HA GLU 677 9.899 -0.795 3.692 124 HB2 GLU 677 HB2 GLU 677 11.501 0.787 4.992 125 HB3 GLU 677 HB3 GLU 677 12.095 -0.788 4.468 126 HG2 GLU 677 HG2 GLU 677 12.981 0.350 2.384 127 HG3 GLU 677 HG3 GLU 677 12.581 1.887 3.140 128 H ARG 678 H ARG 678 9.165 1.003 5.166 129 HA ARG 678 HA ARG 678 7.411 2.733 3.850 130 HB2 ARG 678 HB2 ARG 678 7.041 2.228 6.155 131 HB3 ARG 678 HB3 ARG 678 8.618 2.841 6.619 132 HG2 ARG 678 HG2 ARG 678 7.042 4.828 5.174 133 HG3 ARG 678 HG3 ARG 678 6.226 4.267 6.631 134 HD2 ARG 678 HD2 ARG 678 8.614 4.598 7.720 135 HD3 ARG 678 HD3 ARG 678 8.847 5.693 6.357 136 HE ARG 678 HE ARG 678 7.452 7.186 7.429 137 HH11 ARG 678 HH21 ARG 678 6.867 3.961 8.521 138 HH12 ARG 678 HH22 ARG 678 5.553 4.415 9.588 139 HH21 ARG 678 HH11 ARG 678 5.803 7.772 8.868 140 HH22 ARG 678 HH12 ARG 678 4.993 6.551 9.825 141 H ALA 679 H ALA 679 10.209 3.742 5.749 142 HA ALA 679 HA ALA 679 10.491 6.338 4.983 143 HB1 ALA 679 HB1 ALA 679 11.881 5.062 6.655 144 HB2 ALA 679 HB2 ALA 679 12.821 6.127 5.606 145 HB3 ALA 679 HB3 ALA 679 12.789 4.388 5.303 146 H GLY 680 H GLY 680 11.521 3.451 3.277 147 HA2 GLY 680 HA2 GLY 680 12.850 4.770 1.128 148 HA3 GLY 680 HA3 GLY 680 12.273 3.103 1.125 149 H ALA 681 H ALA 681 9.629 3.298 1.496 150 HA ALA 681 HA ALA 681 8.581 3.961 -1.014 151 HB1 ALA 681 HB1 ALA 681 6.359 3.798 0.155 152 HB2 ALA 681 HB2 ALA 681 7.237 3.655 1.677 153 HB3 ALA 681 HB3 ALA 681 7.425 2.421 0.434 154 H GLU 682 H GLU 682 8.570 5.816 2.025 155 HA GLU 682 HA GLU 682 7.014 7.979 1.094 156 HB2 GLU 682 HB2 GLU 682 9.227 8.402 3.087 157 HB3 GLU 682 HB3 GLU 682 7.611 9.105 3.057 158 HG2 GLU 682 HG2 GLU 682 6.912 6.541 3.344 159 HG3 GLU 682 HG3 GLU 682 8.502 6.444 4.068 160 H SER 683 H SER 683 10.420 7.216 0.825 161 HA SER 683 HA SER 683 11.400 9.716 0.050 162 HB2 SER 683 HB2 SER 683 13.336 8.584 -0.682 163 HB3 SER 683 HB3 SER 683 12.701 7.577 0.617 164 HG SER 683 HG SER 683 11.825 6.190 -0.900 165 H ILE 684 H ILE 684 10.601 6.986 -2.095 166 HA ILE 684 HA ILE 684 10.750 8.465 -4.494 167 HB ILE 684 HB ILE 684 8.873 6.135 -4.119 168 HG12 ILE 684 HG12 ILE 684 11.405 5.195 -4.985 169 HG13 ILE 684 HG13 ILE 684 11.709 6.186 -3.559 170 HG21 ILE 684 HG21 ILE 684 9.009 5.928 -6.393 171 HG22 ILE 684 HG22 ILE 684 9.429 7.638 -6.305 172 HG23 ILE 684 HG23 ILE 684 10.699 6.423 -6.443 173 HD11 ILE 684 HD11 ILE 684 9.920 4.934 -2.355 174 HD12 ILE 684 HD12 ILE 684 9.742 3.889 -3.763 175 HD13 ILE 684 HD13 ILE 684 11.255 3.896 -2.857 176 H LEU 685 H LEU 685 8.017 7.621 -2.413 177 HA LEU 685 HA LEU 685 5.994 8.867 -3.912 178 HB2 LEU 685 HB2 LEU 685 6.264 8.345 -0.946 179 HB3 LEU 685 HB3 LEU 685 4.791 8.968 -1.688 180 HG LEU 685 HG LEU 685 6.164 6.375 -2.466 181 HD11 LEU 685 HD11 LEU 685 3.742 6.973 -0.762 182 HD12 LEU 685 HD12 LEU 685 4.023 5.394 -1.488 183 HD13 LEU 685 HD13 LEU 685 5.172 6.045 -0.321 184 HD21 LEU 685 HD21 LEU 685 3.908 6.041 -3.640 185 HD22 LEU 685 HD22 LEU 685 3.646 7.767 -3.395 186 HD23 LEU 685 HD23 LEU 685 5.003 7.212 -4.373 187 H ALA 686 H ALA 686 7.749 10.154 -1.052 188 HA ALA 686 HA ALA 686 6.744 12.755 -1.120 189 HB1 ALA 686 HB1 ALA 686 8.818 13.394 0.053 190 HB2 ALA 686 HB2 ALA 686 9.547 11.852 -0.401 191 HB3 ALA 686 HB3 ALA 686 8.164 11.886 0.695 192 H ASN 687 H ASN 687 9.360 11.285 -2.984 193 HA ASN 687 HA ASN 687 10.218 13.720 -4.234 194 HB2 ASN 687 HB2 ASN 687 11.561 11.565 -3.952 195 HB3 ASN 687 HB3 ASN 687 10.632 10.930 -5.306 196 HD21 ASN 687 HD21 ASN 687 10.501 13.594 -6.692 197 HD22 ASN 687 HD22 ASN 687 12.069 13.851 -7.298 198 H ARG 688 H ARG 688 7.780 11.299 -4.970 199 HA ARG 688 HA ARG 688 7.418 12.201 -7.696 200 HB2 ARG 688 HB2 ARG 688 6.791 9.889 -6.319 201 HB3 ARG 688 HB3 ARG 688 5.220 10.666 -6.509 202 HG2 ARG 688 HG2 ARG 688 5.303 9.597 -8.549 203 HG3 ARG 688 HG3 ARG 688 6.178 11.060 -8.998 204 HD2 ARG 688 HD2 ARG 688 8.320 9.927 -8.475 205 HD3 ARG 688 HD3 ARG 688 7.435 8.466 -8.056 206 HE ARG 688 HE ARG 688 6.968 8.096 -10.367 207 HH11 ARG 688 HH21 ARG 688 8.587 11.105 -9.785 208 HH12 ARG 688 HH22 ARG 688 9.023 11.332 -11.442 209 HH21 ARG 688 HH11 ARG 688 7.540 8.382 -12.503 210 HH22 ARG 688 HH12 ARG 688 8.432 9.798 -12.974 211 H SER 689 H SER 689 4.479 12.036 -7.589 212 HA SER 689 HA SER 689 3.973 14.783 -6.619 213 HB2 SER 689 HB2 SER 689 3.202 13.295 -8.987 214 HB3 SER 689 HB3 SER 689 1.789 13.950 -8.162 215 HG SER 689 HG SER 689 3.212 15.280 -9.749 216 H ASP 690 H ASP 690 2.095 15.271 -5.394 217 HA ASP 690 HA ASP 690 1.359 13.357 -3.484 218 HB2 ASP 690 HB2 ASP 690 0.730 16.111 -4.020 219 HB3 ASP 690 HB3 ASP 690 -0.746 15.238 -3.620 220 H GLY 691 H GLY 691 0.102 11.667 -3.594 221 HA2 GLY 691 HA2 GLY 691 -2.200 10.844 -4.209 222 HA3 GLY 691 HA3 GLY 691 -1.845 11.461 -5.824 223 H THR 692 H THR 692 1.002 10.723 -5.558 224 HA THR 692 HA THR 692 1.048 8.239 -6.846 225 HB THR 692 HB THR 692 3.293 9.309 -5.120 226 HG1 THR 692 HG1 THR 692 2.681 11.019 -6.383 227 HG21 THR 692 HG21 THR 692 3.189 7.668 -7.663 228 HG22 THR 692 HG22 THR 692 4.667 8.284 -6.933 229 HG23 THR 692 HG23 THR 692 3.686 7.104 -6.070 230 H PHE 693 H PHE 693 1.528 6.108 -6.123 231 HA PHE 693 HA PHE 693 1.623 5.666 -3.220 232 HB2 PHE 693 HB2 PHE 693 -0.287 4.238 -3.164 233 HB3 PHE 693 HB3 PHE 693 -0.795 5.716 -3.980 234 HD1 PHE 693 HD1 PHE 693 -0.879 5.773 -6.505 235 HD2 PHE 693 HD2 PHE 693 -0.297 2.137 -4.293 236 HE1 PHE 693 HE1 PHE 693 -1.510 4.453 -8.509 237 HE2 PHE 693 HE2 PHE 693 -0.931 0.822 -6.296 238 HZ PHE 693 HZ PHE 693 -1.534 1.977 -8.404 239 H LEU 694 H LEU 694 1.634 3.199 -2.778 240 HA LEU 694 HA LEU 694 2.581 1.392 -4.727 241 HB2 LEU 694 HB2 LEU 694 4.927 1.267 -4.241 242 HB3 LEU 694 HB3 LEU 694 4.548 2.929 -4.658 243 HG LEU 694 HG LEU 694 4.197 3.167 -2.042 244 HD11 LEU 694 HD11 LEU 694 4.710 1.249 -0.947 245 HD12 LEU 694 HD12 LEU 694 5.455 0.540 -2.380 246 HD13 LEU 694 HD13 LEU 694 6.391 1.608 -1.335 247 HD21 LEU 694 HD21 LEU 694 6.897 3.021 -3.416 248 HD22 LEU 694 HD22 LEU 694 5.840 4.428 -3.337 249 HD23 LEU 694 HD23 LEU 694 6.601 3.817 -1.876 250 H VAL 695 H VAL 695 3.629 -0.542 -3.728 251 HA VAL 695 HA VAL 695 2.799 -0.967 -0.927 252 HB VAL 695 HB VAL 695 2.368 -3.068 -3.048 253 HG11 VAL 695 HG11 VAL 695 0.549 -3.200 -0.879 254 HG12 VAL 695 HG12 VAL 695 1.895 -4.286 -1.203 255 HG13 VAL 695 HG13 VAL 695 2.129 -2.879 -0.167 256 HG21 VAL 695 HG21 VAL 695 0.478 -0.919 -2.049 257 HG22 VAL 695 HG22 VAL 695 0.972 -1.203 -3.715 258 HG23 VAL 695 HG23 VAL 695 -0.062 -2.367 -2.892 259 H ARG 696 H ARG 696 4.060 -2.437 0.225 260 HA ARG 696 HA ARG 696 6.473 -3.453 -1.149 261 HB2 ARG 696 HB2 ARG 696 7.853 -2.691 0.705 262 HB3 ARG 696 HB3 ARG 696 6.999 -1.324 -0.010 263 HG2 ARG 696 HG2 ARG 696 5.310 -1.410 1.770 264 HG3 ARG 696 HG3 ARG 696 6.080 -2.838 2.458 265 HD2 ARG 696 HD2 ARG 696 7.925 -1.647 3.229 266 HD3 ARG 696 HD3 ARG 696 7.707 -0.345 2.063 267 HE ARG 696 HE ARG 696 6.574 -0.465 4.686 268 HH11 ARG 696 HH21 ARG 696 5.893 0.446 1.444 269 HH12 ARG 696 HH22 ARG 696 4.771 1.702 1.886 270 HH21 ARG 696 HH11 ARG 696 5.182 1.156 5.281 271 HH22 ARG 696 HH12 ARG 696 4.391 2.111 4.058 272 H GLN 697 H GLN 697 7.637 -5.089 0.035 273 HA GLN 697 HA GLN 697 5.843 -6.702 1.751 274 HB2 GLN 697 HB2 GLN 697 6.340 -7.752 -0.419 275 HB3 GLN 697 HB3 GLN 697 8.067 -7.631 -0.089 276 HG2 GLN 697 HG2 GLN 697 6.740 -8.874 2.160 277 HG3 GLN 697 HG3 GLN 697 6.302 -9.720 0.679 278 HE21 GLN 697 HE21 GLN 697 7.670 -11.497 1.740 279 HE22 GLN 697 HE22 GLN 697 9.343 -11.454 1.465 280 H ARG 698 H ARG 698 9.080 -7.780 1.457 281 HA ARG 698 HA ARG 698 10.744 -8.035 3.011 282 HB2 ARG 698 HB2 ARG 698 10.626 -5.410 2.440 283 HB3 ARG 698 HB3 ARG 698 10.270 -5.334 4.165 284 HG2 ARG 698 HG2 ARG 698 12.300 -6.793 4.566 285 HG3 ARG 698 HG3 ARG 698 12.691 -6.613 2.857 286 HD2 ARG 698 HD2 ARG 698 12.295 -4.256 4.714 287 HD3 ARG 698 HD3 ARG 698 13.869 -4.990 4.412 288 HE ARG 698 HE ARG 698 12.692 -4.409 1.924 289 HH11 ARG 698 HH21 ARG 698 13.929 -2.792 4.725 290 HH12 ARG 698 HH22 ARG 698 14.427 -1.363 3.823 291 HH21 ARG 698 HH11 ARG 698 13.320 -2.619 0.789 292 HH22 ARG 698 HH12 ARG 698 14.065 -1.277 1.618 293 H VAL 699 H VAL 699 10.754 -6.490 5.596 294 HA VAL 699 HA VAL 699 10.270 -6.990 7.789 295 HB VAL 699 HB VAL 699 7.421 -7.279 6.828 296 HG11 VAL 699 HG11 VAL 699 8.506 -5.951 9.319 297 HG12 VAL 699 HG12 VAL 699 6.859 -6.491 9.002 298 HG13 VAL 699 HG13 VAL 699 8.137 -7.674 9.267 299 HG21 VAL 699 HG21 VAL 699 7.493 -4.697 7.333 300 HG22 VAL 699 HG22 VAL 699 9.216 -4.867 6.997 301 HG23 VAL 699 HG23 VAL 699 8.030 -5.284 5.760 302 H LYS 700 H LYS 700 11.437 -9.066 7.201 303 HA LYS 700 HA LYS 700 10.280 -11.512 6.684 304 HB2 LYS 700 HB2 LYS 700 12.739 -10.997 6.957 305 HB3 LYS 700 HB3 LYS 700 12.490 -11.061 8.702 306 HG2 LYS 700 HG2 LYS 700 11.604 -13.385 8.450 307 HG3 LYS 700 HG3 LYS 700 11.987 -13.314 6.729 308 HD2 LYS 700 HD2 LYS 700 14.228 -13.561 7.089 309 HD3 LYS 700 HD3 LYS 700 14.205 -12.548 8.533 310 HE2 LYS 700 HE2 LYS 700 12.998 -15.320 8.529 311 HE3 LYS 700 HE3 LYS 700 14.709 -15.057 8.873 312 HZ1 LYS 700 HZ1 LYS 700 14.167 -14.467 10.935 313 HZ2 LYS 700 HZ2 LYS 700 13.189 -13.199 10.351 314 HZ3 LYS 700 HZ3 LYS 700 12.505 -14.740 10.607 315 H ASP 701 H ASP 701 9.740 -13.299 8.079 316 HA ASP 701 HA ASP 701 8.567 -14.309 9.767 317 HB2 ASP 701 HB2 ASP 701 9.434 -12.023 11.539 318 HB3 ASP 701 HB3 ASP 701 9.061 -13.682 12.004 319 H ALA 702 H ALA 702 8.175 -10.764 10.040 320 HA ALA 702 HA ALA 702 5.438 -10.972 10.908 321 HB1 ALA 702 HB1 ALA 702 6.105 -8.409 9.723 322 HB2 ALA 702 HB2 ALA 702 7.380 -8.951 10.817 323 HB3 ALA 702 HB3 ALA 702 5.723 -8.798 11.399 324 H ALA 703 H ALA 703 7.002 -10.035 7.836 325 HA ALA 703 HA ALA 703 6.187 -9.882 5.689 326 HB1 ALA 703 HB1 ALA 703 6.063 -12.319 6.035 327 HB2 ALA 703 HB2 ALA 703 4.780 -11.745 4.968 328 HB3 ALA 703 HB3 ALA 703 4.419 -12.141 6.649 329 H GLU 704 H GLU 704 4.772 -8.287 7.820 330 HA GLU 704 HA GLU 704 1.993 -8.223 7.170 331 HB2 GLU 704 HB2 GLU 704 3.272 -7.227 9.234 332 HB3 GLU 704 HB3 GLU 704 3.485 -5.819 8.192 333 HG2 GLU 704 HG2 GLU 704 0.875 -6.173 7.774 334 HG3 GLU 704 HG3 GLU 704 0.971 -6.970 9.343 335 H PHE 705 H PHE 705 1.001 -7.334 5.462 336 HA PHE 705 HA PHE 705 2.646 -5.832 3.537 337 HB2 PHE 705 HB2 PHE 705 -0.095 -7.085 3.226 338 HB3 PHE 705 HB3 PHE 705 0.817 -6.287 1.947 339 HD1 PHE 705 HD2 PHE 705 3.025 -7.245 1.211 340 HD2 PHE 705 HD1 PHE 705 0.392 -9.325 3.888 341 HE1 PHE 705 HE2 PHE 705 4.218 -9.365 0.740 342 HE2 PHE 705 HE1 PHE 705 1.588 -11.443 3.418 343 HZ PHE 705 HZ PHE 705 3.498 -11.464 1.844 344 H ALA 706 H ALA 706 2.073 -3.817 2.789 345 HA ALA 706 HA ALA 706 -0.331 -2.497 3.751 346 HB1 ALA 706 HB1 ALA 706 1.781 -2.375 5.443 347 HB2 ALA 706 HB2 ALA 706 0.604 -1.077 5.275 348 HB3 ALA 706 HB3 ALA 706 2.128 -0.992 4.408 349 H ILE 707 H ILE 707 -0.872 -0.717 2.544 350 HA ILE 707 HA ILE 707 0.743 -0.288 0.119 351 HB ILE 707 HB ILE 707 -2.048 0.698 0.772 352 HG12 ILE 707 HG12 ILE 707 -1.199 -1.593 -1.025 353 HG13 ILE 707 HG13 ILE 707 -1.783 -1.809 0.623 354 HG21 ILE 707 HG21 ILE 707 -1.810 0.624 -1.948 355 HG22 ILE 707 HG22 ILE 707 -1.521 2.067 -0.980 356 HG23 ILE 707 HG23 ILE 707 -0.166 1.063 -1.489 357 HD11 ILE 707 HD11 ILE 707 -3.354 -1.659 -1.678 358 HD12 ILE 707 HD12 ILE 707 -3.925 -1.543 -0.014 359 HD13 ILE 707 HD13 ILE 707 -3.545 -0.080 -0.919 360 H SER 708 H SER 708 1.684 1.649 -0.369 361 HA SER 708 HA SER 708 1.494 3.757 1.716 362 HB2 SER 708 HB2 SER 708 3.812 3.109 -0.115 363 HB3 SER 708 HB3 SER 708 3.781 4.388 1.098 364 HG SER 708 HG SER 708 3.066 1.809 1.908 365 H ILE 709 H ILE 709 0.533 5.567 1.096 366 HA ILE 709 HA ILE 709 0.604 6.277 -1.778 367 HB ILE 709 HB ILE 709 -1.688 6.902 0.087 368 HG12 ILE 709 HG12 ILE 709 -2.622 4.999 -1.664 369 HG13 ILE 709 HG13 ILE 709 -0.992 4.411 -1.348 370 HG21 ILE 709 HG21 ILE 709 -1.013 7.396 -2.755 371 HG22 ILE 709 HG22 ILE 709 -2.649 6.807 -2.473 372 HG23 ILE 709 HG23 ILE 709 -2.095 8.282 -1.682 373 HD11 ILE 709 HD11 ILE 709 -2.394 3.427 0.325 374 HD12 ILE 709 HD12 ILE 709 -1.492 4.710 1.131 375 HD13 ILE 709 HD13 ILE 709 -3.175 4.969 0.670 376 H LYS 710 H LYS 710 1.102 8.291 -2.323 377 HA LYS 710 HA LYS 710 2.235 10.052 -0.324 378 HB2 LYS 710 HB2 LYS 710 3.326 9.858 -2.476 379 HB3 LYS 710 HB3 LYS 710 1.840 10.277 -3.318 380 HG2 LYS 710 HG2 LYS 710 3.109 12.278 -3.301 381 HG3 LYS 710 HG3 LYS 710 1.918 12.476 -2.022 382 HD2 LYS 710 HD2 LYS 710 3.816 11.405 -0.524 383 HD3 LYS 710 HD3 LYS 710 4.860 12.029 -1.800 384 HE2 LYS 710 HE2 LYS 710 4.577 13.685 0.006 385 HE3 LYS 710 HE3 LYS 710 3.879 14.273 -1.500 386 HZ1 LYS 710 HZ1 LYS 710 2.303 12.850 0.568 387 HZ2 LYS 710 HZ2 LYS 710 2.458 14.540 0.493 388 HZ3 LYS 710 HZ3 LYS 710 1.697 13.730 -0.794 389 H TYR 711 H TYR 711 1.061 11.473 0.835 390 HA TYR 711 HA TYR 711 -1.231 12.836 -0.432 391 HB2 TYR 711 HB2 TYR 711 -1.718 10.688 1.118 392 HB3 TYR 711 HB3 TYR 711 -1.593 11.910 2.378 393 HD1 TYR 711 HD2 TYR 711 -2.755 14.302 1.169 394 HD2 TYR 711 HD1 TYR 711 -3.962 10.200 0.809 395 HE1 TYR 711 HE2 TYR 711 -5.069 15.030 0.667 396 HE2 TYR 711 HE1 TYR 711 -6.280 10.926 0.309 397 HH TYR 711 HH TYR 711 -7.579 12.756 -0.312 398 H ASN 712 H ASN 712 -1.213 14.956 -0.002 399 HA ASN 712 HA ASN 712 -0.488 16.995 0.808 400 HB2 ASN 712 HB2 ASN 712 -2.137 16.239 2.518 401 HB3 ASN 712 HB3 ASN 712 -0.808 15.570 3.455 402 HD21 ASN 712 HD21 ASN 712 0.729 17.090 4.426 403 HD22 ASN 712 HD22 ASN 712 0.325 18.733 4.594 404 H VAL 713 H VAL 713 1.675 16.337 -0.135 405 HA VAL 713 HA VAL 713 3.954 16.035 0.024 406 HB VAL 713 HB VAL 713 5.051 17.762 1.226 407 HG11 VAL 713 HG11 VAL 713 2.420 19.124 1.020 408 HG12 VAL 713 HG12 VAL 713 3.967 19.544 0.285 409 HG13 VAL 713 HG13 VAL 713 2.966 18.279 -0.428 410 HG21 VAL 713 HG21 VAL 713 2.590 18.173 2.941 411 HG22 VAL 713 HG22 VAL 713 3.908 17.118 3.448 412 HG23 VAL 713 HG23 VAL 713 4.206 18.834 3.179 413 H GLU 714 H GLU 714 2.189 14.325 1.828 414 HA GLU 714 HA GLU 714 4.396 13.175 3.405 415 HB2 GLU 714 HB2 GLU 714 1.576 13.794 4.297 416 HB3 GLU 714 HB3 GLU 714 2.543 12.550 5.090 417 HG2 GLU 714 HG2 GLU 714 3.842 14.078 6.148 418 HG3 GLU 714 HG3 GLU 714 4.015 15.062 4.698 419 H VAL 715 H VAL 715 3.520 10.869 4.184 420 HA VAL 715 HA VAL 715 2.125 9.602 1.901 421 HB VAL 715 HB VAL 715 4.620 8.612 3.303 422 HG11 VAL 715 HG11 VAL 715 4.451 6.751 1.607 423 HG12 VAL 715 HG12 VAL 715 3.203 6.709 2.851 424 HG13 VAL 715 HG13 VAL 715 2.822 7.313 1.240 425 HG21 VAL 715 HG21 VAL 715 4.623 8.782 0.396 426 HG22 VAL 715 HG22 VAL 715 4.300 10.347 1.135 427 HG23 VAL 715 HG23 VAL 715 5.762 9.462 1.554 428 H LYS 716 H LYS 716 0.797 7.882 2.365 429 HA LYS 716 HA LYS 716 0.348 7.355 5.253 430 HB2 LYS 716 HB2 LYS 716 -1.450 8.484 3.558 431 HB3 LYS 716 HB3 LYS 716 -1.834 6.779 3.344 432 HG2 LYS 716 HG2 LYS 716 -2.466 6.483 5.575 433 HG3 LYS 716 HG3 LYS 716 -1.485 7.837 6.133 434 HD2 LYS 716 HD2 LYS 716 -4.053 8.051 4.527 435 HD3 LYS 716 HD3 LYS 716 -3.887 8.401 6.228 436 HE2 LYS 716 HE2 LYS 716 -2.640 9.917 3.918 437 HE3 LYS 716 HE3 LYS 716 -3.841 10.507 5.062 438 HZ1 LYS 716 HZ1 LYS 716 -2.268 11.043 6.512 439 HZ2 LYS 716 HZ2 LYS 716 -1.540 9.514 6.413 440 HZ3 LYS 716 HZ3 LYS 716 -1.109 10.725 5.305 441 H HIS 717 H HIS 717 1.069 5.389 5.789 442 HA HIS 717 HA HIS 717 0.782 3.204 3.818 443 HB2 HIS 717 HB2 HIS 717 2.602 2.977 6.191 444 HB3 HIS 717 HB3 HIS 717 2.688 2.148 4.644 445 HD1 HIS 717 HD1 HIS 717 4.063 3.243 2.777 446 HD2 HIS 717 HD2 HIS 717 3.615 5.706 6.132 447 HE1 HIS 717 HE1 HIS 717 5.821 5.081 2.599 448 HE2 HIS 717 HE2 HIS 717 5.476 6.655 4.586 449 H ILE 718 H ILE 718 -1.064 2.136 4.288 450 HA ILE 718 HA ILE 718 -1.680 1.555 7.135 451 HB ILE 718 HB ILE 718 -3.372 2.019 4.723 452 HG12 ILE 718 HG12 ILE 718 -3.337 3.722 6.437 453 HG13 ILE 718 HG13 ILE 718 -4.909 2.938 6.461 454 HG21 ILE 718 HG21 ILE 718 -4.141 0.088 6.928 455 HG22 ILE 718 HG22 ILE 718 -5.247 0.733 5.718 456 HG23 ILE 718 HG23 ILE 718 -3.920 -0.316 5.229 457 HD11 ILE 718 HD11 ILE 718 -4.526 2.744 8.686 458 HD12 ILE 718 HD12 ILE 718 -3.528 1.369 8.219 459 HD13 ILE 718 HD13 ILE 718 -2.788 2.943 8.503 460 H LYS 719 H LYS 719 -1.719 -0.561 7.808 461 HA LYS 719 HA LYS 719 -0.459 -2.499 6.118 462 HB2 LYS 719 HB2 LYS 719 -0.713 -4.017 8.054 463 HB3 LYS 719 HB3 LYS 719 0.015 -2.477 8.501 464 HG2 LYS 719 HG2 LYS 719 -1.769 -1.852 9.784 465 HG3 LYS 719 HG3 LYS 719 -2.942 -2.558 8.674 466 HD2 LYS 719 HD2 LYS 719 -3.149 -4.340 10.035 467 HD3 LYS 719 HD3 LYS 719 -1.445 -4.715 9.793 468 HE2 LYS 719 HE2 LYS 719 -2.406 -2.674 11.818 469 HE3 LYS 719 HE3 LYS 719 -2.144 -4.373 12.215 470 HZ1 LYS 719 HZ1 LYS 719 -0.092 -3.553 12.687 471 HZ2 LYS 719 HZ2 LYS 719 0.160 -3.891 11.022 472 HZ3 LYS 719 HZ3 LYS 719 -0.189 -2.276 11.547 473 H ILE 720 H ILE 720 -1.239 -4.429 5.357 474 HA ILE 720 HA ILE 720 -4.146 -4.453 4.880 475 HB ILE 720 HB ILE 720 -1.837 -5.723 3.410 476 HG12 ILE 720 HG12 ILE 720 -3.911 -3.755 2.428 477 HG13 ILE 720 HG13 ILE 720 -2.400 -3.234 3.169 478 HG21 ILE 720 HG21 ILE 720 -4.813 -5.915 2.831 479 HG22 ILE 720 HG22 ILE 720 -3.521 -6.579 1.834 480 HG23 ILE 720 HG23 ILE 720 -3.817 -7.234 3.443 481 HD11 ILE 720 HD11 ILE 720 -1.130 -3.910 1.387 482 HD12 ILE 720 HD12 ILE 720 -2.189 -5.269 1.012 483 HD13 ILE 720 HD13 ILE 720 -2.642 -3.638 0.527 484 H MET 721 H MET 721 -5.380 -5.913 5.762 485 HA MET 721 HA MET 721 -4.177 -8.059 7.358 486 HB2 MET 721 HB2 MET 721 -6.419 -6.365 7.667 487 HB3 MET 721 HB3 MET 721 -7.062 -7.993 7.436 488 HG2 MET 721 HG2 MET 721 -5.566 -8.837 9.207 489 HG3 MET 721 HG3 MET 721 -4.904 -7.220 9.432 490 HE1 MET 721 HE1 MET 721 -5.682 -6.265 11.825 491 HE2 MET 721 HE2 MET 721 -6.809 -7.329 12.660 492 HE3 MET 721 HE3 MET 721 -5.410 -8.007 11.818 493 H THR 722 H THR 722 -5.504 -10.124 7.390 494 HA THR 722 HA THR 722 -6.782 -10.949 4.954 495 HB THR 722 HB THR 722 -4.326 -11.036 4.357 496 HG1 THR 722 HG1 THR 722 -5.862 -12.318 3.319 497 HG21 THR 722 HG21 THR 722 -2.885 -12.027 5.764 498 HG22 THR 722 HG22 THR 722 -4.208 -12.339 6.883 499 HG23 THR 722 HG23 THR 722 -3.794 -13.534 5.655 500 H ALA 723 H ALA 723 -7.289 -13.337 5.062 501 HA ALA 723 HA ALA 723 -7.119 -14.737 7.509 502 HB1 ALA 723 HB1 ALA 723 -9.448 -14.392 8.303 503 HB2 ALA 723 HB2 ALA 723 -9.668 -13.176 7.044 504 HB3 ALA 723 HB3 ALA 723 -8.511 -12.899 8.350 505 H GLU 724 H GLU 724 -9.810 -14.029 5.377 506 HA GLU 724 HA GLU 724 -10.344 -16.837 4.888 507 HB2 GLU 724 HB2 GLU 724 -11.778 -14.620 3.500 508 HB3 GLU 724 HB3 GLU 724 -12.426 -16.100 4.205 509 HG2 GLU 724 HG2 GLU 724 -13.158 -14.510 5.753 510 HG3 GLU 724 HG3 GLU 724 -11.631 -15.000 6.478 511 H GLY 725 H GLY 725 -7.843 -15.742 3.876 512 HA2 GLY 725 HA2 GLY 725 -6.556 -16.064 1.971 513 HA3 GLY 725 HA3 GLY 725 -7.988 -16.707 1.167 514 H LEU 726 H LEU 726 -8.318 -13.681 2.732 515 HA LEU 726 HA LEU 726 -8.265 -12.289 0.117 516 HB2 LEU 726 HB2 LEU 726 -9.939 -11.644 2.555 517 HB3 LEU 726 HB3 LEU 726 -10.016 -10.836 0.990 518 HG LEU 726 HG LEU 726 -10.379 -13.805 1.062 519 HD11 LEU 726 HD11 LEU 726 -12.718 -11.978 1.545 520 HD12 LEU 726 HD12 LEU 726 -12.611 -13.714 1.783 521 HD13 LEU 726 HD13 LEU 726 -11.800 -12.622 2.899 522 HD21 LEU 726 HD21 LEU 726 -12.257 -12.757 -0.605 523 HD22 LEU 726 HD22 LEU 726 -11.030 -11.494 -0.680 524 HD23 LEU 726 HD23 LEU 726 -10.617 -13.151 -1.116 525 H TYR 727 H TYR 727 -8.018 -9.896 0.352 526 HA TYR 727 HA TYR 727 -5.977 -9.206 2.407 527 HB2 TYR 727 HB2 TYR 727 -6.187 -8.232 -0.461 528 HB3 TYR 727 HB3 TYR 727 -5.003 -7.675 0.718 529 HD1 TYR 727 HD2 TYR 727 -6.200 -10.668 -1.147 530 HD2 TYR 727 HD1 TYR 727 -3.030 -8.936 1.179 531 HE1 TYR 727 HE2 TYR 727 -4.720 -12.573 -1.736 532 HE2 TYR 727 HE1 TYR 727 -1.554 -10.840 0.584 533 HH TYR 727 HH TYR 727 -1.372 -12.530 -1.267 534 H ARG 728 H ARG 728 -6.161 -7.153 3.369 535 HA ARG 728 HA ARG 728 -8.129 -5.260 2.417 536 HB2 ARG 728 HB2 ARG 728 -9.225 -5.331 4.807 537 HB3 ARG 728 HB3 ARG 728 -9.783 -6.389 3.518 538 HG2 ARG 728 HG2 ARG 728 -8.904 -8.281 4.492 539 HG3 ARG 728 HG3 ARG 728 -7.541 -7.410 5.190 540 HD2 ARG 728 HD2 ARG 728 -8.748 -6.732 7.059 541 HD3 ARG 728 HD3 ARG 728 -10.296 -6.842 6.236 542 HE ARG 728 HE ARG 728 -8.872 -9.013 7.553 543 HH11 ARG 728 HH21 ARG 728 -11.390 -8.075 5.361 544 HH12 ARG 728 HH22 ARG 728 -12.167 -9.631 5.426 545 HH21 ARG 728 HH11 ARG 728 -9.906 -11.002 7.608 546 HH22 ARG 728 HH12 ARG 728 -11.339 -11.287 6.652 547 H ILE 729 H ILE 729 -7.593 -3.256 2.952 548 HA ILE 729 HA ILE 729 -5.260 -2.771 4.556 549 HB ILE 729 HB ILE 729 -6.292 -0.292 4.196 550 HG12 ILE 729 HG12 ILE 729 -8.300 -1.447 3.058 551 HG13 ILE 729 HG13 ILE 729 -7.546 -0.106 2.202 552 HG21 ILE 729 HG21 ILE 729 -4.798 -1.951 2.143 553 HG22 ILE 729 HG22 ILE 729 -4.885 -0.194 2.157 554 HG23 ILE 729 HG23 ILE 729 -4.079 -1.046 3.468 555 HD11 ILE 729 HD11 ILE 729 -8.018 -2.626 1.159 556 HD12 ILE 729 HD12 ILE 729 -6.920 -1.426 0.486 557 HD13 ILE 729 HD13 ILE 729 -6.305 -2.679 1.562 558 H THR 730 H THR 730 -8.694 -2.707 5.003 559 HA THR 730 HA THR 730 -8.279 -1.856 7.807 560 HB THR 730 HB THR 730 -9.625 -0.195 6.538 561 HG1 THR 730 HG1 THR 730 -10.169 -1.260 8.843 562 HG21 THR 730 HG21 THR 730 -11.169 -0.858 5.058 563 HG22 THR 730 HG22 THR 730 -10.742 -2.531 5.403 564 HG23 THR 730 HG23 THR 730 -12.033 -1.746 6.308 565 H GLU 731 H GLU 731 -9.359 -3.009 9.357 566 HA GLU 731 HA GLU 731 -9.673 -5.773 8.953 567 HB2 GLU 731 HB2 GLU 731 -10.667 -5.684 11.250 568 HB3 GLU 731 HB3 GLU 731 -9.144 -4.787 11.125 569 HG2 GLU 731 HG2 GLU 731 -11.698 -3.334 10.568 570 HG3 GLU 731 HG3 GLU 731 -11.273 -3.661 12.237 571 H LYS 732 H LYS 732 -11.655 -3.263 7.998 572 HA LYS 732 HA LYS 732 -14.137 -4.767 8.334 573 HB2 LYS 732 HB2 LYS 732 -13.898 -1.983 7.238 574 HB3 LYS 732 HB3 LYS 732 -15.282 -2.744 8.029 575 HG2 LYS 732 HG2 LYS 732 -14.103 -2.815 10.150 576 HG3 LYS 732 HG3 LYS 732 -12.624 -2.245 9.388 577 HD2 LYS 732 HD2 LYS 732 -14.655 -0.371 8.735 578 HD3 LYS 732 HD3 LYS 732 -14.767 -0.688 10.469 579 HE2 LYS 732 HE2 LYS 732 -12.113 -0.516 10.300 580 HE3 LYS 732 HE3 LYS 732 -12.513 0.480 8.899 581 HZ1 LYS 732 HZ1 LYS 732 -14.105 1.675 10.439 582 HZ2 LYS 732 HZ2 LYS 732 -13.326 0.877 11.742 583 HZ3 LYS 732 HZ3 LYS 732 -12.434 1.955 10.722 584 H LYS 733 H LYS 733 -11.789 -4.472 5.958 585 HA LYS 733 HA LYS 733 -13.760 -4.946 3.776 586 HB2 LYS 733 HB2 LYS 733 -11.999 -2.901 3.872 587 HB3 LYS 733 HB3 LYS 733 -11.001 -4.115 3.079 588 HG2 LYS 733 HG2 LYS 733 -12.067 -3.051 1.279 589 HG3 LYS 733 HG3 LYS 733 -13.073 -4.471 1.529 590 HD2 LYS 733 HD2 LYS 733 -14.812 -3.032 1.651 591 HD3 LYS 733 HD3 LYS 733 -14.200 -2.608 3.248 592 HE2 LYS 733 HE2 LYS 733 -14.583 -0.624 1.752 593 HE3 LYS 733 HE3 LYS 733 -12.930 -0.759 2.334 594 HZ1 LYS 733 HZ1 LYS 733 -13.344 -0.294 -0.154 595 HZ2 LYS 733 HZ2 LYS 733 -12.151 -1.458 0.279 596 HZ3 LYS 733 HZ3 LYS 733 -13.699 -1.974 -0.237 597 H ALA 734 H ALA 734 -12.362 -6.033 1.836 598 HA ALA 734 HA ALA 734 -10.400 -7.939 2.463 599 HB1 ALA 734 HB1 ALA 734 -12.589 -9.713 1.989 600 HB2 ALA 734 HB2 ALA 734 -12.990 -8.691 3.364 601 HB3 ALA 734 HB3 ALA 734 -11.514 -9.647 3.381 602 H PHE 735 H PHE 735 -9.440 -8.355 0.577 603 HA PHE 735 HA PHE 735 -11.100 -8.529 -1.882 604 HB2 PHE 735 HB2 PHE 735 -8.505 -7.078 -1.408 605 HB3 PHE 735 HB3 PHE 735 -8.926 -7.653 -3.029 606 HD1 PHE 735 HD2 PHE 735 -10.290 -5.668 -0.151 607 HD2 PHE 735 HD1 PHE 735 -10.350 -6.381 -4.387 608 HE1 PHE 735 HE2 PHE 735 -11.783 -3.702 -0.468 609 HE2 PHE 735 HE1 PHE 735 -11.827 -4.419 -4.704 610 HZ PHE 735 HZ PHE 735 -12.553 -3.088 -2.740 611 H ARG 736 H ARG 736 -10.240 -9.937 -3.546 612 HA ARG 736 HA ARG 736 -9.202 -12.379 -2.534 613 HB2 ARG 736 HB2 ARG 736 -9.237 -11.460 -5.406 614 HB3 ARG 736 HB3 ARG 736 -9.176 -13.121 -4.822 615 HG2 ARG 736 HG2 ARG 736 -11.401 -12.689 -3.673 616 HG3 ARG 736 HG3 ARG 736 -11.472 -11.162 -4.560 617 HD2 ARG 736 HD2 ARG 736 -11.369 -13.954 -5.704 618 HD3 ARG 736 HD3 ARG 736 -12.662 -12.766 -5.886 619 HE ARG 736 HE ARG 736 -10.615 -11.409 -6.974 620 HH11 ARG 736 HH21 ARG 736 -11.681 -14.682 -7.395 621 HH12 ARG 736 HH22 ARG 736 -10.954 -14.853 -8.953 622 HH21 ARG 736 HH11 ARG 736 -9.625 -11.643 -8.946 623 HH22 ARG 736 HH12 ARG 736 -9.803 -13.134 -9.839 624 H GLY 737 H GLY 737 -7.704 -9.541 -3.887 625 HA2 GLY 737 HA2 GLY 737 -5.086 -10.378 -3.087 626 HA3 GLY 737 HA3 GLY 737 -5.287 -10.440 -4.832 627 H LEU 738 H LEU 738 -3.527 -8.729 -3.324 628 HA LEU 738 HA LEU 738 -4.234 -6.153 -2.825 629 HB2 LEU 738 HB2 LEU 738 -1.832 -7.497 -3.859 630 HB3 LEU 738 HB3 LEU 738 -1.949 -5.810 -4.346 631 HG LEU 738 HG LEU 738 -0.734 -6.010 -2.230 632 HD11 LEU 738 HD11 LEU 738 -3.364 -4.908 -1.363 633 HD12 LEU 738 HD12 LEU 738 -1.749 -4.206 -1.246 634 HD13 LEU 738 HD13 LEU 738 -2.602 -4.196 -2.785 635 HD21 LEU 738 HD21 LEU 738 -1.456 -7.217 -0.430 636 HD22 LEU 738 HD22 LEU 738 -3.155 -6.850 -0.732 637 HD23 LEU 738 HD23 LEU 738 -2.343 -8.107 -1.665 638 H THR 739 H THR 739 -3.504 -7.514 -6.001 639 HA THR 739 HA THR 739 -3.861 -5.289 -7.602 640 HB THR 739 HB THR 739 -4.748 -8.050 -8.420 641 HG1 THR 739 HG1 THR 739 -2.098 -7.207 -8.649 642 HG21 THR 739 HG21 THR 739 -5.048 -6.344 -10.110 643 HG22 THR 739 HG22 THR 739 -3.422 -5.720 -9.831 644 HG23 THR 739 HG23 THR 739 -3.644 -7.313 -10.554 645 H GLU 740 H GLU 740 -6.368 -7.478 -6.340 646 HA GLU 740 HA GLU 740 -8.451 -6.176 -7.862 647 HB2 GLU 740 HB2 GLU 740 -9.044 -7.751 -5.381 648 HB3 GLU 740 HB3 GLU 740 -9.927 -7.698 -6.903 649 HG2 GLU 740 HG2 GLU 740 -7.456 -8.734 -7.625 650 HG3 GLU 740 HG3 GLU 740 -7.756 -9.474 -6.065 651 H LEU 741 H LEU 741 -6.838 -5.690 -4.888 652 HA LEU 741 HA LEU 741 -8.915 -4.029 -3.723 653 HB2 LEU 741 HB2 LEU 741 -7.622 -5.443 -2.249 654 HB3 LEU 741 HB3 LEU 741 -6.110 -4.801 -2.872 655 HG LEU 741 HG LEU 741 -7.012 -3.918 -0.596 656 HD11 LEU 741 HD11 LEU 741 -6.442 -1.614 -2.377 657 HD12 LEU 741 HD12 LEU 741 -5.614 -2.144 -0.915 658 HD13 LEU 741 HD13 LEU 741 -5.283 -2.942 -2.450 659 HD21 LEU 741 HD21 LEU 741 -8.799 -2.486 -0.582 660 HD22 LEU 741 HD22 LEU 741 -8.430 -1.838 -2.173 661 HD23 LEU 741 HD23 LEU 741 -9.265 -3.377 -2.018 662 H VAL 742 H VAL 742 -5.640 -3.694 -4.932 663 HA VAL 742 HA VAL 742 -5.413 -0.875 -4.696 664 HB VAL 742 HB VAL 742 -4.021 -2.901 -6.454 665 HG11 VAL 742 HG11 VAL 742 -3.908 -0.044 -6.503 666 HG12 VAL 742 HG12 VAL 742 -2.383 -0.653 -5.867 667 HG13 VAL 742 HG13 VAL 742 -2.963 -1.199 -7.439 668 HG21 VAL 742 HG21 VAL 742 -3.844 -3.275 -4.023 669 HG22 VAL 742 HG22 VAL 742 -2.291 -2.813 -4.725 670 HG23 VAL 742 HG23 VAL 742 -3.236 -1.630 -3.819 671 H GLU 743 H GLU 743 -5.874 -2.909 -7.544 672 HA GLU 743 HA GLU 743 -6.181 -0.787 -9.362 673 HB2 GLU 743 HB2 GLU 743 -7.227 -3.598 -9.643 674 HB3 GLU 743 HB3 GLU 743 -6.783 -2.488 -10.945 675 HG2 GLU 743 HG2 GLU 743 -4.734 -3.178 -8.852 676 HG3 GLU 743 HG3 GLU 743 -5.068 -4.335 -10.117 677 H PHE 744 H PHE 744 -8.419 -2.256 -7.180 678 HA PHE 744 HA PHE 744 -10.797 -1.371 -8.588 679 HB2 PHE 744 HB2 PHE 744 -10.987 -3.358 -7.278 680 HB3 PHE 744 HB3 PHE 744 -10.298 -2.573 -5.864 681 HD1 PHE 744 HD2 PHE 744 -13.124 -1.991 -8.286 682 HD2 PHE 744 HD1 PHE 744 -11.768 -1.911 -4.216 683 HE1 PHE 744 HE2 PHE 744 -15.382 -1.277 -7.548 684 HE2 PHE 744 HE1 PHE 744 -14.024 -1.197 -3.470 685 HZ PHE 744 HZ PHE 744 -15.833 -0.877 -5.140 686 H TYR 745 H TYR 745 -8.718 -0.223 -6.006 687 HA TYR 745 HA TYR 745 -10.531 1.862 -5.168 688 HB2 TYR 745 HB2 TYR 745 -7.675 1.163 -4.537 689 HB3 TYR 745 HB3 TYR 745 -8.396 2.664 -3.962 690 HD1 TYR 745 HD2 TYR 745 -10.959 0.230 -4.257 691 HD2 TYR 745 HD1 TYR 745 -7.676 1.399 -1.746 692 HE1 TYR 745 HE2 TYR 745 -11.974 -0.991 -2.358 693 HE2 TYR 745 HE1 TYR 745 -8.691 0.172 0.148 694 HH TYR 745 HH TYR 745 -10.465 -0.933 0.865 695 H GLN 746 H GLN 746 -8.380 1.491 -7.765 696 HA GLN 746 HA GLN 746 -7.266 3.990 -8.173 697 HB2 GLN 746 HB2 GLN 746 -8.497 2.046 -10.131 698 HB3 GLN 746 HB3 GLN 746 -7.653 3.511 -10.647 699 HG2 GLN 746 HG2 GLN 746 -5.611 2.800 -9.568 700 HG3 GLN 746 HG3 GLN 746 -6.427 1.437 -8.804 701 HE21 GLN 746 HE21 GLN 746 -7.715 0.081 -10.716 702 HE22 GLN 746 HE22 GLN 746 -6.688 -0.320 -12.015 703 H GLN 747 H GLN 747 -10.582 2.948 -8.742 704 HA GLN 747 HA GLN 747 -11.361 5.725 -9.412 705 HB2 GLN 747 HB2 GLN 747 -13.160 3.316 -9.626 706 HB3 GLN 747 HB3 GLN 747 -13.235 4.836 -10.518 707 HG2 GLN 747 HG2 GLN 747 -12.310 3.421 -12.125 708 HG3 GLN 747 HG3 GLN 747 -10.859 4.102 -11.397 709 HE21 GLN 747 HE21 GLN 747 -11.401 1.360 -12.674 710 HE22 GLN 747 HE22 GLN 747 -10.868 0.255 -11.503 711 H ASN 748 H ASN 748 -11.637 3.197 -7.082 712 HA ASN 748 HA ASN 748 -13.765 4.575 -5.593 713 HB2 ASN 748 HB2 ASN 748 -14.229 2.285 -5.713 714 HB3 ASN 748 HB3 ASN 748 -12.542 1.830 -5.529 715 HD21 ASN 748 HD21 ASN 748 -11.621 2.677 -3.255 716 HD22 ASN 748 HD22 ASN 748 -12.642 2.354 -1.938 717 H SER 749 H SER 749 -13.014 6.204 -4.367 718 HA SER 749 HA SER 749 -10.518 6.782 -3.503 719 HB2 SER 749 HB2 SER 749 -12.919 7.907 -3.160 720 HB3 SER 749 HB3 SER 749 -12.683 7.263 -1.543 721 HG SER 749 HG SER 749 -10.382 8.342 -2.306 722 H LEU 750 H LEU 750 -9.158 6.269 -1.855 723 HA LEU 750 HA LEU 750 -9.307 3.678 -0.719 724 HB2 LEU 750 HB2 LEU 750 -7.584 6.060 -0.037 725 HB3 LEU 750 HB3 LEU 750 -7.356 4.455 0.649 726 HG LEU 750 HG LEU 750 -7.621 4.246 -2.216 727 HD11 LEU 750 HD11 LEU 750 -5.658 5.513 -2.886 728 HD12 LEU 750 HD12 LEU 750 -6.811 6.601 -2.113 729 HD13 LEU 750 HD13 LEU 750 -5.397 6.041 -1.224 730 HD21 LEU 750 HD21 LEU 750 -5.171 3.836 -0.485 731 HD22 LEU 750 HD22 LEU 750 -6.515 2.696 -0.518 732 HD23 LEU 750 HD23 LEU 750 -5.584 3.003 -1.983 733 H LYS 751 H LYS 751 -10.296 6.815 0.481 734 HA LYS 751 HA LYS 751 -10.437 6.372 3.195 735 HB2 LYS 751 HB2 LYS 751 -12.308 7.968 3.248 736 HB3 LYS 751 HB3 LYS 751 -10.974 8.523 2.255 737 HG2 LYS 751 HG2 LYS 751 -12.425 7.260 0.362 738 HG3 LYS 751 HG3 LYS 751 -13.725 7.764 1.453 739 HD2 LYS 751 HD2 LYS 751 -12.834 10.059 1.457 740 HD3 LYS 751 HD3 LYS 751 -11.540 9.553 0.383 741 HE2 LYS 751 HE2 LYS 751 -13.819 8.742 -0.959 742 HE3 LYS 751 HE3 LYS 751 -14.272 10.303 -0.257 743 HZ1 LYS 751 HZ1 LYS 751 -13.190 10.824 -2.261 744 HZ2 LYS 751 HZ2 LYS 751 -12.012 11.111 -1.035 745 HZ3 LYS 751 HZ3 LYS 751 -11.941 9.672 -1.990 746 H ASP 752 H ASP 752 -12.122 4.767 0.707 747 HA ASP 752 HA ASP 752 -14.455 3.973 2.149 748 HB2 ASP 752 HB2 ASP 752 -14.840 2.431 0.432 749 HB3 ASP 752 HB3 ASP 752 -13.937 3.704 -0.377 750 H CYS 753 H CYS 753 -11.156 2.902 2.063 751 HA CYS 753 HA CYS 753 -11.716 0.842 4.127 752 HB2 CYS 753 HB2 CYS 753 -9.960 0.849 1.784 753 HB3 CYS 753 HB3 CYS 753 -9.133 0.419 3.267 754 HG CYS 753 HG CYS 753 -10.157 -1.810 3.032 755 H PHE 754 H PHE 754 -9.448 3.268 2.935 756 HA PHE 754 HA PHE 754 -7.822 3.258 5.236 757 HB2 PHE 754 HB2 PHE 754 -8.193 5.132 2.940 758 HB3 PHE 754 HB3 PHE 754 -7.212 5.616 4.321 759 HD1 PHE 754 HD2 PHE 754 -7.689 2.687 2.028 760 HD2 PHE 754 HD1 PHE 754 -4.936 5.054 4.322 761 HE1 PHE 754 HE2 PHE 754 -5.799 1.355 1.138 762 HE2 PHE 754 HE1 PHE 754 -3.046 3.727 3.424 763 HZ PHE 754 HZ PHE 754 -3.478 1.876 1.834 764 H LYS 755 H LYS 755 -7.609 5.009 6.804 765 HA LYS 755 HA LYS 755 -10.219 5.761 7.808 766 HB2 LYS 755 HB2 LYS 755 -7.726 6.678 9.150 767 HB3 LYS 755 HB3 LYS 755 -9.201 6.000 9.842 768 HG2 LYS 755 HG2 LYS 755 -6.964 4.518 8.438 769 HG3 LYS 755 HG3 LYS 755 -7.503 4.325 10.103 770 HD2 LYS 755 HD2 LYS 755 -9.761 3.574 9.136 771 HD3 LYS 755 HD3 LYS 755 -8.947 3.475 7.582 772 HE2 LYS 755 HE2 LYS 755 -8.872 1.282 8.535 773 HE3 LYS 755 HE3 LYS 755 -7.242 1.956 8.654 774 HZ1 LYS 755 HZ1 LYS 755 -8.816 2.682 10.926 775 HZ2 LYS 755 HZ2 LYS 755 -8.792 0.975 10.725 776 HZ3 LYS 755 HZ3 LYS 755 -7.315 1.833 10.842 777 H SER 756 H SER 756 -7.216 7.651 7.327 778 HA SER 756 HA SER 756 -8.862 10.052 6.980 779 HB2 SER 756 HB2 SER 756 -7.103 11.231 7.779 780 HB3 SER 756 HB3 SER 756 -6.532 9.664 8.344 781 HG SER 756 HG SER 756 -4.993 10.866 7.062 782 H LEU 757 H LEU 757 -6.715 7.945 5.244 783 HA LEU 757 HA LEU 757 -5.926 9.310 3.017 784 HB2 LEU 757 HB2 LEU 757 -5.816 6.759 3.734 785 HB3 LEU 757 HB3 LEU 757 -7.164 6.634 2.614 786 HG LEU 757 HG LEU 757 -5.209 6.202 1.343 787 HD11 LEU 757 HD11 LEU 757 -5.752 9.109 0.848 788 HD12 LEU 757 HD12 LEU 757 -5.313 7.863 -0.317 789 HD13 LEU 757 HD13 LEU 757 -6.911 7.847 0.426 790 HD21 LEU 757 HD21 LEU 757 -3.607 7.117 2.969 791 HD22 LEU 757 HD22 LEU 757 -3.287 7.713 1.338 792 HD23 LEU 757 HD23 LEU 757 -4.095 8.751 2.507 793 H ASP 758 H ASP 758 -7.196 10.794 1.962 794 HA ASP 758 HA ASP 758 -9.818 9.818 1.025 795 HB2 ASP 758 HB2 ASP 758 -9.814 11.762 2.685 796 HB3 ASP 758 HB3 ASP 758 -9.144 12.736 1.379 797 H THR 759 H THR 759 -8.513 8.929 -0.748 798 HA THR 759 HA THR 759 -8.865 10.533 -3.053 799 HB THR 759 HB THR 759 -6.741 11.566 -2.403 800 HG1 THR 759 HG1 THR 759 -5.779 11.244 -4.390 801 HG21 THR 759 HG21 THR 759 -4.761 10.379 -2.058 802 HG22 THR 759 HG22 THR 759 -5.960 9.352 -1.284 803 HG23 THR 759 HG23 THR 759 -5.364 8.942 -2.887 804 H THR 760 H THR 760 -7.097 9.198 -4.807 805 HA THR 760 HA THR 760 -7.907 6.360 -4.473 806 HB THR 760 HB THR 760 -8.372 6.286 -6.925 807 HG1 THR 760 HG1 THR 760 -8.718 8.364 -7.898 808 HG21 THR 760 HG21 THR 760 -10.514 7.656 -6.780 809 HG22 THR 760 HG22 THR 760 -10.280 6.445 -5.521 810 HG23 THR 760 HG23 THR 760 -9.976 8.149 -5.174 811 H LEU 761 H LEU 761 -6.746 4.923 -6.070 812 HA LEU 761 HA LEU 761 -3.932 5.255 -5.778 813 HB2 LEU 761 HB2 LEU 761 -5.608 3.351 -7.440 814 HB3 LEU 761 HB3 LEU 761 -3.852 3.281 -7.394 815 HG LEU 761 HG LEU 761 -4.813 1.696 -5.778 816 HD11 LEU 761 HD11 LEU 761 -3.832 3.854 -3.982 817 HD12 LEU 761 HD12 LEU 761 -3.287 2.184 -4.138 818 HD13 LEU 761 HD13 LEU 761 -2.781 3.392 -5.313 819 HD21 LEU 761 HD21 LEU 761 -5.963 4.090 -4.336 820 HD22 LEU 761 HD22 LEU 761 -6.913 3.090 -5.432 821 HD23 LEU 761 HD23 LEU 761 -6.214 2.385 -3.976 822 H GLN 762 H GLN 762 -3.640 7.362 -6.669 823 HA GLN 762 HA GLN 762 -4.326 8.143 -9.271 824 HB2 GLN 762 HB2 GLN 762 -2.121 9.044 -7.418 825 HB3 GLN 762 HB3 GLN 762 -2.474 9.837 -8.950 826 HG2 GLN 762 HG2 GLN 762 -4.840 9.360 -7.242 827 HG3 GLN 762 HG3 GLN 762 -3.672 10.496 -6.578 828 HE21 GLN 762 HE21 GLN 762 -6.106 10.053 -9.016 829 HE22 GLN 762 HE22 GLN 762 -5.965 11.592 -9.715 830 H PHE 763 H PHE 763 -1.033 7.265 -8.182 831 HA PHE 763 HA PHE 763 -0.623 5.712 -10.601 832 HB2 PHE 763 HB2 PHE 763 1.634 7.399 -10.617 833 HB3 PHE 763 HB3 PHE 763 0.356 7.310 -11.825 834 HD1 PHE 763 HD1 PHE 763 1.431 9.022 -8.703 835 HD2 PHE 763 HD2 PHE 763 -1.301 9.024 -12.016 836 HE1 PHE 763 HE1 PHE 763 0.683 11.303 -8.081 837 HE2 PHE 763 HE2 PHE 763 -2.048 11.307 -11.396 838 HZ PHE 763 HZ PHE 763 -1.058 12.445 -9.429 839 HA PRO 764 HA PRO 764 1.984 3.462 -7.870 840 HB2 PRO 764 HB2 PRO 764 3.562 2.206 -9.759 841 HB3 PRO 764 HB3 PRO 764 1.922 1.688 -9.325 842 HG2 PRO 764 HG2 PRO 764 2.864 3.219 -11.677 843 HG3 PRO 764 HG3 PRO 764 1.546 2.046 -11.541 844 HD2 PRO 764 HD2 PRO 764 1.157 4.765 -11.657 845 HD3 PRO 764 HD3 PRO 764 0.024 3.636 -10.884 846 H PHE 765 H PHE 765 3.830 3.909 -6.771 847 HA PHE 765 HA PHE 765 5.409 6.133 -7.247 848 HB2 PHE 765 HB2 PHE 765 6.795 5.382 -5.527 849 HB3 PHE 765 HB3 PHE 765 5.278 4.547 -5.188 850 HD1 PHE 765 HD1 PHE 765 5.012 2.226 -6.541 851 HD2 PHE 765 HD2 PHE 765 8.737 4.100 -5.523 852 HE1 PHE 765 HE1 PHE 765 6.161 0.057 -6.772 853 HE2 PHE 765 HE2 PHE 765 9.894 1.919 -5.750 854 HZ PHE 765 HZ PHE 765 8.606 -0.102 -6.375 855 H LYS 766 H LYS 766 5.733 2.918 -8.581 856 HA LYS 766 HA LYS 766 8.369 3.115 -9.556 857 HB2 LYS 766 HB2 LYS 766 5.993 1.426 -10.071 858 HB3 LYS 766 HB3 LYS 766 7.277 1.404 -11.269 859 HG2 LYS 766 HG2 LYS 766 8.351 1.286 -8.577 860 HG3 LYS 766 HG3 LYS 766 7.223 -0.032 -8.881 861 HD2 LYS 766 HD2 LYS 766 9.441 -0.741 -9.578 862 HD3 LYS 766 HD3 LYS 766 8.448 -0.511 -11.018 863 HE2 LYS 766 HE2 LYS 766 10.090 1.785 -9.970 864 HE3 LYS 766 HE3 LYS 766 10.867 0.528 -10.927 865 HZ1 LYS 766 HZ1 LYS 766 8.716 1.017 -12.420 866 HZ2 LYS 766 HZ2 LYS 766 8.946 2.568 -11.755 867 HZ3 LYS 766 HZ3 LYS 766 10.192 1.818 -12.633 868 H GLU 767 H GLU 767 5.380 4.451 -10.638 869 HA GLU 767 HA GLU 767 6.184 4.815 -13.362 870 HB2 GLU 767 HB2 GLU 767 3.786 4.983 -11.908 871 HB3 GLU 767 HB3 GLU 767 4.102 6.623 -12.464 872 HG2 GLU 767 HG2 GLU 767 4.694 5.254 -14.717 873 HG3 GLU 767 HG3 GLU 767 3.480 4.183 -14.030 874 H1 ASP 338 H1 ASP 338 15.494 0.979 7.595 875 H2 ASP 338 H2 ASP 338 14.882 1.094 6.004 876 H3 ASP 338 H3 ASP 338 15.639 -0.350 6.540 877 HA ASP 338 HA ASP 338 13.007 -0.005 6.487 878 HB2 ASP 338 HB2 ASP 338 14.457 -1.589 8.624 879 HB3 ASP 338 HB3 ASP 338 12.915 -1.979 7.862 880 H THR 339 H THR 339 12.449 -0.851 9.346 881 HA THR 339 HA THR 339 11.778 0.067 11.354 882 HB THR 339 HB THR 339 13.136 2.640 10.509 883 HG1 THR 339 HG1 THR 339 14.573 1.390 12.272 884 HG21 THR 339 HG21 THR 339 11.884 3.210 12.360 885 HG22 THR 339 HG22 THR 339 11.885 1.567 12.998 886 HG23 THR 339 HG23 THR 339 13.318 2.579 13.168 887 H GLU 340 H GLU 340 9.844 0.950 11.914 888 HA GLU 340 HA GLU 340 7.714 1.730 11.525 889 HB2 GLU 340 HB2 GLU 340 9.640 3.876 11.051 890 HB3 GLU 340 HB3 GLU 340 8.123 4.141 10.198 891 HG2 GLU 340 HG2 GLU 340 8.207 5.053 12.571 892 HG3 GLU 340 HG3 GLU 340 6.848 3.988 12.224 893 H VAL 341 H VAL 341 8.510 -0.122 9.623 894 HA VAL 341 HA VAL 341 8.307 0.540 6.939 895 HB VAL 341 HB VAL 341 6.825 -1.927 7.608 896 HG11 VAL 341 HG11 VAL 341 9.419 -2.053 6.216 897 HG12 VAL 341 HG12 VAL 341 7.830 -2.617 5.707 898 HG13 VAL 341 HG13 VAL 341 8.269 -0.926 5.495 899 HG21 VAL 341 HG21 VAL 341 8.549 -1.634 9.543 900 HG22 VAL 341 HG22 VAL 341 8.579 -3.139 8.636 901 HG23 VAL 341 HG23 VAL 341 9.773 -1.892 8.300 902 H TYR 342 H TYR 342 5.863 0.406 9.379 903 HA TYR 342 HA TYR 342 4.009 2.024 8.171 904 HB2 TYR 342 HB2 TYR 342 2.251 -0.050 7.844 905 HB3 TYR 342 HB3 TYR 342 3.080 0.777 6.537 906 HD1 TYR 342 HD2 TYR 342 4.017 -1.884 9.044 907 HD2 TYR 342 HD1 TYR 342 3.893 -0.663 4.919 908 HE1 TYR 342 HE2 TYR 342 5.071 -4.026 8.367 909 HE2 TYR 342 HE1 TYR 342 4.943 -2.798 4.258 910 HH TYR 342 HH TYR 342 4.936 -5.362 5.668 911 H GLU 343 H GLU 343 4.112 2.666 10.324 912 HA GLU 343 HA GLU 343 3.494 1.086 12.573 913 HB2 GLU 343 HB2 GLU 343 3.174 3.236 13.727 914 HB3 GLU 343 HB3 GLU 343 4.615 3.267 12.711 915 HG2 GLU 343 HG2 GLU 343 2.030 4.178 11.499 916 HG3 GLU 343 HG3 GLU 343 2.823 5.251 12.646 917 H SER 344 H SER 344 1.478 1.038 10.236 918 HA SER 344 HA SER 344 -0.807 0.950 9.945 919 HB2 SER 344 HB2 SER 344 -0.840 0.315 12.893 920 HB3 SER 344 HB3 SER 344 -1.936 -0.272 11.641 921 HG SER 344 HG SER 344 0.846 -0.724 11.414 922 HA PRO 345 HA PRO 345 -1.043 5.504 11.241 923 HB2 PRO 345 HB2 PRO 345 -3.095 4.840 9.111 924 HB3 PRO 345 HB3 PRO 345 -2.201 6.356 9.346 925 HG2 PRO 345 HG2 PRO 345 -1.419 4.494 7.589 926 HG3 PRO 345 HG3 PRO 345 -0.266 5.501 8.480 927 HD2 PRO 345 HD2 PRO 345 -0.727 2.616 8.721 928 HD3 PRO 345 HD3 PRO 345 0.586 3.594 9.411 929 H PTR 346 H PTR 346 -3.778 3.200 10.830 930 HA PTR 346 HA PTR 346 -4.706 3.570 13.476 931 HB2 PTR 346 HB2 PTR 346 -5.939 5.429 13.346 932 HB3 PTR 346 HB3 PTR 346 -7.003 4.587 12.228 933 HD1 PTR 346 HD1 PTR 346 -5.320 4.326 9.802 934 HD2 PTR 346 HD2 PTR 346 -5.758 7.600 12.540 935 HE1 PTR 346 HE1 PTR 346 -4.662 5.903 8.000 936 HE2 PTR 346 HE2 PTR 346 -5.104 9.182 10.757 937 H ALA 347 H ALA 347 -6.283 2.150 14.062 938 HA ALA 347 HA ALA 347 -7.107 0.133 12.052 939 HB1 ALA 347 HB1 ALA 347 -6.815 -1.335 13.726 940 HB2 ALA 347 HB2 ALA 347 -7.942 -0.447 14.751 941 HB3 ALA 347 HB3 ALA 347 -6.231 -0.019 14.744 942 H ASP 348 H ASP 348 -8.304 2.371 14.478 943 HA ASP 348 HA ASP 348 -10.247 3.713 14.172 944 HB2 ASP 348 HB2 ASP 348 -11.438 1.259 12.857 945 HB3 ASP 348 HB3 ASP 348 -12.276 2.775 13.132 946 HA PRO 349 HA PRO 349 -11.840 2.093 17.951 947 HB2 PRO 349 HB2 PRO 349 -13.915 3.783 18.395 948 HB3 PRO 349 HB3 PRO 349 -12.224 4.319 18.454 949 HG2 PRO 349 HG2 PRO 349 -14.271 4.752 16.363 950 HG3 PRO 349 HG3 PRO 349 -12.912 5.775 16.848 951 HD2 PRO 349 HD2 PRO 349 -12.985 4.055 14.603 952 HD3 PRO 349 HD3 PRO 349 -11.546 4.855 15.270 953 H GLU 350 H GLU 350 -14.591 2.940 15.844 954 HA GLU 350 HA GLU 350 -16.503 1.830 15.257 955 HB2 GLU 350 HB2 GLU 350 -14.440 -0.221 15.448 956 HB3 GLU 350 HB3 GLU 350 -16.042 -0.865 15.794 957 HG2 GLU 350 HG2 GLU 350 -15.796 -1.040 13.430 958 HG3 GLU 350 HG3 GLU 350 -16.831 0.362 13.686 Start of MODEL 10 1 H1 GLY 661 H1 GLY 661 -5.553 -8.617 -11.800 2 H2 GLY 661 H2 GLY 661 -6.016 -8.896 -10.185 3 H3 GLY 661 H3 GLY 661 -6.523 -9.957 -11.421 4 HA2 GLY 661 HA2 GLY 661 -4.589 -11.092 -11.469 5 HA3 GLY 661 HA3 GLY 661 -3.644 -9.628 -11.204 6 H HIS 662 H HIS 662 -6.047 -11.631 -9.478 7 HA HIS 662 HA HIS 662 -5.189 -10.861 -6.883 8 HB2 HIS 662 HB2 HIS 662 -6.683 -12.570 -6.079 9 HB3 HIS 662 HB3 HIS 662 -7.447 -11.795 -7.465 10 HD1 HIS 662 HD1 HIS 662 -5.050 -14.715 -6.959 11 HD2 HIS 662 HD2 HIS 662 -8.435 -13.714 -9.184 12 HE1 HIS 662 HE1 HIS 662 -5.628 -16.763 -8.358 13 HE2 HIS 662 HE2 HIS 662 -7.691 -16.162 -9.718 14 H MET 663 H MET 663 -2.987 -11.792 -8.588 15 HA MET 663 HA MET 663 -2.171 -14.358 -7.481 16 HB2 MET 663 HB2 MET 663 -0.941 -12.414 -9.426 17 HB3 MET 663 HB3 MET 663 0.011 -13.730 -8.734 18 HG2 MET 663 HG2 MET 663 -0.848 -14.685 -10.699 19 HG3 MET 663 HG3 MET 663 -1.975 -15.245 -9.461 20 HE1 MET 663 HE1 MET 663 -4.144 -15.069 -12.298 21 HE2 MET 663 HE2 MET 663 -2.728 -14.388 -13.095 22 HE3 MET 663 HE3 MET 663 -2.543 -15.677 -11.898 23 H GLN 664 H GLN 664 0.071 -14.513 -6.576 24 HA GLN 664 HA GLN 664 0.313 -12.570 -4.411 25 HB2 GLN 664 HB2 GLN 664 1.077 -15.346 -4.858 26 HB3 GLN 664 HB3 GLN 664 2.392 -14.391 -4.171 27 HG2 GLN 664 HG2 GLN 664 0.847 -15.420 -2.452 28 HG3 GLN 664 HG3 GLN 664 1.024 -13.671 -2.332 29 HE21 GLN 664 HE21 GLN 664 -1.123 -16.023 -4.055 30 HE22 GLN 664 HE22 GLN 664 -2.533 -15.119 -3.794 31 H ASP 665 H ASP 665 2.037 -13.670 -7.279 32 HA ASP 665 HA ASP 665 4.448 -12.238 -6.835 33 HB2 ASP 665 HB2 ASP 665 3.550 -12.598 -9.620 34 HB3 ASP 665 HB3 ASP 665 5.064 -13.065 -8.858 35 H LEU 666 H LEU 666 2.606 -10.536 -6.051 36 HA LEU 666 HA LEU 666 1.532 -8.697 -7.879 37 HB2 LEU 666 HB2 LEU 666 2.551 -8.113 -5.090 38 HB3 LEU 666 HB3 LEU 666 1.359 -7.179 -5.983 39 HG LEU 666 HG LEU 666 0.826 -10.090 -5.630 40 HD11 LEU 666 HD11 LEU 666 1.359 -9.787 -3.397 41 HD12 LEU 666 HD12 LEU 666 0.909 -8.080 -3.414 42 HD13 LEU 666 HD13 LEU 666 -0.342 -9.324 -3.405 43 HD21 LEU 666 HD21 LEU 666 -0.798 -7.544 -5.666 44 HD22 LEU 666 HD22 LEU 666 -0.774 -8.828 -6.874 45 HD23 LEU 666 HD23 LEU 666 -1.495 -9.121 -5.293 46 H SER 667 H SER 667 4.759 -9.311 -6.976 47 HA SER 667 HA SER 667 6.084 -6.893 -7.200 48 HB2 SER 667 HB2 SER 667 7.012 -9.302 -6.813 49 HB3 SER 667 HB3 SER 667 7.163 -9.344 -8.568 50 HG SER 667 HG SER 667 8.396 -7.396 -8.403 51 H VAL 668 H VAL 668 4.329 -8.613 -9.582 52 HA VAL 668 HA VAL 668 5.578 -7.499 -11.906 53 HB VAL 668 HB VAL 668 3.752 -8.486 -13.126 54 HG11 VAL 668 HG11 VAL 668 4.992 -9.974 -10.879 55 HG12 VAL 668 HG12 VAL 668 3.582 -10.742 -11.608 56 HG13 VAL 668 HG13 VAL 668 4.983 -10.341 -12.604 57 HG21 VAL 668 HG21 VAL 668 2.352 -8.107 -10.535 58 HG22 VAL 668 HG22 VAL 668 1.713 -8.048 -12.179 59 HG23 VAL 668 HG23 VAL 668 1.966 -9.603 -11.385 60 H HIS 669 H HIS 669 3.514 -6.213 -9.521 61 HA HIS 669 HA HIS 669 2.194 -4.330 -11.308 62 HB2 HIS 669 HB2 HIS 669 2.182 -4.548 -8.300 63 HB3 HIS 669 HB3 HIS 669 1.202 -3.431 -9.248 64 HD1 HIS 669 HD1 HIS 669 0.096 -5.007 -11.459 65 HD2 HIS 669 HD2 HIS 669 0.573 -6.656 -7.673 66 HE1 HIS 669 HE1 HIS 669 -1.537 -6.934 -11.317 67 HE2 HIS 669 HE2 HIS 669 -1.377 -7.859 -8.944 68 H LEU 670 H LEU 670 2.853 -2.431 -11.822 69 HA LEU 670 HA LEU 670 5.342 -1.356 -11.326 70 HB2 LEU 670 HB2 LEU 670 3.714 -0.691 -13.116 71 HB3 LEU 670 HB3 LEU 670 2.798 0.187 -11.897 72 HG LEU 670 HG LEU 670 4.753 1.613 -11.439 73 HD11 LEU 670 HD11 LEU 670 6.575 0.089 -11.922 74 HD12 LEU 670 HD12 LEU 670 6.045 -0.083 -13.595 75 HD13 LEU 670 HD13 LEU 670 6.701 1.456 -13.032 76 HD21 LEU 670 HD21 LEU 670 3.113 2.159 -13.276 77 HD22 LEU 670 HD22 LEU 670 4.715 2.860 -13.507 78 HD23 LEU 670 HD23 LEU 670 4.240 1.430 -14.418 79 H TRP 671 H TRP 671 2.497 -1.333 -9.292 80 HA TRP 671 HA TRP 671 3.636 0.772 -7.611 81 HB2 TRP 671 HB2 TRP 671 1.506 0.255 -6.208 82 HB3 TRP 671 HB3 TRP 671 1.369 1.159 -7.705 83 HD1 TRP 671 HD1 TRP 671 -0.023 0.122 -9.639 84 HE1 TRP 671 HE1 TRP 671 -1.533 -1.985 -9.838 85 HE3 TRP 671 HE3 TRP 671 1.368 -2.343 -5.381 86 HZ2 TRP 671 HZ2 TRP 671 -2.028 -4.388 -8.381 87 HZ3 TRP 671 HZ3 TRP 671 0.359 -4.535 -4.812 88 HH2 TRP 671 HH2 TRP 671 -1.335 -5.557 -6.307 89 H TYR 672 H TYR 672 4.193 -2.450 -7.904 90 HA TYR 672 HA TYR 672 4.231 -3.047 -5.048 91 HB2 TYR 672 HB2 TYR 672 3.908 -4.672 -7.165 92 HB3 TYR 672 HB3 TYR 672 5.650 -4.836 -6.939 93 HD1 TYR 672 HD2 TYR 672 2.459 -4.799 -4.983 94 HD2 TYR 672 HD1 TYR 672 6.458 -6.329 -5.304 95 HE1 TYR 672 HE2 TYR 672 2.058 -6.266 -3.022 96 HE2 TYR 672 HE1 TYR 672 6.054 -7.790 -3.341 97 HH TYR 672 HH TYR 672 3.644 -8.822 -2.286 98 H ALA 673 H ALA 673 5.757 -2.354 -3.774 99 HA ALA 673 HA ALA 673 8.425 -1.702 -4.845 100 HB1 ALA 673 HB1 ALA 673 6.874 -0.192 -3.317 101 HB2 ALA 673 HB2 ALA 673 8.622 -0.196 -3.103 102 HB3 ALA 673 HB3 ALA 673 7.597 -1.150 -2.027 103 H GLY 674 H GLY 674 6.886 -4.273 -3.597 104 HA2 GLY 674 HA2 GLY 674 7.435 -6.108 -2.276 105 HA3 GLY 674 HA3 GLY 674 8.833 -6.079 -3.333 106 HA PRO 675 HA PRO 675 11.237 -5.860 0.354 107 HB2 PRO 675 HB2 PRO 675 13.607 -5.005 -0.726 108 HB3 PRO 675 HB3 PRO 675 12.995 -6.665 -0.867 109 HG2 PRO 675 HG2 PRO 675 12.913 -4.442 -2.845 110 HG3 PRO 675 HG3 PRO 675 13.206 -6.172 -3.097 111 HD2 PRO 675 HD2 PRO 675 10.797 -4.981 -3.618 112 HD3 PRO 675 HD3 PRO 675 10.951 -6.686 -3.137 113 H MET 676 H MET 676 10.481 -3.041 -1.466 114 HA MET 676 HA MET 676 12.033 -1.083 -0.176 115 HB2 MET 676 HB2 MET 676 10.376 -0.883 -2.174 116 HB3 MET 676 HB3 MET 676 9.173 -0.571 -0.923 117 HG2 MET 676 HG2 MET 676 9.878 1.561 -0.777 118 HG3 MET 676 HG3 MET 676 11.484 0.999 -0.317 119 HE1 MET 676 HE1 MET 676 13.359 2.262 -1.616 120 HE2 MET 676 HE2 MET 676 13.310 0.501 -1.669 121 HE3 MET 676 HE3 MET 676 13.707 1.422 -3.126 122 H GLU 677 H GLU 677 11.534 0.365 1.543 123 HA GLU 677 HA GLU 677 9.760 -0.804 3.598 124 HB2 GLU 677 HB2 GLU 677 11.196 0.391 5.234 125 HB3 GLU 677 HB3 GLU 677 12.092 -0.802 4.287 126 HG2 GLU 677 HG2 GLU 677 13.436 0.792 3.424 127 HG3 GLU 677 HG3 GLU 677 12.054 1.773 2.943 128 H ARG 678 H ARG 678 9.103 0.947 5.256 129 HA ARG 678 HA ARG 678 7.281 2.698 4.076 130 HB2 ARG 678 HB2 ARG 678 7.253 1.898 6.456 131 HB3 ARG 678 HB3 ARG 678 8.554 3.034 6.804 132 HG2 ARG 678 HG2 ARG 678 6.143 4.111 5.412 133 HG3 ARG 678 HG3 ARG 678 5.961 3.687 7.112 134 HD2 ARG 678 HD2 ARG 678 8.064 5.558 5.975 135 HD3 ARG 678 HD3 ARG 678 6.622 6.048 6.857 136 HE ARG 678 HE ARG 678 8.204 4.196 8.363 137 HH11 ARG 678 HH21 ARG 678 8.052 7.520 7.335 138 HH12 ARG 678 HH22 ARG 678 8.813 8.091 8.796 139 HH21 ARG 678 HH11 ARG 678 9.211 4.942 10.157 140 HH22 ARG 678 HH12 ARG 678 9.447 6.648 10.411 141 H ALA 679 H ALA 679 10.135 3.765 5.925 142 HA ALA 679 HA ALA 679 10.178 6.413 5.111 143 HB1 ALA 679 HB1 ALA 679 12.724 4.844 5.484 144 HB2 ALA 679 HB2 ALA 679 11.664 5.204 6.846 145 HB3 ALA 679 HB3 ALA 679 12.388 6.519 5.919 146 H GLY 680 H GLY 680 11.537 3.575 3.549 147 HA2 GLY 680 HA2 GLY 680 12.862 4.899 1.420 148 HA3 GLY 680 HA3 GLY 680 12.316 3.221 1.401 149 H ALA 681 H ALA 681 9.633 3.456 1.750 150 HA ALA 681 HA ALA 681 8.667 4.048 -0.824 151 HB1 ALA 681 HB1 ALA 681 6.395 3.957 0.376 152 HB2 ALA 681 HB2 ALA 681 7.318 3.639 1.843 153 HB3 ALA 681 HB3 ALA 681 7.412 2.521 0.485 154 H GLU 682 H GLU 682 8.538 5.913 2.200 155 HA GLU 682 HA GLU 682 7.010 8.072 1.220 156 HB2 GLU 682 HB2 GLU 682 9.175 8.503 3.260 157 HB3 GLU 682 HB3 GLU 682 7.554 9.200 3.189 158 HG2 GLU 682 HG2 GLU 682 6.868 6.625 3.438 159 HG3 GLU 682 HG3 GLU 682 8.426 6.544 4.221 160 H SER 683 H SER 683 10.440 7.342 1.086 161 HA SER 683 HA SER 683 11.462 9.804 0.309 162 HB2 SER 683 HB2 SER 683 13.385 8.654 -0.377 163 HB3 SER 683 HB3 SER 683 12.686 7.582 0.833 164 HG SER 683 HG SER 683 11.889 6.281 -0.773 165 H ILE 684 H ILE 684 10.520 7.129 -1.836 166 HA ILE 684 HA ILE 684 10.751 8.650 -4.229 167 HB ILE 684 HB ILE 684 8.931 6.266 -3.852 168 HG12 ILE 684 HG12 ILE 684 11.456 5.423 -4.818 169 HG13 ILE 684 HG13 ILE 684 11.782 6.420 -3.401 170 HG21 ILE 684 HG21 ILE 684 9.773 7.854 -6.078 171 HG22 ILE 684 HG22 ILE 684 10.487 6.251 -6.251 172 HG23 ILE 684 HG23 ILE 684 8.740 6.425 -6.084 173 HD11 ILE 684 HD11 ILE 684 10.094 5.106 -2.129 174 HD12 ILE 684 HD12 ILE 684 9.881 4.063 -3.530 175 HD13 ILE 684 HD13 ILE 684 11.433 4.110 -2.695 176 H LEU 685 H LEU 685 7.994 7.721 -2.216 177 HA LEU 685 HA LEU 685 5.979 8.959 -3.721 178 HB2 LEU 685 HB2 LEU 685 6.202 8.358 -0.775 179 HB3 LEU 685 HB3 LEU 685 4.725 8.961 -1.525 180 HG LEU 685 HG LEU 685 6.191 6.421 -2.317 181 HD11 LEU 685 HD11 LEU 685 4.183 5.292 -1.397 182 HD12 LEU 685 HD12 LEU 685 5.061 6.190 -0.160 183 HD13 LEU 685 HD13 LEU 685 3.577 6.853 -0.844 184 HD21 LEU 685 HD21 LEU 685 3.769 7.857 -3.385 185 HD22 LEU 685 HD22 LEU 685 5.119 7.152 -4.273 186 HD23 LEU 685 HD23 LEU 685 3.904 6.106 -3.542 187 H ALA 686 H ALA 686 7.718 10.252 -0.846 188 HA ALA 686 HA ALA 686 6.535 12.800 -0.859 189 HB1 ALA 686 HB1 ALA 686 8.117 11.742 0.884 190 HB2 ALA 686 HB2 ALA 686 8.284 13.470 0.581 191 HB3 ALA 686 HB3 ALA 686 9.427 12.334 -0.137 192 H ASN 687 H ASN 687 9.230 11.485 -2.691 193 HA ASN 687 HA ASN 687 10.044 13.965 -3.881 194 HB2 ASN 687 HB2 ASN 687 11.724 12.339 -3.865 195 HB3 ASN 687 HB3 ASN 687 10.625 11.054 -4.341 196 HD21 ASN 687 HD21 ASN 687 10.889 14.220 -5.995 197 HD22 ASN 687 HD22 ASN 687 11.491 13.570 -7.440 198 H ARG 688 H ARG 688 7.833 11.363 -4.722 199 HA ARG 688 HA ARG 688 7.276 12.331 -7.378 200 HB2 ARG 688 HB2 ARG 688 6.618 10.032 -5.779 201 HB3 ARG 688 HB3 ARG 688 5.141 10.714 -6.453 202 HG2 ARG 688 HG2 ARG 688 5.967 9.179 -8.089 203 HG3 ARG 688 HG3 ARG 688 6.346 10.791 -8.698 204 HD2 ARG 688 HD2 ARG 688 8.559 10.359 -8.649 205 HD3 ARG 688 HD3 ARG 688 8.465 9.836 -6.967 206 HE ARG 688 HE ARG 688 8.428 7.639 -7.712 207 HH11 ARG 688 HH21 ARG 688 7.574 9.766 -10.288 208 HH12 ARG 688 HH22 ARG 688 7.579 8.516 -11.495 209 HH21 ARG 688 HH11 ARG 688 8.459 6.044 -9.260 210 HH22 ARG 688 HH12 ARG 688 8.181 6.456 -10.941 211 H SER 689 H SER 689 4.660 12.446 -7.738 212 HA SER 689 HA SER 689 3.926 14.910 -6.379 213 HB2 SER 689 HB2 SER 689 3.555 14.244 -8.907 214 HB3 SER 689 HB3 SER 689 2.079 13.517 -8.271 215 HG SER 689 HG SER 689 2.297 15.960 -8.900 216 H ASP 690 H ASP 690 1.722 15.212 -5.544 217 HA ASP 690 HA ASP 690 1.144 13.267 -3.569 218 HB2 ASP 690 HB2 ASP 690 0.229 15.938 -4.253 219 HB3 ASP 690 HB3 ASP 690 -1.099 14.907 -3.726 220 H GLY 691 H GLY 691 -0.155 11.582 -3.556 221 HA2 GLY 691 HA2 GLY 691 -2.284 10.548 -4.269 222 HA3 GLY 691 HA3 GLY 691 -1.950 11.166 -5.887 223 H THR 692 H THR 692 0.956 10.590 -5.475 224 HA THR 692 HA THR 692 1.170 8.125 -6.782 225 HB THR 692 HB THR 692 3.306 9.263 -4.969 226 HG1 THR 692 HG1 THR 692 2.817 11.015 -6.136 227 HG21 THR 692 HG21 THR 692 4.745 7.953 -6.146 228 HG22 THR 692 HG22 THR 692 3.300 7.033 -6.560 229 HG23 THR 692 HG23 THR 692 3.918 8.254 -7.672 230 H PHE 693 H PHE 693 1.600 6.012 -6.073 231 HA PHE 693 HA PHE 693 1.649 5.536 -3.169 232 HB2 PHE 693 HB2 PHE 693 -0.250 4.095 -3.183 233 HB3 PHE 693 HB3 PHE 693 -0.741 5.580 -3.995 234 HD1 PHE 693 HD1 PHE 693 -0.839 5.667 -6.503 235 HD2 PHE 693 HD2 PHE 693 -0.149 2.009 -4.361 236 HE1 PHE 693 HE1 PHE 693 -1.422 4.368 -8.533 237 HE2 PHE 693 HE2 PHE 693 -0.736 0.713 -6.388 238 HZ PHE 693 HZ PHE 693 -1.368 1.889 -8.476 239 H LEU 694 H LEU 694 1.740 3.106 -2.710 240 HA LEU 694 HA LEU 694 2.753 1.312 -4.666 241 HB2 LEU 694 HB2 LEU 694 5.078 1.180 -4.011 242 HB3 LEU 694 HB3 LEU 694 4.705 2.823 -4.506 243 HG LEU 694 HG LEU 694 4.169 3.097 -1.909 244 HD11 LEU 694 HD11 LEU 694 4.929 1.429 -0.594 245 HD12 LEU 694 HD12 LEU 694 5.292 0.495 -2.044 246 HD13 LEU 694 HD13 LEU 694 6.527 1.535 -1.334 247 HD21 LEU 694 HD21 LEU 694 6.888 3.137 -3.240 248 HD22 LEU 694 HD22 LEU 694 5.768 4.485 -3.051 249 HD23 LEU 694 HD23 LEU 694 6.586 3.815 -1.644 250 H VAL 695 H VAL 695 3.691 -0.672 -3.673 251 HA VAL 695 HA VAL 695 2.769 -1.141 -0.898 252 HB VAL 695 HB VAL 695 2.267 -3.129 -3.118 253 HG11 VAL 695 HG11 VAL 695 0.674 -4.032 -1.432 254 HG12 VAL 695 HG12 VAL 695 2.331 -4.015 -0.823 255 HG13 VAL 695 HG13 VAL 695 1.186 -2.778 -0.299 256 HG21 VAL 695 HG21 VAL 695 -0.101 -2.343 -3.026 257 HG22 VAL 695 HG22 VAL 695 0.405 -1.023 -1.974 258 HG23 VAL 695 HG23 VAL 695 0.991 -1.097 -3.635 259 H ARG 696 H ARG 696 4.045 -2.547 0.283 260 HA ARG 696 HA ARG 696 6.328 -3.774 -1.144 261 HB2 ARG 696 HB2 ARG 696 7.846 -3.062 0.535 262 HB3 ARG 696 HB3 ARG 696 6.893 -1.643 0.107 263 HG2 ARG 696 HG2 ARG 696 6.659 -1.494 2.383 264 HG3 ARG 696 HG3 ARG 696 5.336 -2.616 2.075 265 HD2 ARG 696 HD2 ARG 696 6.492 -3.737 3.753 266 HD3 ARG 696 HD3 ARG 696 7.206 -4.448 2.320 267 HE ARG 696 HE ARG 696 9.014 -2.657 2.626 268 HH11 ARG 696 HH21 ARG 696 7.141 -3.960 5.286 269 HH12 ARG 696 HH22 ARG 696 8.439 -3.759 6.418 270 HH21 ARG 696 HH11 ARG 696 10.646 -2.446 4.133 271 HH22 ARG 696 HH12 ARG 696 10.393 -2.900 5.782 272 H GLN 697 H GLN 697 7.403 -5.487 -0.014 273 HA GLN 697 HA GLN 697 6.015 -6.846 2.156 274 HB2 GLN 697 HB2 GLN 697 4.844 -7.569 0.042 275 HB3 GLN 697 HB3 GLN 697 6.378 -8.236 -0.512 276 HG2 GLN 697 HG2 GLN 697 5.689 -10.135 0.533 277 HG3 GLN 697 HG3 GLN 697 6.205 -9.314 2.005 278 HE21 GLN 697 HE21 GLN 697 4.018 -7.343 2.017 279 HE22 GLN 697 HE22 GLN 697 2.610 -8.207 2.407 280 H ARG 698 H ARG 698 8.256 -6.009 2.834 281 HA ARG 698 HA ARG 698 10.482 -7.660 1.897 282 HB2 ARG 698 HB2 ARG 698 10.611 -5.135 2.332 283 HB3 ARG 698 HB3 ARG 698 10.603 -5.551 4.046 284 HG2 ARG 698 HG2 ARG 698 12.491 -7.199 2.544 285 HG3 ARG 698 HG3 ARG 698 12.849 -5.481 2.383 286 HD2 ARG 698 HD2 ARG 698 13.035 -5.188 4.735 287 HD3 ARG 698 HD3 ARG 698 12.287 -6.745 5.070 288 HE ARG 698 HE ARG 698 15.060 -6.272 4.324 289 HH11 ARG 698 HH21 ARG 698 12.456 -8.560 4.518 290 HH12 ARG 698 HH22 ARG 698 13.525 -9.920 4.680 291 HH21 ARG 698 HH11 ARG 698 16.404 -8.051 4.515 292 HH22 ARG 698 HH12 ARG 698 15.731 -9.635 4.666 293 H VAL 699 H VAL 699 8.097 -8.031 4.135 294 HA VAL 699 HA VAL 699 9.719 -9.913 5.713 295 HB VAL 699 HB VAL 699 8.231 -9.090 7.724 296 HG11 VAL 699 HG11 VAL 699 10.815 -8.208 6.646 297 HG12 VAL 699 HG12 VAL 699 10.087 -7.042 7.751 298 HG13 VAL 699 HG13 VAL 699 10.384 -8.697 8.285 299 HG21 VAL 699 HG21 VAL 699 8.323 -6.644 5.921 300 HG22 VAL 699 HG22 VAL 699 6.871 -7.516 6.413 301 HG23 VAL 699 HG23 VAL 699 7.823 -6.642 7.613 302 H LYS 700 H LYS 700 8.012 -11.085 7.299 303 HA LYS 700 HA LYS 700 5.514 -11.646 5.832 304 HB2 LYS 700 HB2 LYS 700 7.738 -13.576 6.399 305 HB3 LYS 700 HB3 LYS 700 6.071 -14.155 6.410 306 HG2 LYS 700 HG2 LYS 700 7.128 -12.504 4.113 307 HG3 LYS 700 HG3 LYS 700 7.370 -14.249 4.164 308 HD2 LYS 700 HD2 LYS 700 5.233 -14.642 3.554 309 HD3 LYS 700 HD3 LYS 700 4.616 -13.570 4.810 310 HE2 LYS 700 HE2 LYS 700 5.586 -11.725 3.084 311 HE3 LYS 700 HE3 LYS 700 5.170 -13.006 1.944 312 HZ1 LYS 700 HZ1 LYS 700 2.951 -13.003 2.667 313 HZ2 LYS 700 HZ2 LYS 700 3.292 -12.057 4.062 314 HZ3 LYS 700 HZ3 LYS 700 3.358 -11.353 2.489 315 H ASP 701 H ASP 701 7.084 -11.009 8.694 316 HA ASP 701 HA ASP 701 5.790 -12.614 10.592 317 HB2 ASP 701 HB2 ASP 701 6.594 -9.759 11.090 318 HB3 ASP 701 HB3 ASP 701 6.679 -11.136 12.185 319 H ALA 702 H ALA 702 3.743 -12.056 8.860 320 HA ALA 702 HA ALA 702 1.512 -11.505 8.875 321 HB1 ALA 702 HB1 ALA 702 0.412 -11.153 10.956 322 HB2 ALA 702 HB2 ALA 702 1.888 -10.558 11.717 323 HB3 ALA 702 HB3 ALA 702 1.742 -12.263 11.288 324 H ALA 703 H ALA 703 0.178 -9.770 8.437 325 HA ALA 703 HA ALA 703 -0.279 -7.638 7.690 326 HB1 ALA 703 HB1 ALA 703 -0.087 -5.924 9.344 327 HB2 ALA 703 HB2 ALA 703 1.218 -6.774 10.171 328 HB3 ALA 703 HB3 ALA 703 -0.423 -7.423 10.211 329 H GLU 704 H GLU 704 2.349 -8.913 6.990 330 HA GLU 704 HA GLU 704 4.363 -6.910 6.885 331 HB2 GLU 704 HB2 GLU 704 5.434 -8.409 5.254 332 HB3 GLU 704 HB3 GLU 704 4.839 -9.309 6.650 333 HG2 GLU 704 HG2 GLU 704 2.971 -8.990 4.343 334 HG3 GLU 704 HG3 GLU 704 4.330 -10.085 4.129 335 H PHE 705 H PHE 705 1.500 -7.409 5.045 336 HA PHE 705 HA PHE 705 2.493 -5.756 2.826 337 HB2 PHE 705 HB2 PHE 705 -0.142 -6.362 2.234 338 HB3 PHE 705 HB3 PHE 705 1.272 -7.222 1.639 339 HD1 PHE 705 HD1 PHE 705 -0.713 -7.072 4.829 340 HD2 PHE 705 HD2 PHE 705 1.182 -9.539 1.872 341 HE1 PHE 705 HE1 PHE 705 -1.454 -9.099 6.047 342 HE2 PHE 705 HE2 PHE 705 0.445 -11.568 3.093 343 HZ PHE 705 HZ PHE 705 -0.870 -11.347 5.181 344 H ALA 706 H ALA 706 1.985 -3.750 2.545 345 HA ALA 706 HA ALA 706 -0.398 -2.523 3.666 346 HB1 ALA 706 HB1 ALA 706 2.264 -1.348 4.414 347 HB2 ALA 706 HB2 ALA 706 1.480 -2.530 5.455 348 HB3 ALA 706 HB3 ALA 706 0.687 -0.996 5.102 349 H ILE 707 H ILE 707 -0.966 -0.682 2.518 350 HA ILE 707 HA ILE 707 0.670 -0.160 0.135 351 HB ILE 707 HB ILE 707 -2.109 0.862 0.742 352 HG12 ILE 707 HG12 ILE 707 -1.294 -1.553 -0.906 353 HG13 ILE 707 HG13 ILE 707 -1.932 -1.653 0.734 354 HG21 ILE 707 HG21 ILE 707 -0.271 0.844 -1.640 355 HG22 ILE 707 HG22 ILE 707 -2.016 0.818 -1.886 356 HG23 ILE 707 HG23 ILE 707 -1.269 2.157 -1.014 357 HD11 ILE 707 HD11 ILE 707 -3.502 -1.778 -1.451 358 HD12 ILE 707 HD12 ILE 707 -4.057 -1.116 0.086 359 HD13 ILE 707 HD13 ILE 707 -3.508 -0.033 -1.193 360 H SER 708 H SER 708 1.798 1.625 -0.162 361 HA SER 708 HA SER 708 1.574 3.782 1.860 362 HB2 SER 708 HB2 SER 708 3.847 3.085 -0.011 363 HB3 SER 708 HB3 SER 708 3.856 4.403 1.156 364 HG SER 708 HG SER 708 3.398 1.670 1.821 365 H ILE 709 H ILE 709 0.585 5.615 1.219 366 HA ILE 709 HA ILE 709 0.694 6.279 -1.670 367 HB ILE 709 HB ILE 709 -1.672 6.918 0.084 368 HG12 ILE 709 HG12 ILE 709 -2.533 4.910 -1.557 369 HG13 ILE 709 HG13 ILE 709 -0.889 4.373 -1.219 370 HG21 ILE 709 HG21 ILE 709 -2.474 7.913 -1.780 371 HG22 ILE 709 HG22 ILE 709 -0.882 7.707 -2.505 372 HG23 ILE 709 HG23 ILE 709 -2.131 6.487 -2.757 373 HD11 ILE 709 HD11 ILE 709 -2.832 5.221 0.945 374 HD12 ILE 709 HD12 ILE 709 -2.632 3.548 0.422 375 HD13 ILE 709 HD13 ILE 709 -1.279 4.408 1.155 376 H LYS 710 H LYS 710 1.003 8.316 -2.259 377 HA LYS 710 HA LYS 710 2.083 10.160 -0.292 378 HB2 LYS 710 HB2 LYS 710 3.217 9.912 -2.421 379 HB3 LYS 710 HB3 LYS 710 1.739 10.292 -3.298 380 HG2 LYS 710 HG2 LYS 710 2.997 12.307 -3.299 381 HG3 LYS 710 HG3 LYS 710 1.765 12.520 -2.064 382 HD2 LYS 710 HD2 LYS 710 3.622 11.512 -0.481 383 HD3 LYS 710 HD3 LYS 710 4.699 12.113 -1.738 384 HE2 LYS 710 HE2 LYS 710 4.340 13.809 0.012 385 HE3 LYS 710 HE3 LYS 710 3.694 14.351 -1.536 386 HZ1 LYS 710 HZ1 LYS 710 2.187 14.683 0.364 387 HZ2 LYS 710 HZ2 LYS 710 1.486 13.768 -0.885 388 HZ3 LYS 710 HZ3 LYS 710 2.063 12.995 0.545 389 H TYR 711 H TYR 711 0.898 11.654 0.752 390 HA TYR 711 HA TYR 711 -1.410 12.897 -0.597 391 HB2 TYR 711 HB2 TYR 711 -1.895 10.828 1.052 392 HB3 TYR 711 HB3 TYR 711 -1.804 12.113 2.250 393 HD1 TYR 711 HD2 TYR 711 -2.972 14.436 0.962 394 HD2 TYR 711 HD1 TYR 711 -4.122 10.311 0.666 395 HE1 TYR 711 HE2 TYR 711 -5.277 15.124 0.371 396 HE2 TYR 711 HE1 TYR 711 -6.430 10.996 0.080 397 HH TYR 711 HH TYR 711 -7.761 12.751 -0.537 398 H ASN 712 H ASN 712 -1.467 15.036 -0.251 399 HA ASN 712 HA ASN 712 -0.736 17.121 0.434 400 HB2 ASN 712 HB2 ASN 712 -1.761 15.645 2.795 401 HB3 ASN 712 HB3 ASN 712 -0.857 17.117 3.139 402 HD21 ASN 712 HD21 ASN 712 -3.801 16.646 3.429 403 HD22 ASN 712 HD22 ASN 712 -4.540 17.820 2.451 404 H VAL 713 H VAL 713 1.443 16.424 -0.379 405 HA VAL 713 HA VAL 713 3.715 16.191 -0.158 406 HB VAL 713 HB VAL 713 4.785 17.888 1.158 407 HG11 VAL 713 HG11 VAL 713 3.933 19.516 -0.149 408 HG12 VAL 713 HG12 VAL 713 2.682 18.371 -0.633 409 HG13 VAL 713 HG13 VAL 713 2.392 19.481 0.707 410 HG21 VAL 713 HG21 VAL 713 3.312 17.303 3.232 411 HG22 VAL 713 HG22 VAL 713 3.815 18.978 3.010 412 HG23 VAL 713 HG23 VAL 713 2.183 18.482 2.566 413 H GLU 714 H GLU 714 1.925 14.504 1.720 414 HA GLU 714 HA GLU 714 4.150 13.415 3.307 415 HB2 GLU 714 HB2 GLU 714 1.559 14.405 4.211 416 HB3 GLU 714 HB3 GLU 714 1.826 12.723 4.675 417 HG2 GLU 714 HG2 GLU 714 3.963 14.814 5.050 418 HG3 GLU 714 HG3 GLU 714 2.720 14.549 6.269 419 H VAL 715 H VAL 715 3.471 11.119 4.087 420 HA VAL 715 HA VAL 715 2.168 9.703 1.819 421 HB VAL 715 HB VAL 715 4.559 8.781 3.426 422 HG11 VAL 715 HG11 VAL 715 3.031 7.550 1.117 423 HG12 VAL 715 HG12 VAL 715 4.599 6.974 1.677 424 HG13 VAL 715 HG13 VAL 715 3.198 6.894 2.744 425 HG21 VAL 715 HG21 VAL 715 5.639 10.163 1.976 426 HG22 VAL 715 HG22 VAL 715 5.306 8.900 0.795 427 HG23 VAL 715 HG23 VAL 715 4.239 10.294 0.915 428 H LYS 716 H LYS 716 0.874 7.961 2.279 429 HA LYS 716 HA LYS 716 0.306 7.486 5.157 430 HB2 LYS 716 HB2 LYS 716 -1.446 8.598 3.448 431 HB3 LYS 716 HB3 LYS 716 -1.766 6.899 3.106 432 HG2 LYS 716 HG2 LYS 716 -2.597 6.473 5.223 433 HG3 LYS 716 HG3 LYS 716 -1.578 7.697 5.977 434 HD2 LYS 716 HD2 LYS 716 -4.028 8.250 4.271 435 HD3 LYS 716 HD3 LYS 716 -3.935 8.406 6.006 436 HE2 LYS 716 HE2 LYS 716 -1.798 9.944 5.194 437 HE3 LYS 716 HE3 LYS 716 -2.974 10.232 3.911 438 HZ1 LYS 716 HZ1 LYS 716 -3.020 11.072 6.669 439 HZ2 LYS 716 HZ2 LYS 716 -3.850 11.702 5.327 440 HZ3 LYS 716 HZ3 LYS 716 -4.502 10.361 6.165 441 H HIS 717 H HIS 717 0.813 5.486 5.811 442 HA HIS 717 HA HIS 717 0.681 3.282 3.841 443 HB2 HIS 717 HB2 HIS 717 2.489 3.104 6.224 444 HB3 HIS 717 HB3 HIS 717 2.599 2.266 4.684 445 HD1 HIS 717 HD1 HIS 717 4.117 3.243 2.936 446 HD2 HIS 717 HD2 HIS 717 3.361 5.921 6.067 447 HE1 HIS 717 HE1 HIS 717 5.783 5.161 2.708 448 HE2 HIS 717 HE2 HIS 717 5.285 6.833 4.585 449 H ILE 718 H ILE 718 -1.133 2.159 4.328 450 HA ILE 718 HA ILE 718 -1.725 1.641 7.189 451 HB ILE 718 HB ILE 718 -3.457 1.963 4.772 452 HG12 ILE 718 HG12 ILE 718 -3.550 3.767 6.332 453 HG13 ILE 718 HG13 ILE 718 -5.025 2.844 6.570 454 HG21 ILE 718 HG21 ILE 718 -4.172 0.144 7.091 455 HG22 ILE 718 HG22 ILE 718 -5.276 0.657 5.818 456 HG23 ILE 718 HG23 ILE 718 -3.900 -0.373 5.429 457 HD11 ILE 718 HD11 ILE 718 -2.648 3.089 8.344 458 HD12 ILE 718 HD12 ILE 718 -4.355 3.058 8.759 459 HD13 ILE 718 HD13 ILE 718 -3.523 1.560 8.350 460 H LYS 719 H LYS 719 -1.748 -0.449 7.920 461 HA LYS 719 HA LYS 719 -0.434 -2.408 6.289 462 HB2 LYS 719 HB2 LYS 719 -0.054 -3.525 8.236 463 HB3 LYS 719 HB3 LYS 719 -0.510 -1.985 8.956 464 HG2 LYS 719 HG2 LYS 719 -2.837 -2.763 9.189 465 HG3 LYS 719 HG3 LYS 719 -2.408 -4.299 8.434 466 HD2 LYS 719 HD2 LYS 719 -1.505 -5.116 10.343 467 HD3 LYS 719 HD3 LYS 719 -0.629 -3.620 10.666 468 HE2 LYS 719 HE2 LYS 719 -3.402 -3.082 11.067 469 HE3 LYS 719 HE3 LYS 719 -3.030 -4.589 11.909 470 HZ1 LYS 719 HZ1 LYS 719 -2.569 -2.783 13.375 471 HZ2 LYS 719 HZ2 LYS 719 -1.075 -3.424 12.878 472 HZ3 LYS 719 HZ3 LYS 719 -1.641 -1.967 12.189 473 H ILE 720 H ILE 720 -1.201 -4.273 5.408 474 HA ILE 720 HA ILE 720 -4.106 -4.360 4.990 475 HB ILE 720 HB ILE 720 -1.778 -5.631 3.547 476 HG12 ILE 720 HG12 ILE 720 -3.952 -3.803 2.523 477 HG13 ILE 720 HG13 ILE 720 -2.448 -3.182 3.202 478 HG21 ILE 720 HG21 ILE 720 -3.693 -7.217 3.645 479 HG22 ILE 720 HG22 ILE 720 -4.744 -5.956 2.998 480 HG23 ILE 720 HG23 ILE 720 -3.430 -6.598 2.013 481 HD11 ILE 720 HD11 ILE 720 -2.588 -3.566 0.632 482 HD12 ILE 720 HD12 ILE 720 -1.145 -4.110 1.486 483 HD13 ILE 720 HD13 ILE 720 -2.396 -5.269 1.039 484 H MET 721 H MET 721 -5.366 -5.981 5.623 485 HA MET 721 HA MET 721 -4.134 -8.050 7.332 486 HB2 MET 721 HB2 MET 721 -6.170 -6.379 7.918 487 HB3 MET 721 HB3 MET 721 -7.077 -7.720 7.228 488 HG2 MET 721 HG2 MET 721 -5.121 -8.872 8.924 489 HG3 MET 721 HG3 MET 721 -5.849 -7.542 9.822 490 HE1 MET 721 HE1 MET 721 -7.426 -10.458 11.345 491 HE2 MET 721 HE2 MET 721 -6.239 -9.156 11.347 492 HE3 MET 721 HE3 MET 721 -7.953 -8.792 11.590 493 H THR 722 H THR 722 -5.353 -10.166 7.317 494 HA THR 722 HA THR 722 -6.639 -10.930 4.848 495 HB THR 722 HB THR 722 -4.142 -10.954 4.348 496 HG1 THR 722 HG1 THR 722 -5.703 -12.173 3.197 497 HG21 THR 722 HG21 THR 722 -3.606 -11.908 6.667 498 HG22 THR 722 HG22 THR 722 -4.173 -13.457 6.041 499 HG23 THR 722 HG23 THR 722 -2.786 -12.660 5.299 500 H ALA 723 H ALA 723 -7.354 -13.147 4.877 501 HA ALA 723 HA ALA 723 -7.128 -14.798 7.171 502 HB1 ALA 723 HB1 ALA 723 -8.444 -13.133 8.307 503 HB2 ALA 723 HB2 ALA 723 -9.510 -14.493 7.951 504 HB3 ALA 723 HB3 ALA 723 -9.575 -13.038 6.954 505 H GLU 724 H GLU 724 -10.057 -14.000 5.485 506 HA GLU 724 HA GLU 724 -10.596 -16.665 4.634 507 HB2 GLU 724 HB2 GLU 724 -11.930 -14.299 3.411 508 HB3 GLU 724 HB3 GLU 724 -12.648 -15.782 4.033 509 HG2 GLU 724 HG2 GLU 724 -13.282 -14.284 5.704 510 HG3 GLU 724 HG3 GLU 724 -11.745 -14.844 6.356 511 H GLY 725 H GLY 725 -8.058 -15.924 3.737 512 HA2 GLY 725 HA2 GLY 725 -6.729 -15.962 1.848 513 HA3 GLY 725 HA3 GLY 725 -8.131 -16.610 0.996 514 H LEU 726 H LEU 726 -8.216 -13.568 2.693 515 HA LEU 726 HA LEU 726 -8.381 -12.136 0.106 516 HB2 LEU 726 HB2 LEU 726 -9.881 -11.641 2.687 517 HB3 LEU 726 HB3 LEU 726 -9.927 -10.568 1.291 518 HG LEU 726 HG LEU 726 -10.543 -13.465 0.868 519 HD11 LEU 726 HD11 LEU 726 -12.789 -11.639 1.595 520 HD12 LEU 726 HD12 LEU 726 -12.660 -13.386 1.778 521 HD13 LEU 726 HD13 LEU 726 -11.833 -12.320 2.913 522 HD21 LEU 726 HD21 LEU 726 -11.318 -10.809 -0.329 523 HD22 LEU 726 HD22 LEU 726 -10.542 -12.185 -1.110 524 HD23 LEU 726 HD23 LEU 726 -12.247 -12.267 -0.677 525 H TYR 727 H TYR 727 -8.031 -9.758 0.344 526 HA TYR 727 HA TYR 727 -5.899 -9.110 2.311 527 HB2 TYR 727 HB2 TYR 727 -6.066 -8.323 -0.615 528 HB3 TYR 727 HB3 TYR 727 -4.935 -7.616 0.536 529 HD1 TYR 727 HD2 TYR 727 -5.914 -10.771 -1.169 530 HD2 TYR 727 HD1 TYR 727 -2.990 -8.793 1.281 531 HE1 TYR 727 HE2 TYR 727 -4.336 -12.661 -1.516 532 HE2 TYR 727 HE1 TYR 727 -1.422 -10.678 0.932 533 HH TYR 727 HH TYR 727 -1.777 -12.955 -1.460 534 H ARG 728 H ARG 728 -6.227 -7.196 3.422 535 HA ARG 728 HA ARG 728 -8.055 -5.195 2.339 536 HB2 ARG 728 HB2 ARG 728 -9.222 -5.242 4.690 537 HB3 ARG 728 HB3 ARG 728 -9.744 -6.320 3.401 538 HG2 ARG 728 HG2 ARG 728 -8.926 -8.196 4.439 539 HG3 ARG 728 HG3 ARG 728 -7.542 -7.340 5.111 540 HD2 ARG 728 HD2 ARG 728 -8.727 -6.595 6.973 541 HD3 ARG 728 HD3 ARG 728 -10.281 -6.712 6.166 542 HE ARG 728 HE ARG 728 -8.872 -8.862 7.529 543 HH11 ARG 728 HH21 ARG 728 -11.355 -7.961 5.276 544 HH12 ARG 728 HH22 ARG 728 -12.165 -9.496 5.398 545 HH21 ARG 728 HH11 ARG 728 -9.958 -10.827 7.658 546 HH22 ARG 728 HH12 ARG 728 -11.390 -11.115 6.700 547 H ILE 729 H ILE 729 -7.525 -3.195 2.898 548 HA ILE 729 HA ILE 729 -5.222 -2.724 4.565 549 HB ILE 729 HB ILE 729 -6.257 -0.238 4.121 550 HG12 ILE 729 HG12 ILE 729 -8.159 -1.466 2.862 551 HG13 ILE 729 HG13 ILE 729 -7.384 -0.106 2.052 552 HG21 ILE 729 HG21 ILE 729 -4.467 -2.002 2.471 553 HG22 ILE 729 HG22 ILE 729 -4.824 -0.359 1.958 554 HG23 ILE 729 HG23 ILE 729 -4.035 -0.644 3.505 555 HD11 ILE 729 HD11 ILE 729 -6.659 -1.428 0.376 556 HD12 ILE 729 HD12 ILE 729 -5.978 -2.598 1.506 557 HD13 ILE 729 HD13 ILE 729 -7.677 -2.702 1.042 558 H THR 730 H THR 730 -8.630 -2.768 4.937 559 HA THR 730 HA THR 730 -8.358 -1.715 7.689 560 HB THR 730 HB THR 730 -9.719 -0.153 6.422 561 HG1 THR 730 HG1 THR 730 -10.426 -1.119 8.594 562 HG21 THR 730 HG21 THR 730 -10.631 -2.602 5.171 563 HG22 THR 730 HG22 THR 730 -11.998 -1.642 5.735 564 HG23 THR 730 HG23 THR 730 -10.823 -0.938 4.630 565 H GLU 731 H GLU 731 -9.818 -2.618 9.211 566 HA GLU 731 HA GLU 731 -9.998 -5.468 9.043 567 HB2 GLU 731 HB2 GLU 731 -11.106 -5.182 11.267 568 HB3 GLU 731 HB3 GLU 731 -9.578 -4.294 11.152 569 HG2 GLU 731 HG2 GLU 731 -12.080 -2.885 10.328 570 HG3 GLU 731 HG3 GLU 731 -11.785 -3.098 12.042 571 H LYS 732 H LYS 732 -11.869 -3.009 7.763 572 HA LYS 732 HA LYS 732 -14.404 -4.435 8.066 573 HB2 LYS 732 HB2 LYS 732 -14.073 -1.805 6.670 574 HB3 LYS 732 HB3 LYS 732 -15.493 -2.454 7.496 575 HG2 LYS 732 HG2 LYS 732 -14.566 -2.091 9.628 576 HG3 LYS 732 HG3 LYS 732 -12.933 -1.954 8.990 577 HD2 LYS 732 HD2 LYS 732 -14.218 0.066 7.648 578 HD3 LYS 732 HD3 LYS 732 -15.014 0.104 9.223 579 HE2 LYS 732 HE2 LYS 732 -12.139 -0.286 9.471 580 HE3 LYS 732 HE3 LYS 732 -12.525 1.209 8.617 581 HZ1 LYS 732 HZ1 LYS 732 -14.245 0.770 10.870 582 HZ2 LYS 732 HZ2 LYS 732 -12.592 0.814 11.324 583 HZ3 LYS 732 HZ3 LYS 732 -13.279 2.151 10.483 584 H LYS 733 H LYS 733 -11.908 -4.269 5.759 585 HA LYS 733 HA LYS 733 -13.806 -4.983 3.587 586 HB2 LYS 733 HB2 LYS 733 -11.936 -2.926 3.629 587 HB3 LYS 733 HB3 LYS 733 -11.167 -4.184 2.665 588 HG2 LYS 733 HG2 LYS 733 -12.441 -2.947 1.094 589 HG3 LYS 733 HG3 LYS 733 -13.436 -4.362 1.430 590 HD2 LYS 733 HD2 LYS 733 -14.856 -2.389 1.490 591 HD3 LYS 733 HD3 LYS 733 -14.687 -3.000 3.138 592 HE2 LYS 733 HE2 LYS 733 -13.236 -1.267 3.767 593 HE3 LYS 733 HE3 LYS 733 -12.785 -0.919 2.100 594 HZ1 LYS 733 HZ1 LYS 733 -14.844 0.094 1.658 595 HZ2 LYS 733 HZ2 LYS 733 -15.528 -0.489 3.125 596 HZ3 LYS 733 HZ3 LYS 733 -14.320 0.721 3.174 597 H ALA 734 H ALA 734 -12.353 -6.058 1.724 598 HA ALA 734 HA ALA 734 -10.314 -7.858 2.418 599 HB1 ALA 734 HB1 ALA 734 -12.756 -8.669 3.489 600 HB2 ALA 734 HB2 ALA 734 -11.320 -9.669 3.277 601 HB3 ALA 734 HB3 ALA 734 -12.569 -9.644 2.033 602 H PHE 735 H PHE 735 -9.335 -8.106 0.509 603 HA PHE 735 HA PHE 735 -11.019 -8.454 -1.916 604 HB2 PHE 735 HB2 PHE 735 -8.385 -7.051 -1.499 605 HB3 PHE 735 HB3 PHE 735 -8.849 -7.649 -3.090 606 HD1 PHE 735 HD2 PHE 735 -10.205 -5.630 -0.236 607 HD2 PHE 735 HD1 PHE 735 -10.178 -6.330 -4.476 608 HE1 PHE 735 HE2 PHE 735 -11.662 -3.646 -0.579 609 HE2 PHE 735 HE1 PHE 735 -11.621 -4.347 -4.822 610 HZ PHE 735 HZ PHE 735 -12.375 -3.013 -2.864 611 H ARG 736 H ARG 736 -10.183 -9.927 -3.550 612 HA ARG 736 HA ARG 736 -9.074 -12.302 -2.373 613 HB2 ARG 736 HB2 ARG 736 -9.824 -11.574 -5.207 614 HB3 ARG 736 HB3 ARG 736 -9.184 -13.155 -4.756 615 HG2 ARG 736 HG2 ARG 736 -11.296 -12.396 -2.932 616 HG3 ARG 736 HG3 ARG 736 -11.874 -12.278 -4.591 617 HD2 ARG 736 HD2 ARG 736 -11.986 -14.518 -4.775 618 HD3 ARG 736 HD3 ARG 736 -10.310 -14.694 -4.270 619 HE ARG 736 HE ARG 736 -12.651 -15.073 -2.622 620 HH11 ARG 736 HH21 ARG 736 -9.339 -14.165 -2.673 621 HH12 ARG 736 HH22 ARG 736 -9.024 -14.618 -1.027 622 HH21 ARG 736 HH11 ARG 736 -12.278 -15.703 -0.496 623 HH22 ARG 736 HH12 ARG 736 -10.713 -15.488 0.220 624 H GLY 737 H GLY 737 -7.678 -9.517 -3.591 625 HA2 GLY 737 HA2 GLY 737 -5.032 -10.440 -3.259 626 HA3 GLY 737 HA3 GLY 737 -5.416 -10.457 -4.973 627 H LEU 738 H LEU 738 -3.547 -8.787 -3.331 628 HA LEU 738 HA LEU 738 -4.239 -6.183 -2.899 629 HB2 LEU 738 HB2 LEU 738 -1.801 -7.581 -3.770 630 HB3 LEU 738 HB3 LEU 738 -1.858 -5.891 -4.259 631 HG LEU 738 HG LEU 738 -0.787 -6.156 -2.052 632 HD11 LEU 738 HD11 LEU 738 -2.691 -4.319 -2.770 633 HD12 LEU 738 HD12 LEU 738 -3.330 -4.911 -1.239 634 HD13 LEU 738 HD13 LEU 738 -1.710 -4.221 -1.312 635 HD21 LEU 738 HD21 LEU 738 -3.493 -7.137 -1.104 636 HD22 LEU 738 HD22 LEU 738 -2.136 -8.211 -1.450 637 HD23 LEU 738 HD23 LEU 738 -2.009 -7.015 -0.160 638 H THR 739 H THR 739 -3.298 -7.582 -6.011 639 HA THR 739 HA THR 739 -3.516 -5.390 -7.663 640 HB THR 739 HB THR 739 -4.537 -8.072 -8.502 641 HG1 THR 739 HG1 THR 739 -2.682 -8.933 -8.232 642 HG21 THR 739 HG21 THR 739 -3.331 -7.412 -10.600 643 HG22 THR 739 HG22 THR 739 -4.688 -6.370 -10.179 644 HG23 THR 739 HG23 THR 739 -3.038 -5.839 -9.859 645 H GLU 740 H GLU 740 -6.145 -7.524 -6.571 646 HA GLU 740 HA GLU 740 -8.080 -6.157 -8.208 647 HB2 GLU 740 HB2 GLU 740 -8.948 -7.851 -5.917 648 HB3 GLU 740 HB3 GLU 740 -9.575 -7.782 -7.560 649 HG2 GLU 740 HG2 GLU 740 -6.960 -9.078 -6.712 650 HG3 GLU 740 HG3 GLU 740 -8.436 -9.923 -7.131 651 H LEU 741 H LEU 741 -6.646 -5.711 -5.167 652 HA LEU 741 HA LEU 741 -8.811 -4.113 -4.047 653 HB2 LEU 741 HB2 LEU 741 -7.558 -5.508 -2.525 654 HB3 LEU 741 HB3 LEU 741 -6.032 -4.876 -3.112 655 HG LEU 741 HG LEU 741 -7.006 -4.000 -0.853 656 HD11 LEU 741 HD11 LEU 741 -6.334 -1.574 -2.234 657 HD12 LEU 741 HD12 LEU 741 -5.327 -2.547 -1.162 658 HD13 LEU 741 HD13 LEU 741 -5.357 -2.888 -2.891 659 HD21 LEU 741 HD21 LEU 741 -9.193 -3.403 -2.323 660 HD22 LEU 741 HD22 LEU 741 -8.728 -2.488 -0.894 661 HD23 LEU 741 HD23 LEU 741 -8.312 -1.888 -2.497 662 H VAL 742 H VAL 742 -5.482 -3.731 -5.096 663 HA VAL 742 HA VAL 742 -5.273 -0.922 -4.859 664 HB VAL 742 HB VAL 742 -3.838 -2.958 -6.566 665 HG11 VAL 742 HG11 VAL 742 -3.273 -1.019 -7.683 666 HG12 VAL 742 HG12 VAL 742 -3.474 -0.006 -6.250 667 HG13 VAL 742 HG13 VAL 742 -2.044 -1.024 -6.415 668 HG21 VAL 742 HG21 VAL 742 -2.078 -2.594 -4.793 669 HG22 VAL 742 HG22 VAL 742 -3.275 -1.661 -3.892 670 HG23 VAL 742 HG23 VAL 742 -3.560 -3.372 -4.225 671 H GLU 743 H GLU 743 -5.619 -2.906 -7.763 672 HA GLU 743 HA GLU 743 -5.944 -0.767 -9.545 673 HB2 GLU 743 HB2 GLU 743 -6.955 -3.591 -9.867 674 HB3 GLU 743 HB3 GLU 743 -6.552 -2.452 -11.157 675 HG2 GLU 743 HG2 GLU 743 -4.496 -3.243 -9.084 676 HG3 GLU 743 HG3 GLU 743 -4.770 -4.240 -10.495 677 H PHE 744 H PHE 744 -8.191 -2.309 -7.409 678 HA PHE 744 HA PHE 744 -10.559 -1.365 -8.785 679 HB2 PHE 744 HB2 PHE 744 -10.752 -3.369 -7.479 680 HB3 PHE 744 HB3 PHE 744 -10.071 -2.580 -6.060 681 HD1 PHE 744 HD1 PHE 744 -12.864 -1.965 -8.513 682 HD2 PHE 744 HD2 PHE 744 -11.564 -1.942 -4.424 683 HE1 PHE 744 HE1 PHE 744 -15.127 -1.245 -7.798 684 HE2 PHE 744 HE2 PHE 744 -13.826 -1.220 -3.702 685 HZ PHE 744 HZ PHE 744 -15.609 -0.872 -5.392 686 H TYR 745 H TYR 745 -8.494 -0.337 -6.124 687 HA TYR 745 HA TYR 745 -10.223 1.788 -5.268 688 HB2 TYR 745 HB2 TYR 745 -7.386 1.005 -4.675 689 HB3 TYR 745 HB3 TYR 745 -8.043 2.538 -4.103 690 HD1 TYR 745 HD2 TYR 745 -10.618 0.095 -4.464 691 HD2 TYR 745 HD1 TYR 745 -7.489 1.391 -1.821 692 HE1 TYR 745 HE2 TYR 745 -11.740 -1.039 -2.576 693 HE2 TYR 745 HE1 TYR 745 -8.622 0.246 0.065 694 HH TYR 745 HH TYR 745 -11.706 -0.576 0.091 695 H GLN 746 H GLN 746 -8.210 1.428 -7.949 696 HA GLN 746 HA GLN 746 -7.134 3.991 -8.316 697 HB2 GLN 746 HB2 GLN 746 -8.182 1.929 -10.257 698 HB3 GLN 746 HB3 GLN 746 -7.490 3.457 -10.806 699 HG2 GLN 746 HG2 GLN 746 -5.367 2.960 -9.818 700 HG3 GLN 746 HG3 GLN 746 -6.031 1.602 -8.908 701 HE21 GLN 746 HE21 GLN 746 -4.114 0.510 -10.146 702 HE22 GLN 746 HE22 GLN 746 -4.494 -0.165 -11.660 703 H GLN 747 H GLN 747 -10.367 2.729 -8.815 704 HA GLN 747 HA GLN 747 -11.344 5.409 -9.599 705 HB2 GLN 747 HB2 GLN 747 -12.759 2.735 -9.803 706 HB3 GLN 747 HB3 GLN 747 -13.313 4.273 -10.464 707 HG2 GLN 747 HG2 GLN 747 -10.695 2.961 -11.254 708 HG3 GLN 747 HG3 GLN 747 -12.198 2.750 -12.148 709 HE21 GLN 747 HE21 GLN 747 -9.707 5.123 -11.270 710 HE22 GLN 747 HE22 GLN 747 -10.164 6.271 -12.433 711 H ASN 748 H ASN 748 -11.390 2.997 -7.140 712 HA ASN 748 HA ASN 748 -13.620 4.304 -5.722 713 HB2 ASN 748 HB2 ASN 748 -13.895 1.932 -5.869 714 HB3 ASN 748 HB3 ASN 748 -12.232 1.640 -5.371 715 HD21 ASN 748 HD21 ASN 748 -11.779 1.614 -3.117 716 HD22 ASN 748 HD22 ASN 748 -12.973 1.838 -1.934 717 H SER 749 H SER 749 -12.945 5.986 -4.533 718 HA SER 749 HA SER 749 -10.477 6.689 -3.683 719 HB2 SER 749 HB2 SER 749 -12.915 7.719 -3.343 720 HB3 SER 749 HB3 SER 749 -12.663 7.092 -1.723 721 HG SER 749 HG SER 749 -10.405 8.264 -2.491 722 H LEU 750 H LEU 750 -9.075 6.223 -2.057 723 HA LEU 750 HA LEU 750 -9.130 3.638 -0.914 724 HB2 LEU 750 HB2 LEU 750 -7.486 6.085 -0.315 725 HB3 LEU 750 HB3 LEU 750 -7.249 4.559 0.533 726 HG LEU 750 HG LEU 750 -7.435 4.052 -2.294 727 HD11 LEU 750 HD11 LEU 750 -5.207 5.257 -2.785 728 HD12 LEU 750 HD12 LEU 750 -6.682 6.226 -2.778 729 HD13 LEU 750 HD13 LEU 750 -5.602 6.256 -1.387 730 HD21 LEU 750 HD21 LEU 750 -6.321 2.714 -0.434 731 HD22 LEU 750 HD22 LEU 750 -5.360 2.910 -1.899 732 HD23 LEU 750 HD23 LEU 750 -5.015 3.898 -0.479 733 H LYS 751 H LYS 751 -10.245 6.733 0.290 734 HA LYS 751 HA LYS 751 -10.404 6.260 2.995 735 HB2 LYS 751 HB2 LYS 751 -12.360 7.767 3.026 736 HB3 LYS 751 HB3 LYS 751 -11.021 8.391 2.080 737 HG2 LYS 751 HG2 LYS 751 -12.368 7.095 0.132 738 HG3 LYS 751 HG3 LYS 751 -13.715 7.543 1.188 739 HD2 LYS 751 HD2 LYS 751 -12.864 9.870 1.255 740 HD3 LYS 751 HD3 LYS 751 -11.573 9.409 0.158 741 HE2 LYS 751 HE2 LYS 751 -13.852 8.571 -1.169 742 HE3 LYS 751 HE3 LYS 751 -14.330 10.108 -0.436 743 HZ1 LYS 751 HZ1 LYS 751 -12.122 11.004 -1.238 744 HZ2 LYS 751 HZ2 LYS 751 -11.997 9.561 -2.200 745 HZ3 LYS 751 HZ3 LYS 751 -13.287 10.666 -2.463 746 H ASP 752 H ASP 752 -11.986 4.620 0.461 747 HA ASP 752 HA ASP 752 -14.318 3.640 1.730 748 HB2 ASP 752 HB2 ASP 752 -14.284 2.971 -0.476 749 HB3 ASP 752 HB3 ASP 752 -12.540 2.734 -0.483 750 H CYS 753 H CYS 753 -10.951 2.710 1.854 751 HA CYS 753 HA CYS 753 -11.515 0.766 4.023 752 HB2 CYS 753 HB2 CYS 753 -9.513 0.853 1.821 753 HB3 CYS 753 HB3 CYS 753 -8.980 0.220 3.371 754 HG CYS 753 HG CYS 753 -10.712 -1.274 1.430 755 H PHE 754 H PHE 754 -9.264 3.217 2.826 756 HA PHE 754 HA PHE 754 -7.722 3.368 5.184 757 HB2 PHE 754 HB2 PHE 754 -8.092 5.117 2.791 758 HB3 PHE 754 HB3 PHE 754 -7.160 5.692 4.172 759 HD1 PHE 754 HD2 PHE 754 -7.498 2.678 1.975 760 HD2 PHE 754 HD1 PHE 754 -4.878 5.171 4.287 761 HE1 PHE 754 HE2 PHE 754 -5.555 1.354 1.200 762 HE2 PHE 754 HE1 PHE 754 -2.931 3.852 3.504 763 HZ PHE 754 HZ PHE 754 -3.272 1.941 1.962 764 H LYS 755 H LYS 755 -7.633 5.102 6.709 765 HA LYS 755 HA LYS 755 -10.265 5.941 7.568 766 HB2 LYS 755 HB2 LYS 755 -7.894 6.909 9.049 767 HB3 LYS 755 HB3 LYS 755 -9.358 6.127 9.640 768 HG2 LYS 755 HG2 LYS 755 -6.985 4.769 8.316 769 HG3 LYS 755 HG3 LYS 755 -7.478 4.627 9.998 770 HD2 LYS 755 HD2 LYS 755 -9.411 3.378 9.452 771 HD3 LYS 755 HD3 LYS 755 -9.339 3.837 7.758 772 HE2 LYS 755 HE2 LYS 755 -8.428 1.749 7.555 773 HE3 LYS 755 HE3 LYS 755 -6.950 2.627 7.951 774 HZ1 LYS 755 HZ1 LYS 755 -7.543 0.531 9.291 775 HZ2 LYS 755 HZ2 LYS 755 -6.996 1.909 10.142 776 HZ3 LYS 755 HZ3 LYS 755 -8.671 1.525 10.105 777 H SER 756 H SER 756 -7.200 7.769 7.204 778 HA SER 756 HA SER 756 -8.753 10.220 6.783 779 HB2 SER 756 HB2 SER 756 -6.733 11.410 7.178 780 HB3 SER 756 HB3 SER 756 -6.742 10.086 8.340 781 HG SER 756 HG SER 756 -5.041 9.269 7.398 782 H LEU 757 H LEU 757 -6.839 7.954 5.032 783 HA LEU 757 HA LEU 757 -5.977 9.376 2.812 784 HB2 LEU 757 HB2 LEU 757 -5.777 6.842 3.547 785 HB3 LEU 757 HB3 LEU 757 -7.140 6.660 2.450 786 HG LEU 757 HG LEU 757 -5.255 6.290 1.103 787 HD11 LEU 757 HD11 LEU 757 -5.255 8.108 -0.456 788 HD12 LEU 757 HD12 LEU 757 -6.889 7.925 0.180 789 HD13 LEU 757 HD13 LEU 757 -5.849 9.222 0.771 790 HD21 LEU 757 HD21 LEU 757 -3.272 7.677 1.143 791 HD22 LEU 757 HD22 LEU 757 -4.036 8.786 2.276 792 HD23 LEU 757 HD23 LEU 757 -3.632 7.142 2.789 793 H ASP 758 H ASP 758 -7.340 10.834 1.808 794 HA ASP 758 HA ASP 758 -9.901 9.734 0.846 795 HB2 ASP 758 HB2 ASP 758 -9.986 11.717 2.464 796 HB3 ASP 758 HB3 ASP 758 -9.339 12.682 1.140 797 H THR 759 H THR 759 -8.530 8.844 -0.887 798 HA THR 759 HA THR 759 -8.833 10.441 -3.228 799 HB THR 759 HB THR 759 -6.691 11.422 -2.434 800 HG1 THR 759 HG1 THR 759 -5.984 11.443 -4.451 801 HG21 THR 759 HG21 THR 759 -4.738 9.652 -3.012 802 HG22 THR 759 HG22 THR 759 -5.366 9.879 -1.383 803 HG23 THR 759 HG23 THR 759 -5.948 8.543 -2.373 804 H THR 760 H THR 760 -7.090 9.125 -4.949 805 HA THR 760 HA THR 760 -7.865 6.276 -4.636 806 HB THR 760 HB THR 760 -8.265 6.220 -7.105 807 HG1 THR 760 HG1 THR 760 -8.656 8.352 -8.018 808 HG21 THR 760 HG21 THR 760 -10.425 7.574 -6.989 809 HG22 THR 760 HG22 THR 760 -10.211 6.336 -5.752 810 HG23 THR 760 HG23 THR 760 -9.931 8.033 -5.360 811 H LEU 761 H LEU 761 -6.653 4.874 -6.240 812 HA LEU 761 HA LEU 761 -3.848 5.254 -5.867 813 HB2 LEU 761 HB2 LEU 761 -5.459 3.285 -7.510 814 HB3 LEU 761 HB3 LEU 761 -3.702 3.253 -7.452 815 HG LEU 761 HG LEU 761 -4.775 1.685 -5.817 816 HD11 LEU 761 HD11 LEU 761 -2.831 3.788 -5.187 817 HD12 LEU 761 HD12 LEU 761 -3.602 3.100 -3.761 818 HD13 LEU 761 HD13 LEU 761 -2.750 2.054 -4.892 819 HD21 LEU 761 HD21 LEU 761 -6.722 3.220 -5.356 820 HD22 LEU 761 HD22 LEU 761 -5.965 2.542 -3.917 821 HD23 LEU 761 HD23 LEU 761 -5.632 4.204 -4.387 822 H GLN 762 H GLN 762 -3.548 7.325 -6.774 823 HA GLN 762 HA GLN 762 -4.183 8.047 -9.416 824 HB2 GLN 762 HB2 GLN 762 -2.110 9.053 -7.469 825 HB3 GLN 762 HB3 GLN 762 -2.380 9.800 -9.043 826 HG2 GLN 762 HG2 GLN 762 -4.935 9.404 -7.820 827 HG3 GLN 762 HG3 GLN 762 -3.884 10.169 -6.631 828 HE21 GLN 762 HE21 GLN 762 -2.695 12.191 -7.438 829 HE22 GLN 762 HE22 GLN 762 -3.491 13.165 -8.576 830 H PHE 763 H PHE 763 -0.912 7.281 -8.175 831 HA PHE 763 HA PHE 763 -0.369 5.703 -10.545 832 HB2 PHE 763 HB2 PHE 763 1.849 7.412 -10.553 833 HB3 PHE 763 HB3 PHE 763 0.570 7.330 -11.762 834 HD1 PHE 763 HD1 PHE 763 1.601 8.999 -8.595 835 HD2 PHE 763 HD2 PHE 763 -1.033 9.078 -11.987 836 HE1 PHE 763 HE1 PHE 763 0.866 11.283 -7.969 837 HE2 PHE 763 HE2 PHE 763 -1.767 11.364 -11.363 838 HZ PHE 763 HZ PHE 763 -0.818 12.466 -9.353 839 HA PRO 764 HA PRO 764 2.242 3.566 -7.744 840 HB2 PRO 764 HB2 PRO 764 3.968 2.403 -9.541 841 HB3 PRO 764 HB3 PRO 764 2.310 1.837 -9.254 842 HG2 PRO 764 HG2 PRO 764 3.388 3.501 -11.466 843 HG3 PRO 764 HG3 PRO 764 2.138 2.245 -11.496 844 HD2 PRO 764 HD2 PRO 764 1.575 4.927 -11.540 845 HD3 PRO 764 HD3 PRO 764 0.467 3.706 -10.878 846 H PHE 765 H PHE 765 4.313 3.613 -6.790 847 HA PHE 765 HA PHE 765 5.741 6.064 -7.042 848 HB2 PHE 765 HB2 PHE 765 6.976 5.341 -5.226 849 HB3 PHE 765 HB3 PHE 765 5.500 4.401 -5.035 850 HD1 PHE 765 HD1 PHE 765 5.462 2.033 -6.150 851 HD2 PHE 765 HD2 PHE 765 9.045 4.259 -5.357 852 HE1 PHE 765 HE1 PHE 765 6.780 -0.054 -6.267 853 HE2 PHE 765 HE2 PHE 765 10.369 2.167 -5.469 854 HZ PHE 765 HZ PHE 765 9.235 0.007 -5.922 855 H LYS 766 H LYS 766 5.945 3.119 -8.744 856 HA LYS 766 HA LYS 766 8.730 3.356 -9.500 857 HB2 LYS 766 HB2 LYS 766 6.482 1.554 -10.375 858 HB3 LYS 766 HB3 LYS 766 8.083 1.495 -11.110 859 HG2 LYS 766 HG2 LYS 766 8.346 1.520 -8.241 860 HG3 LYS 766 HG3 LYS 766 7.245 0.234 -8.713 861 HD2 LYS 766 HD2 LYS 766 9.332 -0.817 -8.842 862 HD3 LYS 766 HD3 LYS 766 9.035 -0.337 -10.512 863 HE2 LYS 766 HE2 LYS 766 11.275 0.323 -10.016 864 HE3 LYS 766 HE3 LYS 766 10.315 1.802 -10.003 865 HZ1 LYS 766 HZ1 LYS 766 10.091 1.453 -7.539 866 HZ2 LYS 766 HZ2 LYS 766 11.274 0.239 -7.668 867 HZ3 LYS 766 HZ3 LYS 766 11.658 1.841 -8.075 868 H GLU 767 H GLU 767 5.748 4.643 -10.567 869 HA GLU 767 HA GLU 767 6.312 4.983 -13.329 870 HB2 GLU 767 HB2 GLU 767 4.179 5.526 -11.537 871 HB3 GLU 767 HB3 GLU 767 4.583 7.056 -12.307 872 HG2 GLU 767 HG2 GLU 767 4.607 5.670 -14.511 873 HG3 GLU 767 HG3 GLU 767 3.699 4.481 -13.587 874 H1 ASP 338 H1 ASP 338 10.010 7.524 15.704 875 H2 ASP 338 H2 ASP 338 9.159 8.063 14.325 876 H3 ASP 338 H3 ASP 338 9.955 9.191 15.355 877 HA ASP 338 HA ASP 338 11.048 8.438 13.122 878 HB2 ASP 338 HB2 ASP 338 12.718 8.481 15.644 879 HB3 ASP 338 HB3 ASP 338 13.140 9.103 14.050 880 H THR 339 H THR 339 12.368 6.846 12.239 881 HA THR 339 HA THR 339 13.199 4.747 11.853 882 HB THR 339 HB THR 339 14.214 3.525 13.642 883 HG1 THR 339 HG1 THR 339 12.369 4.978 15.203 884 HG21 THR 339 HG21 THR 339 15.706 5.134 14.414 885 HG22 THR 339 HG22 THR 339 14.996 5.957 13.025 886 HG23 THR 339 HG23 THR 339 14.441 6.338 14.655 887 H GLU 340 H GLU 340 10.237 5.337 12.507 888 HA GLU 340 HA GLU 340 9.340 2.635 13.240 889 HB2 GLU 340 HB2 GLU 340 7.109 3.616 13.343 890 HB3 GLU 340 HB3 GLU 340 8.237 4.597 14.278 891 HG2 GLU 340 HG2 GLU 340 7.632 5.243 11.391 892 HG3 GLU 340 HG3 GLU 340 6.601 5.827 12.687 893 H VAL 341 H VAL 341 7.550 1.673 11.900 894 HA VAL 341 HA VAL 341 8.079 2.159 9.016 895 HB VAL 341 HB VAL 341 6.978 -0.470 9.603 896 HG11 VAL 341 HG11 VAL 341 8.457 -1.114 7.953 897 HG12 VAL 341 HG12 VAL 341 8.351 0.606 7.585 898 HG13 VAL 341 HG13 VAL 341 9.722 -0.017 8.505 899 HG21 VAL 341 HG21 VAL 341 8.982 -1.403 10.693 900 HG22 VAL 341 HG22 VAL 341 9.678 0.215 10.818 901 HG23 VAL 341 HG23 VAL 341 8.222 -0.191 11.723 902 H TYR 342 H TYR 342 6.120 0.791 7.817 903 HA TYR 342 HA TYR 342 3.831 2.436 8.194 904 HB2 TYR 342 HB2 TYR 342 2.748 0.881 6.556 905 HB3 TYR 342 HB3 TYR 342 4.267 1.573 6.003 906 HD1 TYR 342 HD2 TYR 342 4.884 -0.919 8.528 907 HD2 TYR 342 HD1 TYR 342 3.962 -0.413 4.356 908 HE1 TYR 342 HE2 TYR 342 5.741 -3.198 8.052 909 HE2 TYR 342 HE1 TYR 342 4.806 -2.683 3.901 910 HH TYR 342 HH TYR 342 5.070 -4.894 5.337 911 H GLU 343 H GLU 343 4.223 1.571 10.638 912 HA GLU 343 HA GLU 343 3.206 -0.790 11.579 913 HB2 GLU 343 HB2 GLU 343 3.379 1.973 12.648 914 HB3 GLU 343 HB3 GLU 343 2.308 0.861 13.502 915 HG2 GLU 343 HG2 GLU 343 4.613 0.789 14.417 916 HG3 GLU 343 HG3 GLU 343 4.138 -0.762 13.736 917 H SER 344 H SER 344 1.113 2.114 11.758 918 HA SER 344 HA SER 344 -1.013 1.079 10.233 919 HB2 SER 344 HB2 SER 344 -1.063 0.320 13.146 920 HB3 SER 344 HB3 SER 344 -2.553 0.519 12.227 921 HG SER 344 HG SER 344 -0.428 -1.031 11.188 922 HA PRO 345 HA PRO 345 -1.046 5.690 11.215 923 HB2 PRO 345 HB2 PRO 345 -3.007 4.999 9.001 924 HB3 PRO 345 HB3 PRO 345 -2.043 6.477 9.195 925 HG2 PRO 345 HG2 PRO 345 -1.262 4.479 7.605 926 HG3 PRO 345 HG3 PRO 345 -0.105 5.457 8.521 927 HD2 PRO 345 HD2 PRO 345 -0.786 2.622 8.881 928 HD3 PRO 345 HD3 PRO 345 0.560 3.543 9.583 929 H PTR 346 H PTR 346 -3.809 3.446 10.780 930 HA PTR 346 HA PTR 346 -4.918 3.925 13.320 931 HB2 PTR 346 HB2 PTR 346 -6.045 5.845 13.070 932 HB3 PTR 346 HB3 PTR 346 -7.074 5.030 11.898 933 HD1 PTR 346 HD1 PTR 346 -5.428 4.622 9.570 934 HD2 PTR 346 HD2 PTR 346 -5.472 7.948 12.280 935 HE1 PTR 346 HE1 PTR 346 -4.503 6.071 7.783 936 HE2 PTR 346 HE2 PTR 346 -4.546 9.404 10.506 937 H ALA 347 H ALA 347 -6.814 2.723 13.736 938 HA ALA 347 HA ALA 347 -7.307 0.525 11.832 939 HB1 ALA 347 HB1 ALA 347 -6.946 -0.286 14.016 940 HB2 ALA 347 HB2 ALA 347 -8.701 -0.305 13.840 941 HB3 ALA 347 HB3 ALA 347 -7.920 0.988 14.749 942 H ASP 348 H ASP 348 -9.360 2.481 13.988 943 HA ASP 348 HA ASP 348 -11.313 3.632 13.610 944 HB2 ASP 348 HB2 ASP 348 -10.465 4.360 11.438 945 HB3 ASP 348 HB3 ASP 348 -10.921 2.821 10.718 946 HA PRO 349 HA PRO 349 -13.919 0.031 13.959 947 HB2 PRO 349 HB2 PRO 349 -15.958 1.172 15.292 948 HB3 PRO 349 HB3 PRO 349 -14.363 0.969 16.040 949 HG2 PRO 349 HG2 PRO 349 -15.625 3.415 14.922 950 HG3 PRO 349 HG3 PRO 349 -14.544 3.233 16.312 951 HD2 PRO 349 HD2 PRO 349 -13.782 4.063 13.722 952 HD3 PRO 349 HD3 PRO 349 -12.685 3.559 15.027 953 H GLU 350 H GLU 350 -16.637 2.106 13.951 954 HA GLU 350 HA GLU 350 -17.218 2.305 11.197 955 HB2 GLU 350 HB2 GLU 350 -17.497 -0.315 12.155 956 HB3 GLU 350 HB3 GLU 350 -19.140 0.328 12.117 957 HG2 GLU 350 HG2 GLU 350 -19.005 0.831 9.797 958 HG3 GLU 350 HG3 GLU 350 -17.252 0.669 9.780 Start of MODEL 11 1 H1 GLY 661 H1 GLY 661 8.275 -17.023 -8.923 2 H2 GLY 661 H2 GLY 661 7.684 -15.449 -8.617 3 H3 GLY 661 H3 GLY 661 6.604 -16.724 -8.962 4 HA2 GLY 661 HA2 GLY 661 8.349 -17.199 -6.694 5 HA3 GLY 661 HA3 GLY 661 7.176 -15.896 -6.485 6 H HIS 662 H HIS 662 5.652 -16.836 -5.191 7 HA HIS 662 HA HIS 662 4.809 -19.459 -5.060 8 HB2 HIS 662 HB2 HIS 662 2.808 -18.651 -3.999 9 HB3 HIS 662 HB3 HIS 662 4.117 -17.565 -3.539 10 HD1 HIS 662 HD1 HIS 662 0.768 -17.503 -4.846 11 HD2 HIS 662 HD2 HIS 662 4.168 -15.166 -5.441 12 HE1 HIS 662 HE1 HIS 662 -0.027 -15.334 -5.896 13 HE2 HIS 662 HE2 HIS 662 2.035 -13.892 -6.281 14 H MET 663 H MET 663 3.586 -16.908 -7.159 15 HA MET 663 HA MET 663 2.902 -18.614 -9.290 16 HB2 MET 663 HB2 MET 663 0.975 -18.539 -7.180 17 HB3 MET 663 HB3 MET 663 0.301 -17.696 -8.577 18 HG2 MET 663 HG2 MET 663 1.319 -19.750 -9.900 19 HG3 MET 663 HG3 MET 663 1.193 -20.542 -8.330 20 HE1 MET 663 HE1 MET 663 -0.152 -21.354 -11.024 21 HE2 MET 663 HE2 MET 663 -0.313 -22.281 -9.534 22 HE3 MET 663 HE3 MET 663 -1.744 -21.873 -10.485 23 H GLN 664 H GLN 664 1.285 -15.890 -7.790 24 HA GLN 664 HA GLN 664 1.885 -14.278 -10.187 25 HB2 GLN 664 HB2 GLN 664 -0.551 -14.666 -9.542 26 HB3 GLN 664 HB3 GLN 664 -0.236 -13.682 -8.112 27 HG2 GLN 664 HG2 GLN 664 0.846 -12.246 -10.301 28 HG3 GLN 664 HG3 GLN 664 -0.732 -12.823 -10.830 29 HE21 GLN 664 HE21 GLN 664 -2.419 -12.590 -8.793 30 HE22 GLN 664 HE22 GLN 664 -2.417 -11.037 -8.110 31 H ASP 665 H ASP 665 3.898 -13.546 -9.613 32 HA ASP 665 HA ASP 665 4.497 -12.509 -7.013 33 HB2 ASP 665 HB2 ASP 665 5.939 -12.227 -9.662 34 HB3 ASP 665 HB3 ASP 665 6.590 -11.711 -8.110 35 H LEU 666 H LEU 666 3.148 -10.882 -6.435 36 HA LEU 666 HA LEU 666 1.953 -8.921 -7.875 37 HB2 LEU 666 HB2 LEU 666 3.274 -8.428 -5.201 38 HB3 LEU 666 HB3 LEU 666 1.893 -7.569 -5.868 39 HG LEU 666 HG LEU 666 1.992 -10.470 -4.982 40 HD11 LEU 666 HD11 LEU 666 1.114 -7.948 -3.806 41 HD12 LEU 666 HD12 LEU 666 -0.179 -9.146 -3.845 42 HD13 LEU 666 HD13 LEU 666 1.344 -9.520 -3.041 43 HD21 LEU 666 HD21 LEU 666 -0.619 -10.017 -5.558 44 HD22 LEU 666 HD22 LEU 666 0.136 -9.034 -6.810 45 HD23 LEU 666 HD23 LEU 666 0.500 -10.756 -6.701 46 H SER 667 H SER 667 5.325 -9.165 -7.091 47 HA SER 667 HA SER 667 6.298 -6.617 -7.389 48 HB2 SER 667 HB2 SER 667 7.754 -8.503 -6.863 49 HB3 SER 667 HB3 SER 667 7.492 -9.174 -8.471 50 HG SER 667 HG SER 667 8.242 -6.821 -9.019 51 H VAL 668 H VAL 668 4.728 -8.521 -9.769 52 HA VAL 668 HA VAL 668 5.874 -7.276 -12.069 53 HB VAL 668 HB VAL 668 3.990 -8.279 -13.290 54 HG11 VAL 668 HG11 VAL 668 5.609 -9.817 -11.314 55 HG12 VAL 668 HG12 VAL 668 4.305 -10.681 -12.126 56 HG13 VAL 668 HG13 VAL 668 5.583 -9.924 -13.076 57 HG21 VAL 668 HG21 VAL 668 2.850 -9.661 -10.967 58 HG22 VAL 668 HG22 VAL 668 2.593 -7.919 -10.914 59 HG23 VAL 668 HG23 VAL 668 2.031 -8.850 -12.301 60 H HIS 669 H HIS 669 3.523 -6.318 -9.738 61 HA HIS 669 HA HIS 669 2.211 -4.382 -11.461 62 HB2 HIS 669 HB2 HIS 669 2.058 -4.544 -8.448 63 HB3 HIS 669 HB3 HIS 669 0.895 -3.815 -9.557 64 HD1 HIS 669 HD1 HIS 669 0.061 -5.711 -11.507 65 HD2 HIS 669 HD2 HIS 669 1.223 -7.088 -7.753 66 HE1 HIS 669 HE1 HIS 669 -0.851 -8.068 -11.301 67 HE2 HIS 669 HE2 HIS 669 -0.132 -8.951 -9.024 68 H LEU 670 H LEU 670 2.945 -2.473 -11.923 69 HA LEU 670 HA LEU 670 5.363 -1.396 -11.265 70 HB2 LEU 670 HB2 LEU 670 3.878 -0.621 -13.093 71 HB3 LEU 670 HB3 LEU 670 2.836 0.148 -11.902 72 HG LEU 670 HG LEU 670 4.711 1.607 -11.206 73 HD11 LEU 670 HD11 LEU 670 6.197 0.117 -13.385 74 HD12 LEU 670 HD12 LEU 670 6.751 1.640 -12.680 75 HD13 LEU 670 HD13 LEU 670 6.619 0.192 -11.675 76 HD21 LEU 670 HD21 LEU 670 4.742 3.000 -13.163 77 HD22 LEU 670 HD22 LEU 670 4.428 1.625 -14.220 78 HD23 LEU 670 HD23 LEU 670 3.168 2.204 -13.131 79 H TRP 671 H TRP 671 2.389 -1.185 -9.356 80 HA TRP 671 HA TRP 671 3.586 0.802 -7.610 81 HB2 TRP 671 HB2 TRP 671 1.447 0.263 -6.209 82 HB3 TRP 671 HB3 TRP 671 1.319 1.201 -7.690 83 HD1 TRP 671 HD1 TRP 671 -0.083 0.228 -9.626 84 HE1 TRP 671 HE1 TRP 671 -1.517 -1.917 -9.932 85 HE3 TRP 671 HE3 TRP 671 1.386 -2.386 -5.482 86 HZ2 TRP 671 HZ2 TRP 671 -1.930 -4.387 -8.594 87 HZ3 TRP 671 HZ3 TRP 671 0.445 -4.636 -5.027 88 HH2 TRP 671 HH2 TRP 671 -1.207 -5.640 -6.578 89 H TYR 672 H TYR 672 4.146 -2.403 -7.944 90 HA TYR 672 HA TYR 672 4.210 -3.000 -5.078 91 HB2 TYR 672 HB2 TYR 672 3.731 -4.623 -7.160 92 HB3 TYR 672 HB3 TYR 672 5.472 -4.858 -7.016 93 HD1 TYR 672 HD2 TYR 672 2.418 -4.636 -4.863 94 HD2 TYR 672 HD1 TYR 672 6.261 -6.445 -5.468 95 HE1 TYR 672 HE2 TYR 672 2.041 -6.093 -2.894 96 HE2 TYR 672 HE1 TYR 672 5.885 -7.905 -3.500 97 HH TYR 672 HH TYR 672 3.314 -8.724 -2.315 98 H ALA 673 H ALA 673 5.798 -2.212 -3.906 99 HA ALA 673 HA ALA 673 8.428 -1.686 -5.081 100 HB1 ALA 673 HB1 ALA 673 8.838 -0.371 -3.193 101 HB2 ALA 673 HB2 ALA 673 7.710 -1.286 -2.189 102 HB3 ALA 673 HB3 ALA 673 7.102 -0.179 -3.417 103 H GLY 674 H GLY 674 6.891 -4.285 -3.819 104 HA2 GLY 674 HA2 GLY 674 7.498 -6.266 -2.805 105 HA3 GLY 674 HA3 GLY 674 8.926 -6.091 -3.806 106 HA PRO 675 HA PRO 675 11.078 -6.342 0.079 107 HB2 PRO 675 HB2 PRO 675 13.580 -5.738 -0.883 108 HB3 PRO 675 HB3 PRO 675 12.807 -7.325 -1.060 109 HG2 PRO 675 HG2 PRO 675 13.014 -5.091 -3.023 110 HG3 PRO 675 HG3 PRO 675 13.187 -6.837 -3.277 111 HD2 PRO 675 HD2 PRO 675 10.909 -5.503 -3.923 112 HD3 PRO 675 HD3 PRO 675 10.892 -7.191 -3.361 113 H MET 676 H MET 676 10.460 -3.494 -1.575 114 HA MET 676 HA MET 676 12.211 -1.608 -0.466 115 HB2 MET 676 HB2 MET 676 10.458 -1.253 -2.264 116 HB3 MET 676 HB3 MET 676 9.277 -1.137 -0.963 117 HG2 MET 676 HG2 MET 676 9.980 0.938 -0.342 118 HG3 MET 676 HG3 MET 676 11.680 0.540 -0.575 119 HE1 MET 676 HE1 MET 676 12.402 0.441 -3.999 120 HE2 MET 676 HE2 MET 676 12.907 1.945 -3.232 121 HE3 MET 676 HE3 MET 676 12.877 0.440 -2.303 122 H GLU 677 H GLU 677 11.713 0.011 1.181 123 HA GLU 677 HA GLU 677 10.424 -1.217 3.537 124 HB2 GLU 677 HB2 GLU 677 11.900 0.381 4.815 125 HB3 GLU 677 HB3 GLU 677 12.769 -0.879 3.939 126 HG2 GLU 677 HG2 GLU 677 13.567 0.590 2.333 127 HG3 GLU 677 HG3 GLU 677 12.224 1.703 2.541 128 H ARG 678 H ARG 678 9.187 0.160 4.916 129 HA ARG 678 HA ARG 678 7.425 1.894 3.623 130 HB2 ARG 678 HB2 ARG 678 6.994 0.844 5.829 131 HB3 ARG 678 HB3 ARG 678 8.179 1.932 6.556 132 HG2 ARG 678 HG2 ARG 678 6.121 3.237 4.884 133 HG3 ARG 678 HG3 ARG 678 5.522 2.501 6.366 134 HD2 ARG 678 HD2 ARG 678 8.007 4.009 6.765 135 HD3 ARG 678 HD3 ARG 678 6.680 5.004 6.170 136 HE ARG 678 HE ARG 678 6.133 3.199 8.432 137 HH11 ARG 678 HH21 ARG 678 6.902 6.429 7.325 138 HH12 ARG 678 HH22 ARG 678 6.072 7.182 8.651 139 HH21 ARG 678 HH11 ARG 678 5.070 4.199 10.105 140 HH22 ARG 678 HH12 ARG 678 5.071 5.937 10.226 141 H ALA 679 H ALA 679 10.071 2.753 5.849 142 HA ALA 679 HA ALA 679 10.050 5.509 5.568 143 HB1 ALA 679 HB1 ALA 679 12.432 5.437 6.171 144 HB2 ALA 679 HB2 ALA 679 12.487 3.718 5.784 145 HB3 ALA 679 HB3 ALA 679 11.515 4.285 7.140 146 H GLY 680 H GLY 680 11.629 3.073 3.551 147 HA2 GLY 680 HA2 GLY 680 12.827 4.857 1.700 148 HA3 GLY 680 HA3 GLY 680 12.482 3.156 1.404 149 H ALA 681 H ALA 681 9.787 2.984 1.647 150 HA ALA 681 HA ALA 681 8.747 3.734 -0.790 151 HB1 ALA 681 HB1 ALA 681 7.451 2.220 0.459 152 HB2 ALA 681 HB2 ALA 681 6.482 3.692 0.477 153 HB3 ALA 681 HB3 ALA 681 7.447 3.256 1.882 154 H GLU 682 H GLU 682 8.684 5.548 2.254 155 HA GLU 682 HA GLU 682 7.194 7.772 1.325 156 HB2 GLU 682 HB2 GLU 682 9.345 8.099 3.397 157 HB3 GLU 682 HB3 GLU 682 7.720 8.785 3.356 158 HG2 GLU 682 HG2 GLU 682 7.073 6.183 3.479 159 HG3 GLU 682 HG3 GLU 682 8.617 6.107 4.290 160 H SER 683 H SER 683 10.631 7.009 1.356 161 HA SER 683 HA SER 683 11.739 9.431 0.617 162 HB2 SER 683 HB2 SER 683 12.704 6.897 0.944 163 HB3 SER 683 HB3 SER 683 12.879 7.114 -0.797 164 HG SER 683 HG SER 683 14.313 8.194 1.222 165 H ILE 684 H ILE 684 10.462 6.892 -1.515 166 HA ILE 684 HA ILE 684 10.858 8.475 -3.904 167 HB ILE 684 HB ILE 684 8.997 6.113 -3.653 168 HG12 ILE 684 HG12 ILE 684 11.465 5.167 -4.566 169 HG13 ILE 684 HG13 ILE 684 11.880 6.206 -3.202 170 HG21 ILE 684 HG21 ILE 684 8.918 7.231 -5.786 171 HG22 ILE 684 HG22 ILE 684 10.677 7.305 -5.875 172 HG23 ILE 684 HG23 ILE 684 9.852 5.753 -6.005 173 HD11 ILE 684 HD11 ILE 684 9.753 4.913 -2.150 174 HD12 ILE 684 HD12 ILE 684 10.344 3.665 -3.247 175 HD13 ILE 684 HD13 ILE 684 11.406 4.316 -1.999 176 H LEU 685 H LEU 685 8.018 7.414 -2.038 177 HA LEU 685 HA LEU 685 6.066 8.776 -3.492 178 HB2 LEU 685 HB2 LEU 685 6.226 8.011 -0.580 179 HB3 LEU 685 HB3 LEU 685 4.775 8.707 -1.306 180 HG LEU 685 HG LEU 685 6.162 6.159 -2.206 181 HD11 LEU 685 HD11 LEU 685 4.999 5.797 -0.119 182 HD12 LEU 685 HD12 LEU 685 3.588 6.682 -0.700 183 HD13 LEU 685 HD13 LEU 685 4.006 5.126 -1.412 184 HD21 LEU 685 HD21 LEU 685 5.162 7.045 -4.147 185 HD22 LEU 685 HD22 LEU 685 3.904 5.992 -3.502 186 HD23 LEU 685 HD23 LEU 685 3.810 7.733 -3.247 187 H ALA 686 H ALA 686 7.921 9.887 -0.625 188 HA ALA 686 HA ALA 686 6.762 12.404 -0.330 189 HB1 ALA 686 HB1 ALA 686 9.676 11.649 0.008 190 HB2 ALA 686 HB2 ALA 686 8.423 11.507 1.239 191 HB3 ALA 686 HB3 ALA 686 8.914 13.099 0.662 192 H ASN 687 H ASN 687 9.288 11.324 -2.549 193 HA ASN 687 HA ASN 687 9.801 13.899 -3.707 194 HB2 ASN 687 HB2 ASN 687 11.600 12.570 -4.156 195 HB3 ASN 687 HB3 ASN 687 10.641 11.096 -4.171 196 HD21 ASN 687 HD21 ASN 687 11.509 13.931 -6.171 197 HD22 ASN 687 HD22 ASN 687 11.165 13.183 -7.653 198 H ARG 688 H ARG 688 7.704 11.175 -4.510 199 HA ARG 688 HA ARG 688 6.915 12.178 -7.061 200 HB2 ARG 688 HB2 ARG 688 6.447 9.840 -5.478 201 HB3 ARG 688 HB3 ARG 688 4.900 10.476 -6.026 202 HG2 ARG 688 HG2 ARG 688 5.529 9.117 -7.833 203 HG3 ARG 688 HG3 ARG 688 6.112 10.699 -8.349 204 HD2 ARG 688 HD2 ARG 688 8.333 10.131 -7.332 205 HD3 ARG 688 HD3 ARG 688 7.731 8.506 -7.035 206 HE ARG 688 HE ARG 688 7.344 8.461 -9.596 207 HH11 ARG 688 HH21 ARG 688 9.839 10.323 -8.012 208 HH12 ARG 688 HH22 ARG 688 10.914 10.217 -9.363 209 HH21 ARG 688 HH11 ARG 688 8.751 8.328 -11.307 210 HH22 ARG 688 HH12 ARG 688 10.303 9.106 -11.218 211 H SER 689 H SER 689 4.438 12.412 -7.456 212 HA SER 689 HA SER 689 3.658 14.769 -5.975 213 HB2 SER 689 HB2 SER 689 3.401 14.266 -8.538 214 HB3 SER 689 HB3 SER 689 1.902 13.488 -8.032 215 HG SER 689 HG SER 689 1.988 15.903 -8.540 216 H ASP 690 H ASP 690 1.425 15.097 -5.283 217 HA ASP 690 HA ASP 690 0.641 13.293 -3.277 218 HB2 ASP 690 HB2 ASP 690 -0.198 15.844 -4.304 219 HB3 ASP 690 HB3 ASP 690 -1.614 14.829 -4.050 220 H GLY 691 H GLY 691 -0.410 11.410 -3.393 221 HA2 GLY 691 HA2 GLY 691 -2.423 10.213 -4.168 222 HA3 GLY 691 HA3 GLY 691 -2.132 10.897 -5.764 223 H THR 692 H THR 692 0.838 10.467 -5.207 224 HA THR 692 HA THR 692 1.207 8.082 -6.648 225 HB THR 692 HB THR 692 3.178 9.297 -4.698 226 HG1 THR 692 HG1 THR 692 2.593 10.974 -5.975 227 HG21 THR 692 HG21 THR 692 3.786 8.035 -7.358 228 HG22 THR 692 HG22 THR 692 4.832 8.210 -5.948 229 HG23 THR 692 HG23 THR 692 3.533 7.020 -5.940 230 H PHE 693 H PHE 693 1.296 5.950 -6.040 231 HA PHE 693 HA PHE 693 1.413 5.386 -3.139 232 HB2 PHE 693 HB2 PHE 693 -0.473 3.920 -3.243 233 HB3 PHE 693 HB3 PHE 693 -0.954 5.445 -3.983 234 HD1 PHE 693 HD1 PHE 693 -0.967 5.663 -6.501 235 HD2 PHE 693 HD2 PHE 693 -0.417 1.900 -4.503 236 HE1 PHE 693 HE1 PHE 693 -1.537 4.465 -8.598 237 HE2 PHE 693 HE2 PHE 693 -0.982 0.709 -6.600 238 HZ PHE 693 HZ PHE 693 -1.541 1.987 -8.647 239 H LEU 694 H LEU 694 1.710 3.061 -2.625 240 HA LEU 694 HA LEU 694 2.742 1.277 -4.625 241 HB2 LEU 694 HB2 LEU 694 5.046 1.232 -4.023 242 HB3 LEU 694 HB3 LEU 694 4.635 2.917 -4.294 243 HG LEU 694 HG LEU 694 4.065 2.797 -1.688 244 HD11 LEU 694 HD11 LEU 694 6.461 1.297 -1.248 245 HD12 LEU 694 HD12 LEU 694 4.837 0.957 -0.653 246 HD13 LEU 694 HD13 LEU 694 5.362 0.308 -2.205 247 HD21 LEU 694 HD21 LEU 694 5.914 4.120 -1.411 248 HD22 LEU 694 HD22 LEU 694 6.985 2.970 -2.207 249 HD23 LEU 694 HD23 LEU 694 5.961 4.034 -3.161 250 H VAL 695 H VAL 695 3.766 -0.666 -3.622 251 HA VAL 695 HA VAL 695 2.909 -1.215 -0.859 252 HB VAL 695 HB VAL 695 2.246 -3.190 -3.034 253 HG11 VAL 695 HG11 VAL 695 0.650 -3.968 -1.326 254 HG12 VAL 695 HG12 VAL 695 2.284 -3.923 -0.663 255 HG13 VAL 695 HG13 VAL 695 1.134 -2.649 -0.259 256 HG21 VAL 695 HG21 VAL 695 1.033 -1.222 -3.711 257 HG22 VAL 695 HG22 VAL 695 -0.115 -2.248 -2.850 258 HG23 VAL 695 HG23 VAL 695 0.595 -0.851 -2.043 259 H ARG 696 H ARG 696 4.244 -2.621 0.208 260 HA ARG 696 HA ARG 696 6.389 -3.922 -1.366 261 HB2 ARG 696 HB2 ARG 696 8.033 -3.131 0.064 262 HB3 ARG 696 HB3 ARG 696 6.923 -1.761 0.038 263 HG2 ARG 696 HG2 ARG 696 7.099 -2.006 2.318 264 HG3 ARG 696 HG3 ARG 696 5.789 -3.141 2.026 265 HD2 ARG 696 HD2 ARG 696 7.049 -4.790 2.875 266 HD3 ARG 696 HD3 ARG 696 8.182 -4.571 1.550 267 HE ARG 696 HE ARG 696 9.507 -3.155 2.943 268 HH11 ARG 696 HH21 ARG 696 6.663 -4.364 4.539 269 HH12 ARG 696 HH22 ARG 696 7.380 -4.290 6.121 270 HH21 ARG 696 HH11 ARG 696 10.411 -3.037 5.028 271 HH22 ARG 696 HH12 ARG 696 9.451 -3.535 6.394 272 H GLN 697 H GLN 697 7.456 -5.711 -0.256 273 HA GLN 697 HA GLN 697 6.206 -6.940 2.041 274 HB2 GLN 697 HB2 GLN 697 4.634 -7.528 0.179 275 HB3 GLN 697 HB3 GLN 697 5.965 -8.370 -0.615 276 HG2 GLN 697 HG2 GLN 697 6.237 -9.665 1.603 277 HG3 GLN 697 HG3 GLN 697 4.650 -9.027 2.027 278 HE21 GLN 697 HE21 GLN 697 3.469 -9.126 -0.601 279 HE22 GLN 697 HE22 GLN 697 3.290 -10.763 -1.017 280 H ARG 698 H ARG 698 7.729 -8.097 3.096 281 HA ARG 698 HA ARG 698 9.798 -9.549 1.667 282 HB2 ARG 698 HB2 ARG 698 10.522 -7.068 1.873 283 HB3 ARG 698 HB3 ARG 698 10.764 -7.441 3.579 284 HG2 ARG 698 HG2 ARG 698 12.122 -9.483 2.731 285 HG3 ARG 698 HG3 ARG 698 12.155 -8.640 1.182 286 HD2 ARG 698 HD2 ARG 698 13.346 -7.786 3.814 287 HD3 ARG 698 HD3 ARG 698 14.131 -7.920 2.245 288 HE ARG 698 HE ARG 698 12.907 -5.913 1.553 289 HH11 ARG 698 HH21 ARG 698 12.942 -6.638 4.941 290 HH12 ARG 698 HH22 ARG 698 12.535 -5.014 5.424 291 HH21 ARG 698 HH11 ARG 698 12.374 -3.864 2.153 292 HH22 ARG 698 HH12 ARG 698 12.188 -3.451 3.853 293 H VAL 699 H VAL 699 8.595 -8.352 4.783 294 HA VAL 699 HA VAL 699 10.000 -9.864 6.575 295 HB VAL 699 HB VAL 699 7.006 -9.576 6.817 296 HG11 VAL 699 HG11 VAL 699 7.973 -10.749 8.653 297 HG12 VAL 699 HG12 VAL 699 9.370 -9.675 8.701 298 HG13 VAL 699 HG13 VAL 699 7.790 -9.088 9.217 299 HG21 VAL 699 HG21 VAL 699 9.096 -7.485 6.598 300 HG22 VAL 699 HG22 VAL 699 7.350 -7.359 6.375 301 HG23 VAL 699 HG23 VAL 699 8.037 -7.327 7.999 302 H LYS 700 H LYS 700 10.569 -11.931 6.258 303 HA LYS 700 HA LYS 700 9.231 -13.907 4.869 304 HB2 LYS 700 HB2 LYS 700 11.600 -13.954 5.836 305 HB3 LYS 700 HB3 LYS 700 10.853 -14.485 7.346 306 HG2 LYS 700 HG2 LYS 700 9.690 -16.299 5.941 307 HG3 LYS 700 HG3 LYS 700 10.835 -15.884 4.665 308 HD2 LYS 700 HD2 LYS 700 12.688 -16.604 5.922 309 HD3 LYS 700 HD3 LYS 700 11.813 -16.489 7.449 310 HE2 LYS 700 HE2 LYS 700 10.873 -18.413 5.336 311 HE3 LYS 700 HE3 LYS 700 12.219 -18.856 6.389 312 HZ1 LYS 700 HZ1 LYS 700 10.704 -19.392 7.920 313 HZ2 LYS 700 HZ2 LYS 700 10.276 -17.739 8.040 314 HZ3 LYS 700 HZ3 LYS 700 9.421 -18.763 6.978 315 H ASP 701 H ASP 701 7.741 -15.463 5.328 316 HA ASP 701 HA ASP 701 5.952 -16.483 6.324 317 HB2 ASP 701 HB2 ASP 701 7.130 -15.668 8.978 318 HB3 ASP 701 HB3 ASP 701 6.149 -17.084 8.606 319 H ALA 702 H ALA 702 6.719 -13.530 8.199 320 HA ALA 702 HA ALA 702 3.972 -12.999 8.830 321 HB1 ALA 702 HB1 ALA 702 5.580 -10.619 8.953 322 HB2 ALA 702 HB2 ALA 702 6.500 -11.980 9.596 323 HB3 ALA 702 HB3 ALA 702 4.923 -11.581 10.278 324 H ALA 703 H ALA 703 6.132 -12.013 6.237 325 HA ALA 703 HA ALA 703 5.757 -10.919 4.259 326 HB1 ALA 703 HB1 ALA 703 3.122 -10.703 3.763 327 HB2 ALA 703 HB2 ALA 703 3.078 -11.975 4.982 328 HB3 ALA 703 HB3 ALA 703 4.022 -12.197 3.511 329 H GLU 704 H GLU 704 3.228 -9.900 6.565 330 HA GLU 704 HA GLU 704 2.435 -7.801 7.113 331 HB2 GLU 704 HB2 GLU 704 5.035 -8.010 7.872 332 HB3 GLU 704 HB3 GLU 704 5.116 -6.574 6.856 333 HG2 GLU 704 HG2 GLU 704 2.869 -6.009 8.269 334 HG3 GLU 704 HG3 GLU 704 3.729 -6.980 9.457 335 H PHE 705 H PHE 705 1.246 -7.470 5.156 336 HA PHE 705 HA PHE 705 2.586 -5.821 3.120 337 HB2 PHE 705 HB2 PHE 705 -0.112 -6.333 2.379 338 HB3 PHE 705 HB3 PHE 705 1.359 -6.962 1.648 339 HD1 PHE 705 HD2 PHE 705 -0.888 -7.534 4.598 340 HD2 PHE 705 HD1 PHE 705 1.749 -9.256 1.681 341 HE1 PHE 705 HE2 PHE 705 -1.453 -9.801 5.427 342 HE2 PHE 705 HE1 PHE 705 1.183 -11.523 2.504 343 HZ PHE 705 HZ PHE 705 -0.417 -11.796 4.379 344 H ALA 706 H ALA 706 1.979 -3.820 2.596 345 HA ALA 706 HA ALA 706 -0.365 -2.532 3.702 346 HB1 ALA 706 HB1 ALA 706 1.911 -2.503 5.281 347 HB2 ALA 706 HB2 ALA 706 0.587 -1.347 5.372 348 HB3 ALA 706 HB3 ALA 706 2.006 -0.977 4.405 349 H ILE 707 H ILE 707 -0.855 -0.627 2.602 350 HA ILE 707 HA ILE 707 0.767 -0.179 0.179 351 HB ILE 707 HB ILE 707 -2.022 0.835 0.756 352 HG12 ILE 707 HG12 ILE 707 -1.097 -1.687 -0.662 353 HG13 ILE 707 HG13 ILE 707 -2.009 -1.612 0.843 354 HG21 ILE 707 HG21 ILE 707 -0.262 1.641 -1.163 355 HG22 ILE 707 HG22 ILE 707 -1.032 0.285 -1.987 356 HG23 ILE 707 HG23 ILE 707 -2.011 1.624 -1.395 357 HD11 ILE 707 HD11 ILE 707 -3.186 -1.931 -1.566 358 HD12 ILE 707 HD12 ILE 707 -3.975 -1.124 -0.213 359 HD13 ILE 707 HD13 ILE 707 -3.190 -0.170 -1.469 360 H SER 708 H SER 708 1.830 1.666 -0.171 361 HA SER 708 HA SER 708 1.547 3.808 1.867 362 HB2 SER 708 HB2 SER 708 3.905 3.241 0.058 363 HB3 SER 708 HB3 SER 708 3.837 4.436 1.345 364 HG SER 708 HG SER 708 3.475 1.626 1.682 365 H ILE 709 H ILE 709 0.549 5.605 1.207 366 HA ILE 709 HA ILE 709 0.714 6.308 -1.665 367 HB ILE 709 HB ILE 709 -1.676 6.941 0.052 368 HG12 ILE 709 HG12 ILE 709 -2.475 4.890 -1.602 369 HG13 ILE 709 HG13 ILE 709 -0.858 4.364 -1.134 370 HG21 ILE 709 HG21 ILE 709 -0.862 7.283 -2.764 371 HG22 ILE 709 HG22 ILE 709 -2.477 6.607 -2.563 372 HG23 ILE 709 HG23 ILE 709 -2.073 8.158 -1.828 373 HD11 ILE 709 HD11 ILE 709 -1.779 5.186 1.275 374 HD12 ILE 709 HD12 ILE 709 -3.298 4.688 0.528 375 HD13 ILE 709 HD13 ILE 709 -1.972 3.534 0.686 376 H LYS 710 H LYS 710 1.067 8.352 -2.224 377 HA LYS 710 HA LYS 710 2.080 10.185 -0.215 378 HB2 LYS 710 HB2 LYS 710 3.184 10.018 -2.386 379 HB3 LYS 710 HB3 LYS 710 1.694 10.466 -3.206 380 HG2 LYS 710 HG2 LYS 710 2.954 12.476 -3.104 381 HG3 LYS 710 HG3 LYS 710 1.765 12.629 -1.814 382 HD2 LYS 710 HD2 LYS 710 3.343 12.262 -0.132 383 HD3 LYS 710 HD3 LYS 710 4.452 11.426 -1.214 384 HE2 LYS 710 HE2 LYS 710 3.786 14.320 -1.687 385 HE3 LYS 710 HE3 LYS 710 5.000 13.877 -0.484 386 HZ1 LYS 710 HZ1 LYS 710 5.729 12.325 -2.541 387 HZ2 LYS 710 HZ2 LYS 710 5.126 13.674 -3.397 388 HZ3 LYS 710 HZ3 LYS 710 6.385 13.881 -2.252 389 H TYR 711 H TYR 711 0.843 11.554 0.898 390 HA TYR 711 HA TYR 711 -1.456 12.839 -0.431 391 HB2 TYR 711 HB2 TYR 711 -1.965 10.723 1.140 392 HB3 TYR 711 HB3 TYR 711 -1.862 11.962 2.388 393 HD1 TYR 711 HD2 TYR 711 -2.898 14.330 0.812 394 HD2 TYR 711 HD1 TYR 711 -4.288 10.276 1.095 395 HE1 TYR 711 HE2 TYR 711 -5.188 15.077 0.241 396 HE2 TYR 711 HE1 TYR 711 -6.579 11.026 0.518 397 HH TYR 711 HH TYR 711 -7.833 12.769 -0.278 398 H ASN 712 H ASN 712 -1.139 14.958 -0.259 399 HA ASN 712 HA ASN 712 -0.503 17.014 0.560 400 HB2 ASN 712 HB2 ASN 712 -1.322 15.528 3.038 401 HB3 ASN 712 HB3 ASN 712 -0.591 17.123 3.187 402 HD21 ASN 712 HD21 ASN 712 -3.558 15.691 3.040 403 HD22 ASN 712 HD22 ASN 712 -4.442 16.946 2.316 404 H VAL 713 H VAL 713 1.609 16.159 -0.357 405 HA VAL 713 HA VAL 713 3.870 15.729 -0.213 406 HB VAL 713 HB VAL 713 5.107 17.464 0.802 407 HG11 VAL 713 HG11 VAL 713 3.644 19.506 0.351 408 HG12 VAL 713 HG12 VAL 713 3.784 18.349 -0.973 409 HG13 VAL 713 HG13 VAL 713 2.330 18.378 0.026 410 HG21 VAL 713 HG21 VAL 713 3.160 18.817 2.432 411 HG22 VAL 713 HG22 VAL 713 3.288 17.149 2.972 412 HG23 VAL 713 HG23 VAL 713 4.725 18.160 2.906 413 H GLU 714 H GLU 714 2.142 14.115 1.563 414 HA GLU 714 HA GLU 714 4.270 13.092 3.302 415 HB2 GLU 714 HB2 GLU 714 1.681 14.188 4.157 416 HB3 GLU 714 HB3 GLU 714 2.024 12.578 4.795 417 HG2 GLU 714 HG2 GLU 714 4.044 14.821 4.873 418 HG3 GLU 714 HG3 GLU 714 2.902 14.539 6.183 419 H VAL 715 H VAL 715 3.702 10.850 4.112 420 HA VAL 715 HA VAL 715 2.267 9.427 1.940 421 HB VAL 715 HB VAL 715 4.602 8.442 3.579 422 HG11 VAL 715 HG11 VAL 715 2.972 7.275 1.314 423 HG12 VAL 715 HG12 VAL 715 4.575 6.672 1.735 424 HG13 VAL 715 HG13 VAL 715 3.259 6.578 2.906 425 HG21 VAL 715 HG21 VAL 715 5.899 9.522 2.095 426 HG22 VAL 715 HG22 VAL 715 5.146 8.600 0.798 427 HG23 VAL 715 HG23 VAL 715 4.471 10.152 1.276 428 H LYS 716 H LYS 716 0.687 8.063 2.410 429 HA LYS 716 HA LYS 716 0.172 7.481 5.272 430 HB2 LYS 716 HB2 LYS 716 -1.610 8.675 3.797 431 HB3 LYS 716 HB3 LYS 716 -1.847 7.092 3.068 432 HG2 LYS 716 HG2 LYS 716 -2.749 6.160 5.004 433 HG3 LYS 716 HG3 LYS 716 -1.825 7.226 6.059 434 HD2 LYS 716 HD2 LYS 716 -4.270 7.970 4.428 435 HD3 LYS 716 HD3 LYS 716 -4.193 7.825 6.169 436 HE2 LYS 716 HE2 LYS 716 -3.259 10.031 4.395 437 HE3 LYS 716 HE3 LYS 716 -3.951 10.110 6.012 438 HZ1 LYS 716 HZ1 LYS 716 -1.197 10.010 5.210 439 HZ2 LYS 716 HZ2 LYS 716 -1.876 10.494 6.692 440 HZ3 LYS 716 HZ3 LYS 716 -1.565 8.852 6.397 441 H HIS 717 H HIS 717 1.051 5.564 5.778 442 HA HIS 717 HA HIS 717 0.867 3.370 3.810 443 HB2 HIS 717 HB2 HIS 717 2.468 3.286 6.367 444 HB3 HIS 717 HB3 HIS 717 2.632 2.270 4.942 445 HD1 HIS 717 HD1 HIS 717 4.135 3.068 3.056 446 HD2 HIS 717 HD2 HIS 717 3.547 5.960 6.029 447 HE1 HIS 717 HE1 HIS 717 5.929 4.849 2.728 448 HE2 HIS 717 HE2 HIS 717 5.494 6.683 4.469 449 H ILE 718 H ILE 718 -0.945 2.229 4.088 450 HA ILE 718 HA ILE 718 -1.908 1.826 6.852 451 HB ILE 718 HB ILE 718 -3.219 2.334 4.288 452 HG12 ILE 718 HG12 ILE 718 -3.463 3.799 6.192 453 HG13 ILE 718 HG13 ILE 718 -5.026 3.081 5.803 454 HG21 ILE 718 HG21 ILE 718 -3.757 -0.062 4.428 455 HG22 ILE 718 HG22 ILE 718 -4.309 0.151 6.089 456 HG23 ILE 718 HG23 ILE 718 -5.190 0.908 4.764 457 HD11 ILE 718 HD11 ILE 718 -3.309 2.693 8.178 458 HD12 ILE 718 HD12 ILE 718 -5.061 2.617 8.032 459 HD13 ILE 718 HD13 ILE 718 -4.078 1.238 7.551 460 H LYS 719 H LYS 719 -2.152 -0.193 7.668 461 HA LYS 719 HA LYS 719 -0.643 -2.288 6.429 462 HB2 LYS 719 HB2 LYS 719 -0.932 -1.771 8.947 463 HB3 LYS 719 HB3 LYS 719 -2.443 -2.671 8.806 464 HG2 LYS 719 HG2 LYS 719 -1.052 -4.440 9.293 465 HG3 LYS 719 HG3 LYS 719 -0.818 -4.409 7.546 466 HD2 LYS 719 HD2 LYS 719 1.394 -4.201 8.011 467 HD3 LYS 719 HD3 LYS 719 1.018 -2.533 8.436 468 HE2 LYS 719 HE2 LYS 719 0.401 -3.535 10.774 469 HE3 LYS 719 HE3 LYS 719 1.380 -4.907 10.247 470 HZ1 LYS 719 HZ1 LYS 719 3.287 -3.608 10.059 471 HZ2 LYS 719 HZ2 LYS 719 2.388 -2.132 10.016 472 HZ3 LYS 719 HZ3 LYS 719 2.528 -2.998 11.478 473 H ILE 720 H ILE 720 -1.278 -4.145 5.512 474 HA ILE 720 HA ILE 720 -4.109 -4.307 4.724 475 HB ILE 720 HB ILE 720 -1.598 -5.531 3.585 476 HG12 ILE 720 HG12 ILE 720 -3.705 -3.689 2.427 477 HG13 ILE 720 HG13 ILE 720 -2.132 -3.166 3.021 478 HG21 ILE 720 HG21 ILE 720 -4.478 -6.254 3.243 479 HG22 ILE 720 HG22 ILE 720 -3.460 -6.248 1.804 480 HG23 ILE 720 HG23 ILE 720 -3.050 -7.284 3.170 481 HD11 ILE 720 HD11 ILE 720 -1.457 -5.216 1.313 482 HD12 ILE 720 HD12 ILE 720 -2.838 -4.485 0.500 483 HD13 ILE 720 HD13 ILE 720 -1.428 -3.506 0.894 484 H MET 721 H MET 721 -5.375 -5.772 5.570 485 HA MET 721 HA MET 721 -4.222 -7.815 7.338 486 HB2 MET 721 HB2 MET 721 -6.404 -6.177 7.611 487 HB3 MET 721 HB3 MET 721 -7.150 -7.670 7.045 488 HG2 MET 721 HG2 MET 721 -5.587 -8.795 8.842 489 HG3 MET 721 HG3 MET 721 -5.563 -7.180 9.546 490 HE1 MET 721 HE1 MET 721 -6.230 -9.124 11.229 491 HE2 MET 721 HE2 MET 721 -7.070 -7.735 11.908 492 HE3 MET 721 HE3 MET 721 -7.901 -9.289 11.756 493 H THR 722 H THR 722 -5.084 -9.984 7.273 494 HA THR 722 HA THR 722 -6.309 -10.925 4.819 495 HB THR 722 HB THR 722 -3.794 -10.776 4.389 496 HG1 THR 722 HG1 THR 722 -5.248 -12.136 3.243 497 HG21 THR 722 HG21 THR 722 -2.327 -12.185 5.518 498 HG22 THR 722 HG22 THR 722 -3.424 -11.724 6.820 499 HG23 THR 722 HG23 THR 722 -3.608 -13.285 6.020 500 H ALA 723 H ALA 723 -6.856 -13.225 4.957 501 HA ALA 723 HA ALA 723 -6.560 -14.651 7.411 502 HB1 ALA 723 HB1 ALA 723 -9.405 -14.023 7.154 503 HB2 ALA 723 HB2 ALA 723 -8.421 -12.613 7.533 504 HB3 ALA 723 HB3 ALA 723 -8.382 -14.019 8.595 505 H GLU 724 H GLU 724 -9.266 -14.145 5.261 506 HA GLU 724 HA GLU 724 -9.606 -16.974 4.756 507 HB2 GLU 724 HB2 GLU 724 -11.103 -14.855 3.284 508 HB3 GLU 724 HB3 GLU 724 -11.702 -16.346 4.004 509 HG2 GLU 724 HG2 GLU 724 -12.564 -14.755 5.486 510 HG3 GLU 724 HG3 GLU 724 -11.046 -15.160 6.277 511 H GLY 725 H GLY 725 -7.120 -15.779 3.853 512 HA2 GLY 725 HA2 GLY 725 -5.728 -15.985 2.009 513 HA3 GLY 725 HA3 GLY 725 -7.067 -16.745 1.148 514 H LEU 726 H LEU 726 -7.702 -13.734 2.662 515 HA LEU 726 HA LEU 726 -7.696 -12.396 0.021 516 HB2 LEU 726 HB2 LEU 726 -9.395 -11.789 2.451 517 HB3 LEU 726 HB3 LEU 726 -9.525 -11.023 0.869 518 HG LEU 726 HG LEU 726 -9.728 -14.009 1.037 519 HD11 LEU 726 HD11 LEU 726 -11.219 -12.922 2.818 520 HD12 LEU 726 HD12 LEU 726 -12.105 -12.198 1.477 521 HD13 LEU 726 HD13 LEU 726 -12.030 -13.951 1.638 522 HD21 LEU 726 HD21 LEU 726 -9.700 -12.856 -1.145 523 HD22 LEU 726 HD22 LEU 726 -11.260 -13.622 -0.860 524 HD23 LEU 726 HD23 LEU 726 -11.082 -11.880 -0.650 525 H TYR 727 H TYR 727 -7.647 -9.960 0.239 526 HA TYR 727 HA TYR 727 -5.658 -9.093 2.273 527 HB2 TYR 727 HB2 TYR 727 -5.809 -8.230 -0.630 528 HB3 TYR 727 HB3 TYR 727 -4.669 -7.623 0.565 529 HD1 TYR 727 HD2 TYR 727 -5.743 -10.657 -1.296 530 HD2 TYR 727 HD1 TYR 727 -2.685 -8.837 1.110 531 HE1 TYR 727 HE2 TYR 727 -4.201 -12.525 -1.841 532 HE2 TYR 727 HE1 TYR 727 -1.142 -10.700 0.557 533 HH TYR 727 HH TYR 727 -1.967 -13.527 -0.454 534 H ARG 728 H ARG 728 -6.118 -7.150 3.281 535 HA ARG 728 HA ARG 728 -8.069 -5.342 2.096 536 HB2 ARG 728 HB2 ARG 728 -9.213 -5.332 4.483 537 HB3 ARG 728 HB3 ARG 728 -9.720 -6.439 3.211 538 HG2 ARG 728 HG2 ARG 728 -8.789 -8.283 4.242 539 HG3 ARG 728 HG3 ARG 728 -7.500 -7.341 4.985 540 HD2 ARG 728 HD2 ARG 728 -8.840 -6.656 6.771 541 HD3 ARG 728 HD3 ARG 728 -10.335 -6.911 5.888 542 HE ARG 728 HE ARG 728 -8.839 -8.911 7.371 543 HH11 ARG 728 HH21 ARG 728 -11.236 -8.287 4.938 544 HH12 ARG 728 HH22 ARG 728 -11.863 -9.910 4.999 545 HH21 ARG 728 HH11 ARG 728 -9.698 -10.987 7.422 546 HH22 ARG 728 HH12 ARG 728 -11.014 -11.427 6.363 547 H ILE 729 H ILE 729 -7.690 -3.295 2.545 548 HA ILE 729 HA ILE 729 -5.406 -2.555 4.150 549 HB ILE 729 HB ILE 729 -6.474 -0.178 3.526 550 HG12 ILE 729 HG12 ILE 729 -8.500 -1.510 2.588 551 HG13 ILE 729 HG13 ILE 729 -7.851 -0.177 1.640 552 HG21 ILE 729 HG21 ILE 729 -5.359 -0.732 1.123 553 HG22 ILE 729 HG22 ILE 729 -4.407 -0.456 2.578 554 HG23 ILE 729 HG23 ILE 729 -4.755 -2.101 2.050 555 HD11 ILE 729 HD11 ILE 729 -8.222 -2.779 0.749 556 HD12 ILE 729 HD12 ILE 729 -7.249 -1.543 -0.043 557 HD13 ILE 729 HD13 ILE 729 -6.489 -2.691 1.055 558 H THR 730 H THR 730 -8.600 -3.174 4.737 559 HA THR 730 HA THR 730 -8.437 -1.872 7.343 560 HB THR 730 HB THR 730 -9.630 -0.324 5.746 561 HG1 THR 730 HG1 THR 730 -11.545 -0.236 7.219 562 HG21 THR 730 HG21 THR 730 -12.175 -1.599 5.806 563 HG22 THR 730 HG22 THR 730 -11.226 -1.128 4.401 564 HG23 THR 730 HG23 THR 730 -11.025 -2.730 5.103 565 H GLU 731 H GLU 731 -9.451 -2.961 8.925 566 HA GLU 731 HA GLU 731 -9.892 -5.715 8.653 567 HB2 GLU 731 HB2 GLU 731 -10.724 -5.569 10.933 568 HB3 GLU 731 HB3 GLU 731 -9.362 -4.454 10.758 569 HG2 GLU 731 HG2 GLU 731 -12.090 -3.397 10.175 570 HG3 GLU 731 HG3 GLU 731 -11.671 -3.681 11.856 571 H LYS 732 H LYS 732 -11.702 -3.215 7.500 572 HA LYS 732 HA LYS 732 -14.296 -4.492 7.844 573 HB2 LYS 732 HB2 LYS 732 -13.987 -1.912 6.422 574 HB3 LYS 732 HB3 LYS 732 -15.257 -2.458 7.510 575 HG2 LYS 732 HG2 LYS 732 -12.530 -2.177 8.669 576 HG3 LYS 732 HG3 LYS 732 -13.379 -0.707 8.261 577 HD2 LYS 732 HD2 LYS 732 -15.364 -1.643 9.564 578 HD3 LYS 732 HD3 LYS 732 -14.250 -2.869 10.170 579 HE2 LYS 732 HE2 LYS 732 -13.063 -0.234 10.346 580 HE3 LYS 732 HE3 LYS 732 -14.612 -0.279 11.190 581 HZ1 LYS 732 HZ1 LYS 732 -12.109 -1.431 11.925 582 HZ2 LYS 732 HZ2 LYS 732 -13.571 -1.285 12.857 583 HZ3 LYS 732 HZ3 LYS 732 -13.329 -2.633 11.825 584 H LYS 733 H LYS 733 -11.847 -4.700 5.586 585 HA LYS 733 HA LYS 733 -13.772 -5.229 3.379 586 HB2 LYS 733 HB2 LYS 733 -12.060 -3.111 3.396 587 HB3 LYS 733 HB3 LYS 733 -11.091 -4.329 2.568 588 HG2 LYS 733 HG2 LYS 733 -12.256 -3.471 0.769 589 HG3 LYS 733 HG3 LYS 733 -13.376 -4.739 1.255 590 HD2 LYS 733 HD2 LYS 733 -14.859 -2.976 1.180 591 HD3 LYS 733 HD3 LYS 733 -14.292 -2.770 2.838 592 HE2 LYS 733 HE2 LYS 733 -12.671 -1.106 2.131 593 HE3 LYS 733 HE3 LYS 733 -13.062 -1.391 0.436 594 HZ1 LYS 733 HZ1 LYS 733 -14.680 0.104 0.575 595 HZ2 LYS 733 HZ2 LYS 733 -15.442 -0.837 1.793 596 HZ3 LYS 733 HZ3 LYS 733 -14.318 0.370 2.236 597 H ALA 734 H ALA 734 -12.229 -6.210 1.448 598 HA ALA 734 HA ALA 734 -10.224 -8.053 2.159 599 HB1 ALA 734 HB1 ALA 734 -12.812 -8.894 2.955 600 HB2 ALA 734 HB2 ALA 734 -11.304 -9.805 3.021 601 HB3 ALA 734 HB3 ALA 734 -12.331 -9.902 1.592 602 H PHE 735 H PHE 735 -9.162 -8.572 0.339 603 HA PHE 735 HA PHE 735 -10.681 -8.855 -2.197 604 HB2 PHE 735 HB2 PHE 735 -8.176 -7.256 -1.686 605 HB3 PHE 735 HB3 PHE 735 -8.531 -7.896 -3.300 606 HD1 PHE 735 HD2 PHE 735 -10.219 -6.055 -0.492 607 HD2 PHE 735 HD1 PHE 735 -9.825 -6.601 -4.731 608 HE1 PHE 735 HE2 PHE 735 -11.833 -4.211 -0.891 609 HE2 PHE 735 HE1 PHE 735 -11.419 -4.749 -5.131 610 HZ PHE 735 HZ PHE 735 -12.434 -3.560 -3.202 611 H ARG 736 H ARG 736 -9.587 -10.194 -3.821 612 HA ARG 736 HA ARG 736 -8.472 -12.575 -2.682 613 HB2 ARG 736 HB2 ARG 736 -8.493 -11.768 -5.586 614 HB3 ARG 736 HB3 ARG 736 -8.374 -13.398 -4.929 615 HG2 ARG 736 HG2 ARG 736 -10.648 -13.062 -3.887 616 HG3 ARG 736 HG3 ARG 736 -10.764 -11.541 -4.780 617 HD2 ARG 736 HD2 ARG 736 -10.488 -14.324 -5.910 618 HD3 ARG 736 HD3 ARG 736 -11.831 -13.203 -6.141 619 HE ARG 736 HE ARG 736 -9.828 -11.744 -7.172 620 HH11 ARG 736 HH21 ARG 736 -10.654 -15.087 -7.593 621 HH12 ARG 736 HH22 ARG 736 -9.865 -15.220 -9.125 622 HH21 ARG 736 HH11 ARG 736 -8.765 -11.924 -9.116 623 HH22 ARG 736 HH12 ARG 736 -8.811 -13.434 -9.994 624 H GLY 737 H GLY 737 -7.152 -9.713 -4.158 625 HA2 GLY 737 HA2 GLY 737 -4.489 -10.334 -3.299 626 HA3 GLY 737 HA3 GLY 737 -4.675 -10.475 -5.043 627 H LEU 738 H LEU 738 -3.100 -8.583 -3.478 628 HA LEU 738 HA LEU 738 -3.978 -6.057 -3.113 629 HB2 LEU 738 HB2 LEU 738 -1.461 -7.249 -4.121 630 HB3 LEU 738 HB3 LEU 738 -1.679 -5.539 -4.481 631 HG LEU 738 HG LEU 738 -0.515 -5.847 -2.339 632 HD11 LEU 738 HD11 LEU 738 -2.462 -4.095 -2.862 633 HD12 LEU 738 HD12 LEU 738 -3.224 -4.928 -1.509 634 HD13 LEU 738 HD13 LEU 738 -1.655 -4.150 -1.301 635 HD21 LEU 738 HD21 LEU 738 -3.064 -7.213 -1.429 636 HD22 LEU 738 HD22 LEU 738 -1.554 -8.052 -1.790 637 HD23 LEU 738 HD23 LEU 738 -1.630 -6.906 -0.451 638 H THR 739 H THR 739 -3.063 -7.452 -6.222 639 HA THR 739 HA THR 739 -3.433 -5.294 -7.891 640 HB THR 739 HB THR 739 -4.194 -8.101 -8.667 641 HG1 THR 739 HG1 THR 739 -1.581 -7.122 -8.825 642 HG21 THR 739 HG21 THR 739 -3.037 -7.350 -10.784 643 HG22 THR 739 HG22 THR 739 -4.529 -6.482 -10.422 644 HG23 THR 739 HG23 THR 739 -2.967 -5.728 -10.095 645 H GLU 740 H GLU 740 -5.985 -7.486 -6.687 646 HA GLU 740 HA GLU 740 -7.960 -6.173 -8.362 647 HB2 GLU 740 HB2 GLU 740 -8.911 -7.760 -6.063 648 HB3 GLU 740 HB3 GLU 740 -9.370 -7.858 -7.757 649 HG2 GLU 740 HG2 GLU 740 -6.833 -8.826 -7.869 650 HG3 GLU 740 HG3 GLU 740 -7.293 -9.346 -6.260 651 H LEU 741 H LEU 741 -6.514 -5.739 -5.322 652 HA LEU 741 HA LEU 741 -8.695 -4.220 -4.156 653 HB2 LEU 741 HB2 LEU 741 -7.328 -5.620 -2.711 654 HB3 LEU 741 HB3 LEU 741 -5.859 -4.836 -3.273 655 HG LEU 741 HG LEU 741 -6.879 -4.103 -0.991 656 HD11 LEU 741 HD11 LEU 741 -6.503 -1.683 -2.663 657 HD12 LEU 741 HD12 LEU 741 -5.628 -2.207 -1.226 658 HD13 LEU 741 HD13 LEU 741 -5.223 -2.889 -2.799 659 HD21 LEU 741 HD21 LEU 741 -8.736 -2.741 -1.009 660 HD22 LEU 741 HD22 LEU 741 -8.471 -2.208 -2.663 661 HD23 LEU 741 HD23 LEU 741 -9.148 -3.802 -2.344 662 H VAL 742 H VAL 742 -5.400 -3.687 -5.194 663 HA VAL 742 HA VAL 742 -5.271 -0.892 -4.896 664 HB VAL 742 HB VAL 742 -3.805 -2.847 -6.669 665 HG11 VAL 742 HG11 VAL 742 -3.401 0.090 -6.167 666 HG12 VAL 742 HG12 VAL 742 -2.040 -0.957 -6.569 667 HG13 VAL 742 HG13 VAL 742 -3.384 -0.789 -7.698 668 HG21 VAL 742 HG21 VAL 742 -3.607 -3.251 -4.264 669 HG22 VAL 742 HG22 VAL 742 -2.078 -2.657 -4.918 670 HG23 VAL 742 HG23 VAL 742 -3.127 -1.570 -4.006 671 H GLU 743 H GLU 743 -5.560 -2.810 -7.837 672 HA GLU 743 HA GLU 743 -5.899 -0.662 -9.602 673 HB2 GLU 743 HB2 GLU 743 -6.831 -3.509 -9.968 674 HB3 GLU 743 HB3 GLU 743 -6.430 -2.349 -11.241 675 HG2 GLU 743 HG2 GLU 743 -4.397 -3.090 -9.134 676 HG3 GLU 743 HG3 GLU 743 -4.627 -4.105 -10.541 677 H PHE 744 H PHE 744 -8.173 -2.399 -7.632 678 HA PHE 744 HA PHE 744 -10.518 -1.541 -9.070 679 HB2 PHE 744 HB2 PHE 744 -10.672 -3.554 -7.810 680 HB3 PHE 744 HB3 PHE 744 -10.059 -2.775 -6.356 681 HD1 PHE 744 HD2 PHE 744 -12.788 -2.060 -8.857 682 HD2 PHE 744 HD1 PHE 744 -11.652 -2.408 -4.737 683 HE1 PHE 744 HE2 PHE 744 -15.094 -1.459 -8.171 684 HE2 PHE 744 HE1 PHE 744 -13.956 -1.806 -4.041 685 HZ PHE 744 HZ PHE 744 -15.679 -1.331 -5.764 686 H TYR 745 H TYR 745 -8.720 -0.440 -6.236 687 HA TYR 745 HA TYR 745 -10.617 1.542 -5.443 688 HB2 TYR 745 HB2 TYR 745 -7.693 1.102 -4.863 689 HB3 TYR 745 HB3 TYR 745 -8.585 2.477 -4.207 690 HD1 TYR 745 HD2 TYR 745 -10.800 -0.252 -4.711 691 HD2 TYR 745 HD1 TYR 745 -7.788 1.215 -2.020 692 HE1 TYR 745 HE2 TYR 745 -11.689 -1.703 -2.922 693 HE2 TYR 745 HE1 TYR 745 -8.692 -0.247 -0.237 694 HH TYR 745 HH TYR 745 -10.597 -2.808 -0.766 695 H GLN 746 H GLN 746 -8.205 1.420 -7.910 696 HA GLN 746 HA GLN 746 -7.518 4.064 -8.302 697 HB2 GLN 746 HB2 GLN 746 -8.181 1.901 -10.300 698 HB3 GLN 746 HB3 GLN 746 -7.592 3.491 -10.791 699 HG2 GLN 746 HG2 GLN 746 -5.554 3.197 -9.504 700 HG3 GLN 746 HG3 GLN 746 -6.153 1.684 -8.826 701 HE21 GLN 746 HE21 GLN 746 -7.111 0.310 -11.025 702 HE22 GLN 746 HE22 GLN 746 -5.857 0.070 -12.147 703 H GLN 747 H GLN 747 -10.578 2.492 -8.819 704 HA GLN 747 HA GLN 747 -11.758 4.976 -9.898 705 HB2 GLN 747 HB2 GLN 747 -12.996 2.216 -9.866 706 HB3 GLN 747 HB3 GLN 747 -13.524 3.621 -10.791 707 HG2 GLN 747 HG2 GLN 747 -12.126 3.097 -12.477 708 HG3 GLN 747 HG3 GLN 747 -10.750 3.059 -11.380 709 HE21 GLN 747 HE21 GLN 747 -10.224 0.960 -10.362 710 HE22 GLN 747 HE22 GLN 747 -10.799 -0.484 -11.038 711 H ASN 748 H ASN 748 -11.196 3.755 -6.990 712 HA ASN 748 HA ASN 748 -13.711 4.823 -5.897 713 HB2 ASN 748 HB2 ASN 748 -13.932 2.332 -6.064 714 HB3 ASN 748 HB3 ASN 748 -12.547 2.184 -4.984 715 HD21 ASN 748 HD21 ASN 748 -13.684 1.348 -3.152 716 HD22 ASN 748 HD22 ASN 748 -14.872 2.238 -2.334 717 H SER 749 H SER 749 -13.182 6.358 -4.515 718 HA SER 749 HA SER 749 -10.707 7.043 -3.599 719 HB2 SER 749 HB2 SER 749 -13.149 8.086 -3.297 720 HB3 SER 749 HB3 SER 749 -12.948 7.401 -1.693 721 HG SER 749 HG SER 749 -10.662 8.587 -2.369 722 H LEU 750 H LEU 750 -9.343 6.414 -2.034 723 HA LEU 750 HA LEU 750 -9.484 3.813 -0.996 724 HB2 LEU 750 HB2 LEU 750 -7.857 6.186 -0.092 725 HB3 LEU 750 HB3 LEU 750 -7.595 4.534 0.461 726 HG LEU 750 HG LEU 750 -7.804 4.561 -2.416 727 HD11 LEU 750 HD11 LEU 750 -6.840 6.956 -1.586 728 HD12 LEU 750 HD12 LEU 750 -5.350 6.018 -1.652 729 HD13 LEU 750 HD13 LEU 750 -6.358 6.177 -3.089 730 HD21 LEU 750 HD21 LEU 750 -6.725 2.843 -0.993 731 HD22 LEU 750 HD22 LEU 750 -5.624 3.463 -2.221 732 HD23 LEU 750 HD23 LEU 750 -5.479 4.009 -0.551 733 H LYS 751 H LYS 751 -10.521 6.875 0.388 734 HA LYS 751 HA LYS 751 -10.821 6.208 3.049 735 HB2 LYS 751 HB2 LYS 751 -12.621 7.861 3.146 736 HB3 LYS 751 HB3 LYS 751 -11.269 8.442 2.188 737 HG2 LYS 751 HG2 LYS 751 -12.746 7.294 0.231 738 HG3 LYS 751 HG3 LYS 751 -14.033 7.801 1.337 739 HD2 LYS 751 HD2 LYS 751 -13.031 10.060 1.445 740 HD3 LYS 751 HD3 LYS 751 -11.788 9.546 0.313 741 HE2 LYS 751 HE2 LYS 751 -14.112 8.895 -1.018 742 HE3 LYS 751 HE3 LYS 751 -14.521 10.416 -0.210 743 HZ1 LYS 751 HZ1 LYS 751 -13.472 11.042 -2.206 744 HZ2 LYS 751 HZ2 LYS 751 -12.263 11.234 -0.991 745 HZ3 LYS 751 HZ3 LYS 751 -12.239 9.856 -2.031 746 H ASP 752 H ASP 752 -12.423 4.895 0.338 747 HA ASP 752 HA ASP 752 -14.818 3.967 1.619 748 HB2 ASP 752 HB2 ASP 752 -14.621 4.050 -0.822 749 HB3 ASP 752 HB3 ASP 752 -13.279 2.911 -0.777 750 H CYS 753 H CYS 753 -11.531 2.924 1.408 751 HA CYS 753 HA CYS 753 -12.069 0.533 3.064 752 HB2 CYS 753 HB2 CYS 753 -9.657 0.923 1.343 753 HB3 CYS 753 HB3 CYS 753 -10.407 -0.578 1.890 754 HG CYS 753 HG CYS 753 -12.119 1.201 0.016 755 H PHE 754 H PHE 754 -9.614 2.949 2.269 756 HA PHE 754 HA PHE 754 -8.026 2.502 4.557 757 HB2 PHE 754 HB2 PHE 754 -8.336 4.788 2.635 758 HB3 PHE 754 HB3 PHE 754 -7.300 4.948 4.054 759 HD1 PHE 754 HD2 PHE 754 -8.023 2.286 1.500 760 HD2 PHE 754 HD1 PHE 754 -5.050 4.516 3.650 761 HE1 PHE 754 HE2 PHE 754 -6.239 1.016 0.346 762 HE2 PHE 754 HE1 PHE 754 -3.265 3.245 2.497 763 HZ PHE 754 HZ PHE 754 -3.859 1.496 0.845 764 H LYS 755 H LYS 755 -7.749 4.139 6.358 765 HA LYS 755 HA LYS 755 -10.401 4.597 7.452 766 HB2 LYS 755 HB2 LYS 755 -8.029 5.507 8.959 767 HB3 LYS 755 HB3 LYS 755 -9.428 4.589 9.498 768 HG2 LYS 755 HG2 LYS 755 -7.080 3.516 7.895 769 HG3 LYS 755 HG3 LYS 755 -7.462 3.141 9.571 770 HD2 LYS 755 HD2 LYS 755 -9.788 2.384 8.506 771 HD3 LYS 755 HD3 LYS 755 -8.794 2.191 7.064 772 HE2 LYS 755 HE2 LYS 755 -7.702 0.375 7.901 773 HE3 LYS 755 HE3 LYS 755 -7.600 1.065 9.522 774 HZ1 LYS 755 HZ1 LYS 755 -9.979 0.572 9.819 775 HZ2 LYS 755 HZ2 LYS 755 -10.015 -0.195 8.279 776 HZ3 LYS 755 HZ3 LYS 755 -9.072 -0.859 9.555 777 H SER 756 H SER 756 -7.523 6.720 7.243 778 HA SER 756 HA SER 756 -9.335 9.025 7.169 779 HB2 SER 756 HB2 SER 756 -6.333 8.962 7.492 780 HB3 SER 756 HB3 SER 756 -7.375 10.372 7.677 781 HG SER 756 HG SER 756 -6.892 8.280 9.393 782 H LEU 757 H LEU 757 -7.065 7.308 5.196 783 HA LEU 757 HA LEU 757 -6.263 9.042 3.241 784 HB2 LEU 757 HB2 LEU 757 -6.003 6.447 3.555 785 HB3 LEU 757 HB3 LEU 757 -7.376 6.379 2.459 786 HG LEU 757 HG LEU 757 -5.467 6.241 1.066 787 HD11 LEU 757 HD11 LEU 757 -7.222 7.942 0.413 788 HD12 LEU 757 HD12 LEU 757 -6.134 9.176 1.048 789 HD13 LEU 757 HD13 LEU 757 -5.628 8.169 -0.301 790 HD21 LEU 757 HD21 LEU 757 -4.361 8.657 2.502 791 HD22 LEU 757 HD22 LEU 757 -3.858 6.992 2.816 792 HD23 LEU 757 HD23 LEU 757 -3.563 7.725 1.238 793 H ASP 758 H ASP 758 -7.403 10.508 2.029 794 HA ASP 758 HA ASP 758 -10.052 9.650 1.043 795 HB2 ASP 758 HB2 ASP 758 -10.081 11.518 2.775 796 HB3 ASP 758 HB3 ASP 758 -9.320 12.530 1.551 797 H THR 759 H THR 759 -8.742 8.795 -0.748 798 HA THR 759 HA THR 759 -8.978 10.487 -2.997 799 HB THR 759 HB THR 759 -6.839 11.436 -2.080 800 HG1 THR 759 HG1 THR 759 -6.014 11.559 -4.096 801 HG21 THR 759 HG21 THR 759 -6.119 8.598 -2.159 802 HG22 THR 759 HG22 THR 759 -4.951 9.626 -2.978 803 HG23 THR 759 HG23 THR 759 -5.352 9.927 -1.289 804 H THR 760 H THR 760 -7.223 9.246 -4.788 805 HA THR 760 HA THR 760 -8.003 6.389 -4.562 806 HB THR 760 HB THR 760 -8.295 6.437 -7.077 807 HG1 THR 760 HG1 THR 760 -8.779 9.145 -6.934 808 HG21 THR 760 HG21 THR 760 -10.534 7.602 -6.933 809 HG22 THR 760 HG22 THR 760 -10.255 6.370 -5.702 810 HG23 THR 760 HG23 THR 760 -10.097 8.079 -5.290 811 H LEU 761 H LEU 761 -6.818 5.012 -6.170 812 HA LEU 761 HA LEU 761 -3.998 5.284 -5.793 813 HB2 LEU 761 HB2 LEU 761 -5.703 3.419 -7.466 814 HB3 LEU 761 HB3 LEU 761 -3.947 3.303 -7.409 815 HG LEU 761 HG LEU 761 -4.985 1.740 -5.810 816 HD11 LEU 761 HD11 LEU 761 -3.978 3.598 -3.819 817 HD12 LEU 761 HD12 LEU 761 -3.262 2.098 -4.411 818 HD13 LEU 761 HD13 LEU 761 -2.974 3.611 -5.266 819 HD21 LEU 761 HD21 LEU 761 -7.018 3.258 -5.459 820 HD22 LEU 761 HD22 LEU 761 -6.377 2.462 -4.022 821 HD23 LEU 761 HD23 LEU 761 -6.017 4.160 -4.322 822 H GLN 762 H GLN 762 -3.599 7.363 -6.698 823 HA GLN 762 HA GLN 762 -4.252 8.077 -9.358 824 HB2 GLN 762 HB2 GLN 762 -2.190 9.114 -7.413 825 HB3 GLN 762 HB3 GLN 762 -2.460 9.837 -8.996 826 HG2 GLN 762 HG2 GLN 762 -5.022 9.488 -7.818 827 HG3 GLN 762 HG3 GLN 762 -3.987 10.195 -6.581 828 HE21 GLN 762 HE21 GLN 762 -2.678 12.187 -7.355 829 HE22 GLN 762 HE22 GLN 762 -3.446 13.221 -8.461 830 H PHE 763 H PHE 763 -0.977 7.349 -8.086 831 HA PHE 763 HA PHE 763 -0.420 5.773 -10.464 832 HB2 PHE 763 HB2 PHE 763 1.817 7.455 -10.399 833 HB3 PHE 763 HB3 PHE 763 0.559 7.410 -11.632 834 HD1 PHE 763 HD1 PHE 763 1.545 9.006 -8.413 835 HD2 PHE 763 HD2 PHE 763 -1.014 9.183 -11.857 836 HE1 PHE 763 HE1 PHE 763 0.825 11.287 -7.759 837 HE2 PHE 763 HE2 PHE 763 -1.734 11.464 -11.204 838 HZ PHE 763 HZ PHE 763 -0.814 12.517 -9.155 839 HA PRO 764 HA PRO 764 2.174 3.577 -7.700 840 HB2 PRO 764 HB2 PRO 764 3.935 2.468 -9.487 841 HB3 PRO 764 HB3 PRO 764 2.270 1.896 -9.259 842 HG2 PRO 764 HG2 PRO 764 3.416 3.586 -11.407 843 HG3 PRO 764 HG3 PRO 764 2.128 2.375 -11.482 844 HD2 PRO 764 HD2 PRO 764 1.687 5.100 -11.460 845 HD3 PRO 764 HD3 PRO 764 0.499 3.889 -10.934 846 H PHE 765 H PHE 765 4.008 3.887 -6.508 847 HA PHE 765 HA PHE 765 5.518 6.235 -6.741 848 HB2 PHE 765 HB2 PHE 765 6.756 5.453 -4.938 849 HB3 PHE 765 HB3 PHE 765 5.263 4.534 -4.780 850 HD1 PHE 765 HD1 PHE 765 5.239 2.253 -6.240 851 HD2 PHE 765 HD2 PHE 765 8.762 4.270 -4.837 852 HE1 PHE 765 HE1 PHE 765 6.527 0.162 -6.474 853 HE2 PHE 765 HE2 PHE 765 10.052 2.165 -5.066 854 HZ PHE 765 HZ PHE 765 8.936 0.112 -5.881 855 H LYS 766 H LYS 766 5.962 3.107 -8.206 856 HA LYS 766 HA LYS 766 8.661 3.305 -8.932 857 HB2 LYS 766 HB2 LYS 766 6.305 1.720 -9.725 858 HB3 LYS 766 HB3 LYS 766 7.629 1.780 -10.877 859 HG2 LYS 766 HG2 LYS 766 8.572 1.419 -8.150 860 HG3 LYS 766 HG3 LYS 766 7.484 0.134 -8.656 861 HD2 LYS 766 HD2 LYS 766 9.794 -0.434 -9.260 862 HD3 LYS 766 HD3 LYS 766 8.835 -0.175 -10.718 863 HE2 LYS 766 HE2 LYS 766 10.307 2.153 -9.509 864 HE3 LYS 766 HE3 LYS 766 11.203 0.979 -10.468 865 HZ1 LYS 766 HZ1 LYS 766 8.987 1.468 -11.970 866 HZ2 LYS 766 HZ2 LYS 766 9.344 3.016 -11.337 867 HZ3 LYS 766 HZ3 LYS 766 10.516 2.153 -12.223 868 H GLU 767 H GLU 767 5.810 4.789 -10.212 869 HA GLU 767 HA GLU 767 6.859 5.283 -12.813 870 HB2 GLU 767 HB2 GLU 767 4.378 5.636 -11.473 871 HB3 GLU 767 HB3 GLU 767 4.866 7.220 -12.071 872 HG2 GLU 767 HG2 GLU 767 5.432 5.862 -14.269 873 HG3 GLU 767 HG3 GLU 767 4.275 4.717 -13.607 874 H1 ASP 338 H1 ASP 338 13.267 0.901 6.172 875 H2 ASP 338 H2 ASP 338 14.170 0.271 7.474 876 H3 ASP 338 H3 ASP 338 12.745 1.160 7.783 877 HA ASP 338 HA ASP 338 11.549 -0.639 6.465 878 HB2 ASP 338 HB2 ASP 338 13.937 -1.503 5.747 879 HB3 ASP 338 HB3 ASP 338 13.878 -2.352 7.289 880 H THR 339 H THR 339 13.718 -0.521 9.267 881 HA THR 339 HA THR 339 12.301 -2.231 10.990 882 HB THR 339 HB THR 339 13.436 0.021 12.413 883 HG1 THR 339 HG1 THR 339 15.597 -0.448 11.524 884 HG21 THR 339 HG21 THR 339 13.221 -2.317 13.233 885 HG22 THR 339 HG22 THR 339 14.399 -2.828 12.024 886 HG23 THR 339 HG23 THR 339 14.882 -1.732 13.319 887 H GLU 340 H GLU 340 11.695 1.029 9.932 888 HA GLU 340 HA GLU 340 9.785 1.660 12.008 889 HB2 GLU 340 HB2 GLU 340 9.480 3.708 10.863 890 HB3 GLU 340 HB3 GLU 340 11.180 3.318 10.622 891 HG2 GLU 340 HG2 GLU 340 8.951 2.769 8.632 892 HG3 GLU 340 HG3 GLU 340 10.115 4.079 8.519 893 H VAL 341 H VAL 341 9.726 0.543 8.685 894 HA VAL 341 HA VAL 341 8.068 -0.191 7.300 895 HB VAL 341 HB VAL 341 8.570 -1.989 9.106 896 HG11 VAL 341 HG11 VAL 341 7.265 -1.964 10.928 897 HG12 VAL 341 HG12 VAL 341 6.275 -0.670 10.264 898 HG13 VAL 341 HG13 VAL 341 5.886 -2.350 9.901 899 HG21 VAL 341 HG21 VAL 341 6.012 -2.801 8.034 900 HG22 VAL 341 HG22 VAL 341 6.922 -1.903 6.817 901 HG23 VAL 341 HG23 VAL 341 7.627 -3.331 7.577 902 H TYR 342 H TYR 342 5.430 -1.033 7.913 903 HA TYR 342 HA TYR 342 4.130 1.591 8.248 904 HB2 TYR 342 HB2 TYR 342 2.202 -0.000 7.147 905 HB3 TYR 342 HB3 TYR 342 3.289 1.029 6.226 906 HD1 TYR 342 HD2 TYR 342 3.495 -2.353 7.880 907 HD2 TYR 342 HD1 TYR 342 4.239 0.011 4.370 908 HE1 TYR 342 HE2 TYR 342 4.419 -4.340 6.729 909 HE2 TYR 342 HE1 TYR 342 5.161 -1.973 3.239 910 HH TYR 342 HH TYR 342 4.788 -5.163 4.483 911 H GLU 343 H GLU 343 3.728 1.700 10.405 912 HA GLU 343 HA GLU 343 3.046 -0.346 12.152 913 HB2 GLU 343 HB2 GLU 343 1.697 1.599 13.324 914 HB3 GLU 343 HB3 GLU 343 3.455 1.661 13.234 915 HG2 GLU 343 HG2 GLU 343 1.885 2.846 10.973 916 HG3 GLU 343 HG3 GLU 343 1.983 3.745 12.484 917 H SER 344 H SER 344 0.480 1.964 11.494 918 HA SER 344 HA SER 344 -1.299 0.494 9.988 919 HB2 SER 344 HB2 SER 344 -1.471 -1.333 11.411 920 HB3 SER 344 HB3 SER 344 -1.271 -0.356 12.863 921 HG SER 344 HG SER 344 -3.368 0.613 12.231 922 HA PRO 345 HA PRO 345 -2.340 4.894 11.408 923 HB2 PRO 345 HB2 PRO 345 -3.330 4.651 8.570 924 HB3 PRO 345 HB3 PRO 345 -2.588 6.042 9.383 925 HG2 PRO 345 HG2 PRO 345 -1.203 4.510 7.719 926 HG3 PRO 345 HG3 PRO 345 -0.465 5.211 9.169 927 HD2 PRO 345 HD2 PRO 345 -1.186 2.377 8.626 928 HD3 PRO 345 HD3 PRO 345 0.030 3.039 9.737 929 H PTR 346 H PTR 346 -4.132 5.032 12.600 930 HA PTR 346 HA PTR 346 -6.216 4.600 13.466 931 HB2 PTR 346 HB2 PTR 346 -7.673 5.757 12.220 932 HB3 PTR 346 HB3 PTR 346 -7.660 4.531 10.958 933 HD1 PTR 346 HD1 PTR 346 -6.080 4.680 9.068 934 HD2 PTR 346 HD2 PTR 346 -6.190 7.687 12.125 935 HE1 PTR 346 HE1 PTR 346 -4.749 6.166 7.609 936 HE2 PTR 346 HE2 PTR 346 -4.857 9.192 10.679 937 H ALA 347 H ALA 347 -8.464 3.380 12.386 938 HA ALA 347 HA ALA 347 -7.983 0.695 11.466 939 HB1 ALA 347 HB1 ALA 347 -9.166 0.553 14.162 940 HB2 ALA 347 HB2 ALA 347 -7.463 1.002 14.143 941 HB3 ALA 347 HB3 ALA 347 -7.985 -0.501 13.387 942 H ASP 348 H ASP 348 -10.377 1.780 13.844 943 HA ASP 348 HA ASP 348 -12.494 1.197 11.917 944 HB2 ASP 348 HB2 ASP 348 -12.263 0.695 14.591 945 HB3 ASP 348 HB3 ASP 348 -13.239 2.163 14.596 946 HA PRO 349 HA PRO 349 -12.762 5.692 11.427 947 HB2 PRO 349 HB2 PRO 349 -13.265 5.701 8.795 948 HB3 PRO 349 HB3 PRO 349 -11.657 5.270 9.411 949 HG2 PRO 349 HG2 PRO 349 -13.762 3.538 8.275 950 HG3 PRO 349 HG3 PRO 349 -12.006 3.327 8.280 951 HD2 PRO 349 HD2 PRO 349 -13.915 2.140 10.084 952 HD3 PRO 349 HD3 PRO 349 -12.150 1.974 10.107 953 H GLU 350 H GLU 350 -15.094 3.261 11.258 954 HA GLU 350 HA GLU 350 -17.294 4.961 10.380 955 HB2 GLU 350 HB2 GLU 350 -17.173 2.065 11.255 956 HB3 GLU 350 HB3 GLU 350 -18.644 2.880 10.729 957 HG2 GLU 350 HG2 GLU 350 -18.081 2.266 8.623 958 HG3 GLU 350 HG3 GLU 350 -16.827 3.497 8.712 Start of MODEL 12 1 H1 GLY 661 H1 GLY 661 2.495 -15.185 -10.911 2 H2 GLY 661 H2 GLY 661 3.336 -13.711 -10.996 3 H3 GLY 661 H3 GLY 661 3.457 -14.683 -9.597 4 HA2 GLY 661 HA2 GLY 661 4.392 -15.530 -12.292 5 HA3 GLY 661 HA3 GLY 661 5.434 -14.797 -11.072 6 H HIS 662 H HIS 662 6.211 -16.034 -9.416 7 HA HIS 662 HA HIS 662 5.876 -18.910 -9.607 8 HB2 HIS 662 HB2 HIS 662 8.082 -17.834 -9.152 9 HB3 HIS 662 HB3 HIS 662 7.456 -17.275 -7.603 10 HD1 HIS 662 HD1 HIS 662 5.788 -20.107 -7.275 11 HD2 HIS 662 HD2 HIS 662 9.910 -19.575 -7.743 12 HE1 HIS 662 HE1 HIS 662 6.908 -22.173 -6.300 13 HE2 HIS 662 HE2 HIS 662 9.413 -21.861 -6.576 14 H MET 663 H MET 663 4.915 -16.319 -7.405 15 HA MET 663 HA MET 663 2.736 -17.790 -6.338 16 HB2 MET 663 HB2 MET 663 5.145 -18.621 -5.257 17 HB3 MET 663 HB3 MET 663 4.554 -17.456 -4.067 18 HG2 MET 663 HG2 MET 663 2.873 -19.704 -5.209 19 HG3 MET 663 HG3 MET 663 3.747 -19.807 -3.677 20 HE1 MET 663 HE1 MET 663 1.434 -20.242 -2.237 21 HE2 MET 663 HE2 MET 663 -0.052 -19.477 -2.815 22 HE3 MET 663 HE3 MET 663 0.941 -20.450 -3.913 23 H GLN 664 H GLN 664 1.454 -16.020 -6.368 24 HA GLN 664 HA GLN 664 0.668 -13.888 -5.960 25 HB2 GLN 664 HB2 GLN 664 0.683 -15.171 -3.695 26 HB3 GLN 664 HB3 GLN 664 2.024 -14.106 -3.281 27 HG2 GLN 664 HG2 GLN 664 -0.071 -12.521 -4.451 28 HG3 GLN 664 HG3 GLN 664 -0.772 -13.529 -3.188 29 HE21 GLN 664 HE21 GLN 664 2.392 -11.824 -3.511 30 HE22 GLN 664 HE22 GLN 664 2.267 -11.026 -2.009 31 H ASP 665 H ASP 665 3.105 -13.926 -7.335 32 HA ASP 665 HA ASP 665 4.969 -12.064 -6.209 33 HB2 ASP 665 HB2 ASP 665 4.897 -12.415 -9.139 34 HB3 ASP 665 HB3 ASP 665 6.245 -12.547 -8.017 35 H LEU 666 H LEU 666 3.302 -10.471 -5.639 36 HA LEU 666 HA LEU 666 1.880 -8.970 -7.583 37 HB2 LEU 666 HB2 LEU 666 2.868 -7.989 -4.898 38 HB3 LEU 666 HB3 LEU 666 1.521 -7.345 -5.829 39 HG LEU 666 HG LEU 666 1.619 -10.195 -4.798 40 HD11 LEU 666 HD11 LEU 666 -0.141 -9.231 -3.172 41 HD12 LEU 666 HD12 LEU 666 1.552 -8.882 -2.833 42 HD13 LEU 666 HD13 LEU 666 0.535 -7.656 -3.585 43 HD21 LEU 666 HD21 LEU 666 0.055 -10.089 -6.568 44 HD22 LEU 666 HD22 LEU 666 -0.935 -9.817 -5.134 45 HD23 LEU 666 HD23 LEU 666 -0.450 -8.454 -6.142 46 H SER 667 H SER 667 5.161 -9.126 -6.778 47 HA SER 667 HA SER 667 6.155 -6.570 -7.155 48 HB2 SER 667 HB2 SER 667 7.594 -8.389 -6.463 49 HB3 SER 667 HB3 SER 667 7.334 -9.224 -7.994 50 HG SER 667 HG SER 667 8.118 -6.921 -8.758 51 H VAL 668 H VAL 668 4.526 -8.492 -9.431 52 HA VAL 668 HA VAL 668 5.780 -7.473 -11.801 53 HB VAL 668 HB VAL 668 3.935 -8.545 -12.981 54 HG11 VAL 668 HG11 VAL 668 4.121 -10.695 -11.115 55 HG12 VAL 668 HG12 VAL 668 5.044 -10.469 -12.604 56 HG13 VAL 668 HG13 VAL 668 5.659 -9.831 -11.076 57 HG21 VAL 668 HG21 VAL 668 2.005 -8.014 -11.717 58 HG22 VAL 668 HG22 VAL 668 2.212 -9.744 -11.446 59 HG23 VAL 668 HG23 VAL 668 2.721 -8.592 -10.214 60 H HIS 669 H HIS 669 3.598 -6.161 -9.549 61 HA HIS 669 HA HIS 669 2.298 -4.399 -11.481 62 HB2 HIS 669 HB2 HIS 669 2.044 -4.429 -8.470 63 HB3 HIS 669 HB3 HIS 669 0.965 -3.643 -9.629 64 HD1 HIS 669 HD1 HIS 669 -0.004 -5.448 -11.538 65 HD2 HIS 669 HD2 HIS 669 1.157 -6.955 -7.833 66 HE1 HIS 669 HE1 HIS 669 -1.044 -7.753 -11.350 67 HE2 HIS 669 HE2 HIS 669 -0.356 -8.682 -9.087 68 H LEU 670 H LEU 670 2.929 -2.447 -11.976 69 HA LEU 670 HA LEU 670 5.349 -1.312 -11.353 70 HB2 LEU 670 HB2 LEU 670 3.914 -0.616 -13.231 71 HB3 LEU 670 HB3 LEU 670 2.786 0.121 -12.098 72 HG LEU 670 HG LEU 670 4.596 1.654 -11.333 73 HD11 LEU 670 HD11 LEU 670 6.636 1.806 -12.797 74 HD12 LEU 670 HD12 LEU 670 6.567 0.332 -11.822 75 HD13 LEU 670 HD13 LEU 670 6.154 0.276 -13.536 76 HD21 LEU 670 HD21 LEU 670 4.544 3.078 -13.264 77 HD22 LEU 670 HD22 LEU 670 4.310 1.705 -14.345 78 HD23 LEU 670 HD23 LEU 670 3.018 2.191 -13.247 79 H TRP 671 H TRP 671 2.371 -1.175 -9.476 80 HA TRP 671 HA TRP 671 3.420 0.927 -7.767 81 HB2 TRP 671 HB2 TRP 671 1.314 0.300 -6.374 82 HB3 TRP 671 HB3 TRP 671 1.124 1.157 -7.895 83 HD1 TRP 671 HD1 TRP 671 -0.140 -0.038 -9.829 84 HE1 TRP 671 HE1 TRP 671 -1.478 -2.259 -9.997 85 HE3 TRP 671 HE3 TRP 671 1.321 -2.264 -5.459 86 HZ2 TRP 671 HZ2 TRP 671 -1.830 -4.630 -8.481 87 HZ3 TRP 671 HZ3 TRP 671 0.457 -4.507 -4.852 88 HH2 TRP 671 HH2 TRP 671 -1.115 -5.695 -6.356 89 H TYR 672 H TYR 672 4.131 -2.274 -8.018 90 HA TYR 672 HA TYR 672 4.244 -2.777 -5.144 91 HB2 TYR 672 HB2 TYR 672 3.809 -4.481 -7.164 92 HB3 TYR 672 HB3 TYR 672 5.565 -4.634 -7.042 93 HD1 TYR 672 HD2 TYR 672 2.466 -4.600 -4.970 94 HD2 TYR 672 HD1 TYR 672 6.523 -5.948 -5.326 95 HE1 TYR 672 HE2 TYR 672 2.194 -5.951 -2.910 96 HE2 TYR 672 HE1 TYR 672 6.257 -7.294 -3.268 97 HH TYR 672 HH TYR 672 3.894 -8.382 -2.071 98 H ALA 673 H ALA 673 5.877 -2.275 -3.914 99 HA ALA 673 HA ALA 673 8.449 -1.515 -5.135 100 HB1 ALA 673 HB1 ALA 673 7.148 -0.017 -3.515 101 HB2 ALA 673 HB2 ALA 673 8.860 -0.260 -3.178 102 HB3 ALA 673 HB3 ALA 673 7.642 -1.149 -2.259 103 H GLY 674 H GLY 674 7.080 -4.220 -3.911 104 HA2 GLY 674 HA2 GLY 674 7.856 -6.218 -3.074 105 HA3 GLY 674 HA3 GLY 674 9.387 -5.767 -3.795 106 HA PRO 675 HA PRO 675 10.833 -5.900 0.422 107 HB2 PRO 675 HB2 PRO 675 13.416 -5.258 -0.070 108 HB3 PRO 675 HB3 PRO 675 12.719 -6.820 -0.550 109 HG2 PRO 675 HG2 PRO 675 13.202 -4.379 -2.207 110 HG3 PRO 675 HG3 PRO 675 13.516 -6.081 -2.594 111 HD2 PRO 675 HD2 PRO 675 11.291 -4.743 -3.488 112 HD3 PRO 675 HD3 PRO 675 11.321 -6.493 -3.189 113 H MET 676 H MET 676 10.444 -3.075 -1.378 114 HA MET 676 HA MET 676 11.909 -1.174 0.111 115 HB2 MET 676 HB2 MET 676 10.682 -0.927 -2.153 116 HB3 MET 676 HB3 MET 676 9.268 -0.553 -1.165 117 HG2 MET 676 HG2 MET 676 10.022 1.563 -0.995 118 HG3 MET 676 HG3 MET 676 11.380 0.951 -0.056 119 HE1 MET 676 HE1 MET 676 13.849 0.522 -1.064 120 HE2 MET 676 HE2 MET 676 14.240 2.008 -1.922 121 HE3 MET 676 HE3 MET 676 13.257 2.063 -0.455 122 H GLU 677 H GLU 677 11.735 -1.144 2.276 123 HA GLU 677 HA GLU 677 9.367 -1.602 3.762 124 HB2 GLU 677 HB2 GLU 677 10.675 -0.494 5.632 125 HB3 GLU 677 HB3 GLU 677 11.458 -1.879 4.878 126 HG2 GLU 677 HG2 GLU 677 12.735 -0.284 3.407 127 HG3 GLU 677 HG3 GLU 677 12.030 1.045 4.313 128 H ARG 678 H ARG 678 8.028 -0.124 4.884 129 HA ARG 678 HA ARG 678 6.948 2.003 3.565 130 HB2 ARG 678 HB2 ARG 678 5.784 1.343 5.481 131 HB3 ARG 678 HB3 ARG 678 7.224 1.407 6.497 132 HG2 ARG 678 HG2 ARG 678 6.536 3.999 5.281 133 HG3 ARG 678 HG3 ARG 678 5.289 3.377 6.357 134 HD2 ARG 678 HD2 ARG 678 6.775 3.269 8.192 135 HD3 ARG 678 HD3 ARG 678 8.195 3.423 7.181 136 HE ARG 678 HE ARG 678 7.579 5.763 6.807 137 HH11 ARG 678 HH21 ARG 678 6.085 4.111 9.506 138 HH12 ARG 678 HH22 ARG 678 5.403 5.604 10.144 139 HH21 ARG 678 HH11 ARG 678 6.786 7.592 7.690 140 HH22 ARG 678 HH12 ARG 678 5.830 7.538 9.150 141 H ALA 679 H ALA 679 9.424 2.264 6.087 142 HA ALA 679 HA ALA 679 9.958 4.971 6.029 143 HB1 ALA 679 HB1 ALA 679 11.329 4.190 7.632 144 HB2 ALA 679 HB2 ALA 679 12.450 3.705 6.359 145 HB3 ALA 679 HB3 ALA 679 11.255 2.558 6.971 146 H GLY 680 H GLY 680 10.968 2.458 3.825 147 HA2 GLY 680 HA2 GLY 680 12.761 4.185 2.322 148 HA3 GLY 680 HA3 GLY 680 12.341 2.515 1.940 149 H ALA 681 H ALA 681 9.525 2.802 2.081 150 HA ALA 681 HA ALA 681 8.878 3.520 -0.547 151 HB1 ALA 681 HB1 ALA 681 7.248 3.168 1.954 152 HB2 ALA 681 HB2 ALA 681 7.314 2.135 0.528 153 HB3 ALA 681 HB3 ALA 681 6.486 3.691 0.455 154 H GLU 682 H GLU 682 8.544 5.365 2.470 155 HA GLU 682 HA GLU 682 7.306 7.645 1.413 156 HB2 GLU 682 HB2 GLU 682 9.378 7.893 3.579 157 HB3 GLU 682 HB3 GLU 682 7.838 8.736 3.413 158 HG2 GLU 682 HG2 GLU 682 6.920 6.221 3.615 159 HG3 GLU 682 HG3 GLU 682 8.407 6.031 4.519 160 H SER 683 H SER 683 10.662 6.640 1.445 161 HA SER 683 HA SER 683 11.991 8.964 0.838 162 HB2 SER 683 HB2 SER 683 12.941 6.603 1.175 163 HB3 SER 683 HB3 SER 683 12.639 6.368 -0.545 164 HG SER 683 HG SER 683 13.840 8.481 -0.724 165 H ILE 684 H ILE 684 10.501 6.719 -1.472 166 HA ILE 684 HA ILE 684 11.017 8.494 -3.708 167 HB ILE 684 HB ILE 684 9.119 6.151 -3.741 168 HG12 ILE 684 HG12 ILE 684 11.636 5.272 -4.639 169 HG13 ILE 684 HG13 ILE 684 11.966 6.128 -3.134 170 HG21 ILE 684 HG21 ILE 684 10.818 7.630 -5.746 171 HG22 ILE 684 HG22 ILE 684 10.226 6.003 -6.073 172 HG23 ILE 684 HG23 ILE 684 9.086 7.315 -5.793 173 HD11 ILE 684 HD11 ILE 684 11.149 3.529 -3.249 174 HD12 ILE 684 HD12 ILE 684 10.865 4.586 -1.865 175 HD13 ILE 684 HD13 ILE 684 9.598 4.353 -3.069 176 H LEU 685 H LEU 685 8.093 7.280 -2.074 177 HA LEU 685 HA LEU 685 6.194 8.766 -3.444 178 HB2 LEU 685 HB2 LEU 685 6.258 7.824 -0.577 179 HB3 LEU 685 HB3 LEU 685 4.842 8.584 -1.302 180 HG LEU 685 HG LEU 685 6.218 6.063 -2.279 181 HD11 LEU 685 HD11 LEU 685 4.827 5.823 -0.221 182 HD12 LEU 685 HD12 LEU 685 3.453 6.486 -1.106 183 HD13 LEU 685 HD13 LEU 685 4.163 4.947 -1.594 184 HD21 LEU 685 HD21 LEU 685 4.062 6.018 -3.736 185 HD22 LEU 685 HD22 LEU 685 3.971 7.744 -3.391 186 HD23 LEU 685 HD23 LEU 685 5.373 7.086 -4.234 187 H ALA 686 H ALA 686 7.956 9.698 -0.463 188 HA ALA 686 HA ALA 686 6.759 12.172 -0.038 189 HB1 ALA 686 HB1 ALA 686 9.674 11.453 0.358 190 HB2 ALA 686 HB2 ALA 686 8.377 11.159 1.517 191 HB3 ALA 686 HB3 ALA 686 8.836 12.812 1.108 192 H ASN 687 H ASN 687 9.342 11.289 -2.279 193 HA ASN 687 HA ASN 687 9.769 14.004 -3.164 194 HB2 ASN 687 HB2 ASN 687 11.482 12.095 -3.154 195 HB3 ASN 687 HB3 ASN 687 10.667 11.516 -4.605 196 HD21 ASN 687 HD21 ASN 687 10.033 14.211 -5.654 197 HD22 ASN 687 HD22 ASN 687 11.517 14.878 -6.151 198 H ARG 688 H ARG 688 7.717 11.334 -4.156 199 HA ARG 688 HA ARG 688 7.216 12.438 -6.772 200 HB2 ARG 688 HB2 ARG 688 6.855 9.943 -5.615 201 HB3 ARG 688 HB3 ARG 688 5.212 10.550 -5.818 202 HG2 ARG 688 HG2 ARG 688 5.465 9.742 -7.947 203 HG3 ARG 688 HG3 ARG 688 6.279 11.283 -8.209 204 HD2 ARG 688 HD2 ARG 688 8.450 10.232 -7.700 205 HD3 ARG 688 HD3 ARG 688 7.643 8.696 -7.408 206 HE ARG 688 HE ARG 688 7.325 8.425 -9.743 207 HH11 ARG 688 HH21 ARG 688 8.589 11.555 -8.944 208 HH12 ARG 688 HH22 ARG 688 9.018 11.935 -10.572 209 HH21 ARG 688 HH11 ARG 688 7.872 8.918 -11.846 210 HH22 ARG 688 HH12 ARG 688 8.615 10.449 -12.211 211 H SER 689 H SER 689 4.831 12.708 -7.413 212 HA SER 689 HA SER 689 3.861 14.972 -5.972 213 HB2 SER 689 HB2 SER 689 3.687 14.253 -8.542 214 HB3 SER 689 HB3 SER 689 2.125 13.648 -7.989 215 HG SER 689 HG SER 689 2.239 15.927 -8.701 216 H ASP 690 H ASP 690 1.685 15.280 -5.227 217 HA ASP 690 HA ASP 690 0.874 13.445 -3.269 218 HB2 ASP 690 HB2 ASP 690 0.100 16.028 -4.184 219 HB3 ASP 690 HB3 ASP 690 -1.353 15.037 -4.116 220 H GLY 691 H GLY 691 -0.273 11.611 -3.376 221 HA2 GLY 691 HA2 GLY 691 -2.269 10.448 -4.213 222 HA3 GLY 691 HA3 GLY 691 -1.910 11.110 -5.806 223 H THR 692 H THR 692 1.012 10.632 -5.359 224 HA THR 692 HA THR 692 1.318 8.190 -6.685 225 HB THR 692 HB THR 692 3.387 9.334 -4.803 226 HG1 THR 692 HG1 THR 692 2.801 11.096 -5.955 227 HG21 THR 692 HG21 THR 692 3.878 8.254 -7.556 228 HG22 THR 692 HG22 THR 692 4.943 8.252 -6.148 229 HG23 THR 692 HG23 THR 692 3.592 7.122 -6.233 230 H PHE 693 H PHE 693 1.561 6.056 -6.016 231 HA PHE 693 HA PHE 693 1.678 5.559 -3.109 232 HB2 PHE 693 HB2 PHE 693 -0.231 4.124 -3.127 233 HB3 PHE 693 HB3 PHE 693 -0.717 5.632 -3.900 234 HD1 PHE 693 HD1 PHE 693 -0.747 5.772 -6.430 235 HD2 PHE 693 HD2 PHE 693 -0.259 2.062 -4.321 236 HE1 PHE 693 HE1 PHE 693 -1.356 4.523 -8.485 237 HE2 PHE 693 HE2 PHE 693 -0.872 0.816 -6.373 238 HZ PHE 693 HZ PHE 693 -1.419 2.044 -8.456 239 H LEU 694 H LEU 694 1.759 3.128 -2.652 240 HA LEU 694 HA LEU 694 2.728 1.340 -4.631 241 HB2 LEU 694 HB2 LEU 694 5.052 1.205 -4.096 242 HB3 LEU 694 HB3 LEU 694 4.684 2.889 -4.434 243 HG LEU 694 HG LEU 694 4.224 2.887 -1.788 244 HD11 LEU 694 HD11 LEU 694 5.133 1.149 -0.681 245 HD12 LEU 694 HD12 LEU 694 5.407 0.361 -2.233 246 HD13 LEU 694 HD13 LEU 694 6.668 1.365 -1.521 247 HD21 LEU 694 HD21 LEU 694 6.462 3.847 -1.545 248 HD22 LEU 694 HD22 LEU 694 6.970 3.090 -3.052 249 HD23 LEU 694 HD23 LEU 694 5.754 4.364 -3.070 250 H VAL 695 H VAL 695 3.764 -0.618 -3.635 251 HA VAL 695 HA VAL 695 2.921 -1.143 -0.863 252 HB VAL 695 HB VAL 695 2.229 -3.104 -3.044 253 HG11 VAL 695 HG11 VAL 695 0.643 -3.884 -1.316 254 HG12 VAL 695 HG12 VAL 695 2.294 -3.884 -0.696 255 HG13 VAL 695 HG13 VAL 695 1.182 -2.595 -0.239 256 HG21 VAL 695 HG21 VAL 695 0.628 -0.753 -2.009 257 HG22 VAL 695 HG22 VAL 695 1.003 -1.145 -3.686 258 HG23 VAL 695 HG23 VAL 695 -0.130 -2.146 -2.776 259 H ARG 696 H ARG 696 4.088 -2.803 0.163 260 HA ARG 696 HA ARG 696 6.313 -3.958 -1.416 261 HB2 ARG 696 HB2 ARG 696 7.840 -3.577 0.443 262 HB3 ARG 696 HB3 ARG 696 7.130 -2.056 -0.080 263 HG2 ARG 696 HG2 ARG 696 6.193 -1.711 1.929 264 HG3 ARG 696 HG3 ARG 696 5.496 -3.330 1.961 265 HD2 ARG 696 HD2 ARG 696 8.441 -3.019 2.426 266 HD3 ARG 696 HD3 ARG 696 7.326 -2.621 3.731 267 HE ARG 696 HE ARG 696 6.945 -5.217 2.439 268 HH11 ARG 696 HH21 ARG 696 8.264 -3.404 5.070 269 HH12 ARG 696 HH22 ARG 696 8.307 -4.767 6.138 270 HH21 ARG 696 HH11 ARG 696 7.042 -6.978 3.846 271 HH22 ARG 696 HH12 ARG 696 7.616 -6.728 5.492 272 H GLN 697 H GLN 697 7.278 -5.885 -0.493 273 HA GLN 697 HA GLN 697 5.327 -7.481 1.085 274 HB2 GLN 697 HB2 GLN 697 6.141 -7.990 -1.473 275 HB3 GLN 697 HB3 GLN 697 7.309 -8.934 -0.557 276 HG2 GLN 697 HG2 GLN 697 5.673 -10.317 0.368 277 HG3 GLN 697 HG3 GLN 697 4.401 -9.113 0.174 278 HE21 GLN 697 HE21 GLN 697 6.159 -11.691 -1.469 279 HE22 GLN 697 HE22 GLN 697 5.194 -11.698 -2.866 280 H ARG 698 H ARG 698 8.750 -7.808 0.163 281 HA ARG 698 HA ARG 698 10.650 -8.203 1.386 282 HB2 ARG 698 HB2 ARG 698 9.573 -6.189 2.699 283 HB3 ARG 698 HB3 ARG 698 9.277 -7.419 3.927 284 HG2 ARG 698 HG2 ARG 698 11.418 -7.276 4.590 285 HG3 ARG 698 HG3 ARG 698 11.940 -7.795 2.989 286 HD2 ARG 698 HD2 ARG 698 12.759 -5.742 2.595 287 HD3 ARG 698 HD3 ARG 698 11.141 -5.069 2.777 288 HE ARG 698 HE ARG 698 12.208 -5.533 5.365 289 HH11 ARG 698 HH21 ARG 698 12.611 -3.507 2.559 290 HH12 ARG 698 HH22 ARG 698 13.328 -2.210 3.472 291 HH21 ARG 698 HH11 ARG 698 13.075 -3.814 6.517 292 HH22 ARG 698 HH12 ARG 698 13.598 -2.361 5.665 293 H VAL 699 H VAL 699 7.766 -9.127 3.276 294 HA VAL 699 HA VAL 699 8.760 -11.880 3.394 295 HB VAL 699 HB VAL 699 9.741 -10.782 5.377 296 HG11 VAL 699 HG11 VAL 699 8.557 -9.198 6.450 297 HG12 VAL 699 HG12 VAL 699 7.119 -9.585 5.511 298 HG13 VAL 699 HG13 VAL 699 7.450 -10.446 7.014 299 HG21 VAL 699 HG21 VAL 699 9.173 -12.500 6.874 300 HG22 VAL 699 HG22 VAL 699 7.486 -12.521 6.365 301 HG23 VAL 699 HG23 VAL 699 8.731 -13.197 5.316 302 H LYS 700 H LYS 700 7.159 -13.404 3.666 303 HA LYS 700 HA LYS 700 4.404 -12.388 3.433 304 HB2 LYS 700 HB2 LYS 700 3.865 -14.594 2.504 305 HB3 LYS 700 HB3 LYS 700 5.204 -13.864 1.620 306 HG2 LYS 700 HG2 LYS 700 6.810 -15.195 2.942 307 HG3 LYS 700 HG3 LYS 700 5.474 -15.916 3.837 308 HD2 LYS 700 HD2 LYS 700 4.737 -16.348 1.207 309 HD3 LYS 700 HD3 LYS 700 6.486 -16.570 1.166 310 HE2 LYS 700 HE2 LYS 700 4.525 -17.978 3.005 311 HE3 LYS 700 HE3 LYS 700 5.453 -18.710 1.691 312 HZ1 LYS 700 HZ1 LYS 700 7.209 -17.331 3.418 313 HZ2 LYS 700 HZ2 LYS 700 6.226 -18.350 4.374 314 HZ3 LYS 700 HZ3 LYS 700 7.149 -19.000 3.086 315 H ASP 701 H ASP 701 6.290 -14.901 5.109 316 HA ASP 701 HA ASP 701 4.230 -15.830 6.793 317 HB2 ASP 701 HB2 ASP 701 7.146 -15.835 7.547 318 HB3 ASP 701 HB3 ASP 701 5.915 -17.053 7.883 319 H ALA 702 H ALA 702 3.646 -13.358 6.963 320 HA ALA 702 HA ALA 702 3.664 -12.681 9.691 321 HB1 ALA 702 HB1 ALA 702 5.026 -10.413 9.088 322 HB2 ALA 702 HB2 ALA 702 5.890 -11.572 8.076 323 HB3 ALA 702 HB3 ALA 702 5.778 -11.832 9.817 324 H ALA 703 H ALA 703 2.967 -12.119 6.408 325 HA ALA 703 HA ALA 703 1.339 -10.915 5.335 326 HB1 ALA 703 HB1 ALA 703 -0.630 -11.119 6.384 327 HB2 ALA 703 HB2 ALA 703 -0.161 -9.937 7.606 328 HB3 ALA 703 HB3 ALA 703 0.246 -11.639 7.823 329 H GLU 704 H GLU 704 3.786 -9.626 6.451 330 HA GLU 704 HA GLU 704 3.230 -7.008 7.354 331 HB2 GLU 704 HB2 GLU 704 5.471 -8.460 7.158 332 HB3 GLU 704 HB3 GLU 704 5.647 -7.507 5.685 333 HG2 GLU 704 HG2 GLU 704 5.443 -5.434 6.952 334 HG3 GLU 704 HG3 GLU 704 5.117 -6.332 8.432 335 H PHE 705 H PHE 705 1.368 -7.327 5.381 336 HA PHE 705 HA PHE 705 2.418 -5.854 3.042 337 HB2 PHE 705 HB2 PHE 705 -0.367 -6.961 3.246 338 HB3 PHE 705 HB3 PHE 705 0.589 -6.615 1.805 339 HD1 PHE 705 HD2 PHE 705 3.194 -7.874 2.541 340 HD2 PHE 705 HD1 PHE 705 -0.837 -9.263 3.081 341 HE1 PHE 705 HE2 PHE 705 3.998 -10.218 2.521 342 HE2 PHE 705 HE1 PHE 705 -0.032 -11.607 3.054 343 HZ PHE 705 HZ PHE 705 2.384 -12.084 2.773 344 H ALA 706 H ALA 706 1.851 -3.849 2.568 345 HA ALA 706 HA ALA 706 -0.490 -2.546 3.638 346 HB1 ALA 706 HB1 ALA 706 1.667 -2.522 5.318 347 HB2 ALA 706 HB2 ALA 706 0.428 -1.272 5.275 348 HB3 ALA 706 HB3 ALA 706 1.922 -1.053 4.386 349 H ILE 707 H ILE 707 -0.955 -0.641 2.537 350 HA ILE 707 HA ILE 707 0.737 -0.162 0.171 351 HB ILE 707 HB ILE 707 -2.077 0.832 0.672 352 HG12 ILE 707 HG12 ILE 707 -1.134 -1.607 -0.874 353 HG13 ILE 707 HG13 ILE 707 -1.958 -1.652 0.683 354 HG21 ILE 707 HG21 ILE 707 -0.233 1.672 -1.172 355 HG22 ILE 707 HG22 ILE 707 -1.023 0.363 -2.053 356 HG23 ILE 707 HG23 ILE 707 -1.978 1.709 -1.432 357 HD11 ILE 707 HD11 ILE 707 -3.342 -0.037 -1.353 358 HD12 ILE 707 HD12 ILE 707 -3.224 -1.751 -1.750 359 HD13 ILE 707 HD13 ILE 707 -3.985 -1.246 -0.245 360 H SER 708 H SER 708 1.758 1.699 -0.167 361 HA SER 708 HA SER 708 1.450 3.830 1.876 362 HB2 SER 708 HB2 SER 708 3.824 3.271 0.084 363 HB3 SER 708 HB3 SER 708 3.744 4.455 1.385 364 HG SER 708 HG SER 708 3.569 1.617 1.576 365 H ILE 709 H ILE 709 0.478 5.640 1.193 366 HA ILE 709 HA ILE 709 0.685 6.322 -1.685 367 HB ILE 709 HB ILE 709 -1.735 6.918 0.016 368 HG12 ILE 709 HG12 ILE 709 -2.532 4.936 -1.690 369 HG13 ILE 709 HG13 ILE 709 -0.897 4.404 -1.306 370 HG21 ILE 709 HG21 ILE 709 -2.325 6.590 -2.744 371 HG22 ILE 709 HG22 ILE 709 -2.324 8.092 -1.816 372 HG23 ILE 709 HG23 ILE 709 -0.866 7.579 -2.663 373 HD11 ILE 709 HD11 ILE 709 -2.954 5.183 0.779 374 HD12 ILE 709 HD12 ILE 709 -2.636 3.523 0.275 375 HD13 ILE 709 HD13 ILE 709 -1.372 4.459 1.071 376 H LYS 710 H LYS 710 1.100 8.360 -2.233 377 HA LYS 710 HA LYS 710 2.061 10.184 -0.199 378 HB2 LYS 710 HB2 LYS 710 3.191 9.997 -2.368 379 HB3 LYS 710 HB3 LYS 710 1.723 10.511 -3.191 380 HG2 LYS 710 HG2 LYS 710 3.070 12.470 -3.018 381 HG3 LYS 710 HG3 LYS 710 1.838 12.638 -1.769 382 HD2 LYS 710 HD2 LYS 710 3.338 12.152 -0.038 383 HD3 LYS 710 HD3 LYS 710 4.473 11.341 -1.115 384 HE2 LYS 710 HE2 LYS 710 3.872 14.254 -1.522 385 HE3 LYS 710 HE3 LYS 710 5.005 13.769 -0.257 386 HZ1 LYS 710 HZ1 LYS 710 6.488 13.824 -1.946 387 HZ2 LYS 710 HZ2 LYS 710 5.861 12.266 -2.296 388 HZ3 LYS 710 HZ3 LYS 710 5.292 13.622 -3.166 389 H TYR 711 H TYR 711 0.754 11.470 0.932 390 HA TYR 711 HA TYR 711 -1.531 12.758 -0.434 391 HB2 TYR 711 HB2 TYR 711 -2.009 10.636 1.137 392 HB3 TYR 711 HB3 TYR 711 -1.932 11.877 2.385 393 HD1 TYR 711 HD2 TYR 711 -3.153 14.211 1.447 394 HD2 TYR 711 HD1 TYR 711 -4.163 10.165 0.436 395 HE1 TYR 711 HE2 TYR 711 -5.449 14.935 0.850 396 HE2 TYR 711 HE1 TYR 711 -6.462 10.892 -0.164 397 HH TYR 711 HH TYR 711 -7.793 12.708 -0.599 398 H ASN 712 H ASN 712 -1.225 14.866 -0.289 399 HA ASN 712 HA ASN 712 -0.630 16.937 0.494 400 HB2 ASN 712 HB2 ASN 712 -1.402 15.537 3.050 401 HB3 ASN 712 HB3 ASN 712 -0.851 17.210 3.051 402 HD21 ASN 712 HD21 ASN 712 -2.580 16.108 0.225 403 HD22 ASN 712 HD22 ASN 712 -4.034 16.908 0.573 404 H VAL 713 H VAL 713 1.503 16.080 -0.359 405 HA VAL 713 HA VAL 713 3.777 15.781 -0.180 406 HB VAL 713 HB VAL 713 4.933 17.510 1.027 407 HG11 VAL 713 HG11 VAL 713 3.809 19.459 0.158 408 HG12 VAL 713 HG12 VAL 713 3.511 18.129 -0.962 409 HG13 VAL 713 HG13 VAL 713 2.253 18.629 0.168 410 HG21 VAL 713 HG21 VAL 713 3.522 17.143 3.161 411 HG22 VAL 713 HG22 VAL 713 3.990 18.800 2.783 412 HG23 VAL 713 HG23 VAL 713 2.357 18.244 2.428 413 H GLU 714 H GLU 714 2.038 14.112 1.593 414 HA GLU 714 HA GLU 714 4.188 13.095 3.317 415 HB2 GLU 714 HB2 GLU 714 1.604 14.174 4.169 416 HB3 GLU 714 HB3 GLU 714 1.902 12.536 4.763 417 HG2 GLU 714 HG2 GLU 714 4.042 14.644 4.917 418 HG3 GLU 714 HG3 GLU 714 2.806 14.528 6.168 419 H VAL 715 H VAL 715 3.759 10.817 4.024 420 HA VAL 715 HA VAL 715 2.307 9.402 1.856 421 HB VAL 715 HB VAL 715 4.542 8.224 3.486 422 HG11 VAL 715 HG11 VAL 715 4.706 6.746 1.522 423 HG12 VAL 715 HG12 VAL 715 3.088 6.688 2.221 424 HG13 VAL 715 HG13 VAL 715 3.382 7.622 0.752 425 HG21 VAL 715 HG21 VAL 715 4.633 10.168 1.234 426 HG22 VAL 715 HG22 VAL 715 5.815 9.865 2.509 427 HG23 VAL 715 HG23 VAL 715 5.719 8.784 1.120 428 H LYS 716 H LYS 716 0.667 8.121 2.341 429 HA LYS 716 HA LYS 716 0.168 7.499 5.194 430 HB2 LYS 716 HB2 LYS 716 -1.533 8.638 3.438 431 HB3 LYS 716 HB3 LYS 716 -1.901 6.945 3.137 432 HG2 LYS 716 HG2 LYS 716 -2.716 6.575 5.287 433 HG3 LYS 716 HG3 LYS 716 -1.721 7.848 5.989 434 HD2 LYS 716 HD2 LYS 716 -4.168 8.283 4.242 435 HD3 LYS 716 HD3 LYS 716 -4.110 8.495 5.973 436 HE2 LYS 716 HE2 LYS 716 -2.654 10.129 3.877 437 HE3 LYS 716 HE3 LYS 716 -3.904 10.680 4.989 438 HZ1 LYS 716 HZ1 LYS 716 -2.430 10.984 6.604 439 HZ2 LYS 716 HZ2 LYS 716 -1.694 9.475 6.352 440 HZ3 LYS 716 HZ3 LYS 716 -1.212 10.814 5.423 441 H HIS 717 H HIS 717 0.853 5.536 5.797 442 HA HIS 717 HA HIS 717 0.658 3.322 3.844 443 HB2 HIS 717 HB2 HIS 717 2.344 3.175 6.323 444 HB3 HIS 717 HB3 HIS 717 2.484 2.254 4.833 445 HD1 HIS 717 HD1 HIS 717 4.011 3.124 3.037 446 HD2 HIS 717 HD2 HIS 717 3.332 5.922 6.079 447 HE1 HIS 717 HE1 HIS 717 5.784 4.935 2.787 448 HE2 HIS 717 HE2 HIS 717 5.322 6.701 4.589 449 H ILE 718 H ILE 718 -1.157 2.186 4.214 450 HA ILE 718 HA ILE 718 -1.973 1.681 7.024 451 HB ILE 718 HB ILE 718 -3.478 2.079 4.488 452 HG12 ILE 718 HG12 ILE 718 -3.520 3.811 6.178 453 HG13 ILE 718 HG13 ILE 718 -5.109 3.054 6.119 454 HG21 ILE 718 HG21 ILE 718 -4.101 -0.219 4.956 455 HG22 ILE 718 HG22 ILE 718 -4.345 0.159 6.660 456 HG23 ILE 718 HG23 ILE 718 -5.429 0.834 5.445 457 HD11 ILE 718 HD11 ILE 718 -3.816 1.480 7.960 458 HD12 ILE 718 HD12 ILE 718 -3.121 3.069 8.283 459 HD13 ILE 718 HD13 ILE 718 -4.865 2.838 8.360 460 H LYS 719 H LYS 719 -2.069 -0.414 7.746 461 HA LYS 719 HA LYS 719 -0.614 -2.380 6.254 462 HB2 LYS 719 HB2 LYS 719 -1.347 -1.952 8.964 463 HB3 LYS 719 HB3 LYS 719 -1.926 -3.552 8.504 464 HG2 LYS 719 HG2 LYS 719 0.187 -4.380 8.191 465 HG3 LYS 719 HG3 LYS 719 0.811 -2.853 7.574 466 HD2 LYS 719 HD2 LYS 719 0.113 -3.274 10.494 467 HD3 LYS 719 HD3 LYS 719 1.723 -3.576 9.843 468 HE2 LYS 719 HE2 LYS 719 1.274 -1.098 8.842 469 HE3 LYS 719 HE3 LYS 719 0.327 -0.996 10.321 470 HZ1 LYS 719 HZ1 LYS 719 2.259 -0.525 11.299 471 HZ2 LYS 719 HZ2 LYS 719 2.607 -2.189 11.148 472 HZ3 LYS 719 HZ3 LYS 719 3.203 -1.096 9.978 473 H ILE 720 H ILE 720 -1.248 -4.208 5.268 474 HA ILE 720 HA ILE 720 -4.116 -4.399 4.650 475 HB ILE 720 HB ILE 720 -1.645 -5.507 3.332 476 HG12 ILE 720 HG12 ILE 720 -3.895 -3.877 2.157 477 HG13 ILE 720 HG13 ILE 720 -2.528 -3.111 2.971 478 HG21 ILE 720 HG21 ILE 720 -3.292 -7.283 3.235 479 HG22 ILE 720 HG22 ILE 720 -4.559 -6.136 2.800 480 HG23 ILE 720 HG23 ILE 720 -3.260 -6.484 1.663 481 HD11 ILE 720 HD11 ILE 720 -2.525 -3.663 0.344 482 HD12 ILE 720 HD12 ILE 720 -1.051 -3.672 1.315 483 HD13 ILE 720 HD13 ILE 720 -1.879 -5.188 0.952 484 H MET 721 H MET 721 -5.231 -5.654 5.929 485 HA MET 721 HA MET 721 -3.991 -7.807 7.414 486 HB2 MET 721 HB2 MET 721 -6.127 -6.180 7.894 487 HB3 MET 721 HB3 MET 721 -6.936 -7.642 7.337 488 HG2 MET 721 HG2 MET 721 -6.564 -8.625 9.330 489 HG3 MET 721 HG3 MET 721 -4.827 -8.420 9.123 490 HE1 MET 721 HE1 MET 721 -5.604 -7.430 12.698 491 HE2 MET 721 HE2 MET 721 -7.194 -7.771 12.024 492 HE3 MET 721 HE3 MET 721 -5.804 -8.764 11.571 493 H THR 722 H THR 722 -4.952 -9.963 7.429 494 HA THR 722 HA THR 722 -6.334 -10.859 5.055 495 HB THR 722 HB THR 722 -3.882 -10.743 4.405 496 HG1 THR 722 HG1 THR 722 -5.433 -12.110 3.415 497 HG21 THR 722 HG21 THR 722 -2.881 -11.441 6.509 498 HG22 THR 722 HG22 THR 722 -3.751 -12.974 6.455 499 HG23 THR 722 HG23 THR 722 -2.493 -12.632 5.268 500 H ALA 723 H ALA 723 -6.877 -13.130 5.174 501 HA ALA 723 HA ALA 723 -6.458 -14.665 7.527 502 HB1 ALA 723 HB1 ALA 723 -8.559 -12.661 7.603 503 HB2 ALA 723 HB2 ALA 723 -7.974 -13.704 8.900 504 HB3 ALA 723 HB3 ALA 723 -9.222 -14.283 7.792 505 H GLU 724 H GLU 724 -9.514 -14.177 5.964 506 HA GLU 724 HA GLU 724 -9.820 -16.897 5.181 507 HB2 GLU 724 HB2 GLU 724 -11.392 -14.734 3.878 508 HB3 GLU 724 HB3 GLU 724 -11.952 -16.239 4.599 509 HG2 GLU 724 HG2 GLU 724 -12.692 -14.785 6.230 510 HG3 GLU 724 HG3 GLU 724 -11.050 -15.015 6.827 511 H GLY 725 H GLY 725 -7.367 -15.889 4.167 512 HA2 GLY 725 HA2 GLY 725 -6.109 -15.957 2.225 513 HA3 GLY 725 HA3 GLY 725 -7.504 -16.698 1.443 514 H LEU 726 H LEU 726 -7.844 -13.633 3.037 515 HA LEU 726 HA LEU 726 -8.087 -12.304 0.398 516 HB2 LEU 726 HB2 LEU 726 -9.553 -11.744 2.983 517 HB3 LEU 726 HB3 LEU 726 -9.737 -10.818 1.493 518 HG LEU 726 HG LEU 726 -10.108 -13.778 1.344 519 HD11 LEU 726 HD11 LEU 726 -11.337 -12.802 3.406 520 HD12 LEU 726 HD12 LEU 726 -12.359 -11.977 2.230 521 HD13 LEU 726 HD13 LEU 726 -12.288 -13.739 2.253 522 HD21 LEU 726 HD21 LEU 726 -11.704 -11.508 0.138 523 HD22 LEU 726 HD22 LEU 726 -10.238 -12.138 -0.606 524 HD23 LEU 726 HD23 LEU 726 -11.642 -13.185 -0.398 525 H TYR 727 H TYR 727 -7.906 -9.913 0.529 526 HA TYR 727 HA TYR 727 -5.761 -9.047 2.397 527 HB2 TYR 727 HB2 TYR 727 -6.140 -8.291 -0.518 528 HB3 TYR 727 HB3 TYR 727 -4.942 -7.586 0.565 529 HD1 TYR 727 HD2 TYR 727 -5.982 -10.707 -1.153 530 HD2 TYR 727 HD1 TYR 727 -2.960 -8.767 1.204 531 HE1 TYR 727 HE2 TYR 727 -4.409 -12.570 -1.626 532 HE2 TYR 727 HE1 TYR 727 -1.393 -10.626 0.727 533 HH TYR 727 HH TYR 727 -1.067 -12.351 -0.996 534 H ARG 728 H ARG 728 -6.057 -7.038 3.355 535 HA ARG 728 HA ARG 728 -8.059 -5.209 2.344 536 HB2 ARG 728 HB2 ARG 728 -9.062 -5.367 4.845 537 HB3 ARG 728 HB3 ARG 728 -9.727 -6.240 3.467 538 HG2 ARG 728 HG2 ARG 728 -8.718 -8.268 4.079 539 HG3 ARG 728 HG3 ARG 728 -7.483 -7.469 5.048 540 HD2 ARG 728 HD2 ARG 728 -8.842 -8.251 6.734 541 HD3 ARG 728 HD3 ARG 728 -9.586 -6.685 6.459 542 HE ARG 728 HE ARG 728 -11.409 -7.729 5.416 543 HH11 ARG 728 HH21 ARG 728 -8.908 -10.039 6.134 544 HH12 ARG 728 HH22 ARG 728 -9.967 -11.425 5.996 545 HH21 ARG 728 HH11 ARG 728 -12.740 -9.514 5.271 546 HH22 ARG 728 HH12 ARG 728 -12.120 -11.129 5.527 547 H ILE 729 H ILE 729 -7.433 -3.225 2.747 548 HA ILE 729 HA ILE 729 -5.146 -2.662 4.372 549 HB ILE 729 HB ILE 729 -6.188 -0.203 3.900 550 HG12 ILE 729 HG12 ILE 729 -8.177 -1.441 2.807 551 HG13 ILE 729 HG13 ILE 729 -7.457 -0.097 1.924 552 HG21 ILE 729 HG21 ILE 729 -4.246 -1.934 2.633 553 HG22 ILE 729 HG22 ILE 729 -4.991 -0.855 1.459 554 HG23 ILE 729 HG23 ILE 729 -4.199 -0.192 2.884 555 HD11 ILE 729 HD11 ILE 729 -7.867 -2.654 0.938 556 HD12 ILE 729 HD12 ILE 729 -6.806 -1.436 0.235 557 HD13 ILE 729 HD13 ILE 729 -6.147 -2.645 1.336 558 H THR 730 H THR 730 -8.339 -3.171 5.090 559 HA THR 730 HA THR 730 -7.999 -2.100 7.762 560 HB THR 730 HB THR 730 -8.847 -0.208 6.265 561 HG1 THR 730 HG1 THR 730 -9.949 -1.124 8.670 562 HG21 THR 730 HG21 THR 730 -10.359 -1.509 4.874 563 HG22 THR 730 HG22 THR 730 -11.322 -1.949 6.285 564 HG23 THR 730 HG23 THR 730 -11.267 -0.272 5.747 565 H GLU 731 H GLU 731 -9.125 -3.232 9.209 566 HA GLU 731 HA GLU 731 -10.092 -5.766 8.731 567 HB2 GLU 731 HB2 GLU 731 -11.078 -5.602 10.976 568 HB3 GLU 731 HB3 GLU 731 -9.493 -4.818 10.948 569 HG2 GLU 731 HG2 GLU 731 -11.995 -3.227 10.427 570 HG3 GLU 731 HG3 GLU 731 -11.457 -3.542 12.069 571 H LYS 732 H LYS 732 -11.539 -2.820 7.940 572 HA LYS 732 HA LYS 732 -14.285 -3.655 8.093 573 HB2 LYS 732 HB2 LYS 732 -13.274 -1.277 6.572 574 HB3 LYS 732 HB3 LYS 732 -14.824 -1.491 7.386 575 HG2 LYS 732 HG2 LYS 732 -12.828 -1.895 9.349 576 HG3 LYS 732 HG3 LYS 732 -12.353 -0.460 8.448 577 HD2 LYS 732 HD2 LYS 732 -14.555 0.538 8.823 578 HD3 LYS 732 HD3 LYS 732 -15.093 -0.922 9.657 579 HE2 LYS 732 HE2 LYS 732 -12.603 0.460 10.577 580 HE3 LYS 732 HE3 LYS 732 -14.176 1.106 11.056 581 HZ1 LYS 732 HZ1 LYS 732 -12.799 -0.994 12.212 582 HZ2 LYS 732 HZ2 LYS 732 -14.417 -0.516 12.538 583 HZ3 LYS 732 HZ3 LYS 732 -14.112 -1.731 11.354 584 H LYS 733 H LYS 733 -11.792 -4.164 5.793 585 HA LYS 733 HA LYS 733 -13.818 -4.705 3.682 586 HB2 LYS 733 HB2 LYS 733 -11.860 -2.783 3.551 587 HB3 LYS 733 HB3 LYS 733 -11.115 -4.145 2.716 588 HG2 LYS 733 HG2 LYS 733 -12.357 -2.829 1.089 589 HG3 LYS 733 HG3 LYS 733 -13.199 -4.358 1.321 590 HD2 LYS 733 HD2 LYS 733 -14.792 -2.482 1.307 591 HD3 LYS 733 HD3 LYS 733 -14.763 -3.249 2.893 592 HE2 LYS 733 HE2 LYS 733 -13.991 -1.373 3.888 593 HE3 LYS 733 HE3 LYS 733 -12.758 -1.152 2.647 594 HZ1 LYS 733 HZ1 LYS 733 -14.367 -0.164 1.180 595 HZ2 LYS 733 HZ2 LYS 733 -15.619 -0.431 2.327 596 HZ3 LYS 733 HZ3 LYS 733 -14.361 0.669 2.684 597 H ALA 734 H ALA 734 -12.285 -5.819 1.808 598 HA ALA 734 HA ALA 734 -10.503 -7.832 2.566 599 HB1 ALA 734 HB1 ALA 734 -11.741 -9.535 3.326 600 HB2 ALA 734 HB2 ALA 734 -12.855 -9.409 1.964 601 HB3 ALA 734 HB3 ALA 734 -13.110 -8.428 3.409 602 H PHE 735 H PHE 735 -9.451 -8.303 0.738 603 HA PHE 735 HA PHE 735 -10.987 -8.472 -1.793 604 HB2 PHE 735 HB2 PHE 735 -8.365 -7.077 -1.257 605 HB3 PHE 735 HB3 PHE 735 -8.779 -7.651 -2.872 606 HD1 PHE 735 HD2 PHE 735 -10.117 -5.568 -0.051 607 HD2 PHE 735 HD1 PHE 735 -10.154 -6.362 -4.273 608 HE1 PHE 735 HE2 PHE 735 -11.526 -3.556 -0.417 609 HE2 PHE 735 HE1 PHE 735 -11.555 -4.351 -4.643 610 HZ PHE 735 HZ PHE 735 -12.249 -2.953 -2.711 611 H ARG 736 H ARG 736 -10.086 -9.929 -3.373 612 HA ARG 736 HA ARG 736 -9.055 -12.338 -2.195 613 HB2 ARG 736 HB2 ARG 736 -9.396 -11.641 -5.116 614 HB3 ARG 736 HB3 ARG 736 -9.206 -13.256 -4.441 615 HG2 ARG 736 HG2 ARG 736 -11.449 -13.354 -4.253 616 HG3 ARG 736 HG3 ARG 736 -11.327 -12.125 -2.995 617 HD2 ARG 736 HD2 ARG 736 -12.874 -11.642 -5.028 618 HD3 ARG 736 HD3 ARG 736 -11.791 -10.370 -4.477 619 HE ARG 736 HE ARG 736 -10.596 -10.575 -6.469 620 HH11 ARG 736 HH21 ARG 736 -12.740 -13.251 -6.063 621 HH12 ARG 736 HH22 ARG 736 -12.465 -13.866 -7.652 622 HH21 ARG 736 HH11 ARG 736 -10.223 -11.354 -8.487 623 HH22 ARG 736 HH12 ARG 736 -11.042 -12.802 -9.025 624 H GLY 737 H GLY 737 -7.645 -9.607 -3.797 625 HA2 GLY 737 HA2 GLY 737 -4.982 -10.530 -3.224 626 HA3 GLY 737 HA3 GLY 737 -5.346 -10.574 -4.943 627 H LEU 738 H LEU 738 -3.503 -8.898 -3.270 628 HA LEU 738 HA LEU 738 -4.124 -6.292 -2.871 629 HB2 LEU 738 HB2 LEU 738 -1.735 -7.751 -3.760 630 HB3 LEU 738 HB3 LEU 738 -1.760 -6.075 -4.301 631 HG LEU 738 HG LEU 738 -0.668 -6.250 -2.115 632 HD11 LEU 738 HD11 LEU 738 -2.665 -4.489 -2.830 633 HD12 LEU 738 HD12 LEU 738 -3.186 -5.029 -1.236 634 HD13 LEU 738 HD13 LEU 738 -1.592 -4.301 -1.447 635 HD21 LEU 738 HD21 LEU 738 -2.511 -6.799 -0.225 636 HD22 LEU 738 HD22 LEU 738 -3.130 -7.820 -1.520 637 HD23 LEU 738 HD23 LEU 738 -1.483 -8.046 -0.934 638 H THR 739 H THR 739 -3.219 -7.694 -5.980 639 HA THR 739 HA THR 739 -3.527 -5.441 -7.581 640 HB THR 739 HB THR 739 -4.092 -8.296 -8.406 641 HG1 THR 739 HG1 THR 739 -1.631 -6.915 -8.523 642 HG21 THR 739 HG21 THR 739 -3.254 -7.501 -10.589 643 HG22 THR 739 HG22 THR 739 -4.679 -6.594 -10.086 644 HG23 THR 739 HG23 THR 739 -3.075 -5.876 -9.928 645 H GLU 740 H GLU 740 -6.008 -7.561 -6.250 646 HA GLU 740 HA GLU 740 -8.052 -6.460 -8.014 647 HB2 GLU 740 HB2 GLU 740 -8.701 -7.972 -5.499 648 HB3 GLU 740 HB3 GLU 740 -9.547 -7.974 -7.043 649 HG2 GLU 740 HG2 GLU 740 -6.763 -9.016 -7.071 650 HG3 GLU 740 HG3 GLU 740 -7.950 -9.994 -6.230 651 H LEU 741 H LEU 741 -6.572 -5.803 -5.012 652 HA LEU 741 HA LEU 741 -8.725 -4.144 -3.977 653 HB2 LEU 741 HB2 LEU 741 -7.448 -5.479 -2.416 654 HB3 LEU 741 HB3 LEU 741 -5.934 -4.829 -3.018 655 HG LEU 741 HG LEU 741 -6.993 -3.924 -0.783 656 HD11 LEU 741 HD11 LEU 741 -6.208 -1.516 -2.045 657 HD12 LEU 741 HD12 LEU 741 -5.201 -2.613 -1.098 658 HD13 LEU 741 HD13 LEU 741 -5.307 -2.806 -2.844 659 HD21 LEU 741 HD21 LEU 741 -8.182 -1.816 -2.528 660 HD22 LEU 741 HD22 LEU 741 -9.109 -3.304 -2.349 661 HD23 LEU 741 HD23 LEU 741 -8.675 -2.362 -0.929 662 H VAL 742 H VAL 742 -5.384 -3.758 -5.008 663 HA VAL 742 HA VAL 742 -5.219 -0.949 -4.874 664 HB VAL 742 HB VAL 742 -3.775 -2.956 -6.615 665 HG11 VAL 742 HG11 VAL 742 -2.430 -0.453 -5.830 666 HG12 VAL 742 HG12 VAL 742 -2.418 -1.316 -7.370 667 HG13 VAL 742 HG13 VAL 742 -3.760 -0.250 -6.970 668 HG21 VAL 742 HG21 VAL 742 -3.604 -3.372 -4.197 669 HG22 VAL 742 HG22 VAL 742 -2.059 -2.838 -4.862 670 HG23 VAL 742 HG23 VAL 742 -3.060 -1.710 -3.947 671 H GLU 743 H GLU 743 -5.638 -3.042 -7.681 672 HA GLU 743 HA GLU 743 -5.969 -0.955 -9.542 673 HB2 GLU 743 HB2 GLU 743 -6.898 -3.813 -9.775 674 HB3 GLU 743 HB3 GLU 743 -6.484 -2.715 -11.098 675 HG2 GLU 743 HG2 GLU 743 -4.441 -3.273 -8.958 676 HG3 GLU 743 HG3 GLU 743 -4.700 -4.468 -10.206 677 H PHE 744 H PHE 744 -8.178 -2.518 -7.388 678 HA PHE 744 HA PHE 744 -10.574 -1.763 -8.816 679 HB2 PHE 744 HB2 PHE 744 -10.722 -3.687 -7.421 680 HB3 PHE 744 HB3 PHE 744 -10.023 -2.834 -6.048 681 HD1 PHE 744 HD1 PHE 744 -12.954 -2.672 -8.386 682 HD2 PHE 744 HD2 PHE 744 -11.425 -1.860 -4.456 683 HE1 PHE 744 HE1 PHE 744 -15.215 -1.967 -7.652 684 HE2 PHE 744 HE2 PHE 744 -13.688 -1.157 -3.722 685 HZ PHE 744 HZ PHE 744 -15.582 -1.207 -5.321 686 H TYR 745 H TYR 745 -8.664 -0.524 -6.121 687 HA TYR 745 HA TYR 745 -10.520 1.581 -5.494 688 HB2 TYR 745 HB2 TYR 745 -7.775 0.817 -4.607 689 HB3 TYR 745 HB3 TYR 745 -8.346 2.449 -4.272 690 HD1 TYR 745 HD2 TYR 745 -11.324 0.666 -4.328 691 HD2 TYR 745 HD1 TYR 745 -7.759 1.015 -1.947 692 HE1 TYR 745 HE2 TYR 745 -12.560 -0.149 -2.365 693 HE2 TYR 745 HE1 TYR 745 -9.016 0.180 0.016 694 HH TYR 745 HH TYR 745 -12.494 -0.149 -0.016 695 H GLN 746 H GLN 746 -8.288 1.182 -7.994 696 HA GLN 746 HA GLN 746 -7.305 3.765 -8.415 697 HB2 GLN 746 HB2 GLN 746 -8.189 1.598 -10.321 698 HB3 GLN 746 HB3 GLN 746 -7.552 3.137 -10.901 699 HG2 GLN 746 HG2 GLN 746 -5.454 2.774 -9.756 700 HG3 GLN 746 HG3 GLN 746 -6.089 1.340 -8.949 701 HE21 GLN 746 HE21 GLN 746 -7.294 -0.089 -10.993 702 HE22 GLN 746 HE22 GLN 746 -6.143 -0.468 -12.187 703 H GLN 747 H GLN 747 -10.457 2.362 -8.964 704 HA GLN 747 HA GLN 747 -11.513 4.894 -10.046 705 HB2 GLN 747 HB2 GLN 747 -12.918 2.218 -9.884 706 HB3 GLN 747 HB3 GLN 747 -13.371 3.613 -10.861 707 HG2 GLN 747 HG2 GLN 747 -12.046 2.910 -12.543 708 HG3 GLN 747 HG3 GLN 747 -10.650 2.886 -11.468 709 HE21 GLN 747 HE21 GLN 747 -9.981 0.833 -10.601 710 HE22 GLN 747 HE22 GLN 747 -10.707 -0.629 -11.059 711 H ASN 748 H ASN 748 -11.380 3.046 -7.188 712 HA ASN 748 HA ASN 748 -13.661 4.557 -6.047 713 HB2 ASN 748 HB2 ASN 748 -14.168 2.170 -6.115 714 HB3 ASN 748 HB3 ASN 748 -12.648 1.797 -5.312 715 HD21 ASN 748 HD21 ASN 748 -14.393 0.763 -3.771 716 HD22 ASN 748 HD22 ASN 748 -14.943 1.759 -2.507 717 H SER 749 H SER 749 -13.012 6.085 -4.716 718 HA SER 749 HA SER 749 -10.537 6.746 -3.882 719 HB2 SER 749 HB2 SER 749 -12.965 7.762 -3.478 720 HB3 SER 749 HB3 SER 749 -12.696 7.079 -1.884 721 HG SER 749 HG SER 749 -10.445 8.264 -2.581 722 H LEU 750 H LEU 750 -9.116 6.254 -2.259 723 HA LEU 750 HA LEU 750 -9.150 3.637 -1.181 724 HB2 LEU 750 HB2 LEU 750 -7.529 6.080 -0.488 725 HB3 LEU 750 HB3 LEU 750 -7.272 4.515 0.280 726 HG LEU 750 HG LEU 750 -7.449 4.191 -2.588 727 HD11 LEU 750 HD11 LEU 750 -6.677 6.559 -2.524 728 HD12 LEU 750 HD12 LEU 750 -5.280 6.042 -1.583 729 HD13 LEU 750 HD13 LEU 750 -5.490 5.467 -3.236 730 HD21 LEU 750 HD21 LEU 750 -5.064 3.866 -0.746 731 HD22 LEU 750 HD22 LEU 750 -6.379 2.693 -0.830 732 HD23 LEU 750 HD23 LEU 750 -5.383 3.005 -2.252 733 H LYS 751 H LYS 751 -10.316 6.700 0.064 734 HA LYS 751 HA LYS 751 -10.494 6.173 2.763 735 HB2 LYS 751 HB2 LYS 751 -12.445 7.659 2.825 736 HB3 LYS 751 HB3 LYS 751 -11.140 8.321 1.860 737 HG2 LYS 751 HG2 LYS 751 -12.482 7.062 -0.088 738 HG3 LYS 751 HG3 LYS 751 -13.830 7.383 1.011 739 HD2 LYS 751 HD2 LYS 751 -13.205 9.747 1.131 740 HD3 LYS 751 HD3 LYS 751 -11.808 9.441 0.112 741 HE2 LYS 751 HE2 LYS 751 -13.975 8.464 -1.358 742 HE3 LYS 751 HE3 LYS 751 -14.533 9.990 -0.662 743 HZ1 LYS 751 HZ1 LYS 751 -12.099 9.501 -2.304 744 HZ2 LYS 751 HZ2 LYS 751 -13.401 10.576 -2.628 745 HZ3 LYS 751 HZ3 LYS 751 -12.304 10.937 -1.353 746 H ASP 752 H ASP 752 -11.988 4.595 0.157 747 HA ASP 752 HA ASP 752 -14.339 3.525 1.238 748 HB2 ASP 752 HB2 ASP 752 -13.587 3.206 -1.107 749 HB3 ASP 752 HB3 ASP 752 -12.276 2.178 -0.545 750 H CYS 753 H CYS 753 -10.965 2.646 1.597 751 HA CYS 753 HA CYS 753 -11.612 0.734 3.780 752 HB2 CYS 753 HB2 CYS 753 -9.507 0.797 1.676 753 HB3 CYS 753 HB3 CYS 753 -9.046 0.207 3.263 754 HG CYS 753 HG CYS 753 -11.007 -1.198 1.334 755 H PHE 754 H PHE 754 -9.228 3.091 2.603 756 HA PHE 754 HA PHE 754 -7.813 3.357 5.008 757 HB2 PHE 754 HB2 PHE 754 -8.186 5.118 2.613 758 HB3 PHE 754 HB3 PHE 754 -7.264 5.674 4.009 759 HD1 PHE 754 HD2 PHE 754 -7.572 2.630 1.834 760 HD2 PHE 754 HD1 PHE 754 -4.968 5.241 4.034 761 HE1 PHE 754 HE2 PHE 754 -5.611 1.337 1.049 762 HE2 PHE 754 HE1 PHE 754 -3.006 3.954 3.241 763 HZ PHE 754 HZ PHE 754 -3.329 2.000 1.750 764 H LYS 755 H LYS 755 -7.851 5.118 6.547 765 HA LYS 755 HA LYS 755 -10.573 5.823 7.259 766 HB2 LYS 755 HB2 LYS 755 -8.327 6.903 8.855 767 HB3 LYS 755 HB3 LYS 755 -9.798 6.081 9.374 768 HG2 LYS 755 HG2 LYS 755 -7.310 4.798 8.207 769 HG3 LYS 755 HG3 LYS 755 -7.919 4.634 9.848 770 HD2 LYS 755 HD2 LYS 755 -10.088 3.737 8.630 771 HD3 LYS 755 HD3 LYS 755 -8.958 3.404 7.320 772 HE2 LYS 755 HE2 LYS 755 -7.845 1.767 8.494 773 HE3 LYS 755 HE3 LYS 755 -8.122 2.556 10.050 774 HZ1 LYS 755 HZ1 LYS 755 -10.623 1.974 9.315 775 HZ2 LYS 755 HZ2 LYS 755 -9.799 0.635 8.624 776 HZ3 LYS 755 HZ3 LYS 755 -9.680 0.965 10.310 777 H SER 756 H SER 756 -7.588 7.799 7.066 778 HA SER 756 HA SER 756 -9.221 10.170 6.557 779 HB2 SER 756 HB2 SER 756 -7.494 11.329 7.425 780 HB3 SER 756 HB3 SER 756 -6.830 9.767 7.895 781 HG SER 756 HG SER 756 -5.328 10.947 6.656 782 H LEU 757 H LEU 757 -6.832 8.168 4.957 783 HA LEU 757 HA LEU 757 -6.122 9.427 2.680 784 HB2 LEU 757 HB2 LEU 757 -5.941 6.909 3.491 785 HB3 LEU 757 HB3 LEU 757 -7.268 6.701 2.358 786 HG LEU 757 HG LEU 757 -5.344 6.286 1.081 787 HD11 LEU 757 HD11 LEU 757 -5.208 8.154 -0.483 788 HD12 LEU 757 HD12 LEU 757 -6.881 7.836 -0.025 789 HD13 LEU 757 HD13 LEU 757 -6.014 9.196 0.683 790 HD21 LEU 757 HD21 LEU 757 -4.153 8.801 2.240 791 HD22 LEU 757 HD22 LEU 757 -3.760 7.161 2.777 792 HD23 LEU 757 HD23 LEU 757 -3.360 7.683 1.138 793 H ASP 758 H ASP 758 -7.478 10.854 1.635 794 HA ASP 758 HA ASP 758 -10.026 9.727 0.659 795 HB2 ASP 758 HB2 ASP 758 -10.074 11.741 2.274 796 HB3 ASP 758 HB3 ASP 758 -9.500 12.685 0.903 797 H THR 759 H THR 759 -8.565 8.842 -1.032 798 HA THR 759 HA THR 759 -8.835 10.433 -3.401 799 HB THR 759 HB THR 759 -6.698 11.373 -2.485 800 HG1 THR 759 HG1 THR 759 -5.949 11.484 -4.474 801 HG21 THR 759 HG21 THR 759 -5.185 9.955 -1.625 802 HG22 THR 759 HG22 THR 759 -6.112 8.567 -2.192 803 HG23 THR 759 HG23 THR 759 -4.918 9.317 -3.247 804 H THR 760 H THR 760 -7.024 9.081 -5.051 805 HA THR 760 HA THR 760 -7.830 6.240 -4.746 806 HB THR 760 HB THR 760 -8.158 6.169 -7.234 807 HG1 THR 760 HG1 THR 760 -8.673 8.489 -7.943 808 HG21 THR 760 HG21 THR 760 -9.894 8.011 -5.581 809 HG22 THR 760 HG22 THR 760 -10.343 7.435 -7.188 810 HG23 THR 760 HG23 THR 760 -10.122 6.284 -5.871 811 H LEU 761 H LEU 761 -6.615 4.860 -6.406 812 HA LEU 761 HA LEU 761 -3.808 5.148 -5.948 813 HB2 LEU 761 HB2 LEU 761 -5.441 3.308 -7.720 814 HB3 LEU 761 HB3 LEU 761 -3.688 3.209 -7.608 815 HG LEU 761 HG LEU 761 -4.702 1.597 -6.069 816 HD11 LEU 761 HD11 LEU 761 -3.917 3.499 -4.006 817 HD12 LEU 761 HD12 LEU 761 -3.101 2.029 -4.542 818 HD13 LEU 761 HD13 LEU 761 -2.822 3.551 -5.384 819 HD21 LEU 761 HD21 LEU 761 -6.249 2.187 -4.384 820 HD22 LEU 761 HD22 LEU 761 -5.942 3.909 -4.581 821 HD23 LEU 761 HD23 LEU 761 -6.828 3.024 -5.822 822 H GLN 762 H GLN 762 -3.663 7.338 -6.773 823 HA GLN 762 HA GLN 762 -4.184 8.127 -9.396 824 HB2 GLN 762 HB2 GLN 762 -2.044 9.093 -7.497 825 HB3 GLN 762 HB3 GLN 762 -2.575 9.946 -8.946 826 HG2 GLN 762 HG2 GLN 762 -4.798 9.113 -7.213 827 HG3 GLN 762 HG3 GLN 762 -3.693 10.235 -6.431 828 HE21 GLN 762 HE21 GLN 762 -6.352 10.033 -8.545 829 HE22 GLN 762 HE22 GLN 762 -6.277 11.614 -9.163 830 H PHE 763 H PHE 763 -0.944 7.378 -8.106 831 HA PHE 763 HA PHE 763 -0.306 5.912 -10.534 832 HB2 PHE 763 HB2 PHE 763 1.903 7.618 -10.358 833 HB3 PHE 763 HB3 PHE 763 0.674 7.609 -11.617 834 HD1 PHE 763 HD1 PHE 763 1.678 9.145 -8.392 835 HD2 PHE 763 HD2 PHE 763 -1.013 9.314 -11.733 836 HE1 PHE 763 HE1 PHE 763 0.919 11.391 -7.666 837 HE2 PHE 763 HE2 PHE 763 -1.770 11.560 -11.008 838 HZ PHE 763 HZ PHE 763 -0.806 12.598 -8.973 839 HA PRO 764 HA PRO 764 2.182 3.650 -7.710 840 HB2 PRO 764 HB2 PRO 764 3.892 2.473 -9.520 841 HB3 PRO 764 HB3 PRO 764 2.226 1.938 -9.244 842 HG2 PRO 764 HG2 PRO 764 3.340 3.586 -11.439 843 HG3 PRO 764 HG3 PRO 764 2.049 2.375 -11.473 844 HD2 PRO 764 HD2 PRO 764 1.589 5.083 -11.493 845 HD3 PRO 764 HD3 PRO 764 0.429 3.893 -10.866 846 H PHE 765 H PHE 765 4.134 3.842 -6.613 847 HA PHE 765 HA PHE 765 5.600 6.228 -6.878 848 HB2 PHE 765 HB2 PHE 765 6.858 5.486 -5.082 849 HB3 PHE 765 HB3 PHE 765 5.393 4.524 -4.903 850 HD1 PHE 765 HD1 PHE 765 5.373 2.211 -6.166 851 HD2 PHE 765 HD2 PHE 765 8.929 4.408 -5.186 852 HE1 PHE 765 HE1 PHE 765 6.705 0.150 -6.397 853 HE2 PHE 765 HE2 PHE 765 10.269 2.334 -5.412 854 HZ PHE 765 HZ PHE 765 9.157 0.204 -6.018 855 H LYS 766 H LYS 766 5.987 3.156 -8.444 856 HA LYS 766 HA LYS 766 8.710 3.440 -9.220 857 HB2 LYS 766 HB2 LYS 766 6.405 1.758 -10.132 858 HB3 LYS 766 HB3 LYS 766 7.885 1.797 -11.087 859 HG2 LYS 766 HG2 LYS 766 8.624 1.503 -8.338 860 HG3 LYS 766 HG3 LYS 766 7.370 0.317 -8.692 861 HD2 LYS 766 HD2 LYS 766 9.453 -0.737 -9.242 862 HD3 LYS 766 HD3 LYS 766 8.699 -0.303 -10.774 863 HE2 LYS 766 HE2 LYS 766 10.287 1.907 -9.790 864 HE3 LYS 766 HE3 LYS 766 11.270 0.445 -9.866 865 HZ1 LYS 766 HZ1 LYS 766 10.322 2.058 -11.989 866 HZ2 LYS 766 HZ2 LYS 766 11.396 0.741 -12.049 867 HZ3 LYS 766 HZ3 LYS 766 9.725 0.477 -12.166 868 H GLU 767 H GLU 767 5.705 4.709 -10.405 869 HA GLU 767 HA GLU 767 6.620 5.399 -13.011 870 HB2 GLU 767 HB2 GLU 767 4.166 5.422 -11.637 871 HB3 GLU 767 HB3 GLU 767 4.499 7.111 -12.014 872 HG2 GLU 767 HG2 GLU 767 5.117 6.194 -14.377 873 HG3 GLU 767 HG3 GLU 767 4.181 4.788 -13.898 874 H1 ASP 338 H1 ASP 338 9.346 -6.262 11.090 875 H2 ASP 338 H2 ASP 338 9.828 -7.536 10.073 876 H3 ASP 338 H3 ASP 338 8.735 -6.356 9.500 877 HA ASP 338 HA ASP 338 11.639 -6.281 9.723 878 HB2 ASP 338 HB2 ASP 338 9.935 -6.138 7.685 879 HB3 ASP 338 HB3 ASP 338 9.939 -4.427 8.098 880 H THR 339 H THR 339 11.924 -3.528 9.071 881 HA THR 339 HA THR 339 11.973 -2.379 11.713 882 HB THR 339 HB THR 339 13.704 -1.752 10.125 883 HG1 THR 339 HG1 THR 339 13.518 0.475 10.357 884 HG21 THR 339 HG21 THR 339 11.734 -0.221 8.463 885 HG22 THR 339 HG22 THR 339 13.315 -0.862 8.016 886 HG23 THR 339 HG23 THR 339 11.933 -1.946 8.162 887 H GLU 340 H GLU 340 11.281 0.359 10.621 888 HA GLU 340 HA GLU 340 8.627 0.469 11.603 889 HB2 GLU 340 HB2 GLU 340 10.412 2.394 11.185 890 HB3 GLU 340 HB3 GLU 340 9.543 2.554 9.659 891 HG2 GLU 340 HG2 GLU 340 8.502 2.924 12.467 892 HG3 GLU 340 HG3 GLU 340 8.360 4.007 11.088 893 H VAL 341 H VAL 341 7.364 -1.027 10.598 894 HA VAL 341 HA VAL 341 7.025 -0.860 7.694 895 HB VAL 341 HB VAL 341 5.629 -2.968 8.115 896 HG11 VAL 341 HG11 VAL 341 8.441 -2.523 7.976 897 HG12 VAL 341 HG12 VAL 341 8.167 -3.841 9.114 898 HG13 VAL 341 HG13 VAL 341 7.540 -3.952 7.473 899 HG21 VAL 341 HG21 VAL 341 6.010 -4.098 10.253 900 HG22 VAL 341 HG22 VAL 341 7.002 -2.755 10.814 901 HG23 VAL 341 HG23 VAL 341 5.275 -2.523 10.549 902 H TYR 342 H TYR 342 5.707 0.825 7.257 903 HA TYR 342 HA TYR 342 3.848 2.197 7.285 904 HB2 TYR 342 HB2 TYR 342 1.895 0.081 7.583 905 HB3 TYR 342 HB3 TYR 342 2.271 1.044 6.173 906 HD1 TYR 342 HD1 TYR 342 3.959 0.286 4.524 907 HD2 TYR 342 HD2 TYR 342 2.914 -2.100 7.943 908 HE1 TYR 342 HE1 TYR 342 5.049 -1.679 3.499 909 HE2 TYR 342 HE2 TYR 342 3.999 -4.065 6.901 910 HH TYR 342 HH TYR 342 4.608 -4.857 4.622 911 H GLU 343 H GLU 343 4.935 2.023 9.866 912 HA GLU 343 HA GLU 343 4.258 1.714 12.161 913 HB2 GLU 343 HB2 GLU 343 3.018 3.974 12.589 914 HB3 GLU 343 HB3 GLU 343 4.674 3.988 11.982 915 HG2 GLU 343 HG2 GLU 343 3.787 4.191 9.657 916 HG3 GLU 343 HG3 GLU 343 2.157 4.286 10.312 917 H SER 344 H SER 344 1.419 3.557 11.702 918 HA SER 344 HA SER 344 -0.530 1.553 11.352 919 HB2 SER 344 HB2 SER 344 -1.174 0.925 13.506 920 HB3 SER 344 HB3 SER 344 0.582 0.936 13.640 921 HG SER 344 HG SER 344 -1.002 3.232 14.184 922 HA PRO 345 HA PRO 345 -1.689 6.151 11.169 923 HB2 PRO 345 HB2 PRO 345 -3.369 4.820 9.050 924 HB3 PRO 345 HB3 PRO 345 -2.580 6.407 9.009 925 HG2 PRO 345 HG2 PRO 345 -1.546 4.330 7.733 926 HG3 PRO 345 HG3 PRO 345 -0.513 5.515 8.550 927 HD2 PRO 345 HD2 PRO 345 -1.142 2.709 9.345 928 HD3 PRO 345 HD3 PRO 345 0.305 3.683 9.684 929 H PTR 346 H PTR 346 -3.886 3.339 10.764 930 HA PTR 346 HA PTR 346 -5.202 3.648 13.227 931 HB2 PTR 346 HB2 PTR 346 -6.679 5.287 12.892 932 HB3 PTR 346 HB3 PTR 346 -7.445 4.296 11.660 933 HD1 PTR 346 HD1 PTR 346 -5.568 4.254 9.454 934 HD2 PTR 346 HD2 PTR 346 -6.532 7.469 12.125 935 HE1 PTR 346 HE1 PTR 346 -4.865 5.887 7.720 936 HE2 PTR 346 HE2 PTR 346 -5.833 9.106 10.407 937 H ALA 347 H ALA 347 -7.292 2.409 13.324 938 HA ALA 347 HA ALA 347 -7.462 0.194 11.347 939 HB1 ALA 347 HB1 ALA 347 -6.536 0.027 14.077 940 HB2 ALA 347 HB2 ALA 347 -6.664 -1.251 12.867 941 HB3 ALA 347 HB3 ALA 347 -8.042 -0.871 13.901 942 H ASP 348 H ASP 348 -8.989 1.162 14.413 943 HA ASP 348 HA ASP 348 -11.134 1.737 14.951 944 HB2 ASP 348 HB2 ASP 348 -12.102 1.731 12.141 945 HB3 ASP 348 HB3 ASP 348 -12.412 2.879 13.434 946 HA PRO 349 HA PRO 349 -12.868 -2.383 14.769 947 HB2 PRO 349 HB2 PRO 349 -14.553 -2.134 16.868 948 HB3 PRO 349 HB3 PRO 349 -12.794 -2.225 17.086 949 HG2 PRO 349 HG2 PRO 349 -14.590 0.149 17.156 950 HG3 PRO 349 HG3 PRO 349 -13.188 -0.237 18.169 951 HD2 PRO 349 HD2 PRO 349 -13.126 1.502 15.999 952 HD3 PRO 349 HD3 PRO 349 -11.703 0.677 16.675 953 H GLU 350 H GLU 350 -15.414 -3.075 15.287 954 HA GLU 350 HA GLU 350 -17.049 -1.516 13.372 955 HB2 GLU 350 HB2 GLU 350 -16.580 -4.435 13.712 956 HB3 GLU 350 HB3 GLU 350 -18.229 -3.939 13.333 957 HG2 GLU 350 HG2 GLU 350 -17.305 -4.187 11.197 958 HG3 GLU 350 HG3 GLU 350 -17.079 -2.466 11.486 Start of MODEL 13 1 H1 GLY 661 H1 GLY 661 4.948 -12.416 -10.867 2 H2 GLY 661 H2 GLY 661 4.618 -13.914 -10.117 3 H3 GLY 661 H3 GLY 661 4.076 -13.609 -11.706 4 HA2 GLY 661 HA2 GLY 661 6.246 -13.689 -12.595 5 HA3 GLY 661 HA3 GLY 661 6.955 -13.635 -10.979 6 H HIS 662 H HIS 662 6.978 -15.519 -9.687 7 HA HIS 662 HA HIS 662 6.765 -18.007 -11.177 8 HB2 HIS 662 HB2 HIS 662 7.927 -18.998 -9.426 9 HB3 HIS 662 HB3 HIS 662 8.514 -17.339 -9.337 10 HD1 HIS 662 HD1 HIS 662 6.961 -15.751 -7.644 11 HD2 HIS 662 HD2 HIS 662 6.947 -19.889 -7.014 12 HE1 HIS 662 HE1 HIS 662 6.132 -16.132 -5.264 13 HE2 HIS 662 HE2 HIS 662 6.119 -18.643 -4.872 14 H MET 663 H MET 663 4.790 -16.127 -9.093 15 HA MET 663 HA MET 663 2.535 -17.860 -9.429 16 HB2 MET 663 HB2 MET 663 3.748 -19.123 -7.670 17 HB3 MET 663 HB3 MET 663 3.713 -17.695 -6.642 18 HG2 MET 663 HG2 MET 663 1.051 -18.020 -7.460 19 HG3 MET 663 HG3 MET 663 1.621 -19.655 -7.132 20 HE1 MET 663 HE1 MET 663 0.851 -19.960 -3.636 21 HE2 MET 663 HE2 MET 663 0.326 -20.286 -5.289 22 HE3 MET 663 HE3 MET 663 1.986 -20.653 -4.795 23 H GLN 664 H GLN 664 2.704 -16.278 -6.395 24 HA GLN 664 HA GLN 664 0.920 -14.171 -7.394 25 HB2 GLN 664 HB2 GLN 664 0.484 -15.722 -5.311 26 HB3 GLN 664 HB3 GLN 664 1.527 -14.564 -4.481 27 HG2 GLN 664 HG2 GLN 664 0.024 -12.748 -5.561 28 HG3 GLN 664 HG3 GLN 664 -1.109 -14.060 -5.861 29 HE21 GLN 664 HE21 GLN 664 -2.646 -14.210 -4.238 30 HE22 GLN 664 HE22 GLN 664 -2.378 -13.835 -2.598 31 H ASP 665 H ASP 665 3.763 -14.031 -7.965 32 HA ASP 665 HA ASP 665 5.078 -12.245 -6.180 33 HB2 ASP 665 HB2 ASP 665 5.791 -12.004 -9.027 34 HB3 ASP 665 HB3 ASP 665 6.806 -12.347 -7.636 35 H LEU 666 H LEU 666 3.454 -10.725 -5.691 36 HA LEU 666 HA LEU 666 2.037 -9.127 -7.480 37 HB2 LEU 666 HB2 LEU 666 3.107 -8.300 -4.772 38 HB3 LEU 666 HB3 LEU 666 1.752 -7.565 -5.622 39 HG LEU 666 HG LEU 666 1.766 -10.509 -4.942 40 HD11 LEU 666 HD11 LEU 666 1.138 -8.152 -3.207 41 HD12 LEU 666 HD12 LEU 666 0.190 -9.627 -3.034 42 HD13 LEU 666 HD13 LEU 666 1.935 -9.668 -2.784 43 HD21 LEU 666 HD21 LEU 666 -0.612 -10.321 -5.247 44 HD22 LEU 666 HD22 LEU 666 -0.523 -8.560 -5.299 45 HD23 LEU 666 HD23 LEU 666 0.141 -9.517 -6.622 46 H SER 667 H SER 667 5.385 -9.125 -6.753 47 HA SER 667 HA SER 667 6.202 -6.516 -7.146 48 HB2 SER 667 HB2 SER 667 8.267 -7.653 -8.225 49 HB3 SER 667 HB3 SER 667 7.880 -8.018 -6.547 50 HG SER 667 HG SER 667 7.986 -9.675 -8.655 51 H VAL 668 H VAL 668 4.653 -8.573 -9.386 52 HA VAL 668 HA VAL 668 5.686 -7.433 -11.795 53 HB VAL 668 HB VAL 668 3.812 -8.542 -12.897 54 HG11 VAL 668 HG11 VAL 668 5.379 -9.963 -10.783 55 HG12 VAL 668 HG12 VAL 668 4.088 -10.854 -11.588 56 HG13 VAL 668 HG13 VAL 668 5.410 -10.172 -12.534 57 HG21 VAL 668 HG21 VAL 668 2.707 -8.464 -10.130 58 HG22 VAL 668 HG22 VAL 668 1.873 -8.321 -11.677 59 HG23 VAL 668 HG23 VAL 668 2.356 -9.909 -11.078 60 H HIS 669 H HIS 669 3.385 -6.376 -9.439 61 HA HIS 669 HA HIS 669 1.981 -4.576 -11.230 62 HB2 HIS 669 HB2 HIS 669 1.933 -4.601 -8.208 63 HB3 HIS 669 HB3 HIS 669 0.738 -3.898 -9.298 64 HD1 HIS 669 HD1 HIS 669 -0.026 -5.899 -11.228 65 HD2 HIS 669 HD2 HIS 669 0.999 -7.068 -7.363 66 HE1 HIS 669 HE1 HIS 669 -1.013 -8.208 -10.899 67 HE2 HIS 669 HE2 HIS 669 -0.404 -8.936 -8.544 68 H LEU 670 H LEU 670 2.610 -2.650 -11.813 69 HA LEU 670 HA LEU 670 5.023 -1.475 -11.324 70 HB2 LEU 670 HB2 LEU 670 3.372 -0.833 -13.093 71 HB3 LEU 670 HB3 LEU 670 2.466 0.046 -11.864 72 HG LEU 670 HG LEU 670 4.417 1.476 -11.422 73 HD11 LEU 670 HD11 LEU 670 6.351 1.280 -13.092 74 HD12 LEU 670 HD12 LEU 670 6.273 0.031 -11.848 75 HD13 LEU 670 HD13 LEU 670 5.714 -0.317 -13.484 76 HD21 LEU 670 HD21 LEU 670 2.759 1.690 -13.525 77 HD22 LEU 670 HD22 LEU 670 4.077 2.832 -13.252 78 HD23 LEU 670 HD23 LEU 670 4.280 1.510 -14.402 79 H TRP 671 H TRP 671 2.193 -1.334 -9.240 80 HA TRP 671 HA TRP 671 3.436 0.777 -7.653 81 HB2 TRP 671 HB2 TRP 671 1.311 0.273 -6.177 82 HB3 TRP 671 HB3 TRP 671 1.202 1.245 -7.638 83 HD1 TRP 671 HD1 TRP 671 -0.335 0.402 -9.518 84 HE1 TRP 671 HE1 TRP 671 -1.828 -1.697 -9.857 85 HE3 TRP 671 HE3 TRP 671 1.275 -2.440 -5.588 86 HZ2 TRP 671 HZ2 TRP 671 -2.229 -4.222 -8.620 87 HZ3 TRP 671 HZ3 TRP 671 0.312 -4.691 -5.194 88 HH2 TRP 671 HH2 TRP 671 -1.436 -5.586 -6.706 89 H TYR 672 H TYR 672 3.943 -2.434 -7.887 90 HA TYR 672 HA TYR 672 4.144 -2.917 -4.992 91 HB2 TYR 672 HB2 TYR 672 3.419 -4.616 -6.923 92 HB3 TYR 672 HB3 TYR 672 5.157 -4.903 -6.960 93 HD1 TYR 672 HD2 TYR 672 2.225 -4.728 -4.671 94 HD2 TYR 672 HD1 TYR 672 6.203 -6.220 -5.270 95 HE1 TYR 672 HE2 TYR 672 2.026 -6.091 -2.609 96 HE2 TYR 672 HE1 TYR 672 5.999 -7.586 -3.212 97 HH TYR 672 HH TYR 672 4.347 -8.523 -1.776 98 H ALA 673 H ALA 673 5.886 -2.206 -3.974 99 HA ALA 673 HA ALA 673 8.394 -1.806 -5.430 100 HB1 ALA 673 HB1 ALA 673 7.921 -1.295 -2.498 101 HB2 ALA 673 HB2 ALA 673 7.373 -0.164 -3.733 102 HB3 ALA 673 HB3 ALA 673 9.091 -0.527 -3.572 103 H GLY 674 H GLY 674 6.886 -4.201 -3.589 104 HA2 GLY 674 HA2 GLY 674 7.581 -6.194 -2.675 105 HA3 GLY 674 HA3 GLY 674 8.922 -6.092 -3.803 106 HA PRO 675 HA PRO 675 11.400 -5.910 -0.122 107 HB2 PRO 675 HB2 PRO 675 13.810 -5.415 -1.309 108 HB3 PRO 675 HB3 PRO 675 13.020 -7.004 -1.339 109 HG2 PRO 675 HG2 PRO 675 13.107 -4.895 -3.442 110 HG3 PRO 675 HG3 PRO 675 13.251 -6.655 -3.600 111 HD2 PRO 675 HD2 PRO 675 10.938 -5.304 -4.146 112 HD3 PRO 675 HD3 PRO 675 10.961 -6.983 -3.564 113 H MET 676 H MET 676 9.919 -3.608 -0.355 114 HA MET 676 HA MET 676 11.937 -1.455 -0.022 115 HB2 MET 676 HB2 MET 676 10.433 -1.098 -1.953 116 HB3 MET 676 HB3 MET 676 9.051 -1.154 -0.864 117 HG2 MET 676 HG2 MET 676 9.909 1.181 -1.454 118 HG3 MET 676 HG3 MET 676 9.726 0.840 0.266 119 HE1 MET 676 HE1 MET 676 13.167 0.405 -2.415 120 HE2 MET 676 HE2 MET 676 11.584 1.125 -2.720 121 HE3 MET 676 HE3 MET 676 12.943 2.145 -2.238 122 H GLU 677 H GLU 677 11.469 0.188 1.541 123 HA GLU 677 HA GLU 677 9.899 -0.802 3.844 124 HB2 GLU 677 HB2 GLU 677 11.498 0.754 5.144 125 HB3 GLU 677 HB3 GLU 677 12.140 -0.771 4.543 126 HG2 GLU 677 HG2 GLU 677 13.103 0.358 2.599 127 HG3 GLU 677 HG3 GLU 677 12.392 1.885 3.102 128 H ARG 678 H ARG 678 9.259 1.044 5.358 129 HA ARG 678 HA ARG 678 7.419 2.755 4.137 130 HB2 ARG 678 HB2 ARG 678 7.662 2.019 6.624 131 HB3 ARG 678 HB3 ARG 678 8.736 3.402 6.773 132 HG2 ARG 678 HG2 ARG 678 6.676 4.573 5.487 133 HG3 ARG 678 HG3 ARG 678 5.798 3.317 6.357 134 HD2 ARG 678 HD2 ARG 678 5.809 4.907 8.010 135 HD3 ARG 678 HD3 ARG 678 7.371 4.177 8.347 136 HE ARG 678 HE ARG 678 7.017 6.631 6.695 137 HH11 ARG 678 HH21 ARG 678 8.790 4.717 9.054 138 HH12 ARG 678 HH22 ARG 678 10.070 5.887 9.154 139 HH21 ARG 678 HH11 ARG 678 8.714 8.073 6.863 140 HH22 ARG 678 HH12 ARG 678 10.027 7.741 7.963 141 H ALA 679 H ALA 679 10.308 3.796 5.886 142 HA ALA 679 HA ALA 679 10.553 6.386 5.076 143 HB1 ALA 679 HB1 ALA 679 13.123 4.989 5.027 144 HB2 ALA 679 HB2 ALA 679 12.134 4.527 6.412 145 HB3 ALA 679 HB3 ALA 679 12.540 6.226 6.145 146 H GLY 680 H GLY 680 11.712 3.496 3.431 147 HA2 GLY 680 HA2 GLY 680 12.937 4.735 1.218 148 HA3 GLY 680 HA3 GLY 680 12.338 3.077 1.261 149 H ALA 681 H ALA 681 9.719 3.293 1.645 150 HA ALA 681 HA ALA 681 8.662 3.913 -0.864 151 HB1 ALA 681 HB1 ALA 681 6.433 3.967 0.477 152 HB2 ALA 681 HB2 ALA 681 7.438 3.503 1.849 153 HB3 ALA 681 HB3 ALA 681 7.352 2.464 0.428 154 H GLU 682 H GLU 682 8.783 5.844 2.117 155 HA GLU 682 HA GLU 682 7.256 8.023 1.123 156 HB2 GLU 682 HB2 GLU 682 9.456 8.512 3.093 157 HB3 GLU 682 HB3 GLU 682 7.820 9.172 3.052 158 HG2 GLU 682 HG2 GLU 682 7.130 6.663 3.460 159 HG3 GLU 682 HG3 GLU 682 8.760 6.520 4.067 160 H SER 683 H SER 683 10.689 7.237 1.004 161 HA SER 683 HA SER 683 11.778 9.628 0.170 162 HB2 SER 683 HB2 SER 683 13.589 8.388 -0.709 163 HB3 SER 683 HB3 SER 683 12.953 7.393 0.599 164 HG SER 683 HG SER 683 11.875 6.131 -0.910 165 H ILE 684 H ILE 684 10.377 7.100 -1.880 166 HA ILE 684 HA ILE 684 10.583 8.673 -4.281 167 HB ILE 684 HB ILE 684 8.776 6.290 -3.833 168 HG12 ILE 684 HG12 ILE 684 11.201 5.475 -5.045 169 HG13 ILE 684 HG13 ILE 684 11.658 6.433 -3.637 170 HG21 ILE 684 HG21 ILE 684 9.997 6.224 -6.355 171 HG22 ILE 684 HG22 ILE 684 8.331 6.686 -6.005 172 HG23 ILE 684 HG23 ILE 684 9.586 7.921 -6.104 173 HD11 ILE 684 HD11 ILE 684 9.799 4.041 -3.683 174 HD12 ILE 684 HD12 ILE 684 11.385 4.142 -2.912 175 HD13 ILE 684 HD13 ILE 684 10.030 5.081 -2.276 176 H LEU 685 H LEU 685 7.856 7.586 -2.272 177 HA LEU 685 HA LEU 685 5.832 8.980 -3.582 178 HB2 LEU 685 HB2 LEU 685 6.107 8.182 -0.684 179 HB3 LEU 685 HB3 LEU 685 4.620 8.825 -1.381 180 HG LEU 685 HG LEU 685 6.075 6.375 -2.418 181 HD11 LEU 685 HD11 LEU 685 3.597 6.606 -0.691 182 HD12 LEU 685 HD12 LEU 685 4.197 5.114 -1.405 183 HD13 LEU 685 HD13 LEU 685 5.157 5.951 -0.184 184 HD21 LEU 685 HD21 LEU 685 3.342 6.418 -3.137 185 HD22 LEU 685 HD22 LEU 685 3.951 8.041 -3.449 186 HD23 LEU 685 HD23 LEU 685 4.727 6.649 -4.203 187 H ALA 686 H ALA 686 7.784 10.037 -0.760 188 HA ALA 686 HA ALA 686 6.585 12.514 -0.348 189 HB1 ALA 686 HB1 ALA 686 9.532 11.861 -0.104 190 HB2 ALA 686 HB2 ALA 686 8.314 11.549 1.131 191 HB3 ALA 686 HB3 ALA 686 8.697 13.207 0.673 192 H ASN 687 H ASN 687 9.173 11.646 -2.624 193 HA ASN 687 HA ASN 687 9.382 14.338 -3.653 194 HB2 ASN 687 HB2 ASN 687 11.204 12.484 -3.579 195 HB3 ASN 687 HB3 ASN 687 10.442 11.904 -5.059 196 HD21 ASN 687 HD21 ASN 687 9.701 14.482 -6.157 197 HD22 ASN 687 HD22 ASN 687 11.144 15.288 -6.562 198 H ARG 688 H ARG 688 7.270 11.710 -4.231 199 HA ARG 688 HA ARG 688 6.704 12.494 -6.984 200 HB2 ARG 688 HB2 ARG 688 6.357 10.119 -5.424 201 HB3 ARG 688 HB3 ARG 688 4.786 10.624 -6.039 202 HG2 ARG 688 HG2 ARG 688 5.564 9.372 -7.839 203 HG3 ARG 688 HG3 ARG 688 6.123 10.981 -8.294 204 HD2 ARG 688 HD2 ARG 688 8.301 10.389 -8.088 205 HD3 ARG 688 HD3 ARG 688 8.016 9.588 -6.549 206 HE ARG 688 HE ARG 688 7.995 7.586 -7.706 207 HH11 ARG 688 HH21 ARG 688 7.155 10.148 -9.866 208 HH12 ARG 688 HH22 ARG 688 6.999 9.094 -11.233 209 HH21 ARG 688 HH11 ARG 688 7.770 6.250 -9.475 210 HH22 ARG 688 HH12 ARG 688 7.332 6.941 -11.035 211 H SER 689 H SER 689 4.285 12.562 -7.545 212 HA SER 689 HA SER 689 3.180 14.870 -6.292 213 HB2 SER 689 HB2 SER 689 1.162 13.957 -7.844 214 HB3 SER 689 HB3 SER 689 2.541 14.853 -8.478 215 HG SER 689 HG SER 689 1.860 12.548 -9.282 216 H ASP 690 H ASP 690 0.869 14.972 -5.598 217 HA ASP 690 HA ASP 690 0.412 13.207 -3.401 218 HB2 ASP 690 HB2 ASP 690 -1.856 14.445 -3.400 219 HB3 ASP 690 HB3 ASP 690 -0.401 15.398 -3.116 220 H GLY 691 H GLY 691 -0.698 11.361 -3.301 221 HA2 GLY 691 HA2 GLY 691 -2.616 10.006 -3.940 222 HA3 GLY 691 HA3 GLY 691 -2.474 10.659 -5.570 223 H THR 692 H THR 692 0.542 10.433 -5.241 224 HA THR 692 HA THR 692 0.998 8.071 -6.650 225 HB THR 692 HB THR 692 2.990 9.285 -4.723 226 HG1 THR 692 HG1 THR 692 2.384 11.029 -5.855 227 HG21 THR 692 HG21 THR 692 4.579 8.170 -5.930 228 HG22 THR 692 HG22 THR 692 3.228 7.109 -6.331 229 HG23 THR 692 HG23 THR 692 3.712 8.381 -7.453 230 H PHE 693 H PHE 693 1.089 5.946 -6.057 231 HA PHE 693 HA PHE 693 1.305 5.352 -3.165 232 HB2 PHE 693 HB2 PHE 693 -0.564 3.853 -3.262 233 HB3 PHE 693 HB3 PHE 693 -1.080 5.400 -3.935 234 HD1 PHE 693 HD1 PHE 693 -1.161 5.708 -6.440 235 HD2 PHE 693 HD2 PHE 693 -0.504 1.880 -4.604 236 HE1 PHE 693 HE1 PHE 693 -1.757 4.586 -8.567 237 HE2 PHE 693 HE2 PHE 693 -1.103 0.765 -6.731 238 HZ PHE 693 HZ PHE 693 -1.726 2.112 -8.713 239 H LEU 694 H LEU 694 1.796 3.155 -2.618 240 HA LEU 694 HA LEU 694 2.676 1.334 -4.673 241 HB2 LEU 694 HB2 LEU 694 5.014 1.252 -4.088 242 HB3 LEU 694 HB3 LEU 694 4.593 2.902 -4.513 243 HG LEU 694 HG LEU 694 4.103 3.025 -1.881 244 HD11 LEU 694 HD11 LEU 694 6.572 1.606 -1.454 245 HD12 LEU 694 HD12 LEU 694 5.006 1.338 -0.688 246 HD13 LEU 694 HD13 LEU 694 5.404 0.516 -2.197 247 HD21 LEU 694 HD21 LEU 694 6.828 3.262 -3.188 248 HD22 LEU 694 HD22 LEU 694 5.588 4.517 -3.141 249 HD23 LEU 694 HD23 LEU 694 6.372 3.996 -1.651 250 H VAL 695 H VAL 695 3.557 -0.637 -3.822 251 HA VAL 695 HA VAL 695 2.756 -1.220 -1.030 252 HB VAL 695 HB VAL 695 2.364 -3.188 -3.284 253 HG11 VAL 695 HG11 VAL 695 0.584 -3.906 -1.493 254 HG12 VAL 695 HG12 VAL 695 2.279 -4.309 -1.221 255 HG13 VAL 695 HG13 VAL 695 1.557 -2.928 -0.392 256 HG21 VAL 695 HG21 VAL 695 0.436 -1.118 -2.193 257 HG22 VAL 695 HG22 VAL 695 0.984 -1.276 -3.863 258 HG23 VAL 695 HG23 VAL 695 -0.067 -2.506 -3.155 259 H ARG 696 H ARG 696 4.048 -2.747 0.044 260 HA ARG 696 HA ARG 696 6.416 -3.709 -1.438 261 HB2 ARG 696 HB2 ARG 696 7.679 -3.107 0.784 262 HB3 ARG 696 HB3 ARG 696 7.414 -1.885 -0.453 263 HG2 ARG 696 HG2 ARG 696 6.273 -0.626 1.016 264 HG3 ARG 696 HG3 ARG 696 5.107 -1.929 1.239 265 HD2 ARG 696 HD2 ARG 696 7.763 -1.838 2.662 266 HD3 ARG 696 HD3 ARG 696 6.291 -1.172 3.343 267 HE ARG 696 HE ARG 696 5.351 -3.469 3.191 268 HH11 ARG 696 HH21 ARG 696 8.779 -3.192 2.858 269 HH12 ARG 696 HH22 ARG 696 9.072 -4.667 3.750 270 HH21 ARG 696 HH11 ARG 696 5.737 -5.314 4.332 271 HH22 ARG 696 HH12 ARG 696 7.381 -5.872 4.539 272 H GLN 697 H GLN 697 7.617 -5.397 -0.370 273 HA GLN 697 HA GLN 697 5.925 -7.016 1.453 274 HB2 GLN 697 HB2 GLN 697 6.397 -7.677 -1.096 275 HB3 GLN 697 HB3 GLN 697 7.855 -8.356 -0.373 276 HG2 GLN 697 HG2 GLN 697 6.630 -9.817 1.018 277 HG3 GLN 697 HG3 GLN 697 5.140 -8.894 0.829 278 HE21 GLN 697 HE21 GLN 697 6.380 -11.781 -0.054 279 HE22 GLN 697 HE22 GLN 697 5.650 -11.968 -1.573 280 H ARG 698 H ARG 698 9.030 -5.622 0.882 281 HA ARG 698 HA ARG 698 10.872 -7.219 2.091 282 HB2 ARG 698 HB2 ARG 698 10.910 -4.625 1.378 283 HB3 ARG 698 HB3 ARG 698 10.856 -4.432 3.124 284 HG2 ARG 698 HG2 ARG 698 12.748 -6.202 3.181 285 HG3 ARG 698 HG3 ARG 698 12.940 -5.848 1.465 286 HD2 ARG 698 HD2 ARG 698 14.455 -4.386 2.554 287 HD3 ARG 698 HD3 ARG 698 13.065 -3.378 2.150 288 HE ARG 698 HE ARG 698 12.800 -4.513 4.767 289 HH11 ARG 698 HH21 ARG 698 14.419 -2.082 2.949 290 HH12 ARG 698 HH22 ARG 698 14.584 -0.974 4.288 291 HH21 ARG 698 HH11 ARG 698 13.024 -3.115 6.519 292 HH22 ARG 698 HH12 ARG 698 13.842 -1.592 6.313 293 H VAL 699 H VAL 699 10.648 -8.465 3.833 294 HA VAL 699 HA VAL 699 10.306 -9.107 6.013 295 HB VAL 699 HB VAL 699 10.060 -6.131 6.556 296 HG11 VAL 699 HG11 VAL 699 10.788 -6.865 8.858 297 HG12 VAL 699 HG12 VAL 699 9.172 -7.409 8.403 298 HG13 VAL 699 HG13 VAL 699 10.531 -8.533 8.344 299 HG21 VAL 699 HG21 VAL 699 12.513 -7.690 7.218 300 HG22 VAL 699 HG22 VAL 699 12.250 -7.329 5.511 301 HG23 VAL 699 HG23 VAL 699 12.356 -6.017 6.685 302 H LYS 700 H LYS 700 8.413 -10.200 5.865 303 HA LYS 700 HA LYS 700 5.954 -8.700 6.511 304 HB2 LYS 700 HB2 LYS 700 4.678 -9.954 4.885 305 HB3 LYS 700 HB3 LYS 700 6.038 -9.197 4.059 306 HG2 LYS 700 HG2 LYS 700 6.751 -11.213 3.353 307 HG3 LYS 700 HG3 LYS 700 6.907 -11.753 5.022 308 HD2 LYS 700 HD2 LYS 700 4.134 -11.781 4.469 309 HD3 LYS 700 HD3 LYS 700 4.908 -12.486 3.052 310 HE2 LYS 700 HE2 LYS 700 4.692 -14.368 4.399 311 HE3 LYS 700 HE3 LYS 700 6.300 -13.818 4.877 312 HZ1 LYS 700 HZ1 LYS 700 4.829 -12.375 6.539 313 HZ2 LYS 700 HZ2 LYS 700 3.770 -13.714 6.356 314 HZ3 LYS 700 HZ3 LYS 700 5.368 -13.954 6.933 315 H ASP 701 H ASP 701 7.947 -10.525 7.899 316 HA ASP 701 HA ASP 701 7.931 -12.649 9.006 317 HB2 ASP 701 HB2 ASP 701 6.471 -12.108 11.088 318 HB3 ASP 701 HB3 ASP 701 7.843 -11.065 10.716 319 H ALA 702 H ALA 702 4.648 -11.872 9.902 320 HA ALA 702 HA ALA 702 3.784 -14.543 9.040 321 HB1 ALA 702 HB1 ALA 702 3.133 -13.980 11.268 322 HB2 ALA 702 HB2 ALA 702 1.671 -13.869 10.288 323 HB3 ALA 702 HB3 ALA 702 2.527 -12.402 10.766 324 H ALA 703 H ALA 703 2.197 -11.357 8.972 325 HA ALA 703 HA ALA 703 1.781 -11.480 6.108 326 HB1 ALA 703 HB1 ALA 703 -0.808 -11.191 6.615 327 HB2 ALA 703 HB2 ALA 703 -0.399 -12.122 8.057 328 HB3 ALA 703 HB3 ALA 703 -0.091 -12.796 6.458 329 H GLU 704 H GLU 704 3.135 -9.665 7.750 330 HA GLU 704 HA GLU 704 1.447 -7.378 8.279 331 HB2 GLU 704 HB2 GLU 704 4.034 -8.249 9.057 332 HB3 GLU 704 HB3 GLU 704 4.241 -6.702 8.238 333 HG2 GLU 704 HG2 GLU 704 2.026 -6.986 10.245 334 HG3 GLU 704 HG3 GLU 704 3.674 -6.788 10.827 335 H PHE 705 H PHE 705 0.585 -7.230 6.033 336 HA PHE 705 HA PHE 705 2.492 -5.984 4.143 337 HB2 PHE 705 HB2 PHE 705 -0.360 -6.782 3.527 338 HB3 PHE 705 HB3 PHE 705 0.939 -6.428 2.389 339 HD1 PHE 705 HD2 PHE 705 2.970 -7.977 2.344 340 HD2 PHE 705 HD1 PHE 705 -0.685 -8.972 4.368 341 HE1 PHE 705 HE2 PHE 705 3.618 -10.370 2.334 342 HE2 PHE 705 HE1 PHE 705 -0.041 -11.366 4.351 343 HZ PHE 705 HZ PHE 705 2.111 -12.066 3.336 344 H ALA 706 H ALA 706 1.894 -3.994 3.076 345 HA ALA 706 HA ALA 706 -0.364 -2.470 4.019 346 HB1 ALA 706 HB1 ALA 706 0.591 -1.259 5.653 347 HB2 ALA 706 HB2 ALA 706 1.945 -0.846 4.618 348 HB3 ALA 706 HB3 ALA 706 1.984 -2.332 5.567 349 H ILE 707 H ILE 707 -0.657 -0.502 2.910 350 HA ILE 707 HA ILE 707 0.914 -0.296 0.397 351 HB ILE 707 HB ILE 707 -1.863 0.774 0.980 352 HG12 ILE 707 HG12 ILE 707 -0.965 -1.758 -0.436 353 HG13 ILE 707 HG13 ILE 707 -1.891 -1.665 1.061 354 HG21 ILE 707 HG21 ILE 707 -1.778 1.711 -1.072 355 HG22 ILE 707 HG22 ILE 707 -0.041 1.409 -1.051 356 HG23 ILE 707 HG23 ILE 707 -1.133 0.238 -1.792 357 HD11 ILE 707 HD11 ILE 707 -2.887 -0.422 -1.507 358 HD12 ILE 707 HD12 ILE 707 -3.230 -2.099 -1.087 359 HD13 ILE 707 HD13 ILE 707 -3.806 -0.795 -0.050 360 H SER 708 H SER 708 1.897 1.617 -0.148 361 HA SER 708 HA SER 708 1.722 3.807 1.861 362 HB2 SER 708 HB2 SER 708 3.992 3.100 -0.010 363 HB3 SER 708 HB3 SER 708 3.984 4.447 1.120 364 HG SER 708 HG SER 708 3.485 1.788 1.958 365 H ILE 709 H ILE 709 0.687 5.593 1.200 366 HA ILE 709 HA ILE 709 0.766 6.276 -1.682 367 HB ILE 709 HB ILE 709 -1.601 6.840 0.096 368 HG12 ILE 709 HG12 ILE 709 -2.456 4.814 -1.490 369 HG13 ILE 709 HG13 ILE 709 -0.781 4.321 -1.249 370 HG21 ILE 709 HG21 ILE 709 -2.195 8.015 -1.740 371 HG22 ILE 709 HG22 ILE 709 -0.855 7.363 -2.678 372 HG23 ILE 709 HG23 ILE 709 -2.373 6.472 -2.572 373 HD11 ILE 709 HD11 ILE 709 -2.449 3.469 0.480 374 HD12 ILE 709 HD12 ILE 709 -1.030 4.291 1.128 375 HD13 ILE 709 HD13 ILE 709 -2.577 5.137 1.046 376 H LYS 710 H LYS 710 0.873 8.401 -2.251 377 HA LYS 710 HA LYS 710 1.959 10.228 -0.252 378 HB2 LYS 710 HB2 LYS 710 3.000 10.127 -2.459 379 HB3 LYS 710 HB3 LYS 710 1.474 10.549 -3.224 380 HG2 LYS 710 HG2 LYS 710 2.701 12.589 -3.112 381 HG3 LYS 710 HG3 LYS 710 1.522 12.688 -1.806 382 HD2 LYS 710 HD2 LYS 710 3.131 12.339 -0.152 383 HD3 LYS 710 HD3 LYS 710 4.244 11.543 -1.257 384 HE2 LYS 710 HE2 LYS 710 3.513 14.425 -1.696 385 HE3 LYS 710 HE3 LYS 710 4.734 14.005 -0.492 386 HZ1 LYS 710 HZ1 LYS 710 6.112 14.072 -2.267 387 HZ2 LYS 710 HZ2 LYS 710 5.518 12.490 -2.541 388 HZ3 LYS 710 HZ3 LYS 710 4.854 13.801 -3.409 389 H TYR 711 H TYR 711 0.782 11.635 0.864 390 HA TYR 711 HA TYR 711 -1.680 12.762 -0.323 391 HB2 TYR 711 HB2 TYR 711 -1.931 10.728 1.400 392 HB3 TYR 711 HB3 TYR 711 -1.732 12.029 2.571 393 HD1 TYR 711 HD2 TYR 711 -3.093 14.303 1.554 394 HD2 TYR 711 HD1 TYR 711 -4.154 10.169 1.118 395 HE1 TYR 711 HE2 TYR 711 -5.461 14.950 1.214 396 HE2 TYR 711 HE1 TYR 711 -6.520 10.813 0.774 397 HH TYR 711 HH TYR 711 -7.892 12.645 0.201 398 H ASN 712 H ASN 712 -1.573 14.927 -0.204 399 HA ASN 712 HA ASN 712 -0.823 17.035 0.375 400 HB2 ASN 712 HB2 ASN 712 -1.506 15.747 3.014 401 HB3 ASN 712 HB3 ASN 712 -1.001 17.431 2.908 402 HD21 ASN 712 HD21 ASN 712 -3.152 18.188 3.537 403 HD22 ASN 712 HD22 ASN 712 -4.460 18.086 2.461 404 H VAL 713 H VAL 713 1.328 16.300 -0.463 405 HA VAL 713 HA VAL 713 3.602 16.029 -0.318 406 HB VAL 713 HB VAL 713 4.740 17.757 0.916 407 HG11 VAL 713 HG11 VAL 713 2.038 18.665 -0.118 408 HG12 VAL 713 HG12 VAL 713 3.393 19.744 0.210 409 HG13 VAL 713 HG13 VAL 713 3.528 18.518 -1.051 410 HG21 VAL 713 HG21 VAL 713 3.323 17.343 3.037 411 HG22 VAL 713 HG22 VAL 713 3.774 19.010 2.682 412 HG23 VAL 713 HG23 VAL 713 2.148 18.442 2.312 413 H GLU 714 H GLU 714 1.892 14.349 1.526 414 HA GLU 714 HA GLU 714 4.114 13.365 3.178 415 HB2 GLU 714 HB2 GLU 714 1.521 14.382 4.090 416 HB3 GLU 714 HB3 GLU 714 1.902 12.769 4.701 417 HG2 GLU 714 HG2 GLU 714 3.881 15.048 4.773 418 HG3 GLU 714 HG3 GLU 714 2.774 14.718 6.102 419 H VAL 715 H VAL 715 3.693 11.112 3.972 420 HA VAL 715 HA VAL 715 2.252 9.613 1.855 421 HB VAL 715 HB VAL 715 4.636 8.687 3.461 422 HG11 VAL 715 HG11 VAL 715 4.724 6.966 1.648 423 HG12 VAL 715 HG12 VAL 715 3.257 6.860 2.618 424 HG13 VAL 715 HG13 VAL 715 3.203 7.601 1.019 425 HG21 VAL 715 HG21 VAL 715 5.590 10.329 2.122 426 HG22 VAL 715 HG22 VAL 715 5.631 8.957 1.019 427 HG23 VAL 715 HG23 VAL 715 4.360 10.167 0.867 428 H LYS 716 H LYS 716 0.911 7.962 2.366 429 HA LYS 716 HA LYS 716 0.454 7.459 5.262 430 HB2 LYS 716 HB2 LYS 716 -1.422 8.584 3.772 431 HB3 LYS 716 HB3 LYS 716 -1.666 6.942 3.200 432 HG2 LYS 716 HG2 LYS 716 -2.485 6.185 5.221 433 HG3 LYS 716 HG3 LYS 716 -1.466 7.278 6.152 434 HD2 LYS 716 HD2 LYS 716 -3.934 8.094 4.585 435 HD3 LYS 716 HD3 LYS 716 -3.884 7.867 6.318 436 HE2 LYS 716 HE2 LYS 716 -2.872 10.124 4.660 437 HE3 LYS 716 HE3 LYS 716 -3.542 10.140 6.288 438 HZ1 LYS 716 HZ1 LYS 716 -0.799 9.965 5.439 439 HZ2 LYS 716 HZ2 LYS 716 -1.441 10.445 6.939 440 HZ3 LYS 716 HZ3 LYS 716 -1.204 8.798 6.605 441 H HIS 717 H HIS 717 1.275 5.516 5.784 442 HA HIS 717 HA HIS 717 1.144 3.358 3.776 443 HB2 HIS 717 HB2 HIS 717 2.706 3.224 6.353 444 HB3 HIS 717 HB3 HIS 717 2.918 2.255 4.901 445 HD1 HIS 717 HD1 HIS 717 4.318 3.250 2.964 446 HD2 HIS 717 HD2 HIS 717 3.862 5.838 6.225 447 HE1 HIS 717 HE1 HIS 717 6.002 5.139 2.668 448 HE2 HIS 717 HE2 HIS 717 5.721 6.724 4.653 449 H ILE 718 H ILE 718 -0.753 2.316 4.001 450 HA ILE 718 HA ILE 718 -1.735 1.830 6.747 451 HB ILE 718 HB ILE 718 -3.013 2.459 4.189 452 HG12 ILE 718 HG12 ILE 718 -3.119 3.800 6.299 453 HG13 ILE 718 HG13 ILE 718 -4.693 3.416 5.614 454 HG21 ILE 718 HG21 ILE 718 -3.678 0.122 4.214 455 HG22 ILE 718 HG22 ILE 718 -4.144 0.237 5.911 456 HG23 ILE 718 HG23 ILE 718 -5.061 1.109 4.684 457 HD11 ILE 718 HD11 ILE 718 -4.826 3.017 7.977 458 HD12 ILE 718 HD12 ILE 718 -4.793 1.441 7.190 459 HD13 ILE 718 HD13 ILE 718 -3.340 2.074 7.964 460 H LYS 719 H LYS 719 -2.134 -0.171 7.481 461 HA LYS 719 HA LYS 719 -0.674 -2.344 6.332 462 HB2 LYS 719 HB2 LYS 719 -0.891 -1.958 8.761 463 HB3 LYS 719 HB3 LYS 719 -2.614 -2.306 8.647 464 HG2 LYS 719 HG2 LYS 719 -2.097 -4.481 8.977 465 HG3 LYS 719 HG3 LYS 719 -1.379 -4.479 7.371 466 HD2 LYS 719 HD2 LYS 719 0.298 -5.266 8.915 467 HD3 LYS 719 HD3 LYS 719 0.757 -3.643 8.407 468 HE2 LYS 719 HE2 LYS 719 -0.932 -3.286 10.632 469 HE3 LYS 719 HE3 LYS 719 0.148 -4.612 11.061 470 HZ1 LYS 719 HZ1 LYS 719 0.897 -2.217 11.502 471 HZ2 LYS 719 HZ2 LYS 719 2.028 -3.325 10.770 472 HZ3 LYS 719 HZ3 LYS 719 1.209 -2.143 9.816 473 H ILE 720 H ILE 720 -1.382 -4.307 5.614 474 HA ILE 720 HA ILE 720 -4.191 -4.376 4.700 475 HB ILE 720 HB ILE 720 -1.646 -5.326 3.423 476 HG12 ILE 720 HG12 ILE 720 -4.112 -3.933 2.346 477 HG13 ILE 720 HG13 ILE 720 -2.670 -3.091 2.915 478 HG21 ILE 720 HG21 ILE 720 -2.944 -7.318 3.287 479 HG22 ILE 720 HG22 ILE 720 -4.445 -6.417 3.063 480 HG23 ILE 720 HG23 ILE 720 -3.257 -6.488 1.764 481 HD11 ILE 720 HD11 ILE 720 -2.241 -5.265 0.938 482 HD12 ILE 720 HD12 ILE 720 -3.019 -3.798 0.346 483 HD13 ILE 720 HD13 ILE 720 -1.426 -3.710 1.096 484 H MET 721 H MET 721 -5.420 -5.901 5.524 485 HA MET 721 HA MET 721 -4.180 -8.043 7.125 486 HB2 MET 721 HB2 MET 721 -6.330 -6.406 7.647 487 HB3 MET 721 HB3 MET 721 -7.113 -7.861 7.037 488 HG2 MET 721 HG2 MET 721 -5.315 -8.996 8.713 489 HG3 MET 721 HG3 MET 721 -5.563 -7.452 9.536 490 HE1 MET 721 HE1 MET 721 -7.991 -8.844 11.828 491 HE2 MET 721 HE2 MET 721 -6.584 -9.808 11.378 492 HE3 MET 721 HE3 MET 721 -6.461 -8.046 11.471 493 H THR 722 H THR 722 -5.074 -10.200 6.947 494 HA THR 722 HA THR 722 -6.489 -10.922 4.522 495 HB THR 722 HB THR 722 -4.002 -10.704 3.921 496 HG1 THR 722 HG1 THR 722 -5.681 -12.017 2.862 497 HG21 THR 722 HG21 THR 722 -3.815 -13.335 5.393 498 HG22 THR 722 HG22 THR 722 -2.507 -12.397 4.670 499 HG23 THR 722 HG23 THR 722 -3.313 -11.808 6.126 500 H ALA 723 H ALA 723 -7.226 -13.094 4.546 501 HA ALA 723 HA ALA 723 -6.628 -14.875 6.699 502 HB1 ALA 723 HB1 ALA 723 -8.653 -14.702 7.971 503 HB2 ALA 723 HB2 ALA 723 -9.340 -13.551 6.820 504 HB3 ALA 723 HB3 ALA 723 -7.982 -13.075 7.844 505 H GLU 724 H GLU 724 -9.698 -14.090 5.196 506 HA GLU 724 HA GLU 724 -10.206 -16.798 4.393 507 HB2 GLU 724 HB2 GLU 724 -11.769 -14.493 3.346 508 HB3 GLU 724 HB3 GLU 724 -12.347 -16.023 3.998 509 HG2 GLU 724 HG2 GLU 724 -12.918 -14.588 5.741 510 HG3 GLU 724 HG3 GLU 724 -11.299 -15.060 6.251 511 H GLY 725 H GLY 725 -7.814 -15.990 3.242 512 HA2 GLY 725 HA2 GLY 725 -6.721 -15.950 1.195 513 HA3 GLY 725 HA3 GLY 725 -8.221 -16.559 0.491 514 H LEU 726 H LEU 726 -8.173 -13.646 2.369 515 HA LEU 726 HA LEU 726 -8.582 -12.052 -0.087 516 HB2 LEU 726 HB2 LEU 726 -9.886 -11.730 2.623 517 HB3 LEU 726 HB3 LEU 726 -10.086 -10.618 1.270 518 HG LEU 726 HG LEU 726 -10.628 -13.526 0.820 519 HD11 LEU 726 HD11 LEU 726 -11.795 -12.491 2.979 520 HD12 LEU 726 HD12 LEU 726 -12.861 -11.781 1.766 521 HD13 LEU 726 HD13 LEU 726 -12.687 -13.532 1.868 522 HD21 LEU 726 HD21 LEU 726 -12.585 -12.038 -0.394 523 HD22 LEU 726 HD22 LEU 726 -11.223 -10.919 -0.424 524 HD23 LEU 726 HD23 LEU 726 -11.071 -12.512 -1.164 525 H TYR 727 H TYR 727 -8.116 -9.784 0.104 526 HA TYR 727 HA TYR 727 -5.947 -9.137 2.031 527 HB2 TYR 727 HB2 TYR 727 -6.248 -8.262 -0.866 528 HB3 TYR 727 HB3 TYR 727 -5.026 -7.650 0.243 529 HD1 TYR 727 HD2 TYR 727 -6.165 -10.582 -1.686 530 HD2 TYR 727 HD1 TYR 727 -3.130 -9.018 0.915 531 HE1 TYR 727 HE2 TYR 727 -4.684 -12.488 -2.268 532 HE2 TYR 727 HE1 TYR 727 -1.648 -10.920 0.331 533 HH TYR 727 HH TYR 727 -1.415 -12.528 -1.685 534 H ARG 728 H ARG 728 -6.366 -7.326 3.254 535 HA ARG 728 HA ARG 728 -8.209 -5.317 2.194 536 HB2 ARG 728 HB2 ARG 728 -9.285 -5.344 4.592 537 HB3 ARG 728 HB3 ARG 728 -9.860 -6.413 3.318 538 HG2 ARG 728 HG2 ARG 728 -9.022 -8.300 4.325 539 HG3 ARG 728 HG3 ARG 728 -7.622 -7.452 4.973 540 HD2 ARG 728 HD2 ARG 728 -8.784 -6.677 6.847 541 HD3 ARG 728 HD3 ARG 728 -10.352 -6.836 6.074 542 HE ARG 728 HE ARG 728 -8.906 -8.914 7.480 543 HH11 ARG 728 HH21 ARG 728 -11.344 -8.177 5.126 544 HH12 ARG 728 HH22 ARG 728 -12.063 -9.759 5.222 545 HH21 ARG 728 HH11 ARG 728 -9.879 -10.942 7.585 546 HH22 ARG 728 HH12 ARG 728 -11.252 -11.316 6.573 547 H ILE 729 H ILE 729 -7.707 -3.342 2.712 548 HA ILE 729 HA ILE 729 -5.332 -2.807 4.271 549 HB ILE 729 HB ILE 729 -6.312 -0.359 3.661 550 HG12 ILE 729 HG12 ILE 729 -8.328 -1.616 2.651 551 HG13 ILE 729 HG13 ILE 729 -7.580 -0.362 1.666 552 HG21 ILE 729 HG21 ILE 729 -4.147 -1.709 2.973 553 HG22 ILE 729 HG22 ILE 729 -5.002 -1.906 1.445 554 HG23 ILE 729 HG23 ILE 729 -4.644 -0.296 2.055 555 HD11 ILE 729 HD11 ILE 729 -6.892 -1.844 0.104 556 HD12 ILE 729 HD12 ILE 729 -6.397 -3.037 1.302 557 HD13 ILE 729 HD13 ILE 729 -8.090 -2.916 0.820 558 H THR 730 H THR 730 -8.496 -3.291 4.970 559 HA THR 730 HA THR 730 -8.236 -1.933 7.541 560 HB THR 730 HB THR 730 -9.420 -0.385 5.951 561 HG1 THR 730 HG1 THR 730 -11.360 -0.314 7.457 562 HG21 THR 730 HG21 THR 730 -10.957 -1.274 4.588 563 HG22 THR 730 HG22 THR 730 -10.957 -2.791 5.475 564 HG23 THR 730 HG23 THR 730 -12.004 -1.473 5.992 565 H GLU 731 H GLU 731 -9.169 -2.986 9.158 566 HA GLU 731 HA GLU 731 -9.655 -5.717 9.027 567 HB2 GLU 731 HB2 GLU 731 -10.703 -5.317 11.301 568 HB3 GLU 731 HB3 GLU 731 -9.091 -4.618 11.092 569 HG2 GLU 731 HG2 GLU 731 -11.314 -2.871 10.250 570 HG3 GLU 731 HG3 GLU 731 -11.246 -3.194 11.976 571 H LYS 732 H LYS 732 -11.610 -3.312 7.800 572 HA LYS 732 HA LYS 732 -14.097 -4.800 8.286 573 HB2 LYS 732 HB2 LYS 732 -13.977 -2.041 7.128 574 HB3 LYS 732 HB3 LYS 732 -15.232 -2.782 8.127 575 HG2 LYS 732 HG2 LYS 732 -13.235 -2.955 9.879 576 HG3 LYS 732 HG3 LYS 732 -12.599 -1.604 8.942 577 HD2 LYS 732 HD2 LYS 732 -14.468 -0.233 9.451 578 HD3 LYS 732 HD3 LYS 732 -15.428 -1.608 10.008 579 HE2 LYS 732 HE2 LYS 732 -14.019 -1.902 11.945 580 HE3 LYS 732 HE3 LYS 732 -12.857 -0.715 11.349 581 HZ1 LYS 732 HZ1 LYS 732 -14.719 0.957 11.433 582 HZ2 LYS 732 HZ2 LYS 732 -15.654 -0.239 12.281 583 HZ3 LYS 732 HZ3 LYS 732 -14.189 0.358 12.961 584 H LYS 733 H LYS 733 -11.817 -4.569 5.831 585 HA LYS 733 HA LYS 733 -13.894 -5.088 3.760 586 HB2 LYS 733 HB2 LYS 733 -12.163 -2.990 3.727 587 HB3 LYS 733 HB3 LYS 733 -11.253 -4.193 2.814 588 HG2 LYS 733 HG2 LYS 733 -12.540 -3.167 1.139 589 HG3 LYS 733 HG3 LYS 733 -13.522 -4.570 1.549 590 HD2 LYS 733 HD2 LYS 733 -15.026 -2.709 1.482 591 HD3 LYS 733 HD3 LYS 733 -14.769 -3.060 3.193 592 HE2 LYS 733 HE2 LYS 733 -13.278 -1.220 3.447 593 HE3 LYS 733 HE3 LYS 733 -13.103 -1.025 1.705 594 HZ1 LYS 733 HZ1 LYS 733 -15.151 -0.038 1.486 595 HZ2 LYS 733 HZ2 LYS 733 -15.763 -0.756 2.926 596 HZ3 LYS 733 HZ3 LYS 733 -14.654 0.540 3.029 597 H ALA 734 H ALA 734 -12.495 -6.058 1.723 598 HA ALA 734 HA ALA 734 -10.470 -7.926 2.301 599 HB1 ALA 734 HB1 ALA 734 -12.821 -9.608 1.865 600 HB2 ALA 734 HB2 ALA 734 -12.862 -8.747 3.402 601 HB3 ALA 734 HB3 ALA 734 -11.496 -9.795 3.014 602 H PHE 735 H PHE 735 -9.499 -8.135 0.392 603 HA PHE 735 HA PHE 735 -11.170 -8.418 -2.052 604 HB2 PHE 735 HB2 PHE 735 -8.541 -7.002 -1.611 605 HB3 PHE 735 HB3 PHE 735 -9.009 -7.574 -3.208 606 HD1 PHE 735 HD2 PHE 735 -10.376 -5.621 -0.314 607 HD2 PHE 735 HD1 PHE 735 -10.329 -6.230 -4.565 608 HE1 PHE 735 HE2 PHE 735 -11.846 -3.641 -0.622 609 HE2 PHE 735 HE1 PHE 735 -11.787 -4.252 -4.875 610 HZ PHE 735 HZ PHE 735 -12.556 -2.963 -2.893 611 H ARG 736 H ARG 736 -10.257 -9.873 -3.710 612 HA ARG 736 HA ARG 736 -9.088 -12.208 -2.475 613 HB2 ARG 736 HB2 ARG 736 -10.363 -11.548 -5.033 614 HB3 ARG 736 HB3 ARG 736 -9.039 -12.711 -5.171 615 HG2 ARG 736 HG2 ARG 736 -11.211 -12.935 -3.098 616 HG3 ARG 736 HG3 ARG 736 -11.316 -13.714 -4.675 617 HD2 ARG 736 HD2 ARG 736 -9.926 -15.380 -4.026 618 HD3 ARG 736 HD3 ARG 736 -8.730 -14.222 -3.457 619 HE ARG 736 HE ARG 736 -9.452 -14.651 -1.297 620 HH11 ARG 736 HH21 ARG 736 -11.930 -15.408 -3.573 621 HH12 ARG 736 HH22 ARG 736 -13.001 -16.096 -2.407 622 HH21 ARG 736 HH11 ARG 736 -10.868 -15.562 0.264 623 HH22 ARG 736 HH12 ARG 736 -12.404 -16.179 -0.256 624 H GLY 737 H GLY 737 -7.935 -9.493 -4.203 625 HA2 GLY 737 HA2 GLY 737 -5.190 -10.362 -3.835 626 HA3 GLY 737 HA3 GLY 737 -5.684 -10.231 -5.518 627 H LEU 738 H LEU 738 -3.761 -8.702 -3.779 628 HA LEU 738 HA LEU 738 -4.430 -6.145 -3.106 629 HB2 LEU 738 HB2 LEU 738 -2.033 -7.454 -4.225 630 HB3 LEU 738 HB3 LEU 738 -2.118 -5.729 -4.554 631 HG LEU 738 HG LEU 738 -0.913 -6.166 -2.466 632 HD11 LEU 738 HD11 LEU 738 -3.501 -5.044 -1.512 633 HD12 LEU 738 HD12 LEU 738 -1.858 -4.435 -1.307 634 HD13 LEU 738 HD13 LEU 738 -2.686 -4.229 -2.849 635 HD21 LEU 738 HD21 LEU 738 -2.228 -7.051 -0.510 636 HD22 LEU 738 HD22 LEU 738 -3.504 -7.497 -1.644 637 HD23 LEU 738 HD23 LEU 738 -1.910 -8.246 -1.769 638 H THR 739 H THR 739 -3.519 -7.259 -6.320 639 HA THR 739 HA THR 739 -3.868 -4.940 -7.774 640 HB THR 739 HB THR 739 -4.531 -7.700 -8.798 641 HG1 THR 739 HG1 THR 739 -1.960 -6.704 -8.969 642 HG21 THR 739 HG21 THR 739 -4.915 -5.974 -10.433 643 HG22 THR 739 HG22 THR 739 -3.392 -5.178 -10.031 644 HG23 THR 739 HG23 THR 739 -3.384 -6.748 -10.839 645 H GLU 740 H GLU 740 -6.370 -7.258 -6.747 646 HA GLU 740 HA GLU 740 -8.390 -5.929 -8.337 647 HB2 GLU 740 HB2 GLU 740 -9.100 -7.682 -6.012 648 HB3 GLU 740 HB3 GLU 740 -9.857 -7.570 -7.599 649 HG2 GLU 740 HG2 GLU 740 -7.176 -8.851 -6.985 650 HG3 GLU 740 HG3 GLU 740 -8.661 -9.697 -7.394 651 H LEU 741 H LEU 741 -6.889 -5.533 -5.311 652 HA LEU 741 HA LEU 741 -9.026 -3.959 -4.110 653 HB2 LEU 741 HB2 LEU 741 -7.755 -5.399 -2.647 654 HB3 LEU 741 HB3 LEU 741 -6.232 -4.756 -3.239 655 HG LEU 741 HG LEU 741 -7.176 -3.942 -0.942 656 HD11 LEU 741 HD11 LEU 741 -5.478 -2.830 -2.897 657 HD12 LEU 741 HD12 LEU 741 -6.511 -1.495 -2.381 658 HD13 LEU 741 HD13 LEU 741 -5.554 -2.383 -1.195 659 HD21 LEU 741 HD21 LEU 741 -8.508 -1.797 -2.543 660 HD22 LEU 741 HD22 LEU 741 -9.387 -3.309 -2.343 661 HD23 LEU 741 HD23 LEU 741 -8.885 -2.390 -0.929 662 H VAL 742 H VAL 742 -5.717 -3.555 -5.197 663 HA VAL 742 HA VAL 742 -5.492 -0.755 -4.879 664 HB VAL 742 HB VAL 742 -4.092 -2.719 -6.698 665 HG11 VAL 742 HG11 VAL 742 -2.364 -0.618 -6.142 666 HG12 VAL 742 HG12 VAL 742 -3.198 -0.907 -7.672 667 HG13 VAL 742 HG13 VAL 742 -3.902 0.181 -6.472 668 HG21 VAL 742 HG21 VAL 742 -3.493 -1.614 -3.945 669 HG22 VAL 742 HG22 VAL 742 -3.792 -3.298 -4.391 670 HG23 VAL 742 HG23 VAL 742 -2.311 -2.491 -4.920 671 H GLU 743 H GLU 743 -5.893 -2.661 -7.821 672 HA GLU 743 HA GLU 743 -6.223 -0.466 -9.535 673 HB2 GLU 743 HB2 GLU 743 -7.218 -3.277 -9.969 674 HB3 GLU 743 HB3 GLU 743 -6.780 -2.094 -11.210 675 HG2 GLU 743 HG2 GLU 743 -4.765 -2.954 -9.128 676 HG3 GLU 743 HG3 GLU 743 -5.041 -3.936 -10.547 677 H PHE 744 H PHE 744 -8.446 -2.100 -7.457 678 HA PHE 744 HA PHE 744 -10.829 -1.175 -8.812 679 HB2 PHE 744 HB2 PHE 744 -11.010 -3.182 -7.532 680 HB3 PHE 744 HB3 PHE 744 -10.298 -2.424 -6.114 681 HD1 PHE 744 HD2 PHE 744 -13.130 -1.703 -8.493 682 HD2 PHE 744 HD1 PHE 744 -11.769 -1.876 -4.426 683 HE1 PHE 744 HE2 PHE 744 -15.377 -0.999 -7.710 684 HE2 PHE 744 HE1 PHE 744 -14.015 -1.174 -3.636 685 HZ PHE 744 HZ PHE 744 -15.820 -0.734 -5.283 686 H TYR 745 H TYR 745 -8.767 -0.122 -6.174 687 HA TYR 745 HA TYR 745 -10.532 1.968 -5.288 688 HB2 TYR 745 HB2 TYR 745 -7.694 1.194 -4.688 689 HB3 TYR 745 HB3 TYR 745 -8.371 2.707 -4.085 690 HD1 TYR 745 HD2 TYR 745 -10.969 0.326 -4.492 691 HD2 TYR 745 HD1 TYR 745 -7.761 1.426 -1.856 692 HE1 TYR 745 HE2 TYR 745 -12.089 -0.853 -2.633 693 HE2 TYR 745 HE1 TYR 745 -8.893 0.235 -0.001 694 HH TYR 745 HH TYR 745 -12.082 -0.574 -0.072 695 H GLN 746 H GLN 746 -8.418 1.678 -7.923 696 HA GLN 746 HA GLN 746 -7.379 4.256 -8.224 697 HB2 GLN 746 HB2 GLN 746 -8.406 2.255 -10.240 698 HB3 GLN 746 HB3 GLN 746 -7.683 3.791 -10.723 699 HG2 GLN 746 HG2 GLN 746 -5.578 3.223 -9.811 700 HG3 GLN 746 HG3 GLN 746 -6.258 1.938 -8.811 701 HE21 GLN 746 HE21 GLN 746 -4.342 0.792 -10.061 702 HE22 GLN 746 HE22 GLN 746 -4.786 0.007 -11.505 703 H GLN 747 H GLN 747 -10.596 2.984 -8.853 704 HA GLN 747 HA GLN 747 -11.558 5.677 -9.596 705 HB2 GLN 747 HB2 GLN 747 -12.819 2.947 -9.961 706 HB3 GLN 747 HB3 GLN 747 -13.572 4.474 -10.426 707 HG2 GLN 747 HG2 GLN 747 -11.567 4.945 -11.875 708 HG3 GLN 747 HG3 GLN 747 -10.984 3.322 -11.513 709 HE21 GLN 747 HE21 GLN 747 -11.578 1.804 -13.055 710 HE22 GLN 747 HE22 GLN 747 -12.962 1.896 -14.031 711 H ASN 748 H ASN 748 -11.417 3.535 -6.998 712 HA ASN 748 HA ASN 748 -13.754 4.810 -5.687 713 HB2 ASN 748 HB2 ASN 748 -14.235 2.493 -5.769 714 HB3 ASN 748 HB3 ASN 748 -12.571 2.049 -5.398 715 HD21 ASN 748 HD21 ASN 748 -12.559 1.158 -3.339 716 HD22 ASN 748 HD22 ASN 748 -13.378 1.798 -1.998 717 H SER 749 H SER 749 -13.172 6.298 -4.256 718 HA SER 749 HA SER 749 -10.668 6.940 -3.385 719 HB2 SER 749 HB2 SER 749 -13.114 7.948 -2.967 720 HB3 SER 749 HB3 SER 749 -12.841 7.215 -1.396 721 HG SER 749 HG SER 749 -10.592 8.423 -2.068 722 H LEU 750 H LEU 750 -9.270 6.282 -1.835 723 HA LEU 750 HA LEU 750 -9.375 3.625 -0.909 724 HB2 LEU 750 HB2 LEU 750 -7.724 5.974 0.006 725 HB3 LEU 750 HB3 LEU 750 -7.465 4.323 0.559 726 HG LEU 750 HG LEU 750 -7.696 4.283 -2.295 727 HD11 LEU 750 HD11 LEU 750 -5.284 5.855 -1.693 728 HD12 LEU 750 HD12 LEU 750 -6.402 5.975 -3.051 729 HD13 LEU 750 HD13 LEU 750 -6.794 6.749 -1.520 730 HD21 LEU 750 HD21 LEU 750 -6.502 2.675 -0.827 731 HD22 LEU 750 HD22 LEU 750 -5.465 3.291 -2.113 732 HD23 LEU 750 HD23 LEU 750 -5.300 3.915 -0.472 733 H LYS 751 H LYS 751 -10.372 6.632 0.592 734 HA LYS 751 HA LYS 751 -10.576 5.942 3.235 735 HB2 LYS 751 HB2 LYS 751 -12.473 7.511 3.386 736 HB3 LYS 751 HB3 LYS 751 -11.114 8.156 2.482 737 HG2 LYS 751 HG2 LYS 751 -12.507 7.068 0.446 738 HG3 LYS 751 HG3 LYS 751 -13.840 7.466 1.539 739 HD2 LYS 751 HD2 LYS 751 -12.889 9.754 1.802 740 HD3 LYS 751 HD3 LYS 751 -11.652 9.341 0.625 741 HE2 LYS 751 HE2 LYS 751 -14.000 8.701 -0.690 742 HE3 LYS 751 HE3 LYS 751 -14.400 10.184 0.190 743 HZ1 LYS 751 HZ1 LYS 751 -12.183 11.067 -0.609 744 HZ2 LYS 751 HZ2 LYS 751 -12.151 9.715 -1.700 745 HZ3 LYS 751 HZ3 LYS 751 -13.402 10.887 -1.814 746 H ASP 752 H ASP 752 -12.211 4.537 0.599 747 HA ASP 752 HA ASP 752 -14.575 3.551 1.820 748 HB2 ASP 752 HB2 ASP 752 -14.592 3.074 -0.438 749 HB3 ASP 752 HB3 ASP 752 -12.859 2.776 -0.491 750 H CYS 753 H CYS 753 -11.251 2.487 1.780 751 HA CYS 753 HA CYS 753 -11.807 0.413 3.827 752 HB2 CYS 753 HB2 CYS 753 -10.061 0.509 1.470 753 HB3 CYS 753 HB3 CYS 753 -9.265 -0.042 2.929 754 HG CYS 753 HG CYS 753 -11.162 -1.696 1.326 755 H PHE 754 H PHE 754 -9.388 2.686 2.633 756 HA PHE 754 HA PHE 754 -7.716 2.647 4.847 757 HB2 PHE 754 HB2 PHE 754 -8.262 4.699 2.729 758 HB3 PHE 754 HB3 PHE 754 -7.111 5.004 4.031 759 HD1 PHE 754 HD2 PHE 754 -7.966 2.116 1.760 760 HD2 PHE 754 HD1 PHE 754 -4.896 4.561 3.503 761 HE1 PHE 754 HE2 PHE 754 -6.239 0.797 0.572 762 HE2 PHE 754 HE1 PHE 754 -3.176 3.244 2.314 763 HZ PHE 754 HZ PHE 754 -3.843 1.363 0.848 764 H LYS 755 H LYS 755 -7.465 4.196 6.594 765 HA LYS 755 HA LYS 755 -10.075 4.901 7.653 766 HB2 LYS 755 HB2 LYS 755 -7.672 5.661 9.189 767 HB3 LYS 755 HB3 LYS 755 -9.122 4.807 9.702 768 HG2 LYS 755 HG2 LYS 755 -6.801 3.628 8.134 769 HG3 LYS 755 HG3 LYS 755 -7.213 3.280 9.805 770 HD2 LYS 755 HD2 LYS 755 -9.545 2.574 8.751 771 HD3 LYS 755 HD3 LYS 755 -8.574 2.382 7.292 772 HE2 LYS 755 HE2 LYS 755 -7.463 0.557 8.101 773 HE3 LYS 755 HE3 LYS 755 -7.394 1.201 9.741 774 HZ1 LYS 755 HZ1 LYS 755 -8.830 -0.747 9.679 775 HZ2 LYS 755 HZ2 LYS 755 -9.767 0.657 10.006 776 HZ3 LYS 755 HZ3 LYS 755 -9.791 -0.042 8.433 777 H SER 756 H SER 756 -7.035 6.804 7.487 778 HA SER 756 HA SER 756 -8.678 9.236 7.328 779 HB2 SER 756 HB2 SER 756 -5.722 8.879 7.826 780 HB3 SER 756 HB3 SER 756 -6.557 10.430 7.782 781 HG SER 756 HG SER 756 -6.250 9.080 9.876 782 H LEU 757 H LEU 757 -7.244 7.136 5.229 783 HA LEU 757 HA LEU 757 -6.063 8.939 3.333 784 HB2 LEU 757 HB2 LEU 757 -5.785 6.345 3.715 785 HB3 LEU 757 HB3 LEU 757 -7.132 6.253 2.587 786 HG LEU 757 HG LEU 757 -5.133 6.101 1.300 787 HD11 LEU 757 HD11 LEU 757 -6.995 7.668 0.539 788 HD12 LEU 757 HD12 LEU 757 -5.939 8.982 1.057 789 HD13 LEU 757 HD13 LEU 757 -5.413 7.878 -0.210 790 HD21 LEU 757 HD21 LEU 757 -4.241 8.647 2.651 791 HD22 LEU 757 HD22 LEU 757 -3.632 7.031 3.034 792 HD23 LEU 757 HD23 LEU 757 -3.343 7.738 1.441 793 H ASP 758 H ASP 758 -7.358 10.468 2.380 794 HA ASP 758 HA ASP 758 -9.952 9.526 1.339 795 HB2 ASP 758 HB2 ASP 758 -9.936 11.389 3.098 796 HB3 ASP 758 HB3 ASP 758 -9.280 12.422 1.833 797 H THR 759 H THR 759 -8.605 8.724 -0.475 798 HA THR 759 HA THR 759 -8.919 10.481 -2.683 799 HB THR 759 HB THR 759 -6.761 11.397 -1.852 800 HG1 THR 759 HG1 THR 759 -6.033 11.531 -3.874 801 HG21 THR 759 HG21 THR 759 -5.396 9.803 -0.954 802 HG22 THR 759 HG22 THR 759 -6.036 8.527 -1.990 803 HG23 THR 759 HG23 THR 759 -4.834 9.652 -2.617 804 H THR 760 H THR 760 -7.229 9.289 -4.536 805 HA THR 760 HA THR 760 -8.046 6.434 -4.417 806 HB THR 760 HB THR 760 -8.361 6.622 -6.929 807 HG1 THR 760 HG1 THR 760 -8.908 8.917 -7.445 808 HG21 THR 760 HG21 THR 760 -10.597 7.713 -6.697 809 HG22 THR 760 HG22 THR 760 -10.278 6.506 -5.452 810 HG23 THR 760 HG23 THR 760 -10.136 8.222 -5.071 811 H LEU 761 H LEU 761 -6.864 5.102 -6.067 812 HA LEU 761 HA LEU 761 -4.045 5.419 -5.707 813 HB2 LEU 761 HB2 LEU 761 -5.709 3.532 -7.397 814 HB3 LEU 761 HB3 LEU 761 -3.953 3.465 -7.349 815 HG LEU 761 HG LEU 761 -4.992 1.856 -5.760 816 HD11 LEU 761 HD11 LEU 761 -3.054 2.217 -4.675 817 HD12 LEU 761 HD12 LEU 761 -3.068 3.926 -5.103 818 HD13 LEU 761 HD13 LEU 761 -3.913 3.372 -3.662 819 HD21 LEU 761 HD21 LEU 761 -6.982 3.394 -5.315 820 HD22 LEU 761 HD22 LEU 761 -6.294 2.585 -3.908 821 HD23 LEU 761 HD23 LEU 761 -5.924 4.279 -4.217 822 H GLN 762 H GLN 762 -3.910 7.588 -6.550 823 HA GLN 762 HA GLN 762 -4.544 8.373 -9.154 824 HB2 GLN 762 HB2 GLN 762 -2.464 9.329 -7.197 825 HB3 GLN 762 HB3 GLN 762 -2.660 10.081 -8.776 826 HG2 GLN 762 HG2 GLN 762 -5.272 9.852 -7.776 827 HG3 GLN 762 HG3 GLN 762 -4.311 10.368 -6.395 828 HE21 GLN 762 HE21 GLN 762 -2.719 12.294 -6.979 829 HE22 GLN 762 HE22 GLN 762 -3.377 13.491 -7.988 830 H PHE 763 H PHE 763 -1.274 7.486 -8.003 831 HA PHE 763 HA PHE 763 -0.780 6.060 -10.486 832 HB2 PHE 763 HB2 PHE 763 1.495 7.703 -10.335 833 HB3 PHE 763 HB3 PHE 763 0.249 7.722 -11.576 834 HD1 PHE 763 HD1 PHE 763 1.311 9.237 -8.348 835 HD2 PHE 763 HD2 PHE 763 -1.376 9.479 -11.690 836 HE1 PHE 763 HE1 PHE 763 0.622 11.502 -7.626 837 HE2 PHE 763 HE2 PHE 763 -2.064 11.750 -10.968 838 HZ PHE 763 HZ PHE 763 -1.065 12.760 -8.937 839 HA PRO 764 HA PRO 764 1.862 3.730 -7.839 840 HB2 PRO 764 HB2 PRO 764 3.469 2.537 -9.694 841 HB3 PRO 764 HB3 PRO 764 1.767 2.085 -9.461 842 HG2 PRO 764 HG2 PRO 764 3.005 3.804 -11.552 843 HG3 PRO 764 HG3 PRO 764 1.687 2.628 -11.692 844 HD2 PRO 764 HD2 PRO 764 1.291 5.352 -11.551 845 HD3 PRO 764 HD3 PRO 764 0.085 4.151 -11.040 846 H PHE 765 H PHE 765 3.988 3.707 -6.946 847 HA PHE 765 HA PHE 765 5.440 6.146 -7.218 848 HB2 PHE 765 HB2 PHE 765 6.710 5.412 -5.429 849 HB3 PHE 765 HB3 PHE 765 5.232 4.484 -5.200 850 HD1 PHE 765 HD1 PHE 765 5.146 2.129 -6.342 851 HD2 PHE 765 HD2 PHE 765 8.768 4.308 -5.590 852 HE1 PHE 765 HE1 PHE 765 6.443 0.030 -6.516 853 HE2 PHE 765 HE2 PHE 765 10.069 2.205 -5.762 854 HZ PHE 765 HZ PHE 765 8.905 0.065 -6.225 855 H LYS 766 H LYS 766 5.637 3.138 -8.887 856 HA LYS 766 HA LYS 766 8.397 3.406 -9.704 857 HB2 LYS 766 HB2 LYS 766 6.142 1.561 -10.403 858 HB3 LYS 766 HB3 LYS 766 7.629 1.561 -11.345 859 HG2 LYS 766 HG2 LYS 766 8.314 1.581 -8.565 860 HG3 LYS 766 HG3 LYS 766 7.152 0.288 -8.851 861 HD2 LYS 766 HD2 LYS 766 9.356 -0.625 -9.245 862 HD3 LYS 766 HD3 LYS 766 8.569 -0.443 -10.811 863 HE2 LYS 766 HE2 LYS 766 10.079 1.929 -9.894 864 HE3 LYS 766 HE3 LYS 766 11.068 0.511 -10.241 865 HZ1 LYS 766 HZ1 LYS 766 9.615 2.228 -12.044 866 HZ2 LYS 766 HZ2 LYS 766 10.917 1.174 -12.356 867 HZ3 LYS 766 HZ3 LYS 766 9.329 0.573 -12.315 868 H GLU 767 H GLU 767 5.369 4.598 -10.868 869 HA GLU 767 HA GLU 767 5.790 4.726 -13.616 870 HB2 GLU 767 HB2 GLU 767 3.947 5.829 -11.753 871 HB3 GLU 767 HB3 GLU 767 4.528 7.158 -12.755 872 HG2 GLU 767 HG2 GLU 767 4.140 5.346 -14.697 873 HG3 GLU 767 HG3 GLU 767 2.958 4.742 -13.538 874 H1 ASP 338 H1 ASP 338 14.556 2.471 6.020 875 H2 ASP 338 H2 ASP 338 15.020 3.228 7.486 876 H3 ASP 338 H3 ASP 338 13.836 2.010 7.494 877 HA ASP 338 HA ASP 338 16.304 1.134 6.324 878 HB2 ASP 338 HB2 ASP 338 17.406 1.025 8.631 879 HB3 ASP 338 HB3 ASP 338 17.350 2.626 7.890 880 H THR 339 H THR 339 15.626 0.432 9.616 881 HA THR 339 HA THR 339 15.110 -2.300 9.254 882 HB THR 339 HB THR 339 14.213 -2.121 11.628 883 HG1 THR 339 HG1 THR 339 15.014 0.594 11.265 884 HG21 THR 339 HG21 THR 339 16.630 -2.474 11.041 885 HG22 THR 339 HG22 THR 339 16.854 -0.726 11.119 886 HG23 THR 339 HG23 THR 339 16.389 -1.620 12.566 887 H GLU 340 H GLU 340 12.762 -0.009 10.588 888 HA GLU 340 HA GLU 340 10.489 -1.552 10.158 889 HB2 GLU 340 HB2 GLU 340 9.239 0.338 10.767 890 HB3 GLU 340 HB3 GLU 340 10.792 0.586 11.560 891 HG2 GLU 340 HG2 GLU 340 10.979 2.566 10.499 892 HG3 GLU 340 HG3 GLU 340 11.034 1.713 8.962 893 H VAL 341 H VAL 341 8.777 -1.428 8.645 894 HA VAL 341 HA VAL 341 9.574 -0.375 5.999 895 HB VAL 341 HB VAL 341 8.225 -2.322 5.074 896 HG11 VAL 341 HG11 VAL 341 10.161 -3.585 4.963 897 HG12 VAL 341 HG12 VAL 341 10.846 -2.088 5.589 898 HG13 VAL 341 HG13 VAL 341 10.490 -3.421 6.687 899 HG21 VAL 341 HG21 VAL 341 8.729 -3.729 7.658 900 HG22 VAL 341 HG22 VAL 341 7.331 -2.658 7.592 901 HG23 VAL 341 HG23 VAL 341 7.466 -4.005 6.461 902 H TYR 342 H TYR 342 7.372 -0.232 8.482 903 HA TYR 342 HA TYR 342 5.839 1.808 7.844 904 HB2 TYR 342 HB2 TYR 342 3.661 0.790 6.922 905 HB3 TYR 342 HB3 TYR 342 4.964 1.119 5.792 906 HD1 TYR 342 HD2 TYR 342 5.355 -1.768 8.044 907 HD2 TYR 342 HD1 TYR 342 3.902 -0.443 4.226 908 HE1 TYR 342 HE2 TYR 342 5.286 -4.117 7.247 909 HE2 TYR 342 HE1 TYR 342 3.824 -2.779 3.442 910 HH TYR 342 HH TYR 342 4.085 -5.455 5.498 911 H GLU 343 H GLU 343 3.363 1.519 8.736 912 HA GLU 343 HA GLU 343 3.587 -0.217 11.119 913 HB2 GLU 343 HB2 GLU 343 3.992 2.403 11.338 914 HB3 GLU 343 HB3 GLU 343 2.232 2.428 11.403 915 HG2 GLU 343 HG2 GLU 343 3.940 0.619 13.138 916 HG3 GLU 343 HG3 GLU 343 3.371 2.201 13.659 917 H SER 344 H SER 344 0.935 1.436 11.753 918 HA SER 344 HA SER 344 -0.918 0.048 9.962 919 HB2 SER 344 HB2 SER 344 -1.391 -0.357 12.879 920 HB3 SER 344 HB3 SER 344 -1.800 -1.397 11.518 921 HG SER 344 HG SER 344 0.724 -1.008 12.816 922 HA PRO 345 HA PRO 345 -1.917 4.502 11.449 923 HB2 PRO 345 HB2 PRO 345 -2.947 4.242 8.617 924 HB3 PRO 345 HB3 PRO 345 -2.280 5.670 9.441 925 HG2 PRO 345 HG2 PRO 345 -0.781 4.289 7.804 926 HG3 PRO 345 HG3 PRO 345 -0.113 4.884 9.330 927 HD2 PRO 345 HD2 PRO 345 -0.851 2.083 8.580 928 HD3 PRO 345 HD3 PRO 345 0.412 2.660 9.690 929 H PTR 346 H PTR 346 -3.641 4.754 12.644 930 HA PTR 346 HA PTR 346 -5.666 4.382 13.653 931 HB2 PTR 346 HB2 PTR 346 -7.116 5.655 12.530 932 HB3 PTR 346 HB3 PTR 346 -7.255 4.479 11.232 933 HD1 PTR 346 HD1 PTR 346 -5.622 4.519 9.326 934 HD2 PTR 346 HD2 PTR 346 -5.667 7.558 12.352 935 HE1 PTR 346 HE1 PTR 346 -4.281 5.978 7.844 936 HE2 PTR 346 HE2 PTR 346 -4.317 9.028 10.884 937 H ALA 347 H ALA 347 -8.063 3.371 12.593 938 HA ALA 347 HA ALA 347 -7.793 0.619 11.740 939 HB1 ALA 347 HB1 ALA 347 -7.331 1.040 14.435 940 HB2 ALA 347 HB2 ALA 347 -7.878 -0.474 13.718 941 HB3 ALA 347 HB3 ALA 347 -9.053 0.654 14.393 942 H ASP 348 H ASP 348 -9.903 2.619 13.788 943 HA ASP 348 HA ASP 348 -11.910 3.676 12.999 944 HB2 ASP 348 HB2 ASP 348 -11.617 2.671 10.706 945 HB3 ASP 348 HB3 ASP 348 -12.355 1.198 11.325 946 HA PRO 349 HA PRO 349 -13.533 0.759 16.129 947 HB2 PRO 349 HB2 PRO 349 -13.298 2.326 18.301 948 HB3 PRO 349 HB3 PRO 349 -11.891 1.497 17.607 949 HG2 PRO 349 HG2 PRO 349 -12.646 4.354 17.485 950 HG3 PRO 349 HG3 PRO 349 -11.043 3.605 17.452 951 HD2 PRO 349 HD2 PRO 349 -12.568 4.525 15.205 952 HD3 PRO 349 HD3 PRO 349 -11.013 3.660 15.171 953 H GLU 350 H GLU 350 -15.701 0.708 15.581 954 HA GLU 350 HA GLU 350 -17.329 3.128 15.772 955 HB2 GLU 350 HB2 GLU 350 -19.168 1.531 15.026 956 HB3 GLU 350 HB3 GLU 350 -17.842 1.772 13.889 957 HG2 GLU 350 HG2 GLU 350 -17.672 -0.475 15.878 958 HG3 GLU 350 HG3 GLU 350 -18.674 -0.672 14.442 Start of MODEL 14 1 H1 GLY 661 H1 GLY 661 0.669 -12.212 -9.834 2 H2 GLY 661 H2 GLY 661 2.298 -11.747 -9.643 3 H3 GLY 661 H3 GLY 661 1.774 -13.288 -9.109 4 HA2 GLY 661 HA2 GLY 661 1.544 -12.515 -11.963 5 HA3 GLY 661 HA3 GLY 661 3.038 -13.199 -11.312 6 H HIS 662 H HIS 662 3.091 -15.353 -10.653 7 HA HIS 662 HA HIS 662 1.252 -17.130 -11.900 8 HB2 HIS 662 HB2 HIS 662 2.973 -18.005 -9.602 9 HB3 HIS 662 HB3 HIS 662 2.614 -18.840 -11.112 10 HD1 HIS 662 HD1 HIS 662 4.667 -15.944 -9.748 11 HD2 HIS 662 HD2 HIS 662 4.444 -18.353 -13.171 12 HE1 HIS 662 HE1 HIS 662 6.695 -15.375 -11.190 13 HE2 HIS 662 HE2 HIS 662 6.568 -16.833 -13.268 14 H MET 663 H MET 663 1.524 -15.707 -8.715 15 HA MET 663 HA MET 663 -1.202 -16.528 -8.100 16 HB2 MET 663 HB2 MET 663 0.174 -18.403 -7.239 17 HB3 MET 663 HB3 MET 663 1.063 -17.259 -6.232 18 HG2 MET 663 HG2 MET 663 -0.551 -17.899 -4.702 19 HG3 MET 663 HG3 MET 663 -1.429 -16.583 -5.480 20 HE1 MET 663 HE1 MET 663 -3.334 -17.531 -4.387 21 HE2 MET 663 HE2 MET 663 -4.381 -18.789 -5.038 22 HE3 MET 663 HE3 MET 663 -3.044 -19.215 -3.960 23 H GLN 664 H GLN 664 0.793 -15.726 -5.431 24 HA GLN 664 HA GLN 664 -0.548 -13.151 -5.206 25 HB2 GLN 664 HB2 GLN 664 -0.062 -13.238 -2.937 26 HB3 GLN 664 HB3 GLN 664 -0.193 -14.946 -3.342 27 HG2 GLN 664 HG2 GLN 664 2.492 -13.574 -3.465 28 HG3 GLN 664 HG3 GLN 664 1.848 -14.131 -1.928 29 HE21 GLN 664 HE21 GLN 664 3.532 -15.783 -1.778 30 HE22 GLN 664 HE22 GLN 664 3.463 -17.175 -2.746 31 H ASP 665 H ASP 665 1.892 -13.879 -7.040 32 HA ASP 665 HA ASP 665 3.993 -12.166 -6.119 33 HB2 ASP 665 HB2 ASP 665 4.108 -12.398 -8.952 34 HB3 ASP 665 HB3 ASP 665 5.112 -13.187 -7.754 35 H LEU 666 H LEU 666 2.947 -10.203 -5.594 36 HA LEU 666 HA LEU 666 1.486 -8.709 -7.595 37 HB2 LEU 666 HB2 LEU 666 2.649 -7.512 -5.086 38 HB3 LEU 666 HB3 LEU 666 1.202 -7.034 -5.961 39 HG LEU 666 HG LEU 666 1.386 -9.772 -4.721 40 HD11 LEU 666 HD11 LEU 666 1.079 -7.152 -3.359 41 HD12 LEU 666 HD12 LEU 666 -0.062 -8.413 -2.892 42 HD13 LEU 666 HD13 LEU 666 1.671 -8.690 -2.728 43 HD21 LEU 666 HD21 LEU 666 -0.811 -7.886 -5.584 44 HD22 LEU 666 HD22 LEU 666 -0.483 -9.515 -6.173 45 HD23 LEU 666 HD23 LEU 666 -1.130 -9.279 -4.549 46 H SER 667 H SER 667 4.777 -9.091 -6.688 47 HA SER 667 HA SER 667 6.030 -6.735 -7.327 48 HB2 SER 667 HB2 SER 667 6.994 -9.465 -8.178 49 HB3 SER 667 HB3 SER 667 7.981 -8.051 -7.835 50 HG SER 667 HG SER 667 7.945 -8.657 -5.834 51 H VAL 668 H VAL 668 4.298 -8.842 -9.449 52 HA VAL 668 HA VAL 668 5.510 -8.075 -11.894 53 HB VAL 668 HB VAL 668 3.562 -9.020 -12.975 54 HG11 VAL 668 HG11 VAL 668 5.202 -10.508 -11.666 55 HG12 VAL 668 HG12 VAL 668 3.942 -10.620 -10.440 56 HG13 VAL 668 HG13 VAL 668 3.640 -11.218 -12.070 57 HG21 VAL 668 HG21 VAL 668 2.311 -8.631 -10.248 58 HG22 VAL 668 HG22 VAL 668 1.729 -8.055 -11.810 59 HG23 VAL 668 HG23 VAL 668 1.640 -9.771 -11.415 60 H HIS 669 H HIS 669 3.441 -6.405 -9.726 61 HA HIS 669 HA HIS 669 2.289 -4.621 -11.699 62 HB2 HIS 669 HB2 HIS 669 2.354 -4.484 -8.678 63 HB3 HIS 669 HB3 HIS 669 1.443 -3.393 -9.721 64 HD1 HIS 669 HD1 HIS 669 0.079 -5.074 -11.685 65 HD2 HIS 669 HD2 HIS 669 0.596 -6.378 -7.769 66 HE1 HIS 669 HE1 HIS 669 -1.734 -6.786 -11.266 67 HE2 HIS 669 HE2 HIS 669 -1.524 -7.508 -8.830 68 H LEU 670 H LEU 670 2.469 -2.243 -11.340 69 HA LEU 670 HA LEU 670 5.290 -1.491 -11.342 70 HB2 LEU 670 HB2 LEU 670 3.913 -0.723 -13.198 71 HB3 LEU 670 HB3 LEU 670 2.761 0.009 -12.089 72 HG LEU 670 HG LEU 670 4.562 1.552 -11.295 73 HD11 LEU 670 HD11 LEU 670 6.573 1.742 -12.839 74 HD12 LEU 670 HD12 LEU 670 6.571 0.324 -11.777 75 HD13 LEU 670 HD13 LEU 670 6.126 0.154 -13.477 76 HD21 LEU 670 HD21 LEU 670 4.263 1.623 -14.304 77 HD22 LEU 670 HD22 LEU 670 2.971 2.084 -13.198 78 HD23 LEU 670 HD23 LEU 670 4.483 2.991 -13.214 79 H TRP 671 H TRP 671 2.483 -1.311 -9.277 80 HA TRP 671 HA TRP 671 3.659 0.844 -7.702 81 HB2 TRP 671 HB2 TRP 671 1.586 0.337 -6.205 82 HB3 TRP 671 HB3 TRP 671 1.388 1.196 -7.721 83 HD1 TRP 671 HD1 TRP 671 -0.130 0.140 -9.516 84 HE1 TRP 671 HE1 TRP 671 -1.595 -2.005 -9.626 85 HE3 TRP 671 HE3 TRP 671 1.624 -2.304 -5.384 86 HZ2 TRP 671 HZ2 TRP 671 -1.922 -4.435 -8.151 87 HZ3 TRP 671 HZ3 TRP 671 0.719 -4.526 -4.759 88 HH2 TRP 671 HH2 TRP 671 -1.048 -5.590 -6.137 89 H TYR 672 H TYR 672 4.357 -2.296 -7.919 90 HA TYR 672 HA TYR 672 4.521 -2.804 -5.038 91 HB2 TYR 672 HB2 TYR 672 3.896 -4.522 -6.967 92 HB3 TYR 672 HB3 TYR 672 5.649 -4.717 -7.026 93 HD1 TYR 672 HD2 TYR 672 2.879 -4.463 -4.513 94 HD2 TYR 672 HD1 TYR 672 6.637 -6.252 -5.562 95 HE1 TYR 672 HE2 TYR 672 2.790 -5.857 -2.461 96 HE2 TYR 672 HE1 TYR 672 6.544 -7.648 -3.516 97 HH TYR 672 HH TYR 672 3.961 -8.308 -1.867 98 H ALA 673 H ALA 673 6.191 -1.908 -4.012 99 HA ALA 673 HA ALA 673 8.741 -1.524 -5.404 100 HB1 ALA 673 HB1 ALA 673 9.357 -0.120 -3.600 101 HB2 ALA 673 HB2 ALA 673 8.147 -0.826 -2.532 102 HB3 ALA 673 HB3 ALA 673 7.645 0.206 -3.867 103 H GLY 674 H GLY 674 7.265 -3.964 -3.774 104 HA2 GLY 674 HA2 GLY 674 7.934 -5.860 -2.640 105 HA3 GLY 674 HA3 GLY 674 9.263 -5.812 -3.781 106 HA PRO 675 HA PRO 675 11.850 -5.694 -0.183 107 HB2 PRO 675 HB2 PRO 675 14.203 -5.007 -1.417 108 HB3 PRO 675 HB3 PRO 675 13.496 -6.634 -1.473 109 HG2 PRO 675 HG2 PRO 675 13.401 -4.458 -3.505 110 HG3 PRO 675 HG3 PRO 675 13.622 -6.201 -3.728 111 HD2 PRO 675 HD2 PRO 675 11.236 -4.961 -4.166 112 HD3 PRO 675 HD3 PRO 675 11.350 -6.644 -3.600 113 H MET 676 H MET 676 10.280 -3.344 -0.536 114 HA MET 676 HA MET 676 12.221 -1.197 0.123 115 HB2 MET 676 HB2 MET 676 10.804 -0.722 -1.848 116 HB3 MET 676 HB3 MET 676 9.365 -0.949 -0.859 117 HG2 MET 676 HG2 MET 676 10.159 1.474 -1.202 118 HG3 MET 676 HG3 MET 676 9.835 0.975 0.457 119 HE1 MET 676 HE1 MET 676 12.562 1.039 -2.302 120 HE2 MET 676 HE2 MET 676 12.126 2.683 -1.847 121 HE3 MET 676 HE3 MET 676 13.760 2.077 -1.539 122 H GLU 677 H GLU 677 11.649 0.233 1.899 123 HA GLU 677 HA GLU 677 9.905 -1.110 3.876 124 HB2 GLU 677 HB2 GLU 677 11.250 0.148 5.586 125 HB3 GLU 677 HB3 GLU 677 12.153 -1.076 4.698 126 HG2 GLU 677 HG2 GLU 677 13.339 0.506 3.450 127 HG3 GLU 677 HG3 GLU 677 12.123 1.753 3.686 128 H ARG 678 H ARG 678 8.525 0.149 5.156 129 HA ARG 678 HA ARG 678 6.917 1.998 4.005 130 HB2 ARG 678 HB2 ARG 678 6.483 0.978 6.182 131 HB3 ARG 678 HB3 ARG 678 7.758 1.953 6.911 132 HG2 ARG 678 HG2 ARG 678 6.216 3.871 5.669 133 HG3 ARG 678 HG3 ARG 678 5.000 2.705 6.193 134 HD2 ARG 678 HD2 ARG 678 5.201 4.031 8.106 135 HD3 ARG 678 HD3 ARG 678 6.349 2.744 8.457 136 HE ARG 678 HE ARG 678 8.058 4.324 8.366 137 HH11 ARG 678 HH21 ARG 678 5.267 5.418 6.685 138 HH12 ARG 678 HH22 ARG 678 5.919 6.983 6.309 139 HH21 ARG 678 HH11 ARG 678 8.907 6.337 7.915 140 HH22 ARG 678 HH12 ARG 678 8.004 7.498 6.964 141 H ALA 679 H ALA 679 9.513 2.976 6.256 142 HA ALA 679 HA ALA 679 9.431 5.716 5.821 143 HB1 ALA 679 HB1 ALA 679 10.917 5.360 7.494 144 HB2 ALA 679 HB2 ALA 679 12.111 5.225 6.203 145 HB3 ALA 679 HB3 ALA 679 11.364 3.772 6.872 146 H GLY 680 H GLY 680 11.242 3.237 4.093 147 HA2 GLY 680 HA2 GLY 680 12.611 4.952 2.302 148 HA3 GLY 680 HA3 GLY 680 12.336 3.230 2.061 149 H ALA 681 H ALA 681 9.563 3.153 2.081 150 HA ALA 681 HA ALA 681 8.887 3.678 -0.567 151 HB1 ALA 681 HB1 ALA 681 7.467 2.927 1.873 152 HB2 ALA 681 HB2 ALA 681 7.204 2.396 0.213 153 HB3 ALA 681 HB3 ALA 681 6.471 3.894 0.786 154 H GLU 682 H GLU 682 8.764 5.781 2.239 155 HA GLU 682 HA GLU 682 7.192 7.860 1.087 156 HB2 GLU 682 HB2 GLU 682 9.293 8.338 3.189 157 HB3 GLU 682 HB3 GLU 682 7.731 9.129 2.986 158 HG2 GLU 682 HG2 GLU 682 6.837 6.648 3.366 159 HG3 GLU 682 HG3 GLU 682 8.364 6.472 4.198 160 H SER 683 H SER 683 10.632 7.142 1.132 161 HA SER 683 HA SER 683 11.794 9.503 0.356 162 HB2 SER 683 HB2 SER 683 13.548 8.176 -0.667 163 HB3 SER 683 HB3 SER 683 12.994 7.361 0.795 164 HG SER 683 HG SER 683 11.777 5.965 -0.458 165 H ILE 684 H ILE 684 10.557 7.017 -1.837 166 HA ILE 684 HA ILE 684 10.822 8.667 -4.173 167 HB ILE 684 HB ILE 684 9.002 6.274 -3.946 168 HG12 ILE 684 HG12 ILE 684 11.519 5.410 -4.871 169 HG13 ILE 684 HG13 ILE 684 11.864 6.382 -3.441 170 HG21 ILE 684 HG21 ILE 684 8.896 7.368 -6.073 171 HG22 ILE 684 HG22 ILE 684 10.647 7.557 -6.140 172 HG23 ILE 684 HG23 ILE 684 9.926 5.957 -6.301 173 HD11 ILE 684 HD11 ILE 684 9.560 4.547 -3.159 174 HD12 ILE 684 HD12 ILE 684 11.124 3.754 -3.357 175 HD13 ILE 684 HD13 ILE 684 10.874 4.893 -2.035 176 H LEU 685 H LEU 685 8.074 7.576 -2.208 177 HA LEU 685 HA LEU 685 6.033 8.875 -3.601 178 HB2 LEU 685 HB2 LEU 685 6.302 8.148 -0.687 179 HB3 LEU 685 HB3 LEU 685 4.816 8.795 -1.382 180 HG LEU 685 HG LEU 685 6.247 6.298 -2.337 181 HD11 LEU 685 HD11 LEU 685 4.225 5.150 -1.394 182 HD12 LEU 685 HD12 LEU 685 5.239 5.905 -0.166 183 HD13 LEU 685 HD13 LEU 685 3.743 6.687 -0.678 184 HD21 LEU 685 HD21 LEU 685 5.083 7.092 -4.210 185 HD22 LEU 685 HD22 LEU 685 3.882 6.048 -3.452 186 HD23 LEU 685 HD23 LEU 685 3.794 7.794 -3.232 187 H ALA 686 H ALA 686 7.914 10.070 -0.772 188 HA ALA 686 HA ALA 686 6.670 12.558 -0.525 189 HB1 ALA 686 HB1 ALA 686 8.527 13.230 0.744 190 HB2 ALA 686 HB2 ALA 686 9.648 12.251 -0.202 191 HB3 ALA 686 HB3 ALA 686 8.534 11.477 0.923 192 H ASN 687 H ASN 687 9.260 11.510 -2.678 193 HA ASN 687 HA ASN 687 9.745 14.060 -3.886 194 HB2 ASN 687 HB2 ASN 687 11.545 12.711 -4.296 195 HB3 ASN 687 HB3 ASN 687 10.576 11.245 -4.326 196 HD21 ASN 687 HD21 ASN 687 11.573 14.035 -6.312 197 HD22 ASN 687 HD22 ASN 687 11.205 13.307 -7.798 198 H ARG 688 H ARG 688 7.732 11.268 -4.712 199 HA ARG 688 HA ARG 688 6.904 12.218 -7.248 200 HB2 ARG 688 HB2 ARG 688 6.464 9.919 -5.625 201 HB3 ARG 688 HB3 ARG 688 4.895 10.546 -6.120 202 HG2 ARG 688 HG2 ARG 688 5.414 9.211 -7.953 203 HG3 ARG 688 HG3 ARG 688 6.074 10.755 -8.484 204 HD2 ARG 688 HD2 ARG 688 8.275 10.037 -7.452 205 HD3 ARG 688 HD3 ARG 688 7.573 8.437 -7.252 206 HE ARG 688 HE ARG 688 7.218 8.479 -9.770 207 HH11 ARG 688 HH21 ARG 688 9.701 10.405 -8.229 208 HH12 ARG 688 HH22 ARG 688 10.690 10.430 -9.647 209 HH21 ARG 688 HH11 ARG 688 8.486 8.536 -11.550 210 HH22 ARG 688 HH12 ARG 688 10.006 9.377 -11.527 211 H SER 689 H SER 689 4.505 12.525 -7.715 212 HA SER 689 HA SER 689 3.690 14.883 -6.294 213 HB2 SER 689 HB2 SER 689 3.419 14.274 -8.836 214 HB3 SER 689 HB3 SER 689 1.919 13.526 -8.287 215 HG SER 689 HG SER 689 1.951 15.883 -8.903 216 H ASP 690 H ASP 690 1.489 15.236 -5.555 217 HA ASP 690 HA ASP 690 0.739 13.461 -3.510 218 HB2 ASP 690 HB2 ASP 690 0.005 16.039 -4.405 219 HB3 ASP 690 HB3 ASP 690 -1.479 15.094 -4.350 220 H GLY 691 H GLY 691 -0.374 11.624 -3.553 221 HA2 GLY 691 HA2 GLY 691 -2.423 10.449 -4.251 222 HA3 GLY 691 HA3 GLY 691 -2.143 11.070 -5.874 223 H THR 692 H THR 692 0.811 10.617 -5.419 224 HA THR 692 HA THR 692 1.125 8.183 -6.759 225 HB THR 692 HB THR 692 3.161 9.407 -4.888 226 HG1 THR 692 HG1 THR 692 2.589 11.080 -6.168 227 HG21 THR 692 HG21 THR 692 4.752 8.254 -6.133 228 HG22 THR 692 HG22 THR 692 3.416 7.107 -6.147 229 HG23 THR 692 HG23 THR 692 3.704 8.137 -7.548 230 H PHE 693 H PHE 693 1.343 6.072 -6.112 231 HA PHE 693 HA PHE 693 1.474 5.544 -3.210 232 HB2 PHE 693 HB2 PHE 693 -0.396 4.064 -3.261 233 HB3 PHE 693 HB3 PHE 693 -0.912 5.559 -4.037 234 HD1 PHE 693 HD1 PHE 693 -1.045 5.708 -6.526 235 HD2 PHE 693 HD2 PHE 693 -0.220 2.012 -4.501 236 HE1 PHE 693 HE1 PHE 693 -1.608 4.453 -8.590 237 HE2 PHE 693 HE2 PHE 693 -0.784 0.759 -6.561 238 HZ PHE 693 HZ PHE 693 -1.475 1.976 -8.607 239 H LEU 694 H LEU 694 1.797 3.210 -2.705 240 HA LEU 694 HA LEU 694 2.787 1.439 -4.724 241 HB2 LEU 694 HB2 LEU 694 5.116 1.442 -4.243 242 HB3 LEU 694 HB3 LEU 694 4.659 3.116 -4.509 243 HG LEU 694 HG LEU 694 4.234 3.007 -1.865 244 HD11 LEU 694 HD11 LEU 694 5.199 1.259 -0.822 245 HD12 LEU 694 HD12 LEU 694 5.499 0.536 -2.402 246 HD13 LEU 694 HD13 LEU 694 6.725 1.557 -1.652 247 HD21 LEU 694 HD21 LEU 694 6.472 3.992 -1.589 248 HD22 LEU 694 HD22 LEU 694 6.952 3.352 -3.159 249 HD23 LEU 694 HD23 LEU 694 5.704 4.590 -3.056 250 H VAL 695 H VAL 695 3.862 -0.469 -3.780 251 HA VAL 695 HA VAL 695 3.198 -0.990 -0.965 252 HB VAL 695 HB VAL 695 2.408 -2.986 -3.079 253 HG11 VAL 695 HG11 VAL 695 2.131 -2.628 -0.127 254 HG12 VAL 695 HG12 VAL 695 0.766 -3.359 -0.974 255 HG13 VAL 695 HG13 VAL 695 2.360 -4.105 -1.062 256 HG21 VAL 695 HG21 VAL 695 0.064 -2.130 -2.736 257 HG22 VAL 695 HG22 VAL 695 0.748 -0.753 -1.874 258 HG23 VAL 695 HG23 VAL 695 1.110 -0.990 -3.584 259 H ARG 696 H ARG 696 4.541 -2.451 0.008 260 HA ARG 696 HA ARG 696 6.476 -3.929 -1.622 261 HB2 ARG 696 HB2 ARG 696 8.168 -3.003 0.235 262 HB3 ARG 696 HB3 ARG 696 7.898 -2.176 -1.295 263 HG2 ARG 696 HG2 ARG 696 7.666 -0.512 0.412 264 HG3 ARG 696 HG3 ARG 696 6.041 -0.872 -0.130 265 HD2 ARG 696 HD2 ARG 696 6.300 -0.780 2.371 266 HD3 ARG 696 HD3 ARG 696 5.654 -2.301 1.768 267 HE ARG 696 HE ARG 696 8.567 -2.104 2.221 268 HH11 ARG 696 HH21 ARG 696 5.551 -3.651 2.845 269 HH12 ARG 696 HH22 ARG 696 6.134 -4.524 4.236 270 HH21 ARG 696 HH11 ARG 696 9.352 -3.369 3.877 271 HH22 ARG 696 HH12 ARG 696 8.300 -4.458 4.715 272 H GLN 697 H GLN 697 7.685 -5.498 -0.393 273 HA GLN 697 HA GLN 697 6.176 -6.462 1.957 274 HB2 GLN 697 HB2 GLN 697 6.168 -7.914 -0.088 275 HB3 GLN 697 HB3 GLN 697 7.916 -8.070 0.068 276 HG2 GLN 697 HG2 GLN 697 6.747 -9.980 1.121 277 HG3 GLN 697 HG3 GLN 697 7.641 -9.041 2.315 278 HE21 GLN 697 HE21 GLN 697 6.220 -9.610 4.090 279 HE22 GLN 697 HE22 GLN 697 4.618 -9.021 4.169 280 H ARG 698 H ARG 698 9.458 -6.906 0.621 281 HA ARG 698 HA ARG 698 11.538 -6.815 1.604 282 HB2 ARG 698 HB2 ARG 698 10.799 -4.528 2.266 283 HB3 ARG 698 HB3 ARG 698 10.143 -5.208 3.753 284 HG2 ARG 698 HG2 ARG 698 12.395 -6.068 4.343 285 HG3 ARG 698 HG3 ARG 698 13.048 -5.306 2.893 286 HD2 ARG 698 HD2 ARG 698 11.674 -3.222 4.039 287 HD3 ARG 698 HD3 ARG 698 12.237 -4.095 5.461 288 HE ARG 698 HE ARG 698 14.323 -3.198 5.029 289 HH11 ARG 698 HH21 ARG 698 12.587 -3.661 2.077 290 HH12 ARG 698 HH22 ARG 698 13.831 -3.011 1.058 291 HH21 ARG 698 HH11 ARG 698 15.944 -2.334 3.750 292 HH22 ARG 698 HH12 ARG 698 15.734 -2.255 2.017 293 H VAL 699 H VAL 699 9.035 -7.172 4.111 294 HA VAL 699 HA VAL 699 10.683 -9.127 5.530 295 HB VAL 699 HB VAL 699 7.901 -8.106 6.177 296 HG11 VAL 699 HG11 VAL 699 8.704 -8.853 8.511 297 HG12 VAL 699 HG12 VAL 699 8.269 -10.127 7.371 298 HG13 VAL 699 HG13 VAL 699 9.965 -9.743 7.658 299 HG21 VAL 699 HG21 VAL 699 9.544 -6.950 7.998 300 HG22 VAL 699 HG22 VAL 699 10.637 -7.002 6.615 301 HG23 VAL 699 HG23 VAL 699 9.088 -6.162 6.490 302 H LYS 700 H LYS 700 10.690 -11.122 4.734 303 HA LYS 700 HA LYS 700 8.390 -12.213 3.321 304 HB2 LYS 700 HB2 LYS 700 9.876 -14.148 2.911 305 HB3 LYS 700 HB3 LYS 700 10.641 -12.632 2.437 306 HG2 LYS 700 HG2 LYS 700 12.000 -12.597 4.414 307 HG3 LYS 700 HG3 LYS 700 11.074 -13.907 5.150 308 HD2 LYS 700 HD2 LYS 700 11.804 -15.295 3.074 309 HD3 LYS 700 HD3 LYS 700 13.030 -14.047 2.855 310 HE2 LYS 700 HE2 LYS 700 14.178 -15.555 4.212 311 HE3 LYS 700 HE3 LYS 700 13.481 -14.476 5.425 312 HZ1 LYS 700 HZ1 LYS 700 11.824 -16.716 4.548 313 HZ2 LYS 700 HZ2 LYS 700 13.166 -17.096 5.526 314 HZ3 LYS 700 HZ3 LYS 700 11.968 -16.014 6.100 315 H ASP 701 H ASP 701 8.143 -14.740 3.887 316 HA ASP 701 HA ASP 701 7.220 -16.270 5.318 317 HB2 ASP 701 HB2 ASP 701 8.706 -14.961 7.586 318 HB3 ASP 701 HB3 ASP 701 8.294 -16.659 7.375 319 H ALA 702 H ALA 702 7.400 -13.086 6.929 320 HA ALA 702 HA ALA 702 4.984 -13.479 8.422 321 HB1 ALA 702 HB1 ALA 702 5.288 -11.271 9.190 322 HB2 ALA 702 HB2 ALA 702 6.170 -10.793 7.739 323 HB3 ALA 702 HB3 ALA 702 6.927 -11.861 8.922 324 H ALA 703 H ALA 703 3.145 -13.821 7.326 325 HA ALA 703 HA ALA 703 2.507 -12.754 4.784 326 HB1 ALA 703 HB1 ALA 703 1.325 -14.537 6.681 327 HB2 ALA 703 HB2 ALA 703 0.934 -14.335 4.973 328 HB3 ALA 703 HB3 ALA 703 0.105 -13.365 6.191 329 H GLU 704 H GLU 704 3.376 -10.537 6.013 330 HA GLU 704 HA GLU 704 0.906 -8.988 6.570 331 HB2 GLU 704 HB2 GLU 704 2.270 -7.457 7.914 332 HB3 GLU 704 HB3 GLU 704 2.385 -9.103 8.535 333 HG2 GLU 704 HG2 GLU 704 4.624 -8.993 8.331 334 HG3 GLU 704 HG3 GLU 704 4.437 -8.830 6.589 335 H PHE 705 H PHE 705 0.523 -7.166 5.433 336 HA PHE 705 HA PHE 705 2.593 -6.102 3.640 337 HB2 PHE 705 HB2 PHE 705 -0.037 -6.324 2.334 338 HB3 PHE 705 HB3 PHE 705 1.571 -6.628 1.687 339 HD1 PHE 705 HD1 PHE 705 -1.173 -8.095 3.733 340 HD2 PHE 705 HD2 PHE 705 2.473 -8.837 1.588 341 HE1 PHE 705 HE1 PHE 705 -1.553 -10.536 3.933 342 HE2 PHE 705 HE2 PHE 705 2.097 -11.279 1.790 343 HZ PHE 705 HZ PHE 705 0.082 -12.130 2.962 344 H ALA 706 H ALA 706 1.904 -4.016 2.638 345 HA ALA 706 HA ALA 706 -0.337 -2.577 3.754 346 HB1 ALA 706 HB1 ALA 706 2.302 -1.397 4.494 347 HB2 ALA 706 HB2 ALA 706 1.623 -2.659 5.522 348 HB3 ALA 706 HB3 ALA 706 0.727 -1.165 5.245 349 H ILE 707 H ILE 707 -0.814 -0.757 2.565 350 HA ILE 707 HA ILE 707 0.887 -0.281 0.207 351 HB ILE 707 HB ILE 707 -1.897 0.758 0.771 352 HG12 ILE 707 HG12 ILE 707 -1.041 -1.632 -0.891 353 HG13 ILE 707 HG13 ILE 707 -1.787 -1.735 0.700 354 HG21 ILE 707 HG21 ILE 707 -1.388 2.044 -1.021 355 HG22 ILE 707 HG22 ILE 707 0.071 1.122 -1.374 356 HG23 ILE 707 HG23 ILE 707 -1.491 0.560 -1.966 357 HD11 ILE 707 HD11 ILE 707 -3.396 -2.001 -1.223 358 HD12 ILE 707 HD12 ILE 707 -3.812 -0.708 -0.099 359 HD13 ILE 707 HD13 ILE 707 -3.068 -0.322 -1.651 360 H SER 708 H SER 708 1.789 1.691 -0.270 361 HA SER 708 HA SER 708 1.552 3.774 1.838 362 HB2 SER 708 HB2 SER 708 3.927 3.150 0.070 363 HB3 SER 708 HB3 SER 708 3.852 4.428 1.280 364 HG SER 708 HG SER 708 3.560 1.625 1.730 365 H ILE 709 H ILE 709 0.546 5.576 1.170 366 HA ILE 709 HA ILE 709 0.725 6.288 -1.701 367 HB ILE 709 HB ILE 709 -1.687 6.942 -0.036 368 HG12 ILE 709 HG12 ILE 709 -2.529 4.799 -1.456 369 HG13 ILE 709 HG13 ILE 709 -0.864 4.307 -1.150 370 HG21 ILE 709 HG21 ILE 709 -0.836 7.186 -2.826 371 HG22 ILE 709 HG22 ILE 709 -2.394 6.375 -2.671 372 HG23 ILE 709 HG23 ILE 709 -2.164 7.982 -1.986 373 HD11 ILE 709 HD11 ILE 709 -1.579 3.619 0.881 374 HD12 ILE 709 HD12 ILE 709 -1.708 5.326 1.304 375 HD13 ILE 709 HD13 ILE 709 -3.120 4.458 0.698 376 H LYS 710 H LYS 710 0.918 8.372 -2.271 377 HA LYS 710 HA LYS 710 1.938 10.219 -0.265 378 HB2 LYS 710 HB2 LYS 710 3.058 10.048 -2.428 379 HB3 LYS 710 HB3 LYS 710 1.567 10.467 -3.262 380 HG2 LYS 710 HG2 LYS 710 2.715 12.515 -3.195 381 HG3 LYS 710 HG3 LYS 710 1.630 12.635 -1.811 382 HD2 LYS 710 HD2 LYS 710 3.350 12.272 -0.265 383 HD3 LYS 710 HD3 LYS 710 4.385 11.485 -1.451 384 HE2 LYS 710 HE2 LYS 710 3.625 14.342 -1.917 385 HE3 LYS 710 HE3 LYS 710 4.837 13.994 -0.683 386 HZ1 LYS 710 HZ1 LYS 710 5.659 12.412 -2.693 387 HZ2 LYS 710 HZ2 LYS 710 5.030 13.729 -3.582 388 HZ3 LYS 710 HZ3 LYS 710 6.260 13.993 -2.420 389 H TYR 711 H TYR 711 0.755 11.691 0.769 390 HA TYR 711 HA TYR 711 -1.627 12.850 -0.530 391 HB2 TYR 711 HB2 TYR 711 -2.014 10.811 1.178 392 HB3 TYR 711 HB3 TYR 711 -1.896 12.123 2.347 393 HD1 TYR 711 HD2 TYR 711 -3.122 14.398 0.975 394 HD2 TYR 711 HD1 TYR 711 -4.254 10.260 0.968 395 HE1 TYR 711 HE2 TYR 711 -5.462 15.040 0.463 396 HE2 TYR 711 HE1 TYR 711 -6.592 10.901 0.453 397 HH TYR 711 HH TYR 711 -7.927 12.651 -0.312 398 H ASN 712 H ASN 712 -1.360 14.990 -0.470 399 HA ASN 712 HA ASN 712 -0.727 17.092 0.213 400 HB2 ASN 712 HB2 ASN 712 -1.612 15.719 2.700 401 HB3 ASN 712 HB3 ASN 712 -0.724 17.227 2.898 402 HD21 ASN 712 HD21 ASN 712 -3.798 16.256 2.894 403 HD22 ASN 712 HD22 ASN 712 -4.543 17.552 2.092 404 H VAL 713 H VAL 713 1.407 16.151 -0.682 405 HA VAL 713 HA VAL 713 3.692 15.897 -0.545 406 HB VAL 713 HB VAL 713 4.870 17.667 0.557 407 HG11 VAL 713 HG11 VAL 713 2.557 18.107 -1.063 408 HG12 VAL 713 HG12 VAL 713 2.650 19.414 0.115 409 HG13 VAL 713 HG13 VAL 713 4.015 19.092 -0.953 410 HG21 VAL 713 HG21 VAL 713 2.358 18.430 2.055 411 HG22 VAL 713 HG22 VAL 713 3.555 17.342 2.758 412 HG23 VAL 713 HG23 VAL 713 4.005 18.991 2.327 413 H GLU 714 H GLU 714 1.977 14.317 1.338 414 HA GLU 714 HA GLU 714 4.154 13.344 3.058 415 HB2 GLU 714 HB2 GLU 714 1.609 14.497 3.906 416 HB3 GLU 714 HB3 GLU 714 1.857 12.867 4.538 417 HG2 GLU 714 HG2 GLU 714 4.088 14.875 4.625 418 HG3 GLU 714 HG3 GLU 714 2.837 14.896 5.864 419 H VAL 715 H VAL 715 3.661 11.089 3.892 420 HA VAL 715 HA VAL 715 2.163 9.616 1.795 421 HB VAL 715 HB VAL 715 4.562 8.670 3.365 422 HG11 VAL 715 HG11 VAL 715 4.513 6.890 1.546 423 HG12 VAL 715 HG12 VAL 715 3.211 6.792 2.728 424 HG13 VAL 715 HG13 VAL 715 2.903 7.475 1.135 425 HG21 VAL 715 HG21 VAL 715 5.462 10.241 1.889 426 HG22 VAL 715 HG22 VAL 715 5.496 8.778 0.913 427 HG23 VAL 715 HG23 VAL 715 4.214 9.960 0.673 428 H LYS 716 H LYS 716 0.853 7.926 2.325 429 HA LYS 716 HA LYS 716 0.369 7.491 5.226 430 HB2 LYS 716 HB2 LYS 716 -1.460 8.611 3.641 431 HB3 LYS 716 HB3 LYS 716 -1.772 6.930 3.221 432 HG2 LYS 716 HG2 LYS 716 -2.624 6.417 5.294 433 HG3 LYS 716 HG3 LYS 716 -1.491 7.481 6.128 434 HD2 LYS 716 HD2 LYS 716 -3.900 8.432 4.541 435 HD3 LYS 716 HD3 LYS 716 -3.847 8.292 6.286 436 HE2 LYS 716 HE2 LYS 716 -2.108 10.096 4.572 437 HE3 LYS 716 HE3 LYS 716 -3.405 10.604 5.653 438 HZ1 LYS 716 HZ1 LYS 716 -1.978 10.633 7.316 439 HZ2 LYS 716 HZ2 LYS 716 -1.643 8.984 7.109 440 HZ3 LYS 716 HZ3 LYS 716 -0.713 10.144 6.285 441 H HIS 717 H HIS 717 0.818 5.495 5.892 442 HA HIS 717 HA HIS 717 0.753 3.298 3.914 443 HB2 HIS 717 HB2 HIS 717 2.442 3.249 6.402 444 HB3 HIS 717 HB3 HIS 717 2.601 2.265 4.952 445 HD1 HIS 717 HD1 HIS 717 4.092 3.133 3.092 446 HD2 HIS 717 HD2 HIS 717 3.329 6.025 6.023 447 HE1 HIS 717 HE1 HIS 717 5.746 5.034 2.718 448 HE2 HIS 717 HE2 HIS 717 5.252 6.831 4.465 449 H ILE 718 H ILE 718 -1.086 2.168 4.275 450 HA ILE 718 HA ILE 718 -1.881 1.658 7.086 451 HB ILE 718 HB ILE 718 -3.408 2.010 4.554 452 HG12 ILE 718 HG12 ILE 718 -3.587 3.734 6.246 453 HG13 ILE 718 HG13 ILE 718 -5.116 2.875 6.166 454 HG21 ILE 718 HG21 ILE 718 -4.106 -0.040 6.656 455 HG22 ILE 718 HG22 ILE 718 -5.328 0.707 5.632 456 HG23 ILE 718 HG23 ILE 718 -4.040 -0.252 4.908 457 HD11 ILE 718 HD11 ILE 718 -4.951 2.475 8.358 458 HD12 ILE 718 HD12 ILE 718 -3.550 1.461 8.037 459 HD13 ILE 718 HD13 ILE 718 -3.334 3.171 8.405 460 H LYS 719 H LYS 719 -1.993 -0.426 7.814 461 HA LYS 719 HA LYS 719 -0.502 -2.407 6.388 462 HB2 LYS 719 HB2 LYS 719 -0.719 -3.736 8.347 463 HB3 LYS 719 HB3 LYS 719 -0.574 -2.072 8.909 464 HG2 LYS 719 HG2 LYS 719 -3.235 -3.489 8.520 465 HG3 LYS 719 HG3 LYS 719 -2.388 -3.398 10.063 466 HD2 LYS 719 HD2 LYS 719 -2.392 -0.855 9.761 467 HD3 LYS 719 HD3 LYS 719 -3.534 -1.112 8.444 468 HE2 LYS 719 HE2 LYS 719 -5.189 -1.162 9.965 469 HE3 LYS 719 HE3 LYS 719 -4.504 -2.664 10.587 470 HZ1 LYS 719 HZ1 LYS 719 -4.296 0.066 11.630 471 HZ2 LYS 719 HZ2 LYS 719 -4.337 -1.428 12.455 472 HZ3 LYS 719 HZ3 LYS 719 -2.870 -0.908 11.745 473 H ILE 720 H ILE 720 -1.171 -4.412 5.606 474 HA ILE 720 HA ILE 720 -4.033 -4.501 4.870 475 HB ILE 720 HB ILE 720 -1.596 -5.719 3.565 476 HG12 ILE 720 HG12 ILE 720 -3.665 -3.787 2.488 477 HG13 ILE 720 HG13 ILE 720 -2.162 -3.259 3.240 478 HG21 ILE 720 HG21 ILE 720 -3.409 -7.331 3.377 479 HG22 ILE 720 HG22 ILE 720 -4.549 -6.055 2.947 480 HG23 ILE 720 HG23 ILE 720 -3.256 -6.494 1.832 481 HD11 ILE 720 HD11 ILE 720 -0.939 -3.789 1.416 482 HD12 ILE 720 HD12 ILE 720 -1.768 -5.333 1.208 483 HD13 ILE 720 HD13 ILE 720 -2.486 -3.856 0.571 484 H MET 721 H MET 721 -5.277 -5.921 5.804 485 HA MET 721 HA MET 721 -4.089 -8.084 7.397 486 HB2 MET 721 HB2 MET 721 -6.203 -6.356 7.837 487 HB3 MET 721 HB3 MET 721 -7.008 -7.850 7.367 488 HG2 MET 721 HG2 MET 721 -6.667 -8.619 9.462 489 HG3 MET 721 HG3 MET 721 -4.933 -8.620 9.133 490 HE1 MET 721 HE1 MET 721 -4.738 -7.270 12.496 491 HE2 MET 721 HE2 MET 721 -4.631 -8.608 11.357 492 HE3 MET 721 HE3 MET 721 -3.473 -7.274 11.268 493 H THR 722 H THR 722 -5.771 -10.036 7.448 494 HA THR 722 HA THR 722 -6.832 -10.832 4.896 495 HB THR 722 HB THR 722 -4.382 -11.213 4.571 496 HG1 THR 722 HG1 THR 722 -5.792 -12.460 3.425 497 HG21 THR 722 HG21 THR 722 -3.995 -13.587 5.994 498 HG22 THR 722 HG22 THR 722 -3.239 -12.030 6.335 499 HG23 THR 722 HG23 THR 722 -4.722 -12.492 7.169 500 H ALA 723 H ALA 723 -7.120 -13.406 5.083 501 HA ALA 723 HA ALA 723 -7.724 -14.366 7.699 502 HB1 ALA 723 HB1 ALA 723 -9.755 -13.429 7.964 503 HB2 ALA 723 HB2 ALA 723 -10.308 -14.474 6.656 504 HB3 ALA 723 HB3 ALA 723 -9.770 -12.832 6.305 505 H GLU 724 H GLU 724 -9.628 -14.796 4.776 506 HA GLU 724 HA GLU 724 -8.922 -17.643 4.699 507 HB2 GLU 724 HB2 GLU 724 -10.798 -16.375 2.752 508 HB3 GLU 724 HB3 GLU 724 -10.909 -17.938 3.560 509 HG2 GLU 724 HG2 GLU 724 -12.556 -16.763 4.703 510 HG3 GLU 724 HG3 GLU 724 -11.166 -16.433 5.732 511 H GLY 725 H GLY 725 -7.015 -15.508 3.944 512 HA2 GLY 725 HA2 GLY 725 -5.236 -15.689 2.377 513 HA3 GLY 725 HA3 GLY 725 -6.325 -16.524 1.271 514 H LEU 726 H LEU 726 -8.035 -14.000 2.516 515 HA LEU 726 HA LEU 726 -7.770 -12.442 0.078 516 HB2 LEU 726 HB2 LEU 726 -9.510 -11.972 2.517 517 HB3 LEU 726 HB3 LEU 726 -9.638 -11.127 0.976 518 HG LEU 726 HG LEU 726 -9.936 -14.121 1.293 519 HD11 LEU 726 HD11 LEU 726 -11.847 -11.887 1.609 520 HD12 LEU 726 HD12 LEU 726 -12.395 -13.195 0.564 521 HD13 LEU 726 HD13 LEU 726 -11.932 -13.535 2.231 522 HD21 LEU 726 HD21 LEU 726 -9.349 -13.728 -0.943 523 HD22 LEU 726 HD22 LEU 726 -11.110 -13.670 -1.002 524 HD23 LEU 726 HD23 LEU 726 -10.181 -12.173 -0.984 525 H TYR 727 H TYR 727 -7.759 -10.003 0.325 526 HA TYR 727 HA TYR 727 -5.744 -9.192 2.365 527 HB2 TYR 727 HB2 TYR 727 -5.997 -8.214 -0.495 528 HB3 TYR 727 HB3 TYR 727 -4.807 -7.664 0.685 529 HD1 TYR 727 HD2 TYR 727 -6.048 -10.715 -1.079 530 HD2 TYR 727 HD1 TYR 727 -2.784 -8.851 1.003 531 HE1 TYR 727 HE2 TYR 727 -4.579 -12.624 -1.669 532 HE2 TYR 727 HE1 TYR 727 -1.315 -10.762 0.406 533 HH TYR 727 HH TYR 727 -2.360 -13.646 -0.528 534 H ARG 728 H ARG 728 -5.997 -7.208 3.345 535 HA ARG 728 HA ARG 728 -8.048 -5.365 2.459 536 HB2 ARG 728 HB2 ARG 728 -9.051 -5.566 4.899 537 HB3 ARG 728 HB3 ARG 728 -9.617 -6.587 3.577 538 HG2 ARG 728 HG2 ARG 728 -8.336 -8.453 4.301 539 HG3 ARG 728 HG3 ARG 728 -7.323 -7.454 5.338 540 HD2 ARG 728 HD2 ARG 728 -9.188 -7.069 6.859 541 HD3 ARG 728 HD3 ARG 728 -10.273 -7.939 5.786 542 HE ARG 728 HE ARG 728 -8.012 -9.518 6.652 543 HH11 ARG 728 HH21 ARG 728 -11.198 -8.414 7.379 544 HH12 ARG 728 HH22 ARG 728 -11.586 -9.775 8.373 545 HH21 ARG 728 HH11 ARG 728 -8.496 -11.284 7.964 546 HH22 ARG 728 HH12 ARG 728 -10.068 -11.389 8.699 547 H ILE 729 H ILE 729 -7.390 -3.387 2.890 548 HA ILE 729 HA ILE 729 -5.108 -2.876 4.559 549 HB ILE 729 HB ILE 729 -6.045 -0.406 4.102 550 HG12 ILE 729 HG12 ILE 729 -8.115 -1.539 3.057 551 HG13 ILE 729 HG13 ILE 729 -7.376 -0.203 2.180 552 HG21 ILE 729 HG21 ILE 729 -4.748 -1.998 1.885 553 HG22 ILE 729 HG22 ILE 729 -4.592 -0.276 2.223 554 HG23 ILE 729 HG23 ILE 729 -3.890 -1.457 3.324 555 HD11 ILE 729 HD11 ILE 729 -7.953 -2.684 1.135 556 HD12 ILE 729 HD12 ILE 729 -6.815 -1.530 0.442 557 HD13 ILE 729 HD13 ILE 729 -6.233 -2.822 1.492 558 H THR 730 H THR 730 -8.300 -3.384 5.165 559 HA THR 730 HA THR 730 -8.070 -2.258 7.841 560 HB THR 730 HB THR 730 -9.124 -0.582 6.153 561 HG1 THR 730 HG1 THR 730 -10.079 -1.347 8.709 562 HG21 THR 730 HG21 THR 730 -11.512 -0.864 5.797 563 HG22 THR 730 HG22 THR 730 -10.634 -2.238 5.123 564 HG23 THR 730 HG23 THR 730 -11.485 -2.398 6.659 565 H GLU 731 H GLU 731 -9.023 -3.479 9.297 566 HA GLU 731 HA GLU 731 -9.726 -6.104 8.927 567 HB2 GLU 731 HB2 GLU 731 -10.764 -5.937 11.161 568 HB3 GLU 731 HB3 GLU 731 -9.243 -5.035 11.103 569 HG2 GLU 731 HG2 GLU 731 -11.866 -3.670 10.515 570 HG3 GLU 731 HG3 GLU 731 -11.293 -3.858 12.165 571 H LYS 732 H LYS 732 -11.567 -3.313 8.207 572 HA LYS 732 HA LYS 732 -14.156 -4.588 8.284 573 HB2 LYS 732 HB2 LYS 732 -13.549 -1.921 7.049 574 HB3 LYS 732 HB3 LYS 732 -15.037 -2.467 7.830 575 HG2 LYS 732 HG2 LYS 732 -13.679 -2.707 9.968 576 HG3 LYS 732 HG3 LYS 732 -12.379 -1.858 9.136 577 HD2 LYS 732 HD2 LYS 732 -13.914 0.047 8.716 578 HD3 LYS 732 HD3 LYS 732 -15.172 -0.792 9.630 579 HE2 LYS 732 HE2 LYS 732 -13.918 -0.703 11.642 580 HE3 LYS 732 HE3 LYS 732 -12.443 -0.244 10.789 581 HZ1 LYS 732 HZ1 LYS 732 -14.460 1.426 11.855 582 HZ2 LYS 732 HZ2 LYS 732 -12.978 1.881 11.072 583 HZ3 LYS 732 HZ3 LYS 732 -14.406 1.628 10.156 584 H LYS 733 H LYS 733 -11.676 -4.566 5.936 585 HA LYS 733 HA LYS 733 -13.689 -5.034 3.788 586 HB2 LYS 733 HB2 LYS 733 -11.756 -3.063 3.830 587 HB3 LYS 733 HB3 LYS 733 -11.035 -4.319 2.824 588 HG2 LYS 733 HG2 LYS 733 -12.310 -2.960 1.327 589 HG3 LYS 733 HG3 LYS 733 -13.286 -4.406 1.588 590 HD2 LYS 733 HD2 LYS 733 -14.762 -2.508 1.786 591 HD3 LYS 733 HD3 LYS 733 -14.507 -3.134 3.416 592 HE2 LYS 733 HE2 LYS 733 -13.069 -1.371 4.003 593 HE3 LYS 733 HE3 LYS 733 -12.725 -0.976 2.320 594 HZ1 LYS 733 HZ1 LYS 733 -15.425 -0.674 3.496 595 HZ2 LYS 733 HZ2 LYS 733 -14.260 0.584 3.522 596 HZ3 LYS 733 HZ3 LYS 733 -14.835 -0.019 2.018 597 H ALA 734 H ALA 734 -12.210 -6.012 1.817 598 HA ALA 734 HA ALA 734 -10.338 -8.016 2.436 599 HB1 ALA 734 HB1 ALA 734 -12.349 -8.949 3.653 600 HB2 ALA 734 HB2 ALA 734 -11.639 -10.025 2.452 601 HB3 ALA 734 HB3 ALA 734 -13.119 -9.141 2.078 602 H PHE 735 H PHE 735 -9.368 -8.633 0.594 603 HA PHE 735 HA PHE 735 -10.903 -8.632 -1.935 604 HB2 PHE 735 HB2 PHE 735 -8.316 -7.182 -1.378 605 HB3 PHE 735 HB3 PHE 735 -8.745 -7.691 -3.017 606 HD1 PHE 735 HD2 PHE 735 -10.026 -5.753 -0.075 607 HD2 PHE 735 HD1 PHE 735 -10.229 -6.404 -4.315 608 HE1 PHE 735 HE2 PHE 735 -11.483 -3.754 -0.312 609 HE2 PHE 735 HE1 PHE 735 -11.677 -4.408 -4.558 610 HZ PHE 735 HZ PHE 735 -12.311 -3.088 -2.552 611 H ARG 736 H ARG 736 -9.982 -9.980 -3.593 612 HA ARG 736 HA ARG 736 -8.923 -12.439 -2.634 613 HB2 ARG 736 HB2 ARG 736 -8.969 -11.432 -5.478 614 HB3 ARG 736 HB3 ARG 736 -8.865 -13.110 -4.950 615 HG2 ARG 736 HG2 ARG 736 -11.101 -12.760 -3.780 616 HG3 ARG 736 HG3 ARG 736 -11.211 -11.220 -4.638 617 HD2 ARG 736 HD2 ARG 736 -11.022 -13.982 -5.846 618 HD3 ARG 736 HD3 ARG 736 -12.369 -12.850 -5.975 619 HE ARG 736 HE ARG 736 -10.383 -11.382 -7.057 620 HH11 ARG 736 HH21 ARG 736 -11.403 -14.657 -7.574 621 HH12 ARG 736 HH22 ARG 736 -10.713 -14.759 -9.154 622 HH21 ARG 736 HH11 ARG 736 -9.440 -11.526 -9.064 623 HH22 ARG 736 HH12 ARG 736 -9.616 -12.986 -10.008 624 H GLY 737 H GLY 737 -7.452 -9.540 -3.872 625 HA2 GLY 737 HA2 GLY 737 -4.833 -10.348 -3.073 626 HA3 GLY 737 HA3 GLY 737 -5.012 -10.405 -4.822 627 H LEU 738 H LEU 738 -3.311 -8.661 -3.256 628 HA LEU 738 HA LEU 738 -4.070 -6.101 -2.771 629 HB2 LEU 738 HB2 LEU 738 -1.636 -7.389 -3.789 630 HB3 LEU 738 HB3 LEU 738 -1.784 -5.709 -4.276 631 HG LEU 738 HG LEU 738 -0.564 -6.005 -2.129 632 HD11 LEU 738 HD11 LEU 738 -2.156 -4.024 -2.805 633 HD12 LEU 738 HD12 LEU 738 -3.126 -4.622 -1.458 634 HD13 LEU 738 HD13 LEU 738 -1.461 -4.103 -1.190 635 HD21 LEU 738 HD21 LEU 738 -1.373 -7.262 -0.448 636 HD22 LEU 738 HD22 LEU 738 -2.947 -6.469 -0.521 637 HD23 LEU 738 HD23 LEU 738 -2.597 -7.835 -1.579 638 H THR 739 H THR 739 -3.246 -7.424 -5.940 639 HA THR 739 HA THR 739 -3.635 -5.245 -7.571 640 HB THR 739 HB THR 739 -4.606 -7.985 -8.335 641 HG1 THR 739 HG1 THR 739 -2.700 -8.655 -7.809 642 HG21 THR 739 HG21 THR 739 -4.922 -6.294 -10.020 643 HG22 THR 739 HG22 THR 739 -3.273 -5.707 -9.802 644 HG23 THR 739 HG23 THR 739 -3.558 -7.298 -10.507 645 H GLU 740 H GLU 740 -6.148 -7.484 -6.379 646 HA GLU 740 HA GLU 740 -8.239 -6.169 -7.844 647 HB2 GLU 740 HB2 GLU 740 -8.793 -7.762 -5.361 648 HB3 GLU 740 HB3 GLU 740 -9.709 -7.688 -6.863 649 HG2 GLU 740 HG2 GLU 740 -7.232 -8.703 -7.630 650 HG3 GLU 740 HG3 GLU 740 -7.546 -9.491 -6.095 651 H LEU 741 H LEU 741 -6.658 -5.691 -4.843 652 HA LEU 741 HA LEU 741 -8.758 -4.039 -3.709 653 HB2 LEU 741 HB2 LEU 741 -7.495 -5.444 -2.211 654 HB3 LEU 741 HB3 LEU 741 -5.966 -4.827 -2.824 655 HG LEU 741 HG LEU 741 -6.900 -3.929 -0.556 656 HD11 LEU 741 HD11 LEU 741 -5.133 -2.986 -2.437 657 HD12 LEU 741 HD12 LEU 741 -6.235 -1.618 -2.277 658 HD13 LEU 741 HD13 LEU 741 -5.399 -2.246 -0.858 659 HD21 LEU 741 HD21 LEU 741 -8.249 -1.867 -2.255 660 HD22 LEU 741 HD22 LEU 741 -9.123 -3.365 -1.951 661 HD23 LEU 741 HD23 LEU 741 -8.601 -2.361 -0.606 662 H VAL 742 H VAL 742 -5.458 -3.688 -4.860 663 HA VAL 742 HA VAL 742 -5.238 -0.872 -4.653 664 HB VAL 742 HB VAL 742 -3.874 -2.885 -6.449 665 HG11 VAL 742 HG11 VAL 742 -3.824 -0.284 -6.976 666 HG12 VAL 742 HG12 VAL 742 -2.636 -0.277 -5.671 667 HG13 VAL 742 HG13 VAL 742 -2.371 -1.269 -7.105 668 HG21 VAL 742 HG21 VAL 742 -3.101 -1.667 -3.785 669 HG22 VAL 742 HG22 VAL 742 -3.612 -3.335 -4.063 670 HG23 VAL 742 HG23 VAL 742 -2.091 -2.752 -4.741 671 H GLU 743 H GLU 743 -5.711 -2.908 -7.493 672 HA GLU 743 HA GLU 743 -6.108 -0.785 -9.290 673 HB2 GLU 743 HB2 GLU 743 -7.061 -3.629 -9.584 674 HB3 GLU 743 HB3 GLU 743 -6.668 -2.489 -10.880 675 HG2 GLU 743 HG2 GLU 743 -4.600 -3.200 -8.794 676 HG3 GLU 743 HG3 GLU 743 -4.865 -4.256 -10.158 677 H PHE 744 H PHE 744 -8.275 -2.375 -7.109 678 HA PHE 744 HA PHE 744 -10.695 -1.505 -8.441 679 HB2 PHE 744 HB2 PHE 744 -10.794 -3.477 -7.062 680 HB3 PHE 744 HB3 PHE 744 -10.133 -2.612 -5.680 681 HD1 PHE 744 HD2 PHE 744 -13.009 -2.428 -8.090 682 HD2 PHE 744 HD1 PHE 744 -11.597 -1.759 -4.094 683 HE1 PHE 744 HE2 PHE 744 -15.301 -1.792 -7.386 684 HE2 PHE 744 HE1 PHE 744 -13.886 -1.122 -3.385 685 HZ PHE 744 HZ PHE 744 -15.740 -1.137 -5.035 686 H TYR 745 H TYR 745 -8.575 -0.346 -5.888 687 HA TYR 745 HA TYR 745 -10.317 1.780 -5.056 688 HB2 TYR 745 HB2 TYR 745 -7.455 1.058 -4.504 689 HB3 TYR 745 HB3 TYR 745 -8.127 2.596 -3.965 690 HD1 TYR 745 HD1 TYR 745 -10.735 0.207 -4.130 691 HD2 TYR 745 HD2 TYR 745 -7.407 1.419 -1.702 692 HE1 TYR 745 HE1 TYR 745 -11.768 -0.885 -2.168 693 HE2 TYR 745 HE2 TYR 745 -8.449 0.315 0.258 694 HH TYR 745 HH TYR 745 -11.663 -0.574 0.346 695 H GLN 746 H GLN 746 -8.267 1.372 -7.736 696 HA GLN 746 HA GLN 746 -7.264 3.940 -8.182 697 HB2 GLN 746 HB2 GLN 746 -8.314 1.841 -10.081 698 HB3 GLN 746 HB3 GLN 746 -7.629 3.367 -10.647 699 HG2 GLN 746 HG2 GLN 746 -5.492 2.875 -9.732 700 HG3 GLN 746 HG3 GLN 746 -6.134 1.582 -8.716 701 HE21 GLN 746 HE21 GLN 746 -4.217 0.459 -9.979 702 HE22 GLN 746 HE22 GLN 746 -4.663 -0.339 -11.413 703 H GLN 747 H GLN 747 -10.479 2.619 -8.651 704 HA GLN 747 HA GLN 747 -11.494 5.269 -9.487 705 HB2 GLN 747 HB2 GLN 747 -12.829 2.553 -9.663 706 HB3 GLN 747 HB3 GLN 747 -13.461 4.069 -10.308 707 HG2 GLN 747 HG2 GLN 747 -10.825 2.818 -11.150 708 HG3 GLN 747 HG3 GLN 747 -12.333 2.653 -12.045 709 HE21 GLN 747 HE21 GLN 747 -9.891 5.035 -10.998 710 HE22 GLN 747 HE22 GLN 747 -10.309 6.200 -12.159 711 H ASN 748 H ASN 748 -11.460 2.972 -6.940 712 HA ASN 748 HA ASN 748 -13.720 4.294 -5.567 713 HB2 ASN 748 HB2 ASN 748 -12.332 1.682 -4.905 714 HB3 ASN 748 HB3 ASN 748 -13.762 2.331 -4.110 715 HD21 ASN 748 HD21 ASN 748 -12.575 0.915 -7.153 716 HD22 ASN 748 HD22 ASN 748 -14.122 0.555 -7.763 717 H SER 749 H SER 749 -13.076 5.930 -4.309 718 HA SER 749 HA SER 749 -10.582 6.629 -3.514 719 HB2 SER 749 HB2 SER 749 -13.009 7.666 -3.129 720 HB3 SER 749 HB3 SER 749 -12.735 7.021 -1.518 721 HG SER 749 HG SER 749 -10.486 8.200 -2.319 722 H LEU 750 H LEU 750 -9.161 6.156 -1.892 723 HA LEU 750 HA LEU 750 -9.198 3.557 -0.780 724 HB2 LEU 750 HB2 LEU 750 -7.568 5.994 -0.096 725 HB3 LEU 750 HB3 LEU 750 -7.289 4.411 0.620 726 HG LEU 750 HG LEU 750 -7.532 4.080 -2.214 727 HD11 LEU 750 HD11 LEU 750 -6.358 5.764 -3.130 728 HD12 LEU 750 HD12 LEU 750 -6.581 6.620 -1.609 729 HD13 LEU 750 HD13 LEU 750 -5.118 5.676 -1.879 730 HD21 LEU 750 HD21 LEU 750 -5.387 3.030 -1.952 731 HD22 LEU 750 HD22 LEU 750 -5.044 3.957 -0.491 732 HD23 LEU 750 HD23 LEU 750 -6.289 2.708 -0.473 733 H LYS 751 H LYS 751 -10.342 6.621 0.451 734 HA LYS 751 HA LYS 751 -10.444 6.145 3.160 735 HB2 LYS 751 HB2 LYS 751 -12.414 7.625 3.235 736 HB3 LYS 751 HB3 LYS 751 -11.111 8.269 2.252 737 HG2 LYS 751 HG2 LYS 751 -12.472 6.986 0.325 738 HG3 LYS 751 HG3 LYS 751 -13.811 7.342 1.426 739 HD2 LYS 751 HD2 LYS 751 -13.134 9.701 1.512 740 HD3 LYS 751 HD3 LYS 751 -11.771 9.354 0.461 741 HE2 LYS 751 HE2 LYS 751 -13.977 8.401 -0.951 742 HE3 LYS 751 HE3 LYS 751 -14.516 9.930 -0.244 743 HZ1 LYS 751 HZ1 LYS 751 -13.432 10.523 -2.230 744 HZ2 LYS 751 HZ2 LYS 751 -12.286 10.861 -0.986 745 HZ3 LYS 751 HZ3 LYS 751 -12.130 9.433 -1.951 746 H ASP 752 H ASP 752 -12.019 4.455 0.665 747 HA ASP 752 HA ASP 752 -14.320 3.447 1.964 748 HB2 ASP 752 HB2 ASP 752 -14.248 2.802 -0.262 749 HB3 ASP 752 HB3 ASP 752 -12.518 2.486 -0.225 750 H CYS 753 H CYS 753 -10.938 2.508 2.042 751 HA CYS 753 HA CYS 753 -11.451 0.639 4.295 752 HB2 CYS 753 HB2 CYS 753 -9.529 0.631 2.030 753 HB3 CYS 753 HB3 CYS 753 -8.928 0.084 3.586 754 HG CYS 753 HG CYS 753 -10.757 -1.502 1.799 755 H PHE 754 H PHE 754 -9.223 3.022 2.932 756 HA PHE 754 HA PHE 754 -7.632 3.283 5.254 757 HB2 PHE 754 HB2 PHE 754 -8.102 5.030 2.853 758 HB3 PHE 754 HB3 PHE 754 -7.037 5.512 4.172 759 HD1 PHE 754 HD2 PHE 754 -7.699 2.466 2.069 760 HD2 PHE 754 HD1 PHE 754 -4.788 4.997 3.955 761 HE1 PHE 754 HE2 PHE 754 -5.875 1.080 1.119 762 HE2 PHE 754 HE1 PHE 754 -2.966 3.616 3.003 763 HZ PHE 754 HZ PHE 754 -3.511 1.659 1.585 764 H LYS 755 H LYS 755 -7.681 5.036 6.828 765 HA LYS 755 HA LYS 755 -10.411 5.797 7.448 766 HB2 LYS 755 HB2 LYS 755 -8.173 6.766 9.134 767 HB3 LYS 755 HB3 LYS 755 -9.715 6.046 9.594 768 HG2 LYS 755 HG2 LYS 755 -7.282 4.608 8.509 769 HG3 LYS 755 HG3 LYS 755 -7.975 4.461 10.117 770 HD2 LYS 755 HD2 LYS 755 -10.048 3.513 9.105 771 HD3 LYS 755 HD3 LYS 755 -9.273 3.582 7.528 772 HE2 LYS 755 HE2 LYS 755 -7.368 2.239 8.887 773 HE3 LYS 755 HE3 LYS 755 -8.803 1.710 9.776 774 HZ1 LYS 755 HZ1 LYS 755 -7.923 0.792 7.312 775 HZ2 LYS 755 HZ2 LYS 755 -9.402 0.390 8.083 776 HZ3 LYS 755 HZ3 LYS 755 -9.328 1.703 6.973 777 H SER 756 H SER 756 -7.403 7.759 7.438 778 HA SER 756 HA SER 756 -9.000 10.143 6.942 779 HB2 SER 756 HB2 SER 756 -7.258 11.263 7.826 780 HB3 SER 756 HB3 SER 756 -6.591 9.689 8.238 781 HG SER 756 HG SER 756 -5.165 11.038 6.974 782 H LEU 757 H LEU 757 -6.796 8.037 5.274 783 HA LEU 757 HA LEU 757 -6.073 9.380 3.002 784 HB2 LEU 757 HB2 LEU 757 -5.819 6.862 3.806 785 HB3 LEU 757 HB3 LEU 757 -7.155 6.632 2.683 786 HG LEU 757 HG LEU 757 -5.189 6.278 1.422 787 HD11 LEU 757 HD11 LEU 757 -6.917 7.754 0.390 788 HD12 LEU 757 HD12 LEU 757 -5.963 9.139 0.912 789 HD13 LEU 757 HD13 LEU 757 -5.288 7.994 -0.241 790 HD21 LEU 757 HD21 LEU 757 -3.318 7.838 1.411 791 HD22 LEU 757 HD22 LEU 757 -4.175 8.891 2.533 792 HD23 LEU 757 HD23 LEU 757 -3.647 7.289 3.058 793 H ASP 758 H ASP 758 -7.476 10.778 2.010 794 HA ASP 758 HA ASP 758 -10.011 9.611 1.046 795 HB2 ASP 758 HB2 ASP 758 -10.131 11.582 2.681 796 HB3 ASP 758 HB3 ASP 758 -9.518 12.570 1.358 797 H THR 759 H THR 759 -8.560 8.767 -0.678 798 HA THR 759 HA THR 759 -8.901 10.413 -3.005 799 HB THR 759 HB THR 759 -6.755 11.350 -2.174 800 HG1 THR 759 HG1 THR 759 -5.963 11.361 -4.178 801 HG21 THR 759 HG21 THR 759 -5.344 9.865 -1.215 802 HG22 THR 759 HG22 THR 759 -6.106 8.495 -2.019 803 HG23 THR 759 HG23 THR 759 -4.885 9.441 -2.863 804 H THR 760 H THR 760 -7.116 9.124 -4.728 805 HA THR 760 HA THR 760 -7.935 6.274 -4.530 806 HB THR 760 HB THR 760 -8.380 6.276 -6.963 807 HG1 THR 760 HG1 THR 760 -8.696 8.646 -7.670 808 HG21 THR 760 HG21 THR 760 -10.450 6.556 -6.096 809 HG22 THR 760 HG22 THR 760 -9.920 7.825 -4.990 810 HG23 THR 760 HG23 THR 760 -10.296 8.217 -6.667 811 H LEU 761 H LEU 761 -6.727 4.893 -6.117 812 HA LEU 761 HA LEU 761 -3.912 5.265 -5.786 813 HB2 LEU 761 HB2 LEU 761 -5.559 3.287 -7.382 814 HB3 LEU 761 HB3 LEU 761 -3.801 3.248 -7.356 815 HG LEU 761 HG LEU 761 -4.831 1.692 -5.693 816 HD11 LEU 761 HD11 LEU 761 -2.911 3.828 -5.100 817 HD12 LEU 761 HD12 LEU 761 -3.656 3.140 -3.661 818 HD13 LEU 761 HD13 LEU 761 -2.801 2.095 -4.793 819 HD21 LEU 761 HD21 LEU 761 -6.047 2.517 -3.816 820 HD22 LEU 761 HD22 LEU 761 -5.682 4.191 -4.224 821 HD23 LEU 761 HD23 LEU 761 -6.783 3.260 -5.236 822 H GLN 762 H GLN 762 -3.702 7.361 -6.723 823 HA GLN 762 HA GLN 762 -4.356 8.030 -9.369 824 HB2 GLN 762 HB2 GLN 762 -2.240 9.112 -7.500 825 HB3 GLN 762 HB3 GLN 762 -2.650 9.853 -9.045 826 HG2 GLN 762 HG2 GLN 762 -5.107 9.373 -7.713 827 HG3 GLN 762 HG3 GLN 762 -4.022 10.083 -6.522 828 HE21 GLN 762 HE21 GLN 762 -2.768 12.122 -7.421 829 HE22 GLN 762 HE22 GLN 762 -3.685 13.167 -8.397 830 H PHE 763 H PHE 763 -1.059 7.365 -8.139 831 HA PHE 763 HA PHE 763 -0.490 5.818 -10.537 832 HB2 PHE 763 HB2 PHE 763 1.712 7.541 -10.474 833 HB3 PHE 763 HB3 PHE 763 0.442 7.496 -11.692 834 HD1 PHE 763 HD1 PHE 763 1.490 9.089 -8.499 835 HD2 PHE 763 HD2 PHE 763 -1.215 9.217 -11.831 836 HE1 PHE 763 HE1 PHE 763 0.740 11.347 -7.802 837 HE2 PHE 763 HE2 PHE 763 -1.963 11.477 -11.135 838 HZ PHE 763 HZ PHE 763 -0.986 12.542 -9.120 839 HA PRO 764 HA PRO 764 2.136 3.645 -7.762 840 HB2 PRO 764 HB2 PRO 764 3.874 2.546 -9.596 841 HB3 PRO 764 HB3 PRO 764 2.241 1.927 -9.279 842 HG2 PRO 764 HG2 PRO 764 3.232 3.602 -11.514 843 HG3 PRO 764 HG3 PRO 764 1.983 2.347 -11.505 844 HD2 PRO 764 HD2 PRO 764 1.436 5.040 -11.536 845 HD3 PRO 764 HD3 PRO 764 0.330 3.816 -10.882 846 H PHE 765 H PHE 765 4.023 4.012 -6.638 847 HA PHE 765 HA PHE 765 5.453 6.389 -6.975 848 HB2 PHE 765 HB2 PHE 765 6.814 5.673 -5.231 849 HB3 PHE 765 HB3 PHE 765 5.354 4.723 -4.974 850 HD1 PHE 765 HD1 PHE 765 5.305 2.433 -6.425 851 HD2 PHE 765 HD2 PHE 765 8.837 4.534 -5.190 852 HE1 PHE 765 HE1 PHE 765 6.627 0.367 -6.696 853 HE2 PHE 765 HE2 PHE 765 10.164 2.459 -5.455 854 HZ PHE 765 HZ PHE 765 9.059 0.372 -6.209 855 H LYS 766 H LYS 766 5.945 3.257 -8.449 856 HA LYS 766 HA LYS 766 8.607 3.583 -9.295 857 HB2 LYS 766 HB2 LYS 766 6.304 1.879 -10.073 858 HB3 LYS 766 HB3 LYS 766 7.660 1.986 -11.188 859 HG2 LYS 766 HG2 LYS 766 8.585 1.684 -8.461 860 HG3 LYS 766 HG3 LYS 766 7.501 0.372 -8.914 861 HD2 LYS 766 HD2 LYS 766 9.709 -0.307 -9.575 862 HD3 LYS 766 HD3 LYS 766 8.859 0.142 -11.054 863 HE2 LYS 766 HE2 LYS 766 10.396 2.266 -9.602 864 HE3 LYS 766 HE3 LYS 766 11.297 1.079 -10.542 865 HZ1 LYS 766 HZ1 LYS 766 9.343 3.100 -11.470 866 HZ2 LYS 766 HZ2 LYS 766 10.869 2.695 -12.108 867 HZ3 LYS 766 HZ3 LYS 766 9.550 1.660 -12.360 868 H GLU 767 H GLU 767 5.626 4.914 -10.460 869 HA GLU 767 HA GLU 767 6.445 5.417 -13.113 870 HB2 GLU 767 HB2 GLU 767 4.151 5.929 -11.475 871 HB3 GLU 767 HB3 GLU 767 4.614 7.435 -12.264 872 HG2 GLU 767 HG2 GLU 767 4.713 6.184 -14.433 873 HG3 GLU 767 HG3 GLU 767 4.065 4.776 -13.605 874 H1 ASP 338 H1 ASP 338 15.515 1.627 5.955 875 H2 ASP 338 H2 ASP 338 16.969 0.729 5.976 876 H3 ASP 338 H3 ASP 338 16.541 1.679 7.317 877 HA ASP 338 HA ASP 338 14.575 -0.293 6.557 878 HB2 ASP 338 HB2 ASP 338 17.400 -1.006 6.997 879 HB3 ASP 338 HB3 ASP 338 16.261 -1.883 8.018 880 H THR 339 H THR 339 13.216 0.748 7.920 881 HA THR 339 HA THR 339 13.825 0.564 10.806 882 HB THR 339 HB THR 339 14.272 2.866 10.385 883 HG1 THR 339 HG1 THR 339 11.711 3.509 10.953 884 HG21 THR 339 HG21 THR 339 11.852 2.709 8.588 885 HG22 THR 339 HG22 THR 339 12.512 4.250 9.135 886 HG23 THR 339 HG23 THR 339 13.502 3.163 8.162 887 H GLU 340 H GLU 340 11.274 2.135 11.186 888 HA GLU 340 HA GLU 340 9.494 0.056 11.646 889 HB2 GLU 340 HB2 GLU 340 7.948 1.687 12.222 890 HB3 GLU 340 HB3 GLU 340 9.456 2.584 12.357 891 HG2 GLU 340 HG2 GLU 340 7.749 2.557 9.854 892 HG3 GLU 340 HG3 GLU 340 7.619 3.787 11.101 893 H VAL 341 H VAL 341 7.334 -0.292 10.604 894 HA VAL 341 HA VAL 341 7.356 0.120 7.693 895 HB VAL 341 HB VAL 341 6.495 -2.490 7.867 896 HG11 VAL 341 HG11 VAL 341 9.036 -2.882 7.156 897 HG12 VAL 341 HG12 VAL 341 7.908 -2.036 6.097 898 HG13 VAL 341 HG13 VAL 341 9.038 -1.119 7.095 899 HG21 VAL 341 HG21 VAL 341 7.322 -2.500 10.262 900 HG22 VAL 341 HG22 VAL 341 8.081 -3.709 9.226 901 HG23 VAL 341 HG23 VAL 341 8.949 -2.229 9.633 902 H TYR 342 H TYR 342 5.535 1.263 7.517 903 HA TYR 342 HA TYR 342 3.375 1.950 7.621 904 HB2 TYR 342 HB2 TYR 342 1.856 -0.390 7.846 905 HB3 TYR 342 HB3 TYR 342 2.273 0.477 6.375 906 HD1 TYR 342 HD1 TYR 342 4.259 -0.217 5.025 907 HD2 TYR 342 HD2 TYR 342 2.918 -2.452 8.443 908 HE1 TYR 342 HE1 TYR 342 5.608 -2.145 4.303 909 HE2 TYR 342 HE2 TYR 342 4.263 -4.392 7.704 910 HH TYR 342 HH TYR 342 5.456 -5.285 6.047 911 H GLU 343 H GLU 343 3.903 -0.622 10.020 912 HA GLU 343 HA GLU 343 3.170 -0.832 12.187 913 HB2 GLU 343 HB2 GLU 343 3.305 2.154 11.830 914 HB3 GLU 343 HB3 GLU 343 2.697 1.464 13.336 915 HG2 GLU 343 HG2 GLU 343 5.123 1.891 13.485 916 HG3 GLU 343 HG3 GLU 343 4.784 0.168 13.594 917 H SER 344 H SER 344 1.177 2.032 11.555 918 HA SER 344 HA SER 344 -1.147 0.952 10.611 919 HB2 SER 344 HB2 SER 344 -0.710 0.182 13.433 920 HB3 SER 344 HB3 SER 344 -2.323 0.769 13.033 921 HG SER 344 HG SER 344 -0.848 -1.326 11.789 922 HA PRO 345 HA PRO 345 -1.240 5.557 11.392 923 HB2 PRO 345 HB2 PRO 345 -3.197 4.985 9.159 924 HB3 PRO 345 HB3 PRO 345 -2.098 6.364 9.337 925 HG2 PRO 345 HG2 PRO 345 -1.531 4.365 7.703 926 HG3 PRO 345 HG3 PRO 345 -0.265 5.144 8.666 927 HD2 PRO 345 HD2 PRO 345 -1.474 2.442 8.999 928 HD3 PRO 345 HD3 PRO 345 0.138 3.023 9.465 929 H PTR 346 H PTR 346 -3.662 3.028 11.071 930 HA PTR 346 HA PTR 346 -5.011 3.784 13.477 931 HB2 PTR 346 HB2 PTR 346 -6.900 4.767 12.772 932 HB3 PTR 346 HB3 PTR 346 -7.079 3.647 11.431 933 HD1 PTR 346 HD1 PTR 346 -5.358 4.028 9.425 934 HD2 PTR 346 HD2 PTR 346 -6.477 6.994 12.311 935 HE1 PTR 346 HE1 PTR 346 -4.697 5.810 7.828 936 HE2 PTR 346 HE2 PTR 346 -5.817 8.781 10.736 937 H ALA 347 H ALA 347 -7.213 2.412 13.528 938 HA ALA 347 HA ALA 347 -7.418 -0.065 12.167 939 HB1 ALA 347 HB1 ALA 347 -6.175 -1.542 13.375 940 HB2 ALA 347 HB2 ALA 347 -6.523 -0.737 14.904 941 HB3 ALA 347 HB3 ALA 347 -5.245 -0.122 13.858 942 H ASP 348 H ASP 348 -9.209 1.823 12.782 943 HA ASP 348 HA ASP 348 -10.608 1.595 15.208 944 HB2 ASP 348 HB2 ASP 348 -12.543 2.399 13.568 945 HB3 ASP 348 HB3 ASP 348 -11.218 3.469 14.021 946 HA PRO 349 HA PRO 349 -12.201 -2.582 14.654 947 HB2 PRO 349 HB2 PRO 349 -14.015 -1.715 16.851 948 HB3 PRO 349 HB3 PRO 349 -12.949 -3.130 16.760 949 HG2 PRO 349 HG2 PRO 349 -12.374 -1.006 18.286 950 HG3 PRO 349 HG3 PRO 349 -11.120 -1.967 17.486 951 HD2 PRO 349 HD2 PRO 349 -12.141 0.750 16.786 952 HD3 PRO 349 HD3 PRO 349 -10.520 0.055 16.560 953 H GLU 350 H GLU 350 -14.541 -0.016 15.515 954 HA GLU 350 HA GLU 350 -16.637 -1.187 13.899 955 HB2 GLU 350 HB2 GLU 350 -16.706 1.622 14.962 956 HB3 GLU 350 HB3 GLU 350 -18.024 0.461 14.798 957 HG2 GLU 350 HG2 GLU 350 -17.678 0.277 17.073 958 HG3 GLU 350 HG3 GLU 350 -16.508 -0.920 16.528 Start of MODEL 15 1 H1 GLY 661 H1 GLY 661 4.757 -15.258 -10.343 2 H2 GLY 661 H2 GLY 661 5.525 -13.777 -10.011 3 H3 GLY 661 H3 GLY 661 5.352 -14.945 -8.777 4 HA2 GLY 661 HA2 GLY 661 6.881 -15.514 -11.258 5 HA3 GLY 661 HA3 GLY 661 7.634 -14.741 -9.863 6 H HIS 662 H HIS 662 7.815 -15.897 -7.886 7 HA HIS 662 HA HIS 662 8.088 -18.771 -8.210 8 HB2 HIS 662 HB2 HIS 662 9.681 -17.407 -6.860 9 HB3 HIS 662 HB3 HIS 662 8.380 -17.024 -5.740 10 HD1 HIS 662 HD1 HIS 662 7.264 -20.142 -6.109 11 HD2 HIS 662 HD2 HIS 662 10.969 -18.834 -4.678 12 HE1 HIS 662 HE1 HIS 662 8.190 -22.012 -4.651 13 HE2 HIS 662 HE2 HIS 662 10.430 -21.219 -3.762 14 H MET 663 H MET 663 5.754 -16.522 -7.005 15 HA MET 663 HA MET 663 3.665 -18.417 -6.816 16 HB2 MET 663 HB2 MET 663 4.999 -19.059 -4.768 17 HB3 MET 663 HB3 MET 663 4.631 -17.470 -4.108 18 HG2 MET 663 HG2 MET 663 2.167 -18.502 -5.028 19 HG3 MET 663 HG3 MET 663 2.967 -19.833 -4.198 20 HE1 MET 663 HE1 MET 663 3.926 -19.347 -1.308 21 HE2 MET 663 HE2 MET 663 2.241 -19.476 -0.826 22 HE3 MET 663 HE3 MET 663 2.830 -20.353 -2.246 23 H GLN 664 H GLN 664 3.577 -16.156 -4.250 24 HA GLN 664 HA GLN 664 1.713 -14.484 -5.776 25 HB2 GLN 664 HB2 GLN 664 1.235 -15.436 -3.433 26 HB3 GLN 664 HB3 GLN 664 2.360 -14.216 -2.839 27 HG2 GLN 664 HG2 GLN 664 0.684 -12.801 -4.582 28 HG3 GLN 664 HG3 GLN 664 -0.402 -13.906 -3.748 29 HE21 GLN 664 HE21 GLN 664 2.530 -12.150 -2.598 30 HE22 GLN 664 HE22 GLN 664 1.733 -11.407 -1.291 31 H ASP 665 H ASP 665 4.369 -14.218 -6.587 32 HA ASP 665 HA ASP 665 5.747 -12.093 -5.300 33 HB2 ASP 665 HB2 ASP 665 6.028 -12.433 -8.238 34 HB3 ASP 665 HB3 ASP 665 7.265 -12.245 -7.005 35 H LEU 666 H LEU 666 3.919 -10.676 -4.905 36 HA LEU 666 HA LEU 666 2.367 -9.440 -6.885 37 HB2 LEU 666 HB2 LEU 666 3.314 -8.230 -4.276 38 HB3 LEU 666 HB3 LEU 666 1.948 -7.678 -5.234 39 HG LEU 666 HG LEU 666 2.189 -10.426 -3.972 40 HD11 LEU 666 HD11 LEU 666 0.340 -9.570 -2.512 41 HD12 LEU 666 HD12 LEU 666 1.873 -8.734 -2.266 42 HD13 LEU 666 HD13 LEU 666 0.593 -7.969 -3.207 43 HD21 LEU 666 HD21 LEU 666 0.009 -9.050 -5.565 44 HD22 LEU 666 HD22 LEU 666 0.822 -10.567 -5.949 45 HD23 LEU 666 HD23 LEU 666 -0.284 -10.480 -4.578 46 H SER 667 H SER 667 5.682 -9.119 -6.176 47 HA SER 667 HA SER 667 6.367 -6.532 -6.812 48 HB2 SER 667 HB2 SER 667 8.456 -7.682 -7.852 49 HB3 SER 667 HB3 SER 667 8.127 -7.895 -6.135 50 HG SER 667 HG SER 667 8.125 -9.728 -8.159 51 H VAL 668 H VAL 668 4.888 -8.841 -8.864 52 HA VAL 668 HA VAL 668 5.852 -7.886 -11.369 53 HB VAL 668 HB VAL 668 3.928 -9.093 -12.331 54 HG11 VAL 668 HG11 VAL 668 5.668 -10.588 -11.956 55 HG12 VAL 668 HG12 VAL 668 5.635 -10.351 -10.208 56 HG13 VAL 668 HG13 VAL 668 4.389 -11.323 -10.990 57 HG21 VAL 668 HG21 VAL 668 2.035 -9.043 -11.077 58 HG22 VAL 668 HG22 VAL 668 2.743 -10.400 -10.200 59 HG23 VAL 668 HG23 VAL 668 2.926 -8.758 -9.584 60 H HIS 669 H HIS 669 3.520 -6.715 -9.094 61 HA HIS 669 HA HIS 669 2.114 -5.046 -11.014 62 HB2 HIS 669 HB2 HIS 669 2.004 -4.860 -8.002 63 HB3 HIS 669 HB3 HIS 669 0.802 -4.303 -9.168 64 HD1 HIS 669 HD1 HIS 669 0.104 -6.477 -10.906 65 HD2 HIS 669 HD2 HIS 669 1.210 -7.292 -6.975 66 HE1 HIS 669 HE1 HIS 669 -0.787 -8.792 -10.382 67 HE2 HIS 669 HE2 HIS 669 -0.127 -9.302 -7.980 68 H LEU 670 H LEU 670 2.710 -3.119 -11.658 69 HA LEU 670 HA LEU 670 5.104 -1.896 -11.193 70 HB2 LEU 670 HB2 LEU 670 3.462 -1.345 -12.999 71 HB3 LEU 670 HB3 LEU 670 2.517 -0.452 -11.811 72 HG LEU 670 HG LEU 670 4.459 1.031 -11.390 73 HD11 LEU 670 HD11 LEU 670 5.739 -0.648 -13.562 74 HD12 LEU 670 HD12 LEU 670 6.367 0.912 -13.023 75 HD13 LEU 670 HD13 LEU 670 6.303 -0.453 -11.903 76 HD21 LEU 670 HD21 LEU 670 4.285 2.287 -13.411 77 HD22 LEU 670 HD22 LEU 670 3.959 0.841 -14.365 78 HD23 LEU 670 HD23 LEU 670 2.744 1.447 -13.240 79 H TRP 671 H TRP 671 2.184 -1.593 -9.210 80 HA TRP 671 HA TRP 671 3.392 0.549 -7.663 81 HB2 TRP 671 HB2 TRP 671 1.277 0.037 -6.175 82 HB3 TRP 671 HB3 TRP 671 1.139 0.939 -7.677 83 HD1 TRP 671 HD1 TRP 671 -0.288 -0.071 -9.571 84 HE1 TRP 671 HE1 TRP 671 -1.727 -2.221 -9.817 85 HE3 TRP 671 HE3 TRP 671 1.224 -2.607 -5.394 86 HZ2 TRP 671 HZ2 TRP 671 -2.137 -4.661 -8.422 87 HZ3 TRP 671 HZ3 TRP 671 0.281 -4.845 -4.881 88 HH2 TRP 671 HH2 TRP 671 -1.394 -5.873 -6.391 89 H TYR 672 H TYR 672 4.063 -2.627 -7.758 90 HA TYR 672 HA TYR 672 4.206 -2.958 -4.835 91 HB2 TYR 672 HB2 TYR 672 3.481 -4.757 -6.670 92 HB3 TYR 672 HB3 TYR 672 5.214 -5.075 -6.655 93 HD1 TYR 672 HD2 TYR 672 2.219 -4.758 -4.486 94 HD2 TYR 672 HD1 TYR 672 6.240 -6.214 -4.821 95 HE1 TYR 672 HE2 TYR 672 1.962 -5.956 -2.331 96 HE2 TYR 672 HE1 TYR 672 5.987 -7.409 -2.662 97 HH TYR 672 HH TYR 672 3.568 -6.764 -0.491 98 H ALA 673 H ALA 673 5.931 -2.187 -3.844 99 HA ALA 673 HA ALA 673 8.466 -1.864 -5.251 100 HB1 ALA 673 HB1 ALA 673 9.076 -0.442 -3.538 101 HB2 ALA 673 HB2 ALA 673 8.151 -1.332 -2.331 102 HB3 ALA 673 HB3 ALA 673 7.322 -0.281 -3.474 103 H GLY 674 H GLY 674 6.987 -4.351 -3.683 104 HA2 GLY 674 HA2 GLY 674 7.679 -6.337 -2.751 105 HA3 GLY 674 HA3 GLY 674 9.091 -6.134 -3.766 106 HA PRO 675 HA PRO 675 11.350 -6.259 0.045 107 HB2 PRO 675 HB2 PRO 675 13.785 -5.503 -0.955 108 HB3 PRO 675 HB3 PRO 675 13.092 -7.123 -1.167 109 HG2 PRO 675 HG2 PRO 675 13.125 -4.817 -3.058 110 HG3 PRO 675 HG3 PRO 675 13.404 -6.540 -3.374 111 HD2 PRO 675 HD2 PRO 675 11.029 -5.346 -3.932 112 HD3 PRO 675 HD3 PRO 675 11.136 -7.043 -3.413 113 H MET 676 H MET 676 10.707 -3.360 -1.650 114 HA MET 676 HA MET 676 12.382 -1.512 -0.357 115 HB2 MET 676 HB2 MET 676 10.558 -1.221 -2.247 116 HB3 MET 676 HB3 MET 676 9.527 -0.795 -0.883 117 HG2 MET 676 HG2 MET 676 10.542 1.246 -1.728 118 HG3 MET 676 HG3 MET 676 11.273 0.878 -0.170 119 HE1 MET 676 HE1 MET 676 12.796 2.885 -2.315 120 HE2 MET 676 HE2 MET 676 13.000 2.478 -0.615 121 HE3 MET 676 HE3 MET 676 14.358 2.320 -1.732 122 H GLU 677 H GLU 677 11.774 0.048 1.346 123 HA GLU 677 HA GLU 677 10.279 -1.299 3.516 124 HB2 GLU 677 HB2 GLU 677 11.648 0.163 5.029 125 HB3 GLU 677 HB3 GLU 677 12.586 -1.026 4.127 126 HG2 GLU 677 HG2 GLU 677 13.675 0.565 2.915 127 HG3 GLU 677 HG3 GLU 677 12.230 1.550 2.735 128 H ARG 678 H ARG 678 9.065 0.083 4.975 129 HA ARG 678 HA ARG 678 7.246 1.786 3.759 130 HB2 ARG 678 HB2 ARG 678 6.550 1.100 5.857 131 HB3 ARG 678 HB3 ARG 678 8.135 1.355 6.580 132 HG2 ARG 678 HG2 ARG 678 6.873 3.831 5.579 133 HG3 ARG 678 HG3 ARG 678 5.983 3.049 6.883 134 HD2 ARG 678 HD2 ARG 678 7.543 3.595 8.424 135 HD3 ARG 678 HD3 ARG 678 8.866 3.081 7.381 136 HE ARG 678 HE ARG 678 7.963 5.475 6.310 137 HH11 ARG 678 HH21 ARG 678 9.332 4.330 9.288 138 HH12 ARG 678 HH22 ARG 678 9.984 5.889 9.700 139 HH21 ARG 678 HH11 ARG 678 8.812 7.444 6.834 140 HH22 ARG 678 HH12 ARG 678 9.684 7.639 8.336 141 H ALA 679 H ALA 679 9.948 2.805 5.847 142 HA ALA 679 HA ALA 679 9.786 5.547 5.400 143 HB1 ALA 679 HB1 ALA 679 11.828 5.690 6.482 144 HB2 ALA 679 HB2 ALA 679 12.463 4.243 5.699 145 HB3 ALA 679 HB3 ALA 679 11.291 4.095 7.007 146 H GLY 680 H GLY 680 11.220 3.021 3.463 147 HA2 GLY 680 HA2 GLY 680 12.613 4.761 1.645 148 HA3 GLY 680 HA3 GLY 680 12.268 3.051 1.391 149 H ALA 681 H ALA 681 9.583 2.911 1.535 150 HA ALA 681 HA ALA 681 8.619 3.516 -0.969 151 HB1 ALA 681 HB1 ALA 681 7.413 2.037 0.494 152 HB2 ALA 681 HB2 ALA 681 6.338 3.382 0.118 153 HB3 ALA 681 HB3 ALA 681 7.161 3.321 1.675 154 H GLU 682 H GLU 682 8.746 5.603 1.851 155 HA GLU 682 HA GLU 682 7.071 7.675 0.854 156 HB2 GLU 682 HB2 GLU 682 9.290 8.134 2.826 157 HB3 GLU 682 HB3 GLU 682 7.686 8.867 2.770 158 HG2 GLU 682 HG2 GLU 682 6.829 6.440 3.154 159 HG3 GLU 682 HG3 GLU 682 8.457 6.110 3.696 160 H SER 683 H SER 683 10.526 7.051 0.749 161 HA SER 683 HA SER 683 11.515 9.485 -0.102 162 HB2 SER 683 HB2 SER 683 13.373 8.242 -1.053 163 HB3 SER 683 HB3 SER 683 12.885 7.495 0.466 164 HG SER 683 HG SER 683 11.735 5.939 -0.710 165 H ILE 684 H ILE 684 10.563 6.791 -2.208 166 HA ILE 684 HA ILE 684 10.762 8.283 -4.623 167 HB ILE 684 HB ILE 684 8.931 5.914 -4.269 168 HG12 ILE 684 HG12 ILE 684 11.419 4.923 -5.053 169 HG13 ILE 684 HG13 ILE 684 11.815 6.063 -3.769 170 HG21 ILE 684 HG21 ILE 684 9.018 7.068 -6.462 171 HG22 ILE 684 HG22 ILE 684 10.765 6.826 -6.510 172 HG23 ILE 684 HG23 ILE 684 9.681 5.436 -6.565 173 HD11 ILE 684 HD11 ILE 684 9.587 4.736 -2.776 174 HD12 ILE 684 HD12 ILE 684 10.491 3.463 -3.597 175 HD13 ILE 684 HD13 ILE 684 11.263 4.414 -2.330 176 H LEU 685 H LEU 685 7.994 7.367 -2.594 177 HA LEU 685 HA LEU 685 5.966 8.589 -4.087 178 HB2 LEU 685 HB2 LEU 685 6.271 8.146 -1.114 179 HB3 LEU 685 HB3 LEU 685 4.796 8.784 -1.836 180 HG LEU 685 HG LEU 685 6.097 6.156 -2.602 181 HD11 LEU 685 HD11 LEU 685 3.908 6.884 -0.679 182 HD12 LEU 685 HD12 LEU 685 3.835 5.343 -1.535 183 HD13 LEU 685 HD13 LEU 685 5.211 5.708 -0.492 184 HD21 LEU 685 HD21 LEU 685 3.414 6.200 -3.366 185 HD22 LEU 685 HD22 LEU 685 4.004 7.807 -3.774 186 HD23 LEU 685 HD23 LEU 685 4.804 6.384 -4.434 187 H ALA 686 H ALA 686 7.806 9.919 -1.330 188 HA ALA 686 HA ALA 686 6.757 12.523 -1.428 189 HB1 ALA 686 HB1 ALA 686 8.689 13.154 -0.092 190 HB2 ALA 686 HB2 ALA 686 9.549 11.697 -0.592 191 HB3 ALA 686 HB3 ALA 686 8.122 11.569 0.437 192 H ASN 687 H ASN 687 9.430 11.031 -3.174 193 HA ASN 687 HA ASN 687 10.338 13.474 -4.378 194 HB2 ASN 687 HB2 ASN 687 11.948 11.749 -4.212 195 HB3 ASN 687 HB3 ASN 687 10.860 10.551 -4.902 196 HD21 ASN 687 HD21 ASN 687 11.515 13.850 -6.153 197 HD22 ASN 687 HD22 ASN 687 12.145 13.313 -7.631 198 H ARG 688 H ARG 688 8.227 10.797 -5.426 199 HA ARG 688 HA ARG 688 7.921 11.639 -8.107 200 HB2 ARG 688 HB2 ARG 688 7.006 9.517 -6.589 201 HB3 ARG 688 HB3 ARG 688 5.527 10.388 -6.976 202 HG2 ARG 688 HG2 ARG 688 5.732 9.019 -8.842 203 HG3 ARG 688 HG3 ARG 688 6.556 10.474 -9.401 204 HD2 ARG 688 HD2 ARG 688 8.721 9.462 -8.604 205 HD3 ARG 688 HD3 ARG 688 7.834 7.979 -8.264 206 HE ARG 688 HE ARG 688 7.759 7.530 -10.571 207 HH11 ARG 688 HH21 ARG 688 8.735 10.791 -9.940 208 HH12 ARG 688 HH22 ARG 688 9.082 11.141 -11.596 209 HH21 ARG 688 HH11 ARG 688 8.158 7.992 -12.711 210 HH22 ARG 688 HH12 ARG 688 8.765 9.560 -13.159 211 H SER 689 H SER 689 5.133 11.739 -5.932 212 HA SER 689 HA SER 689 4.696 14.493 -5.831 213 HB2 SER 689 HB2 SER 689 3.783 13.175 -8.352 214 HB3 SER 689 HB3 SER 689 2.786 14.438 -7.640 215 HG SER 689 HG SER 689 5.582 14.653 -8.155 216 H ASP 690 H ASP 690 2.588 15.072 -5.047 217 HA ASP 690 HA ASP 690 1.457 13.228 -3.291 218 HB2 ASP 690 HB2 ASP 690 1.061 15.962 -3.935 219 HB3 ASP 690 HB3 ASP 690 -0.516 15.178 -3.968 220 H GLY 691 H GLY 691 -0.060 11.740 -3.402 221 HA2 GLY 691 HA2 GLY 691 -2.113 10.834 -4.343 222 HA3 GLY 691 HA3 GLY 691 -1.618 11.476 -5.910 223 H THR 692 H THR 692 1.170 10.695 -5.557 224 HA THR 692 HA THR 692 1.218 8.214 -6.829 225 HB THR 692 HB THR 692 3.423 9.235 -5.027 226 HG1 THR 692 HG1 THR 692 2.999 10.967 -6.254 227 HG21 THR 692 HG21 THR 692 3.543 6.949 -6.195 228 HG22 THR 692 HG22 THR 692 3.617 7.855 -7.706 229 HG23 THR 692 HG23 THR 692 4.879 8.060 -6.493 230 H PHE 693 H PHE 693 1.590 6.083 -6.126 231 HA PHE 693 HA PHE 693 1.548 5.590 -3.227 232 HB2 PHE 693 HB2 PHE 693 -0.395 4.227 -3.278 233 HB3 PHE 693 HB3 PHE 693 -0.823 5.706 -4.133 234 HD1 PHE 693 HD1 PHE 693 -0.911 5.741 -6.629 235 HD2 PHE 693 HD2 PHE 693 -0.256 2.113 -4.424 236 HE1 PHE 693 HE1 PHE 693 -1.474 4.413 -8.645 237 HE2 PHE 693 HE2 PHE 693 -0.820 0.789 -6.440 238 HZ PHE 693 HZ PHE 693 -1.426 1.935 -8.552 239 H LEU 694 H LEU 694 1.601 3.154 -2.782 240 HA LEU 694 HA LEU 694 2.563 1.336 -4.715 241 HB2 LEU 694 HB2 LEU 694 4.901 1.215 -4.226 242 HB3 LEU 694 HB3 LEU 694 4.527 2.882 -4.625 243 HG LEU 694 HG LEU 694 4.142 3.027 -1.981 244 HD11 LEU 694 HD11 LEU 694 6.508 1.497 -1.546 245 HD12 LEU 694 HD12 LEU 694 4.908 1.232 -0.856 246 HD13 LEU 694 HD13 LEU 694 5.354 0.453 -2.373 247 HD21 LEU 694 HD21 LEU 694 6.421 3.910 -1.818 248 HD22 LEU 694 HD22 LEU 694 6.875 3.065 -3.295 249 HD23 LEU 694 HD23 LEU 694 5.706 4.382 -3.352 250 H VAL 695 H VAL 695 3.549 -0.607 -3.738 251 HA VAL 695 HA VAL 695 2.779 -1.051 -0.918 252 HB VAL 695 HB VAL 695 2.172 -3.132 -3.006 253 HG11 VAL 695 HG11 VAL 695 2.198 -3.239 -0.289 254 HG12 VAL 695 HG12 VAL 695 0.544 -2.699 -0.556 255 HG13 VAL 695 HG13 VAL 695 1.103 -4.205 -1.279 256 HG21 VAL 695 HG21 VAL 695 0.459 -0.795 -2.127 257 HG22 VAL 695 HG22 VAL 695 0.913 -1.228 -3.774 258 HG23 VAL 695 HG23 VAL 695 -0.211 -2.245 -2.871 259 H ARG 696 H ARG 696 4.006 -2.653 0.150 260 HA ARG 696 HA ARG 696 6.183 -3.886 -1.400 261 HB2 ARG 696 HB2 ARG 696 7.668 -3.164 0.653 262 HB3 ARG 696 HB3 ARG 696 7.422 -2.084 -0.711 263 HG2 ARG 696 HG2 ARG 696 6.078 -0.645 0.468 264 HG3 ARG 696 HG3 ARG 696 5.386 -1.929 1.454 265 HD2 ARG 696 HD2 ARG 696 7.894 -0.359 1.863 266 HD3 ARG 696 HD3 ARG 696 6.697 -0.878 3.046 267 HE ARG 696 HE ARG 696 9.079 -2.291 2.333 268 HH11 ARG 696 HH21 ARG 696 5.748 -2.782 2.919 269 HH12 ARG 696 HH22 ARG 696 5.928 -4.352 3.621 270 HH21 ARG 696 HH11 ARG 696 9.359 -4.322 3.201 271 HH22 ARG 696 HH12 ARG 696 7.994 -5.260 3.720 272 H GLN 697 H GLN 697 7.354 -5.552 -0.231 273 HA GLN 697 HA GLN 697 5.736 -6.795 1.923 274 HB2 GLN 697 HB2 GLN 697 6.051 -7.827 -0.604 275 HB3 GLN 697 HB3 GLN 697 7.363 -8.617 0.267 276 HG2 GLN 697 HG2 GLN 697 5.877 -9.600 1.838 277 HG3 GLN 697 HG3 GLN 697 4.560 -8.520 1.392 278 HE21 GLN 697 HE21 GLN 697 3.916 -8.753 -1.070 279 HE22 GLN 697 HE22 GLN 697 3.849 -10.354 -1.652 280 H ARG 698 H ARG 698 8.900 -7.540 0.458 281 HA ARG 698 HA ARG 698 11.006 -7.724 1.361 282 HB2 ARG 698 HB2 ARG 698 10.391 -5.323 2.048 283 HB3 ARG 698 HB3 ARG 698 10.090 -5.997 3.651 284 HG2 ARG 698 HG2 ARG 698 12.433 -7.030 3.490 285 HG3 ARG 698 HG3 ARG 698 12.686 -5.968 2.103 286 HD2 ARG 698 HD2 ARG 698 12.084 -4.014 3.526 287 HD3 ARG 698 HD3 ARG 698 11.942 -5.099 4.910 288 HE ARG 698 HE ARG 698 14.499 -5.268 3.566 289 HH11 ARG 698 HH21 ARG 698 12.604 -3.617 5.932 290 HH12 ARG 698 HH22 ARG 698 13.973 -3.044 6.834 291 HH21 ARG 698 HH11 ARG 698 16.271 -4.509 4.719 292 HH22 ARG 698 HH12 ARG 698 16.041 -3.529 6.144 293 H VAL 699 H VAL 699 8.501 -7.847 3.908 294 HA VAL 699 HA VAL 699 10.055 -9.759 5.451 295 HB VAL 699 HB VAL 699 7.368 -9.742 6.371 296 HG11 VAL 699 HG11 VAL 699 9.909 -9.511 7.399 297 HG12 VAL 699 HG12 VAL 699 9.243 -7.903 7.691 298 HG13 VAL 699 HG13 VAL 699 8.421 -9.326 8.323 299 HG21 VAL 699 HG21 VAL 699 7.102 -7.267 6.749 300 HG22 VAL 699 HG22 VAL 699 8.399 -7.002 5.584 301 HG23 VAL 699 HG23 VAL 699 6.886 -7.765 5.073 302 H LYS 700 H LYS 700 8.368 -10.049 2.671 303 HA LYS 700 HA LYS 700 6.939 -11.692 1.766 304 HB2 LYS 700 HB2 LYS 700 8.361 -13.839 1.589 305 HB3 LYS 700 HB3 LYS 700 9.007 -12.357 0.896 306 HG2 LYS 700 HG2 LYS 700 10.866 -12.787 2.109 307 HG3 LYS 700 HG3 LYS 700 9.938 -12.249 3.502 308 HD2 LYS 700 HD2 LYS 700 9.228 -14.975 2.967 309 HD3 LYS 700 HD3 LYS 700 10.987 -14.857 2.986 310 HE2 LYS 700 HE2 LYS 700 10.416 -15.232 5.252 311 HE3 LYS 700 HE3 LYS 700 10.685 -13.489 5.161 312 HZ1 LYS 700 HZ1 LYS 700 8.474 -14.598 6.168 313 HZ2 LYS 700 HZ2 LYS 700 8.517 -13.031 5.478 314 HZ3 LYS 700 HZ3 LYS 700 7.979 -14.363 4.547 315 H ASP 701 H ASP 701 5.757 -11.353 4.067 316 HA ASP 701 HA ASP 701 5.588 -13.954 5.440 317 HB2 ASP 701 HB2 ASP 701 4.390 -12.654 7.185 318 HB3 ASP 701 HB3 ASP 701 6.000 -12.013 6.860 319 H ALA 702 H ALA 702 2.868 -12.319 6.164 320 HA ALA 702 HA ALA 702 1.165 -12.724 3.930 321 HB1 ALA 702 HB1 ALA 702 -0.068 -14.703 4.727 322 HB2 ALA 702 HB2 ALA 702 1.076 -14.881 6.058 323 HB3 ALA 702 HB3 ALA 702 1.618 -15.101 4.393 324 H ALA 703 H ALA 703 1.811 -10.996 6.397 325 HA ALA 703 HA ALA 703 -0.945 -10.243 6.935 326 HB1 ALA 703 HB1 ALA 703 -0.720 -12.022 8.564 327 HB2 ALA 703 HB2 ALA 703 -0.724 -10.471 9.406 328 HB3 ALA 703 HB3 ALA 703 0.794 -11.338 9.157 329 H GLU 704 H GLU 704 2.405 -9.610 6.865 330 HA GLU 704 HA GLU 704 2.068 -6.980 8.162 331 HB2 GLU 704 HB2 GLU 704 4.459 -8.686 7.498 332 HB3 GLU 704 HB3 GLU 704 4.641 -6.963 7.829 333 HG2 GLU 704 HG2 GLU 704 3.217 -8.886 9.687 334 HG3 GLU 704 HG3 GLU 704 4.911 -8.431 9.861 335 H PHE 705 H PHE 705 0.762 -7.244 5.747 336 HA PHE 705 HA PHE 705 2.501 -5.936 3.748 337 HB2 PHE 705 HB2 PHE 705 -0.314 -7.036 3.476 338 HB3 PHE 705 HB3 PHE 705 0.615 -6.292 2.179 339 HD1 PHE 705 HD1 PHE 705 3.024 -7.991 4.049 340 HD2 PHE 705 HD2 PHE 705 -0.279 -8.766 1.406 341 HE1 PHE 705 HE1 PHE 705 3.980 -10.203 3.491 342 HE2 PHE 705 HE2 PHE 705 0.687 -10.977 0.852 343 HZ PHE 705 HZ PHE 705 2.814 -11.697 1.896 344 H ALA 706 H ALA 706 1.861 -3.938 2.801 345 HA ALA 706 HA ALA 706 -0.444 -2.513 3.796 346 HB1 ALA 706 HB1 ALA 706 1.865 -2.359 5.355 347 HB2 ALA 706 HB2 ALA 706 0.497 -1.253 5.406 348 HB3 ALA 706 HB3 ALA 706 1.883 -0.881 4.395 349 H ILE 707 H ILE 707 -0.875 -0.626 2.661 350 HA ILE 707 HA ILE 707 0.691 -0.303 0.176 351 HB ILE 707 HB ILE 707 -2.108 0.656 0.845 352 HG12 ILE 707 HG12 ILE 707 -1.144 -1.662 -0.859 353 HG13 ILE 707 HG13 ILE 707 -1.938 -1.800 0.706 354 HG21 ILE 707 HG21 ILE 707 -1.191 0.398 -1.955 355 HG22 ILE 707 HG22 ILE 707 -2.171 1.652 -1.206 356 HG23 ILE 707 HG23 ILE 707 -0.419 1.688 -1.039 357 HD11 ILE 707 HD11 ILE 707 -3.966 -0.821 -0.169 358 HD12 ILE 707 HD12 ILE 707 -3.180 -0.451 -1.703 359 HD13 ILE 707 HD13 ILE 707 -3.482 -2.129 -1.247 360 H SER 708 H SER 708 1.648 1.629 -0.310 361 HA SER 708 HA SER 708 1.435 3.737 1.772 362 HB2 SER 708 HB2 SER 708 3.775 3.026 -0.009 363 HB3 SER 708 HB3 SER 708 3.738 4.373 1.126 364 HG SER 708 HG SER 708 3.193 1.690 1.888 365 H ILE 709 H ILE 709 0.511 5.571 1.146 366 HA ILE 709 HA ILE 709 0.596 6.271 -1.733 367 HB ILE 709 HB ILE 709 -1.682 6.965 0.114 368 HG12 ILE 709 HG12 ILE 709 -2.688 5.040 -1.534 369 HG13 ILE 709 HG13 ILE 709 -1.051 4.430 -1.291 370 HG21 ILE 709 HG21 ILE 709 -0.989 7.389 -2.725 371 HG22 ILE 709 HG22 ILE 709 -2.628 6.795 -2.461 372 HG23 ILE 709 HG23 ILE 709 -2.095 8.289 -1.690 373 HD11 ILE 709 HD11 ILE 709 -2.296 3.492 0.491 374 HD12 ILE 709 HD12 ILE 709 -1.457 4.863 1.219 375 HD13 ILE 709 HD13 ILE 709 -3.162 5.001 0.788 376 H LYS 710 H LYS 710 1.033 8.313 -2.288 377 HA LYS 710 HA LYS 710 2.244 10.027 -0.299 378 HB2 LYS 710 HB2 LYS 710 3.236 9.782 -2.523 379 HB3 LYS 710 HB3 LYS 710 1.767 10.414 -3.261 380 HG2 LYS 710 HG2 LYS 710 3.234 12.275 -3.146 381 HG3 LYS 710 HG3 LYS 710 2.121 12.482 -1.799 382 HD2 LYS 710 HD2 LYS 710 3.909 11.181 -0.426 383 HD3 LYS 710 HD3 LYS 710 4.995 11.625 -1.742 384 HE2 LYS 710 HE2 LYS 710 5.008 13.282 0.127 385 HE3 LYS 710 HE3 LYS 710 4.489 13.991 -1.399 386 HZ1 LYS 710 HZ1 LYS 710 3.078 14.530 0.548 387 HZ2 LYS 710 HZ2 LYS 710 2.220 13.878 -0.771 388 HZ3 LYS 710 HZ3 LYS 710 2.598 12.899 0.599 389 H TYR 711 H TYR 711 1.345 11.690 0.748 390 HA TYR 711 HA TYR 711 -0.930 13.145 -0.375 391 HB2 TYR 711 HB2 TYR 711 -1.509 10.934 1.137 392 HB3 TYR 711 HB3 TYR 711 -1.453 12.184 2.375 393 HD1 TYR 711 HD2 TYR 711 -2.437 14.539 0.752 394 HD2 TYR 711 HD1 TYR 711 -3.805 10.475 0.986 395 HE1 TYR 711 HE2 TYR 711 -4.718 15.268 0.108 396 HE2 TYR 711 HE1 TYR 711 -6.083 11.197 0.342 397 HH TYR 711 HH TYR 711 -7.336 12.947 -0.486 398 H ASN 712 H ASN 712 -0.508 15.245 0.015 399 HA ASN 712 HA ASN 712 0.253 17.173 1.017 400 HB2 ASN 712 HB2 ASN 712 -1.399 16.564 2.715 401 HB3 ASN 712 HB3 ASN 712 -0.209 15.565 3.538 402 HD21 ASN 712 HD21 ASN 712 1.077 16.592 5.097 403 HD22 ASN 712 HD22 ASN 712 1.184 18.284 5.268 404 H VAL 713 H VAL 713 2.372 16.410 -0.008 405 HA VAL 713 HA VAL 713 4.634 15.951 0.101 406 HB VAL 713 HB VAL 713 5.851 17.524 1.404 407 HG11 VAL 713 HG11 VAL 713 4.803 19.535 0.793 408 HG12 VAL 713 HG12 VAL 713 4.060 18.363 -0.297 409 HG13 VAL 713 HG13 VAL 713 3.189 18.908 1.138 410 HG21 VAL 713 HG21 VAL 713 5.129 18.483 3.438 411 HG22 VAL 713 HG22 VAL 713 3.439 18.085 3.134 412 HG23 VAL 713 HG23 VAL 713 4.582 16.814 3.571 413 H GLU 714 H GLU 714 2.729 14.334 1.890 414 HA GLU 714 HA GLU 714 4.831 12.915 3.389 415 HB2 GLU 714 HB2 GLU 714 2.053 13.680 4.307 416 HB3 GLU 714 HB3 GLU 714 2.981 12.395 5.075 417 HG2 GLU 714 HG2 GLU 714 4.180 13.896 6.251 418 HG3 GLU 714 HG3 GLU 714 4.651 14.731 4.776 419 H VAL 715 H VAL 715 3.797 10.693 4.095 420 HA VAL 715 HA VAL 715 2.230 9.589 1.843 421 HB VAL 715 HB VAL 715 4.762 8.493 3.081 422 HG11 VAL 715 HG11 VAL 715 2.733 7.117 1.292 423 HG12 VAL 715 HG12 VAL 715 4.358 6.506 1.598 424 HG13 VAL 715 HG13 VAL 715 3.200 6.634 2.921 425 HG21 VAL 715 HG21 VAL 715 3.898 9.239 0.276 426 HG22 VAL 715 HG22 VAL 715 5.140 10.027 1.250 427 HG23 VAL 715 HG23 VAL 715 5.392 8.393 0.646 428 H LYS 716 H LYS 716 0.795 7.973 2.333 429 HA LYS 716 HA LYS 716 0.385 7.467 5.230 430 HB2 LYS 716 HB2 LYS 716 -1.424 8.606 3.622 431 HB3 LYS 716 HB3 LYS 716 -1.768 6.920 3.245 432 HG2 LYS 716 HG2 LYS 716 -2.476 6.423 5.411 433 HG3 LYS 716 HG3 LYS 716 -1.502 7.711 6.124 434 HD2 LYS 716 HD2 LYS 716 -3.870 8.301 4.334 435 HD3 LYS 716 HD3 LYS 716 -4.037 8.105 6.067 436 HE2 LYS 716 HE2 LYS 716 -1.838 9.895 5.436 437 HE3 LYS 716 HE3 LYS 716 -3.348 10.460 4.714 438 HZ1 LYS 716 HZ1 LYS 716 -3.508 9.461 7.440 439 HZ2 LYS 716 HZ2 LYS 716 -2.668 10.925 7.238 440 HZ3 LYS 716 HZ3 LYS 716 -4.303 10.806 6.729 441 H HIS 717 H HIS 717 0.983 5.504 5.851 442 HA HIS 717 HA HIS 717 0.840 3.283 3.899 443 HB2 HIS 717 HB2 HIS 717 2.472 3.234 6.436 444 HB3 HIS 717 HB3 HIS 717 2.630 2.210 5.017 445 HD1 HIS 717 HD1 HIS 717 4.043 3.086 3.035 446 HD2 HIS 717 HD2 HIS 717 3.637 5.865 6.142 447 HE1 HIS 717 HE1 HIS 717 5.848 4.848 2.703 448 HE2 HIS 717 HE2 HIS 717 5.549 6.601 4.553 449 H ILE 718 H ILE 718 -1.044 2.211 4.236 450 HA ILE 718 HA ILE 718 -1.948 1.788 7.033 451 HB ILE 718 HB ILE 718 -3.340 2.155 4.440 452 HG12 ILE 718 HG12 ILE 718 -3.446 3.830 6.240 453 HG13 ILE 718 HG13 ILE 718 -5.038 3.166 5.898 454 HG21 ILE 718 HG21 ILE 718 -5.348 0.883 5.391 455 HG22 ILE 718 HG22 ILE 718 -4.038 -0.108 4.751 456 HG23 ILE 718 HG23 ILE 718 -4.209 0.110 6.491 457 HD11 ILE 718 HD11 ILE 718 -4.247 1.428 7.796 458 HD12 ILE 718 HD12 ILE 718 -3.333 2.846 8.304 459 HD13 ILE 718 HD13 ILE 718 -5.087 2.931 8.170 460 H LYS 719 H LYS 719 -2.045 -0.276 7.838 461 HA LYS 719 HA LYS 719 -0.628 -2.316 6.404 462 HB2 LYS 719 HB2 LYS 719 -1.116 -1.789 9.069 463 HB3 LYS 719 HB3 LYS 719 -2.098 -3.221 8.764 464 HG2 LYS 719 HG2 LYS 719 0.583 -3.334 7.544 465 HG3 LYS 719 HG3 LYS 719 0.610 -3.252 9.302 466 HD2 LYS 719 HD2 LYS 719 -1.342 -5.144 8.062 467 HD3 LYS 719 HD3 LYS 719 0.363 -5.581 7.980 468 HE2 LYS 719 HE2 LYS 719 0.175 -4.783 10.583 469 HE3 LYS 719 HE3 LYS 719 -1.437 -5.448 10.324 470 HZ1 LYS 719 HZ1 LYS 719 1.182 -6.780 10.314 471 HZ2 LYS 719 HZ2 LYS 719 -0.351 -7.353 10.835 472 HZ3 LYS 719 HZ3 LYS 719 0.013 -7.344 9.165 473 H ILE 720 H ILE 720 -1.315 -4.192 5.533 474 HA ILE 720 HA ILE 720 -4.195 -4.313 4.911 475 HB ILE 720 HB ILE 720 -1.721 -5.411 3.593 476 HG12 ILE 720 HG12 ILE 720 -4.088 -3.918 2.448 477 HG13 ILE 720 HG13 ILE 720 -2.684 -3.092 3.129 478 HG21 ILE 720 HG21 ILE 720 -3.411 -6.453 1.957 479 HG22 ILE 720 HG22 ILE 720 -3.169 -7.300 3.486 480 HG23 ILE 720 HG23 ILE 720 -4.593 -6.287 3.254 481 HD11 ILE 720 HD11 ILE 720 -2.699 -3.576 0.582 482 HD12 ILE 720 HD12 ILE 720 -1.232 -3.947 1.488 483 HD13 ILE 720 HD13 ILE 720 -2.349 -5.239 1.048 484 H MET 721 H MET 721 -5.455 -6.006 5.517 485 HA MET 721 HA MET 721 -4.176 -7.996 7.280 486 HB2 MET 721 HB2 MET 721 -6.275 -6.558 7.918 487 HB3 MET 721 HB3 MET 721 -7.140 -7.770 6.976 488 HG2 MET 721 HG2 MET 721 -5.762 -9.505 8.353 489 HG3 MET 721 HG3 MET 721 -5.498 -8.166 9.470 490 HE1 MET 721 HE1 MET 721 -6.401 -10.247 10.758 491 HE2 MET 721 HE2 MET 721 -8.097 -10.430 11.199 492 HE3 MET 721 HE3 MET 721 -7.468 -11.196 9.735 493 H THR 722 H THR 722 -4.558 -10.193 7.065 494 HA THR 722 HA THR 722 -5.490 -11.049 4.392 495 HB THR 722 HB THR 722 -3.901 -13.045 4.910 496 HG1 THR 722 HG1 THR 722 -2.100 -12.230 6.214 497 HG21 THR 722 HG21 THR 722 -3.042 -10.229 4.243 498 HG22 THR 722 HG22 THR 722 -1.952 -11.610 4.098 499 HG23 THR 722 HG23 THR 722 -3.422 -11.541 3.124 500 H ALA 723 H ALA 723 -7.164 -12.370 4.343 501 HA ALA 723 HA ALA 723 -7.711 -14.146 6.626 502 HB1 ALA 723 HB1 ALA 723 -10.090 -13.473 6.647 503 HB2 ALA 723 HB2 ALA 723 -9.738 -12.210 5.467 504 HB3 ALA 723 HB3 ALA 723 -9.032 -12.131 7.082 505 H GLU 724 H GLU 724 -8.271 -16.122 5.937 506 HA GLU 724 HA GLU 724 -8.565 -17.843 4.419 507 HB2 GLU 724 HB2 GLU 724 -10.790 -16.213 3.244 508 HB3 GLU 724 HB3 GLU 724 -10.748 -17.935 3.622 509 HG2 GLU 724 HG2 GLU 724 -10.962 -15.625 5.567 510 HG3 GLU 724 HG3 GLU 724 -12.138 -16.904 5.286 511 H GLY 725 H GLY 725 -6.789 -15.627 3.527 512 HA2 GLY 725 HA2 GLY 725 -5.444 -15.517 1.598 513 HA3 GLY 725 HA3 GLY 725 -6.703 -16.354 0.696 514 H LEU 726 H LEU 726 -8.054 -13.874 2.546 515 HA LEU 726 HA LEU 726 -8.299 -12.190 0.144 516 HB2 LEU 726 HB2 LEU 726 -9.830 -12.153 2.751 517 HB3 LEU 726 HB3 LEU 726 -10.130 -11.074 1.394 518 HG LEU 726 HG LEU 726 -10.090 -14.008 0.838 519 HD11 LEU 726 HD11 LEU 726 -12.775 -13.258 1.446 520 HD12 LEU 726 HD12 LEU 726 -11.795 -14.506 2.214 521 HD13 LEU 726 HD13 LEU 726 -11.781 -12.861 2.847 522 HD21 LEU 726 HD21 LEU 726 -10.514 -12.790 -1.089 523 HD22 LEU 726 HD22 LEU 726 -12.159 -13.059 -0.522 524 HD23 LEU 726 HD23 LEU 726 -11.367 -11.513 -0.222 525 H TYR 727 H TYR 727 -7.925 -9.952 0.215 526 HA TYR 727 HA TYR 727 -6.096 -9.098 2.402 527 HB2 TYR 727 HB2 TYR 727 -6.125 -8.243 -0.501 528 HB3 TYR 727 HB3 TYR 727 -5.021 -7.634 0.733 529 HD1 TYR 727 HD2 TYR 727 -6.103 -10.707 -1.075 530 HD2 TYR 727 HD1 TYR 727 -3.089 -8.870 1.377 531 HE1 TYR 727 HE2 TYR 727 -4.598 -12.643 -1.462 532 HE2 TYR 727 HE1 TYR 727 -1.591 -10.804 0.985 533 HH TYR 727 HH TYR 727 -1.458 -12.639 -1.091 534 H ARG 728 H ARG 728 -6.324 -7.075 3.307 535 HA ARG 728 HA ARG 728 -8.193 -5.156 2.208 536 HB2 ARG 728 HB2 ARG 728 -9.310 -5.057 4.574 537 HB3 ARG 728 HB3 ARG 728 -9.889 -6.188 3.356 538 HG2 ARG 728 HG2 ARG 728 -9.208 -8.004 4.547 539 HG3 ARG 728 HG3 ARG 728 -7.685 -7.244 5.000 540 HD2 ARG 728 HD2 ARG 728 -8.638 -6.139 6.847 541 HD3 ARG 728 HD3 ARG 728 -10.276 -6.327 6.234 542 HE ARG 728 HE ARG 728 -8.759 -8.288 7.741 543 HH11 ARG 728 HH21 ARG 728 -11.374 -7.719 5.538 544 HH12 ARG 728 HH22 ARG 728 -12.201 -9.183 5.977 545 HH21 ARG 728 HH11 ARG 728 -9.839 -10.163 8.285 546 HH22 ARG 728 HH12 ARG 728 -11.339 -10.557 7.520 547 H ILE 729 H ILE 729 -7.634 -3.146 2.694 548 HA ILE 729 HA ILE 729 -5.263 -2.632 4.232 549 HB ILE 729 HB ILE 729 -6.280 -0.163 3.849 550 HG12 ILE 729 HG12 ILE 729 -8.364 -1.371 2.862 551 HG13 ILE 729 HG13 ILE 729 -7.700 0.009 1.995 552 HG21 ILE 729 HG21 ILE 729 -4.691 -2.026 2.143 553 HG22 ILE 729 HG22 ILE 729 -5.209 -0.506 1.420 554 HG23 ILE 729 HG23 ILE 729 -4.218 -0.496 2.875 555 HD11 ILE 729 HD11 ILE 729 -8.145 -2.539 0.949 556 HD12 ILE 729 HD12 ILE 729 -7.204 -1.252 0.201 557 HD13 ILE 729 HD13 ILE 729 -6.399 -2.469 1.191 558 H THR 730 H THR 730 -8.686 -2.472 4.711 559 HA THR 730 HA THR 730 -8.246 -1.456 7.452 560 HB THR 730 HB THR 730 -9.653 0.108 6.316 561 HG1 THR 730 HG1 THR 730 -10.384 -0.924 8.427 562 HG21 THR 730 HG21 THR 730 -11.777 -0.742 5.214 563 HG22 THR 730 HG22 THR 730 -10.280 -1.128 4.364 564 HG23 THR 730 HG23 THR 730 -11.086 -2.360 5.336 565 H GLU 731 H GLU 731 -9.441 -2.382 9.083 566 HA GLU 731 HA GLU 731 -9.703 -5.200 8.959 567 HB2 GLU 731 HB2 GLU 731 -10.626 -4.890 11.255 568 HB3 GLU 731 HB3 GLU 731 -9.139 -3.961 11.020 569 HG2 GLU 731 HG2 GLU 731 -11.777 -2.677 10.402 570 HG3 GLU 731 HG3 GLU 731 -11.262 -2.792 12.068 571 H LYS 732 H LYS 732 -11.618 -2.755 7.760 572 HA LYS 732 HA LYS 732 -14.140 -4.154 8.221 573 HB2 LYS 732 HB2 LYS 732 -13.824 -1.477 6.900 574 HB3 LYS 732 HB3 LYS 732 -15.235 -2.135 7.733 575 HG2 LYS 732 HG2 LYS 732 -14.168 -1.986 9.864 576 HG3 LYS 732 HG3 LYS 732 -12.599 -1.704 9.128 577 HD2 LYS 732 HD2 LYS 732 -13.943 0.386 8.080 578 HD3 LYS 732 HD3 LYS 732 -14.811 0.205 9.607 579 HE2 LYS 732 HE2 LYS 732 -11.864 -0.008 9.762 580 HE3 LYS 732 HE3 LYS 732 -12.497 1.596 9.386 581 HZ1 LYS 732 HZ1 LYS 732 -12.230 0.914 11.840 582 HZ2 LYS 732 HZ2 LYS 732 -13.701 1.690 11.370 583 HZ3 LYS 732 HZ3 LYS 732 -13.649 -0.012 11.588 584 H LYS 733 H LYS 733 -11.801 -4.268 5.840 585 HA LYS 733 HA LYS 733 -13.831 -4.806 3.730 586 HB2 LYS 733 HB2 LYS 733 -11.987 -2.772 3.662 587 HB3 LYS 733 HB3 LYS 733 -11.169 -4.044 2.763 588 HG2 LYS 733 HG2 LYS 733 -12.403 -3.029 1.071 589 HG3 LYS 733 HG3 LYS 733 -13.520 -4.296 1.575 590 HD2 LYS 733 HD2 LYS 733 -14.762 -2.221 1.414 591 HD3 LYS 733 HD3 LYS 733 -14.601 -2.624 3.124 592 HE2 LYS 733 HE2 LYS 733 -13.153 -0.883 3.539 593 HE3 LYS 733 HE3 LYS 733 -12.462 -0.933 1.916 594 HZ1 LYS 733 HZ1 LYS 733 -15.273 -0.186 2.126 595 HZ2 LYS 733 HZ2 LYS 733 -14.141 0.962 2.692 596 HZ3 LYS 733 HZ3 LYS 733 -14.064 0.415 1.068 597 H ALA 734 H ALA 734 -12.486 -5.924 1.779 598 HA ALA 734 HA ALA 734 -10.496 -7.827 2.446 599 HB1 ALA 734 HB1 ALA 734 -13.245 -9.052 2.203 600 HB2 ALA 734 HB2 ALA 734 -12.472 -8.732 3.755 601 HB3 ALA 734 HB3 ALA 734 -11.734 -9.860 2.620 602 H PHE 735 H PHE 735 -9.551 -8.506 0.593 603 HA PHE 735 HA PHE 735 -11.150 -8.589 -1.899 604 HB2 PHE 735 HB2 PHE 735 -8.588 -7.101 -1.385 605 HB3 PHE 735 HB3 PHE 735 -8.924 -7.735 -3.002 606 HD1 PHE 735 HD2 PHE 735 -10.585 -5.810 -0.240 607 HD2 PHE 735 HD1 PHE 735 -10.184 -6.436 -4.469 608 HE1 PHE 735 HE2 PHE 735 -12.136 -3.917 -0.674 609 HE2 PHE 735 HE1 PHE 735 -11.714 -4.538 -4.907 610 HZ PHE 735 HZ PHE 735 -12.699 -3.284 -3.002 611 H ARG 736 H ARG 736 -10.244 -9.942 -3.566 612 HA ARG 736 HA ARG 736 -9.275 -12.437 -2.627 613 HB2 ARG 736 HB2 ARG 736 -9.152 -11.421 -5.460 614 HB3 ARG 736 HB3 ARG 736 -9.246 -13.096 -4.920 615 HG2 ARG 736 HG2 ARG 736 -11.486 -12.596 -3.919 616 HG3 ARG 736 HG3 ARG 736 -11.396 -10.978 -4.621 617 HD2 ARG 736 HD2 ARG 736 -11.125 -13.512 -6.240 618 HD3 ARG 736 HD3 ARG 736 -12.651 -12.663 -6.022 619 HE ARG 736 HE ARG 736 -10.238 -11.449 -7.318 620 HH11 ARG 736 HH21 ARG 736 -13.682 -11.876 -7.043 621 HH12 ARG 736 HH22 ARG 736 -14.038 -10.776 -8.323 622 HH21 ARG 736 HH11 ARG 736 -10.721 -10.008 -8.944 623 HH22 ARG 736 HH12 ARG 736 -12.382 -9.731 -9.392 624 H GLY 737 H GLY 737 -7.700 -9.578 -3.803 625 HA2 GLY 737 HA2 GLY 737 -5.118 -10.394 -2.940 626 HA3 GLY 737 HA3 GLY 737 -5.253 -10.529 -4.690 627 H LEU 738 H LEU 738 -3.524 -8.750 -3.292 628 HA LEU 738 HA LEU 738 -4.287 -6.154 -2.891 629 HB2 LEU 738 HB2 LEU 738 -1.830 -7.472 -3.893 630 HB3 LEU 738 HB3 LEU 738 -1.971 -5.756 -4.261 631 HG LEU 738 HG LEU 738 -0.818 -6.140 -2.106 632 HD11 LEU 738 HD11 LEU 738 -1.782 -4.305 -1.176 633 HD12 LEU 738 HD12 LEU 738 -2.726 -4.287 -2.661 634 HD13 LEU 738 HD13 LEU 738 -3.398 -5.011 -1.202 635 HD21 LEU 738 HD21 LEU 738 -1.942 -7.145 -0.239 636 HD22 LEU 738 HD22 LEU 738 -3.469 -7.220 -1.118 637 HD23 LEU 738 HD23 LEU 738 -2.125 -8.259 -1.593 638 H THR 739 H THR 739 -3.471 -7.617 -6.010 639 HA THR 739 HA THR 739 -3.776 -5.440 -7.680 640 HB THR 739 HB THR 739 -4.699 -8.187 -8.476 641 HG1 THR 739 HG1 THR 739 -2.047 -7.653 -8.750 642 HG21 THR 739 HG21 THR 739 -3.448 -7.526 -10.556 643 HG22 THR 739 HG22 THR 739 -4.838 -6.500 -10.203 644 HG23 THR 739 HG23 THR 739 -3.208 -5.930 -9.841 645 H GLU 740 H GLU 740 -6.353 -7.541 -6.406 646 HA GLU 740 HA GLU 740 -8.351 -6.232 -8.051 647 HB2 GLU 740 HB2 GLU 740 -9.138 -7.796 -5.631 648 HB3 GLU 740 HB3 GLU 740 -9.855 -7.791 -7.239 649 HG2 GLU 740 HG2 GLU 740 -7.208 -8.799 -7.491 650 HG3 GLU 740 HG3 GLU 740 -7.938 -9.617 -6.128 651 H LEU 741 H LEU 741 -6.806 -5.731 -5.076 652 HA LEU 741 HA LEU 741 -8.901 -4.093 -3.910 653 HB2 LEU 741 HB2 LEU 741 -7.546 -5.515 -2.467 654 HB3 LEU 741 HB3 LEU 741 -6.069 -4.774 -3.068 655 HG LEU 741 HG LEU 741 -7.011 -3.970 -0.794 656 HD11 LEU 741 HD11 LEU 741 -6.672 -1.582 -2.500 657 HD12 LEU 741 HD12 LEU 741 -5.733 -2.114 -1.106 658 HD13 LEU 741 HD13 LEU 741 -5.417 -2.808 -2.695 659 HD21 LEU 741 HD21 LEU 741 -9.327 -3.689 -2.042 660 HD22 LEU 741 HD22 LEU 741 -8.849 -2.556 -0.787 661 HD23 LEU 741 HD23 LEU 741 -8.656 -2.121 -2.482 662 H VAL 742 H VAL 742 -5.598 -3.705 -5.032 663 HA VAL 742 HA VAL 742 -5.401 -0.896 -4.812 664 HB VAL 742 HB VAL 742 -3.957 -2.909 -6.539 665 HG11 VAL 742 HG11 VAL 742 -3.758 0.005 -6.346 666 HG12 VAL 742 HG12 VAL 742 -2.228 -0.817 -6.040 667 HG13 VAL 742 HG13 VAL 742 -3.094 -1.099 -7.552 668 HG21 VAL 742 HG21 VAL 742 -3.838 -3.313 -4.113 669 HG22 VAL 742 HG22 VAL 742 -2.271 -2.818 -4.761 670 HG23 VAL 742 HG23 VAL 742 -3.260 -1.661 -3.867 671 H GLU 743 H GLU 743 -5.802 -2.930 -7.663 672 HA GLU 743 HA GLU 743 -6.049 -0.812 -9.501 673 HB2 GLU 743 HB2 GLU 743 -7.063 -3.632 -9.806 674 HB3 GLU 743 HB3 GLU 743 -6.570 -2.529 -11.095 675 HG2 GLU 743 HG2 GLU 743 -4.593 -3.173 -8.927 676 HG3 GLU 743 HG3 GLU 743 -4.896 -4.382 -10.155 677 H PHE 744 H PHE 744 -8.354 -2.351 -7.423 678 HA PHE 744 HA PHE 744 -10.674 -1.498 -8.932 679 HB2 PHE 744 HB2 PHE 744 -10.897 -3.482 -7.631 680 HB3 PHE 744 HB3 PHE 744 -10.274 -2.690 -6.190 681 HD1 PHE 744 HD2 PHE 744 -12.975 -2.006 -8.727 682 HD2 PHE 744 HD1 PHE 744 -11.853 -2.191 -4.592 683 HE1 PHE 744 HE2 PHE 744 -15.271 -1.328 -8.074 684 HE2 PHE 744 HE1 PHE 744 -14.146 -1.514 -3.929 685 HZ PHE 744 HZ PHE 744 -15.856 -1.080 -5.676 686 H TYR 745 H TYR 745 -8.832 -0.381 -6.144 687 HA TYR 745 HA TYR 745 -10.670 1.678 -5.384 688 HB2 TYR 745 HB2 TYR 745 -7.774 1.131 -4.770 689 HB3 TYR 745 HB3 TYR 745 -8.611 2.556 -4.148 690 HD1 TYR 745 HD2 TYR 745 -10.978 -0.033 -4.597 691 HD2 TYR 745 HD1 TYR 745 -7.844 1.245 -1.946 692 HE1 TYR 745 HE2 TYR 745 -11.939 -1.415 -2.791 693 HE2 TYR 745 HE1 TYR 745 -8.819 -0.152 -0.144 694 HH TYR 745 HH TYR 745 -10.802 -2.588 -0.608 695 H GLN 746 H GLN 746 -8.333 1.415 -7.887 696 HA GLN 746 HA GLN 746 -7.455 3.989 -8.316 697 HB2 GLN 746 HB2 GLN 746 -8.408 1.898 -10.272 698 HB3 GLN 746 HB3 GLN 746 -7.701 3.429 -10.794 699 HG2 GLN 746 HG2 GLN 746 -5.627 2.946 -9.665 700 HG3 GLN 746 HG3 GLN 746 -6.325 1.541 -8.863 701 HE21 GLN 746 HE21 GLN 746 -7.538 0.110 -10.852 702 HE22 GLN 746 HE22 GLN 746 -6.418 -0.290 -12.070 703 H GLN 747 H GLN 747 -10.654 2.678 -8.750 704 HA GLN 747 HA GLN 747 -11.667 5.286 -9.706 705 HB2 GLN 747 HB2 GLN 747 -12.965 2.549 -9.837 706 HB3 GLN 747 HB3 GLN 747 -13.614 4.040 -10.521 707 HG2 GLN 747 HG2 GLN 747 -11.585 4.223 -11.960 708 HG3 GLN 747 HG3 GLN 747 -11.022 2.679 -11.328 709 HE21 GLN 747 HE21 GLN 747 -11.776 0.819 -12.386 710 HE22 GLN 747 HE22 GLN 747 -13.036 0.814 -13.523 711 H ASN 748 H ASN 748 -11.116 3.987 -6.868 712 HA ASN 748 HA ASN 748 -13.576 5.088 -5.680 713 HB2 ASN 748 HB2 ASN 748 -14.148 2.806 -5.623 714 HB3 ASN 748 HB3 ASN 748 -12.499 2.307 -5.274 715 HD21 ASN 748 HD21 ASN 748 -12.614 1.392 -3.206 716 HD22 ASN 748 HD22 ASN 748 -13.328 2.145 -1.863 717 H SER 749 H SER 749 -12.971 6.615 -4.323 718 HA SER 749 HA SER 749 -10.448 7.266 -3.504 719 HB2 SER 749 HB2 SER 749 -12.869 8.352 -3.128 720 HB3 SER 749 HB3 SER 749 -12.611 7.690 -1.524 721 HG SER 749 HG SER 749 -10.341 8.836 -2.323 722 H LEU 750 H LEU 750 -9.053 6.647 -1.936 723 HA LEU 750 HA LEU 750 -9.280 4.045 -0.861 724 HB2 LEU 750 HB2 LEU 750 -7.444 6.339 -0.202 725 HB3 LEU 750 HB3 LEU 750 -7.293 4.748 0.539 726 HG LEU 750 HG LEU 750 -7.607 4.448 -2.311 727 HD11 LEU 750 HD11 LEU 750 -6.677 6.572 -2.690 728 HD12 LEU 750 HD12 LEU 750 -5.558 6.424 -1.339 729 HD13 LEU 750 HD13 LEU 750 -5.298 5.481 -2.806 730 HD21 LEU 750 HD21 LEU 750 -6.571 2.880 -0.629 731 HD22 LEU 750 HD22 LEU 750 -5.591 3.148 -2.069 732 HD23 LEU 750 HD23 LEU 750 -5.182 3.966 -0.562 733 H LYS 751 H LYS 751 -10.153 7.182 0.453 734 HA LYS 751 HA LYS 751 -10.329 6.618 3.152 735 HB2 LYS 751 HB2 LYS 751 -12.099 8.304 3.284 736 HB3 LYS 751 HB3 LYS 751 -10.772 8.836 2.266 737 HG2 LYS 751 HG2 LYS 751 -12.346 7.664 0.397 738 HG3 LYS 751 HG3 LYS 751 -13.575 8.234 1.533 739 HD2 LYS 751 HD2 LYS 751 -12.505 10.474 1.531 740 HD3 LYS 751 HD3 LYS 751 -11.341 9.889 0.351 741 HE2 LYS 751 HE2 LYS 751 -13.751 9.254 -0.826 742 HE3 LYS 751 HE3 LYS 751 -14.075 10.814 -0.053 743 HZ1 LYS 751 HZ1 LYS 751 -13.124 11.324 -2.133 744 HZ2 LYS 751 HZ2 LYS 751 -11.855 11.550 -0.987 745 HZ3 LYS 751 HZ3 LYS 751 -11.902 10.126 -1.963 746 H ASP 752 H ASP 752 -12.077 5.249 0.565 747 HA ASP 752 HA ASP 752 -14.451 4.441 1.951 748 HB2 ASP 752 HB2 ASP 752 -14.555 4.229 -0.400 749 HB3 ASP 752 HB3 ASP 752 -12.989 3.426 -0.486 750 H CYS 753 H CYS 753 -11.195 3.336 1.776 751 HA CYS 753 HA CYS 753 -11.742 1.065 3.602 752 HB2 CYS 753 HB2 CYS 753 -9.347 1.367 1.820 753 HB3 CYS 753 HB3 CYS 753 -9.999 -0.093 2.550 754 HG CYS 753 HG CYS 753 -11.816 1.370 0.514 755 H PHE 754 H PHE 754 -9.470 3.560 2.643 756 HA PHE 754 HA PHE 754 -7.821 3.302 4.979 757 HB2 PHE 754 HB2 PHE 754 -8.044 5.277 2.737 758 HB3 PHE 754 HB3 PHE 754 -6.970 5.562 4.107 759 HD1 PHE 754 HD2 PHE 754 -7.891 2.666 1.910 760 HD2 PHE 754 HD1 PHE 754 -4.756 4.948 3.743 761 HE1 PHE 754 HE2 PHE 754 -6.206 1.172 0.880 762 HE2 PHE 754 HE1 PHE 754 -3.067 3.460 2.709 763 HZ PHE 754 HZ PHE 754 -3.793 1.571 1.277 764 H LYS 755 H LYS 755 -7.579 4.926 6.623 765 HA LYS 755 HA LYS 755 -10.129 5.985 7.483 766 HB2 LYS 755 HB2 LYS 755 -7.706 6.611 9.058 767 HB3 LYS 755 HB3 LYS 755 -9.265 5.974 9.579 768 HG2 LYS 755 HG2 LYS 755 -7.048 4.418 8.205 769 HG3 LYS 755 HG3 LYS 755 -7.565 4.254 9.873 770 HD2 LYS 755 HD2 LYS 755 -9.902 3.707 8.858 771 HD3 LYS 755 HD3 LYS 755 -8.997 3.400 7.376 772 HE2 LYS 755 HE2 LYS 755 -9.137 1.294 8.487 773 HE3 LYS 755 HE3 LYS 755 -7.489 1.873 8.756 774 HZ1 LYS 755 HZ1 LYS 755 -7.937 2.431 10.938 775 HZ2 LYS 755 HZ2 LYS 755 -9.650 2.515 10.699 776 HZ3 LYS 755 HZ3 LYS 755 -8.852 0.993 10.746 777 H SER 756 H SER 756 -6.893 7.557 7.295 778 HA SER 756 HA SER 756 -8.269 10.135 6.958 779 HB2 SER 756 HB2 SER 756 -6.642 10.621 8.468 780 HB3 SER 756 HB3 SER 756 -5.608 9.297 7.936 781 HG SER 756 HG SER 756 -6.032 11.342 6.084 782 H LEU 757 H LEU 757 -7.125 7.773 4.994 783 HA LEU 757 HA LEU 757 -5.770 9.339 2.992 784 HB2 LEU 757 HB2 LEU 757 -5.721 6.759 3.553 785 HB3 LEU 757 HB3 LEU 757 -7.065 6.721 2.424 786 HG LEU 757 HG LEU 757 -5.186 6.331 1.089 787 HD11 LEU 757 HD11 LEU 757 -6.656 8.115 0.209 788 HD12 LEU 757 HD12 LEU 757 -5.595 9.309 0.961 789 HD13 LEU 757 HD13 LEU 757 -4.978 8.269 -0.316 790 HD21 LEU 757 HD21 LEU 757 -3.100 7.441 1.314 791 HD22 LEU 757 HD22 LEU 757 -3.796 8.672 2.359 792 HD23 LEU 757 HD23 LEU 757 -3.613 7.015 2.950 793 H ASP 758 H ASP 758 -6.994 10.920 1.986 794 HA ASP 758 HA ASP 758 -9.642 10.059 1.011 795 HB2 ASP 758 HB2 ASP 758 -9.550 12.009 2.651 796 HB3 ASP 758 HB3 ASP 758 -8.803 12.935 1.353 797 H THR 759 H THR 759 -8.302 9.069 -0.727 798 HA THR 759 HA THR 759 -8.531 10.696 -3.056 799 HB THR 759 HB THR 759 -6.339 11.545 -2.208 800 HG1 THR 759 HG1 THR 759 -5.523 11.524 -4.216 801 HG21 THR 759 HG21 THR 759 -4.586 9.529 -2.974 802 HG22 THR 759 HG22 THR 759 -4.945 10.014 -1.317 803 HG23 THR 759 HG23 THR 759 -5.823 8.675 -2.057 804 H THR 760 H THR 760 -6.921 9.318 -4.827 805 HA THR 760 HA THR 760 -7.821 6.504 -4.523 806 HB THR 760 HB THR 760 -8.121 6.555 -7.055 807 HG1 THR 760 HG1 THR 760 -8.672 8.836 -7.665 808 HG21 THR 760 HG21 THR 760 -9.886 8.268 -5.293 809 HG22 THR 760 HG22 THR 760 -10.353 7.638 -6.876 810 HG23 THR 760 HG23 THR 760 -10.024 6.527 -5.546 811 H LEU 761 H LEU 761 -6.703 5.073 -6.202 812 HA LEU 761 HA LEU 761 -3.867 5.269 -5.815 813 HB2 LEU 761 HB2 LEU 761 -5.582 3.463 -7.555 814 HB3 LEU 761 HB3 LEU 761 -3.836 3.295 -7.413 815 HG LEU 761 HG LEU 761 -4.962 1.749 -5.872 816 HD11 LEU 761 HD11 LEU 761 -3.880 3.981 -4.158 817 HD12 LEU 761 HD12 LEU 761 -3.670 2.239 -3.970 818 HD13 LEU 761 HD13 LEU 761 -2.830 3.094 -5.259 819 HD21 LEU 761 HD21 LEU 761 -7.016 3.251 -5.628 820 HD22 LEU 761 HD22 LEU 761 -6.441 2.479 -4.150 821 HD23 LEU 761 HD23 LEU 761 -6.080 4.175 -4.452 822 H GLN 762 H GLN 762 -3.399 7.340 -6.695 823 HA GLN 762 HA GLN 762 -4.076 8.132 -9.322 824 HB2 GLN 762 HB2 GLN 762 -1.892 9.071 -7.462 825 HB3 GLN 762 HB3 GLN 762 -2.307 9.864 -8.978 826 HG2 GLN 762 HG2 GLN 762 -4.632 9.308 -7.259 827 HG3 GLN 762 HG3 GLN 762 -3.474 10.430 -6.555 828 HE21 GLN 762 HE21 GLN 762 -5.893 10.049 -9.033 829 HE22 GLN 762 HE22 GLN 762 -5.770 11.619 -9.662 830 H PHE 763 H PHE 763 -0.783 7.306 -8.159 831 HA PHE 763 HA PHE 763 -0.323 5.825 -10.630 832 HB2 PHE 763 HB2 PHE 763 1.955 7.515 -10.387 833 HB3 PHE 763 HB3 PHE 763 0.805 7.418 -11.716 834 HD1 PHE 763 HD1 PHE 763 1.663 9.178 -8.579 835 HD2 PHE 763 HD2 PHE 763 -1.005 9.020 -11.943 836 HE1 PHE 763 HE1 PHE 763 0.804 11.433 -8.003 837 HE2 PHE 763 HE2 PHE 763 -1.861 11.274 -11.369 838 HZ PHE 763 HZ PHE 763 -0.959 12.481 -9.398 839 HA PRO 764 HA PRO 764 2.155 3.384 -7.933 840 HB2 PRO 764 HB2 PRO 764 3.682 2.115 -9.848 841 HB3 PRO 764 HB3 PRO 764 2.015 1.660 -9.442 842 HG2 PRO 764 HG2 PRO 764 3.051 3.201 -11.748 843 HG3 PRO 764 HG3 PRO 764 1.664 2.106 -11.646 844 HD2 PRO 764 HD2 PRO 764 1.460 4.859 -11.679 845 HD3 PRO 764 HD3 PRO 764 0.236 3.774 -10.992 846 H PHE 765 H PHE 765 3.991 3.779 -6.812 847 HA PHE 765 HA PHE 765 5.651 5.946 -7.290 848 HB2 PHE 765 HB2 PHE 765 6.939 5.200 -5.507 849 HB3 PHE 765 HB3 PHE 765 5.406 4.383 -5.216 850 HD1 PHE 765 HD1 PHE 765 5.185 2.047 -6.596 851 HD2 PHE 765 HD2 PHE 765 8.856 3.900 -5.362 852 HE1 PHE 765 HE1 PHE 765 6.332 -0.120 -6.771 853 HE2 PHE 765 HE2 PHE 765 10.010 1.714 -5.533 854 HZ PHE 765 HZ PHE 765 8.750 -0.295 -6.240 855 H LYS 766 H LYS 766 5.867 2.710 -8.608 856 HA LYS 766 HA LYS 766 8.537 2.782 -9.482 857 HB2 LYS 766 HB2 LYS 766 6.117 1.197 -10.023 858 HB3 LYS 766 HB3 LYS 766 7.383 1.133 -11.238 859 HG2 LYS 766 HG2 LYS 766 8.416 0.978 -8.512 860 HG3 LYS 766 HG3 LYS 766 7.331 -0.344 -8.917 861 HD2 LYS 766 HD2 LYS 766 9.659 -0.902 -9.526 862 HD3 LYS 766 HD3 LYS 766 8.648 -0.792 -10.967 863 HE2 LYS 766 HE2 LYS 766 10.075 1.675 -10.012 864 HE3 LYS 766 HE3 LYS 766 10.993 0.445 -10.874 865 HZ1 LYS 766 HZ1 LYS 766 8.679 0.764 -12.327 866 HZ2 LYS 766 HZ2 LYS 766 9.123 2.362 -11.909 867 HZ3 LYS 766 HZ3 LYS 766 10.215 1.348 -12.741 868 H GLU 767 H GLU 767 5.662 4.260 -10.721 869 HA GLU 767 HA GLU 767 6.511 4.473 -13.419 870 HB2 GLU 767 HB2 GLU 767 4.261 5.300 -11.856 871 HB3 GLU 767 HB3 GLU 767 4.873 6.709 -12.721 872 HG2 GLU 767 HG2 GLU 767 4.967 5.071 -14.769 873 HG3 GLU 767 HG3 GLU 767 3.821 4.121 -13.830 874 H1 ASP 338 H1 ASP 338 14.532 3.414 5.210 875 H2 ASP 338 H2 ASP 338 15.259 4.619 6.178 876 H3 ASP 338 H3 ASP 338 14.658 3.201 6.901 877 HA ASP 338 HA ASP 338 16.966 3.375 5.039 878 HB2 ASP 338 HB2 ASP 338 18.079 2.425 7.197 879 HB3 ASP 338 HB3 ASP 338 17.718 4.148 7.138 880 H THR 339 H THR 339 15.424 1.263 7.457 881 HA THR 339 HA THR 339 15.158 -0.910 5.526 882 HB THR 339 HB THR 339 17.437 -1.321 6.169 883 HG1 THR 339 HG1 THR 339 15.886 -2.919 7.914 884 HG21 THR 339 HG21 THR 339 16.428 -0.903 8.997 885 HG22 THR 339 HG22 THR 339 18.018 -1.562 8.609 886 HG23 THR 339 HG23 THR 339 17.605 0.084 8.130 887 H GLU 340 H GLU 340 13.578 0.816 7.469 888 HA GLU 340 HA GLU 340 12.545 -1.176 9.352 889 HB2 GLU 340 HB2 GLU 340 11.200 0.713 10.212 890 HB3 GLU 340 HB3 GLU 340 12.921 1.092 10.166 891 HG2 GLU 340 HG2 GLU 340 12.697 2.507 8.313 892 HG3 GLU 340 HG3 GLU 340 11.167 1.786 7.820 893 H VAL 341 H VAL 341 9.865 -0.253 9.470 894 HA VAL 341 HA VAL 341 8.713 -0.728 6.828 895 HB VAL 341 HB VAL 341 7.183 -2.505 8.048 896 HG11 VAL 341 HG11 VAL 341 8.819 -4.279 7.308 897 HG12 VAL 341 HG12 VAL 341 8.484 -3.045 6.093 898 HG13 VAL 341 HG13 VAL 341 9.988 -2.992 7.013 899 HG21 VAL 341 HG21 VAL 341 8.369 -3.806 9.716 900 HG22 VAL 341 HG22 VAL 341 9.809 -2.801 9.539 901 HG23 VAL 341 HG23 VAL 341 8.342 -2.125 10.250 902 H TYR 342 H TYR 342 6.207 -0.929 7.149 903 HA TYR 342 HA TYR 342 5.328 1.561 8.260 904 HB2 TYR 342 HB2 TYR 342 3.015 0.329 7.628 905 HB3 TYR 342 HB3 TYR 342 4.043 1.105 6.428 906 HD1 TYR 342 HD2 TYR 342 4.494 -2.134 8.279 907 HD2 TYR 342 HD1 TYR 342 3.892 -0.202 4.484 908 HE1 TYR 342 HE2 TYR 342 4.817 -4.303 7.118 909 HE2 TYR 342 HE1 TYR 342 4.204 -2.368 3.338 910 HH TYR 342 HH TYR 342 4.328 -5.382 5.048 911 H GLU 343 H GLU 343 3.027 1.366 9.423 912 HA GLU 343 HA GLU 343 3.322 -0.484 11.711 913 HB2 GLU 343 HB2 GLU 343 4.045 1.720 12.416 914 HB3 GLU 343 HB3 GLU 343 2.588 2.454 11.752 915 HG2 GLU 343 HG2 GLU 343 1.745 0.367 13.499 916 HG3 GLU 343 HG3 GLU 343 2.986 1.280 14.350 917 H SER 344 H SER 344 0.733 1.816 11.769 918 HA SER 344 HA SER 344 -1.174 0.366 10.224 919 HB2 SER 344 HB2 SER 344 -0.977 -0.309 13.149 920 HB3 SER 344 HB3 SER 344 -2.514 -0.420 12.294 921 HG SER 344 HG SER 344 -0.174 -1.560 11.186 922 HA PRO 345 HA PRO 345 -1.945 4.855 11.653 923 HB2 PRO 345 HB2 PRO 345 -2.860 4.645 8.765 924 HB3 PRO 345 HB3 PRO 345 -2.148 6.032 9.617 925 HG2 PRO 345 HG2 PRO 345 -0.650 4.561 8.060 926 HG3 PRO 345 HG3 PRO 345 -0.026 5.110 9.625 927 HD2 PRO 345 HD2 PRO 345 -0.928 2.365 8.830 928 HD3 PRO 345 HD3 PRO 345 0.338 2.848 9.980 929 H PTR 346 H PTR 346 -3.735 5.262 12.724 930 HA PTR 346 HA PTR 346 -5.801 4.883 13.691 931 HB2 PTR 346 HB2 PTR 346 -6.972 6.426 12.595 932 HB3 PTR 346 HB3 PTR 346 -7.399 5.246 11.368 933 HD1 PTR 346 HD1 PTR 346 -5.716 4.840 9.447 934 HD2 PTR 346 HD2 PTR 346 -5.477 8.188 12.117 935 HE1 PTR 346 HE1 PTR 346 -4.245 5.997 7.828 936 HE2 PTR 346 HE2 PTR 346 -3.999 9.357 10.508 937 H ALA 347 H ALA 347 -6.085 2.806 14.374 938 HA ALA 347 HA ALA 347 -7.161 0.795 12.472 939 HB1 ALA 347 HB1 ALA 347 -5.994 0.579 15.265 940 HB2 ALA 347 HB2 ALA 347 -5.308 -0.039 13.761 941 HB3 ALA 347 HB3 ALA 347 -6.768 -0.768 14.431 942 H ASP 348 H ASP 348 -8.818 2.900 13.083 943 HA ASP 348 HA ASP 348 -10.576 2.683 15.222 944 HB2 ASP 348 HB2 ASP 348 -12.207 3.525 13.220 945 HB3 ASP 348 HB3 ASP 348 -11.040 4.574 14.028 946 HA PRO 349 HA PRO 349 -12.593 -1.212 14.318 947 HB2 PRO 349 HB2 PRO 349 -14.791 -0.330 16.063 948 HB3 PRO 349 HB3 PRO 349 -13.649 -1.664 16.289 949 HG2 PRO 349 HG2 PRO 349 -13.602 0.593 17.775 950 HG3 PRO 349 HG3 PRO 349 -12.160 -0.374 17.423 951 HD2 PRO 349 HD2 PRO 349 -13.030 2.222 16.207 952 HD3 PRO 349 HD3 PRO 349 -11.392 1.634 16.573 953 H GLU 350 H GLU 350 -15.043 1.346 14.853 954 HA GLU 350 HA GLU 350 -16.852 0.448 12.883 955 HB2 GLU 350 HB2 GLU 350 -16.490 3.272 13.918 956 HB3 GLU 350 HB3 GLU 350 -17.943 2.603 13.176 957 HG2 GLU 350 HG2 GLU 350 -18.535 2.244 15.362 958 HG3 GLU 350 HG3 GLU 350 -17.576 0.783 15.142 Start of MODEL 16 1 H1 GLY 661 H1 GLY 661 5.188 -14.843 -8.902 2 H2 GLY 661 H2 GLY 661 4.726 -15.125 -10.521 3 H3 GLY 661 H3 GLY 661 5.481 -13.663 -10.094 4 HA2 GLY 661 HA2 GLY 661 6.946 -15.347 -11.247 5 HA3 GLY 661 HA3 GLY 661 7.554 -14.697 -9.721 6 H HIS 662 H HIS 662 7.514 -15.994 -7.852 7 HA HIS 662 HA HIS 662 7.758 -18.827 -8.322 8 HB2 HIS 662 HB2 HIS 662 7.524 -17.484 -5.623 9 HB3 HIS 662 HB3 HIS 662 8.393 -18.963 -6.035 10 HD1 HIS 662 HD1 HIS 662 8.509 -15.215 -6.610 11 HD2 HIS 662 HD2 HIS 662 11.032 -18.548 -6.888 12 HE1 HIS 662 HE1 HIS 662 10.841 -14.333 -7.139 13 HE2 HIS 662 HE2 HIS 662 12.380 -16.349 -7.316 14 H MET 663 H MET 663 5.294 -16.624 -7.335 15 HA MET 663 HA MET 663 3.194 -18.512 -7.588 16 HB2 MET 663 HB2 MET 663 4.151 -19.338 -5.453 17 HB3 MET 663 HB3 MET 663 3.896 -17.752 -4.740 18 HG2 MET 663 HG2 MET 663 1.446 -17.990 -5.249 19 HG3 MET 663 HG3 MET 663 1.768 -19.629 -5.802 20 HE1 MET 663 HE1 MET 663 0.356 -21.034 -2.708 21 HE2 MET 663 HE2 MET 663 -0.244 -20.051 -4.023 22 HE3 MET 663 HE3 MET 663 0.890 -21.361 -4.351 23 H GLN 664 H GLN 664 2.771 -16.408 -4.928 24 HA GLN 664 HA GLN 664 1.111 -14.632 -6.567 25 HB2 GLN 664 HB2 GLN 664 0.542 -15.777 -4.231 26 HB3 GLN 664 HB3 GLN 664 1.304 -14.313 -3.608 27 HG2 GLN 664 HG2 GLN 664 -0.216 -12.987 -5.138 28 HG3 GLN 664 HG3 GLN 664 -1.057 -14.492 -5.498 29 HE21 GLN 664 HE21 GLN 664 -1.810 -15.714 -3.380 30 HE22 GLN 664 HE22 GLN 664 -2.445 -14.725 -2.155 31 H ASP 665 H ASP 665 3.954 -14.376 -6.848 32 HA ASP 665 HA ASP 665 5.117 -12.353 -5.308 33 HB2 ASP 665 HB2 ASP 665 5.680 -12.526 -8.240 34 HB3 ASP 665 HB3 ASP 665 6.795 -12.292 -6.899 35 H LEU 666 H LEU 666 3.525 -10.789 -4.896 36 HA LEU 666 HA LEU 666 2.024 -9.350 -6.759 37 HB2 LEU 666 HB2 LEU 666 3.204 -8.314 -4.167 38 HB3 LEU 666 HB3 LEU 666 1.816 -7.639 -5.015 39 HG LEU 666 HG LEU 666 1.852 -10.525 -4.126 40 HD11 LEU 666 HD11 LEU 666 1.093 -8.069 -2.536 41 HD12 LEU 666 HD12 LEU 666 0.526 -9.689 -2.132 42 HD13 LEU 666 HD13 LEU 666 2.250 -9.323 -2.096 43 HD21 LEU 666 HD21 LEU 666 -0.018 -10.311 -5.441 44 HD22 LEU 666 HD22 LEU 666 -0.704 -9.675 -3.947 45 HD23 LEU 666 HD23 LEU 666 -0.124 -8.569 -5.191 46 H SER 667 H SER 667 5.388 -9.297 -6.123 47 HA SER 667 HA SER 667 6.245 -6.765 -6.735 48 HB2 SER 667 HB2 SER 667 8.213 -8.063 -7.875 49 HB3 SER 667 HB3 SER 667 7.939 -8.236 -6.142 50 HG SER 667 HG SER 667 8.172 -10.223 -7.534 51 H VAL 668 H VAL 668 4.652 -8.997 -8.807 52 HA VAL 668 HA VAL 668 5.582 -8.016 -11.305 53 HB VAL 668 HB VAL 668 3.676 -9.190 -12.265 54 HG11 VAL 668 HG11 VAL 668 4.037 -11.282 -10.420 55 HG12 VAL 668 HG12 VAL 668 4.963 -11.003 -11.894 56 HG13 VAL 668 HG13 VAL 668 5.533 -10.352 -10.359 57 HG21 VAL 668 HG21 VAL 668 2.727 -9.529 -9.400 58 HG22 VAL 668 HG22 VAL 668 2.004 -8.425 -10.570 59 HG23 VAL 668 HG23 VAL 668 1.940 -10.165 -10.844 60 H HIS 669 H HIS 669 3.467 -6.669 -8.954 61 HA HIS 669 HA HIS 669 2.012 -5.019 -10.868 62 HB2 HIS 669 HB2 HIS 669 2.007 -4.798 -7.857 63 HB3 HIS 669 HB3 HIS 669 0.804 -4.180 -8.990 64 HD1 HIS 669 HD1 HIS 669 -0.102 -6.310 -10.679 65 HD2 HIS 669 HD2 HIS 669 1.136 -7.185 -6.802 66 HE1 HIS 669 HE1 HIS 669 -1.110 -8.563 -10.103 67 HE2 HIS 669 HE2 HIS 669 -0.358 -9.117 -7.740 68 H LEU 670 H LEU 670 2.589 -3.119 -11.545 69 HA LEU 670 HA LEU 670 5.023 -1.919 -11.239 70 HB2 LEU 670 HB2 LEU 670 3.443 -1.345 -13.008 71 HB3 LEU 670 HB3 LEU 670 2.361 -0.606 -11.833 72 HG LEU 670 HG LEU 670 4.126 1.059 -11.284 73 HD11 LEU 670 HD11 LEU 670 6.037 1.230 -12.936 74 HD12 LEU 670 HD12 LEU 670 6.146 -0.138 -11.820 75 HD13 LEU 670 HD13 LEU 670 5.614 -0.396 -13.483 76 HD21 LEU 670 HD21 LEU 670 3.884 2.359 -13.286 77 HD22 LEU 670 HD22 LEU 670 3.640 0.916 -14.266 78 HD23 LEU 670 HD23 LEU 670 2.406 1.414 -13.109 79 H TRP 671 H TRP 671 2.248 -1.624 -9.070 80 HA TRP 671 HA TRP 671 3.515 0.586 -7.669 81 HB2 TRP 671 HB2 TRP 671 1.503 0.013 -6.018 82 HB3 TRP 671 HB3 TRP 671 1.300 0.997 -7.456 83 HD1 TRP 671 HD1 TRP 671 -0.277 0.121 -9.306 84 HE1 TRP 671 HE1 TRP 671 -1.793 -1.974 -9.553 85 HE3 TRP 671 HE3 TRP 671 1.461 -2.665 -5.390 86 HZ2 TRP 671 HZ2 TRP 671 -2.166 -4.480 -8.256 87 HZ3 TRP 671 HZ3 TRP 671 0.503 -4.902 -4.918 88 HH2 TRP 671 HH2 TRP 671 -1.308 -5.814 -6.349 89 H TYR 672 H TYR 672 4.154 -2.632 -7.699 90 HA TYR 672 HA TYR 672 4.462 -2.932 -4.799 91 HB2 TYR 672 HB2 TYR 672 3.916 -4.766 -6.667 92 HB3 TYR 672 HB3 TYR 672 5.674 -4.899 -6.674 93 HD1 TYR 672 HD2 TYR 672 2.704 -4.888 -4.420 94 HD2 TYR 672 HD1 TYR 672 6.808 -6.048 -4.925 95 HE1 TYR 672 HE2 TYR 672 2.609 -6.169 -2.294 96 HE2 TYR 672 HE1 TYR 672 6.708 -7.326 -2.802 97 HH TYR 672 HH TYR 672 5.247 -8.256 -1.263 98 H ALA 673 H ALA 673 6.093 -1.860 -3.857 99 HA ALA 673 HA ALA 673 8.609 -1.409 -5.279 100 HB1 ALA 673 HB1 ALA 673 7.951 -0.630 -2.441 101 HB2 ALA 673 HB2 ALA 673 7.421 0.322 -3.826 102 HB3 ALA 673 HB3 ALA 673 9.142 0.096 -3.521 103 H GLY 674 H GLY 674 7.340 -3.900 -3.612 104 HA2 GLY 674 HA2 GLY 674 8.151 -5.713 -2.453 105 HA3 GLY 674 HA3 GLY 674 9.554 -5.503 -3.478 106 HA PRO 675 HA PRO 675 11.758 -5.229 0.363 107 HB2 PRO 675 HB2 PRO 675 14.152 -4.330 -0.678 108 HB3 PRO 675 HB3 PRO 675 13.612 -6.020 -0.704 109 HG2 PRO 675 HG2 PRO 675 13.517 -3.969 -2.857 110 HG3 PRO 675 HG3 PRO 675 13.881 -5.700 -2.958 111 HD2 PRO 675 HD2 PRO 675 11.465 -4.677 -3.676 112 HD3 PRO 675 HD3 PRO 675 11.643 -6.309 -2.992 113 H MET 676 H MET 676 10.785 -2.536 -1.409 114 HA MET 676 HA MET 676 12.318 -0.452 -0.293 115 HB2 MET 676 HB2 MET 676 10.711 -0.227 -2.198 116 HB3 MET 676 HB3 MET 676 9.390 -0.325 -1.033 117 HG2 MET 676 HG2 MET 676 10.168 2.036 -1.710 118 HG3 MET 676 HG3 MET 676 10.012 1.714 0.016 119 HE1 MET 676 HE1 MET 676 12.007 2.546 -2.932 120 HE2 MET 676 HE2 MET 676 13.711 2.509 -2.491 121 HE3 MET 676 HE3 MET 676 12.845 1.001 -2.814 122 H GLU 677 H GLU 677 11.827 1.028 1.400 123 HA GLU 677 HA GLU 677 10.298 -0.179 3.626 124 HB2 GLU 677 HB2 GLU 677 11.782 1.425 5.020 125 HB3 GLU 677 HB3 GLU 677 12.511 -0.045 4.377 126 HG2 GLU 677 HG2 GLU 677 13.304 1.303 2.399 127 HG3 GLU 677 HG3 GLU 677 12.721 2.743 3.214 128 H ARG 678 H ARG 678 9.405 1.476 5.190 129 HA ARG 678 HA ARG 678 7.505 3.103 3.995 130 HB2 ARG 678 HB2 ARG 678 7.391 2.441 6.348 131 HB3 ARG 678 HB3 ARG 678 8.801 3.425 6.719 132 HG2 ARG 678 HG2 ARG 678 6.980 5.140 5.390 133 HG3 ARG 678 HG3 ARG 678 6.021 4.218 6.546 134 HD2 ARG 678 HD2 ARG 678 8.497 5.021 7.784 135 HD3 ARG 678 HD3 ARG 678 7.720 6.432 7.079 136 HE ARG 678 HE ARG 678 6.765 4.852 9.344 137 HH11 ARG 678 HH21 ARG 678 5.935 7.098 6.792 138 HH12 ARG 678 HH22 ARG 678 4.585 7.746 7.674 139 HH21 ARG 678 HH11 ARG 678 5.028 5.714 10.446 140 HH22 ARG 678 HH12 ARG 678 4.066 6.967 9.698 141 H ALA 679 H ALA 679 10.339 4.369 5.736 142 HA ALA 679 HA ALA 679 10.294 6.987 4.896 143 HB1 ALA 679 HB1 ALA 679 12.987 5.799 4.940 144 HB2 ALA 679 HB2 ALA 679 12.004 5.414 6.351 145 HB3 ALA 679 HB3 ALA 679 12.312 7.099 5.927 146 H GLY 680 H GLY 680 11.680 4.197 3.266 147 HA2 GLY 680 HA2 GLY 680 12.845 5.596 1.093 148 HA3 GLY 680 HA3 GLY 680 12.478 3.874 1.131 149 H ALA 681 H ALA 681 9.781 3.856 1.503 150 HA ALA 681 HA ALA 681 8.750 4.243 -1.082 151 HB1 ALA 681 HB1 ALA 681 7.483 3.833 1.620 152 HB2 ALA 681 HB2 ALA 681 7.596 2.701 0.273 153 HB3 ALA 681 HB3 ALA 681 6.492 4.074 0.181 154 H GLU 682 H GLU 682 8.634 6.286 1.799 155 HA GLU 682 HA GLU 682 6.872 8.251 0.782 156 HB2 GLU 682 HB2 GLU 682 9.084 8.821 2.750 157 HB3 GLU 682 HB3 GLU 682 7.491 9.566 2.647 158 HG2 GLU 682 HG2 GLU 682 6.831 6.926 2.982 159 HG3 GLU 682 HG3 GLU 682 8.307 7.028 3.920 160 H SER 683 H SER 683 10.305 7.714 0.422 161 HA SER 683 HA SER 683 11.123 10.247 -0.428 162 HB2 SER 683 HB2 SER 683 13.070 9.186 -1.275 163 HB3 SER 683 HB3 SER 683 12.574 8.223 0.115 164 HG SER 683 HG SER 683 11.710 6.699 -1.244 165 H ILE 684 H ILE 684 10.423 7.452 -2.518 166 HA ILE 684 HA ILE 684 10.373 8.910 -4.931 167 HB ILE 684 HB ILE 684 8.679 6.459 -4.440 168 HG12 ILE 684 HG12 ILE 684 11.173 5.618 -5.407 169 HG13 ILE 684 HG13 ILE 684 11.563 6.752 -4.114 170 HG21 ILE 684 HG21 ILE 684 8.986 7.947 -6.674 171 HG22 ILE 684 HG22 ILE 684 10.372 6.873 -6.856 172 HG23 ILE 684 HG23 ILE 684 8.749 6.201 -6.724 173 HD11 ILE 684 HD11 ILE 684 11.298 4.811 -2.879 174 HD12 ILE 684 HD12 ILE 684 9.647 5.427 -2.838 175 HD13 ILE 684 HD13 ILE 684 10.084 4.154 -3.976 176 H LEU 685 H LEU 685 7.806 7.913 -2.728 177 HA LEU 685 HA LEU 685 5.629 9.005 -4.113 178 HB2 LEU 685 HB2 LEU 685 6.129 8.541 -1.170 179 HB3 LEU 685 HB3 LEU 685 4.576 9.091 -1.798 180 HG LEU 685 HG LEU 685 6.001 6.577 -2.718 181 HD11 LEU 685 HD11 LEU 685 5.266 6.299 -0.419 182 HD12 LEU 685 HD12 LEU 685 3.677 6.957 -0.814 183 HD13 LEU 685 HD13 LEU 685 4.180 5.405 -1.481 184 HD21 LEU 685 HD21 LEU 685 3.850 8.117 -3.802 185 HD22 LEU 685 HD22 LEU 685 4.502 6.589 -4.387 186 HD23 LEU 685 HD23 LEU 685 3.192 6.595 -3.209 187 H ALA 686 H ALA 686 7.407 10.457 -1.346 188 HA ALA 686 HA ALA 686 6.257 12.999 -1.446 189 HB1 ALA 686 HB1 ALA 686 9.134 12.308 -0.793 190 HB2 ALA 686 HB2 ALA 686 7.786 12.225 0.341 191 HB3 ALA 686 HB3 ALA 686 8.288 13.782 -0.319 192 H ASN 687 H ASN 687 8.932 11.645 -3.329 193 HA ASN 687 HA ASN 687 9.609 14.088 -4.658 194 HB2 ASN 687 HB2 ASN 687 11.077 12.021 -4.400 195 HB3 ASN 687 HB3 ASN 687 10.125 11.301 -5.694 196 HD21 ASN 687 HD21 ASN 687 9.792 13.963 -7.094 197 HD22 ASN 687 HD22 ASN 687 11.311 14.272 -7.792 198 H ARG 688 H ARG 688 7.317 11.493 -5.299 199 HA ARG 688 HA ARG 688 6.777 12.359 -8.005 200 HB2 ARG 688 HB2 ARG 688 6.341 10.029 -6.593 201 HB3 ARG 688 HB3 ARG 688 4.723 10.716 -6.699 202 HG2 ARG 688 HG2 ARG 688 4.767 9.615 -8.727 203 HG3 ARG 688 HG3 ARG 688 5.495 11.137 -9.238 204 HD2 ARG 688 HD2 ARG 688 7.747 10.178 -8.849 205 HD3 ARG 688 HD3 ARG 688 7.008 8.657 -8.361 206 HE ARG 688 HE ARG 688 6.528 8.178 -10.623 207 HH11 ARG 688 HH21 ARG 688 7.616 11.437 -10.202 208 HH12 ARG 688 HH22 ARG 688 7.801 11.729 -11.894 209 HH21 ARG 688 HH11 ARG 688 6.762 8.546 -12.808 210 HH22 ARG 688 HH12 ARG 688 7.320 10.097 -13.368 211 H SER 689 H SER 689 3.841 12.030 -7.726 212 HA SER 689 HA SER 689 3.257 14.761 -6.747 213 HB2 SER 689 HB2 SER 689 2.582 13.410 -9.138 214 HB3 SER 689 HB3 SER 689 1.085 13.587 -8.224 215 HG SER 689 HG SER 689 2.208 15.418 -9.645 216 H ASP 690 H ASP 690 1.402 15.161 -5.452 217 HA ASP 690 HA ASP 690 0.877 13.248 -3.472 218 HB2 ASP 690 HB2 ASP 690 0.066 15.953 -4.018 219 HB3 ASP 690 HB3 ASP 690 -1.336 15.005 -3.530 220 H GLY 691 H GLY 691 -0.212 11.448 -3.567 221 HA2 GLY 691 HA2 GLY 691 -2.511 10.495 -4.028 222 HA3 GLY 691 HA3 GLY 691 -2.287 11.128 -5.655 223 H THR 692 H THR 692 0.628 10.528 -5.478 224 HA THR 692 HA THR 692 0.723 8.063 -6.812 225 HB THR 692 HB THR 692 2.984 9.266 -5.199 226 HG1 THR 692 HG1 THR 692 2.229 10.921 -6.443 227 HG21 THR 692 HG21 THR 692 4.350 8.283 -7.024 228 HG22 THR 692 HG22 THR 692 3.430 7.055 -6.157 229 HG23 THR 692 HG23 THR 692 2.885 7.613 -7.738 230 H PHE 693 H PHE 693 1.076 5.943 -6.138 231 HA PHE 693 HA PHE 693 1.390 5.497 -3.233 232 HB2 PHE 693 HB2 PHE 693 -0.434 3.964 -3.145 233 HB3 PHE 693 HB3 PHE 693 -1.036 5.417 -3.941 234 HD1 PHE 693 HD1 PHE 693 -1.393 5.463 -6.391 235 HD2 PHE 693 HD2 PHE 693 -0.149 1.889 -4.359 236 HE1 PHE 693 HE1 PHE 693 -2.014 4.117 -8.378 237 HE2 PHE 693 HE2 PHE 693 -0.771 0.549 -6.345 238 HZ PHE 693 HZ PHE 693 -1.701 1.660 -8.357 239 H LEU 694 H LEU 694 1.692 3.124 -2.721 240 HA LEU 694 HA LEU 694 2.677 1.339 -4.708 241 HB2 LEU 694 HB2 LEU 694 5.035 1.372 -4.239 242 HB3 LEU 694 HB3 LEU 694 4.536 3.001 -4.659 243 HG LEU 694 HG LEU 694 4.186 3.218 -2.039 244 HD11 LEU 694 HD11 LEU 694 6.544 1.790 -1.444 245 HD12 LEU 694 HD12 LEU 694 4.915 1.419 -0.887 246 HD13 LEU 694 HD13 LEU 694 5.535 0.671 -2.357 247 HD21 LEU 694 HD21 LEU 694 6.502 4.089 -1.883 248 HD22 LEU 694 HD22 LEU 694 6.902 3.272 -3.392 249 HD23 LEU 694 HD23 LEU 694 5.727 4.586 -3.383 250 H VAL 695 H VAL 695 3.816 -0.542 -3.734 251 HA VAL 695 HA VAL 695 2.926 -1.060 -0.947 252 HB VAL 695 HB VAL 695 2.934 -3.100 -3.183 253 HG11 VAL 695 HG11 VAL 695 3.178 -4.179 -1.065 254 HG12 VAL 695 HG12 VAL 695 2.039 -3.079 -0.292 255 HG13 VAL 695 HG13 VAL 695 1.458 -4.282 -1.442 256 HG21 VAL 695 HG21 VAL 695 0.660 -1.510 -1.953 257 HG22 VAL 695 HG22 VAL 695 1.210 -1.422 -3.626 258 HG23 VAL 695 HG23 VAL 695 0.444 -2.892 -3.026 259 H ARG 696 H ARG 696 4.310 -2.396 0.330 260 HA ARG 696 HA ARG 696 6.870 -3.167 -0.914 261 HB2 ARG 696 HB2 ARG 696 8.170 -2.044 0.850 262 HB3 ARG 696 HB3 ARG 696 7.252 -0.888 -0.111 263 HG2 ARG 696 HG2 ARG 696 5.641 -0.569 1.598 264 HG3 ARG 696 HG3 ARG 696 6.139 -2.024 2.454 265 HD2 ARG 696 HD2 ARG 696 8.439 -0.374 2.273 266 HD3 ARG 696 HD3 ARG 696 7.115 0.671 2.762 267 HE ARG 696 HE ARG 696 7.003 -0.472 4.792 268 HH11 ARG 696 HH21 ARG 696 9.156 -2.086 2.604 269 HH12 ARG 696 HH22 ARG 696 9.506 -3.363 3.727 270 HH21 ARG 696 HH11 ARG 696 7.543 -2.106 6.235 271 HH22 ARG 696 HH12 ARG 696 8.617 -3.389 5.763 272 H GLN 697 H GLN 697 8.216 -4.532 0.429 273 HA GLN 697 HA GLN 697 6.563 -6.267 2.129 274 HB2 GLN 697 HB2 GLN 697 9.342 -6.781 1.046 275 HB3 GLN 697 HB3 GLN 697 8.254 -7.963 1.777 276 HG2 GLN 697 HG2 GLN 697 6.802 -6.710 -0.320 277 HG3 GLN 697 HG3 GLN 697 8.394 -7.094 -0.968 278 HE21 GLN 697 HE21 GLN 697 8.892 -9.478 0.588 279 HE22 GLN 697 HE22 GLN 697 7.797 -10.665 0.068 280 H ARG 698 H ARG 698 9.692 -6.931 2.834 281 HA ARG 698 HA ARG 698 10.793 -6.874 4.865 282 HB2 ARG 698 HB2 ARG 698 11.039 -4.469 3.422 283 HB3 ARG 698 HB3 ARG 698 10.850 -3.996 5.111 284 HG2 ARG 698 HG2 ARG 698 12.612 -5.785 5.650 285 HG3 ARG 698 HG3 ARG 698 12.934 -5.834 3.915 286 HD2 ARG 698 HD2 ARG 698 13.089 -3.360 5.665 287 HD3 ARG 698 HD3 ARG 698 14.471 -4.277 5.066 288 HE ARG 698 HE ARG 698 13.031 -3.619 2.805 289 HH11 ARG 698 HH21 ARG 698 14.503 -1.892 5.415 290 HH12 ARG 698 HH22 ARG 698 14.775 -0.443 4.476 291 HH21 ARG 698 HH11 ARG 698 13.375 -1.796 1.613 292 HH22 ARG 698 HH12 ARG 698 14.139 -0.406 2.340 293 H VAL 699 H VAL 699 9.376 -7.700 6.334 294 HA VAL 699 HA VAL 699 8.691 -7.392 8.613 295 HB VAL 699 HB VAL 699 7.520 -4.774 7.628 296 HG11 VAL 699 HG11 VAL 699 5.979 -5.637 9.230 297 HG12 VAL 699 HG12 VAL 699 7.276 -6.262 10.248 298 HG13 VAL 699 HG13 VAL 699 7.012 -4.523 10.126 299 HG21 VAL 699 HG21 VAL 699 9.997 -4.821 8.079 300 HG22 VAL 699 HG22 VAL 699 9.114 -3.776 9.189 301 HG23 VAL 699 HG23 VAL 699 9.645 -5.371 9.715 302 H LYS 700 H LYS 700 6.417 -6.156 6.135 303 HA LYS 700 HA LYS 700 4.149 -7.553 7.110 304 HB2 LYS 700 HB2 LYS 700 3.142 -7.010 4.969 305 HB3 LYS 700 HB3 LYS 700 4.098 -5.631 5.508 306 HG2 LYS 700 HG2 LYS 700 5.224 -5.715 3.557 307 HG3 LYS 700 HG3 LYS 700 5.893 -7.267 4.061 308 HD2 LYS 700 HD2 LYS 700 3.366 -7.978 3.191 309 HD3 LYS 700 HD3 LYS 700 3.789 -6.679 2.081 310 HE2 LYS 700 HE2 LYS 700 4.611 -8.646 1.037 311 HE3 LYS 700 HE3 LYS 700 6.032 -7.917 1.765 312 HZ1 LYS 700 HZ1 LYS 700 4.722 -9.586 3.637 313 HZ2 LYS 700 HZ2 LYS 700 5.057 -10.457 2.206 314 HZ3 LYS 700 HZ3 LYS 700 6.342 -9.692 3.048 315 H ASP 701 H ASP 701 6.404 -9.354 7.012 316 HA ASP 701 HA ASP 701 5.536 -11.219 4.888 317 HB2 ASP 701 HB2 ASP 701 8.192 -11.243 6.319 318 HB3 ASP 701 HB3 ASP 701 7.756 -12.068 4.822 319 H ALA 702 H ALA 702 3.997 -11.111 7.155 320 HA ALA 702 HA ALA 702 4.636 -13.709 8.439 321 HB1 ALA 702 HB1 ALA 702 4.228 -11.150 9.677 322 HB2 ALA 702 HB2 ALA 702 4.552 -12.702 10.448 323 HB3 ALA 702 HB3 ALA 702 2.891 -12.213 10.116 324 H ALA 703 H ALA 703 2.104 -11.390 7.593 325 HA ALA 703 HA ALA 703 0.454 -13.145 6.173 326 HB1 ALA 703 HB1 ALA 703 -0.833 -12.704 8.842 327 HB2 ALA 703 HB2 ALA 703 0.313 -14.032 8.679 328 HB3 ALA 703 HB3 ALA 703 -1.120 -13.977 7.656 329 H GLU 704 H GLU 704 1.419 -10.436 6.196 330 HA GLU 704 HA GLU 704 -1.123 -9.032 5.837 331 HB2 GLU 704 HB2 GLU 704 -0.356 -7.124 7.216 332 HB3 GLU 704 HB3 GLU 704 -0.536 -8.594 8.174 333 HG2 GLU 704 HG2 GLU 704 2.087 -7.593 7.016 334 HG3 GLU 704 HG3 GLU 704 1.590 -7.396 8.692 335 H PHE 705 H PHE 705 -0.622 -6.711 5.101 336 HA PHE 705 HA PHE 705 1.829 -6.405 3.505 337 HB2 PHE 705 HB2 PHE 705 -0.957 -6.586 2.330 338 HB3 PHE 705 HB3 PHE 705 0.370 -5.774 1.498 339 HD1 PHE 705 HD1 PHE 705 -0.862 -9.017 2.787 340 HD2 PHE 705 HD2 PHE 705 2.221 -7.024 0.557 341 HE1 PHE 705 HE1 PHE 705 -0.016 -11.210 2.000 342 HE2 PHE 705 HE2 PHE 705 3.065 -9.216 -0.234 343 HZ PHE 705 HZ PHE 705 1.948 -11.310 0.488 344 H ALA 706 H ALA 706 1.429 -4.114 2.237 345 HA ALA 706 HA ALA 706 -0.183 -2.254 3.726 346 HB1 ALA 706 HB1 ALA 706 1.502 -2.445 5.401 347 HB2 ALA 706 HB2 ALA 706 1.819 -0.930 4.553 348 HB3 ALA 706 HB3 ALA 706 2.790 -2.360 4.201 349 H ILE 707 H ILE 707 -0.722 -0.638 2.432 350 HA ILE 707 HA ILE 707 0.904 -0.168 0.014 351 HB ILE 707 HB ILE 707 -1.856 0.918 0.601 352 HG12 ILE 707 HG12 ILE 707 -1.109 -1.576 -0.956 353 HG13 ILE 707 HG13 ILE 707 -1.804 -1.584 0.664 354 HG21 ILE 707 HG21 ILE 707 -0.455 2.001 -1.187 355 HG22 ILE 707 HG22 ILE 707 -0.380 0.442 -2.008 356 HG23 ILE 707 HG23 ILE 707 -1.929 1.258 -1.806 357 HD11 ILE 707 HD11 ILE 707 -3.202 -0.013 -1.463 358 HD12 ILE 707 HD12 ILE 707 -3.354 -1.769 -1.486 359 HD13 ILE 707 HD13 ILE 707 -3.873 -0.858 -0.070 360 H SER 708 H SER 708 1.999 1.666 -0.291 361 HA SER 708 HA SER 708 1.751 3.771 1.781 362 HB2 SER 708 HB2 SER 708 4.030 3.226 -0.134 363 HB3 SER 708 HB3 SER 708 4.014 4.435 1.145 364 HG SER 708 HG SER 708 3.848 1.601 1.411 365 H ILE 709 H ILE 709 0.564 5.479 1.158 366 HA ILE 709 HA ILE 709 0.635 6.212 -1.711 367 HB ILE 709 HB ILE 709 -1.668 6.789 0.145 368 HG12 ILE 709 HG12 ILE 709 -2.485 4.774 -1.576 369 HG13 ILE 709 HG13 ILE 709 -0.860 4.263 -1.124 370 HG21 ILE 709 HG21 ILE 709 -1.003 7.238 -2.697 371 HG22 ILE 709 HG22 ILE 709 -2.595 6.526 -2.438 372 HG23 ILE 709 HG23 ILE 709 -2.180 8.061 -1.675 373 HD11 ILE 709 HD11 ILE 709 -2.680 3.434 0.417 374 HD12 ILE 709 HD12 ILE 709 -1.405 4.348 1.223 375 HD13 ILE 709 HD13 ILE 709 -2.959 5.111 0.888 376 H LYS 710 H LYS 710 1.060 8.215 -2.284 377 HA LYS 710 HA LYS 710 2.155 10.053 -0.363 378 HB2 LYS 710 HB2 LYS 710 3.099 9.949 -2.591 379 HB3 LYS 710 HB3 LYS 710 1.530 10.274 -3.320 380 HG2 LYS 710 HG2 LYS 710 2.682 12.355 -3.357 381 HG3 LYS 710 HG3 LYS 710 1.546 12.462 -2.018 382 HD2 LYS 710 HD2 LYS 710 3.586 11.504 -0.632 383 HD3 LYS 710 HD3 LYS 710 4.516 12.219 -1.949 384 HE2 LYS 710 HE2 LYS 710 4.202 13.821 -0.098 385 HE3 LYS 710 HE3 LYS 710 3.398 14.382 -1.562 386 HZ1 LYS 710 HZ1 LYS 710 2.048 14.528 0.486 387 HZ2 LYS 710 HZ2 LYS 710 1.292 13.656 -0.765 388 HZ3 LYS 710 HZ3 LYS 710 2.023 12.827 0.559 389 H TYR 711 H TYR 711 0.986 11.399 0.881 390 HA TYR 711 HA TYR 711 -1.495 12.570 -0.204 391 HB2 TYR 711 HB2 TYR 711 -1.791 10.447 1.336 392 HB3 TYR 711 HB3 TYR 711 -1.464 11.597 2.632 393 HD1 TYR 711 HD2 TYR 711 -2.838 13.818 2.592 394 HD2 TYR 711 HD1 TYR 711 -3.940 10.264 0.460 395 HE1 TYR 711 HE2 TYR 711 -5.171 14.647 2.420 396 HE2 TYR 711 HE1 TYR 711 -6.271 11.092 0.286 397 HH TYR 711 HH TYR 711 -7.574 12.986 0.469 398 H ASN 712 H ASN 712 -1.627 14.687 0.192 399 HA ASN 712 HA ASN 712 -0.946 16.797 0.872 400 HB2 ASN 712 HB2 ASN 712 -2.482 16.084 2.665 401 HB3 ASN 712 HB3 ASN 712 -1.127 15.390 3.546 402 HD21 ASN 712 HD21 ASN 712 0.260 16.819 4.709 403 HD22 ASN 712 HD22 ASN 712 -0.027 18.491 4.806 404 H VAL 713 H VAL 713 1.204 16.291 -0.138 405 HA VAL 713 HA VAL 713 3.494 16.123 -0.083 406 HB VAL 713 HB VAL 713 4.556 17.894 1.044 407 HG11 VAL 713 HG11 VAL 713 2.761 19.755 1.000 408 HG12 VAL 713 HG12 VAL 713 3.060 18.874 -0.497 409 HG13 VAL 713 HG13 VAL 713 1.649 18.488 0.488 410 HG21 VAL 713 HG21 VAL 713 2.502 18.685 2.949 411 HG22 VAL 713 HG22 VAL 713 3.067 17.049 3.272 412 HG23 VAL 713 HG23 VAL 713 4.216 18.382 3.220 413 H GLU 714 H GLU 714 1.907 14.317 1.832 414 HA GLU 714 HA GLU 714 4.269 13.272 3.254 415 HB2 GLU 714 HB2 GLU 714 1.460 13.652 4.321 416 HB3 GLU 714 HB3 GLU 714 2.634 12.579 5.081 417 HG2 GLU 714 HG2 GLU 714 3.705 14.313 6.056 418 HG3 GLU 714 HG3 GLU 714 3.822 15.176 4.528 419 H VAL 715 H VAL 715 3.474 10.908 4.105 420 HA VAL 715 HA VAL 715 2.085 9.598 1.837 421 HB VAL 715 HB VAL 715 4.617 8.671 3.215 422 HG11 VAL 715 HG11 VAL 715 2.864 7.335 1.136 423 HG12 VAL 715 HG12 VAL 715 4.488 6.797 1.558 424 HG13 VAL 715 HG13 VAL 715 3.204 6.749 2.763 425 HG21 VAL 715 HG21 VAL 715 4.819 8.748 0.392 426 HG22 VAL 715 HG22 VAL 715 4.081 10.270 0.879 427 HG23 VAL 715 HG23 VAL 715 5.637 9.793 1.553 428 H LYS 716 H LYS 716 0.893 7.754 2.304 429 HA LYS 716 HA LYS 716 0.443 7.253 5.195 430 HB2 LYS 716 HB2 LYS 716 -1.387 8.363 3.537 431 HB3 LYS 716 HB3 LYS 716 -1.739 6.656 3.276 432 HG2 LYS 716 HG2 LYS 716 -2.535 6.347 5.412 433 HG3 LYS 716 HG3 LYS 716 -1.370 7.476 6.111 434 HD2 LYS 716 HD2 LYS 716 -3.800 8.306 4.492 435 HD3 LYS 716 HD3 LYS 716 -3.726 8.303 6.233 436 HE2 LYS 716 HE2 LYS 716 -1.543 9.770 5.789 437 HE3 LYS 716 HE3 LYS 716 -2.398 10.130 4.289 438 HZ1 LYS 716 HZ1 LYS 716 -3.660 11.545 5.419 439 HZ2 LYS 716 HZ2 LYS 716 -4.278 10.258 6.368 440 HZ3 LYS 716 HZ3 LYS 716 -2.898 11.129 6.880 441 H HIS 717 H HIS 717 1.079 5.284 5.783 442 HA HIS 717 HA HIS 717 0.872 3.059 3.837 443 HB2 HIS 717 HB2 HIS 717 2.708 2.887 6.202 444 HB3 HIS 717 HB3 HIS 717 2.813 2.061 4.651 445 HD1 HIS 717 HD1 HIS 717 4.231 3.122 2.847 446 HD2 HIS 717 HD2 HIS 717 3.562 5.712 6.067 447 HE1 HIS 717 HE1 HIS 717 5.845 5.076 2.596 448 HE2 HIS 717 HE2 HIS 717 5.446 6.651 4.559 449 H ILE 718 H ILE 718 -0.948 1.965 4.356 450 HA ILE 718 HA ILE 718 -1.606 1.582 7.221 451 HB ILE 718 HB ILE 718 -3.239 1.839 4.737 452 HG12 ILE 718 HG12 ILE 718 -2.897 3.641 6.470 453 HG13 ILE 718 HG13 ILE 718 -4.584 3.221 6.171 454 HG21 ILE 718 HG21 ILE 718 -3.972 -0.350 5.435 455 HG22 ILE 718 HG22 ILE 718 -3.983 0.133 7.129 456 HG23 ILE 718 HG23 ILE 718 -5.172 0.802 6.015 457 HD11 ILE 718 HD11 ILE 718 -4.874 2.533 8.294 458 HD12 ILE 718 HD12 ILE 718 -3.428 1.531 8.238 459 HD13 ILE 718 HD13 ILE 718 -3.299 3.238 8.651 460 H LYS 719 H LYS 719 -2.049 -0.461 8.008 461 HA LYS 719 HA LYS 719 -0.560 -2.588 6.798 462 HB2 LYS 719 HB2 LYS 719 -1.454 -3.896 8.786 463 HB3 LYS 719 HB3 LYS 719 -0.522 -2.453 9.176 464 HG2 LYS 719 HG2 LYS 719 -2.275 -1.741 10.404 465 HG3 LYS 719 HG3 LYS 719 -3.178 -1.551 8.902 466 HD2 LYS 719 HD2 LYS 719 -3.553 -4.170 9.194 467 HD3 LYS 719 HD3 LYS 719 -3.257 -3.789 10.891 468 HE2 LYS 719 HE2 LYS 719 -4.982 -1.841 10.450 469 HE3 LYS 719 HE3 LYS 719 -5.487 -2.860 9.101 470 HZ1 LYS 719 HZ1 LYS 719 -5.946 -4.648 10.577 471 HZ2 LYS 719 HZ2 LYS 719 -5.242 -3.839 11.895 472 HZ3 LYS 719 HZ3 LYS 719 -6.717 -3.257 11.241 473 H ILE 720 H ILE 720 -1.246 -3.988 5.319 474 HA ILE 720 HA ILE 720 -4.125 -4.291 4.878 475 HB ILE 720 HB ILE 720 -1.694 -4.954 3.259 476 HG12 ILE 720 HG12 ILE 720 -4.344 -3.576 2.728 477 HG13 ILE 720 HG13 ILE 720 -2.795 -2.779 2.990 478 HG21 ILE 720 HG21 ILE 720 -3.011 -7.033 3.241 479 HG22 ILE 720 HG22 ILE 720 -4.473 -6.118 2.879 480 HG23 ILE 720 HG23 ILE 720 -3.175 -6.211 1.693 481 HD11 ILE 720 HD11 ILE 720 -3.402 -4.686 0.721 482 HD12 ILE 720 HD12 ILE 720 -3.369 -2.932 0.585 483 HD13 ILE 720 HD13 ILE 720 -1.891 -3.812 0.969 484 H MET 721 H MET 721 -5.148 -5.768 5.949 485 HA MET 721 HA MET 721 -3.699 -8.043 7.092 486 HB2 MET 721 HB2 MET 721 -5.868 -6.409 7.913 487 HB3 MET 721 HB3 MET 721 -6.499 -8.041 7.703 488 HG2 MET 721 HG2 MET 721 -5.306 -8.860 9.469 489 HG3 MET 721 HG3 MET 721 -3.880 -7.900 9.076 490 HE1 MET 721 HE1 MET 721 -4.299 -8.471 11.657 491 HE2 MET 721 HE2 MET 721 -4.723 -7.146 12.739 492 HE3 MET 721 HE3 MET 721 -5.967 -8.273 12.188 493 H THR 722 H THR 722 -5.198 -10.026 7.288 494 HA THR 722 HA THR 722 -6.715 -10.687 4.918 495 HB THR 722 HB THR 722 -4.296 -11.100 4.300 496 HG1 THR 722 HG1 THR 722 -6.066 -12.192 3.353 497 HG21 THR 722 HG21 THR 722 -3.009 -12.649 5.421 498 HG22 THR 722 HG22 THR 722 -3.955 -12.033 6.776 499 HG23 THR 722 HG23 THR 722 -4.407 -13.553 6.001 500 H ALA 723 H ALA 723 -7.123 -13.244 5.137 501 HA ALA 723 HA ALA 723 -7.237 -14.482 7.590 502 HB1 ALA 723 HB1 ALA 723 -8.466 -12.793 8.655 503 HB2 ALA 723 HB2 ALA 723 -9.725 -13.914 8.134 504 HB3 ALA 723 HB3 ALA 723 -9.409 -12.452 7.202 505 H GLU 724 H GLU 724 -10.005 -13.607 5.664 506 HA GLU 724 HA GLU 724 -10.682 -16.365 5.118 507 HB2 GLU 724 HB2 GLU 724 -12.061 -14.012 3.889 508 HB3 GLU 724 HB3 GLU 724 -12.756 -15.503 4.519 509 HG2 GLU 724 HG2 GLU 724 -13.351 -13.983 6.197 510 HG3 GLU 724 HG3 GLU 724 -11.834 -14.612 6.831 511 H GLY 725 H GLY 725 -8.183 -15.539 4.000 512 HA2 GLY 725 HA2 GLY 725 -7.010 -15.813 2.021 513 HA3 GLY 725 HA3 GLY 725 -8.506 -16.391 1.290 514 H LEU 726 H LEU 726 -8.475 -13.337 2.889 515 HA LEU 726 HA LEU 726 -8.558 -11.948 0.278 516 HB2 LEU 726 HB2 LEU 726 -10.051 -11.261 2.817 517 HB3 LEU 726 HB3 LEU 726 -10.170 -10.405 1.280 518 HG LEU 726 HG LEU 726 -10.694 -13.354 1.314 519 HD11 LEU 726 HD11 LEU 726 -11.951 -12.129 3.233 520 HD12 LEU 726 HD12 LEU 726 -12.886 -11.385 1.937 521 HD13 LEU 726 HD13 LEU 726 -12.889 -13.137 2.130 522 HD21 LEU 726 HD21 LEU 726 -11.432 -10.947 -0.309 523 HD22 LEU 726 HD22 LEU 726 -10.883 -12.535 -0.845 524 HD23 LEU 726 HD23 LEU 726 -12.541 -12.317 -0.291 525 H TYR 727 H TYR 727 -8.198 -9.553 0.531 526 HA TYR 727 HA TYR 727 -6.017 -8.973 2.475 527 HB2 TYR 727 HB2 TYR 727 -6.306 -7.999 -0.391 528 HB3 TYR 727 HB3 TYR 727 -5.060 -7.473 0.738 529 HD1 TYR 727 HD2 TYR 727 -6.476 -10.545 -0.870 530 HD2 TYR 727 HD1 TYR 727 -3.061 -8.685 0.958 531 HE1 TYR 727 HE2 TYR 727 -5.078 -12.506 -1.476 532 HE2 TYR 727 HE1 TYR 727 -1.665 -10.644 0.342 533 HH TYR 727 HH TYR 727 -2.117 -12.618 -1.825 534 H ARG 728 H ARG 728 -6.184 -7.026 3.573 535 HA ARG 728 HA ARG 728 -8.064 -5.009 2.659 536 HB2 ARG 728 HB2 ARG 728 -9.074 -5.111 5.105 537 HB3 ARG 728 HB3 ARG 728 -9.743 -6.054 3.778 538 HG2 ARG 728 HG2 ARG 728 -9.078 -8.038 4.682 539 HG3 ARG 728 HG3 ARG 728 -7.520 -7.387 5.187 540 HD2 ARG 728 HD2 ARG 728 -8.380 -6.529 7.192 541 HD3 ARG 728 HD3 ARG 728 -10.043 -6.579 6.621 542 HE ARG 728 HE ARG 728 -8.550 -8.768 7.799 543 HH11 ARG 728 HH21 ARG 728 -11.217 -7.855 5.778 544 HH12 ARG 728 HH22 ARG 728 -12.044 -9.367 6.017 545 HH21 ARG 728 HH11 ARG 728 -9.657 -10.694 8.084 546 HH22 ARG 728 HH12 ARG 728 -11.184 -10.967 7.279 547 H ILE 729 H ILE 729 -7.412 -3.050 3.166 548 HA ILE 729 HA ILE 729 -5.052 -2.608 4.724 549 HB ILE 729 HB ILE 729 -6.152 -0.127 4.512 550 HG12 ILE 729 HG12 ILE 729 -8.139 -1.287 3.356 551 HG13 ILE 729 HG13 ILE 729 -7.443 0.116 2.553 552 HG21 ILE 729 HG21 ILE 729 -3.944 -1.221 3.615 553 HG22 ILE 729 HG22 ILE 729 -4.819 -1.298 2.092 554 HG23 ILE 729 HG23 ILE 729 -4.558 0.252 2.878 555 HD11 ILE 729 HD11 ILE 729 -7.878 -2.338 1.372 556 HD12 ILE 729 HD12 ILE 729 -6.765 -1.112 0.771 557 HD13 ILE 729 HD13 ILE 729 -6.167 -2.425 1.785 558 H THR 730 H THR 730 -8.458 -2.533 5.247 559 HA THR 730 HA THR 730 -7.993 -1.838 8.079 560 HB THR 730 HB THR 730 -9.359 -0.112 6.896 561 HG1 THR 730 HG1 THR 730 -9.799 -1.234 9.177 562 HG21 THR 730 HG21 THR 730 -11.337 -0.636 5.797 563 HG22 THR 730 HG22 THR 730 -10.355 -2.045 5.401 564 HG23 THR 730 HG23 THR 730 -11.551 -2.139 6.691 565 H GLU 731 H GLU 731 -8.539 -3.320 9.453 566 HA GLU 731 HA GLU 731 -9.128 -5.940 8.905 567 HB2 GLU 731 HB2 GLU 731 -9.906 -5.989 11.301 568 HB3 GLU 731 HB3 GLU 731 -8.351 -5.170 11.079 569 HG2 GLU 731 HG2 GLU 731 -10.947 -3.636 11.003 570 HG3 GLU 731 HG3 GLU 731 -10.123 -3.954 12.518 571 H LYS 732 H LYS 732 -11.143 -3.231 8.627 572 HA LYS 732 HA LYS 732 -13.626 -4.644 9.020 573 HB2 LYS 732 HB2 LYS 732 -13.331 -1.847 7.971 574 HB3 LYS 732 HB3 LYS 732 -14.671 -2.550 8.884 575 HG2 LYS 732 HG2 LYS 732 -13.167 -2.849 10.835 576 HG3 LYS 732 HG3 LYS 732 -11.859 -2.113 9.924 577 HD2 LYS 732 HD2 LYS 732 -14.111 -0.359 9.770 578 HD3 LYS 732 HD3 LYS 732 -13.864 -0.796 11.465 579 HE2 LYS 732 HE2 LYS 732 -11.321 -0.401 10.839 580 HE3 LYS 732 HE3 LYS 732 -12.020 0.619 9.584 581 HZ1 LYS 732 HZ1 LYS 732 -12.052 0.945 12.506 582 HZ2 LYS 732 HZ2 LYS 732 -11.903 2.134 11.265 583 HZ3 LYS 732 HZ3 LYS 732 -13.434 1.460 11.635 584 H LYS 733 H LYS 733 -11.493 -4.373 6.419 585 HA LYS 733 HA LYS 733 -13.690 -4.798 4.445 586 HB2 LYS 733 HB2 LYS 733 -11.929 -2.725 4.387 587 HB3 LYS 733 HB3 LYS 733 -11.074 -3.912 3.407 588 HG2 LYS 733 HG2 LYS 733 -12.402 -2.856 1.799 589 HG3 LYS 733 HG3 LYS 733 -13.418 -4.225 2.242 590 HD2 LYS 733 HD2 LYS 733 -14.814 -2.250 2.227 591 HD3 LYS 733 HD3 LYS 733 -14.578 -2.720 3.913 592 HE2 LYS 733 HE2 LYS 733 -12.933 -1.003 4.246 593 HE3 LYS 733 HE3 LYS 733 -12.846 -0.669 2.517 594 HZ1 LYS 733 HZ1 LYS 733 -15.399 -0.384 3.957 595 HZ2 LYS 733 HZ2 LYS 733 -14.234 0.872 3.999 596 HZ3 LYS 733 HZ3 LYS 733 -14.891 0.369 2.496 597 H ALA 734 H ALA 734 -12.400 -5.741 2.312 598 HA ALA 734 HA ALA 734 -10.384 -7.660 2.760 599 HB1 ALA 734 HB1 ALA 734 -11.427 -9.539 3.435 600 HB2 ALA 734 HB2 ALA 734 -12.799 -9.268 2.362 601 HB3 ALA 734 HB3 ALA 734 -12.737 -8.468 3.930 602 H PHE 735 H PHE 735 -9.492 -7.991 0.822 603 HA PHE 735 HA PHE 735 -11.245 -8.105 -1.576 604 HB2 PHE 735 HB2 PHE 735 -8.583 -6.753 -1.175 605 HB3 PHE 735 HB3 PHE 735 -9.076 -7.300 -2.785 606 HD1 PHE 735 HD2 PHE 735 -10.315 -5.328 0.154 607 HD2 PHE 735 HD1 PHE 735 -10.461 -5.943 -4.094 608 HE1 PHE 735 HE2 PHE 735 -11.759 -3.323 -0.091 609 HE2 PHE 735 HE1 PHE 735 -11.895 -3.940 -4.341 610 HZ PHE 735 HZ PHE 735 -12.553 -2.635 -2.331 611 H ARG 736 H ARG 736 -10.432 -9.486 -3.314 612 HA ARG 736 HA ARG 736 -9.487 -11.993 -2.357 613 HB2 ARG 736 HB2 ARG 736 -9.542 -11.031 -5.215 614 HB3 ARG 736 HB3 ARG 736 -9.551 -12.700 -4.653 615 HG2 ARG 736 HG2 ARG 736 -11.727 -12.181 -3.455 616 HG3 ARG 736 HG3 ARG 736 -11.740 -10.635 -4.312 617 HD2 ARG 736 HD2 ARG 736 -11.824 -13.410 -5.494 618 HD3 ARG 736 HD3 ARG 736 -13.031 -12.131 -5.655 619 HE ARG 736 HE ARG 736 -10.911 -10.912 -6.758 620 HH11 ARG 736 HH21 ARG 736 -12.189 -14.108 -7.191 621 HH12 ARG 736 HH22 ARG 736 -11.475 -14.318 -8.750 622 HH21 ARG 736 HH11 ARG 736 -9.937 -11.204 -8.726 623 HH22 ARG 736 HH12 ARG 736 -10.214 -12.676 -9.627 624 H GLY 737 H GLY 737 -7.883 -9.176 -3.587 625 HA2 GLY 737 HA2 GLY 737 -5.296 -10.141 -2.888 626 HA3 GLY 737 HA3 GLY 737 -5.524 -10.181 -4.631 627 H LEU 738 H LEU 738 -3.632 -8.566 -3.268 628 HA LEU 738 HA LEU 738 -4.228 -5.960 -2.691 629 HB2 LEU 738 HB2 LEU 738 -1.920 -7.393 -3.810 630 HB3 LEU 738 HB3 LEU 738 -1.990 -5.704 -4.304 631 HG LEU 738 HG LEU 738 -0.704 -5.974 -2.229 632 HD11 LEU 738 HD11 LEU 738 -1.625 -4.150 -1.118 633 HD12 LEU 738 HD12 LEU 738 -2.296 -3.989 -2.736 634 HD13 LEU 738 HD13 LEU 738 -3.283 -4.661 -1.440 635 HD21 LEU 738 HD21 LEU 738 -3.152 -7.460 -1.422 636 HD22 LEU 738 HD22 LEU 738 -1.467 -7.742 -0.988 637 HD23 LEU 738 HD23 LEU 738 -2.381 -6.467 -0.189 638 H THR 739 H THR 739 -3.586 -7.280 -5.911 639 HA THR 739 HA THR 739 -3.961 -5.045 -7.475 640 HB THR 739 HB THR 739 -4.998 -7.747 -8.303 641 HG1 THR 739 HG1 THR 739 -2.316 -7.139 -8.622 642 HG21 THR 739 HG21 THR 739 -5.218 -6.118 -10.021 643 HG22 THR 739 HG22 THR 739 -3.642 -5.412 -9.660 644 HG23 THR 739 HG23 THR 739 -3.745 -7.004 -10.412 645 H GLU 740 H GLU 740 -6.476 -7.219 -6.195 646 HA GLU 740 HA GLU 740 -8.584 -5.862 -7.597 647 HB2 GLU 740 HB2 GLU 740 -9.085 -7.420 -5.080 648 HB3 GLU 740 HB3 GLU 740 -10.053 -7.338 -6.549 649 HG2 GLU 740 HG2 GLU 740 -7.603 -8.419 -7.367 650 HG3 GLU 740 HG3 GLU 740 -7.937 -9.204 -5.837 651 H LEU 741 H LEU 741 -6.887 -5.419 -4.637 652 HA LEU 741 HA LEU 741 -8.891 -3.665 -3.465 653 HB2 LEU 741 HB2 LEU 741 -7.642 -5.128 -1.993 654 HB3 LEU 741 HB3 LEU 741 -6.107 -4.550 -2.631 655 HG LEU 741 HG LEU 741 -7.001 -3.631 -0.351 656 HD11 LEU 741 HD11 LEU 741 -5.282 -2.240 -0.700 657 HD12 LEU 741 HD12 LEU 741 -5.339 -2.636 -2.418 658 HD13 LEU 741 HD13 LEU 741 -6.252 -1.259 -1.798 659 HD21 LEU 741 HD21 LEU 741 -9.213 -2.973 -1.696 660 HD22 LEU 741 HD22 LEU 741 -8.615 -1.964 -0.387 661 HD23 LEU 741 HD23 LEU 741 -8.280 -1.524 -2.057 662 H VAL 742 H VAL 742 -5.616 -3.495 -4.698 663 HA VAL 742 HA VAL 742 -5.200 -0.707 -4.502 664 HB VAL 742 HB VAL 742 -4.060 -2.808 -6.349 665 HG11 VAL 742 HG11 VAL 742 -3.469 -0.824 -7.400 666 HG12 VAL 742 HG12 VAL 742 -3.373 0.074 -5.882 667 HG13 VAL 742 HG13 VAL 742 -2.107 -1.078 -6.308 668 HG21 VAL 742 HG21 VAL 742 -3.226 -3.544 -4.394 669 HG22 VAL 742 HG22 VAL 742 -2.160 -2.138 -4.473 670 HG23 VAL 742 HG23 VAL 742 -3.657 -2.064 -3.543 671 H GLU 743 H GLU 743 -5.922 -2.691 -7.316 672 HA GLU 743 HA GLU 743 -6.199 -0.543 -9.109 673 HB2 GLU 743 HB2 GLU 743 -7.372 -3.309 -9.363 674 HB3 GLU 743 HB3 GLU 743 -6.937 -2.206 -10.675 675 HG2 GLU 743 HG2 GLU 743 -4.896 -3.163 -8.650 676 HG3 GLU 743 HG3 GLU 743 -5.248 -4.074 -10.099 677 H PHE 744 H PHE 744 -8.427 -2.014 -6.891 678 HA PHE 744 HA PHE 744 -10.808 -0.952 -8.158 679 HB2 PHE 744 HB2 PHE 744 -11.037 -2.962 -6.865 680 HB3 PHE 744 HB3 PHE 744 -10.263 -2.224 -5.469 681 HD1 PHE 744 HD2 PHE 744 -13.143 -1.488 -7.781 682 HD2 PHE 744 HD1 PHE 744 -11.648 -1.527 -3.760 683 HE1 PHE 744 HE2 PHE 744 -15.346 -0.701 -6.954 684 HE2 PHE 744 HE1 PHE 744 -13.849 -0.742 -2.924 685 HZ PHE 744 HZ PHE 744 -15.700 -0.327 -4.528 686 H TYR 745 H TYR 745 -8.646 -0.057 -5.514 687 HA TYR 745 HA TYR 745 -10.262 2.103 -4.580 688 HB2 TYR 745 HB2 TYR 745 -7.465 1.170 -4.093 689 HB3 TYR 745 HB3 TYR 745 -7.935 2.794 -3.595 690 HD1 TYR 745 HD2 TYR 745 -10.477 0.176 -3.752 691 HD2 TYR 745 HD1 TYR 745 -7.675 2.195 -1.210 692 HE1 TYR 745 HE2 TYR 745 -11.656 -0.700 -1.758 693 HE2 TYR 745 HE1 TYR 745 -8.858 1.320 0.781 694 HH TYR 745 HH TYR 745 -11.941 0.070 0.657 695 H GLN 746 H GLN 746 -8.386 1.719 -7.347 696 HA GLN 746 HA GLN 746 -7.341 4.302 -7.755 697 HB2 GLN 746 HB2 GLN 746 -8.365 2.189 -9.655 698 HB3 GLN 746 HB3 GLN 746 -7.644 3.700 -10.218 699 HG2 GLN 746 HG2 GLN 746 -5.579 3.203 -9.000 700 HG3 GLN 746 HG3 GLN 746 -6.296 1.745 -8.329 701 HE21 GLN 746 HE21 GLN 746 -7.462 0.514 -10.495 702 HE22 GLN 746 HE22 GLN 746 -6.284 0.174 -11.673 703 H GLN 747 H GLN 747 -10.532 2.959 -8.058 704 HA GLN 747 HA GLN 747 -11.609 5.571 -8.925 705 HB2 GLN 747 HB2 GLN 747 -13.116 2.958 -8.956 706 HB3 GLN 747 HB3 GLN 747 -13.437 4.425 -9.880 707 HG2 GLN 747 HG2 GLN 747 -10.903 3.839 -10.727 708 HG3 GLN 747 HG3 GLN 747 -11.537 2.221 -10.435 709 HE21 GLN 747 HE21 GLN 747 -11.056 4.017 -12.988 710 HE22 GLN 747 HE22 GLN 747 -12.488 3.782 -13.865 711 H ASN 748 H ASN 748 -11.624 3.119 -6.454 712 HA ASN 748 HA ASN 748 -13.811 4.433 -4.977 713 HB2 ASN 748 HB2 ASN 748 -13.989 2.030 -5.152 714 HB3 ASN 748 HB3 ASN 748 -12.340 1.816 -4.572 715 HD21 ASN 748 HD21 ASN 748 -12.088 1.578 -2.337 716 HD22 ASN 748 HD22 ASN 748 -13.307 1.890 -1.200 717 H SER 749 H SER 749 -13.149 6.128 -3.794 718 HA SER 749 HA SER 749 -10.656 6.854 -3.017 719 HB2 SER 749 HB2 SER 749 -13.079 7.899 -2.655 720 HB3 SER 749 HB3 SER 749 -12.808 7.292 -1.029 721 HG SER 749 HG SER 749 -10.550 8.428 -1.805 722 H LEU 750 H LEU 750 -9.220 6.409 -1.436 723 HA LEU 750 HA LEU 750 -9.185 3.865 -0.231 724 HB2 LEU 750 HB2 LEU 750 -7.660 6.385 0.402 725 HB3 LEU 750 HB3 LEU 750 -7.322 4.832 1.160 726 HG LEU 750 HG LEU 750 -7.519 4.446 -1.679 727 HD11 LEU 750 HD11 LEU 750 -5.281 6.317 -1.008 728 HD12 LEU 750 HD12 LEU 750 -6.022 5.977 -2.571 729 HD13 LEU 750 HD13 LEU 750 -6.866 6.981 -1.397 730 HD21 LEU 750 HD21 LEU 750 -6.289 3.037 -0.060 731 HD22 LEU 750 HD22 LEU 750 -5.224 3.601 -1.346 732 HD23 LEU 750 HD23 LEU 750 -5.169 4.365 0.240 733 H LYS 751 H LYS 751 -10.300 6.970 0.962 734 HA LYS 751 HA LYS 751 -10.463 6.519 3.663 735 HB2 LYS 751 HB2 LYS 751 -12.393 8.057 3.682 736 HB3 LYS 751 HB3 LYS 751 -11.045 8.643 2.725 737 HG2 LYS 751 HG2 LYS 751 -12.413 7.367 0.789 738 HG3 LYS 751 HG3 LYS 751 -13.757 7.822 1.846 739 HD2 LYS 751 HD2 LYS 751 -12.873 10.148 1.916 740 HD3 LYS 751 HD3 LYS 751 -11.609 9.672 0.794 741 HE2 LYS 751 HE2 LYS 751 -13.943 8.862 -0.473 742 HE3 LYS 751 HE3 LYS 751 -14.356 10.425 0.248 743 HZ1 LYS 751 HZ1 LYS 751 -12.146 11.243 -0.621 744 HZ2 LYS 751 HZ2 LYS 751 -12.083 9.780 -1.559 745 HZ3 LYS 751 HZ3 LYS 751 -13.345 10.918 -1.815 746 H ASP 752 H ASP 752 -12.051 4.857 1.162 747 HA ASP 752 HA ASP 752 -14.377 3.889 2.472 748 HB2 ASP 752 HB2 ASP 752 -14.332 3.354 0.205 749 HB3 ASP 752 HB3 ASP 752 -12.626 2.928 0.236 750 H CYS 753 H CYS 753 -11.004 2.932 2.503 751 HA CYS 753 HA CYS 753 -11.531 0.995 4.694 752 HB2 CYS 753 HB2 CYS 753 -9.625 0.995 2.420 753 HB3 CYS 753 HB3 CYS 753 -9.014 0.415 3.957 754 HG CYS 753 HG CYS 753 -10.899 -1.110 2.167 755 H PHE 754 H PHE 754 -9.359 3.453 3.390 756 HA PHE 754 HA PHE 754 -7.715 3.600 5.705 757 HB2 PHE 754 HB2 PHE 754 -8.140 5.376 3.321 758 HB3 PHE 754 HB3 PHE 754 -7.068 5.843 4.639 759 HD1 PHE 754 HD2 PHE 754 -7.778 2.818 2.526 760 HD2 PHE 754 HD1 PHE 754 -4.819 5.292 4.410 761 HE1 PHE 754 HE2 PHE 754 -5.982 1.421 1.544 762 HE2 PHE 754 HE1 PHE 754 -3.022 3.899 3.423 763 HZ PHE 754 HZ PHE 754 -3.605 1.963 1.990 764 H LYS 755 H LYS 755 -7.632 5.353 7.242 765 HA LYS 755 HA LYS 755 -10.285 6.307 7.958 766 HB2 LYS 755 HB2 LYS 755 -8.178 7.352 9.638 767 HB3 LYS 755 HB3 LYS 755 -9.505 6.273 10.048 768 HG2 LYS 755 HG2 LYS 755 -6.850 5.459 8.838 769 HG3 LYS 755 HG3 LYS 755 -7.371 5.177 10.492 770 HD2 LYS 755 HD2 LYS 755 -9.440 4.042 9.119 771 HD3 LYS 755 HD3 LYS 755 -8.102 3.723 8.020 772 HE2 LYS 755 HE2 LYS 755 -7.907 1.883 9.379 773 HE3 LYS 755 HE3 LYS 755 -6.881 3.005 10.267 774 HZ1 LYS 755 HZ1 LYS 755 -9.807 2.873 10.823 775 HZ2 LYS 755 HZ2 LYS 755 -8.728 1.735 11.527 776 HZ3 LYS 755 HZ3 LYS 755 -8.543 3.405 11.855 777 H SER 756 H SER 756 -7.125 7.965 7.754 778 HA SER 756 HA SER 756 -8.415 10.525 7.323 779 HB2 SER 756 HB2 SER 756 -6.205 11.455 7.403 780 HB3 SER 756 HB3 SER 756 -6.279 10.204 8.641 781 HG SER 756 HG SER 756 -4.818 9.105 7.592 782 H LEU 757 H LEU 757 -6.326 8.370 5.483 783 HA LEU 757 HA LEU 757 -5.822 9.563 3.138 784 HB2 LEU 757 HB2 LEU 757 -5.687 7.046 3.961 785 HB3 LEU 757 HB3 LEU 757 -7.131 6.897 2.971 786 HG LEU 757 HG LEU 757 -5.423 6.390 1.470 787 HD11 LEU 757 HD11 LEU 757 -6.902 8.144 0.583 788 HD12 LEU 757 HD12 LEU 757 -5.799 9.369 1.204 789 HD13 LEU 757 HD13 LEU 757 -5.265 8.274 -0.063 790 HD21 LEU 757 HD21 LEU 757 -3.302 7.527 1.376 791 HD22 LEU 757 HD22 LEU 757 -3.860 8.745 2.514 792 HD23 LEU 757 HD23 LEU 757 -3.614 7.080 3.058 793 H ASP 758 H ASP 758 -7.229 11.056 2.188 794 HA ASP 758 HA ASP 758 -9.879 9.960 1.463 795 HB2 ASP 758 HB2 ASP 758 -9.898 11.953 3.043 796 HB3 ASP 758 HB3 ASP 758 -9.290 12.914 1.698 797 H THR 759 H THR 759 -8.599 9.046 -0.325 798 HA THR 759 HA THR 759 -9.095 10.585 -2.679 799 HB THR 759 HB THR 759 -6.897 11.584 -2.066 800 HG1 THR 759 HG1 THR 759 -6.270 11.497 -4.133 801 HG21 THR 759 HG21 THR 759 -5.271 10.237 -1.280 802 HG22 THR 759 HG22 THR 759 -6.235 8.812 -1.650 803 HG23 THR 759 HG23 THR 759 -5.171 9.492 -2.875 804 H THR 760 H THR 760 -7.511 9.245 -4.496 805 HA THR 760 HA THR 760 -8.285 6.408 -4.071 806 HB THR 760 HB THR 760 -8.673 6.362 -6.581 807 HG1 THR 760 HG1 THR 760 -9.264 8.562 -7.328 808 HG21 THR 760 HG21 THR 760 -10.563 6.328 -5.120 809 HG22 THR 760 HG22 THR 760 -10.384 8.044 -4.748 810 HG23 THR 760 HG23 THR 760 -10.908 7.539 -6.356 811 H LEU 761 H LEU 761 -7.139 4.963 -5.721 812 HA LEU 761 HA LEU 761 -4.309 5.332 -5.400 813 HB2 LEU 761 HB2 LEU 761 -6.050 3.273 -6.743 814 HB3 LEU 761 HB3 LEU 761 -4.307 3.259 -6.989 815 HG LEU 761 HG LEU 761 -5.275 1.833 -5.045 816 HD11 LEU 761 HD11 LEU 761 -3.054 3.845 -4.654 817 HD12 LEU 761 HD12 LEU 761 -3.329 2.464 -3.592 818 HD13 LEU 761 HD13 LEU 761 -2.911 2.203 -5.283 819 HD21 LEU 761 HD21 LEU 761 -5.893 2.893 -3.064 820 HD22 LEU 761 HD22 LEU 761 -5.097 4.403 -3.503 821 HD23 LEU 761 HD23 LEU 761 -6.616 3.952 -4.270 822 H GLN 762 H GLN 762 -3.923 7.309 -6.430 823 HA GLN 762 HA GLN 762 -4.674 8.042 -9.016 824 HB2 GLN 762 HB2 GLN 762 -2.162 8.806 -7.511 825 HB3 GLN 762 HB3 GLN 762 -2.887 9.701 -8.841 826 HG2 GLN 762 HG2 GLN 762 -3.922 9.327 -6.040 827 HG3 GLN 762 HG3 GLN 762 -3.681 10.819 -6.930 828 HE21 GLN 762 HE21 GLN 762 -5.976 8.480 -6.058 829 HE22 GLN 762 HE22 GLN 762 -7.238 8.975 -7.092 830 H PHE 763 H PHE 763 -1.403 7.004 -8.056 831 HA PHE 763 HA PHE 763 -1.179 5.250 -10.337 832 HB2 PHE 763 HB2 PHE 763 1.046 6.859 -10.813 833 HB3 PHE 763 HB3 PHE 763 -0.401 6.751 -11.811 834 HD1 PHE 763 HD1 PHE 763 1.078 8.567 -8.899 835 HD2 PHE 763 HD2 PHE 763 -1.873 8.590 -12.021 836 HE1 PHE 763 HE1 PHE 763 0.532 10.926 -8.365 837 HE2 PHE 763 HE2 PHE 763 -2.418 10.951 -11.486 838 HZ PHE 763 HZ PHE 763 -1.216 12.119 -9.658 839 HA PRO 764 HA PRO 764 1.808 3.316 -7.773 840 HB2 PRO 764 HB2 PRO 764 3.406 2.134 -9.677 841 HB3 PRO 764 HB3 PRO 764 1.805 1.527 -9.216 842 HG2 PRO 764 HG2 PRO 764 2.611 3.121 -11.583 843 HG3 PRO 764 HG3 PRO 764 1.407 1.831 -11.441 844 HD2 PRO 764 HD2 PRO 764 0.752 4.492 -11.545 845 HD3 PRO 764 HD3 PRO 764 -0.248 3.269 -10.734 846 H PHE 765 H PHE 765 3.721 3.816 -6.794 847 HA PHE 765 HA PHE 765 5.086 6.183 -7.347 848 HB2 PHE 765 HB2 PHE 765 6.553 5.591 -5.636 849 HB3 PHE 765 HB3 PHE 765 5.117 4.647 -5.245 850 HD1 PHE 765 HD1 PHE 765 5.026 2.276 -6.557 851 HD2 PHE 765 HD2 PHE 765 8.589 4.467 -5.588 852 HE1 PHE 765 HE1 PHE 765 6.350 0.199 -6.733 853 HE2 PHE 765 HE2 PHE 765 9.919 2.382 -5.762 854 HZ PHE 765 HZ PHE 765 8.798 0.247 -6.335 855 H LYS 766 H LYS 766 5.567 2.992 -8.678 856 HA LYS 766 HA LYS 766 8.174 3.383 -9.725 857 HB2 LYS 766 HB2 LYS 766 5.935 1.475 -10.189 858 HB3 LYS 766 HB3 LYS 766 7.244 1.536 -11.365 859 HG2 LYS 766 HG2 LYS 766 8.326 1.558 -8.690 860 HG3 LYS 766 HG3 LYS 766 7.239 0.186 -8.891 861 HD2 LYS 766 HD2 LYS 766 9.418 -0.548 -9.603 862 HD3 LYS 766 HD3 LYS 766 8.452 -0.328 -11.062 863 HE2 LYS 766 HE2 LYS 766 9.931 2.072 -10.136 864 HE3 LYS 766 HE3 LYS 766 10.930 0.744 -10.729 865 HZ1 LYS 766 HZ1 LYS 766 8.828 2.259 -12.166 866 HZ2 LYS 766 HZ2 LYS 766 10.438 1.972 -12.628 867 HZ3 LYS 766 HZ3 LYS 766 9.307 0.712 -12.688 868 H GLU 767 H GLU 767 5.035 4.431 -10.725 869 HA GLU 767 HA GLU 767 5.680 4.816 -13.480 870 HB2 GLU 767 HB2 GLU 767 3.362 5.020 -11.838 871 HB3 GLU 767 HB3 GLU 767 3.598 6.591 -12.601 872 HG2 GLU 767 HG2 GLU 767 4.016 5.144 -14.763 873 HG3 GLU 767 HG3 GLU 767 3.108 3.924 -13.881 874 H1 ASP 338 H1 ASP 338 13.134 7.218 10.639 875 H2 ASP 338 H2 ASP 338 14.451 8.069 11.339 876 H3 ASP 338 H3 ASP 338 14.180 6.430 11.733 877 HA ASP 338 HA ASP 338 14.664 7.193 8.937 878 HB2 ASP 338 HB2 ASP 338 16.941 6.368 10.698 879 HB3 ASP 338 HB3 ASP 338 16.968 7.280 9.198 880 H THR 339 H THR 339 15.113 5.322 7.717 881 HA THR 339 HA THR 339 14.909 3.083 7.190 882 HB THR 339 HB THR 339 16.120 1.513 8.670 883 HG1 THR 339 HG1 THR 339 15.691 3.560 10.442 884 HG21 THR 339 HG21 THR 339 17.193 3.406 7.125 885 HG22 THR 339 HG22 THR 339 17.831 3.944 8.680 886 HG23 THR 339 HG23 THR 339 18.187 2.321 8.099 887 H GLU 340 H GLU 340 12.779 4.473 8.852 888 HA GLU 340 HA GLU 340 11.658 2.381 10.518 889 HB2 GLU 340 HB2 GLU 340 9.697 3.951 10.648 890 HB3 GLU 340 HB3 GLU 340 11.230 4.648 11.171 891 HG2 GLU 340 HG2 GLU 340 10.381 4.930 8.303 892 HG3 GLU 340 HG3 GLU 340 9.698 6.003 9.524 893 H VAL 341 H VAL 341 9.309 1.768 10.168 894 HA VAL 341 HA VAL 341 8.821 1.170 7.311 895 HB VAL 341 HB VAL 341 7.853 -1.009 8.117 896 HG11 VAL 341 HG11 VAL 341 10.136 -2.001 8.600 897 HG12 VAL 341 HG12 VAL 341 10.053 -1.013 7.143 898 HG13 VAL 341 HG13 VAL 341 10.767 -0.356 8.615 899 HG21 VAL 341 HG21 VAL 341 7.590 -0.155 10.509 900 HG22 VAL 341 HG22 VAL 341 8.314 -1.755 10.353 901 HG23 VAL 341 HG23 VAL 341 9.335 -0.355 10.679 902 H TYR 342 H TYR 342 6.444 0.122 7.242 903 HA TYR 342 HA TYR 342 4.665 2.278 7.786 904 HB2 TYR 342 HB2 TYR 342 2.941 0.349 7.175 905 HB3 TYR 342 HB3 TYR 342 3.960 1.086 5.943 906 HD1 TYR 342 HD2 TYR 342 4.993 -1.355 8.589 907 HD2 TYR 342 HD1 TYR 342 4.277 -0.680 4.407 908 HE1 TYR 342 HE2 TYR 342 5.979 -3.562 8.063 909 HE2 TYR 342 HE1 TYR 342 5.258 -2.888 3.889 910 HH TYR 342 HH TYR 342 6.905 -4.486 4.931 911 H GLU 343 H GLU 343 5.344 2.290 10.156 912 HA GLU 343 HA GLU 343 4.854 0.506 12.109 913 HB2 GLU 343 HB2 GLU 343 3.890 3.375 12.218 914 HB3 GLU 343 HB3 GLU 343 4.251 2.347 13.600 915 HG2 GLU 343 HG2 GLU 343 6.347 3.208 13.496 916 HG3 GLU 343 HG3 GLU 343 6.574 2.161 12.100 917 H SER 344 H SER 344 2.214 2.830 11.565 918 HA SER 344 HA SER 344 0.165 1.218 10.737 919 HB2 SER 344 HB2 SER 344 0.736 0.820 13.651 920 HB3 SER 344 HB3 SER 344 -0.930 0.773 13.085 921 HG SER 344 HG SER 344 1.262 -0.755 12.084 922 HA PRO 345 HA PRO 345 -0.676 5.797 11.409 923 HB2 PRO 345 HB2 PRO 345 -2.498 4.874 9.175 924 HB3 PRO 345 HB3 PRO 345 -1.646 6.420 9.343 925 HG2 PRO 345 HG2 PRO 345 -0.720 4.525 7.753 926 HG3 PRO 345 HG3 PRO 345 0.381 5.514 8.728 927 HD2 PRO 345 HD2 PRO 345 -0.380 2.653 9.083 928 HD3 PRO 345 HD3 PRO 345 1.112 3.492 9.561 929 H PTR 346 H PTR 346 -2.973 3.128 10.837 930 HA PTR 346 HA PTR 346 -4.252 3.294 13.336 931 HB2 PTR 346 HB2 PTR 346 -5.726 4.968 13.102 932 HB3 PTR 346 HB3 PTR 346 -6.503 4.051 11.820 933 HD1 PTR 346 HD1 PTR 346 -4.930 4.128 9.524 934 HD2 PTR 346 HD2 PTR 346 -5.245 7.158 12.540 935 HE1 PTR 346 HE1 PTR 346 -4.172 5.824 7.878 936 HE2 PTR 346 HE2 PTR 346 -4.495 8.863 10.909 937 H ALA 347 H ALA 347 -5.719 1.597 13.644 938 HA ALA 347 HA ALA 347 -6.067 -0.243 11.329 939 HB1 ALA 347 HB1 ALA 347 -5.619 -0.837 14.263 940 HB2 ALA 347 HB2 ALA 347 -4.540 -1.211 12.921 941 HB3 ALA 347 HB3 ALA 347 -6.082 -2.054 13.074 942 H ASP 348 H ASP 348 -7.566 -1.273 14.172 943 HA ASP 348 HA ASP 348 -10.123 -1.385 13.105 944 HB2 ASP 348 HB2 ASP 348 -9.841 -1.017 16.052 945 HB3 ASP 348 HB3 ASP 348 -10.768 -2.211 15.150 946 HA PRO 349 HA PRO 349 -11.120 2.770 15.438 947 HB2 PRO 349 HB2 PRO 349 -8.512 4.144 15.485 948 HB3 PRO 349 HB3 PRO 349 -9.687 3.912 16.791 949 HG2 PRO 349 HG2 PRO 349 -7.335 2.622 16.734 950 HG3 PRO 349 HG3 PRO 349 -8.801 1.897 17.415 951 HD2 PRO 349 HD2 PRO 349 -7.514 1.390 14.748 952 HD3 PRO 349 HD3 PRO 349 -8.282 0.238 15.866 953 H GLU 350 H GLU 350 -12.163 3.949 13.991 954 HA GLU 350 HA GLU 350 -12.680 5.282 12.213 955 HB2 GLU 350 HB2 GLU 350 -9.751 5.990 12.076 956 HB3 GLU 350 HB3 GLU 350 -11.136 6.977 11.607 957 HG2 GLU 350 HG2 GLU 350 -10.311 6.169 14.409 958 HG3 GLU 350 HG3 GLU 350 -10.407 7.798 13.747 Start of MODEL 17 1 H1 GLY 661 H1 GLY 661 5.879 -15.483 -8.648 2 H2 GLY 661 H2 GLY 661 5.659 -16.406 -10.069 3 H3 GLY 661 H3 GLY 661 6.229 -14.808 -10.175 4 HA2 GLY 661 HA2 GLY 661 7.984 -16.545 -10.473 5 HA3 GLY 661 HA3 GLY 661 8.304 -15.375 -9.191 6 H HIS 662 H HIS 662 8.022 -15.991 -7.006 7 HA HIS 662 HA HIS 662 8.544 -18.798 -6.495 8 HB2 HIS 662 HB2 HIS 662 7.987 -16.670 -4.420 9 HB3 HIS 662 HB3 HIS 662 8.953 -18.136 -4.248 10 HD1 HIS 662 HD1 HIS 662 8.982 -14.848 -6.193 11 HD2 HIS 662 HD2 HIS 662 11.647 -17.767 -4.806 12 HE1 HIS 662 HE1 HIS 662 11.334 -13.995 -6.682 13 HE2 HIS 662 HE2 HIS 662 12.958 -15.764 -5.852 14 H MET 663 H MET 663 5.884 -16.587 -6.393 15 HA MET 663 HA MET 663 3.868 -18.517 -6.375 16 HB2 MET 663 HB2 MET 663 4.646 -19.047 -4.099 17 HB3 MET 663 HB3 MET 663 4.406 -17.368 -3.623 18 HG2 MET 663 HG2 MET 663 1.982 -18.148 -4.819 19 HG3 MET 663 HG3 MET 663 2.467 -19.519 -3.823 20 HE1 MET 663 HE1 MET 663 -0.086 -18.140 -1.612 21 HE2 MET 663 HE2 MET 663 0.408 -19.252 -2.884 22 HE3 MET 663 HE3 MET 663 1.113 -19.386 -1.266 23 H GLN 664 H GLN 664 3.436 -15.988 -4.082 24 HA GLN 664 HA GLN 664 1.715 -14.553 -5.975 25 HB2 GLN 664 HB2 GLN 664 1.361 -15.234 -3.345 26 HB3 GLN 664 HB3 GLN 664 1.899 -13.561 -3.208 27 HG2 GLN 664 HG2 GLN 664 0.172 -12.883 -4.843 28 HG3 GLN 664 HG3 GLN 664 -0.383 -14.550 -4.939 29 HE21 GLN 664 HE21 GLN 664 0.528 -14.152 -1.761 30 HE22 GLN 664 HE22 GLN 664 -0.966 -13.661 -1.113 31 H ASP 665 H ASP 665 4.294 -14.283 -6.677 32 HA ASP 665 HA ASP 665 5.739 -12.170 -5.511 33 HB2 ASP 665 HB2 ASP 665 5.777 -12.861 -8.434 34 HB3 ASP 665 HB3 ASP 665 7.091 -12.247 -7.439 35 H LEU 666 H LEU 666 3.569 -10.949 -5.212 36 HA LEU 666 HA LEU 666 2.246 -9.513 -7.169 37 HB2 LEU 666 HB2 LEU 666 3.083 -8.533 -4.429 38 HB3 LEU 666 HB3 LEU 666 1.867 -7.767 -5.438 39 HG LEU 666 HG LEU 666 1.731 -10.595 -4.339 40 HD11 LEU 666 HD11 LEU 666 -0.242 -9.621 -3.104 41 HD12 LEU 666 HD12 LEU 666 1.321 -8.987 -2.592 42 HD13 LEU 666 HD13 LEU 666 0.284 -8.029 -3.647 43 HD21 LEU 666 HD21 LEU 666 0.594 -10.586 -6.449 44 HD22 LEU 666 HD22 LEU 666 -0.662 -10.394 -5.226 45 HD23 LEU 666 HD23 LEU 666 -0.102 -8.994 -6.141 46 H SER 667 H SER 667 5.516 -9.275 -6.227 47 HA SER 667 HA SER 667 6.291 -6.685 -6.684 48 HB2 SER 667 HB2 SER 667 7.959 -8.212 -6.002 49 HB3 SER 667 HB3 SER 667 7.637 -9.293 -7.355 50 HG SER 667 HG SER 667 8.206 -6.971 -8.427 51 H VAL 668 H VAL 668 4.842 -8.793 -8.943 52 HA VAL 668 HA VAL 668 5.988 -7.750 -11.330 53 HB VAL 668 HB VAL 668 4.086 -8.821 -12.467 54 HG11 VAL 668 HG11 VAL 668 4.347 -11.123 -11.121 55 HG12 VAL 668 HG12 VAL 668 5.662 -10.463 -12.096 56 HG13 VAL 668 HG13 VAL 668 5.655 -10.227 -10.347 57 HG21 VAL 668 HG21 VAL 668 2.567 -10.152 -10.737 58 HG22 VAL 668 HG22 VAL 668 2.998 -8.815 -9.671 59 HG23 VAL 668 HG23 VAL 668 2.170 -8.493 -11.194 60 H HIS 669 H HIS 669 3.652 -6.524 -9.110 61 HA HIS 669 HA HIS 669 2.390 -4.742 -11.032 62 HB2 HIS 669 HB2 HIS 669 2.161 -4.636 -8.022 63 HB3 HIS 669 HB3 HIS 669 1.036 -3.996 -9.221 64 HD1 HIS 669 HD1 HIS 669 0.289 -6.072 -11.041 65 HD2 HIS 669 HD2 HIS 669 1.255 -7.081 -7.117 66 HE1 HIS 669 HE1 HIS 669 -0.708 -8.365 -10.631 67 HE2 HIS 669 HE2 HIS 669 -0.135 -8.994 -8.238 68 H LEU 670 H LEU 670 3.087 -2.824 -11.595 69 HA LEU 670 HA LEU 670 5.514 -1.712 -11.002 70 HB2 LEU 670 HB2 LEU 670 4.109 -1.010 -12.886 71 HB3 LEU 670 HB3 LEU 670 2.965 -0.265 -11.774 72 HG LEU 670 HG LEU 670 4.741 1.299 -11.015 73 HD11 LEU 670 HD11 LEU 670 6.739 0.002 -11.400 74 HD12 LEU 670 HD12 LEU 670 6.373 -0.140 -13.120 75 HD13 LEU 670 HD13 LEU 670 6.816 1.431 -12.443 76 HD21 LEU 670 HD21 LEU 670 4.591 1.301 -14.036 77 HD22 LEU 670 HD22 LEU 670 3.226 1.762 -13.020 78 HD23 LEU 670 HD23 LEU 670 4.725 2.692 -12.959 79 H TRP 671 H TRP 671 2.516 -1.350 -9.152 80 HA TRP 671 HA TRP 671 3.705 0.707 -7.485 81 HB2 TRP 671 HB2 TRP 671 1.540 0.212 -6.084 82 HB3 TRP 671 HB3 TRP 671 1.454 1.131 -7.579 83 HD1 TRP 671 HD1 TRP 671 0.084 0.144 -9.536 84 HE1 TRP 671 HE1 TRP 671 -1.407 -1.964 -9.824 85 HE3 TRP 671 HE3 TRP 671 1.386 -2.420 -5.300 86 HZ2 TRP 671 HZ2 TRP 671 -1.922 -4.391 -8.444 87 HZ3 TRP 671 HZ3 TRP 671 0.368 -4.631 -4.819 88 HH2 TRP 671 HH2 TRP 671 -1.281 -5.619 -6.387 89 H TYR 672 H TYR 672 4.301 -2.496 -7.639 90 HA TYR 672 HA TYR 672 4.260 -2.964 -4.747 91 HB2 TYR 672 HB2 TYR 672 3.905 -4.675 -6.805 92 HB3 TYR 672 HB3 TYR 672 5.631 -4.901 -6.517 93 HD1 TYR 672 HD2 TYR 672 2.347 -4.746 -4.757 94 HD2 TYR 672 HD1 TYR 672 6.369 -6.245 -4.700 95 HE1 TYR 672 HE2 TYR 672 1.812 -6.098 -2.748 96 HE2 TYR 672 HE1 TYR 672 5.831 -7.597 -2.687 97 HH TYR 672 HH TYR 672 3.688 -8.604 -1.672 98 H ALA 673 H ALA 673 5.792 -1.997 -3.594 99 HA ALA 673 HA ALA 673 8.486 -1.605 -4.685 100 HB1 ALA 673 HB1 ALA 673 7.101 0.075 -3.231 101 HB2 ALA 673 HB2 ALA 673 8.825 -0.111 -2.916 102 HB3 ALA 673 HB3 ALA 673 7.645 -0.917 -1.880 103 H GLY 674 H GLY 674 6.839 -4.041 -3.310 104 HA2 GLY 674 HA2 GLY 674 7.307 -5.828 -1.882 105 HA3 GLY 674 HA3 GLY 674 8.607 -5.986 -3.044 106 HA PRO 675 HA PRO 675 11.362 -5.901 0.370 107 HB2 PRO 675 HB2 PRO 675 13.667 -5.162 -0.933 108 HB3 PRO 675 HB3 PRO 675 12.963 -6.789 -0.988 109 HG2 PRO 675 HG2 PRO 675 12.815 -4.593 -2.987 110 HG3 PRO 675 HG3 PRO 675 12.966 -6.341 -3.234 111 HD2 PRO 675 HD2 PRO 675 10.605 -4.992 -3.540 112 HD3 PRO 675 HD3 PRO 675 10.689 -6.699 -3.052 113 H MET 676 H MET 676 10.480 -3.060 -1.232 114 HA MET 676 HA MET 676 12.286 -1.173 -0.149 115 HB2 MET 676 HB2 MET 676 10.575 -0.825 -2.008 116 HB3 MET 676 HB3 MET 676 9.370 -0.655 -0.727 117 HG2 MET 676 HG2 MET 676 10.085 1.435 -0.190 118 HG3 MET 676 HG3 MET 676 11.778 0.960 -0.259 119 HE1 MET 676 HE1 MET 676 13.188 2.678 -2.660 120 HE2 MET 676 HE2 MET 676 13.208 1.297 -1.570 121 HE3 MET 676 HE3 MET 676 13.095 1.044 -3.315 122 H GLU 677 H GLU 677 11.826 0.447 1.490 123 HA GLU 677 HA GLU 677 10.399 -0.689 3.817 124 HB2 GLU 677 HB2 GLU 677 11.917 0.754 5.174 125 HB3 GLU 677 HB3 GLU 677 12.785 -0.463 4.232 126 HG2 GLU 677 HG2 GLU 677 13.851 1.114 2.994 127 HG3 GLU 677 HG3 GLU 677 12.363 2.025 2.748 128 H ARG 678 H ARG 678 9.712 1.089 5.383 129 HA ARG 678 HA ARG 678 7.703 2.665 4.260 130 HB2 ARG 678 HB2 ARG 678 8.028 1.918 6.697 131 HB3 ARG 678 HB3 ARG 678 9.065 3.333 6.869 132 HG2 ARG 678 HG2 ARG 678 6.468 3.852 5.558 133 HG3 ARG 678 HG3 ARG 678 6.358 3.366 7.244 134 HD2 ARG 678 HD2 ARG 678 7.992 5.152 7.836 135 HD3 ARG 678 HD3 ARG 678 8.015 5.659 6.151 136 HE ARG 678 HE ARG 678 5.980 6.725 6.490 137 HH11 ARG 678 HH21 ARG 678 6.654 4.530 9.099 138 HH12 ARG 678 HH22 ARG 678 5.097 4.764 9.861 139 HH21 ARG 678 HH11 ARG 678 3.992 7.045 7.575 140 HH22 ARG 678 HH12 ARG 678 3.658 6.171 9.040 141 H ALA 679 H ALA 679 10.588 3.996 5.882 142 HA ALA 679 HA ALA 679 10.384 6.610 4.960 143 HB1 ALA 679 HB1 ALA 679 13.126 5.479 5.161 144 HB2 ALA 679 HB2 ALA 679 12.112 5.346 6.597 145 HB3 ALA 679 HB3 ALA 679 12.447 6.931 5.897 146 H GLY 680 H GLY 680 11.971 3.827 3.505 147 HA2 GLY 680 HA2 GLY 680 13.094 5.130 1.264 148 HA3 GLY 680 HA3 GLY 680 12.684 3.415 1.340 149 H ALA 681 H ALA 681 10.023 3.396 1.718 150 HA ALA 681 HA ALA 681 8.937 3.800 -0.820 151 HB1 ALA 681 HB1 ALA 681 6.704 3.837 0.612 152 HB2 ALA 681 HB2 ALA 681 7.797 3.363 1.909 153 HB3 ALA 681 HB3 ALA 681 7.659 2.360 0.469 154 H GLU 682 H GLU 682 8.912 5.864 2.056 155 HA GLU 682 HA GLU 682 7.270 7.921 0.988 156 HB2 GLU 682 HB2 GLU 682 9.459 8.436 2.994 157 HB3 GLU 682 HB3 GLU 682 7.880 9.210 2.861 158 HG2 GLU 682 HG2 GLU 682 7.117 6.637 3.269 159 HG3 GLU 682 HG3 GLU 682 8.628 6.650 4.150 160 H SER 683 H SER 683 10.762 7.376 1.024 161 HA SER 683 HA SER 683 11.753 9.761 0.121 162 HB2 SER 683 HB2 SER 683 13.630 8.585 -0.695 163 HB3 SER 683 HB3 SER 683 13.005 7.580 0.610 164 HG SER 683 HG SER 683 12.004 6.266 -0.913 165 H ILE 684 H ILE 684 10.427 7.160 -1.874 166 HA ILE 684 HA ILE 684 10.655 8.666 -4.329 167 HB ILE 684 HB ILE 684 8.864 6.275 -3.893 168 HG12 ILE 684 HG12 ILE 684 11.324 5.379 -4.912 169 HG13 ILE 684 HG13 ILE 684 11.752 6.444 -3.572 170 HG21 ILE 684 HG21 ILE 684 9.486 5.847 -6.262 171 HG22 ILE 684 HG22 ILE 684 8.703 7.413 -6.060 172 HG23 ILE 684 HG23 ILE 684 10.452 7.323 -6.259 173 HD11 ILE 684 HD11 ILE 684 10.045 3.963 -3.528 174 HD12 ILE 684 HD12 ILE 684 11.434 4.363 -2.518 175 HD13 ILE 684 HD13 ILE 684 9.893 5.185 -2.265 176 H LEU 685 H LEU 685 7.926 7.596 -2.310 177 HA LEU 685 HA LEU 685 5.896 8.916 -3.709 178 HB2 LEU 685 HB2 LEU 685 6.139 8.172 -0.793 179 HB3 LEU 685 HB3 LEU 685 4.659 8.811 -1.509 180 HG LEU 685 HG LEU 685 6.113 6.297 -2.390 181 HD11 LEU 685 HD11 LEU 685 3.878 5.283 -1.606 182 HD12 LEU 685 HD12 LEU 685 5.005 5.800 -0.352 183 HD13 LEU 685 HD13 LEU 685 3.620 6.810 -0.766 184 HD21 LEU 685 HD21 LEU 685 3.712 7.791 -3.432 185 HD22 LEU 685 HD22 LEU 685 5.071 7.118 -4.334 186 HD23 LEU 685 HD23 LEU 685 3.844 6.047 -3.658 187 H ALA 686 H ALA 686 7.861 10.053 -0.937 188 HA ALA 686 HA ALA 686 6.667 12.542 -0.560 189 HB1 ALA 686 HB1 ALA 686 8.876 13.273 0.300 190 HB2 ALA 686 HB2 ALA 686 9.603 11.813 -0.375 191 HB3 ALA 686 HB3 ALA 686 8.415 11.688 0.923 192 H ASN 687 H ASN 687 9.117 11.541 -2.903 193 HA ASN 687 HA ASN 687 9.539 14.120 -4.060 194 HB2 ASN 687 HB2 ASN 687 11.304 12.772 -4.604 195 HB3 ASN 687 HB3 ASN 687 10.315 11.316 -4.654 196 HD21 ASN 687 HD21 ASN 687 11.150 14.237 -6.544 197 HD22 ASN 687 HD22 ASN 687 10.737 13.569 -8.047 198 H ARG 688 H ARG 688 7.441 11.374 -4.868 199 HA ARG 688 HA ARG 688 6.506 12.500 -7.319 200 HB2 ARG 688 HB2 ARG 688 6.118 10.079 -5.801 201 HB3 ARG 688 HB3 ARG 688 4.575 10.696 -6.379 202 HG2 ARG 688 HG2 ARG 688 5.193 9.528 -8.267 203 HG3 ARG 688 HG3 ARG 688 6.015 11.046 -8.627 204 HD2 ARG 688 HD2 ARG 688 8.057 10.156 -7.519 205 HD3 ARG 688 HD3 ARG 688 7.228 8.627 -7.277 206 HE ARG 688 HE ARG 688 7.103 8.414 -9.757 207 HH11 ARG 688 HH21 ARG 688 9.374 10.694 -8.367 208 HH12 ARG 688 HH22 ARG 688 10.390 10.674 -9.767 209 HH21 ARG 688 HH11 ARG 688 8.447 8.395 -11.515 210 HH22 ARG 688 HH12 ARG 688 9.874 9.390 -11.536 211 H SER 689 H SER 689 3.993 12.665 -7.585 212 HA SER 689 HA SER 689 3.206 14.881 -5.878 213 HB2 SER 689 HB2 SER 689 2.813 14.447 -8.520 214 HB3 SER 689 HB3 SER 689 1.278 13.867 -7.876 215 HG SER 689 HG SER 689 0.877 15.844 -7.001 216 H ASP 690 H ASP 690 0.826 15.029 -5.384 217 HA ASP 690 HA ASP 690 0.122 13.203 -3.376 218 HB2 ASP 690 HB2 ASP 690 -2.152 14.388 -3.671 219 HB3 ASP 690 HB3 ASP 690 -0.763 15.382 -3.242 220 H GLY 691 H GLY 691 -0.913 11.290 -3.424 221 HA2 GLY 691 HA2 GLY 691 -2.732 9.900 -4.276 222 HA3 GLY 691 HA3 GLY 691 -2.436 10.578 -5.873 223 H THR 692 H THR 692 0.506 10.401 -5.442 224 HA THR 692 HA THR 692 1.072 7.998 -6.736 225 HB THR 692 HB THR 692 2.959 9.356 -4.807 226 HG1 THR 692 HG1 THR 692 2.283 11.027 -6.007 227 HG21 THR 692 HG21 THR 692 3.420 7.136 -6.173 228 HG22 THR 692 HG22 THR 692 3.656 8.262 -7.509 229 HG23 THR 692 HG23 THR 692 4.658 8.385 -6.064 230 H PHE 693 H PHE 693 1.286 5.897 -6.057 231 HA PHE 693 HA PHE 693 1.431 5.432 -3.141 232 HB2 PHE 693 HB2 PHE 693 -0.400 3.902 -3.188 233 HB3 PHE 693 HB3 PHE 693 -0.941 5.374 -3.996 234 HD1 PHE 693 HD1 PHE 693 -0.822 5.488 -6.549 235 HD2 PHE 693 HD2 PHE 693 -0.363 1.834 -4.338 236 HE1 PHE 693 HE1 PHE 693 -1.306 4.187 -8.601 237 HE2 PHE 693 HE2 PHE 693 -0.848 0.539 -6.390 238 HZ PHE 693 HZ PHE 693 -1.319 1.710 -8.522 239 H LEU 694 H LEU 694 1.668 3.092 -2.605 240 HA LEU 694 HA LEU 694 2.759 1.279 -4.515 241 HB2 LEU 694 HB2 LEU 694 5.066 1.266 -3.872 242 HB3 LEU 694 HB3 LEU 694 4.637 2.920 -4.271 243 HG LEU 694 HG LEU 694 4.058 2.989 -1.665 244 HD11 LEU 694 HD11 LEU 694 6.502 1.573 -1.149 245 HD12 LEU 694 HD12 LEU 694 4.899 1.265 -0.483 246 HD13 LEU 694 HD13 LEU 694 5.393 0.492 -1.989 247 HD21 LEU 694 HD21 LEU 694 6.887 3.215 -2.728 248 HD22 LEU 694 HD22 LEU 694 5.641 4.440 -2.952 249 HD23 LEU 694 HD23 LEU 694 6.212 4.057 -1.334 250 H VAL 695 H VAL 695 3.846 -0.599 -3.366 251 HA VAL 695 HA VAL 695 2.817 -1.037 -0.639 252 HB VAL 695 HB VAL 695 2.448 -3.150 -2.756 253 HG11 VAL 695 HG11 VAL 695 0.682 -2.723 -0.381 254 HG12 VAL 695 HG12 VAL 695 1.198 -4.230 -1.139 255 HG13 VAL 695 HG13 VAL 695 2.305 -3.347 -0.086 256 HG21 VAL 695 HG21 VAL 695 1.195 -1.258 -3.598 257 HG22 VAL 695 HG22 VAL 695 0.043 -2.350 -2.827 258 HG23 VAL 695 HG23 VAL 695 0.574 -0.893 -1.988 259 H ARG 696 H ARG 696 4.033 -2.499 0.578 260 HA ARG 696 HA ARG 696 6.452 -3.590 -0.743 261 HB2 ARG 696 HB2 ARG 696 7.832 -2.899 1.094 262 HB3 ARG 696 HB3 ARG 696 6.937 -1.492 0.531 263 HG2 ARG 696 HG2 ARG 696 5.648 -1.367 2.438 264 HG3 ARG 696 HG3 ARG 696 5.667 -3.112 2.695 265 HD2 ARG 696 HD2 ARG 696 7.854 -1.120 3.323 266 HD3 ARG 696 HD3 ARG 696 7.016 -2.186 4.445 267 HE ARG 696 HE ARG 696 9.248 -2.875 2.717 268 HH11 ARG 696 HH21 ARG 696 6.557 -4.015 4.598 269 HH12 ARG 696 HH22 ARG 696 7.089 -5.659 4.588 270 HH21 ARG 696 HH11 ARG 696 9.922 -5.007 2.754 271 HH22 ARG 696 HH12 ARG 696 8.957 -6.238 3.519 272 H GLN 697 H GLN 697 7.516 -5.361 0.400 273 HA GLN 697 HA GLN 697 5.956 -6.774 2.435 274 HB2 GLN 697 HB2 GLN 697 5.004 -7.445 0.198 275 HB3 GLN 697 HB3 GLN 697 6.572 -8.147 -0.191 276 HG2 GLN 697 HG2 GLN 697 5.356 -8.915 2.426 277 HG3 GLN 697 HG3 GLN 697 4.611 -9.574 0.975 278 HE21 GLN 697 HE21 GLN 697 6.176 -11.047 3.036 279 HE22 GLN 697 HE22 GLN 697 7.503 -11.735 2.207 280 H ARG 698 H ARG 698 8.372 -7.934 0.095 281 HA ARG 698 HA ARG 698 10.601 -8.505 0.341 282 HB2 ARG 698 HB2 ARG 698 10.624 -6.542 2.029 283 HB3 ARG 698 HB3 ARG 698 10.508 -7.795 3.264 284 HG2 ARG 698 HG2 ARG 698 12.526 -8.892 2.310 285 HG3 ARG 698 HG3 ARG 698 12.662 -7.586 1.133 286 HD2 ARG 698 HD2 ARG 698 12.546 -6.985 4.084 287 HD3 ARG 698 HD3 ARG 698 14.070 -7.436 3.317 288 HE ARG 698 HE ARG 698 12.756 -5.360 1.848 289 HH11 ARG 698 HH21 ARG 698 14.608 -5.977 4.698 290 HH12 ARG 698 HH22 ARG 698 15.264 -4.380 4.764 291 HH21 ARG 698 HH11 ARG 698 13.575 -3.323 1.930 292 HH22 ARG 698 HH12 ARG 698 14.681 -2.869 3.198 293 H VAL 699 H VAL 699 11.416 -10.494 0.582 294 HA VAL 699 HA VAL 699 11.678 -12.676 1.249 295 HB VAL 699 HB VAL 699 10.246 -11.899 3.796 296 HG11 VAL 699 HG11 VAL 699 10.570 -14.246 3.713 297 HG12 VAL 699 HG12 VAL 699 12.161 -14.087 2.970 298 HG13 VAL 699 HG13 VAL 699 11.928 -13.646 4.662 299 HG21 VAL 699 HG21 VAL 699 12.850 -11.063 2.708 300 HG22 VAL 699 HG22 VAL 699 11.929 -10.393 4.055 301 HG23 VAL 699 HG23 VAL 699 12.961 -11.801 4.306 302 H LYS 700 H LYS 700 10.469 -13.919 -0.053 303 HA LYS 700 HA LYS 700 7.645 -13.898 -0.222 304 HB2 LYS 700 HB2 LYS 700 7.930 -15.972 -1.535 305 HB3 LYS 700 HB3 LYS 700 9.056 -14.714 -2.043 306 HG2 LYS 700 HG2 LYS 700 10.798 -16.075 -1.611 307 HG3 LYS 700 HG3 LYS 700 10.291 -16.198 0.073 308 HD2 LYS 700 HD2 LYS 700 8.491 -17.839 -1.328 309 HD3 LYS 700 HD3 LYS 700 10.060 -18.165 -2.063 310 HE2 LYS 700 HE2 LYS 700 10.165 -19.646 -0.292 311 HE3 LYS 700 HE3 LYS 700 10.836 -18.214 0.493 312 HZ1 LYS 700 HZ1 LYS 700 9.223 -18.589 1.997 313 HZ2 LYS 700 HZ2 LYS 700 8.214 -17.802 0.841 314 HZ3 LYS 700 HZ3 LYS 700 8.273 -19.509 0.900 315 H ASP 701 H ASP 701 8.201 -14.044 2.467 316 HA ASP 701 HA ASP 701 6.883 -16.568 3.195 317 HB2 ASP 701 HB2 ASP 701 9.278 -15.534 4.731 318 HB3 ASP 701 HB3 ASP 701 8.410 -17.045 4.985 319 H ALA 702 H ALA 702 8.030 -13.369 4.190 320 HA ALA 702 HA ALA 702 6.319 -13.168 6.477 321 HB1 ALA 702 HB1 ALA 702 8.209 -11.416 5.018 322 HB2 ALA 702 HB2 ALA 702 7.992 -11.647 6.753 323 HB3 ALA 702 HB3 ALA 702 6.904 -10.583 5.862 324 H ALA 703 H ALA 703 4.228 -13.669 5.788 325 HA ALA 703 HA ALA 703 2.926 -12.479 3.569 326 HB1 ALA 703 HB1 ALA 703 1.510 -13.472 6.039 327 HB2 ALA 703 HB2 ALA 703 2.267 -14.585 4.899 328 HB3 ALA 703 HB3 ALA 703 0.963 -13.524 4.364 329 H GLU 704 H GLU 704 4.186 -10.379 4.728 330 HA GLU 704 HA GLU 704 2.067 -8.852 6.126 331 HB2 GLU 704 HB2 GLU 704 4.507 -9.168 7.054 332 HB3 GLU 704 HB3 GLU 704 4.907 -7.908 5.888 333 HG2 GLU 704 HG2 GLU 704 2.713 -7.668 7.970 334 HG3 GLU 704 HG3 GLU 704 4.334 -7.009 8.160 335 H PHE 705 H PHE 705 1.016 -7.333 5.005 336 HA PHE 705 HA PHE 705 2.372 -6.073 2.710 337 HB2 PHE 705 HB2 PHE 705 -0.528 -6.838 2.520 338 HB3 PHE 705 HB3 PHE 705 0.603 -6.464 1.226 339 HD1 PHE 705 HD2 PHE 705 2.342 -8.114 0.561 340 HD2 PHE 705 HD1 PHE 705 -0.655 -9.038 3.498 341 HE1 PHE 705 HE2 PHE 705 2.859 -10.531 0.332 342 HE2 PHE 705 HE1 PHE 705 -0.136 -11.452 3.266 343 HZ PHE 705 HZ PHE 705 1.620 -12.197 1.683 344 H ALA 706 H ALA 706 1.995 -3.950 2.452 345 HA ALA 706 HA ALA 706 -0.218 -2.622 3.825 346 HB1 ALA 706 HB1 ALA 706 2.642 -1.778 4.318 347 HB2 ALA 706 HB2 ALA 706 1.703 -2.732 5.465 348 HB3 ALA 706 HB3 ALA 706 1.192 -1.094 5.047 349 H ILE 707 H ILE 707 -0.816 -0.730 2.840 350 HA ILE 707 HA ILE 707 0.608 -0.167 0.320 351 HB ILE 707 HB ILE 707 -2.169 0.697 1.142 352 HG12 ILE 707 HG12 ILE 707 -1.175 -1.628 -0.536 353 HG13 ILE 707 HG13 ILE 707 -2.052 -1.731 0.988 354 HG21 ILE 707 HG21 ILE 707 -2.395 1.178 -1.265 355 HG22 ILE 707 HG22 ILE 707 -1.053 2.098 -0.586 356 HG23 ILE 707 HG23 ILE 707 -0.735 0.646 -1.535 357 HD11 ILE 707 HD11 ILE 707 -3.549 -2.114 -0.936 358 HD12 ILE 707 HD12 ILE 707 -4.005 -0.658 -0.049 359 HD13 ILE 707 HD13 ILE 707 -3.130 -0.525 -1.575 360 H SER 708 H SER 708 1.497 1.701 -0.138 361 HA SER 708 HA SER 708 1.366 3.851 1.896 362 HB2 SER 708 HB2 SER 708 3.546 2.754 1.855 363 HB3 SER 708 HB3 SER 708 3.664 3.015 0.123 364 HG SER 708 HG SER 708 3.863 4.822 2.243 365 H ILE 709 H ILE 709 0.578 5.757 1.188 366 HA ILE 709 HA ILE 709 0.710 6.323 -1.711 367 HB ILE 709 HB ILE 709 -1.710 7.022 -0.063 368 HG12 ILE 709 HG12 ILE 709 -2.555 4.945 -1.603 369 HG13 ILE 709 HG13 ILE 709 -0.918 4.409 -1.234 370 HG21 ILE 709 HG21 ILE 709 -0.910 7.080 -2.947 371 HG22 ILE 709 HG22 ILE 709 -2.597 6.742 -2.570 372 HG23 ILE 709 HG23 ILE 709 -1.854 8.244 -2.020 373 HD11 ILE 709 HD11 ILE 709 -3.253 4.533 0.503 374 HD12 ILE 709 HD12 ILE 709 -1.723 3.690 0.750 375 HD13 ILE 709 HD13 ILE 709 -1.878 5.389 1.202 376 H LYS 710 H LYS 710 0.888 8.408 -2.341 377 HA LYS 710 HA LYS 710 2.003 10.279 -0.432 378 HB2 LYS 710 HB2 LYS 710 2.839 10.118 -2.760 379 HB3 LYS 710 HB3 LYS 710 1.270 10.645 -3.352 380 HG2 LYS 710 HG2 LYS 710 2.721 12.580 -3.290 381 HG3 LYS 710 HG3 LYS 710 1.543 12.751 -1.992 382 HD2 LYS 710 HD2 LYS 710 3.117 12.220 -0.327 383 HD3 LYS 710 HD3 LYS 710 4.213 11.456 -1.474 384 HE2 LYS 710 HE2 LYS 710 3.555 14.378 -1.751 385 HE3 LYS 710 HE3 LYS 710 4.768 13.858 -0.579 386 HZ1 LYS 710 HZ1 LYS 710 6.137 14.010 -2.370 387 HZ2 LYS 710 HZ2 LYS 710 5.529 12.444 -2.700 388 HZ3 LYS 710 HZ3 LYS 710 4.875 13.794 -3.512 389 H TYR 711 H TYR 711 0.737 11.437 0.878 390 HA TYR 711 HA TYR 711 -1.753 12.594 -0.223 391 HB2 TYR 711 HB2 TYR 711 -1.957 10.497 1.375 392 HB3 TYR 711 HB3 TYR 711 -1.668 11.700 2.633 393 HD1 TYR 711 HD2 TYR 711 -3.193 13.656 2.866 394 HD2 TYR 711 HD1 TYR 711 -3.994 10.439 0.147 395 HE1 TYR 711 HE2 TYR 711 -5.547 14.418 2.658 396 HE2 TYR 711 HE1 TYR 711 -6.344 11.195 -0.062 397 HH TYR 711 HH TYR 711 -7.654 13.207 0.233 398 H ASN 712 H ASN 712 -1.755 14.732 -0.021 399 HA ASN 712 HA ASN 712 -1.080 16.856 0.594 400 HB2 ASN 712 HB2 ASN 712 -1.526 15.473 3.243 401 HB3 ASN 712 HB3 ASN 712 -1.173 17.196 3.123 402 HD21 ASN 712 HD21 ASN 712 -3.229 18.066 3.643 403 HD22 ASN 712 HD22 ASN 712 -4.635 17.735 2.752 404 H VAL 713 H VAL 713 1.062 16.174 -0.379 405 HA VAL 713 HA VAL 713 3.355 15.974 -0.345 406 HB VAL 713 HB VAL 713 4.489 17.734 0.865 407 HG11 VAL 713 HG11 VAL 713 3.143 19.667 0.120 408 HG12 VAL 713 HG12 VAL 713 3.147 18.386 -1.093 409 HG13 VAL 713 HG13 VAL 713 1.737 18.616 -0.057 410 HG21 VAL 713 HG21 VAL 713 3.128 17.299 3.019 411 HG22 VAL 713 HG22 VAL 713 3.525 18.974 2.643 412 HG23 VAL 713 HG23 VAL 713 1.908 18.357 2.311 413 H GLU 714 H GLU 714 1.844 14.160 1.468 414 HA GLU 714 HA GLU 714 4.138 13.281 3.068 415 HB2 GLU 714 HB2 GLU 714 1.584 14.253 4.091 416 HB3 GLU 714 HB3 GLU 714 1.958 12.620 4.649 417 HG2 GLU 714 HG2 GLU 714 4.066 14.758 4.688 418 HG3 GLU 714 HG3 GLU 714 2.893 14.651 5.997 419 H VAL 715 H VAL 715 3.761 11.003 3.910 420 HA VAL 715 HA VAL 715 2.347 9.478 1.795 421 HB VAL 715 HB VAL 715 4.745 8.628 3.424 422 HG11 VAL 715 HG11 VAL 715 3.225 7.371 1.125 423 HG12 VAL 715 HG12 VAL 715 4.803 6.813 1.678 424 HG13 VAL 715 HG13 VAL 715 3.407 6.726 2.754 425 HG21 VAL 715 HG21 VAL 715 6.077 9.456 1.782 426 HG22 VAL 715 HG22 VAL 715 4.975 8.930 0.512 427 HG23 VAL 715 HG23 VAL 715 4.690 10.451 1.350 428 H LYS 716 H LYS 716 0.848 8.022 2.312 429 HA LYS 716 HA LYS 716 0.346 7.521 5.195 430 HB2 LYS 716 HB2 LYS 716 -1.413 8.603 3.519 431 HB3 LYS 716 HB3 LYS 716 -1.698 6.915 3.099 432 HG2 LYS 716 HG2 LYS 716 -2.632 6.413 5.143 433 HG3 LYS 716 HG3 LYS 716 -1.557 7.510 6.010 434 HD2 LYS 716 HD2 LYS 716 -3.938 8.356 4.328 435 HD3 LYS 716 HD3 LYS 716 -3.887 8.314 6.073 436 HE2 LYS 716 HE2 LYS 716 -1.775 9.859 5.766 437 HE3 LYS 716 HE3 LYS 716 -2.509 10.193 4.197 438 HZ1 LYS 716 HZ1 LYS 716 -3.950 11.536 5.181 439 HZ2 LYS 716 HZ2 LYS 716 -4.530 10.263 6.176 440 HZ3 LYS 716 HZ3 LYS 716 -3.220 11.240 6.688 441 H HIS 717 H HIS 717 1.110 5.595 5.835 442 HA HIS 717 HA HIS 717 1.107 3.341 3.920 443 HB2 HIS 717 HB2 HIS 717 2.575 3.521 6.557 444 HB3 HIS 717 HB3 HIS 717 2.765 2.290 5.315 445 HD1 HIS 717 HD1 HIS 717 4.503 2.713 3.578 446 HD2 HIS 717 HD2 HIS 717 3.539 6.174 5.676 447 HE1 HIS 717 HE1 HIS 717 6.179 4.476 2.867 448 HE2 HIS 717 HE2 HIS 717 5.632 6.582 4.192 449 H ILE 718 H ILE 718 -0.754 2.188 4.123 450 HA ILE 718 HA ILE 718 -1.698 1.611 6.880 451 HB ILE 718 HB ILE 718 -3.116 2.136 4.326 452 HG12 ILE 718 HG12 ILE 718 -3.265 3.769 6.091 453 HG13 ILE 718 HG13 ILE 718 -4.831 2.978 5.954 454 HG21 ILE 718 HG21 ILE 718 -4.007 0.035 6.312 455 HG22 ILE 718 HG22 ILE 718 -5.110 0.841 5.199 456 HG23 ILE 718 HG23 ILE 718 -3.797 -0.152 4.571 457 HD11 ILE 718 HD11 ILE 718 -4.645 2.667 8.187 458 HD12 ILE 718 HD12 ILE 718 -3.546 1.358 7.763 459 HD13 ILE 718 HD13 ILE 718 -2.906 2.949 8.173 460 H LYS 719 H LYS 719 -1.674 -0.454 7.567 461 HA LYS 719 HA LYS 719 -0.337 -2.429 5.974 462 HB2 LYS 719 HB2 LYS 719 -0.475 -3.835 7.929 463 HB3 LYS 719 HB3 LYS 719 -0.078 -2.201 8.456 464 HG2 LYS 719 HG2 LYS 719 -2.829 -2.135 8.481 465 HG3 LYS 719 HG3 LYS 719 -2.504 -3.797 8.976 466 HD2 LYS 719 HD2 LYS 719 -1.129 -3.075 10.807 467 HD3 LYS 719 HD3 LYS 719 -1.123 -1.408 10.230 468 HE2 LYS 719 HE2 LYS 719 -3.764 -1.693 10.456 469 HE3 LYS 719 HE3 LYS 719 -3.290 -2.919 11.637 470 HZ1 LYS 719 HZ1 LYS 719 -3.011 -1.250 13.058 471 HZ2 LYS 719 HZ2 LYS 719 -1.638 -0.765 12.151 472 HZ3 LYS 719 HZ3 LYS 719 -3.178 -0.071 11.842 473 H ILE 720 H ILE 720 -1.140 -4.359 5.165 474 HA ILE 720 HA ILE 720 -4.042 -4.324 4.685 475 HB ILE 720 HB ILE 720 -1.780 -5.742 3.290 476 HG12 ILE 720 HG12 ILE 720 -3.793 -3.695 2.319 477 HG13 ILE 720 HG13 ILE 720 -2.142 -3.315 2.807 478 HG21 ILE 720 HG21 ILE 720 -4.621 -6.397 3.431 479 HG22 ILE 720 HG22 ILE 720 -4.116 -6.044 1.779 480 HG23 ILE 720 HG23 ILE 720 -3.302 -7.309 2.698 481 HD11 ILE 720 HD11 ILE 720 -2.978 -5.147 0.549 482 HD12 ILE 720 HD12 ILE 720 -2.199 -3.575 0.393 483 HD13 ILE 720 HD13 ILE 720 -1.312 -4.929 1.089 484 H MET 721 H MET 721 -5.301 -5.646 5.730 485 HA MET 721 HA MET 721 -4.171 -7.800 7.352 486 HB2 MET 721 HB2 MET 721 -6.212 -6.055 7.803 487 HB3 MET 721 HB3 MET 721 -7.103 -7.443 7.187 488 HG2 MET 721 HG2 MET 721 -5.307 -8.621 8.931 489 HG3 MET 721 HG3 MET 721 -5.703 -7.109 9.749 490 HE1 MET 721 HE1 MET 721 -6.356 -8.256 11.536 491 HE2 MET 721 HE2 MET 721 -8.031 -8.687 11.875 492 HE3 MET 721 HE3 MET 721 -6.891 -9.922 11.318 493 H THR 722 H THR 722 -5.204 -9.933 7.300 494 HA THR 722 HA THR 722 -6.611 -10.684 4.885 495 HB THR 722 HB THR 722 -4.148 -10.663 4.272 496 HG1 THR 722 HG1 THR 722 -5.732 -11.893 3.182 497 HG21 THR 722 HG21 THR 722 -3.517 -11.643 6.571 498 HG22 THR 722 HG22 THR 722 -4.044 -13.195 5.912 499 HG23 THR 722 HG23 THR 722 -2.710 -12.322 5.157 500 H ALA 723 H ALA 723 -7.266 -12.921 4.891 501 HA ALA 723 HA ALA 723 -6.935 -14.612 7.130 502 HB1 ALA 723 HB1 ALA 723 -8.802 -12.460 7.471 503 HB2 ALA 723 HB2 ALA 723 -8.377 -13.736 8.612 504 HB3 ALA 723 HB3 ALA 723 -9.681 -13.989 7.447 505 H GLU 724 H GLU 724 -10.012 -13.853 5.681 506 HA GLU 724 HA GLU 724 -10.485 -16.516 4.781 507 HB2 GLU 724 HB2 GLU 724 -11.977 -14.209 3.648 508 HB3 GLU 724 HB3 GLU 724 -12.596 -15.725 4.293 509 HG2 GLU 724 HG2 GLU 724 -13.214 -14.337 6.030 510 HG3 GLU 724 HG3 GLU 724 -11.571 -14.687 6.562 511 H GLY 725 H GLY 725 -8.043 -15.801 3.738 512 HA2 GLY 725 HA2 GLY 725 -6.838 -15.726 1.760 513 HA3 GLY 725 HA3 GLY 725 -8.284 -16.384 0.989 514 H LEU 726 H LEU 726 -8.195 -13.372 2.770 515 HA LEU 726 HA LEU 726 -8.642 -11.897 0.244 516 HB2 LEU 726 HB2 LEU 726 -9.888 -11.462 2.965 517 HB3 LEU 726 HB3 LEU 726 -10.048 -10.341 1.614 518 HG LEU 726 HG LEU 726 -10.715 -13.224 1.172 519 HD11 LEU 726 HD11 LEU 726 -12.826 -11.332 2.154 520 HD12 LEU 726 HD12 LEU 726 -12.816 -13.094 2.170 521 HD13 LEU 726 HD13 LEU 726 -11.830 -12.198 3.325 522 HD21 LEU 726 HD21 LEU 726 -12.494 -12.020 -0.253 523 HD22 LEU 726 HD22 LEU 726 -11.587 -10.545 0.082 524 HD23 LEU 726 HD23 LEU 726 -10.817 -11.877 -0.778 525 H TYR 727 H TYR 727 -8.273 -9.560 0.446 526 HA TYR 727 HA TYR 727 -5.995 -8.872 2.215 527 HB2 TYR 727 HB2 TYR 727 -6.363 -8.155 -0.711 528 HB3 TYR 727 HB3 TYR 727 -5.108 -7.495 0.337 529 HD1 TYR 727 HD1 TYR 727 -3.257 -8.888 1.129 530 HD2 TYR 727 HD2 TYR 727 -6.297 -10.478 -1.447 531 HE1 TYR 727 HE1 TYR 727 -1.819 -10.850 0.643 532 HE2 TYR 727 HE2 TYR 727 -4.863 -12.442 -1.931 533 HH TYR 727 HH TYR 727 -2.428 -12.971 -1.931 534 H ARG 728 H ARG 728 -6.341 -7.038 3.344 535 HA ARG 728 HA ARG 728 -8.191 -5.023 2.315 536 HB2 ARG 728 HB2 ARG 728 -9.108 -5.126 4.846 537 HB3 ARG 728 HB3 ARG 728 -9.848 -5.984 3.497 538 HG2 ARG 728 HG2 ARG 728 -8.880 -8.044 4.091 539 HG3 ARG 728 HG3 ARG 728 -7.621 -7.276 5.056 540 HD2 ARG 728 HD2 ARG 728 -9.030 -8.048 6.729 541 HD3 ARG 728 HD3 ARG 728 -9.661 -6.427 6.490 542 HE ARG 728 HE ARG 728 -11.560 -7.318 5.441 543 HH11 ARG 728 HH21 ARG 728 -9.208 -9.808 6.030 544 HH12 ARG 728 HH22 ARG 728 -10.363 -11.114 5.906 545 HH21 ARG 728 HH11 ARG 728 -13.025 -9.011 5.331 546 HH22 ARG 728 HH12 ARG 728 -12.504 -10.667 5.529 547 H ILE 729 H ILE 729 -7.659 -3.033 2.839 548 HA ILE 729 HA ILE 729 -5.214 -2.519 4.286 549 HB ILE 729 HB ILE 729 -6.205 -0.061 3.862 550 HG12 ILE 729 HG12 ILE 729 -8.348 -1.226 3.010 551 HG13 ILE 729 HG13 ILE 729 -7.694 0.094 2.055 552 HG21 ILE 729 HG21 ILE 729 -5.115 -1.663 1.550 553 HG22 ILE 729 HG22 ILE 729 -4.876 0.044 1.911 554 HG23 ILE 729 HG23 ILE 729 -4.122 -1.183 2.922 555 HD11 ILE 729 HD11 ILE 729 -6.652 -2.584 1.356 556 HD12 ILE 729 HD12 ILE 729 -8.368 -2.328 1.033 557 HD13 ILE 729 HD13 ILE 729 -7.164 -1.262 0.313 558 H THR 730 H THR 730 -8.376 -2.982 5.150 559 HA THR 730 HA THR 730 -7.923 -1.895 7.802 560 HB THR 730 HB THR 730 -8.880 -0.068 6.202 561 HG1 THR 730 HG1 THR 730 -9.869 -0.782 8.768 562 HG21 THR 730 HG21 THR 730 -11.519 -1.286 6.885 563 HG22 THR 730 HG22 THR 730 -11.104 -0.160 5.597 564 HG23 THR 730 HG23 THR 730 -10.650 -1.856 5.460 565 H GLU 731 H GLU 731 -9.072 -2.985 9.308 566 HA GLU 731 HA GLU 731 -9.970 -5.545 8.916 567 HB2 GLU 731 HB2 GLU 731 -11.101 -5.276 11.108 568 HB3 GLU 731 HB3 GLU 731 -9.486 -4.555 11.115 569 HG2 GLU 731 HG2 GLU 731 -11.906 -2.906 10.413 570 HG3 GLU 731 HG3 GLU 731 -11.443 -3.147 12.086 571 H LYS 732 H LYS 732 -11.537 -2.633 8.094 572 HA LYS 732 HA LYS 732 -14.197 -3.788 8.024 573 HB2 LYS 732 HB2 LYS 732 -13.434 -1.026 7.145 574 HB3 LYS 732 HB3 LYS 732 -14.992 -1.608 7.740 575 HG2 LYS 732 HG2 LYS 732 -13.806 -2.196 9.916 576 HG3 LYS 732 HG3 LYS 732 -12.425 -1.293 9.305 577 HD2 LYS 732 HD2 LYS 732 -14.917 0.202 9.025 578 HD3 LYS 732 HD3 LYS 732 -14.571 -0.219 10.703 579 HE2 LYS 732 HE2 LYS 732 -12.136 0.586 9.409 580 HE3 LYS 732 HE3 LYS 732 -13.367 1.828 9.159 581 HZ1 LYS 732 HZ1 LYS 732 -13.811 1.365 11.704 582 HZ2 LYS 732 HZ2 LYS 732 -12.177 0.846 11.663 583 HZ3 LYS 732 HZ3 LYS 732 -12.570 2.456 11.200 584 H LYS 733 H LYS 733 -11.657 -3.972 5.940 585 HA LYS 733 HA LYS 733 -13.431 -3.923 3.547 586 HB2 LYS 733 HB2 LYS 733 -11.328 -2.288 3.811 587 HB3 LYS 733 HB3 LYS 733 -10.478 -3.706 3.210 588 HG2 LYS 733 HG2 LYS 733 -11.057 -2.881 1.168 589 HG3 LYS 733 HG3 LYS 733 -12.608 -3.644 1.507 590 HD2 LYS 733 HD2 LYS 733 -11.859 -0.744 1.902 591 HD3 LYS 733 HD3 LYS 733 -13.097 -1.408 0.839 592 HE2 LYS 733 HE2 LYS 733 -14.236 -2.302 2.908 593 HE3 LYS 733 HE3 LYS 733 -13.108 -1.327 3.853 594 HZ1 LYS 733 HZ1 LYS 733 -14.038 0.632 3.143 595 HZ2 LYS 733 HZ2 LYS 733 -14.590 -0.017 1.650 596 HZ3 LYS 733 HZ3 LYS 733 -15.420 -0.371 3.104 597 H ALA 734 H ALA 734 -12.172 -5.321 1.722 598 HA ALA 734 HA ALA 734 -10.713 -7.579 2.495 599 HB1 ALA 734 HB1 ALA 734 -12.428 -9.327 2.467 600 HB2 ALA 734 HB2 ALA 734 -13.685 -8.093 2.327 601 HB3 ALA 734 HB3 ALA 734 -12.695 -8.187 3.784 602 H PHE 735 H PHE 735 -9.659 -7.840 0.622 603 HA PHE 735 HA PHE 735 -11.271 -8.148 -1.854 604 HB2 PHE 735 HB2 PHE 735 -8.594 -6.794 -1.488 605 HB3 PHE 735 HB3 PHE 735 -9.142 -7.382 -3.054 606 HD1 PHE 735 HD2 PHE 735 -10.566 -5.453 -0.147 607 HD2 PHE 735 HD1 PHE 735 -10.220 -5.866 -4.411 608 HE1 PHE 735 HE2 PHE 735 -11.991 -3.434 -0.466 609 HE2 PHE 735 HE1 PHE 735 -11.614 -3.847 -4.733 610 HZ PHE 735 HZ PHE 735 -12.511 -2.637 -2.755 611 H ARG 736 H ARG 736 -10.253 -9.602 -3.469 612 HA ARG 736 HA ARG 736 -9.199 -11.947 -2.124 613 HB2 ARG 736 HB2 ARG 736 -10.476 -11.342 -4.694 614 HB3 ARG 736 HB3 ARG 736 -9.207 -12.570 -4.787 615 HG2 ARG 736 HG2 ARG 736 -11.326 -12.602 -2.655 616 HG3 ARG 736 HG3 ARG 736 -11.548 -13.409 -4.207 617 HD2 ARG 736 HD2 ARG 736 -10.232 -15.143 -3.577 618 HD3 ARG 736 HD3 ARG 736 -8.945 -14.046 -3.087 619 HE ARG 736 HE ARG 736 -9.576 -14.464 -0.899 620 HH11 ARG 736 HH21 ARG 736 -12.273 -14.820 -3.016 621 HH12 ARG 736 HH22 ARG 736 -13.363 -15.336 -1.779 622 HH21 ARG 736 HH11 ARG 736 -11.016 -15.162 0.745 623 HH22 ARG 736 HH12 ARG 736 -12.659 -15.525 0.321 624 H GLY 737 H GLY 737 -7.972 -9.373 -4.050 625 HA2 GLY 737 HA2 GLY 737 -5.262 -10.378 -3.683 626 HA3 GLY 737 HA3 GLY 737 -5.794 -10.267 -5.355 627 H LEU 738 H LEU 738 -3.784 -8.807 -3.579 628 HA LEU 738 HA LEU 738 -4.279 -6.196 -3.033 629 HB2 LEU 738 HB2 LEU 738 -1.976 -7.752 -3.896 630 HB3 LEU 738 HB3 LEU 738 -1.902 -6.117 -4.541 631 HG LEU 738 HG LEU 738 -0.790 -6.250 -2.360 632 HD11 LEU 738 HD11 LEU 738 -2.446 -4.309 -3.179 633 HD12 LEU 738 HD12 LEU 738 -3.270 -4.760 -1.687 634 HD13 LEU 738 HD13 LEU 738 -1.587 -4.233 -1.643 635 HD21 LEU 738 HD21 LEU 738 -1.966 -6.855 -0.357 636 HD22 LEU 738 HD22 LEU 738 -3.505 -6.940 -1.214 637 HD23 LEU 738 HD23 LEU 738 -2.250 -8.142 -1.526 638 H THR 739 H THR 739 -3.445 -7.494 -6.201 639 HA THR 739 HA THR 739 -3.618 -5.177 -7.721 640 HB THR 739 HB THR 739 -4.407 -7.923 -8.690 641 HG1 THR 739 HG1 THR 739 -1.785 -7.038 -8.810 642 HG21 THR 739 HG21 THR 739 -3.222 -7.095 -10.741 643 HG22 THR 739 HG22 THR 739 -4.674 -6.176 -10.346 644 HG23 THR 739 HG23 THR 739 -3.082 -5.516 -9.968 645 H GLU 740 H GLU 740 -6.231 -7.236 -6.531 646 HA GLU 740 HA GLU 740 -8.166 -5.911 -8.261 647 HB2 GLU 740 HB2 GLU 740 -8.965 -7.609 -5.918 648 HB3 GLU 740 HB3 GLU 740 -9.714 -7.478 -7.508 649 HG2 GLU 740 HG2 GLU 740 -7.063 -8.830 -6.906 650 HG3 GLU 740 HG3 GLU 740 -8.580 -9.650 -7.255 651 H LEU 741 H LEU 741 -6.719 -5.507 -5.216 652 HA LEU 741 HA LEU 741 -8.843 -3.876 -4.083 653 HB2 LEU 741 HB2 LEU 741 -7.572 -5.339 -2.605 654 HB3 LEU 741 HB3 LEU 741 -6.055 -4.620 -3.133 655 HG LEU 741 HG LEU 741 -7.091 -3.833 -0.876 656 HD11 LEU 741 HD11 LEU 741 -6.611 -1.417 -2.505 657 HD12 LEU 741 HD12 LEU 741 -5.731 -2.023 -1.102 658 HD13 LEU 741 HD13 LEU 741 -5.387 -2.673 -2.704 659 HD21 LEU 741 HD21 LEU 741 -8.599 -1.893 -2.589 660 HD22 LEU 741 HD22 LEU 741 -9.335 -3.451 -2.241 661 HD23 LEU 741 HD23 LEU 741 -8.893 -2.377 -0.921 662 H VAL 742 H VAL 742 -5.517 -3.532 -5.125 663 HA VAL 742 HA VAL 742 -5.286 -0.725 -4.837 664 HB VAL 742 HB VAL 742 -3.835 -2.737 -6.560 665 HG11 VAL 742 HG11 VAL 742 -3.453 -0.559 -7.497 666 HG12 VAL 742 HG12 VAL 742 -3.187 0.142 -5.898 667 HG13 VAL 742 HG13 VAL 742 -2.023 -1.003 -6.564 668 HG21 VAL 742 HG21 VAL 742 -3.757 -3.134 -4.130 669 HG22 VAL 742 HG22 VAL 742 -2.176 -2.664 -4.762 670 HG23 VAL 742 HG23 VAL 742 -3.158 -1.490 -3.883 671 H GLU 743 H GLU 743 -5.572 -2.686 -7.749 672 HA GLU 743 HA GLU 743 -5.806 -0.541 -9.539 673 HB2 GLU 743 HB2 GLU 743 -6.807 -3.358 -9.934 674 HB3 GLU 743 HB3 GLU 743 -6.308 -2.216 -11.186 675 HG2 GLU 743 HG2 GLU 743 -4.358 -2.914 -9.006 676 HG3 GLU 743 HG3 GLU 743 -4.625 -4.069 -10.292 677 H PHE 744 H PHE 744 -8.182 -2.084 -7.538 678 HA PHE 744 HA PHE 744 -10.463 -1.182 -9.083 679 HB2 PHE 744 HB2 PHE 744 -10.684 -3.188 -7.765 680 HB3 PHE 744 HB3 PHE 744 -10.172 -2.347 -6.306 681 HD1 PHE 744 HD2 PHE 744 -12.759 -2.023 -9.016 682 HD2 PHE 744 HD1 PHE 744 -11.813 -1.600 -4.850 683 HE1 PHE 744 HE2 PHE 744 -15.110 -1.385 -8.548 684 HE2 PHE 744 HE1 PHE 744 -14.162 -0.958 -4.379 685 HZ PHE 744 HZ PHE 744 -15.811 -0.850 -6.229 686 H TYR 745 H TYR 745 -8.557 -0.070 -6.372 687 HA TYR 745 HA TYR 745 -10.383 2.021 -5.614 688 HB2 TYR 745 HB2 TYR 745 -7.552 1.331 -4.877 689 HB3 TYR 745 HB3 TYR 745 -8.337 2.798 -4.293 690 HD1 TYR 745 HD2 TYR 745 -10.976 0.600 -4.722 691 HD2 TYR 745 HD1 TYR 745 -7.567 1.205 -2.177 692 HE1 TYR 745 HE2 TYR 745 -12.089 -0.675 -2.933 693 HE2 TYR 745 HE1 TYR 745 -8.693 -0.088 -0.389 694 HH TYR 745 HH TYR 745 -11.869 -0.617 -0.280 695 H GLN 746 H GLN 746 -8.032 1.667 -8.068 696 HA GLN 746 HA GLN 746 -7.038 4.238 -8.414 697 HB2 GLN 746 HB2 GLN 746 -7.985 2.229 -10.469 698 HB3 GLN 746 HB3 GLN 746 -7.145 3.724 -10.892 699 HG2 GLN 746 HG2 GLN 746 -5.191 3.061 -9.629 700 HG3 GLN 746 HG3 GLN 746 -6.033 1.663 -8.962 701 HE21 GLN 746 HE21 GLN 746 -7.095 0.301 -11.002 702 HE22 GLN 746 HE22 GLN 746 -5.941 -0.059 -12.199 703 H GLN 747 H GLN 747 -10.221 2.935 -9.103 704 HA GLN 747 HA GLN 747 -11.181 5.579 -9.985 705 HB2 GLN 747 HB2 GLN 747 -12.668 2.946 -10.070 706 HB3 GLN 747 HB3 GLN 747 -13.073 4.438 -10.920 707 HG2 GLN 747 HG2 GLN 747 -11.732 3.877 -12.641 708 HG3 GLN 747 HG3 GLN 747 -10.361 3.670 -11.558 709 HE21 GLN 747 HE21 GLN 747 -9.494 1.633 -12.041 710 HE22 GLN 747 HE22 GLN 747 -10.410 0.212 -12.182 711 H ASN 748 H ASN 748 -11.386 3.242 -7.422 712 HA ASN 748 HA ASN 748 -13.599 4.718 -6.133 713 HB2 ASN 748 HB2 ASN 748 -12.390 2.045 -5.373 714 HB3 ASN 748 HB3 ASN 748 -13.834 2.775 -4.681 715 HD21 ASN 748 HD21 ASN 748 -12.522 1.300 -7.653 716 HD22 ASN 748 HD22 ASN 748 -14.045 0.985 -8.341 717 H SER 749 H SER 749 -12.992 6.271 -4.769 718 HA SER 749 HA SER 749 -10.505 6.894 -3.876 719 HB2 SER 749 HB2 SER 749 -12.913 7.989 -3.566 720 HB3 SER 749 HB3 SER 749 -12.719 7.308 -1.957 721 HG SER 749 HG SER 749 -10.405 8.404 -2.593 722 H LEU 750 H LEU 750 -9.183 6.417 -2.170 723 HA LEU 750 HA LEU 750 -9.303 3.799 -1.081 724 HB2 LEU 750 HB2 LEU 750 -7.643 6.205 -0.338 725 HB3 LEU 750 HB3 LEU 750 -7.413 4.608 0.367 726 HG LEU 750 HG LEU 750 -7.581 4.413 -2.516 727 HD11 LEU 750 HD11 LEU 750 -6.759 6.710 -2.474 728 HD12 LEU 750 HD12 LEU 750 -5.478 6.253 -1.352 729 HD13 LEU 750 HD13 LEU 750 -5.470 5.625 -3.000 730 HD21 LEU 750 HD21 LEU 750 -6.581 2.792 -0.851 731 HD22 LEU 750 HD22 LEU 750 -5.521 3.181 -2.207 732 HD23 LEU 750 HD23 LEU 750 -5.252 3.931 -0.634 733 H LYS 751 H LYS 751 -10.408 6.899 0.118 734 HA LYS 751 HA LYS 751 -10.595 6.442 2.822 735 HB2 LYS 751 HB2 LYS 751 -12.565 7.946 2.817 736 HB3 LYS 751 HB3 LYS 751 -11.203 8.570 1.907 737 HG2 LYS 751 HG2 LYS 751 -12.485 7.304 -0.090 738 HG3 LYS 751 HG3 LYS 751 -13.872 7.695 0.939 739 HD2 LYS 751 HD2 LYS 751 -13.143 10.038 1.054 740 HD3 LYS 751 HD3 LYS 751 -11.743 9.655 0.067 741 HE2 LYS 751 HE2 LYS 751 -13.908 8.745 -1.434 742 HE3 LYS 751 HE3 LYS 751 -14.438 10.292 -0.760 743 HZ1 LYS 751 HZ1 LYS 751 -12.167 11.171 -1.410 744 HZ2 LYS 751 HZ2 LYS 751 -11.990 9.722 -2.352 745 HZ3 LYS 751 HZ3 LYS 751 -13.250 10.833 -2.705 746 H ASP 752 H ASP 752 -12.149 4.779 0.299 747 HA ASP 752 HA ASP 752 -14.485 3.791 1.564 748 HB2 ASP 752 HB2 ASP 752 -14.461 3.048 -0.610 749 HB3 ASP 752 HB3 ASP 752 -12.707 2.931 -0.654 750 H CYS 753 H CYS 753 -11.105 3.027 1.815 751 HA CYS 753 HA CYS 753 -11.637 1.055 3.964 752 HB2 CYS 753 HB2 CYS 753 -8.953 1.174 2.841 753 HB3 CYS 753 HB3 CYS 753 -9.982 -0.217 3.120 754 HG CYS 753 HG CYS 753 -11.247 0.993 0.841 755 H PHE 754 H PHE 754 -9.245 3.324 2.751 756 HA PHE 754 HA PHE 754 -7.805 3.610 5.106 757 HB2 PHE 754 HB2 PHE 754 -8.177 5.374 2.703 758 HB3 PHE 754 HB3 PHE 754 -7.158 5.861 4.055 759 HD1 PHE 754 HD2 PHE 754 -7.752 2.903 1.827 760 HD2 PHE 754 HD1 PHE 754 -4.908 5.247 4.031 761 HE1 PHE 754 HE2 PHE 754 -5.912 1.512 0.930 762 HE2 PHE 754 HE1 PHE 754 -3.066 3.857 3.131 763 HZ PHE 754 HZ PHE 754 -3.570 1.989 1.582 764 H LYS 755 H LYS 755 -7.809 5.344 6.650 765 HA LYS 755 HA LYS 755 -10.485 6.236 7.309 766 HB2 LYS 755 HB2 LYS 755 -8.310 7.218 9.006 767 HB3 LYS 755 HB3 LYS 755 -9.751 6.297 9.431 768 HG2 LYS 755 HG2 LYS 755 -7.164 5.198 8.296 769 HG3 LYS 755 HG3 LYS 755 -7.797 4.957 9.916 770 HD2 LYS 755 HD2 LYS 755 -9.862 3.915 8.700 771 HD3 LYS 755 HD3 LYS 755 -8.772 3.774 7.325 772 HE2 LYS 755 HE2 LYS 755 -7.594 2.081 8.260 773 HE3 LYS 755 HE3 LYS 755 -7.592 2.842 9.850 774 HZ1 LYS 755 HZ1 LYS 755 -8.998 1.145 10.304 775 HZ2 LYS 755 HZ2 LYS 755 -10.151 2.216 9.667 776 HZ3 LYS 755 HZ3 LYS 755 -9.522 0.960 8.681 777 H SER 756 H SER 756 -7.369 7.991 7.189 778 HA SER 756 HA SER 756 -8.762 10.514 6.767 779 HB2 SER 756 HB2 SER 756 -6.555 11.523 6.948 780 HB3 SER 756 HB3 SER 756 -6.761 10.348 8.243 781 HG SER 756 HG SER 756 -5.195 9.189 7.425 782 H LEU 757 H LEU 757 -6.790 8.272 4.981 783 HA LEU 757 HA LEU 757 -6.068 9.638 2.710 784 HB2 LEU 757 HB2 LEU 757 -5.853 7.108 3.523 785 HB3 LEU 757 HB3 LEU 757 -7.187 6.906 2.396 786 HG LEU 757 HG LEU 757 -5.211 6.514 1.157 787 HD11 LEU 757 HD11 LEU 757 -6.934 7.987 0.110 788 HD12 LEU 757 HD12 LEU 757 -5.964 9.372 0.610 789 HD13 LEU 757 HD13 LEU 757 -5.302 8.204 -0.529 790 HD21 LEU 757 HD21 LEU 757 -3.605 7.469 2.709 791 HD22 LEU 757 HD22 LEU 757 -3.368 8.175 1.107 792 HD23 LEU 757 HD23 LEU 757 -4.203 9.094 2.356 793 H ASP 758 H ASP 758 -7.452 11.043 1.668 794 HA ASP 758 HA ASP 758 -10.009 9.886 0.740 795 HB2 ASP 758 HB2 ASP 758 -10.189 11.848 2.357 796 HB3 ASP 758 HB3 ASP 758 -9.521 12.847 1.073 797 H THR 759 H THR 759 -8.562 9.040 -0.966 798 HA THR 759 HA THR 759 -8.892 10.639 -3.326 799 HB THR 759 HB THR 759 -6.742 11.593 -2.510 800 HG1 THR 759 HG1 THR 759 -6.037 11.620 -4.522 801 HG21 THR 759 HG21 THR 759 -5.366 10.094 -1.493 802 HG22 THR 759 HG22 THR 759 -6.080 8.723 -2.338 803 HG23 THR 759 HG23 THR 759 -4.851 9.705 -3.131 804 H THR 760 H THR 760 -7.110 9.304 -5.011 805 HA THR 760 HA THR 760 -7.926 6.461 -4.735 806 HB THR 760 HB THR 760 -8.239 6.434 -7.230 807 HG1 THR 760 HG1 THR 760 -8.516 8.467 -8.210 808 HG21 THR 760 HG21 THR 760 -10.434 7.678 -7.158 809 HG22 THR 760 HG22 THR 760 -10.201 6.503 -5.864 810 HG23 THR 760 HG23 THR 760 -9.990 8.224 -5.540 811 H LEU 761 H LEU 761 -6.703 5.060 -6.330 812 HA LEU 761 HA LEU 761 -3.894 5.414 -5.916 813 HB2 LEU 761 HB2 LEU 761 -5.505 3.434 -7.545 814 HB3 LEU 761 HB3 LEU 761 -3.749 3.381 -7.452 815 HG LEU 761 HG LEU 761 -4.744 1.856 -5.797 816 HD11 LEU 761 HD11 LEU 761 -3.137 2.372 -4.295 817 HD12 LEU 761 HD12 LEU 761 -2.807 3.772 -5.312 818 HD13 LEU 761 HD13 LEU 761 -3.876 3.932 -3.923 819 HD21 LEU 761 HD21 LEU 761 -5.917 4.282 -4.441 820 HD22 LEU 761 HD22 LEU 761 -6.848 3.312 -5.579 821 HD23 LEU 761 HD23 LEU 761 -6.227 2.584 -4.099 822 H GLN 762 H GLN 762 -3.574 7.479 -6.864 823 HA GLN 762 HA GLN 762 -4.152 8.177 -9.524 824 HB2 GLN 762 HB2 GLN 762 -2.292 9.164 -7.418 825 HB3 GLN 762 HB3 GLN 762 -2.013 9.705 -9.067 826 HG2 GLN 762 HG2 GLN 762 -4.776 9.946 -8.748 827 HG3 GLN 762 HG3 GLN 762 -4.123 10.479 -7.202 828 HE21 GLN 762 HE21 GLN 762 -2.605 12.348 -7.239 829 HE22 GLN 762 HE22 GLN 762 -2.613 13.401 -8.571 830 H PHE 763 H PHE 763 -0.941 7.276 -8.239 831 HA PHE 763 HA PHE 763 -0.413 5.663 -10.589 832 HB2 PHE 763 HB2 PHE 763 1.863 7.310 -10.538 833 HB3 PHE 763 HB3 PHE 763 0.628 7.243 -11.792 834 HD1 PHE 763 HD1 PHE 763 1.558 8.919 -8.592 835 HD2 PHE 763 HD2 PHE 763 -0.904 9.035 -12.110 836 HE1 PHE 763 HE1 PHE 763 0.850 11.226 -8.020 837 HE2 PHE 763 HE2 PHE 763 -1.611 11.342 -11.538 838 HZ PHE 763 HZ PHE 763 -0.735 12.438 -9.494 839 HA PRO 764 HA PRO 764 2.131 3.519 -7.727 840 HB2 PRO 764 HB2 PRO 764 3.913 2.338 -9.454 841 HB3 PRO 764 HB3 PRO 764 2.245 1.780 -9.223 842 HG2 PRO 764 HG2 PRO 764 3.424 3.364 -11.424 843 HG3 PRO 764 HG3 PRO 764 2.108 2.182 -11.456 844 HD2 PRO 764 HD2 PRO 764 1.747 4.927 -11.538 845 HD3 PRO 764 HD3 PRO 764 0.513 3.764 -11.012 846 H PHE 765 H PHE 765 3.884 3.960 -6.476 847 HA PHE 765 HA PHE 765 5.416 6.257 -6.759 848 HB2 PHE 765 HB2 PHE 765 6.673 5.494 -4.952 849 HB3 PHE 765 HB3 PHE 765 5.167 4.597 -4.772 850 HD1 PHE 765 HD1 PHE 765 5.089 2.293 -6.150 851 HD2 PHE 765 HD2 PHE 765 8.669 4.297 -4.892 852 HE1 PHE 765 HE1 PHE 765 6.335 0.174 -6.338 853 HE2 PHE 765 HE2 PHE 765 9.923 2.165 -5.074 854 HZ PHE 765 HZ PHE 765 8.755 0.102 -5.797 855 H LYS 766 H LYS 766 5.980 3.059 -8.070 856 HA LYS 766 HA LYS 766 8.662 3.334 -8.820 857 HB2 LYS 766 HB2 LYS 766 6.376 1.604 -9.516 858 HB3 LYS 766 HB3 LYS 766 7.700 1.651 -10.672 859 HG2 LYS 766 HG2 LYS 766 8.664 1.507 -7.937 860 HG3 LYS 766 HG3 LYS 766 7.621 0.150 -8.340 861 HD2 LYS 766 HD2 LYS 766 9.944 -0.379 -8.917 862 HD3 LYS 766 HD3 LYS 766 8.975 -0.253 -10.387 863 HE2 LYS 766 HE2 LYS 766 10.384 2.192 -9.338 864 HE3 LYS 766 HE3 LYS 766 11.298 0.990 -10.242 865 HZ1 LYS 766 HZ1 LYS 766 10.557 2.041 -12.051 866 HZ2 LYS 766 HZ2 LYS 766 9.049 1.337 -11.736 867 HZ3 LYS 766 HZ3 LYS 766 9.370 2.924 -11.197 868 H GLU 767 H GLU 767 5.782 4.668 -10.143 869 HA GLU 767 HA GLU 767 6.823 5.063 -12.775 870 HB2 GLU 767 HB2 GLU 767 4.307 5.249 -11.528 871 HB3 GLU 767 HB3 GLU 767 4.681 6.883 -12.074 872 HG2 GLU 767 HG2 GLU 767 5.457 5.481 -14.253 873 HG3 GLU 767 HG3 GLU 767 4.182 4.423 -13.660 874 H1 ASP 338 H1 ASP 338 7.824 9.193 6.688 875 H2 ASP 338 H2 ASP 338 8.049 10.094 8.122 876 H3 ASP 338 H3 ASP 338 7.536 8.475 8.207 877 HA ASP 338 HA ASP 338 9.716 7.948 6.991 878 HB2 ASP 338 HB2 ASP 338 10.009 10.535 6.717 879 HB3 ASP 338 HB3 ASP 338 10.618 10.463 8.372 880 H THR 339 H THR 339 11.831 8.180 8.710 881 HA THR 339 HA THR 339 12.699 7.396 10.680 882 HB THR 339 HB THR 339 11.653 7.965 12.746 883 HG1 THR 339 HG1 THR 339 9.294 8.036 11.168 884 HG21 THR 339 HG21 THR 339 10.886 9.996 10.630 885 HG22 THR 339 HG22 THR 339 10.973 10.322 12.361 886 HG23 THR 339 HG23 THR 339 12.434 9.897 11.469 887 H GLU 340 H GLU 340 9.665 6.560 12.038 888 HA GLU 340 HA GLU 340 10.369 3.792 12.220 889 HB2 GLU 340 HB2 GLU 340 9.072 4.875 13.966 890 HB3 GLU 340 HB3 GLU 340 7.778 5.237 12.823 891 HG2 GLU 340 HG2 GLU 340 7.235 3.242 14.172 892 HG3 GLU 340 HG3 GLU 340 7.403 2.823 12.471 893 H VAL 341 H VAL 341 9.272 1.981 11.375 894 HA VAL 341 HA VAL 341 8.668 2.137 8.604 895 HB VAL 341 HB VAL 341 8.132 -0.210 8.752 896 HG11 VAL 341 HG11 VAL 341 10.459 0.923 10.149 897 HG12 VAL 341 HG12 VAL 341 10.086 -0.731 10.637 898 HG13 VAL 341 HG13 VAL 341 10.386 -0.360 8.938 899 HG21 VAL 341 HG21 VAL 341 8.038 -1.253 11.094 900 HG22 VAL 341 HG22 VAL 341 7.829 0.387 11.705 901 HG23 VAL 341 HG23 VAL 341 6.632 -0.306 10.612 902 H TYR 342 H TYR 342 6.456 0.896 7.910 903 HA TYR 342 HA TYR 342 4.413 2.794 8.387 904 HB2 TYR 342 HB2 TYR 342 2.926 1.061 7.244 905 HB3 TYR 342 HB3 TYR 342 4.291 1.680 6.325 906 HD1 TYR 342 HD2 TYR 342 5.204 -0.619 8.996 907 HD2 TYR 342 HD1 TYR 342 3.920 -0.379 4.892 908 HE1 TYR 342 HE2 TYR 342 6.005 -2.932 8.600 909 HE2 TYR 342 HE1 TYR 342 4.717 -2.688 4.519 910 HH TYR 342 HH TYR 342 5.060 -4.812 6.189 911 H GLU 343 H GLU 343 4.796 2.592 10.795 912 HA GLU 343 HA GLU 343 4.096 0.627 12.502 913 HB2 GLU 343 HB2 GLU 343 2.712 2.814 13.575 914 HB3 GLU 343 HB3 GLU 343 4.383 2.363 13.886 915 HG2 GLU 343 HG2 GLU 343 4.187 4.725 13.164 916 HG3 GLU 343 HG3 GLU 343 5.147 3.779 12.037 917 H SER 344 H SER 344 1.560 3.016 11.815 918 HA SER 344 HA SER 344 -0.409 1.399 10.726 919 HB2 SER 344 HB2 SER 344 -0.105 1.055 13.680 920 HB3 SER 344 HB3 SER 344 -1.729 1.071 12.998 921 HG SER 344 HG SER 344 0.464 -0.559 12.153 922 HA PRO 345 HA PRO 345 -1.173 6.011 11.086 923 HB2 PRO 345 HB2 PRO 345 -2.977 4.898 8.920 924 HB3 PRO 345 HB3 PRO 345 -2.157 6.472 8.971 925 HG2 PRO 345 HG2 PRO 345 -1.164 4.474 7.562 926 HG3 PRO 345 HG3 PRO 345 -0.101 5.555 8.478 927 HD2 PRO 345 HD2 PRO 345 -0.789 2.713 9.023 928 HD3 PRO 345 HD3 PRO 345 0.643 3.644 9.522 929 H PTR 346 H PTR 346 -3.478 3.302 10.813 930 HA PTR 346 HA PTR 346 -4.829 4.055 13.227 931 HB2 PTR 346 HB2 PTR 346 -6.681 5.102 12.489 932 HB3 PTR 346 HB3 PTR 346 -6.872 3.989 11.143 933 HD1 PTR 346 HD1 PTR 346 -5.284 4.299 9.109 934 HD2 PTR 346 HD2 PTR 346 -5.904 7.285 12.128 935 HE1 PTR 346 HE1 PTR 346 -4.382 6.024 7.567 936 HE2 PTR 346 HE2 PTR 346 -5.007 9.014 10.603 937 H ALA 347 H ALA 347 -7.154 2.790 13.057 938 HA ALA 347 HA ALA 347 -7.438 0.316 11.798 939 HB1 ALA 347 HB1 ALA 347 -6.246 -1.224 12.974 940 HB2 ALA 347 HB2 ALA 347 -6.561 -0.428 14.516 941 HB3 ALA 347 HB3 ALA 347 -5.254 0.142 13.482 942 H ASP 348 H ASP 348 -8.984 2.462 12.617 943 HA ASP 348 HA ASP 348 -10.398 2.121 15.027 944 HB2 ASP 348 HB2 ASP 348 -12.146 3.506 13.742 945 HB3 ASP 348 HB3 ASP 348 -10.546 4.219 13.943 946 HA PRO 349 HA PRO 349 -13.117 -1.229 14.011 947 HB2 PRO 349 HB2 PRO 349 -15.091 -0.824 15.819 948 HB3 PRO 349 HB3 PRO 349 -13.454 -1.303 16.309 949 HG2 PRO 349 HG2 PRO 349 -14.737 1.385 16.370 950 HG3 PRO 349 HG3 PRO 349 -13.667 0.617 17.556 951 HD2 PRO 349 HD2 PRO 349 -12.826 2.485 15.693 952 HD3 PRO 349 HD3 PRO 349 -11.760 1.286 16.457 953 H GLU 350 H GLU 350 -15.895 -1.267 14.209 954 HA GLU 350 HA GLU 350 -16.661 0.344 11.879 955 HB2 GLU 350 HB2 GLU 350 -18.257 -1.869 13.171 956 HB3 GLU 350 HB3 GLU 350 -18.405 -1.234 11.533 957 HG2 GLU 350 HG2 GLU 350 -15.696 -2.088 11.904 958 HG3 GLU 350 HG3 GLU 350 -16.754 -3.388 12.444 Start of MODEL 18 1 H1 GLY 661 H1 GLY 661 7.257 -15.166 -4.688 2 H2 GLY 661 H2 GLY 661 5.823 -15.651 -3.890 3 H3 GLY 661 H3 GLY 661 6.540 -16.665 -5.052 4 HA2 GLY 661 HA2 GLY 661 8.106 -17.458 -3.639 5 HA3 GLY 661 HA3 GLY 661 8.225 -15.913 -2.792 6 H HIS 662 H HIS 662 7.785 -16.408 -0.678 7 HA HIS 662 HA HIS 662 6.224 -18.397 0.404 8 HB2 HIS 662 HB2 HIS 662 7.575 -16.771 1.727 9 HB3 HIS 662 HB3 HIS 662 6.362 -15.534 1.406 10 HD1 HIS 662 HD1 HIS 662 3.997 -17.835 1.690 11 HD2 HIS 662 HD2 HIS 662 6.854 -16.683 4.518 12 HE1 HIS 662 HE1 HIS 662 3.059 -18.450 3.972 13 HE2 HIS 662 HE2 HIS 662 4.787 -17.754 5.698 14 H MET 663 H MET 663 5.244 -15.410 -1.075 15 HA MET 663 HA MET 663 2.457 -16.326 -1.139 16 HB2 MET 663 HB2 MET 663 3.512 -13.802 0.060 17 HB3 MET 663 HB3 MET 663 2.023 -13.687 -0.878 18 HG2 MET 663 HG2 MET 663 1.488 -15.909 0.603 19 HG3 MET 663 HG3 MET 663 2.519 -15.025 1.725 20 HE1 MET 663 HE1 MET 663 -0.719 -15.877 1.708 21 HE2 MET 663 HE2 MET 663 0.206 -15.361 3.120 22 HE3 MET 663 HE3 MET 663 -1.315 -14.551 2.706 23 H GLN 664 H GLN 664 1.297 -14.436 -2.658 24 HA GLN 664 HA GLN 664 2.373 -14.908 -5.229 25 HB2 GLN 664 HB2 GLN 664 0.533 -12.604 -4.573 26 HB3 GLN 664 HB3 GLN 664 0.653 -13.515 -6.078 27 HG2 GLN 664 HG2 GLN 664 -1.203 -14.551 -5.169 28 HG3 GLN 664 HG3 GLN 664 0.058 -15.559 -4.464 29 HE21 GLN 664 HE21 GLN 664 -2.744 -14.398 -3.497 30 HE22 GLN 664 HE22 GLN 664 -2.386 -13.874 -1.916 31 H ASP 665 H ASP 665 4.114 -14.069 -6.142 32 HA ASP 665 HA ASP 665 5.595 -11.938 -5.019 33 HB2 ASP 665 HB2 ASP 665 5.757 -12.959 -7.849 34 HB3 ASP 665 HB3 ASP 665 7.026 -12.167 -6.919 35 H LEU 666 H LEU 666 3.401 -10.698 -4.979 36 HA LEU 666 HA LEU 666 2.248 -9.377 -7.098 37 HB2 LEU 666 HB2 LEU 666 2.898 -8.296 -4.350 38 HB3 LEU 666 HB3 LEU 666 1.798 -7.518 -5.480 39 HG LEU 666 HG LEU 666 1.403 -10.408 -4.736 40 HD11 LEU 666 HD11 LEU 666 1.482 -8.430 -2.812 41 HD12 LEU 666 HD12 LEU 666 -0.226 -8.494 -3.236 42 HD13 LEU 666 HD13 LEU 666 0.599 -9.948 -2.680 43 HD21 LEU 666 HD21 LEU 666 -0.265 -8.151 -5.832 44 HD22 LEU 666 HD22 LEU 666 -0.031 -9.774 -6.485 45 HD23 LEU 666 HD23 LEU 666 -1.032 -9.534 -5.054 46 H SER 667 H SER 667 5.467 -9.083 -5.988 47 HA SER 667 HA SER 667 6.285 -6.528 -6.553 48 HB2 SER 667 HB2 SER 667 7.531 -9.091 -6.326 49 HB3 SER 667 HB3 SER 667 8.228 -8.247 -7.707 50 HG SER 667 HG SER 667 8.844 -6.606 -6.396 51 H VAL 668 H VAL 668 5.040 -8.867 -8.726 52 HA VAL 668 HA VAL 668 6.132 -7.889 -11.149 53 HB VAL 668 HB VAL 668 4.294 -9.112 -12.234 54 HG11 VAL 668 HG11 VAL 668 6.346 -10.193 -10.887 55 HG12 VAL 668 HG12 VAL 668 5.025 -10.889 -9.949 56 HG13 VAL 668 HG13 VAL 668 5.128 -11.190 -11.683 57 HG21 VAL 668 HG21 VAL 668 3.265 -9.604 -9.419 58 HG22 VAL 668 HG22 VAL 668 2.541 -8.450 -10.540 59 HG23 VAL 668 HG23 VAL 668 2.544 -10.171 -10.924 60 H HIS 669 H HIS 669 3.665 -6.679 -9.030 61 HA HIS 669 HA HIS 669 2.413 -5.037 -11.084 62 HB2 HIS 669 HB2 HIS 669 2.059 -4.859 -8.088 63 HB3 HIS 669 HB3 HIS 669 1.010 -4.183 -9.331 64 HD1 HIS 669 HD1 HIS 669 0.199 -6.210 -11.153 65 HD2 HIS 669 HD2 HIS 669 1.078 -7.273 -7.227 66 HE1 HIS 669 HE1 HIS 669 -0.931 -8.443 -10.752 67 HE2 HIS 669 HE2 HIS 669 -0.413 -9.104 -8.356 68 H LEU 670 H LEU 670 2.975 -3.080 -11.650 69 HA LEU 670 HA LEU 670 5.346 -1.854 -11.072 70 HB2 LEU 670 HB2 LEU 670 3.787 -1.289 -12.937 71 HB3 LEU 670 HB3 LEU 670 2.770 -0.434 -11.783 72 HG LEU 670 HG LEU 670 4.685 1.060 -11.235 73 HD11 LEU 670 HD11 LEU 670 6.639 1.014 -12.811 74 HD12 LEU 670 HD12 LEU 670 6.553 -0.401 -11.757 75 HD13 LEU 670 HD13 LEU 670 6.037 -0.522 -13.439 76 HD21 LEU 670 HD21 LEU 670 4.595 2.348 -13.273 77 HD22 LEU 670 HD22 LEU 670 4.186 0.918 -14.219 78 HD23 LEU 670 HD23 LEU 670 3.023 1.575 -13.067 79 H TRP 671 H TRP 671 2.335 -1.577 -9.223 80 HA TRP 671 HA TRP 671 3.451 0.549 -7.587 81 HB2 TRP 671 HB2 TRP 671 1.273 0.011 -6.218 82 HB3 TRP 671 HB3 TRP 671 1.183 0.892 -7.739 83 HD1 TRP 671 HD1 TRP 671 0.054 -0.270 -9.776 84 HE1 TRP 671 HE1 TRP 671 -1.303 -2.449 -10.042 85 HE3 TRP 671 HE3 TRP 671 1.067 -2.504 -5.293 86 HZ2 TRP 671 HZ2 TRP 671 -1.880 -4.810 -8.561 87 HZ3 TRP 671 HZ3 TRP 671 0.095 -4.720 -4.749 88 HH2 TRP 671 HH2 TRP 671 -1.375 -5.876 -6.379 89 H TYR 672 H TYR 672 4.096 -2.646 -7.690 90 HA TYR 672 HA TYR 672 4.135 -2.990 -4.764 91 HB2 TYR 672 HB2 TYR 672 3.448 -4.761 -6.651 92 HB3 TYR 672 HB3 TYR 672 5.172 -5.104 -6.571 93 HD1 TYR 672 HD2 TYR 672 2.094 -4.783 -4.516 94 HD2 TYR 672 HD1 TYR 672 6.098 -6.317 -4.719 95 HE1 TYR 672 HE2 TYR 672 1.720 -6.052 -2.415 96 HE2 TYR 672 HE1 TYR 672 5.720 -7.587 -2.628 97 HH TYR 672 HH TYR 672 2.682 -8.121 -1.321 98 H ALA 673 H ALA 673 5.854 -2.238 -3.722 99 HA ALA 673 HA ALA 673 8.429 -1.997 -5.100 100 HB1 ALA 673 HB1 ALA 673 7.160 -0.459 -3.180 101 HB2 ALA 673 HB2 ALA 673 8.864 -0.348 -3.621 102 HB3 ALA 673 HB3 ALA 673 8.373 -1.337 -2.249 103 H GLY 674 H GLY 674 6.764 -4.190 -3.129 104 HA2 GLY 674 HA2 GLY 674 7.350 -6.142 -2.064 105 HA3 GLY 674 HA3 GLY 674 8.711 -6.186 -3.172 106 HA PRO 675 HA PRO 675 11.151 -5.861 0.519 107 HB2 PRO 675 HB2 PRO 675 13.593 -5.522 -0.673 108 HB3 PRO 675 HB3 PRO 675 12.756 -7.084 -0.586 109 HG2 PRO 675 HG2 PRO 675 12.942 -5.159 -2.844 110 HG3 PRO 675 HG3 PRO 675 12.993 -6.929 -2.863 111 HD2 PRO 675 HD2 PRO 675 10.760 -5.492 -3.534 112 HD3 PRO 675 HD3 PRO 675 10.690 -7.129 -2.848 113 H MET 676 H MET 676 9.844 -3.626 0.540 114 HA MET 676 HA MET 676 11.898 -1.495 0.665 115 HB2 MET 676 HB2 MET 676 10.460 -1.175 -1.335 116 HB3 MET 676 HB3 MET 676 9.047 -1.121 -0.282 117 HG2 MET 676 HG2 MET 676 10.047 1.142 -0.955 118 HG3 MET 676 HG3 MET 676 9.775 0.891 0.769 119 HE1 MET 676 HE1 MET 676 11.869 0.803 -2.163 120 HE2 MET 676 HE2 MET 676 13.452 1.413 -1.690 121 HE3 MET 676 HE3 MET 676 13.110 -0.322 -1.617 122 H GLU 677 H GLU 677 11.509 0.156 2.209 123 HA GLU 677 HA GLU 677 9.795 -0.704 4.464 124 HB2 GLU 677 HB2 GLU 677 11.353 0.843 5.792 125 HB3 GLU 677 HB3 GLU 677 12.060 -0.661 5.195 126 HG2 GLU 677 HG2 GLU 677 12.987 0.552 3.246 127 HG3 GLU 677 HG3 GLU 677 12.285 2.041 3.838 128 H ARG 678 H ARG 678 8.894 1.099 5.780 129 HA ARG 678 HA ARG 678 7.225 2.782 4.366 130 HB2 ARG 678 HB2 ARG 678 6.835 2.424 6.704 131 HB3 ARG 678 HB3 ARG 678 8.391 3.119 7.143 132 HG2 ARG 678 HG2 ARG 678 6.816 4.971 5.533 133 HG3 ARG 678 HG3 ARG 678 5.940 4.477 6.978 134 HD2 ARG 678 HD2 ARG 678 7.420 5.502 8.395 135 HD3 ARG 678 HD3 ARG 678 8.806 5.158 7.359 136 HE ARG 678 HE ARG 678 7.012 7.073 6.163 137 HH11 ARG 678 HH21 ARG 678 9.503 6.669 8.564 138 HH12 ARG 678 HH22 ARG 678 10.094 8.300 8.371 139 HH21 ARG 678 HH11 ARG 678 7.820 9.158 5.898 140 HH22 ARG 678 HH12 ARG 678 9.151 9.688 6.890 141 H ALA 679 H ALA 679 9.948 4.076 6.242 142 HA ALA 679 HA ALA 679 10.158 6.565 5.096 143 HB1 ALA 679 HB1 ALA 679 11.484 5.970 7.021 144 HB2 ALA 679 HB2 ALA 679 12.601 6.408 5.726 145 HB3 ALA 679 HB3 ALA 679 12.322 4.708 6.114 146 H GLY 680 H GLY 680 11.337 3.502 3.919 147 HA2 GLY 680 HA2 GLY 680 12.910 4.505 1.765 148 HA3 GLY 680 HA3 GLY 680 12.323 2.851 1.928 149 H ALA 681 H ALA 681 9.662 3.046 1.938 150 HA ALA 681 HA ALA 681 8.933 3.388 -0.741 151 HB1 ALA 681 HB1 ALA 681 7.380 2.161 0.490 152 HB2 ALA 681 HB2 ALA 681 6.558 3.716 0.360 153 HB3 ALA 681 HB3 ALA 681 7.411 3.290 1.845 154 H GLU 682 H GLU 682 8.790 5.605 2.004 155 HA GLU 682 HA GLU 682 7.576 7.788 0.635 156 HB2 GLU 682 HB2 GLU 682 9.499 8.092 2.935 157 HB3 GLU 682 HB3 GLU 682 8.106 9.093 2.527 158 HG2 GLU 682 HG2 GLU 682 6.878 6.700 2.855 159 HG3 GLU 682 HG3 GLU 682 8.221 6.497 3.961 160 H SER 683 H SER 683 10.911 6.739 1.122 161 HA SER 683 HA SER 683 12.418 8.880 0.370 162 HB2 SER 683 HB2 SER 683 13.288 6.581 0.904 163 HB3 SER 683 HB3 SER 683 12.868 6.103 -0.740 164 HG SER 683 HG SER 683 14.159 8.148 -1.257 165 H ILE 684 H ILE 684 10.455 6.855 -1.710 166 HA ILE 684 HA ILE 684 11.271 8.372 -4.095 167 HB ILE 684 HB ILE 684 9.221 6.155 -3.963 168 HG12 ILE 684 HG12 ILE 684 11.653 5.132 -4.963 169 HG13 ILE 684 HG13 ILE 684 12.079 5.999 -3.486 170 HG21 ILE 684 HG21 ILE 684 11.054 7.100 -6.187 171 HG22 ILE 684 HG22 ILE 684 9.774 5.896 -6.320 172 HG23 ILE 684 HG23 ILE 684 9.368 7.584 -6.013 173 HD11 ILE 684 HD11 ILE 684 10.833 4.607 -2.142 174 HD12 ILE 684 HD12 ILE 684 9.657 4.255 -3.406 175 HD13 ILE 684 HD13 ILE 684 11.234 3.464 -3.424 176 H LEU 685 H LEU 685 8.269 7.388 -2.469 177 HA LEU 685 HA LEU 685 6.456 8.971 -3.833 178 HB2 LEU 685 HB2 LEU 685 6.449 8.134 -0.931 179 HB3 LEU 685 HB3 LEU 685 5.064 8.831 -1.762 180 HG LEU 685 HG LEU 685 6.487 6.270 -2.547 181 HD11 LEU 685 HD11 LEU 685 5.215 5.856 -0.570 182 HD12 LEU 685 HD12 LEU 685 3.879 6.861 -1.134 183 HD13 LEU 685 HD13 LEU 685 4.203 5.310 -1.906 184 HD21 LEU 685 HD21 LEU 685 4.293 7.906 -3.775 185 HD22 LEU 685 HD22 LEU 685 5.614 7.046 -4.563 186 HD23 LEU 685 HD23 LEU 685 4.234 6.151 -3.928 187 H ALA 686 H ALA 686 8.412 9.838 -0.968 188 HA ALA 686 HA ALA 686 7.342 12.261 -0.257 189 HB1 ALA 686 HB1 ALA 686 10.311 11.797 -0.611 190 HB2 ALA 686 HB2 ALA 686 9.373 11.157 0.745 191 HB3 ALA 686 HB3 ALA 686 9.529 12.900 0.524 192 H ASN 687 H ASN 687 9.631 11.681 -2.882 193 HA ASN 687 HA ASN 687 9.597 14.436 -3.749 194 HB2 ASN 687 HB2 ASN 687 10.642 12.420 -5.612 195 HB3 ASN 687 HB3 ASN 687 11.400 13.868 -4.969 196 HD21 ASN 687 HD21 ASN 687 10.507 10.527 -4.005 197 HD22 ASN 687 HD22 ASN 687 11.814 10.342 -2.918 198 H ARG 688 H ARG 688 7.914 11.486 -4.589 199 HA ARG 688 HA ARG 688 7.000 12.329 -7.146 200 HB2 ARG 688 HB2 ARG 688 6.849 9.987 -5.656 201 HB3 ARG 688 HB3 ARG 688 5.175 10.519 -5.780 202 HG2 ARG 688 HG2 ARG 688 5.560 9.195 -7.729 203 HG3 ARG 688 HG3 ARG 688 5.625 10.865 -8.281 204 HD2 ARG 688 HD2 ARG 688 8.189 10.654 -7.784 205 HD3 ARG 688 HD3 ARG 688 7.882 8.925 -7.872 206 HE ARG 688 HE ARG 688 7.389 10.841 -10.081 207 HH11 ARG 688 HH21 ARG 688 7.989 7.632 -8.914 208 HH12 ARG 688 HH22 ARG 688 8.159 6.953 -10.512 209 HH21 ARG 688 HH11 ARG 688 7.541 9.929 -12.120 210 HH22 ARG 688 HH12 ARG 688 7.844 8.223 -12.308 211 H SER 689 H SER 689 4.676 12.671 -7.647 212 HA SER 689 HA SER 689 3.755 14.938 -6.178 213 HB2 SER 689 HB2 SER 689 3.492 14.342 -8.725 214 HB3 SER 689 HB3 SER 689 2.019 13.541 -8.173 215 HG SER 689 HG SER 689 1.959 15.904 -8.770 216 H ASP 690 H ASP 690 1.696 15.251 -5.260 217 HA ASP 690 HA ASP 690 0.928 13.405 -3.309 218 HB2 ASP 690 HB2 ASP 690 0.116 16.005 -4.214 219 HB3 ASP 690 HB3 ASP 690 -1.323 15.015 -3.985 220 H GLY 691 H GLY 691 -0.238 11.582 -3.405 221 HA2 GLY 691 HA2 GLY 691 -2.295 10.465 -4.187 222 HA3 GLY 691 HA3 GLY 691 -1.968 11.138 -5.782 223 H THR 692 H THR 692 0.967 10.613 -5.361 224 HA THR 692 HA THR 692 1.207 8.179 -6.731 225 HB THR 692 HB THR 692 3.307 9.317 -4.875 226 HG1 THR 692 HG1 THR 692 2.689 11.020 -6.138 227 HG21 THR 692 HG21 THR 692 3.484 7.031 -6.163 228 HG22 THR 692 HG22 THR 692 3.754 8.060 -7.567 229 HG23 THR 692 HG23 THR 692 4.846 8.147 -6.185 230 H PHE 693 H PHE 693 1.547 6.044 -6.077 231 HA PHE 693 HA PHE 693 1.631 5.531 -3.179 232 HB2 PHE 693 HB2 PHE 693 -0.288 4.139 -3.170 233 HB3 PHE 693 HB3 PHE 693 -0.766 5.606 -4.024 234 HD1 PHE 693 HD1 PHE 693 -0.811 5.625 -6.546 235 HD2 PHE 693 HD2 PHE 693 -0.250 2.019 -4.279 236 HE1 PHE 693 HE1 PHE 693 -1.402 4.278 -8.543 237 HE2 PHE 693 HE2 PHE 693 -0.843 0.674 -6.277 238 HZ PHE 693 HZ PHE 693 -1.416 1.802 -8.409 239 H LEU 694 H LEU 694 1.677 3.098 -2.752 240 HA LEU 694 HA LEU 694 2.657 1.287 -4.694 241 HB2 LEU 694 HB2 LEU 694 4.999 1.152 -4.098 242 HB3 LEU 694 HB3 LEU 694 4.632 2.797 -4.588 243 HG LEU 694 HG LEU 694 4.142 3.037 -1.962 244 HD11 LEU 694 HD11 LEU 694 4.915 0.522 -1.819 245 HD12 LEU 694 HD12 LEU 694 6.533 1.214 -1.934 246 HD13 LEU 694 HD13 LEU 694 5.470 1.669 -0.605 247 HD21 LEU 694 HD21 LEU 694 6.840 3.160 -3.329 248 HD22 LEU 694 HD22 LEU 694 5.668 4.467 -3.177 249 HD23 LEU 694 HD23 LEU 694 6.503 3.862 -1.750 250 H VAL 695 H VAL 695 3.662 -0.675 -3.638 251 HA VAL 695 HA VAL 695 2.790 -1.065 -0.840 252 HB VAL 695 HB VAL 695 2.208 -3.151 -2.938 253 HG11 VAL 695 HG11 VAL 695 2.095 -3.026 -0.095 254 HG12 VAL 695 HG12 VAL 695 0.429 -3.027 -0.673 255 HG13 VAL 695 HG13 VAL 695 1.522 -4.327 -1.138 256 HG21 VAL 695 HG21 VAL 695 -0.162 -2.314 -2.844 257 HG22 VAL 695 HG22 VAL 695 0.416 -0.909 -1.949 258 HG23 VAL 695 HG23 VAL 695 0.945 -1.175 -3.611 259 H ARG 696 H ARG 696 4.027 -2.571 0.321 260 HA ARG 696 HA ARG 696 6.143 -4.031 -1.087 261 HB2 ARG 696 HB2 ARG 696 7.716 -2.996 0.773 262 HB3 ARG 696 HB3 ARG 696 7.431 -2.164 -0.752 263 HG2 ARG 696 HG2 ARG 696 7.064 -0.510 0.906 264 HG3 ARG 696 HG3 ARG 696 5.459 -1.009 0.427 265 HD2 ARG 696 HD2 ARG 696 5.873 -0.834 2.936 266 HD3 ARG 696 HD3 ARG 696 5.178 -2.343 2.361 267 HE ARG 696 HE ARG 696 8.118 -2.145 2.756 268 HH11 ARG 696 HH21 ARG 696 5.068 -3.645 3.379 269 HH12 ARG 696 HH22 ARG 696 5.700 -4.739 4.573 270 HH21 ARG 696 HH11 ARG 696 8.930 -3.631 4.205 271 HH22 ARG 696 HH12 ARG 696 7.883 -4.821 4.943 272 H GLN 697 H GLN 697 7.375 -5.483 0.325 273 HA GLN 697 HA GLN 697 6.145 -6.135 2.908 274 HB2 GLN 697 HB2 GLN 697 6.221 -8.634 2.027 275 HB3 GLN 697 HB3 GLN 697 4.811 -7.617 1.763 276 HG2 GLN 697 HG2 GLN 697 5.299 -8.625 -0.347 277 HG3 GLN 697 HG3 GLN 697 5.840 -6.958 -0.470 278 HE21 GLN 697 HE21 GLN 697 6.813 -10.179 -0.947 279 HE22 GLN 697 HE22 GLN 697 8.485 -9.908 -1.049 280 H ARG 698 H ARG 698 8.576 -5.040 2.790 281 HA ARG 698 HA ARG 698 10.873 -6.398 2.292 282 HB2 ARG 698 HB2 ARG 698 11.047 -4.232 3.265 283 HB3 ARG 698 HB3 ARG 698 10.182 -4.742 4.714 284 HG2 ARG 698 HG2 ARG 698 12.648 -4.580 5.074 285 HG3 ARG 698 HG3 ARG 698 12.020 -6.199 5.367 286 HD2 ARG 698 HD2 ARG 698 12.710 -6.837 3.041 287 HD3 ARG 698 HD3 ARG 698 13.420 -5.238 2.853 288 HE ARG 698 HE ARG 698 15.190 -5.908 4.209 289 HH11 ARG 698 HH21 ARG 698 12.580 -8.192 4.401 290 HH12 ARG 698 HH22 ARG 698 13.510 -9.333 5.322 291 HH21 ARG 698 HH11 ARG 698 16.360 -7.410 5.386 292 HH22 ARG 698 HH12 ARG 698 15.623 -8.897 5.871 293 H VAL 699 H VAL 699 8.697 -7.016 5.021 294 HA VAL 699 HA VAL 699 10.415 -9.300 5.789 295 HB VAL 699 HB VAL 699 8.092 -8.332 7.431 296 HG11 VAL 699 HG11 VAL 699 9.101 -10.335 8.234 297 HG12 VAL 699 HG12 VAL 699 10.728 -9.731 7.920 298 HG13 VAL 699 HG13 VAL 699 9.771 -9.045 9.233 299 HG21 VAL 699 HG21 VAL 699 9.813 -6.870 8.615 300 HG22 VAL 699 HG22 VAL 699 10.842 -7.085 7.200 301 HG23 VAL 699 HG23 VAL 699 9.280 -6.283 7.041 302 H LYS 700 H LYS 700 8.596 -9.211 3.476 303 HA LYS 700 HA LYS 700 6.192 -10.359 3.477 304 HB2 LYS 700 HB2 LYS 700 7.141 -11.995 1.667 305 HB3 LYS 700 HB3 LYS 700 7.181 -10.261 1.372 306 HG2 LYS 700 HG2 LYS 700 9.406 -10.458 1.042 307 HG3 LYS 700 HG3 LYS 700 9.560 -10.780 2.768 308 HD2 LYS 700 HD2 LYS 700 9.122 -13.216 2.277 309 HD3 LYS 700 HD3 LYS 700 9.207 -12.826 0.558 310 HE2 LYS 700 HE2 LYS 700 11.482 -12.404 0.621 311 HE3 LYS 700 HE3 LYS 700 11.447 -11.903 2.313 312 HZ1 LYS 700 HZ1 LYS 700 11.562 -14.033 3.079 313 HZ2 LYS 700 HZ2 LYS 700 10.770 -14.682 1.700 314 HZ3 LYS 700 HZ3 LYS 700 12.405 -14.232 1.597 315 H ASP 701 H ASP 701 9.144 -12.060 4.402 316 HA ASP 701 HA ASP 701 8.295 -14.657 4.664 317 HB2 ASP 701 HB2 ASP 701 9.939 -13.396 6.836 318 HB3 ASP 701 HB3 ASP 701 10.140 -14.965 6.055 319 H ALA 702 H ALA 702 7.375 -11.892 6.569 320 HA ALA 702 HA ALA 702 5.999 -13.607 8.539 321 HB1 ALA 702 HB1 ALA 702 7.527 -11.588 9.137 322 HB2 ALA 702 HB2 ALA 702 5.992 -11.770 9.984 323 HB3 ALA 702 HB3 ALA 702 6.138 -10.608 8.666 324 H ALA 703 H ALA 703 5.268 -12.571 5.587 325 HA ALA 703 HA ALA 703 3.310 -12.174 4.447 326 HB1 ALA 703 HB1 ALA 703 1.727 -12.771 6.927 327 HB2 ALA 703 HB2 ALA 703 2.628 -14.062 6.133 328 HB3 ALA 703 HB3 ALA 703 1.374 -13.190 5.250 329 H GLU 704 H GLU 704 4.558 -9.948 5.475 330 HA GLU 704 HA GLU 704 2.480 -8.271 6.685 331 HB2 GLU 704 HB2 GLU 704 4.297 -6.642 6.986 332 HB3 GLU 704 HB3 GLU 704 4.722 -8.203 7.668 333 HG2 GLU 704 HG2 GLU 704 6.545 -8.321 6.353 334 HG3 GLU 704 HG3 GLU 704 5.547 -8.182 4.915 335 H PHE 705 H PHE 705 1.294 -6.839 5.534 336 HA PHE 705 HA PHE 705 2.349 -5.831 2.986 337 HB2 PHE 705 HB2 PHE 705 -0.448 -6.950 3.115 338 HB3 PHE 705 HB3 PHE 705 0.462 -6.440 1.692 339 HD1 PHE 705 HD2 PHE 705 2.487 -7.768 0.984 340 HD2 PHE 705 HD1 PHE 705 -0.232 -9.150 4.005 341 HE1 PHE 705 HE2 PHE 705 3.360 -10.073 0.715 342 HE2 PHE 705 HE1 PHE 705 0.636 -11.456 3.734 343 HZ PHE 705 HZ PHE 705 2.433 -11.917 2.088 344 H ALA 706 H ALA 706 1.808 -3.798 2.540 345 HA ALA 706 HA ALA 706 -0.523 -2.503 3.673 346 HB1 ALA 706 HB1 ALA 706 0.526 -1.001 5.108 347 HB2 ALA 706 HB2 ALA 706 2.096 -1.221 4.344 348 HB3 ALA 706 HB3 ALA 706 1.452 -2.471 5.408 349 H ILE 707 H ILE 707 -1.090 -0.687 2.510 350 HA ILE 707 HA ILE 707 0.488 -0.225 0.071 351 HB ILE 707 HB ILE 707 -2.226 0.911 0.783 352 HG12 ILE 707 HG12 ILE 707 -1.599 -1.526 -0.911 353 HG13 ILE 707 HG13 ILE 707 -2.189 -1.605 0.749 354 HG21 ILE 707 HG21 ILE 707 -2.144 0.764 -1.906 355 HG22 ILE 707 HG22 ILE 707 -1.559 2.173 -1.021 356 HG23 ILE 707 HG23 ILE 707 -0.418 0.953 -1.588 357 HD11 ILE 707 HD11 ILE 707 -4.277 -1.467 -0.074 358 HD12 ILE 707 HD12 ILE 707 -3.913 0.189 -0.554 359 HD13 ILE 707 HD13 ILE 707 -3.673 -1.134 -1.695 360 H SER 708 H SER 708 1.552 1.593 -0.348 361 HA SER 708 HA SER 708 1.508 3.710 1.725 362 HB2 SER 708 HB2 SER 708 3.667 2.635 1.542 363 HB3 SER 708 HB3 SER 708 3.663 2.837 -0.201 364 HG SER 708 HG SER 708 3.504 4.977 1.656 365 H ILE 709 H ILE 709 0.723 5.663 1.143 366 HA ILE 709 HA ILE 709 0.693 6.341 -1.740 367 HB ILE 709 HB ILE 709 -1.624 7.085 0.016 368 HG12 ILE 709 HG12 ILE 709 -2.641 4.960 -1.252 369 HG13 ILE 709 HG13 ILE 709 -0.973 4.402 -1.130 370 HG21 ILE 709 HG21 ILE 709 -2.309 6.386 -2.668 371 HG22 ILE 709 HG22 ILE 709 -2.330 7.985 -1.924 372 HG23 ILE 709 HG23 ILE 709 -0.875 7.411 -2.738 373 HD11 ILE 709 HD11 ILE 709 -1.656 3.670 0.926 374 HD12 ILE 709 HD12 ILE 709 -1.349 5.342 1.393 375 HD13 ILE 709 HD13 ILE 709 -2.989 4.822 1.002 376 H LYS 710 H LYS 710 1.057 8.399 -2.288 377 HA LYS 710 HA LYS 710 2.152 10.187 -0.273 378 HB2 LYS 710 HB2 LYS 710 3.247 9.972 -2.453 379 HB3 LYS 710 HB3 LYS 710 1.774 10.487 -3.264 380 HG2 LYS 710 HG2 LYS 710 3.050 12.462 -3.173 381 HG3 LYS 710 HG3 LYS 710 1.967 12.624 -1.791 382 HD2 LYS 710 HD2 LYS 710 3.666 12.055 -0.246 383 HD3 LYS 710 HD3 LYS 710 4.699 11.372 -1.497 384 HE2 LYS 710 HE2 LYS 710 3.938 14.251 -1.746 385 HE3 LYS 710 HE3 LYS 710 5.132 13.817 -0.520 386 HZ1 LYS 710 HZ1 LYS 710 6.559 13.978 -2.250 387 HZ2 LYS 710 HZ2 LYS 710 6.020 12.389 -2.585 388 HZ3 LYS 710 HZ3 LYS 710 5.343 13.704 -3.438 389 H TYR 711 H TYR 711 1.004 11.667 0.798 390 HA TYR 711 HA TYR 711 -1.234 13.036 -0.513 391 HB2 TYR 711 HB2 TYR 711 -1.834 10.842 0.978 392 HB3 TYR 711 HB3 TYR 711 -1.860 12.088 2.221 393 HD1 TYR 711 HD2 TYR 711 -2.774 14.416 0.436 394 HD2 TYR 711 HD1 TYR 711 -4.148 10.373 0.835 395 HE1 TYR 711 HE2 TYR 711 -5.027 15.107 -0.334 396 HE2 TYR 711 HE1 TYR 711 -6.400 11.057 0.062 397 HH TYR 711 HH TYR 711 -7.652 12.737 -0.815 398 H ASN 712 H ASN 712 -0.929 15.135 -0.153 399 HA ASN 712 HA ASN 712 -0.433 17.117 0.915 400 HB2 ASN 712 HB2 ASN 712 -1.847 16.032 2.742 401 HB3 ASN 712 HB3 ASN 712 -0.330 15.549 3.497 402 HD21 ASN 712 HD21 ASN 712 1.308 17.579 3.552 403 HD22 ASN 712 HD22 ASN 712 0.606 19.010 4.149 404 H VAL 713 H VAL 713 1.616 16.202 -0.358 405 HA VAL 713 HA VAL 713 3.889 15.927 -0.483 406 HB VAL 713 HB VAL 713 5.112 17.727 0.302 407 HG11 VAL 713 HG11 VAL 713 3.685 19.665 0.154 408 HG12 VAL 713 HG12 VAL 713 3.022 18.427 -0.913 409 HG13 VAL 713 HG13 VAL 713 2.277 18.730 0.657 410 HG21 VAL 713 HG21 VAL 713 4.530 18.976 2.402 411 HG22 VAL 713 HG22 VAL 713 3.300 17.769 2.736 412 HG23 VAL 713 HG23 VAL 713 4.998 17.304 2.696 413 H GLU 714 H GLU 714 2.355 14.290 1.508 414 HA GLU 714 HA GLU 714 4.698 13.156 2.852 415 HB2 GLU 714 HB2 GLU 714 2.372 14.362 4.147 416 HB3 GLU 714 HB3 GLU 714 2.664 12.698 4.667 417 HG2 GLU 714 HG2 GLU 714 4.841 14.788 4.506 418 HG3 GLU 714 HG3 GLU 714 3.928 14.473 5.978 419 H VAL 715 H VAL 715 4.154 10.905 3.728 420 HA VAL 715 HA VAL 715 2.416 9.568 1.728 421 HB VAL 715 HB VAL 715 4.894 8.510 3.091 422 HG11 VAL 715 HG11 VAL 715 3.205 7.381 0.837 423 HG12 VAL 715 HG12 VAL 715 4.672 6.658 1.496 424 HG13 VAL 715 HG13 VAL 715 3.223 6.772 2.492 425 HG21 VAL 715 HG21 VAL 715 5.439 10.271 1.500 426 HG22 VAL 715 HG22 VAL 715 5.850 8.712 0.793 427 HG23 VAL 715 HG23 VAL 715 4.382 9.545 0.286 428 H LYS 716 H LYS 716 0.925 8.129 2.312 429 HA LYS 716 HA LYS 716 0.566 7.605 5.214 430 HB2 LYS 716 HB2 LYS 716 -1.257 8.684 3.552 431 HB3 LYS 716 HB3 LYS 716 -1.592 6.981 3.255 432 HG2 LYS 716 HG2 LYS 716 -2.392 6.611 5.392 433 HG3 LYS 716 HG3 LYS 716 -1.297 7.796 6.111 434 HD2 LYS 716 HD2 LYS 716 -3.697 8.535 4.404 435 HD3 LYS 716 HD3 LYS 716 -3.711 8.502 6.157 436 HE2 LYS 716 HE2 LYS 716 -1.660 10.083 6.003 437 HE3 LYS 716 HE3 LYS 716 -2.159 10.330 4.331 438 HZ1 LYS 716 HZ1 LYS 716 -3.731 11.713 5.012 439 HZ2 LYS 716 HZ2 LYS 716 -4.431 10.524 6.029 440 HZ3 LYS 716 HZ3 LYS 716 -3.189 11.543 6.612 441 H HIS 717 H HIS 717 0.488 5.514 5.957 442 HA HIS 717 HA HIS 717 0.621 3.318 3.981 443 HB2 HIS 717 HB2 HIS 717 2.304 3.329 6.481 444 HB3 HIS 717 HB3 HIS 717 2.407 2.238 5.107 445 HD1 HIS 717 HD1 HIS 717 4.055 2.830 3.332 446 HD2 HIS 717 HD2 HIS 717 3.261 6.058 5.846 447 HE1 HIS 717 HE1 HIS 717 5.750 4.632 2.756 448 HE2 HIS 717 HE2 HIS 717 5.307 6.596 4.328 449 H ILE 718 H ILE 718 -1.247 2.203 4.374 450 HA ILE 718 HA ILE 718 -1.884 1.636 7.207 451 HB ILE 718 HB ILE 718 -3.617 2.124 4.832 452 HG12 ILE 718 HG12 ILE 718 -3.658 3.852 6.436 453 HG13 ILE 718 HG13 ILE 718 -5.123 2.934 6.755 454 HG21 ILE 718 HG21 ILE 718 -4.191 -0.192 5.314 455 HG22 ILE 718 HG22 ILE 718 -4.332 0.173 7.033 456 HG23 ILE 718 HG23 ILE 718 -5.483 0.858 5.889 457 HD11 ILE 718 HD11 ILE 718 -4.355 2.959 8.903 458 HD12 ILE 718 HD12 ILE 718 -3.376 1.605 8.358 459 HD13 ILE 718 HD13 ILE 718 -2.686 3.229 8.407 460 H LYS 719 H LYS 719 -1.903 -0.454 7.878 461 HA LYS 719 HA LYS 719 -0.616 -2.375 6.202 462 HB2 LYS 719 HB2 LYS 719 -0.922 -3.892 8.158 463 HB3 LYS 719 HB3 LYS 719 -0.131 -2.368 8.556 464 HG2 LYS 719 HG2 LYS 719 -3.066 -2.242 8.757 465 HG3 LYS 719 HG3 LYS 719 -2.337 -3.404 9.865 466 HD2 LYS 719 HD2 LYS 719 -0.634 -1.270 10.141 467 HD3 LYS 719 HD3 LYS 719 -2.171 -0.452 9.858 468 HE2 LYS 719 HE2 LYS 719 -3.159 -2.013 11.631 469 HE3 LYS 719 HE3 LYS 719 -1.494 -2.437 12.033 470 HZ1 LYS 719 HZ1 LYS 719 -2.595 0.333 12.018 471 HZ2 LYS 719 HZ2 LYS 719 -2.318 -0.617 13.405 472 HZ3 LYS 719 HZ3 LYS 719 -0.992 -0.131 12.449 473 H ILE 720 H ILE 720 -1.338 -4.319 5.443 474 HA ILE 720 HA ILE 720 -4.234 -4.429 4.945 475 HB ILE 720 HB ILE 720 -1.876 -5.676 3.539 476 HG12 ILE 720 HG12 ILE 720 -3.959 -3.749 2.499 477 HG13 ILE 720 HG13 ILE 720 -2.446 -3.207 3.225 478 HG21 ILE 720 HG21 ILE 720 -3.361 -7.291 2.946 479 HG22 ILE 720 HG22 ILE 720 -4.735 -6.360 3.532 480 HG23 ILE 720 HG23 ILE 720 -4.082 -6.045 1.928 481 HD11 ILE 720 HD11 ILE 720 -1.861 -5.276 1.334 482 HD12 ILE 720 HD12 ILE 720 -2.884 -4.070 0.556 483 HD13 ILE 720 HD13 ILE 720 -1.361 -3.585 1.298 484 H MET 721 H MET 721 -5.450 -5.906 5.861 485 HA MET 721 HA MET 721 -4.197 -8.017 7.467 486 HB2 MET 721 HB2 MET 721 -6.533 -6.467 7.711 487 HB3 MET 721 HB3 MET 721 -7.089 -8.104 7.373 488 HG2 MET 721 HG2 MET 721 -6.005 -8.999 9.265 489 HG3 MET 721 HG3 MET 721 -4.951 -7.594 9.434 490 HE1 MET 721 HE1 MET 721 -7.453 -7.972 12.522 491 HE2 MET 721 HE2 MET 721 -6.485 -9.080 11.555 492 HE3 MET 721 HE3 MET 721 -5.765 -7.595 12.195 493 H THR 722 H THR 722 -4.820 -10.253 7.228 494 HA THR 722 HA THR 722 -6.178 -11.040 4.778 495 HB THR 722 HB THR 722 -3.760 -10.587 4.160 496 HG1 THR 722 HG1 THR 722 -5.179 -12.023 3.028 497 HG21 THR 722 HG21 THR 722 -2.041 -11.913 5.000 498 HG22 THR 722 HG22 THR 722 -3.043 -11.702 6.437 499 HG23 THR 722 HG23 THR 722 -3.140 -13.197 5.504 500 H ALA 723 H ALA 723 -6.948 -13.102 4.802 501 HA ALA 723 HA ALA 723 -6.202 -14.912 6.976 502 HB1 ALA 723 HB1 ALA 723 -8.779 -13.461 6.761 503 HB2 ALA 723 HB2 ALA 723 -7.962 -14.104 8.186 504 HB3 ALA 723 HB3 ALA 723 -8.887 -15.182 7.137 505 H GLU 724 H GLU 724 -9.206 -15.128 5.234 506 HA GLU 724 HA GLU 724 -8.546 -17.694 4.150 507 HB2 GLU 724 HB2 GLU 724 -10.791 -15.987 3.140 508 HB3 GLU 724 HB3 GLU 724 -10.756 -17.732 3.398 509 HG2 GLU 724 HG2 GLU 724 -11.921 -17.178 5.296 510 HG3 GLU 724 HG3 GLU 724 -10.305 -16.879 5.933 511 H GLY 725 H GLY 725 -6.533 -16.087 3.327 512 HA2 GLY 725 HA2 GLY 725 -5.287 -15.638 1.427 513 HA3 GLY 725 HA3 GLY 725 -6.553 -16.419 0.486 514 H LEU 726 H LEU 726 -7.751 -13.955 2.470 515 HA LEU 726 HA LEU 726 -8.167 -12.214 0.147 516 HB2 LEU 726 HB2 LEU 726 -9.408 -12.315 2.900 517 HB3 LEU 726 HB3 LEU 726 -9.751 -11.031 1.742 518 HG LEU 726 HG LEU 726 -9.979 -13.829 0.747 519 HD11 LEU 726 HD11 LEU 726 -11.214 -13.181 3.163 520 HD12 LEU 726 HD12 LEU 726 -12.471 -12.908 1.957 521 HD13 LEU 726 HD13 LEU 726 -11.687 -14.483 2.071 522 HD21 LEU 726 HD21 LEU 726 -10.479 -12.085 -0.803 523 HD22 LEU 726 HD22 LEU 726 -12.041 -12.728 -0.299 524 HD23 LEU 726 HD23 LEU 726 -11.450 -11.211 0.380 525 H TYR 727 H TYR 727 -8.074 -9.852 0.479 526 HA TYR 727 HA TYR 727 -5.949 -9.015 2.373 527 HB2 TYR 727 HB2 TYR 727 -6.157 -8.187 -0.535 528 HB3 TYR 727 HB3 TYR 727 -4.962 -7.610 0.624 529 HD1 TYR 727 HD2 TYR 727 -6.240 -10.676 -1.067 530 HD2 TYR 727 HD1 TYR 727 -2.996 -8.859 1.082 531 HE1 TYR 727 HE2 TYR 727 -4.809 -12.640 -1.561 532 HE2 TYR 727 HE1 TYR 727 -1.566 -10.824 0.583 533 HH TYR 727 HH TYR 727 -1.401 -12.642 -0.909 534 H ARG 728 H ARG 728 -6.323 -7.127 3.407 535 HA ARG 728 HA ARG 728 -8.108 -5.127 2.318 536 HB2 ARG 728 HB2 ARG 728 -9.265 -5.204 4.739 537 HB3 ARG 728 HB3 ARG 728 -9.918 -6.035 3.333 538 HG2 ARG 728 HG2 ARG 728 -9.520 -8.083 4.229 539 HG3 ARG 728 HG3 ARG 728 -7.890 -7.632 4.725 540 HD2 ARG 728 HD2 ARG 728 -8.870 -7.903 6.791 541 HD3 ARG 728 HD3 ARG 728 -9.196 -6.198 6.525 542 HE ARG 728 HE ARG 728 -11.381 -7.422 5.458 543 HH11 ARG 728 HH21 ARG 728 -9.761 -7.717 8.504 544 HH12 ARG 728 HH22 ARG 728 -11.238 -7.827 9.430 545 HH21 ARG 728 HH11 ARG 728 -13.254 -7.688 6.638 546 HH22 ARG 728 HH12 ARG 728 -13.188 -7.871 8.357 547 H ILE 729 H ILE 729 -7.469 -3.156 2.885 548 HA ILE 729 HA ILE 729 -5.172 -2.778 4.572 549 HB ILE 729 HB ILE 729 -6.109 -0.261 4.215 550 HG12 ILE 729 HG12 ILE 729 -8.116 -1.357 3.029 551 HG13 ILE 729 HG13 ILE 729 -7.337 0.007 2.231 552 HG21 ILE 729 HG21 ILE 729 -4.370 -0.014 2.780 553 HG22 ILE 729 HG22 ILE 729 -3.977 -1.638 3.337 554 HG23 ILE 729 HG23 ILE 729 -4.817 -1.409 1.806 555 HD11 ILE 729 HD11 ILE 729 -6.175 -2.608 1.529 556 HD12 ILE 729 HD12 ILE 729 -7.867 -2.427 1.066 557 HD13 ILE 729 HD13 ILE 729 -6.667 -1.275 0.484 558 H THR 730 H THR 730 -8.509 -2.865 5.023 559 HA THR 730 HA THR 730 -8.228 -2.001 7.814 560 HB THR 730 HB THR 730 -9.057 -0.141 6.217 561 HG1 THR 730 HG1 THR 730 -11.023 -0.398 8.079 562 HG21 THR 730 HG21 THR 730 -10.603 -1.416 4.886 563 HG22 THR 730 HG22 THR 730 -11.492 -1.928 6.316 564 HG23 THR 730 HG23 THR 730 -11.525 -0.239 5.823 565 H GLU 731 H GLU 731 -9.293 -3.228 9.164 566 HA GLU 731 HA GLU 731 -10.158 -5.746 8.456 567 HB2 GLU 731 HB2 GLU 731 -9.974 -5.891 10.679 568 HB3 GLU 731 HB3 GLU 731 -9.927 -4.134 10.801 569 HG2 GLU 731 HG2 GLU 731 -11.793 -4.626 12.067 570 HG3 GLU 731 HG3 GLU 731 -12.512 -4.314 10.501 571 H LYS 732 H LYS 732 -11.656 -2.881 7.800 572 HA LYS 732 HA LYS 732 -14.372 -3.815 8.038 573 HB2 LYS 732 HB2 LYS 732 -13.514 -1.275 6.683 574 HB3 LYS 732 HB3 LYS 732 -15.020 -1.617 7.542 575 HG2 LYS 732 HG2 LYS 732 -13.819 -1.777 9.656 576 HG3 LYS 732 HG3 LYS 732 -12.282 -1.552 8.834 577 HD2 LYS 732 HD2 LYS 732 -13.123 0.690 8.035 578 HD3 LYS 732 HD3 LYS 732 -14.514 0.463 9.092 579 HE2 LYS 732 HE2 LYS 732 -12.360 -0.195 10.692 580 HE3 LYS 732 HE3 LYS 732 -11.780 1.195 9.779 581 HZ1 LYS 732 HZ1 LYS 732 -14.279 1.986 10.460 582 HZ2 LYS 732 HZ2 LYS 732 -13.829 1.022 11.822 583 HZ3 LYS 732 HZ3 LYS 732 -12.834 2.354 11.361 584 H LYS 733 H LYS 733 -11.940 -4.227 5.749 585 HA LYS 733 HA LYS 733 -13.936 -4.666 3.593 586 HB2 LYS 733 HB2 LYS 733 -11.923 -2.744 3.563 587 HB3 LYS 733 HB3 LYS 733 -11.273 -4.067 2.596 588 HG2 LYS 733 HG2 LYS 733 -12.535 -2.609 1.119 589 HG3 LYS 733 HG3 LYS 733 -13.446 -4.106 1.312 590 HD2 LYS 733 HD2 LYS 733 -14.915 -2.117 1.500 591 HD3 LYS 733 HD3 LYS 733 -14.875 -3.027 3.010 592 HE2 LYS 733 HE2 LYS 733 -13.930 -1.309 4.132 593 HE3 LYS 733 HE3 LYS 733 -12.746 -1.042 2.852 594 HZ1 LYS 733 HZ1 LYS 733 -15.554 -0.079 2.867 595 HZ2 LYS 733 HZ2 LYS 733 -14.150 0.878 3.065 596 HZ3 LYS 733 HZ3 LYS 733 -14.455 0.115 1.557 597 H ALA 734 H ALA 734 -12.389 -5.760 1.713 598 HA ALA 734 HA ALA 734 -10.546 -7.702 2.435 599 HB1 ALA 734 HB1 ALA 734 -12.226 -9.716 2.191 600 HB2 ALA 734 HB2 ALA 734 -13.391 -8.536 2.788 601 HB3 ALA 734 HB3 ALA 734 -11.970 -8.940 3.755 602 H PHE 735 H PHE 735 -9.563 -8.287 0.607 603 HA PHE 735 HA PHE 735 -11.169 -8.504 -1.878 604 HB2 PHE 735 HB2 PHE 735 -8.509 -7.113 -1.492 605 HB3 PHE 735 HB3 PHE 735 -9.110 -7.597 -3.084 606 HD1 PHE 735 HD2 PHE 735 -10.100 -5.667 -0.018 607 HD2 PHE 735 HD1 PHE 735 -10.579 -6.182 -4.256 608 HE1 PHE 735 HE2 PHE 735 -11.492 -3.608 -0.108 609 HE2 PHE 735 HE1 PHE 735 -11.963 -4.130 -4.353 610 HZ PHE 735 HZ PHE 735 -12.425 -2.847 -2.278 611 H ARG 736 H ARG 736 -10.222 -9.922 -3.501 612 HA ARG 736 HA ARG 736 -9.204 -12.349 -2.399 613 HB2 ARG 736 HB2 ARG 736 -9.241 -11.528 -5.297 614 HB3 ARG 736 HB3 ARG 736 -9.197 -13.167 -4.651 615 HG2 ARG 736 HG2 ARG 736 -11.421 -12.702 -3.544 616 HG3 ARG 736 HG3 ARG 736 -11.475 -11.180 -4.438 617 HD2 ARG 736 HD2 ARG 736 -11.441 -13.985 -5.539 618 HD3 ARG 736 HD3 ARG 736 -12.660 -12.733 -5.797 619 HE ARG 736 HE ARG 736 -10.508 -11.520 -6.849 620 HH11 ARG 736 HH21 ARG 736 -11.769 -14.727 -7.252 621 HH12 ARG 736 HH22 ARG 736 -10.960 -14.991 -8.756 622 HH21 ARG 736 HH11 ARG 736 -9.417 -11.879 -8.745 623 HH22 ARG 736 HH12 ARG 736 -9.639 -13.383 -9.606 624 H GLY 737 H GLY 737 -7.723 -9.544 -3.812 625 HA2 GLY 737 HA2 GLY 737 -5.090 -10.386 -3.052 626 HA3 GLY 737 HA3 GLY 737 -5.326 -10.451 -4.794 627 H LEU 738 H LEU 738 -3.506 -8.749 -3.417 628 HA LEU 738 HA LEU 738 -4.250 -6.163 -2.896 629 HB2 LEU 738 HB2 LEU 738 -1.828 -7.500 -3.868 630 HB3 LEU 738 HB3 LEU 738 -1.949 -5.825 -4.393 631 HG LEU 738 HG LEU 738 -0.774 -6.001 -2.233 632 HD11 LEU 738 HD11 LEU 738 -1.802 -4.147 -1.329 633 HD12 LEU 738 HD12 LEU 738 -2.567 -4.157 -2.914 634 HD13 LEU 738 HD13 LEU 738 -3.423 -4.816 -1.520 635 HD21 LEU 738 HD21 LEU 738 -1.737 -7.974 -1.274 636 HD22 LEU 738 HD22 LEU 738 -2.213 -6.639 -0.229 637 HD23 LEU 738 HD23 LEU 738 -3.368 -7.311 -1.377 638 H THR 739 H THR 739 -3.461 -7.504 -6.082 639 HA THR 739 HA THR 739 -3.866 -5.270 -7.652 640 HB THR 739 HB THR 739 -4.772 -8.006 -8.527 641 HG1 THR 739 HG1 THR 739 -2.106 -7.296 -8.754 642 HG21 THR 739 HG21 THR 739 -3.269 -7.063 -10.516 643 HG22 THR 739 HG22 THR 739 -4.962 -6.600 -10.353 644 HG23 THR 739 HG23 THR 739 -3.692 -5.516 -9.784 645 H GLU 740 H GLU 740 -6.325 -7.571 -6.473 646 HA GLU 740 HA GLU 740 -8.492 -6.333 -7.879 647 HB2 GLU 740 HB2 GLU 740 -8.959 -7.820 -5.325 648 HB3 GLU 740 HB3 GLU 740 -9.871 -7.870 -6.831 649 HG2 GLU 740 HG2 GLU 740 -7.356 -8.832 -7.537 650 HG3 GLU 740 HG3 GLU 740 -7.638 -9.539 -5.958 651 H LEU 741 H LEU 741 -6.844 -5.767 -4.907 652 HA LEU 741 HA LEU 741 -8.897 -4.032 -3.803 653 HB2 LEU 741 HB2 LEU 741 -7.610 -5.377 -2.272 654 HB3 LEU 741 HB3 LEU 741 -6.096 -4.843 -2.980 655 HG LEU 741 HG LEU 741 -6.928 -3.826 -0.715 656 HD11 LEU 741 HD11 LEU 741 -5.540 -2.632 -3.044 657 HD12 LEU 741 HD12 LEU 741 -6.044 -1.496 -1.793 658 HD13 LEU 741 HD13 LEU 741 -4.989 -2.849 -1.387 659 HD21 LEU 741 HD21 LEU 741 -8.486 -2.103 -0.796 660 HD22 LEU 741 HD22 LEU 741 -8.179 -1.757 -2.493 661 HD23 LEU 741 HD23 LEU 741 -9.143 -3.161 -2.040 662 H VAL 742 H VAL 742 -5.656 -3.830 -5.135 663 HA VAL 742 HA VAL 742 -5.357 -1.019 -5.073 664 HB VAL 742 HB VAL 742 -4.108 -3.168 -6.790 665 HG11 VAL 742 HG11 VAL 742 -3.758 -1.150 -7.980 666 HG12 VAL 742 HG12 VAL 742 -3.503 -0.227 -6.498 667 HG13 VAL 742 HG13 VAL 742 -2.285 -1.383 -7.034 668 HG21 VAL 742 HG21 VAL 742 -3.119 -1.697 -4.333 669 HG22 VAL 742 HG22 VAL 742 -3.773 -3.338 -4.340 670 HG23 VAL 742 HG23 VAL 742 -2.271 -2.982 -5.194 671 H GLU 743 H GLU 743 -6.175 -3.198 -7.770 672 HA GLU 743 HA GLU 743 -6.584 -1.120 -9.641 673 HB2 GLU 743 HB2 GLU 743 -7.612 -3.953 -9.644 674 HB3 GLU 743 HB3 GLU 743 -7.570 -2.879 -11.045 675 HG2 GLU 743 HG2 GLU 743 -5.011 -3.132 -9.571 676 HG3 GLU 743 HG3 GLU 743 -5.541 -4.588 -10.385 677 H PHE 744 H PHE 744 -8.626 -2.456 -7.202 678 HA PHE 744 HA PHE 744 -11.091 -1.518 -8.427 679 HB2 PHE 744 HB2 PHE 744 -11.178 -3.508 -7.033 680 HB3 PHE 744 HB3 PHE 744 -10.505 -2.622 -5.666 681 HD1 PHE 744 HD2 PHE 744 -13.342 -2.397 -8.118 682 HD2 PHE 744 HD1 PHE 744 -11.978 -1.710 -4.106 683 HE1 PHE 744 HE2 PHE 744 -15.618 -1.655 -7.471 684 HE2 PHE 744 HE1 PHE 744 -14.253 -0.962 -3.460 685 HZ PHE 744 HZ PHE 744 -16.073 -0.935 -5.143 686 H TYR 745 H TYR 745 -8.842 -0.494 -5.916 687 HA TYR 745 HA TYR 745 -10.503 1.735 -5.128 688 HB2 TYR 745 HB2 TYR 745 -7.809 0.707 -4.357 689 HB3 TYR 745 HB3 TYR 745 -8.220 2.381 -3.979 690 HD1 TYR 745 HD2 TYR 745 -11.084 0.191 -4.193 691 HD2 TYR 745 HD1 TYR 745 -7.995 1.571 -1.547 692 HE1 TYR 745 HE2 TYR 745 -12.427 -0.541 -2.248 693 HE2 TYR 745 HE1 TYR 745 -9.340 0.828 0.395 694 HH TYR 745 HH TYR 745 -12.639 0.025 0.170 695 H GLN 746 H GLN 746 -8.581 1.179 -7.797 696 HA GLN 746 HA GLN 746 -7.320 3.673 -8.193 697 HB2 GLN 746 HB2 GLN 746 -8.360 1.541 -10.043 698 HB3 GLN 746 HB3 GLN 746 -7.769 3.070 -10.699 699 HG2 GLN 746 HG2 GLN 746 -5.596 2.753 -9.765 700 HG3 GLN 746 HG3 GLN 746 -6.149 1.440 -8.733 701 HE21 GLN 746 HE21 GLN 746 -7.735 0.223 -11.035 702 HE22 GLN 746 HE22 GLN 746 -6.546 -0.528 -11.994 703 H GLN 747 H GLN 747 -10.604 2.551 -8.703 704 HA GLN 747 HA GLN 747 -11.446 5.260 -9.543 705 HB2 GLN 747 HB2 GLN 747 -12.944 2.627 -9.711 706 HB3 GLN 747 HB3 GLN 747 -13.510 4.181 -10.322 707 HG2 GLN 747 HG2 GLN 747 -10.937 2.864 -11.239 708 HG3 GLN 747 HG3 GLN 747 -12.475 2.681 -12.077 709 HE21 GLN 747 HE21 GLN 747 -9.942 5.023 -11.241 710 HE22 GLN 747 HE22 GLN 747 -10.429 6.195 -12.369 711 H ASN 748 H ASN 748 -11.552 2.952 -7.007 712 HA ASN 748 HA ASN 748 -13.712 4.389 -5.595 713 HB2 ASN 748 HB2 ASN 748 -13.794 1.863 -5.878 714 HB3 ASN 748 HB3 ASN 748 -12.400 1.779 -4.807 715 HD21 ASN 748 HD21 ASN 748 -12.866 3.340 -2.693 716 HD22 ASN 748 HD22 ASN 748 -14.379 3.024 -1.982 717 H SER 749 H SER 749 -12.934 6.044 -4.440 718 HA SER 749 HA SER 749 -10.439 6.687 -3.669 719 HB2 SER 749 HB2 SER 749 -12.851 7.740 -3.221 720 HB3 SER 749 HB3 SER 749 -12.530 7.107 -1.618 721 HG SER 749 HG SER 749 -10.300 8.266 -2.486 722 H LEU 750 H LEU 750 -8.985 6.238 -2.051 723 HA LEU 750 HA LEU 750 -9.020 3.644 -0.910 724 HB2 LEU 750 HB2 LEU 750 -7.341 6.073 -0.310 725 HB3 LEU 750 HB3 LEU 750 -7.075 4.507 0.450 726 HG LEU 750 HG LEU 750 -7.366 4.186 -2.411 727 HD11 LEU 750 HD11 LEU 750 -5.113 5.988 -1.507 728 HD12 LEU 750 HD12 LEU 750 -5.451 5.452 -3.155 729 HD13 LEU 750 HD13 LEU 750 -6.560 6.555 -2.340 730 HD21 LEU 750 HD21 LEU 750 -6.068 2.483 -1.676 731 HD22 LEU 750 HD22 LEU 750 -4.731 3.631 -1.673 732 HD23 LEU 750 HD23 LEU 750 -5.650 3.346 -0.197 733 H LYS 751 H LYS 751 -10.091 6.754 0.302 734 HA LYS 751 HA LYS 751 -10.177 6.319 3.018 735 HB2 LYS 751 HB2 LYS 751 -12.138 7.808 3.088 736 HB3 LYS 751 HB3 LYS 751 -10.851 8.436 2.075 737 HG2 LYS 751 HG2 LYS 751 -12.243 7.100 0.203 738 HG3 LYS 751 HG3 LYS 751 -13.561 7.494 1.314 739 HD2 LYS 751 HD2 LYS 751 -12.860 9.855 1.321 740 HD3 LYS 751 HD3 LYS 751 -11.540 9.465 0.232 741 HE2 LYS 751 HE2 LYS 751 -13.799 8.474 -1.064 742 HE3 LYS 751 HE3 LYS 751 -14.309 10.025 -0.387 743 HZ1 LYS 751 HZ1 LYS 751 -12.144 10.954 -1.250 744 HZ2 LYS 751 HZ2 LYS 751 -11.968 9.479 -2.142 745 HZ3 LYS 751 HZ3 LYS 751 -13.299 10.517 -2.452 746 H ASP 752 H ASP 752 -11.776 4.667 0.530 747 HA ASP 752 HA ASP 752 -14.095 3.653 1.719 748 HB2 ASP 752 HB2 ASP 752 -13.200 3.301 -0.649 749 HB3 ASP 752 HB3 ASP 752 -12.163 2.054 0.024 750 H CYS 753 H CYS 753 -10.715 2.775 2.028 751 HA CYS 753 HA CYS 753 -11.348 0.957 4.288 752 HB2 CYS 753 HB2 CYS 753 -9.170 0.887 2.218 753 HB3 CYS 753 HB3 CYS 753 -8.957 0.115 3.782 754 HG CYS 753 HG CYS 753 -10.980 -0.786 1.606 755 H PHE 754 H PHE 754 -8.979 3.224 2.929 756 HA PHE 754 HA PHE 754 -7.475 3.591 5.295 757 HB2 PHE 754 HB2 PHE 754 -7.858 5.161 2.770 758 HB3 PHE 754 HB3 PHE 754 -6.962 5.850 4.120 759 HD1 PHE 754 HD2 PHE 754 -7.159 2.767 2.016 760 HD2 PHE 754 HD1 PHE 754 -4.684 5.348 4.391 761 HE1 PHE 754 HE2 PHE 754 -5.158 1.471 1.339 762 HE2 PHE 754 HE1 PHE 754 -2.681 4.060 3.706 763 HZ PHE 754 HZ PHE 754 -2.917 2.121 2.179 764 H LYS 755 H LYS 755 -7.551 5.355 6.786 765 HA LYS 755 HA LYS 755 -10.266 6.202 7.337 766 HB2 LYS 755 HB2 LYS 755 -8.012 7.164 9.015 767 HB3 LYS 755 HB3 LYS 755 -9.587 6.525 9.486 768 HG2 LYS 755 HG2 LYS 755 -7.199 4.949 8.492 769 HG3 LYS 755 HG3 LYS 755 -7.908 4.899 10.101 770 HD2 LYS 755 HD2 LYS 755 -9.981 3.932 9.172 771 HD3 LYS 755 HD3 LYS 755 -9.292 3.993 7.555 772 HE2 LYS 755 HE2 LYS 755 -7.326 2.632 8.829 773 HE3 LYS 755 HE3 LYS 755 -8.720 2.110 9.775 774 HZ1 LYS 755 HZ1 LYS 755 -9.330 2.091 6.978 775 HZ2 LYS 755 HZ2 LYS 755 -7.940 1.155 7.308 776 HZ3 LYS 755 HZ3 LYS 755 -9.404 0.790 8.112 777 H SER 756 H SER 756 -7.189 8.055 7.219 778 HA SER 756 HA SER 756 -8.709 10.482 6.654 779 HB2 SER 756 HB2 SER 756 -6.711 11.673 7.076 780 HB3 SER 756 HB3 SER 756 -6.699 10.347 8.237 781 HG SER 756 HG SER 756 -4.997 9.562 7.295 782 H LEU 757 H LEU 757 -6.780 8.154 5.011 783 HA LEU 757 HA LEU 757 -5.889 9.553 2.768 784 HB2 LEU 757 HB2 LEU 757 -5.629 7.046 3.594 785 HB3 LEU 757 HB3 LEU 757 -6.943 6.791 2.451 786 HG LEU 757 HG LEU 757 -4.940 6.449 1.239 787 HD11 LEU 757 HD11 LEU 757 -6.639 7.823 0.096 788 HD12 LEU 757 HD12 LEU 757 -5.820 9.269 0.680 789 HD13 LEU 757 HD13 LEU 757 -4.995 8.184 -0.433 790 HD21 LEU 757 HD21 LEU 757 -3.126 8.122 1.212 791 HD22 LEU 757 HD22 LEU 757 -4.011 9.070 2.403 792 HD23 LEU 757 HD23 LEU 757 -3.404 7.470 2.831 793 H ASP 758 H ASP 758 -7.279 10.943 1.727 794 HA ASP 758 HA ASP 758 -9.810 9.772 0.773 795 HB2 ASP 758 HB2 ASP 758 -9.891 11.817 2.327 796 HB3 ASP 758 HB3 ASP 758 -9.292 12.735 0.950 797 H THR 759 H THR 759 -8.378 8.848 -0.927 798 HA THR 759 HA THR 759 -8.697 10.414 -3.310 799 HB THR 759 HB THR 759 -6.546 11.370 -2.566 800 HG1 THR 759 HG1 THR 759 -5.722 11.209 -4.550 801 HG21 THR 759 HG21 THR 759 -5.931 8.529 -2.167 802 HG22 THR 759 HG22 THR 759 -4.687 9.391 -3.068 803 HG23 THR 759 HG23 THR 759 -5.163 9.956 -1.469 804 H THR 760 H THR 760 -6.955 9.011 -5.001 805 HA THR 760 HA THR 760 -7.798 6.187 -4.628 806 HB THR 760 HB THR 760 -8.275 6.065 -7.071 807 HG1 THR 760 HG1 THR 760 -8.683 8.297 -7.943 808 HG21 THR 760 HG21 THR 760 -10.188 6.305 -5.706 809 HG22 THR 760 HG22 THR 760 -9.829 7.997 -5.354 810 HG23 THR 760 HG23 THR 760 -10.373 7.525 -6.964 811 H LEU 761 H LEU 761 -6.644 4.724 -6.214 812 HA LEU 761 HA LEU 761 -3.832 4.991 -5.899 813 HB2 LEU 761 HB2 LEU 761 -5.542 3.152 -7.596 814 HB3 LEU 761 HB3 LEU 761 -3.788 3.033 -7.543 815 HG LEU 761 HG LEU 761 -4.806 1.447 -5.957 816 HD11 LEU 761 HD11 LEU 761 -2.812 3.325 -5.386 817 HD12 LEU 761 HD12 LEU 761 -3.835 3.326 -3.952 818 HD13 LEU 761 HD13 LEU 761 -3.110 1.821 -4.516 819 HD21 LEU 761 HD21 LEU 761 -6.859 2.924 -5.590 820 HD22 LEU 761 HD22 LEU 761 -6.202 2.134 -4.160 821 HD23 LEU 761 HD23 LEU 761 -5.875 3.839 -4.450 822 H GLN 762 H GLN 762 -3.585 7.139 -6.756 823 HA GLN 762 HA GLN 762 -4.172 7.909 -9.392 824 HB2 GLN 762 HB2 GLN 762 -2.056 8.899 -7.476 825 HB3 GLN 762 HB3 GLN 762 -2.498 9.714 -8.974 826 HG2 GLN 762 HG2 GLN 762 -4.830 9.022 -7.342 827 HG3 GLN 762 HG3 GLN 762 -3.715 10.099 -6.510 828 HE21 GLN 762 HE21 GLN 762 -6.118 9.920 -8.989 829 HE22 GLN 762 HE22 GLN 762 -5.971 11.521 -9.532 830 H PHE 763 H PHE 763 -0.909 7.191 -8.123 831 HA PHE 763 HA PHE 763 -0.289 5.684 -10.527 832 HB2 PHE 763 HB2 PHE 763 1.904 7.439 -10.374 833 HB3 PHE 763 HB3 PHE 763 0.703 7.342 -11.657 834 HD1 PHE 763 HD1 PHE 763 1.623 9.061 -8.507 835 HD2 PHE 763 HD2 PHE 763 -1.069 8.966 -11.851 836 HE1 PHE 763 HE1 PHE 763 0.780 11.311 -7.891 837 HE2 PHE 763 HE2 PHE 763 -1.911 11.216 -11.237 838 HZ PHE 763 HZ PHE 763 -0.987 12.388 -9.257 839 HA PRO 764 HA PRO 764 2.299 3.561 -7.693 840 HB2 PRO 764 HB2 PRO 764 3.949 2.285 -9.464 841 HB3 PRO 764 HB3 PRO 764 2.261 1.809 -9.187 842 HG2 PRO 764 HG2 PRO 764 3.458 3.337 -11.425 843 HG3 PRO 764 HG3 PRO 764 2.102 2.198 -11.425 844 HD2 PRO 764 HD2 PRO 764 1.836 4.961 -11.488 845 HD3 PRO 764 HD3 PRO 764 0.572 3.835 -10.963 846 H PHE 765 H PHE 765 4.334 3.628 -6.734 847 HA PHE 765 HA PHE 765 5.864 5.986 -7.090 848 HB2 PHE 765 HB2 PHE 765 7.115 5.233 -5.288 849 HB3 PHE 765 HB3 PHE 765 5.609 4.349 -5.054 850 HD1 PHE 765 HD1 PHE 765 5.465 1.999 -6.278 851 HD2 PHE 765 HD2 PHE 765 9.123 4.044 -5.345 852 HE1 PHE 765 HE1 PHE 765 6.694 -0.141 -6.423 853 HE2 PHE 765 HE2 PHE 765 10.357 1.899 -5.490 854 HZ PHE 765 HZ PHE 765 9.142 -0.194 -6.028 855 H LYS 766 H LYS 766 6.125 2.746 -8.381 856 HA LYS 766 HA LYS 766 8.779 2.779 -9.254 857 HB2 LYS 766 HB2 LYS 766 6.323 1.255 -9.825 858 HB3 LYS 766 HB3 LYS 766 7.600 1.162 -11.027 859 HG2 LYS 766 HG2 LYS 766 8.605 0.972 -8.293 860 HG3 LYS 766 HG3 LYS 766 7.487 -0.320 -8.708 861 HD2 LYS 766 HD2 LYS 766 9.790 -0.954 -9.301 862 HD3 LYS 766 HD3 LYS 766 8.806 -0.788 -10.755 863 HE2 LYS 766 HE2 LYS 766 10.308 1.613 -9.745 864 HE3 LYS 766 HE3 LYS 766 11.191 0.363 -10.614 865 HZ1 LYS 766 HZ1 LYS 766 9.358 2.342 -11.634 866 HZ2 LYS 766 HZ2 LYS 766 10.485 1.364 -12.463 867 HZ3 LYS 766 HZ3 LYS 766 8.944 0.754 -12.116 868 H GLU 767 H GLU 767 5.981 4.358 -10.493 869 HA GLU 767 HA GLU 767 6.705 4.558 -13.201 870 HB2 GLU 767 HB2 GLU 767 4.720 5.674 -11.427 871 HB3 GLU 767 HB3 GLU 767 5.358 6.935 -12.476 872 HG2 GLU 767 HG2 GLU 767 4.940 5.464 -14.438 873 HG3 GLU 767 HG3 GLU 767 4.213 4.275 -13.365 874 H1 ASP 338 H1 ASP 338 15.788 0.633 5.807 875 H2 ASP 338 H2 ASP 338 16.584 0.801 7.308 876 H3 ASP 338 H3 ASP 338 14.982 1.352 7.119 877 HA ASP 338 HA ASP 338 14.688 -1.202 6.418 878 HB2 ASP 338 HB2 ASP 338 16.699 -2.190 6.922 879 HB3 ASP 338 HB3 ASP 338 17.142 -0.942 8.082 880 H THR 339 H THR 339 15.591 -0.132 9.679 881 HA THR 339 HA THR 339 13.178 -0.942 10.878 882 HB THR 339 HB THR 339 14.654 1.261 12.184 883 HG1 THR 339 HG1 THR 339 15.875 -1.091 11.187 884 HG21 THR 339 HG21 THR 339 13.883 -1.578 12.918 885 HG22 THR 339 HG22 THR 339 14.693 -0.455 14.009 886 HG23 THR 339 HG23 THR 339 13.068 -0.098 13.426 887 H GLU 340 H GLU 340 11.587 0.433 11.934 888 HA GLU 340 HA GLU 340 10.073 2.171 12.040 889 HB2 GLU 340 HB2 GLU 340 12.169 3.643 11.796 890 HB3 GLU 340 HB3 GLU 340 11.752 3.742 10.085 891 HG2 GLU 340 HG2 GLU 340 9.329 4.237 11.359 892 HG3 GLU 340 HG3 GLU 340 10.500 5.067 12.381 893 H VAL 341 H VAL 341 9.073 0.308 10.759 894 HA VAL 341 HA VAL 341 8.699 0.746 7.931 895 HB VAL 341 HB VAL 341 7.123 -1.175 8.105 896 HG11 VAL 341 HG11 VAL 341 9.617 -1.459 7.860 897 HG12 VAL 341 HG12 VAL 341 9.709 -1.663 9.609 898 HG13 VAL 341 HG13 VAL 341 8.810 -2.824 8.633 899 HG21 VAL 341 HG21 VAL 341 6.447 -0.506 10.507 900 HG22 VAL 341 HG22 VAL 341 6.658 -2.226 10.184 901 HG23 VAL 341 HG23 VAL 341 7.922 -1.324 11.018 902 H TYR 342 H TYR 342 6.020 0.200 7.552 903 HA TYR 342 HA TYR 342 4.860 2.767 7.765 904 HB2 TYR 342 HB2 TYR 342 2.729 1.447 7.112 905 HB3 TYR 342 HB3 TYR 342 4.080 1.478 5.982 906 HD1 TYR 342 HD2 TYR 342 3.698 -0.509 9.140 907 HD2 TYR 342 HD1 TYR 342 3.932 -0.589 4.844 908 HE1 TYR 342 HE2 TYR 342 3.774 -2.977 9.192 909 HE2 TYR 342 HE1 TYR 342 4.006 -3.069 4.915 910 HH TYR 342 HH TYR 342 4.683 -4.857 6.545 911 H GLU 343 H GLU 343 5.610 2.274 10.315 912 HA GLU 343 HA GLU 343 4.666 1.397 12.426 913 HB2 GLU 343 HB2 GLU 343 5.283 3.875 12.129 914 HB3 GLU 343 HB3 GLU 343 3.551 4.170 12.029 915 HG2 GLU 343 HG2 GLU 343 4.833 2.640 14.313 916 HG3 GLU 343 HG3 GLU 343 4.556 4.379 14.360 917 H SER 344 H SER 344 2.036 3.607 11.779 918 HA SER 344 HA SER 344 0.044 1.871 10.930 919 HB2 SER 344 HB2 SER 344 0.648 1.689 13.842 920 HB3 SER 344 HB3 SER 344 -1.040 1.636 13.338 921 HG SER 344 HG SER 344 1.101 0.018 12.349 922 HA PRO 345 HA PRO 345 -1.006 6.427 11.271 923 HB2 PRO 345 HB2 PRO 345 -2.648 5.382 8.966 924 HB3 PRO 345 HB3 PRO 345 -1.780 6.924 9.108 925 HG2 PRO 345 HG2 PRO 345 -0.803 4.927 7.665 926 HG3 PRO 345 HG3 PRO 345 0.257 5.975 8.623 927 HD2 PRO 345 HD2 PRO 345 -0.547 3.146 9.138 928 HD3 PRO 345 HD3 PRO 345 0.945 3.997 9.595 929 H PTR 346 H PTR 346 -3.033 3.602 10.616 930 HA PTR 346 HA PTR 346 -4.724 4.152 12.906 931 HB2 PTR 346 HB2 PTR 346 -6.672 4.703 11.853 932 HB3 PTR 346 HB3 PTR 346 -6.311 3.710 10.444 933 HD1 PTR 346 HD1 PTR 346 -5.069 4.602 8.553 934 HD2 PTR 346 HD2 PTR 346 -5.779 7.000 12.043 935 HE1 PTR 346 HE1 PTR 346 -4.342 6.604 7.307 936 HE2 PTR 346 HE2 PTR 346 -5.052 9.016 10.798 937 H ALA 347 H ALA 347 -6.842 2.446 12.075 938 HA ALA 347 HA ALA 347 -6.633 0.034 10.998 939 HB1 ALA 347 HB1 ALA 347 -4.788 0.094 13.378 940 HB2 ALA 347 HB2 ALA 347 -4.518 -0.594 11.777 941 HB3 ALA 347 HB3 ALA 347 -5.594 -1.405 12.913 942 H ASP 348 H ASP 348 -8.589 1.708 12.103 943 HA ASP 348 HA ASP 348 -9.649 0.521 14.507 944 HB2 ASP 348 HB2 ASP 348 -11.661 1.985 13.868 945 HB3 ASP 348 HB3 ASP 348 -10.148 2.813 14.228 946 HA PRO 349 HA PRO 349 -12.321 -2.412 12.460 947 HB2 PRO 349 HB2 PRO 349 -13.920 -3.031 14.526 948 HB3 PRO 349 HB3 PRO 349 -12.175 -3.338 14.604 949 HG2 PRO 349 HG2 PRO 349 -13.780 -1.254 15.946 950 HG3 PRO 349 HG3 PRO 349 -12.261 -2.012 16.447 951 HD2 PRO 349 HD2 PRO 349 -12.600 0.524 15.121 952 HD3 PRO 349 HD3 PRO 349 -11.076 -0.263 15.592 953 H GLU 350 H GLU 350 -14.961 -2.939 12.763 954 HA GLU 350 HA GLU 350 -16.778 -0.814 12.902 955 HB2 GLU 350 HB2 GLU 350 -15.248 -0.723 10.522 956 HB3 GLU 350 HB3 GLU 350 -16.846 -1.303 10.066 957 HG2 GLU 350 HG2 GLU 350 -17.919 0.626 10.890 958 HG3 GLU 350 HG3 GLU 350 -16.550 1.069 11.904 Start of MODEL 19 1 H1 GLY 661 H1 GLY 661 2.122 -13.891 -8.225 2 H2 GLY 661 H2 GLY 661 0.800 -12.862 -7.905 3 H3 GLY 661 H3 GLY 661 2.206 -12.233 -8.634 4 HA2 GLY 661 HA2 GLY 661 0.349 -12.578 -10.231 5 HA3 GLY 661 HA3 GLY 661 1.799 -13.509 -10.631 6 H HIS 662 H HIS 662 1.842 -15.766 -10.205 7 HA HIS 662 HA HIS 662 -0.722 -17.080 -10.359 8 HB2 HIS 662 HB2 HIS 662 0.551 -19.139 -10.473 9 HB3 HIS 662 HB3 HIS 662 1.381 -17.943 -11.468 10 HD1 HIS 662 HD1 HIS 662 1.891 -20.208 -8.654 11 HD2 HIS 662 HD2 HIS 662 3.658 -16.693 -10.020 12 HE1 HIS 662 HE1 HIS 662 4.119 -20.015 -7.458 13 HE2 HIS 662 HE2 HIS 662 5.187 -17.848 -8.250 14 H MET 663 H MET 663 1.585 -16.221 -7.925 15 HA MET 663 HA MET 663 -0.193 -17.283 -5.825 16 HB2 MET 663 HB2 MET 663 1.938 -18.725 -6.374 17 HB3 MET 663 HB3 MET 663 2.793 -17.463 -5.497 18 HG2 MET 663 HG2 MET 663 0.461 -18.180 -3.987 19 HG3 MET 663 HG3 MET 663 1.316 -19.655 -4.422 20 HE1 MET 663 HE1 MET 663 3.327 -20.478 -2.451 21 HE2 MET 663 HE2 MET 663 2.638 -19.628 -1.066 22 HE3 MET 663 HE3 MET 663 1.579 -20.269 -2.329 23 H GLN 664 H GLN 664 2.111 -16.409 -3.961 24 HA GLN 664 HA GLN 664 1.105 -13.784 -3.450 25 HB2 GLN 664 HB2 GLN 664 2.091 -15.547 -1.811 26 HB3 GLN 664 HB3 GLN 664 3.646 -14.842 -2.254 27 HG2 GLN 664 HG2 GLN 664 1.790 -12.710 -1.745 28 HG3 GLN 664 HG3 GLN 664 1.730 -13.836 -0.394 29 HE21 GLN 664 HE21 GLN 664 4.231 -12.282 -2.479 30 HE22 GLN 664 HE22 GLN 664 5.311 -11.991 -1.194 31 H ASP 665 H ASP 665 2.634 -14.357 -6.057 32 HA ASP 665 HA ASP 665 4.956 -12.638 -5.859 33 HB2 ASP 665 HB2 ASP 665 4.098 -13.028 -8.568 34 HB3 ASP 665 HB3 ASP 665 5.537 -13.629 -7.763 35 H LEU 666 H LEU 666 3.857 -10.813 -4.984 36 HA LEU 666 HA LEU 666 1.995 -9.362 -6.690 37 HB2 LEU 666 HB2 LEU 666 3.237 -8.355 -4.132 38 HB3 LEU 666 HB3 LEU 666 1.698 -7.891 -4.853 39 HG LEU 666 HG LEU 666 2.234 -10.725 -3.946 40 HD11 LEU 666 HD11 LEU 666 1.789 -8.331 -2.326 41 HD12 LEU 666 HD12 LEU 666 0.581 -9.585 -2.045 42 HD13 LEU 666 HD13 LEU 666 2.292 -9.947 -1.830 43 HD21 LEU 666 HD21 LEU 666 -0.221 -9.080 -4.588 44 HD22 LEU 666 HD22 LEU 666 0.327 -10.559 -5.376 45 HD23 LEU 666 HD23 LEU 666 -0.311 -10.619 -3.734 46 H SER 667 H SER 667 5.360 -9.569 -6.202 47 HA SER 667 HA SER 667 6.290 -6.993 -6.648 48 HB2 SER 667 HB2 SER 667 7.689 -9.285 -7.918 49 HB3 SER 667 HB3 SER 667 8.338 -7.989 -6.916 50 HG SER 667 HG SER 667 7.754 -10.414 -6.150 51 H VAL 668 H VAL 668 4.679 -9.111 -8.818 52 HA VAL 668 HA VAL 668 5.698 -8.094 -11.273 53 HB VAL 668 HB VAL 668 3.798 -9.197 -12.301 54 HG11 VAL 668 HG11 VAL 668 3.911 -11.380 -10.668 55 HG12 VAL 668 HG12 VAL 668 5.174 -10.961 -11.825 56 HG13 VAL 668 HG13 VAL 668 5.341 -10.502 -10.131 57 HG21 VAL 668 HG21 VAL 668 2.201 -10.315 -10.461 58 HG22 VAL 668 HG22 VAL 668 2.667 -8.882 -9.548 59 HG23 VAL 668 HG23 VAL 668 1.874 -8.711 -11.113 60 H HIS 669 H HIS 669 3.502 -6.827 -8.939 61 HA HIS 669 HA HIS 669 2.153 -5.038 -10.784 62 HB2 HIS 669 HB2 HIS 669 2.112 -4.906 -7.773 63 HB3 HIS 669 HB3 HIS 669 0.910 -4.297 -8.911 64 HD1 HIS 669 HD1 HIS 669 0.281 -6.520 -10.720 65 HD2 HIS 669 HD2 HIS 669 1.082 -7.228 -6.695 66 HE1 HIS 669 HE1 HIS 669 -0.739 -8.778 -10.179 67 HE2 HIS 669 HE2 HIS 669 -0.274 -9.218 -7.719 68 H LEU 670 H LEU 670 2.910 -3.207 -11.454 69 HA LEU 670 HA LEU 670 5.347 -2.088 -10.930 70 HB2 LEU 670 HB2 LEU 670 3.903 -1.492 -12.835 71 HB3 LEU 670 HB3 LEU 670 2.822 -0.629 -11.746 72 HG LEU 670 HG LEU 670 4.679 0.894 -11.126 73 HD11 LEU 670 HD11 LEU 670 6.597 -0.537 -11.459 74 HD12 LEU 670 HD12 LEU 670 6.198 -0.752 -13.165 75 HD13 LEU 670 HD13 LEU 670 6.738 0.823 -12.579 76 HD21 LEU 670 HD21 LEU 670 3.146 1.327 -13.103 77 HD22 LEU 670 HD22 LEU 670 4.707 2.147 -13.175 78 HD23 LEU 670 HD23 LEU 670 4.429 0.695 -14.136 79 H TRP 671 H TRP 671 2.424 -1.724 -8.978 80 HA TRP 671 HA TRP 671 3.658 0.476 -7.515 81 HB2 TRP 671 HB2 TRP 671 1.500 0.067 -6.041 82 HB3 TRP 671 HB3 TRP 671 1.428 0.959 -7.554 83 HD1 TRP 671 HD1 TRP 671 -0.122 0.048 -9.381 84 HE1 TRP 671 HE1 TRP 671 -1.603 -2.068 -9.647 85 HE3 TRP 671 HE3 TRP 671 1.504 -2.638 -5.350 86 HZ2 TRP 671 HZ2 TRP 671 -1.987 -4.555 -8.317 87 HZ3 TRP 671 HZ3 TRP 671 0.562 -4.879 -4.873 88 HH2 TRP 671 HH2 TRP 671 -1.184 -5.843 -6.354 89 H TYR 672 H TYR 672 4.188 -2.723 -7.506 90 HA TYR 672 HA TYR 672 4.160 -3.114 -4.621 91 HB2 TYR 672 HB2 TYR 672 3.774 -4.902 -6.480 92 HB3 TYR 672 HB3 TYR 672 5.540 -4.977 -6.516 93 HD1 TYR 672 HD2 TYR 672 2.696 -4.902 -4.096 94 HD2 TYR 672 HD1 TYR 672 6.645 -6.343 -4.956 95 HE1 TYR 672 HE2 TYR 672 2.678 -6.225 -1.989 96 HE2 TYR 672 HE1 TYR 672 6.628 -7.664 -2.863 97 HH TYR 672 HH TYR 672 5.452 -7.514 -0.619 98 H ALA 673 H ALA 673 5.649 -2.273 -3.369 99 HA ALA 673 HA ALA 673 8.385 -1.836 -4.394 100 HB1 ALA 673 HB1 ALA 673 8.615 -0.192 -2.743 101 HB2 ALA 673 HB2 ALA 673 7.357 -0.898 -1.728 102 HB3 ALA 673 HB3 ALA 673 6.922 -0.037 -3.203 103 H GLY 674 H GLY 674 6.685 -4.162 -2.928 104 HA2 GLY 674 HA2 GLY 674 7.066 -5.770 -1.268 105 HA3 GLY 674 HA3 GLY 674 8.376 -6.082 -2.378 106 HA PRO 675 HA PRO 675 11.172 -5.635 0.972 107 HB2 PRO 675 HB2 PRO 675 13.446 -4.956 -0.388 108 HB3 PRO 675 HB3 PRO 675 12.744 -6.586 -0.405 109 HG2 PRO 675 HG2 PRO 675 12.532 -4.417 -2.439 110 HG3 PRO 675 HG3 PRO 675 12.761 -6.161 -2.668 111 HD2 PRO 675 HD2 PRO 675 10.338 -4.944 -2.978 112 HD3 PRO 675 HD3 PRO 675 10.498 -6.625 -2.426 113 H MET 676 H MET 676 10.360 -2.920 -0.982 114 HA MET 676 HA MET 676 12.057 -0.926 0.049 115 HB2 MET 676 HB2 MET 676 10.515 -0.557 -1.828 116 HB3 MET 676 HB3 MET 676 9.139 -0.722 -0.734 117 HG2 MET 676 HG2 MET 676 9.921 1.686 -1.286 118 HG3 MET 676 HG3 MET 676 9.671 1.288 0.417 119 HE1 MET 676 HE1 MET 676 13.664 1.657 -1.843 120 HE2 MET 676 HE2 MET 676 12.289 0.672 -2.335 121 HE3 MET 676 HE3 MET 676 12.149 2.431 -2.307 122 H GLU 677 H GLU 677 11.835 0.515 1.833 123 HA GLU 677 HA GLU 677 10.218 -0.572 4.047 124 HB2 GLU 677 HB2 GLU 677 11.628 0.930 5.474 125 HB3 GLU 677 HB3 GLU 677 12.554 -0.302 4.608 126 HG2 GLU 677 HG2 GLU 677 13.660 1.250 3.378 127 HG3 GLU 677 HG3 GLU 677 12.187 2.163 3.069 128 H ARG 678 H ARG 678 9.507 1.261 5.632 129 HA ARG 678 HA ARG 678 7.463 2.721 4.406 130 HB2 ARG 678 HB2 ARG 678 7.742 2.097 6.886 131 HB3 ARG 678 HB3 ARG 678 8.746 3.537 7.014 132 HG2 ARG 678 HG2 ARG 678 6.350 4.216 5.579 133 HG3 ARG 678 HG3 ARG 678 5.896 3.372 7.057 134 HD2 ARG 678 HD2 ARG 678 8.015 5.265 7.602 135 HD3 ARG 678 HD3 ARG 678 6.674 6.076 6.805 136 HE ARG 678 HE ARG 678 5.219 5.093 8.602 137 HH11 ARG 678 HH21 ARG 678 8.618 5.478 9.109 138 HH12 ARG 678 HH22 ARG 678 8.504 5.448 10.847 139 HH21 ARG 678 HH11 ARG 678 5.037 5.097 10.809 140 HH22 ARG 678 HH12 ARG 678 6.473 5.270 11.796 141 H ALA 679 H ALA 679 10.265 4.195 6.041 142 HA ALA 679 HA ALA 679 10.059 6.739 4.929 143 HB1 ALA 679 HB1 ALA 679 12.834 5.877 5.270 144 HB2 ALA 679 HB2 ALA 679 11.819 5.482 6.656 145 HB3 ALA 679 HB3 ALA 679 11.939 7.150 6.098 146 H GLY 680 H GLY 680 11.692 3.861 3.717 147 HA2 GLY 680 HA2 GLY 680 12.956 5.017 1.465 148 HA3 GLY 680 HA3 GLY 680 12.503 3.320 1.611 149 H ALA 681 H ALA 681 9.792 3.445 1.884 150 HA ALA 681 HA ALA 681 8.864 3.717 -0.747 151 HB1 ALA 681 HB1 ALA 681 7.497 2.385 0.601 152 HB2 ALA 681 HB2 ALA 681 6.561 3.878 0.519 153 HB3 ALA 681 HB3 ALA 681 7.539 3.528 1.941 154 H GLU 682 H GLU 682 8.781 5.906 2.021 155 HA GLU 682 HA GLU 682 7.308 8.003 0.803 156 HB2 GLU 682 HB2 GLU 682 9.431 8.544 2.860 157 HB3 GLU 682 HB3 GLU 682 7.841 9.286 2.680 158 HG2 GLU 682 HG2 GLU 682 6.989 6.835 3.168 159 HG3 GLU 682 HG3 GLU 682 8.563 6.649 3.892 160 H SER 683 H SER 683 10.753 7.234 0.963 161 HA SER 683 HA SER 683 11.980 9.481 0.038 162 HB2 SER 683 HB2 SER 683 13.078 7.253 0.511 163 HB3 SER 683 HB3 SER 683 12.571 6.744 -1.098 164 HG SER 683 HG SER 683 13.645 8.893 -1.698 165 H ILE 684 H ILE 684 10.152 7.156 -1.855 166 HA ILE 684 HA ILE 684 10.539 8.700 -4.311 167 HB ILE 684 HB ILE 684 8.811 6.247 -3.948 168 HG12 ILE 684 HG12 ILE 684 11.256 5.444 -5.049 169 HG13 ILE 684 HG13 ILE 684 11.714 6.515 -3.724 170 HG21 ILE 684 HG21 ILE 684 8.518 7.389 -6.063 171 HG22 ILE 684 HG22 ILE 684 10.262 7.520 -6.288 172 HG23 ILE 684 HG23 ILE 684 9.479 5.942 -6.359 173 HD11 ILE 684 HD11 ILE 684 9.722 5.049 -2.551 174 HD12 ILE 684 HD12 ILE 684 10.439 3.854 -3.631 175 HD13 ILE 684 HD13 ILE 684 11.438 4.669 -2.430 176 H LEU 685 H LEU 685 7.874 7.539 -2.262 177 HA LEU 685 HA LEU 685 5.796 8.877 -3.594 178 HB2 LEU 685 HB2 LEU 685 6.062 7.973 -0.728 179 HB3 LEU 685 HB3 LEU 685 4.568 8.611 -1.410 180 HG LEU 685 HG LEU 685 6.079 6.155 -2.349 181 HD11 LEU 685 HD11 LEU 685 3.451 6.613 -0.925 182 HD12 LEU 685 HD12 LEU 685 3.843 5.098 -1.731 183 HD13 LEU 685 HD13 LEU 685 4.826 5.651 -0.379 184 HD21 LEU 685 HD21 LEU 685 3.913 5.939 -3.777 185 HD22 LEU 685 HD22 LEU 685 3.734 7.669 -3.493 186 HD23 LEU 685 HD23 LEU 685 5.159 7.056 -4.330 187 H ALA 686 H ALA 686 7.709 9.921 -0.733 188 HA ALA 686 HA ALA 686 6.353 12.352 -0.323 189 HB1 ALA 686 HB1 ALA 686 8.467 11.091 0.895 190 HB2 ALA 686 HB2 ALA 686 7.922 12.724 1.265 191 HB3 ALA 686 HB3 ALA 686 9.256 12.475 0.139 192 H ASN 687 H ASN 687 8.952 11.486 -2.532 193 HA ASN 687 HA ASN 687 9.361 14.182 -3.484 194 HB2 ASN 687 HB2 ASN 687 11.268 12.829 -3.682 195 HB3 ASN 687 HB3 ASN 687 10.349 11.459 -4.298 196 HD21 ASN 687 HD21 ASN 687 11.336 14.799 -5.235 197 HD22 ASN 687 HD22 ASN 687 11.364 14.470 -6.898 198 H ARG 688 H ARG 688 7.539 11.341 -4.521 199 HA ARG 688 HA ARG 688 6.814 12.328 -7.082 200 HB2 ARG 688 HB2 ARG 688 6.474 9.940 -5.643 201 HB3 ARG 688 HB3 ARG 688 4.847 10.523 -5.977 202 HG2 ARG 688 HG2 ARG 688 5.432 9.225 -7.883 203 HG3 ARG 688 HG3 ARG 688 5.645 10.898 -8.390 204 HD2 ARG 688 HD2 ARG 688 8.106 10.577 -7.572 205 HD3 ARG 688 HD3 ARG 688 7.746 8.859 -7.697 206 HE ARG 688 HE ARG 688 7.674 10.786 -9.943 207 HH11 ARG 688 HH21 ARG 688 7.851 7.538 -8.735 208 HH12 ARG 688 HH22 ARG 688 8.070 6.838 -10.319 209 HH21 ARG 688 HH11 ARG 688 7.888 9.845 -11.963 210 HH22 ARG 688 HH12 ARG 688 8.002 8.114 -12.125 211 H SER 689 H SER 689 4.382 12.534 -7.628 212 HA SER 689 HA SER 689 3.449 14.844 -6.203 213 HB2 SER 689 HB2 SER 689 3.262 14.190 -8.768 214 HB3 SER 689 HB3 SER 689 1.740 13.483 -8.232 215 HG SER 689 HG SER 689 1.967 15.896 -8.860 216 H ASP 690 H ASP 690 1.234 15.124 -5.503 217 HA ASP 690 HA ASP 690 0.465 13.315 -3.503 218 HB2 ASP 690 HB2 ASP 690 -0.405 15.851 -4.519 219 HB3 ASP 690 HB3 ASP 690 -1.811 14.813 -4.311 220 H GLY 691 H GLY 691 -0.557 11.422 -3.603 221 HA2 GLY 691 HA2 GLY 691 -2.541 10.185 -4.386 222 HA3 GLY 691 HA3 GLY 691 -2.235 10.847 -5.989 223 H THR 692 H THR 692 0.732 10.483 -5.432 224 HA THR 692 HA THR 692 1.135 8.057 -6.796 225 HB THR 692 HB THR 692 3.115 9.324 -4.891 226 HG1 THR 692 HG1 THR 692 2.483 10.982 -6.187 227 HG21 THR 692 HG21 THR 692 4.749 8.207 -6.118 228 HG22 THR 692 HG22 THR 692 3.436 7.033 -6.158 229 HG23 THR 692 HG23 THR 692 3.728 8.075 -7.549 230 H PHE 693 H PHE 693 1.324 5.951 -6.125 231 HA PHE 693 HA PHE 693 1.427 5.471 -3.212 232 HB2 PHE 693 HB2 PHE 693 -0.428 3.995 -3.252 233 HB3 PHE 693 HB3 PHE 693 -0.943 5.436 -4.126 234 HD1 PHE 693 HD1 PHE 693 -0.861 5.441 -6.661 235 HD2 PHE 693 HD2 PHE 693 -0.321 1.876 -4.329 236 HE1 PHE 693 HE1 PHE 693 -1.346 4.062 -8.661 237 HE2 PHE 693 HE2 PHE 693 -0.806 0.500 -6.329 238 HZ PHE 693 HZ PHE 693 -1.317 1.590 -8.496 239 H LEU 694 H LEU 694 1.553 3.063 -2.762 240 HA LEU 694 HA LEU 694 2.680 1.265 -4.634 241 HB2 LEU 694 HB2 LEU 694 4.983 1.202 -3.903 242 HB3 LEU 694 HB3 LEU 694 4.600 2.834 -4.424 243 HG LEU 694 HG LEU 694 3.962 3.154 -1.877 244 HD11 LEU 694 HD11 LEU 694 5.257 0.549 -1.963 245 HD12 LEU 694 HD12 LEU 694 6.147 1.668 -0.931 246 HD13 LEU 694 HD13 LEU 694 4.443 1.345 -0.616 247 HD21 LEU 694 HD21 LEU 694 6.242 3.978 -1.482 248 HD22 LEU 694 HD22 LEU 694 6.833 3.037 -2.849 249 HD23 LEU 694 HD23 LEU 694 5.723 4.379 -3.114 250 H VAL 695 H VAL 695 3.585 -0.683 -3.514 251 HA VAL 695 HA VAL 695 2.535 -0.956 -0.757 252 HB VAL 695 HB VAL 695 2.116 -3.096 -2.840 253 HG11 VAL 695 HG11 VAL 695 0.779 -2.540 -0.168 254 HG12 VAL 695 HG12 VAL 695 0.563 -3.967 -1.183 255 HG13 VAL 695 HG13 VAL 695 2.109 -3.677 -0.384 256 HG21 VAL 695 HG21 VAL 695 0.797 -1.313 -3.674 257 HG22 VAL 695 HG22 VAL 695 -0.323 -2.221 -2.658 258 HG23 VAL 695 HG23 VAL 695 0.408 -0.735 -2.055 259 H ARG 696 H ARG 696 3.697 -2.163 0.608 260 HA ARG 696 HA ARG 696 5.918 -3.804 -0.430 261 HB2 ARG 696 HB2 ARG 696 7.535 -2.724 0.885 262 HB3 ARG 696 HB3 ARG 696 6.586 -1.390 0.234 263 HG2 ARG 696 HG2 ARG 696 6.451 -0.751 2.418 264 HG3 ARG 696 HG3 ARG 696 5.154 -1.936 2.477 265 HD2 ARG 696 HD2 ARG 696 6.316 -3.196 3.927 266 HD3 ARG 696 HD3 ARG 696 7.656 -3.302 2.801 267 HE ARG 696 HE ARG 696 8.098 -0.887 3.830 268 HH11 ARG 696 HH21 ARG 696 7.165 -3.838 5.381 269 HH12 ARG 696 HH22 ARG 696 7.953 -3.446 6.865 270 HH21 ARG 696 HH11 ARG 696 9.096 -0.398 5.774 271 HH22 ARG 696 HH12 ARG 696 9.036 -1.514 7.088 272 H GLN 697 H GLN 697 6.782 -5.281 1.221 273 HA GLN 697 HA GLN 697 5.124 -5.678 3.606 274 HB2 GLN 697 HB2 GLN 697 4.262 -7.713 3.061 275 HB3 GLN 697 HB3 GLN 697 4.440 -7.109 1.416 276 HG2 GLN 697 HG2 GLN 697 6.514 -8.775 2.884 277 HG3 GLN 697 HG3 GLN 697 5.381 -9.399 1.692 278 HE21 GLN 697 HE21 GLN 697 8.342 -9.349 1.462 279 HE22 GLN 697 HE22 GLN 697 8.680 -8.426 0.081 280 H ARG 698 H ARG 698 6.164 -6.932 5.248 281 HA ARG 698 HA ARG 698 8.866 -7.870 4.715 282 HB2 ARG 698 HB2 ARG 698 8.755 -5.282 5.338 283 HB3 ARG 698 HB3 ARG 698 8.713 -5.929 6.972 284 HG2 ARG 698 HG2 ARG 698 11.035 -5.532 6.287 285 HG3 ARG 698 HG3 ARG 698 10.750 -7.258 6.488 286 HD2 ARG 698 HD2 ARG 698 11.987 -6.359 4.330 287 HD3 ARG 698 HD3 ARG 698 10.842 -7.688 4.213 288 HE ARG 698 HE ARG 698 9.407 -6.302 2.998 289 HH11 ARG 698 HH21 ARG 698 11.749 -4.419 4.700 290 HH12 ARG 698 HH22 ARG 698 11.417 -2.970 3.819 291 HH21 ARG 698 HH11 ARG 698 9.009 -4.437 1.818 292 HH22 ARG 698 HH12 ARG 698 9.828 -2.949 2.235 293 H VAL 699 H VAL 699 7.814 -6.890 7.936 294 HA VAL 699 HA VAL 699 8.279 -9.482 8.993 295 HB VAL 699 HB VAL 699 7.158 -8.560 11.052 296 HG11 VAL 699 HG11 VAL 699 8.890 -6.620 11.237 297 HG12 VAL 699 HG12 VAL 699 9.491 -8.261 11.001 298 HG13 VAL 699 HG13 VAL 699 9.412 -7.144 9.638 299 HG21 VAL 699 HG21 VAL 699 7.079 -5.942 9.541 300 HG22 VAL 699 HG22 VAL 699 5.673 -7.004 9.597 301 HG23 VAL 699 HG23 VAL 699 6.334 -6.335 11.088 302 H LYS 700 H LYS 700 6.771 -10.268 7.052 303 HA LYS 700 HA LYS 700 3.958 -10.263 7.618 304 HB2 LYS 700 HB2 LYS 700 3.883 -12.061 5.843 305 HB3 LYS 700 HB3 LYS 700 4.567 -10.520 5.333 306 HG2 LYS 700 HG2 LYS 700 6.770 -11.358 5.333 307 HG3 LYS 700 HG3 LYS 700 6.349 -12.724 6.365 308 HD2 LYS 700 HD2 LYS 700 6.634 -13.537 4.091 309 HD3 LYS 700 HD3 LYS 700 4.925 -13.626 4.511 310 HE2 LYS 700 HE2 LYS 700 5.506 -11.024 3.409 311 HE3 LYS 700 HE3 LYS 700 6.091 -12.271 2.308 312 HZ1 LYS 700 HZ1 LYS 700 3.585 -13.056 3.289 313 HZ2 LYS 700 HZ2 LYS 700 3.447 -11.451 2.742 314 HZ3 LYS 700 HZ3 LYS 700 4.006 -12.666 1.678 315 H ASP 701 H ASP 701 6.573 -12.587 8.147 316 HA ASP 701 HA ASP 701 6.702 -14.495 9.417 317 HB2 ASP 701 HB2 ASP 701 4.653 -12.864 10.904 318 HB3 ASP 701 HB3 ASP 701 5.141 -14.459 11.475 319 H ALA 702 H ALA 702 3.231 -13.722 9.330 320 HA ALA 702 HA ALA 702 2.695 -16.484 8.388 321 HB1 ALA 702 HB1 ALA 702 1.727 -15.900 10.613 322 HB2 ALA 702 HB2 ALA 702 0.492 -16.273 9.410 323 HB3 ALA 702 HB3 ALA 702 0.822 -14.596 9.844 324 H ALA 703 H ALA 703 1.783 -13.067 8.048 325 HA ALA 703 HA ALA 703 1.619 -12.985 5.291 326 HB1 ALA 703 HB1 ALA 703 -0.933 -13.930 6.579 327 HB2 ALA 703 HB2 ALA 703 -0.128 -14.548 5.136 328 HB3 ALA 703 HB3 ALA 703 -0.970 -13.001 5.080 329 H GLU 704 H GLU 704 2.249 -10.873 5.436 330 HA GLU 704 HA GLU 704 0.221 -8.955 6.329 331 HB2 GLU 704 HB2 GLU 704 1.502 -7.870 7.876 332 HB3 GLU 704 HB3 GLU 704 2.230 -9.462 8.048 333 HG2 GLU 704 HG2 GLU 704 4.136 -8.163 7.755 334 HG3 GLU 704 HG3 GLU 704 3.808 -8.612 6.088 335 H PHE 705 H PHE 705 0.382 -6.922 5.362 336 HA PHE 705 HA PHE 705 2.413 -6.330 3.393 337 HB2 PHE 705 HB2 PHE 705 -0.444 -6.732 2.438 338 HB3 PHE 705 HB3 PHE 705 0.929 -6.232 1.460 339 HD1 PHE 705 HD1 PHE 705 2.666 -7.833 0.812 340 HD2 PHE 705 HD2 PHE 705 -0.693 -9.041 3.198 341 HE1 PHE 705 HE1 PHE 705 3.211 -10.213 0.370 342 HE2 PHE 705 HE2 PHE 705 -0.150 -11.421 2.761 343 HZ PHE 705 HZ PHE 705 1.800 -12.008 1.344 344 H ALA 706 H ALA 706 1.844 -4.125 2.348 345 HA ALA 706 HA ALA 706 -0.168 -2.542 3.675 346 HB1 ALA 706 HB1 ALA 706 2.684 -1.841 4.282 347 HB2 ALA 706 HB2 ALA 706 1.682 -2.771 5.389 348 HB3 ALA 706 HB3 ALA 706 1.229 -1.119 4.961 349 H ILE 707 H ILE 707 -0.651 -0.763 2.594 350 HA ILE 707 HA ILE 707 0.880 -0.179 0.150 351 HB ILE 707 HB ILE 707 -1.841 0.882 0.912 352 HG12 ILE 707 HG12 ILE 707 -1.125 -1.646 -0.605 353 HG13 ILE 707 HG13 ILE 707 -1.930 -1.562 0.960 354 HG21 ILE 707 HG21 ILE 707 -0.105 1.519 -1.170 355 HG22 ILE 707 HG22 ILE 707 -1.221 0.367 -1.900 356 HG23 ILE 707 HG23 ILE 707 -1.837 1.833 -1.142 357 HD11 ILE 707 HD11 ILE 707 -3.342 -1.829 -1.268 358 HD12 ILE 707 HD12 ILE 707 -3.930 -0.813 0.047 359 HD13 ILE 707 HD13 ILE 707 -3.140 -0.081 -1.348 360 H SER 708 H SER 708 1.750 1.782 -0.281 361 HA SER 708 HA SER 708 1.594 3.845 1.858 362 HB2 SER 708 HB2 SER 708 3.921 3.178 0.037 363 HB3 SER 708 HB3 SER 708 3.877 4.534 1.155 364 HG SER 708 HG SER 708 3.769 1.751 1.749 365 H ILE 709 H ILE 709 0.551 5.642 1.185 366 HA ILE 709 HA ILE 709 0.695 6.309 -1.699 367 HB ILE 709 HB ILE 709 -1.713 6.867 0.027 368 HG12 ILE 709 HG12 ILE 709 -2.457 4.851 -1.693 369 HG13 ILE 709 HG13 ILE 709 -0.829 4.354 -1.239 370 HG21 ILE 709 HG21 ILE 709 -2.637 6.713 -2.480 371 HG22 ILE 709 HG22 ILE 709 -1.938 8.204 -1.850 372 HG23 ILE 709 HG23 ILE 709 -0.969 7.135 -2.862 373 HD11 ILE 709 HD11 ILE 709 -1.533 4.803 1.187 374 HD12 ILE 709 HD12 ILE 709 -3.185 4.881 0.577 375 HD13 ILE 709 HD13 ILE 709 -2.251 3.394 0.409 376 H LYS 710 H LYS 710 0.889 8.374 -2.297 377 HA LYS 710 HA LYS 710 1.877 10.263 -0.314 378 HB2 LYS 710 HB2 LYS 710 3.016 10.087 -2.459 379 HB3 LYS 710 HB3 LYS 710 1.524 10.452 -3.316 380 HG2 LYS 710 HG2 LYS 710 2.742 12.503 -3.244 381 HG3 LYS 710 HG3 LYS 710 1.479 12.659 -2.027 382 HD2 LYS 710 HD2 LYS 710 2.967 12.440 -0.253 383 HD3 LYS 710 HD3 LYS 710 4.150 11.563 -1.216 384 HE2 LYS 710 HE2 LYS 710 3.471 14.420 -1.875 385 HE3 LYS 710 HE3 LYS 710 4.637 14.051 -0.602 386 HZ1 LYS 710 HZ1 LYS 710 5.444 12.410 -2.571 387 HZ2 LYS 710 HZ2 LYS 710 4.899 13.745 -3.489 388 HZ3 LYS 710 HZ3 LYS 710 6.103 13.968 -2.287 389 H TYR 711 H TYR 711 0.573 11.590 0.776 390 HA TYR 711 HA TYR 711 -1.750 12.795 -0.595 391 HB2 TYR 711 HB2 TYR 711 -2.199 10.709 1.041 392 HB3 TYR 711 HB3 TYR 711 -2.133 11.991 2.248 393 HD1 TYR 711 HD2 TYR 711 -3.293 14.303 0.856 394 HD2 TYR 711 HD1 TYR 711 -4.447 10.170 0.747 395 HE1 TYR 711 HE2 TYR 711 -5.604 14.967 0.257 396 HE2 TYR 711 HE1 TYR 711 -6.759 10.832 0.145 397 HH TYR 711 HH TYR 711 -8.127 12.542 -0.443 398 H ASN 712 H ASN 712 -1.527 14.922 -0.461 399 HA ASN 712 HA ASN 712 -0.964 17.015 0.298 400 HB2 ASN 712 HB2 ASN 712 -1.848 15.553 2.727 401 HB3 ASN 712 HB3 ASN 712 -0.955 17.046 2.998 402 HD21 ASN 712 HD21 ASN 712 -4.017 16.139 3.006 403 HD22 ASN 712 HD22 ASN 712 -4.759 17.450 2.226 404 H VAL 713 H VAL 713 1.172 16.152 -0.627 405 HA VAL 713 HA VAL 713 3.457 15.905 -0.510 406 HB VAL 713 HB VAL 713 4.623 17.662 0.659 407 HG11 VAL 713 HG11 VAL 713 2.023 18.294 -0.679 408 HG12 VAL 713 HG12 VAL 713 2.915 19.616 0.070 409 HG13 VAL 713 HG13 VAL 713 3.669 18.651 -1.199 410 HG21 VAL 713 HG21 VAL 713 2.062 18.452 2.048 411 HG22 VAL 713 HG22 VAL 713 3.189 17.324 2.801 412 HG23 VAL 713 HG23 VAL 713 3.710 18.962 2.406 413 H GLU 714 H GLU 714 1.803 14.229 1.346 414 HA GLU 714 HA GLU 714 4.030 13.304 3.024 415 HB2 GLU 714 HB2 GLU 714 1.448 14.341 3.941 416 HB3 GLU 714 HB3 GLU 714 1.826 12.736 4.575 417 HG2 GLU 714 HG2 GLU 714 3.922 14.888 4.565 418 HG3 GLU 714 HG3 GLU 714 2.720 14.836 5.853 419 H VAL 715 H VAL 715 3.752 11.056 3.756 420 HA VAL 715 HA VAL 715 2.276 9.512 1.707 421 HB VAL 715 HB VAL 715 4.574 8.510 3.376 422 HG11 VAL 715 HG11 VAL 715 4.747 7.057 1.234 423 HG12 VAL 715 HG12 VAL 715 3.443 6.700 2.366 424 HG13 VAL 715 HG13 VAL 715 3.109 7.616 0.897 425 HG21 VAL 715 HG21 VAL 715 4.539 10.344 1.053 426 HG22 VAL 715 HG22 VAL 715 5.808 10.061 2.245 427 HG23 VAL 715 HG23 VAL 715 5.612 8.959 0.886 428 H LYS 716 H LYS 716 0.861 7.947 2.242 429 HA LYS 716 HA LYS 716 0.350 7.524 5.140 430 HB2 LYS 716 HB2 LYS 716 -1.438 8.582 3.503 431 HB3 LYS 716 HB3 LYS 716 -1.697 6.902 3.043 432 HG2 LYS 716 HG2 LYS 716 -2.547 6.306 5.120 433 HG3 LYS 716 HG3 LYS 716 -1.582 7.514 5.969 434 HD2 LYS 716 HD2 LYS 716 -4.040 8.064 4.279 435 HD3 LYS 716 HD3 LYS 716 -3.945 8.154 6.020 436 HE2 LYS 716 HE2 LYS 716 -1.879 9.804 5.308 437 HE3 LYS 716 HE3 LYS 716 -3.004 10.076 3.978 438 HZ1 LYS 716 HZ1 LYS 716 -3.188 10.898 6.720 439 HZ2 LYS 716 HZ2 LYS 716 -4.032 11.466 5.361 440 HZ3 LYS 716 HZ3 LYS 716 -4.614 10.094 6.198 441 H HIS 717 H HIS 717 1.228 5.624 5.759 442 HA HIS 717 HA HIS 717 1.091 3.340 3.888 443 HB2 HIS 717 HB2 HIS 717 2.704 3.353 6.431 444 HB3 HIS 717 HB3 HIS 717 2.924 2.360 4.994 445 HD1 HIS 717 HD1 HIS 717 4.250 3.354 3.022 446 HD2 HIS 717 HD2 HIS 717 3.760 6.020 6.216 447 HE1 HIS 717 HE1 HIS 717 5.944 5.234 2.700 448 HE2 HIS 717 HE2 HIS 717 5.589 6.919 4.596 449 H ILE 718 H ILE 718 -0.772 2.228 4.229 450 HA ILE 718 HA ILE 718 -1.582 1.680 7.040 451 HB ILE 718 HB ILE 718 -3.136 2.059 4.514 452 HG12 ILE 718 HG12 ILE 718 -2.940 3.785 6.360 453 HG13 ILE 718 HG13 ILE 718 -4.581 3.337 5.924 454 HG21 ILE 718 HG21 ILE 718 -3.990 0.275 6.812 455 HG22 ILE 718 HG22 ILE 718 -5.074 0.877 5.559 456 HG23 ILE 718 HG23 ILE 718 -3.760 -0.219 5.135 457 HD11 ILE 718 HD11 ILE 718 -4.733 1.844 7.838 458 HD12 ILE 718 HD12 ILE 718 -3.044 2.144 8.245 459 HD13 ILE 718 HD13 ILE 718 -4.226 3.440 8.384 460 H LYS 719 H LYS 719 -1.586 -0.399 7.728 461 HA LYS 719 HA LYS 719 -0.220 -2.357 6.140 462 HB2 LYS 719 HB2 LYS 719 -0.604 -3.835 8.117 463 HB3 LYS 719 HB3 LYS 719 0.162 -2.301 8.525 464 HG2 LYS 719 HG2 LYS 719 -1.509 -1.845 9.958 465 HG3 LYS 719 HG3 LYS 719 -2.661 -1.892 8.626 466 HD2 LYS 719 HD2 LYS 719 -1.685 -4.454 9.883 467 HD3 LYS 719 HD3 LYS 719 -2.989 -3.538 10.635 468 HE2 LYS 719 HE2 LYS 719 -2.945 -4.774 7.873 469 HE3 LYS 719 HE3 LYS 719 -4.051 -5.129 9.200 470 HZ1 LYS 719 HZ1 LYS 719 -4.029 -2.865 7.331 471 HZ2 LYS 719 HZ2 LYS 719 -5.348 -3.696 8.024 472 HZ3 LYS 719 HZ3 LYS 719 -4.504 -2.545 8.940 473 H ILE 720 H ILE 720 -0.979 -4.393 5.488 474 HA ILE 720 HA ILE 720 -3.875 -4.420 4.911 475 HB ILE 720 HB ILE 720 -1.541 -5.766 3.558 476 HG12 ILE 720 HG12 ILE 720 -3.505 -3.676 2.593 477 HG13 ILE 720 HG13 ILE 720 -1.857 -3.340 3.117 478 HG21 ILE 720 HG21 ILE 720 -3.056 -6.825 2.081 479 HG22 ILE 720 HG22 ILE 720 -3.786 -7.076 3.663 480 HG23 ILE 720 HG23 ILE 720 -4.402 -5.814 2.597 481 HD11 ILE 720 HD11 ILE 720 -0.954 -4.729 1.342 482 HD12 ILE 720 HD12 ILE 720 -2.576 -5.239 0.873 483 HD13 ILE 720 HD13 ILE 720 -2.075 -3.567 0.633 484 H MET 721 H MET 721 -5.136 -6.037 5.552 485 HA MET 721 HA MET 721 -3.928 -8.147 7.244 486 HB2 MET 721 HB2 MET 721 -6.001 -6.433 7.791 487 HB3 MET 721 HB3 MET 721 -6.859 -7.843 7.185 488 HG2 MET 721 HG2 MET 721 -5.633 -9.274 8.799 489 HG3 MET 721 HG3 MET 721 -4.827 -7.837 9.435 490 HE1 MET 721 HE1 MET 721 -7.393 -9.533 11.773 491 HE2 MET 721 HE2 MET 721 -5.738 -9.472 11.173 492 HE3 MET 721 HE3 MET 721 -6.332 -8.219 12.273 493 H THR 722 H THR 722 -5.400 -10.228 7.139 494 HA THR 722 HA THR 722 -6.329 -10.739 4.411 495 HB THR 722 HB THR 722 -3.938 -11.332 4.383 496 HG1 THR 722 HG1 THR 722 -5.418 -12.511 3.141 497 HG21 THR 722 HG21 THR 722 -3.748 -13.666 5.823 498 HG22 THR 722 HG22 THR 722 -3.126 -12.104 6.355 499 HG23 THR 722 HG23 THR 722 -4.711 -12.654 6.899 500 H ALA 723 H ALA 723 -7.042 -13.045 4.230 501 HA ALA 723 HA ALA 723 -8.002 -14.457 6.472 502 HB1 ALA 723 HB1 ALA 723 -10.486 -13.976 5.943 503 HB2 ALA 723 HB2 ALA 723 -9.894 -12.519 5.145 504 HB3 ALA 723 HB3 ALA 723 -9.605 -12.760 6.868 505 H GLU 724 H GLU 724 -8.344 -16.501 5.760 506 HA GLU 724 HA GLU 724 -8.309 -18.247 4.248 507 HB2 GLU 724 HB2 GLU 724 -10.437 -16.793 2.720 508 HB3 GLU 724 HB3 GLU 724 -10.336 -18.501 3.147 509 HG2 GLU 724 HG2 GLU 724 -11.051 -16.172 4.933 510 HG3 GLU 724 HG3 GLU 724 -12.007 -17.607 4.585 511 H GLY 725 H GLY 725 -6.635 -15.824 3.583 512 HA2 GLY 725 HA2 GLY 725 -4.973 -15.747 1.882 513 HA3 GLY 725 HA3 GLY 725 -6.082 -16.565 0.791 514 H LEU 726 H LEU 726 -7.772 -14.154 2.417 515 HA LEU 726 HA LEU 726 -7.827 -12.495 0.026 516 HB2 LEU 726 HB2 LEU 726 -9.291 -12.314 2.668 517 HB3 LEU 726 HB3 LEU 726 -9.537 -11.194 1.329 518 HG LEU 726 HG LEU 726 -9.681 -14.060 0.606 519 HD11 LEU 726 HD11 LEU 726 -12.183 -13.916 1.456 520 HD12 LEU 726 HD12 LEU 726 -10.905 -14.457 2.542 521 HD13 LEU 726 HD13 LEU 726 -11.495 -12.799 2.632 522 HD21 LEU 726 HD21 LEU 726 -10.613 -11.501 -0.327 523 HD22 LEU 726 HD22 LEU 726 -10.666 -13.056 -1.155 524 HD23 LEU 726 HD23 LEU 726 -11.996 -12.570 -0.104 525 H TYR 727 H TYR 727 -7.846 -10.046 0.383 526 HA TYR 727 HA TYR 727 -5.694 -9.233 2.263 527 HB2 TYR 727 HB2 TYR 727 -5.987 -8.346 -0.618 528 HB3 TYR 727 HB3 TYR 727 -4.758 -7.788 0.517 529 HD1 TYR 727 HD2 TYR 727 -6.064 -10.786 -1.262 530 HD2 TYR 727 HD1 TYR 727 -2.812 -9.084 0.970 531 HE1 TYR 727 HE2 TYR 727 -4.651 -12.747 -1.821 532 HE2 TYR 727 HE1 TYR 727 -1.399 -11.042 0.403 533 HH TYR 727 HH TYR 727 -2.734 -13.869 -1.153 534 H ARG 728 H ARG 728 -5.981 -7.282 3.289 535 HA ARG 728 HA ARG 728 -7.866 -5.339 2.267 536 HB2 ARG 728 HB2 ARG 728 -9.038 -5.318 4.586 537 HB3 ARG 728 HB3 ARG 728 -9.552 -6.462 3.356 538 HG2 ARG 728 HG2 ARG 728 -8.869 -8.254 4.580 539 HG3 ARG 728 HG3 ARG 728 -7.355 -7.471 5.025 540 HD2 ARG 728 HD2 ARG 728 -8.322 -6.361 6.861 541 HD3 ARG 728 HD3 ARG 728 -9.957 -6.574 6.251 542 HE ARG 728 HE ARG 728 -8.399 -8.526 7.748 543 HH11 ARG 728 HH21 ARG 728 -11.075 -7.925 5.630 544 HH12 ARG 728 HH22 ARG 728 -11.928 -9.356 6.129 545 HH21 ARG 728 HH11 ARG 728 -9.509 -10.366 8.361 546 HH22 ARG 728 HH12 ARG 728 -11.051 -10.719 7.668 547 H ILE 729 H ILE 729 -7.330 -3.356 2.820 548 HA ILE 729 HA ILE 729 -5.010 -2.895 4.462 549 HB ILE 729 HB ILE 729 -6.006 -0.411 4.041 550 HG12 ILE 729 HG12 ILE 729 -7.993 -1.577 2.878 551 HG13 ILE 729 HG13 ILE 729 -7.228 -0.239 2.029 552 HG21 ILE 729 HG21 ILE 729 -4.503 -2.067 1.990 553 HG22 ILE 729 HG22 ILE 729 -4.519 -0.311 2.092 554 HG23 ILE 729 HG23 ILE 729 -3.779 -1.260 3.377 555 HD11 ILE 729 HD11 ILE 729 -7.682 -2.775 1.003 556 HD12 ILE 729 HD12 ILE 729 -6.592 -1.569 0.325 557 HD13 ILE 729 HD13 ILE 729 -5.971 -2.809 1.413 558 H THR 730 H THR 730 -8.479 -2.692 4.765 559 HA THR 730 HA THR 730 -8.142 -1.762 7.549 560 HB THR 730 HB THR 730 -9.470 -0.227 6.081 561 HG1 THR 730 HG1 THR 730 -10.081 -1.235 8.494 562 HG21 THR 730 HG21 THR 730 -11.697 -0.924 5.374 563 HG22 THR 730 HG22 THR 730 -10.489 -2.003 4.679 564 HG23 THR 730 HG23 THR 730 -11.442 -2.522 6.066 565 H GLU 731 H GLU 731 -9.241 -2.785 9.125 566 HA GLU 731 HA GLU 731 -9.475 -5.566 8.988 567 HB2 GLU 731 HB2 GLU 731 -10.583 -5.239 11.229 568 HB3 GLU 731 HB3 GLU 731 -9.051 -4.368 11.055 569 HG2 GLU 731 HG2 GLU 731 -11.551 -2.961 10.226 570 HG3 GLU 731 HG3 GLU 731 -11.247 -3.132 11.942 571 H LYS 732 H LYS 732 -11.586 -3.231 7.768 572 HA LYS 732 HA LYS 732 -13.972 -4.859 8.200 573 HB2 LYS 732 HB2 LYS 732 -13.935 -2.184 6.858 574 HB3 LYS 732 HB3 LYS 732 -15.249 -2.967 7.747 575 HG2 LYS 732 HG2 LYS 732 -14.000 -2.776 9.831 576 HG3 LYS 732 HG3 LYS 732 -12.623 -2.104 8.968 577 HD2 LYS 732 HD2 LYS 732 -14.598 -0.415 8.150 578 HD3 LYS 732 HD3 LYS 732 -15.130 -0.795 9.789 579 HE2 LYS 732 HE2 LYS 732 -12.249 -0.362 9.620 580 HE3 LYS 732 HE3 LYS 732 -13.176 1.055 9.119 581 HZ1 LYS 732 HZ1 LYS 732 -14.555 0.318 11.299 582 HZ2 LYS 732 HZ2 LYS 732 -12.966 -0.213 11.727 583 HZ3 LYS 732 HZ3 LYS 732 -13.228 1.437 11.325 584 H LYS 733 H LYS 733 -11.633 -4.525 5.773 585 HA LYS 733 HA LYS 733 -13.600 -5.301 3.684 586 HB2 LYS 733 HB2 LYS 733 -11.808 -3.186 3.657 587 HB3 LYS 733 HB3 LYS 733 -11.013 -4.418 2.680 588 HG2 LYS 733 HG2 LYS 733 -12.368 -3.248 1.130 589 HG3 LYS 733 HG3 LYS 733 -13.309 -4.690 1.506 590 HD2 LYS 733 HD2 LYS 733 -14.782 -2.752 1.579 591 HD3 LYS 733 HD3 LYS 733 -14.566 -3.356 3.225 592 HE2 LYS 733 HE2 LYS 733 -13.127 -1.591 3.814 593 HE3 LYS 733 HE3 LYS 733 -12.760 -1.216 2.133 594 HZ1 LYS 733 HZ1 LYS 733 -14.302 0.362 3.286 595 HZ2 LYS 733 HZ2 LYS 733 -14.868 -0.273 1.788 596 HZ3 LYS 733 HZ3 LYS 733 -15.471 -0.891 3.271 597 H ALA 734 H ALA 734 -12.194 -6.318 1.759 598 HA ALA 734 HA ALA 734 -10.074 -8.062 2.364 599 HB1 ALA 734 HB1 ALA 734 -11.755 -10.165 2.069 600 HB2 ALA 734 HB2 ALA 734 -12.786 -9.070 2.989 601 HB3 ALA 734 HB3 ALA 734 -11.221 -9.560 3.638 602 H PHE 735 H PHE 735 -9.156 -8.529 0.467 603 HA PHE 735 HA PHE 735 -10.874 -8.710 -1.948 604 HB2 PHE 735 HB2 PHE 735 -8.257 -7.285 -1.516 605 HB3 PHE 735 HB3 PHE 735 -8.696 -7.867 -3.128 606 HD1 PHE 735 HD2 PHE 735 -10.071 -5.889 -0.249 607 HD2 PHE 735 HD1 PHE 735 -10.075 -6.558 -4.489 608 HE1 PHE 735 HE2 PHE 735 -11.545 -3.914 -0.562 609 HE2 PHE 735 HE1 PHE 735 -11.537 -4.586 -4.809 610 HZ PHE 735 HZ PHE 735 -12.282 -3.270 -2.839 611 H ARG 736 H ARG 736 -9.998 -10.068 -3.665 612 HA ARG 736 HA ARG 736 -8.991 -12.552 -2.682 613 HB2 ARG 736 HB2 ARG 736 -9.157 -11.578 -5.529 614 HB3 ARG 736 HB3 ARG 736 -9.011 -13.250 -4.999 615 HG2 ARG 736 HG2 ARG 736 -11.192 -12.989 -3.773 616 HG3 ARG 736 HG3 ARG 736 -11.356 -11.390 -4.513 617 HD2 ARG 736 HD2 ARG 736 -11.335 -14.084 -5.840 618 HD3 ARG 736 HD3 ARG 736 -12.523 -12.790 -6.007 619 HE ARG 736 HE ARG 736 -10.433 -11.532 -7.045 620 HH11 ARG 736 HH21 ARG 736 -11.448 -14.826 -7.489 621 HH12 ARG 736 HH22 ARG 736 -10.561 -15.033 -8.955 622 HH21 ARG 736 HH11 ARG 736 -9.253 -11.814 -8.908 623 HH22 ARG 736 HH12 ARG 736 -9.341 -13.332 -9.770 624 H GLY 737 H GLY 737 -7.548 -9.699 -4.019 625 HA2 GLY 737 HA2 GLY 737 -4.889 -10.570 -3.384 626 HA3 GLY 737 HA3 GLY 737 -5.183 -10.541 -5.119 627 H LEU 738 H LEU 738 -3.376 -8.896 -3.525 628 HA LEU 738 HA LEU 738 -4.128 -6.339 -2.930 629 HB2 LEU 738 HB2 LEU 738 -1.684 -7.648 -3.861 630 HB3 LEU 738 HB3 LEU 738 -1.780 -5.969 -4.378 631 HG LEU 738 HG LEU 738 -0.675 -6.073 -2.218 632 HD11 LEU 738 HD11 LEU 738 -2.704 -4.406 -2.834 633 HD12 LEU 738 HD12 LEU 738 -3.359 -5.130 -1.367 634 HD13 LEU 738 HD13 LEU 738 -1.804 -4.299 -1.327 635 HD21 LEU 738 HD21 LEU 738 -2.883 -6.921 -0.564 636 HD22 LEU 738 HD22 LEU 738 -2.512 -8.175 -1.745 637 HD23 LEU 738 HD23 LEU 738 -1.253 -7.588 -0.661 638 H THR 739 H THR 739 -3.338 -7.593 -6.146 639 HA THR 739 HA THR 739 -3.637 -5.303 -7.667 640 HB THR 739 HB THR 739 -4.601 -7.983 -8.633 641 HG1 THR 739 HG1 THR 739 -1.896 -7.264 -8.633 642 HG21 THR 739 HG21 THR 739 -3.219 -7.174 -10.635 643 HG22 THR 739 HG22 THR 739 -4.717 -6.302 -10.312 644 HG23 THR 739 HG23 THR 739 -3.169 -5.606 -9.831 645 H GLU 740 H GLU 740 -6.199 -7.533 -6.577 646 HA GLU 740 HA GLU 740 -8.229 -6.140 -8.060 647 HB2 GLU 740 HB2 GLU 740 -8.999 -7.723 -5.660 648 HB3 GLU 740 HB3 GLU 740 -9.695 -7.732 -7.274 649 HG2 GLU 740 HG2 GLU 740 -7.202 -8.780 -7.731 650 HG3 GLU 740 HG3 GLU 740 -7.548 -9.397 -6.129 651 H LEU 741 H LEU 741 -6.649 -5.731 -5.056 652 HA LEU 741 HA LEU 741 -8.740 -4.095 -3.870 653 HB2 LEU 741 HB2 LEU 741 -7.484 -5.515 -2.392 654 HB3 LEU 741 HB3 LEU 741 -5.955 -4.927 -3.025 655 HG LEU 741 HG LEU 741 -6.774 -4.017 -0.748 656 HD11 LEU 741 HD11 LEU 741 -6.245 -1.683 -2.478 657 HD12 LEU 741 HD12 LEU 741 -5.333 -2.299 -1.100 658 HD13 LEU 741 HD13 LEU 741 -5.120 -3.027 -2.692 659 HD21 LEU 741 HD21 LEU 741 -9.074 -3.479 -2.047 660 HD22 LEU 741 HD22 LEU 741 -8.525 -2.521 -0.681 661 HD23 LEU 741 HD23 LEU 741 -8.243 -1.952 -2.321 662 H VAL 742 H VAL 742 -5.445 -3.742 -5.033 663 HA VAL 742 HA VAL 742 -5.222 -0.928 -4.772 664 HB VAL 742 HB VAL 742 -3.846 -2.919 -6.585 665 HG11 VAL 742 HG11 VAL 742 -2.039 -1.121 -6.588 666 HG12 VAL 742 HG12 VAL 742 -3.475 -0.787 -7.556 667 HG13 VAL 742 HG13 VAL 742 -3.271 -0.018 -5.979 668 HG21 VAL 742 HG21 VAL 742 -3.573 -3.393 -4.213 669 HG22 VAL 742 HG22 VAL 742 -2.059 -2.770 -4.874 670 HG23 VAL 742 HG23 VAL 742 -3.095 -1.720 -3.906 671 H GLU 743 H GLU 743 -5.608 -2.905 -7.665 672 HA GLU 743 HA GLU 743 -5.988 -0.780 -9.445 673 HB2 GLU 743 HB2 GLU 743 -6.999 -3.604 -9.767 674 HB3 GLU 743 HB3 GLU 743 -6.563 -2.468 -11.048 675 HG2 GLU 743 HG2 GLU 743 -4.541 -3.272 -8.950 676 HG3 GLU 743 HG3 GLU 743 -4.819 -4.279 -10.348 677 H PHE 744 H PHE 744 -8.199 -2.340 -7.291 678 HA PHE 744 HA PHE 744 -10.603 -1.453 -8.651 679 HB2 PHE 744 HB2 PHE 744 -10.692 -3.473 -7.347 680 HB3 PHE 744 HB3 PHE 744 -10.080 -2.645 -5.921 681 HD1 PHE 744 HD2 PHE 744 -12.895 -2.349 -8.402 682 HD2 PHE 744 HD1 PHE 744 -11.606 -1.970 -4.326 683 HE1 PHE 744 HE2 PHE 744 -15.217 -1.805 -7.717 684 HE2 PHE 744 HE1 PHE 744 -13.928 -1.427 -3.632 685 HZ PHE 744 HZ PHE 744 -15.734 -1.342 -5.335 686 H TYR 745 H TYR 745 -8.457 -0.275 -6.161 687 HA TYR 745 HA TYR 745 -10.281 1.781 -5.261 688 HB2 TYR 745 HB2 TYR 745 -7.417 1.089 -4.657 689 HB3 TYR 745 HB3 TYR 745 -8.151 2.580 -4.068 690 HD1 TYR 745 HD1 TYR 745 -10.691 0.140 -4.409 691 HD2 TYR 745 HD2 TYR 745 -7.448 1.304 -1.842 692 HE1 TYR 745 HE1 TYR 745 -11.744 -1.072 -2.528 693 HE2 TYR 745 HE2 TYR 745 -8.509 0.077 0.035 694 HH TYR 745 HH TYR 745 -11.659 -0.806 0.073 695 H GLN 746 H GLN 746 -8.159 1.427 -7.892 696 HA GLN 746 HA GLN 746 -7.192 4.039 -8.255 697 HB2 GLN 746 HB2 GLN 746 -8.097 1.960 -10.266 698 HB3 GLN 746 HB3 GLN 746 -7.349 3.490 -10.732 699 HG2 GLN 746 HG2 GLN 746 -5.318 2.950 -9.554 700 HG3 GLN 746 HG3 GLN 746 -6.063 1.547 -8.791 701 HE21 GLN 746 HE21 GLN 746 -7.246 0.188 -10.878 702 HE22 GLN 746 HE22 GLN 746 -6.076 -0.232 -12.040 703 H GLN 747 H GLN 747 -10.324 2.596 -8.866 704 HA GLN 747 HA GLN 747 -11.432 5.168 -9.758 705 HB2 GLN 747 HB2 GLN 747 -13.421 3.703 -10.343 706 HB3 GLN 747 HB3 GLN 747 -11.942 3.391 -11.249 707 HG2 GLN 747 HG2 GLN 747 -11.448 1.437 -10.015 708 HG3 GLN 747 HG3 GLN 747 -12.581 1.860 -8.736 709 HE21 GLN 747 HE21 GLN 747 -14.899 2.465 -10.215 710 HE22 GLN 747 HE22 GLN 747 -15.406 1.072 -11.042 711 H ASN 748 H ASN 748 -11.423 2.914 -7.121 712 HA ASN 748 HA ASN 748 -13.695 4.292 -5.818 713 HB2 ASN 748 HB2 ASN 748 -12.327 1.684 -5.091 714 HB3 ASN 748 HB3 ASN 748 -13.714 2.383 -4.260 715 HD21 ASN 748 HD21 ASN 748 -12.678 0.697 -7.171 716 HD22 ASN 748 HD22 ASN 748 -14.246 0.418 -7.769 717 H SER 749 H SER 749 -13.205 5.832 -4.396 718 HA SER 749 HA SER 749 -10.710 6.630 -3.600 719 HB2 SER 749 HB2 SER 749 -13.171 7.574 -3.209 720 HB3 SER 749 HB3 SER 749 -12.899 6.885 -1.618 721 HG SER 749 HG SER 749 -10.679 8.146 -2.316 722 H LEU 750 H LEU 750 -9.255 6.079 -2.060 723 HA LEU 750 HA LEU 750 -9.249 3.467 -0.999 724 HB2 LEU 750 HB2 LEU 750 -7.651 5.926 -0.333 725 HB3 LEU 750 HB3 LEU 750 -7.373 4.382 0.470 726 HG LEU 750 HG LEU 750 -7.562 3.915 -2.352 727 HD11 LEU 750 HD11 LEU 750 -6.063 6.330 -1.494 728 HD12 LEU 750 HD12 LEU 750 -5.272 5.274 -2.662 729 HD13 LEU 750 HD13 LEU 750 -6.846 5.978 -3.030 730 HD21 LEU 750 HD21 LEU 750 -6.352 2.594 -0.580 731 HD22 LEU 750 HD22 LEU 750 -5.372 2.938 -2.003 732 HD23 LEU 750 HD23 LEU 750 -5.140 3.875 -0.528 733 H LYS 751 H LYS 751 -10.422 6.480 0.324 734 HA LYS 751 HA LYS 751 -10.510 5.918 3.019 735 HB2 LYS 751 HB2 LYS 751 -12.477 7.394 3.151 736 HB3 LYS 751 HB3 LYS 751 -11.181 8.067 2.175 737 HG2 LYS 751 HG2 LYS 751 -12.553 6.843 0.223 738 HG3 LYS 751 HG3 LYS 751 -13.886 7.156 1.345 739 HD2 LYS 751 HD2 LYS 751 -13.184 9.518 1.513 740 HD3 LYS 751 HD3 LYS 751 -11.873 9.198 0.389 741 HE2 LYS 751 HE2 LYS 751 -14.144 8.294 -0.946 742 HE3 LYS 751 HE3 LYS 751 -14.647 9.801 -0.167 743 HZ1 LYS 751 HZ1 LYS 751 -12.466 10.763 -0.981 744 HZ2 LYS 751 HZ2 LYS 751 -12.335 9.352 -1.984 745 HZ3 LYS 751 HZ3 LYS 751 -13.648 10.439 -2.191 746 H ASP 752 H ASP 752 -12.104 4.301 0.479 747 HA ASP 752 HA ASP 752 -14.400 3.269 1.778 748 HB2 ASP 752 HB2 ASP 752 -14.391 2.586 -0.424 749 HB3 ASP 752 HB3 ASP 752 -12.644 2.379 -0.463 750 H CYS 753 H CYS 753 -11.019 2.384 1.825 751 HA CYS 753 HA CYS 753 -11.490 0.454 4.023 752 HB2 CYS 753 HB2 CYS 753 -9.566 0.553 1.762 753 HB3 CYS 753 HB3 CYS 753 -8.959 -0.035 3.301 754 HG CYS 753 HG CYS 753 -10.753 -1.593 1.456 755 H PHE 754 H PHE 754 -9.208 2.843 2.746 756 HA PHE 754 HA PHE 754 -7.624 3.061 5.028 757 HB2 PHE 754 HB2 PHE 754 -8.199 4.870 2.719 758 HB3 PHE 754 HB3 PHE 754 -7.208 5.430 4.068 759 HD1 PHE 754 HD2 PHE 754 -7.580 2.437 1.838 760 HD2 PHE 754 HD1 PHE 754 -4.910 5.004 4.013 761 HE1 PHE 754 HE2 PHE 754 -5.642 1.177 0.949 762 HE2 PHE 754 HE1 PHE 754 -2.973 3.747 3.118 763 HZ PHE 754 HZ PHE 754 -3.341 1.834 1.589 764 H LYS 755 H LYS 755 -7.530 4.652 6.651 765 HA LYS 755 HA LYS 755 -10.150 5.349 7.657 766 HB2 LYS 755 HB2 LYS 755 -7.742 6.273 9.111 767 HB3 LYS 755 HB3 LYS 755 -9.171 5.429 9.704 768 HG2 LYS 755 HG2 LYS 755 -6.829 4.206 8.208 769 HG3 LYS 755 HG3 LYS 755 -7.266 3.927 9.884 770 HD2 LYS 755 HD2 LYS 755 -9.592 3.208 8.666 771 HD3 LYS 755 HD3 LYS 755 -8.429 2.779 7.410 772 HE2 LYS 755 HE2 LYS 755 -7.497 1.087 8.645 773 HE3 LYS 755 HE3 LYS 755 -7.701 1.955 10.167 774 HZ1 LYS 755 HZ1 LYS 755 -10.051 0.900 8.701 775 HZ2 LYS 755 HZ2 LYS 755 -9.182 -0.107 9.775 776 HZ3 LYS 755 HZ3 LYS 755 -9.934 1.329 10.368 777 H SER 756 H SER 756 -7.154 7.292 7.213 778 HA SER 756 HA SER 756 -8.828 9.697 7.030 779 HB2 SER 756 HB2 SER 756 -6.854 10.961 7.385 780 HB3 SER 756 HB3 SER 756 -6.714 9.571 8.458 781 HG SER 756 HG SER 756 -4.981 9.019 7.414 782 H LEU 757 H LEU 757 -6.747 7.698 5.094 783 HA LEU 757 HA LEU 757 -6.132 9.203 2.885 784 HB2 LEU 757 HB2 LEU 757 -5.821 6.645 3.528 785 HB3 LEU 757 HB3 LEU 757 -7.195 6.462 2.447 786 HG LEU 757 HG LEU 757 -5.290 6.201 1.083 787 HD11 LEU 757 HD11 LEU 757 -5.431 8.057 -0.439 788 HD12 LEU 757 HD12 LEU 757 -7.040 7.711 0.194 789 HD13 LEU 757 HD13 LEU 757 -6.121 9.081 0.815 790 HD21 LEU 757 HD21 LEU 757 -3.429 7.797 1.086 791 HD22 LEU 757 HD22 LEU 757 -4.227 8.729 2.349 792 HD23 LEU 757 HD23 LEU 757 -3.654 7.092 2.691 793 H ASP 758 H ASP 758 -7.561 10.612 1.895 794 HA ASP 758 HA ASP 758 -10.126 9.442 1.009 795 HB2 ASP 758 HB2 ASP 758 -10.264 11.375 2.673 796 HB3 ASP 758 HB3 ASP 758 -9.652 12.403 1.381 797 H THR 759 H THR 759 -8.711 8.647 -0.772 798 HA THR 759 HA THR 759 -9.135 10.295 -3.075 799 HB THR 759 HB THR 759 -7.008 11.307 -2.218 800 HG1 THR 759 HG1 THR 759 -6.076 11.243 -4.262 801 HG21 THR 759 HG21 THR 759 -5.092 9.504 -3.084 802 HG22 THR 759 HG22 THR 759 -5.484 9.849 -1.400 803 HG23 THR 759 HG23 THR 759 -6.234 8.479 -2.220 804 H THR 760 H THR 760 -7.343 9.115 -4.853 805 HA THR 760 HA THR 760 -8.023 6.231 -4.644 806 HB THR 760 HB THR 760 -8.401 6.239 -7.109 807 HG1 THR 760 HG1 THR 760 -8.790 8.351 -8.003 808 HG21 THR 760 HG21 THR 760 -10.305 6.342 -5.585 809 HG22 THR 760 HG22 THR 760 -10.146 8.096 -5.468 810 HG23 THR 760 HG23 THR 760 -10.616 7.353 -6.998 811 H LEU 761 H LEU 761 -6.753 4.905 -6.250 812 HA LEU 761 HA LEU 761 -3.956 5.364 -5.835 813 HB2 LEU 761 HB2 LEU 761 -5.490 3.320 -7.463 814 HB3 LEU 761 HB3 LEU 761 -3.735 3.329 -7.356 815 HG LEU 761 HG LEU 761 -4.828 1.764 -5.726 816 HD11 LEU 761 HD11 LEU 761 -2.882 2.147 -4.665 817 HD12 LEU 761 HD12 LEU 761 -2.879 3.839 -5.156 818 HD13 LEU 761 HD13 LEU 761 -3.729 3.350 -3.694 819 HD21 LEU 761 HD21 LEU 761 -6.806 3.300 -5.338 820 HD22 LEU 761 HD22 LEU 761 -6.090 2.616 -3.880 821 HD23 LEU 761 HD23 LEU 761 -5.747 4.283 -4.331 822 H GLN 762 H GLN 762 -3.471 7.348 -6.828 823 HA GLN 762 HA GLN 762 -4.176 8.033 -9.485 824 HB2 GLN 762 HB2 GLN 762 -2.206 9.033 -7.478 825 HB3 GLN 762 HB3 GLN 762 -2.021 9.551 -9.148 826 HG2 GLN 762 HG2 GLN 762 -4.759 9.829 -8.657 827 HG3 GLN 762 HG3 GLN 762 -3.998 10.374 -7.165 828 HE21 GLN 762 HE21 GLN 762 -2.527 12.253 -7.304 829 HE22 GLN 762 HE22 GLN 762 -2.567 13.271 -8.660 830 H PHE 763 H PHE 763 -0.908 7.199 -8.302 831 HA PHE 763 HA PHE 763 -0.452 5.488 -10.606 832 HB2 PHE 763 HB2 PHE 763 1.827 7.115 -10.688 833 HB3 PHE 763 HB3 PHE 763 0.540 7.042 -11.887 834 HD1 PHE 763 HD1 PHE 763 1.602 8.762 -8.747 835 HD2 PHE 763 HD2 PHE 763 -0.945 8.864 -12.205 836 HE1 PHE 763 HE1 PHE 763 0.960 11.092 -8.203 837 HE2 PHE 763 HE2 PHE 763 -1.587 11.197 -11.659 838 HZ PHE 763 HZ PHE 763 -0.635 12.311 -9.660 839 HA PRO 764 HA PRO 764 2.202 3.474 -7.749 840 HB2 PRO 764 HB2 PRO 764 3.940 2.208 -9.431 841 HB3 PRO 764 HB3 PRO 764 2.247 1.712 -9.232 842 HG2 PRO 764 HG2 PRO 764 3.525 3.260 -11.417 843 HG3 PRO 764 HG3 PRO 764 2.210 2.078 -11.485 844 HD2 PRO 764 HD2 PRO 764 1.846 4.824 -11.583 845 HD3 PRO 764 HD3 PRO 764 0.603 3.660 -11.089 846 H PHE 765 H PHE 765 4.233 3.539 -6.742 847 HA PHE 765 HA PHE 765 5.725 5.947 -7.091 848 HB2 PHE 765 HB2 PHE 765 6.867 5.316 -5.181 849 HB3 PHE 765 HB3 PHE 765 5.376 4.397 -4.991 850 HD1 PHE 765 HD1 PHE 765 5.365 1.975 -6.033 851 HD2 PHE 765 HD2 PHE 765 8.923 4.203 -5.124 852 HE1 PHE 765 HE1 PHE 765 6.668 -0.123 -6.005 853 HE2 PHE 765 HE2 PHE 765 10.231 2.094 -5.094 854 HZ PHE 765 HZ PHE 765 9.102 -0.069 -5.532 855 H LYS 766 H LYS 766 6.045 2.684 -8.266 856 HA LYS 766 HA LYS 766 8.758 2.705 -9.012 857 HB2 LYS 766 HB2 LYS 766 6.340 1.144 -9.677 858 HB3 LYS 766 HB3 LYS 766 7.713 0.995 -10.756 859 HG2 LYS 766 HG2 LYS 766 8.516 0.919 -7.958 860 HG3 LYS 766 HG3 LYS 766 7.381 -0.363 -8.359 861 HD2 LYS 766 HD2 LYS 766 9.686 -1.111 -8.765 862 HD3 LYS 766 HD3 LYS 766 8.801 -1.004 -10.288 863 HE2 LYS 766 HE2 LYS 766 10.387 1.361 -9.299 864 HE3 LYS 766 HE3 LYS 766 11.197 0.040 -10.136 865 HZ1 LYS 766 HZ1 LYS 766 10.623 1.193 -11.965 866 HZ2 LYS 766 HZ2 LYS 766 9.103 0.478 -11.753 867 HZ3 LYS 766 HZ3 LYS 766 9.379 2.065 -11.196 868 H GLU 767 H GLU 767 6.003 4.235 -10.383 869 HA GLU 767 HA GLU 767 6.891 4.343 -13.076 870 HB2 GLU 767 HB2 GLU 767 4.643 5.246 -11.560 871 HB3 GLU 767 HB3 GLU 767 5.283 6.626 -12.449 872 HG2 GLU 767 HG2 GLU 767 5.378 4.938 -14.458 873 HG3 GLU 767 HG3 GLU 767 4.204 4.031 -13.512 874 H1 ASP 338 H1 ASP 338 11.273 5.997 11.700 875 H2 ASP 338 H2 ASP 338 12.502 5.855 12.870 876 H3 ASP 338 H3 ASP 338 11.182 4.772 12.879 877 HA ASP 338 HA ASP 338 12.475 4.725 10.349 878 HB2 ASP 338 HB2 ASP 338 14.584 3.615 11.357 879 HB3 ASP 338 HB3 ASP 338 14.503 5.378 11.401 880 H THR 339 H THR 339 13.460 2.615 12.910 881 HA THR 339 HA THR 339 12.739 0.208 11.880 882 HB THR 339 HB THR 339 12.457 -0.429 14.434 883 HG1 THR 339 HG1 THR 339 13.639 2.169 14.493 884 HG21 THR 339 HG21 THR 339 14.626 -1.044 14.244 885 HG22 THR 339 HG22 THR 339 14.567 -0.303 12.646 886 HG23 THR 339 HG23 THR 339 15.162 0.620 14.025 887 H GLU 340 H GLU 340 10.545 2.402 13.596 888 HA GLU 340 HA GLU 340 8.472 0.546 14.060 889 HB2 GLU 340 HB2 GLU 340 7.121 2.381 14.600 890 HB3 GLU 340 HB3 GLU 340 8.747 2.962 14.949 891 HG2 GLU 340 HG2 GLU 340 7.398 3.433 12.277 892 HG3 GLU 340 HG3 GLU 340 7.241 4.552 13.623 893 H VAL 341 H VAL 341 9.578 2.009 11.157 894 HA VAL 341 HA VAL 341 8.690 2.167 9.025 895 HB VAL 341 HB VAL 341 8.053 -0.028 8.123 896 HG11 VAL 341 HG11 VAL 341 10.302 -0.074 10.153 897 HG12 VAL 341 HG12 VAL 341 10.096 -1.264 8.870 898 HG13 VAL 341 HG13 VAL 341 10.422 0.422 8.466 899 HG21 VAL 341 HG21 VAL 341 6.704 -0.632 10.246 900 HG22 VAL 341 HG22 VAL 341 7.642 -1.923 9.501 901 HG23 VAL 341 HG23 VAL 341 8.252 -1.109 10.939 902 H TYR 342 H TYR 342 6.362 0.556 8.071 903 HA TYR 342 HA TYR 342 4.368 2.537 8.524 904 HB2 TYR 342 HB2 TYR 342 2.861 0.892 7.295 905 HB3 TYR 342 HB3 TYR 342 4.266 1.479 6.419 906 HD1 TYR 342 HD2 TYR 342 5.028 -0.917 9.055 907 HD2 TYR 342 HD1 TYR 342 3.853 -0.533 4.931 908 HE1 TYR 342 HE2 TYR 342 5.748 -3.247 8.627 909 HE2 TYR 342 HE1 TYR 342 4.569 -2.857 4.522 910 HH TYR 342 HH TYR 342 4.852 -5.056 6.086 911 H GLU 343 H GLU 343 4.581 2.337 10.910 912 HA GLU 343 HA GLU 343 3.813 0.302 12.543 913 HB2 GLU 343 HB2 GLU 343 2.436 2.558 13.564 914 HB3 GLU 343 HB3 GLU 343 4.023 1.962 14.032 915 HG2 GLU 343 HG2 GLU 343 4.185 4.312 13.371 916 HG3 GLU 343 HG3 GLU 343 5.052 3.313 12.215 917 H SER 344 H SER 344 1.409 2.782 11.708 918 HA SER 344 HA SER 344 -0.567 1.329 10.496 919 HB2 SER 344 HB2 SER 344 -0.978 -0.321 12.026 920 HB3 SER 344 HB3 SER 344 -0.346 0.622 13.371 921 HG SER 344 HG SER 344 -2.324 1.977 12.990 922 HA PRO 345 HA PRO 345 -1.079 5.958 11.063 923 HB2 PRO 345 HB2 PRO 345 -2.970 4.925 8.932 924 HB3 PRO 345 HB3 PRO 345 -2.120 6.484 8.992 925 HG2 PRO 345 HG2 PRO 345 -1.194 4.442 7.558 926 HG3 PRO 345 HG3 PRO 345 -0.108 5.557 8.402 927 HD2 PRO 345 HD2 PRO 345 -0.637 2.718 8.978 928 HD3 PRO 345 HD3 PRO 345 0.686 3.753 9.560 929 H PTR 346 H PTR 346 -3.679 3.514 10.707 930 HA PTR 346 HA PTR 346 -4.846 4.123 13.225 931 HB2 PTR 346 HB2 PTR 346 -6.291 5.767 12.768 932 HB3 PTR 346 HB3 PTR 346 -7.022 4.804 11.493 933 HD1 PTR 346 HD1 PTR 346 -5.382 4.629 9.308 934 HD2 PTR 346 HD2 PTR 346 -5.481 7.844 12.137 935 HE1 PTR 346 HE1 PTR 346 -4.366 6.123 7.609 936 HE2 PTR 346 HE2 PTR 346 -4.462 9.353 10.459 937 H ALA 347 H ALA 347 -6.599 2.812 13.768 938 HA ALA 347 HA ALA 347 -7.498 0.720 11.885 939 HB1 ALA 347 HB1 ALA 347 -6.532 0.039 14.670 940 HB2 ALA 347 HB2 ALA 347 -5.477 -0.077 13.263 941 HB3 ALA 347 HB3 ALA 347 -6.936 -1.064 13.356 942 H ASP 348 H ASP 348 -9.460 -0.339 12.671 943 HA ASP 348 HA ASP 348 -10.782 0.532 15.035 944 HB2 ASP 348 HB2 ASP 348 -12.568 1.895 13.861 945 HB3 ASP 348 HB3 ASP 348 -10.999 2.672 14.017 946 HA PRO 349 HA PRO 349 -12.773 -3.217 13.564 947 HB2 PRO 349 HB2 PRO 349 -14.244 -3.685 15.828 948 HB3 PRO 349 HB3 PRO 349 -12.518 -4.069 15.690 949 HG2 PRO 349 HG2 PRO 349 -13.838 -1.730 16.979 950 HG3 PRO 349 HG3 PRO 349 -12.445 -2.680 17.524 951 HD2 PRO 349 HD2 PRO 349 -12.185 -0.241 16.321 952 HD3 PRO 349 HD3 PRO 349 -10.955 -1.518 16.180 953 H GLU 350 H GLU 350 -14.264 -2.824 12.017 954 HA GLU 350 HA GLU 350 -16.206 -2.221 10.964 955 HB2 GLU 350 HB2 GLU 350 -17.125 -2.945 13.734 956 HB3 GLU 350 HB3 GLU 350 -18.278 -2.398 12.518 957 HG2 GLU 350 HG2 GLU 350 -17.832 -4.954 12.708 958 HG3 GLU 350 HG3 GLU 350 -17.846 -4.237 11.101 Start of MODEL 20 1 H1 GLY 661 H1 GLY 661 8.891 -13.499 -8.799 2 H2 GLY 661 H2 GLY 661 10.390 -13.835 -8.069 3 H3 GLY 661 H3 GLY 661 8.941 -14.105 -7.206 4 HA2 GLY 661 HA2 GLY 661 9.629 -15.528 -9.723 5 HA3 GLY 661 HA3 GLY 661 10.021 -16.154 -8.121 6 H HIS 662 H HIS 662 8.619 -17.948 -8.476 7 HA HIS 662 HA HIS 662 5.863 -17.718 -9.127 8 HB2 HIS 662 HB2 HIS 662 7.305 -19.797 -9.285 9 HB3 HIS 662 HB3 HIS 662 7.163 -19.934 -7.535 10 HD1 HIS 662 HD1 HIS 662 4.112 -18.916 -7.472 11 HD2 HIS 662 HD2 HIS 662 5.645 -22.037 -9.793 12 HE1 HIS 662 HE1 HIS 662 2.161 -20.472 -7.991 13 HE2 HIS 662 HE2 HIS 662 3.086 -22.374 -9.398 14 H MET 663 H MET 663 7.615 -17.288 -6.174 15 HA MET 663 HA MET 663 5.573 -17.831 -4.299 16 HB2 MET 663 HB2 MET 663 8.179 -17.314 -4.048 17 HB3 MET 663 HB3 MET 663 7.574 -15.684 -3.747 18 HG2 MET 663 HG2 MET 663 6.262 -16.406 -1.898 19 HG3 MET 663 HG3 MET 663 6.459 -18.105 -2.332 20 HE1 MET 663 HE1 MET 663 6.873 -18.764 -0.321 21 HE2 MET 663 HE2 MET 663 8.402 -19.547 -0.715 22 HE3 MET 663 HE3 MET 663 8.272 -18.510 0.717 23 H GLN 664 H GLN 664 4.231 -16.549 -6.281 24 HA GLN 664 HA GLN 664 2.971 -14.681 -6.847 25 HB2 GLN 664 HB2 GLN 664 2.055 -15.894 -4.632 26 HB3 GLN 664 HB3 GLN 664 2.356 -14.289 -3.963 27 HG2 GLN 664 HG2 GLN 664 0.173 -14.059 -4.764 28 HG3 GLN 664 HG3 GLN 664 1.112 -13.459 -6.128 29 HE21 GLN 664 HE21 GLN 664 -1.490 -15.348 -5.537 30 HE22 GLN 664 HE22 GLN 664 -1.346 -16.463 -6.805 31 H ASP 665 H ASP 665 5.483 -13.813 -6.884 32 HA ASP 665 HA ASP 665 6.042 -11.684 -5.078 33 HB2 ASP 665 HB2 ASP 665 7.163 -12.556 -7.718 34 HB3 ASP 665 HB3 ASP 665 7.668 -11.036 -6.984 35 H LEU 666 H LEU 666 4.361 -10.302 -4.955 36 HA LEU 666 HA LEU 666 2.859 -9.242 -7.071 37 HB2 LEU 666 HB2 LEU 666 3.511 -7.923 -4.430 38 HB3 LEU 666 HB3 LEU 666 2.142 -7.552 -5.472 39 HG LEU 666 HG LEU 666 2.638 -10.249 -4.167 40 HD11 LEU 666 HD11 LEU 666 1.536 -7.813 -3.125 41 HD12 LEU 666 HD12 LEU 666 0.244 -9.000 -3.278 42 HD13 LEU 666 HD13 LEU 666 1.682 -9.379 -2.330 43 HD21 LEU 666 HD21 LEU 666 1.374 -10.380 -6.287 44 HD22 LEU 666 HD22 LEU 666 0.323 -10.717 -4.914 45 HD23 LEU 666 HD23 LEU 666 0.262 -9.142 -5.704 46 H SER 667 H SER 667 6.090 -8.615 -6.149 47 HA SER 667 HA SER 667 6.528 -5.961 -6.746 48 HB2 SER 667 HB2 SER 667 8.294 -7.494 -5.962 49 HB3 SER 667 HB3 SER 667 8.313 -8.265 -7.546 50 HG SER 667 HG SER 667 8.552 -5.831 -8.186 51 H VAL 668 H VAL 668 5.391 -8.358 -8.884 52 HA VAL 668 HA VAL 668 6.414 -7.340 -11.326 53 HB VAL 668 HB VAL 668 4.547 -8.618 -12.367 54 HG11 VAL 668 HG11 VAL 668 6.705 -9.679 -11.616 55 HG12 VAL 668 HG12 VAL 668 5.896 -10.130 -10.116 56 HG13 VAL 668 HG13 VAL 668 5.335 -10.790 -11.650 57 HG21 VAL 668 HG21 VAL 668 2.764 -9.417 -11.166 58 HG22 VAL 668 HG22 VAL 668 3.742 -9.729 -9.733 59 HG23 VAL 668 HG23 VAL 668 3.170 -8.096 -10.071 60 H HIS 669 H HIS 669 3.892 -6.247 -9.213 61 HA HIS 669 HA HIS 669 2.513 -4.707 -11.262 62 HB2 HIS 669 HB2 HIS 669 2.217 -4.425 -8.271 63 HB3 HIS 669 HB3 HIS 669 1.050 -3.997 -9.522 64 HD1 HIS 669 HD1 HIS 669 0.518 -6.258 -11.167 65 HD2 HIS 669 HD2 HIS 669 1.610 -6.882 -7.202 66 HE1 HIS 669 HE1 HIS 669 -0.229 -8.610 -10.586 67 HE2 HIS 669 HE2 HIS 669 0.420 -9.003 -8.161 68 H LEU 670 H LEU 670 2.972 -2.706 -11.899 69 HA LEU 670 HA LEU 670 5.289 -1.361 -11.333 70 HB2 LEU 670 HB2 LEU 670 3.748 -0.849 -13.221 71 HB3 LEU 670 HB3 LEU 670 2.662 -0.056 -12.083 72 HG LEU 670 HG LEU 670 4.517 1.507 -11.462 73 HD11 LEU 670 HD11 LEU 670 6.467 1.601 -13.047 74 HD12 LEU 670 HD12 LEU 670 6.452 0.162 -12.019 75 HD13 LEU 670 HD13 LEU 670 5.940 0.047 -13.703 76 HD21 LEU 670 HD21 LEU 670 4.071 1.468 -14.454 77 HD22 LEU 670 HD22 LEU 670 2.834 1.982 -13.309 78 HD23 LEU 670 HD23 LEU 670 4.354 2.872 -13.424 79 H TRP 671 H TRP 671 2.238 -1.156 -9.528 80 HA TRP 671 HA TRP 671 3.258 1.016 -7.902 81 HB2 TRP 671 HB2 TRP 671 1.153 0.363 -6.480 82 HB3 TRP 671 HB3 TRP 671 0.975 1.227 -7.999 83 HD1 TRP 671 HD1 TRP 671 -0.259 0.037 -9.949 84 HE1 TRP 671 HE1 TRP 671 -1.565 -2.201 -10.149 85 HE3 TRP 671 HE3 TRP 671 1.175 -2.204 -5.579 86 HZ2 TRP 671 HZ2 TRP 671 -1.909 -4.587 -8.659 87 HZ3 TRP 671 HZ3 TRP 671 0.329 -4.465 -4.999 88 HH2 TRP 671 HH2 TRP 671 -1.206 -5.658 -6.534 89 H TYR 672 H TYR 672 4.188 -2.059 -8.028 90 HA TYR 672 HA TYR 672 4.285 -2.435 -5.118 91 HB2 TYR 672 HB2 TYR 672 3.727 -4.229 -7.044 92 HB3 TYR 672 HB3 TYR 672 5.468 -4.461 -6.910 93 HD1 TYR 672 HD2 TYR 672 2.276 -4.484 -5.062 94 HD2 TYR 672 HD1 TYR 672 6.459 -5.387 -4.922 95 HE1 TYR 672 HE2 TYR 672 1.932 -5.715 -2.938 96 HE2 TYR 672 HE1 TYR 672 6.129 -6.606 -2.801 97 HH TYR 672 HH TYR 672 4.057 -6.349 -0.819 98 H ALA 673 H ALA 673 6.015 -1.971 -3.985 99 HA ALA 673 HA ALA 673 8.508 -1.266 -5.369 100 HB1 ALA 673 HB1 ALA 673 9.104 -0.081 -3.437 101 HB2 ALA 673 HB2 ALA 673 8.030 -1.034 -2.410 102 HB3 ALA 673 HB3 ALA 673 7.360 0.153 -3.530 103 H GLY 674 H GLY 674 7.119 -3.928 -3.997 104 HA2 GLY 674 HA2 GLY 674 7.892 -5.989 -3.351 105 HA3 GLY 674 HA3 GLY 674 9.355 -5.586 -4.224 106 HA PRO 675 HA PRO 675 11.266 -5.960 -0.232 107 HB2 PRO 675 HB2 PRO 675 13.772 -5.175 -0.979 108 HB3 PRO 675 HB3 PRO 675 13.091 -6.765 -1.380 109 HG2 PRO 675 HG2 PRO 675 13.278 -4.307 -3.066 110 HG3 PRO 675 HG3 PRO 675 13.610 -5.997 -3.496 111 HD2 PRO 675 HD2 PRO 675 11.267 -4.782 -4.155 112 HD3 PRO 675 HD3 PRO 675 11.361 -6.514 -3.772 113 H MET 676 H MET 676 10.831 -2.976 -1.895 114 HA MET 676 HA MET 676 12.346 -1.252 -0.228 115 HB2 MET 676 HB2 MET 676 11.166 -0.762 -2.489 116 HB3 MET 676 HB3 MET 676 9.766 -0.388 -1.487 117 HG2 MET 676 HG2 MET 676 11.046 1.667 -1.858 118 HG3 MET 676 HG3 MET 676 11.188 1.196 -0.165 119 HE1 MET 676 HE1 MET 676 14.512 2.635 -2.303 120 HE2 MET 676 HE2 MET 676 13.124 2.220 -3.305 121 HE3 MET 676 HE3 MET 676 12.902 3.164 -1.824 122 H GLU 677 H GLU 677 11.729 0.118 1.467 123 HA GLU 677 HA GLU 677 9.434 -0.852 3.068 124 HB2 GLU 677 HB2 GLU 677 10.832 0.346 4.949 125 HB3 GLU 677 HB3 GLU 677 11.255 -1.283 4.428 126 HG2 GLU 677 HG2 GLU 677 12.863 -0.201 2.770 127 HG3 GLU 677 HG3 GLU 677 12.562 1.318 3.606 128 H ARG 678 H ARG 678 8.554 0.881 4.617 129 HA ARG 678 HA ARG 678 7.350 2.941 3.273 130 HB2 ARG 678 HB2 ARG 678 6.495 2.535 5.398 131 HB3 ARG 678 HB3 ARG 678 8.082 2.609 6.163 132 HG2 ARG 678 HG2 ARG 678 7.228 5.089 4.788 133 HG3 ARG 678 HG3 ARG 678 6.272 4.642 6.198 134 HD2 ARG 678 HD2 ARG 678 9.179 4.378 6.570 135 HD3 ARG 678 HD3 ARG 678 8.621 6.027 6.335 136 HE ARG 678 HE ARG 678 7.723 4.164 8.456 137 HH11 ARG 678 HH21 ARG 678 7.867 7.401 7.090 138 HH12 ARG 678 HH22 ARG 678 7.316 8.131 8.566 139 HH21 ARG 678 HH11 ARG 678 7.041 5.136 10.297 140 HH22 ARG 678 HH12 ARG 678 6.856 6.872 10.364 141 H ALA 679 H ALA 679 10.161 3.378 5.423 142 HA ALA 679 HA ALA 679 10.757 6.004 4.944 143 HB1 ALA 679 HB1 ALA 679 13.217 5.235 5.253 144 HB2 ALA 679 HB2 ALA 679 12.535 3.619 5.446 145 HB3 ALA 679 HB3 ALA 679 12.080 4.908 6.561 146 H GLY 680 H GLY 680 11.287 3.248 2.910 147 HA2 GLY 680 HA2 GLY 680 12.815 4.715 0.923 148 HA3 GLY 680 HA3 GLY 680 12.231 3.053 0.785 149 H ALA 681 H ALA 681 9.600 3.273 1.293 150 HA ALA 681 HA ALA 681 8.420 4.029 -1.106 151 HB1 ALA 681 HB1 ALA 681 6.283 4.084 0.303 152 HB2 ALA 681 HB2 ALA 681 7.320 3.741 1.676 153 HB3 ALA 681 HB3 ALA 681 7.216 2.589 0.353 154 H GLU 682 H GLU 682 8.618 5.873 1.941 155 HA GLU 682 HA GLU 682 7.200 8.134 0.996 156 HB2 GLU 682 HB2 GLU 682 9.365 8.419 3.053 157 HB3 GLU 682 HB3 GLU 682 7.778 9.191 2.985 158 HG2 GLU 682 HG2 GLU 682 6.932 6.688 3.217 159 HG3 GLU 682 HG3 GLU 682 8.511 6.453 3.940 160 H SER 683 H SER 683 10.600 7.234 0.922 161 HA SER 683 HA SER 683 11.736 9.648 0.159 162 HB2 SER 683 HB2 SER 683 13.608 8.409 -0.572 163 HB3 SER 683 HB3 SER 683 12.893 7.422 0.699 164 HG SER 683 HG SER 683 11.907 6.154 -0.881 165 H ILE 684 H ILE 684 10.510 7.055 -1.943 166 HA ILE 684 HA ILE 684 10.823 8.603 -4.341 167 HB ILE 684 HB ILE 684 8.929 6.276 -4.028 168 HG12 ILE 684 HG12 ILE 684 11.407 5.315 -4.961 169 HG13 ILE 684 HG13 ILE 684 11.795 6.309 -3.557 170 HG21 ILE 684 HG21 ILE 684 10.320 6.046 -6.400 171 HG22 ILE 684 HG22 ILE 684 8.727 6.781 -6.232 172 HG23 ILE 684 HG23 ILE 684 10.170 7.794 -6.223 173 HD11 ILE 684 HD11 ILE 684 9.782 5.063 -2.442 174 HD12 ILE 684 HD12 ILE 684 10.041 3.873 -3.717 175 HD13 ILE 684 HD13 ILE 684 11.333 4.237 -2.576 176 H LEU 685 H LEU 685 8.034 7.683 -2.316 177 HA LEU 685 HA LEU 685 6.061 9.021 -3.775 178 HB2 LEU 685 HB2 LEU 685 6.268 8.457 -0.813 179 HB3 LEU 685 HB3 LEU 685 4.819 9.097 -1.587 180 HG LEU 685 HG LEU 685 6.177 6.522 -2.443 181 HD11 LEU 685 HD11 LEU 685 3.745 6.946 -0.688 182 HD12 LEU 685 HD12 LEU 685 4.303 5.390 -1.294 183 HD13 LEU 685 HD13 LEU 685 5.300 6.300 -0.159 184 HD21 LEU 685 HD21 LEU 685 4.250 8.167 -3.682 185 HD22 LEU 685 HD22 LEU 685 4.690 6.524 -4.138 186 HD23 LEU 685 HD23 LEU 685 3.354 6.802 -3.025 187 H ALA 686 H ALA 686 7.980 10.237 -0.985 188 HA ALA 686 HA ALA 686 6.936 12.836 -0.926 189 HB1 ALA 686 HB1 ALA 686 9.070 13.474 0.137 190 HB2 ALA 686 HB2 ALA 686 9.784 11.945 -0.380 191 HB3 ALA 686 HB3 ALA 686 8.464 11.952 0.791 192 H ASN 687 H ASN 687 9.300 11.360 -3.053 193 HA ASN 687 HA ASN 687 10.095 13.821 -4.348 194 HB2 ASN 687 HB2 ASN 687 11.801 12.336 -4.668 195 HB3 ASN 687 HB3 ASN 687 10.740 10.938 -4.569 196 HD21 ASN 687 HD21 ASN 687 11.589 13.626 -6.806 197 HD22 ASN 687 HD22 ASN 687 11.304 12.732 -8.219 198 H ARG 688 H ARG 688 7.762 11.264 -4.855 199 HA ARG 688 HA ARG 688 6.992 12.170 -7.493 200 HB2 ARG 688 HB2 ARG 688 6.501 9.869 -5.810 201 HB3 ARG 688 HB3 ARG 688 4.988 10.492 -6.459 202 HG2 ARG 688 HG2 ARG 688 5.891 8.889 -8.043 203 HG3 ARG 688 HG3 ARG 688 6.042 10.501 -8.742 204 HD2 ARG 688 HD2 ARG 688 8.377 10.623 -8.057 205 HD3 ARG 688 HD3 ARG 688 8.245 9.069 -7.235 206 HE ARG 688 HE ARG 688 7.496 8.559 -9.857 207 HH11 ARG 688 HH21 ARG 688 10.246 9.889 -8.204 208 HH12 ARG 688 HH22 ARG 688 11.369 9.346 -9.412 209 HH21 ARG 688 HH11 ARG 688 8.918 7.890 -11.403 210 HH22 ARG 688 HH12 ARG 688 10.617 8.212 -11.230 211 H SER 689 H SER 689 4.699 12.677 -7.948 212 HA SER 689 HA SER 689 3.892 14.936 -6.428 213 HB2 SER 689 HB2 SER 689 3.414 14.299 -8.945 214 HB3 SER 689 HB3 SER 689 1.971 13.554 -8.252 215 HG SER 689 HG SER 689 2.104 15.985 -8.871 216 H ASP 690 H ASP 690 1.806 15.245 -5.444 217 HA ASP 690 HA ASP 690 1.250 13.269 -3.497 218 HB2 ASP 690 HB2 ASP 690 -0.067 15.843 -4.308 219 HB3 ASP 690 HB3 ASP 690 -0.750 14.817 -3.047 220 H GLY 691 H GLY 691 -0.175 11.674 -3.432 221 HA2 GLY 691 HA2 GLY 691 -2.355 10.729 -4.093 222 HA3 GLY 691 HA3 GLY 691 -2.048 11.356 -5.714 223 H THR 692 H THR 692 0.851 10.653 -5.327 224 HA THR 692 HA THR 692 0.955 8.211 -6.698 225 HB THR 692 HB THR 692 3.117 9.345 -4.906 226 HG1 THR 692 HG1 THR 692 2.682 11.018 -6.202 227 HG21 THR 692 HG21 THR 692 4.635 8.225 -6.404 228 HG22 THR 692 HG22 THR 692 3.427 7.044 -5.904 229 HG23 THR 692 HG23 THR 692 3.321 7.792 -7.497 230 H PHE 693 H PHE 693 1.567 6.075 -5.987 231 HA PHE 693 HA PHE 693 1.534 5.576 -3.099 232 HB2 PHE 693 HB2 PHE 693 -0.345 4.110 -3.127 233 HB3 PHE 693 HB3 PHE 693 -0.853 5.598 -3.922 234 HD1 PHE 693 HD1 PHE 693 -0.832 5.708 -6.465 235 HD2 PHE 693 HD2 PHE 693 -0.352 2.034 -4.290 236 HE1 PHE 693 HE1 PHE 693 -1.420 4.424 -8.503 237 HE2 PHE 693 HE2 PHE 693 -0.940 0.755 -6.330 238 HZ PHE 693 HZ PHE 693 -1.473 1.947 -8.436 239 H LEU 694 H LEU 694 1.782 3.189 -2.600 240 HA LEU 694 HA LEU 694 2.800 1.451 -4.621 241 HB2 LEU 694 HB2 LEU 694 5.135 1.372 -3.997 242 HB3 LEU 694 HB3 LEU 694 4.705 3.018 -4.441 243 HG LEU 694 HG LEU 694 4.172 3.154 -1.817 244 HD11 LEU 694 HD11 LEU 694 5.167 1.568 -0.544 245 HD12 LEU 694 HD12 LEU 694 5.348 0.631 -2.026 246 HD13 LEU 694 HD13 LEU 694 6.663 1.665 -1.471 247 HD21 LEU 694 HD21 LEU 694 7.042 3.336 -2.726 248 HD22 LEU 694 HD22 LEU 694 5.827 4.455 -3.338 249 HD23 LEU 694 HD23 LEU 694 6.170 4.391 -1.617 250 H VAL 695 H VAL 695 3.825 -0.511 -3.713 251 HA VAL 695 HA VAL 695 3.043 -1.142 -0.943 252 HB VAL 695 HB VAL 695 2.359 -3.045 -3.174 253 HG11 VAL 695 HG11 VAL 695 2.430 -3.846 -0.816 254 HG12 VAL 695 HG12 VAL 695 1.246 -2.613 -0.382 255 HG13 VAL 695 HG13 VAL 695 0.801 -3.912 -1.489 256 HG21 VAL 695 HG21 VAL 695 0.696 -0.761 -2.077 257 HG22 VAL 695 HG22 VAL 695 1.144 -1.040 -3.762 258 HG23 VAL 695 HG23 VAL 695 0.005 -2.123 -2.957 259 H ARG 696 H ARG 696 4.286 -2.769 0.018 260 HA ARG 696 HA ARG 696 6.646 -3.634 -1.558 261 HB2 ARG 696 HB2 ARG 696 7.972 -3.439 0.351 262 HB3 ARG 696 HB3 ARG 696 6.909 -2.037 0.450 263 HG2 ARG 696 HG2 ARG 696 6.654 -2.866 2.587 264 HG3 ARG 696 HG3 ARG 696 5.357 -3.739 1.776 265 HD2 ARG 696 HD2 ARG 696 6.337 -5.709 2.205 266 HD3 ARG 696 HD3 ARG 696 7.853 -5.172 1.481 267 HE ARG 696 HE ARG 696 8.223 -4.033 3.723 268 HH11 ARG 696 HH21 ARG 696 6.596 -7.064 3.312 269 HH12 ARG 696 HH22 ARG 696 6.666 -7.454 5.026 270 HH21 ARG 696 HH11 ARG 696 8.313 -4.546 5.871 271 HH22 ARG 696 HH12 ARG 696 7.607 -6.028 6.466 272 H GLN 697 H GLN 697 7.656 -5.665 -0.888 273 HA GLN 697 HA GLN 697 5.620 -7.711 -0.246 274 HB2 GLN 697 HB2 GLN 697 7.772 -7.571 -2.159 275 HB3 GLN 697 HB3 GLN 697 8.029 -8.942 -1.090 276 HG2 GLN 697 HG2 GLN 697 5.816 -9.814 -1.574 277 HG3 GLN 697 HG3 GLN 697 5.418 -8.392 -2.529 278 HE21 GLN 697 HE21 GLN 697 7.640 -11.192 -2.432 279 HE22 GLN 697 HE22 GLN 697 7.925 -11.237 -4.113 280 H ARG 698 H ARG 698 9.067 -8.266 0.047 281 HA ARG 698 HA ARG 698 10.329 -9.101 1.771 282 HB2 ARG 698 HB2 ARG 698 8.718 -6.974 3.176 283 HB3 ARG 698 HB3 ARG 698 9.955 -7.904 4.012 284 HG2 ARG 698 HG2 ARG 698 11.545 -7.211 2.132 285 HG3 ARG 698 HG3 ARG 698 10.304 -6.058 1.642 286 HD2 ARG 698 HD2 ARG 698 10.346 -5.237 4.081 287 HD3 ARG 698 HD3 ARG 698 11.845 -6.154 4.238 288 HE ARG 698 HE ARG 698 11.955 -4.459 1.932 289 HH11 ARG 698 HH21 ARG 698 12.119 -4.392 5.398 290 HH12 ARG 698 HH22 ARG 698 13.073 -2.944 5.430 291 HH21 ARG 698 HH11 ARG 698 13.199 -2.628 2.025 292 HH22 ARG 698 HH12 ARG 698 13.680 -1.959 3.571 293 H VAL 699 H VAL 699 9.034 -9.175 4.631 294 HA VAL 699 HA VAL 699 8.129 -11.875 4.439 295 HB VAL 699 HB VAL 699 7.599 -10.040 6.781 296 HG11 VAL 699 HG11 VAL 699 7.287 -12.846 6.233 297 HG12 VAL 699 HG12 VAL 699 8.504 -12.639 7.492 298 HG13 VAL 699 HG13 VAL 699 6.890 -11.962 7.705 299 HG21 VAL 699 HG21 VAL 699 10.172 -11.373 5.910 300 HG22 VAL 699 HG22 VAL 699 9.916 -9.680 6.327 301 HG23 VAL 699 HG23 VAL 699 9.871 -10.913 7.585 302 H LYS 700 H LYS 700 6.644 -10.657 2.614 303 HA LYS 700 HA LYS 700 4.193 -9.545 3.417 304 HB2 LYS 700 HB2 LYS 700 3.551 -9.696 1.173 305 HB3 LYS 700 HB3 LYS 700 5.301 -9.576 1.104 306 HG2 LYS 700 HG2 LYS 700 3.550 -11.972 0.577 307 HG3 LYS 700 HG3 LYS 700 4.820 -11.293 -0.423 308 HD2 LYS 700 HD2 LYS 700 6.509 -12.360 0.738 309 HD3 LYS 700 HD3 LYS 700 5.615 -12.372 2.252 310 HE2 LYS 700 HE2 LYS 700 4.764 -14.026 -0.125 311 HE3 LYS 700 HE3 LYS 700 5.872 -14.633 1.110 312 HZ1 LYS 700 HZ1 LYS 700 3.404 -13.349 2.041 313 HZ2 LYS 700 HZ2 LYS 700 3.261 -14.900 1.328 314 HZ3 LYS 700 HZ3 LYS 700 4.267 -14.693 2.700 315 H ASP 701 H ASP 701 4.143 -11.273 5.289 316 HA ASP 701 HA ASP 701 2.122 -13.277 4.470 317 HB2 ASP 701 HB2 ASP 701 4.684 -13.708 5.868 318 HB3 ASP 701 HB3 ASP 701 3.294 -14.493 6.612 319 H ALA 702 H ALA 702 0.911 -14.122 6.424 320 HA ALA 702 HA ALA 702 -0.643 -13.663 8.055 321 HB1 ALA 702 HB1 ALA 702 1.854 -12.355 9.126 322 HB2 ALA 702 HB2 ALA 702 1.134 -13.894 9.594 323 HB3 ALA 702 HB3 ALA 702 0.352 -12.381 10.049 324 H ALA 703 H ALA 703 0.940 -10.621 8.686 325 HA ALA 703 HA ALA 703 -1.010 -9.074 7.163 326 HB1 ALA 703 HB1 ALA 703 -1.974 -7.945 9.002 327 HB2 ALA 703 HB2 ALA 703 -0.758 -8.557 10.124 328 HB3 ALA 703 HB3 ALA 703 -1.988 -9.643 9.480 329 H GLU 704 H GLU 704 1.852 -9.538 7.125 330 HA GLU 704 HA GLU 704 3.068 -7.110 8.172 331 HB2 GLU 704 HB2 GLU 704 4.007 -9.628 7.793 332 HB3 GLU 704 HB3 GLU 704 4.594 -8.844 6.330 333 HG2 GLU 704 HG2 GLU 704 4.989 -7.174 8.703 334 HG3 GLU 704 HG3 GLU 704 5.796 -8.730 8.851 335 H PHE 705 H PHE 705 1.080 -7.444 5.689 336 HA PHE 705 HA PHE 705 2.711 -5.926 3.754 337 HB2 PHE 705 HB2 PHE 705 0.147 -6.339 2.665 338 HB3 PHE 705 HB3 PHE 705 1.640 -7.148 2.213 339 HD1 PHE 705 HD2 PHE 705 -1.279 -7.312 4.506 340 HD2 PHE 705 HD1 PHE 705 2.007 -9.445 2.769 341 HE1 PHE 705 HE2 PHE 705 -2.199 -9.435 5.390 342 HE2 PHE 705 HE1 PHE 705 1.088 -11.574 3.649 343 HZ PHE 705 HZ PHE 705 -1.014 -11.568 4.958 344 H ALA 706 H ALA 706 2.158 -3.911 3.049 345 HA ALA 706 HA ALA 706 -0.237 -2.572 4.036 346 HB1 ALA 706 HB1 ALA 706 2.333 -1.172 4.610 347 HB2 ALA 706 HB2 ALA 706 1.810 -2.427 5.728 348 HB3 ALA 706 HB3 ALA 706 0.779 -1.031 5.422 349 H ILE 707 H ILE 707 -0.627 -0.560 2.981 350 HA ILE 707 HA ILE 707 0.901 -0.276 0.450 351 HB ILE 707 HB ILE 707 -1.954 0.564 1.025 352 HG12 ILE 707 HG12 ILE 707 -0.861 -1.773 -0.581 353 HG13 ILE 707 HG13 ILE 707 -1.649 -1.899 0.992 354 HG21 ILE 707 HG21 ILE 707 -0.084 1.267 -1.044 355 HG22 ILE 707 HG22 ILE 707 -1.353 0.267 -1.748 356 HG23 ILE 707 HG23 ILE 707 -1.774 1.745 -0.886 357 HD11 ILE 707 HD11 ILE 707 -3.742 -1.247 0.133 358 HD12 ILE 707 HD12 ILE 707 -3.031 -0.541 -1.317 359 HD13 ILE 707 HD13 ILE 707 -3.093 -2.294 -1.129 360 H SER 708 H SER 708 1.823 1.631 -0.053 361 HA SER 708 HA SER 708 1.508 3.832 1.909 362 HB2 SER 708 HB2 SER 708 3.834 3.268 0.062 363 HB3 SER 708 HB3 SER 708 3.755 4.532 1.286 364 HG SER 708 HG SER 708 3.430 1.757 1.834 365 H ILE 709 H ILE 709 0.551 5.643 1.242 366 HA ILE 709 HA ILE 709 0.570 6.251 -1.659 367 HB ILE 709 HB ILE 709 -1.740 6.892 0.173 368 HG12 ILE 709 HG12 ILE 709 -2.651 4.902 -1.465 369 HG13 ILE 709 HG13 ILE 709 -0.999 4.361 -1.171 370 HG21 ILE 709 HG21 ILE 709 -2.181 6.482 -2.707 371 HG22 ILE 709 HG22 ILE 709 -2.704 7.804 -1.665 372 HG23 ILE 709 HG23 ILE 709 -1.083 7.816 -2.355 373 HD11 ILE 709 HD11 ILE 709 -3.269 4.295 0.604 374 HD12 ILE 709 HD12 ILE 709 -1.670 3.585 0.830 375 HD13 ILE 709 HD13 ILE 709 -1.975 5.250 1.324 376 H LYS 710 H LYS 710 0.851 8.326 -2.257 377 HA LYS 710 HA LYS 710 1.992 10.120 -0.270 378 HB2 LYS 710 HB2 LYS 710 3.090 9.843 -2.430 379 HB3 LYS 710 HB3 LYS 710 1.629 10.359 -3.267 380 HG2 LYS 710 HG2 LYS 710 2.955 12.305 -3.205 381 HG3 LYS 710 HG3 LYS 710 1.832 12.525 -1.862 382 HD2 LYS 710 HD2 LYS 710 3.590 11.517 -0.351 383 HD3 LYS 710 HD3 LYS 710 4.705 11.591 -1.712 384 HE2 LYS 710 HE2 LYS 710 3.250 13.927 -0.453 385 HE3 LYS 710 HE3 LYS 710 4.979 13.590 -0.339 386 HZ1 LYS 710 HZ1 LYS 710 5.116 14.902 -2.138 387 HZ2 LYS 710 HZ2 LYS 710 4.551 13.556 -3.006 388 HZ3 LYS 710 HZ3 LYS 710 3.441 14.769 -2.509 389 H TYR 711 H TYR 711 0.932 11.719 0.722 390 HA TYR 711 HA TYR 711 -1.404 12.981 -0.551 391 HB2 TYR 711 HB2 TYR 711 -1.838 10.933 1.183 392 HB3 TYR 711 HB3 TYR 711 -1.757 12.281 2.310 393 HD1 TYR 711 HD2 TYR 711 -2.951 14.510 0.875 394 HD2 TYR 711 HD1 TYR 711 -4.066 10.366 0.876 395 HE1 TYR 711 HE2 TYR 711 -5.272 15.138 0.280 396 HE2 TYR 711 HE1 TYR 711 -6.389 10.990 0.280 397 HH TYR 711 HH TYR 711 -7.728 12.714 -0.495 398 H ASN 712 H ASN 712 -1.370 15.141 -0.223 399 HA ASN 712 HA ASN 712 -0.550 17.198 0.445 400 HB2 ASN 712 HB2 ASN 712 -1.069 15.825 3.092 401 HB3 ASN 712 HB3 ASN 712 -0.746 17.548 2.926 402 HD21 ASN 712 HD21 ASN 712 -3.137 17.208 4.001 403 HD22 ASN 712 HD22 ASN 712 -4.399 17.337 2.873 404 H VAL 713 H VAL 713 1.565 16.348 -0.487 405 HA VAL 713 HA VAL 713 3.837 16.018 -0.373 406 HB VAL 713 HB VAL 713 5.049 17.694 0.857 407 HG11 VAL 713 HG11 VAL 713 3.633 18.393 -1.095 408 HG12 VAL 713 HG12 VAL 713 2.366 18.848 0.045 409 HG13 VAL 713 HG13 VAL 713 3.917 19.687 0.069 410 HG21 VAL 713 HG21 VAL 713 3.667 17.300 3.004 411 HG22 VAL 713 HG22 VAL 713 4.153 18.958 2.658 412 HG23 VAL 713 HG23 VAL 713 2.505 18.433 2.316 413 H GLU 714 H GLU 714 2.069 14.433 1.556 414 HA GLU 714 HA GLU 714 4.296 13.323 3.130 415 HB2 GLU 714 HB2 GLU 714 1.778 14.457 4.088 416 HB3 GLU 714 HB3 GLU 714 2.042 12.804 4.652 417 HG2 GLU 714 HG2 GLU 714 4.265 14.827 4.750 418 HG3 GLU 714 HG3 GLU 714 3.064 14.760 6.037 419 H VAL 715 H VAL 715 3.640 11.065 3.993 420 HA VAL 715 HA VAL 715 2.152 9.678 1.830 421 HB VAL 715 HB VAL 715 4.649 8.793 3.281 422 HG11 VAL 715 HG11 VAL 715 2.907 7.326 1.278 423 HG12 VAL 715 HG12 VAL 715 4.488 6.780 1.834 424 HG13 VAL 715 HG13 VAL 715 3.143 6.882 2.968 425 HG21 VAL 715 HG21 VAL 715 4.422 10.433 1.131 426 HG22 VAL 715 HG22 VAL 715 5.769 9.327 1.367 427 HG23 VAL 715 HG23 VAL 715 4.422 8.863 0.333 428 H LYS 716 H LYS 716 0.848 7.980 2.320 429 HA LYS 716 HA LYS 716 0.319 7.522 5.205 430 HB2 LYS 716 HB2 LYS 716 -1.461 8.652 3.578 431 HB3 LYS 716 HB3 LYS 716 -1.764 6.975 3.141 432 HG2 LYS 716 HG2 LYS 716 -2.663 6.448 5.179 433 HG3 LYS 716 HG3 LYS 716 -1.567 7.516 6.047 434 HD2 LYS 716 HD2 LYS 716 -3.982 8.399 4.429 435 HD3 LYS 716 HD3 LYS 716 -3.892 8.356 6.176 436 HE2 LYS 716 HE2 LYS 716 -2.372 10.164 4.277 437 HE3 LYS 716 HE3 LYS 716 -3.487 10.630 5.557 438 HZ1 LYS 716 HZ1 LYS 716 -1.840 10.648 7.013 439 HZ2 LYS 716 HZ2 LYS 716 -1.405 9.054 6.633 440 HZ3 LYS 716 HZ3 LYS 716 -0.731 10.341 5.753 441 H HIS 717 H HIS 717 1.056 5.579 5.779 442 HA HIS 717 HA HIS 717 0.954 3.393 3.804 443 HB2 HIS 717 HB2 HIS 717 2.482 3.314 6.403 444 HB3 HIS 717 HB3 HIS 717 2.700 2.304 4.980 445 HD1 HIS 717 HD1 HIS 717 4.157 3.209 3.055 446 HD2 HIS 717 HD2 HIS 717 3.608 5.964 6.162 447 HE1 HIS 717 HE1 HIS 717 5.895 5.051 2.746 448 HE2 HIS 717 HE2 HIS 717 5.504 6.782 4.594 449 H ILE 718 H ILE 718 -0.860 2.246 3.993 450 HA ILE 718 HA ILE 718 -1.957 1.782 6.711 451 HB ILE 718 HB ILE 718 -3.154 2.305 4.084 452 HG12 ILE 718 HG12 ILE 718 -3.566 3.803 5.910 453 HG13 ILE 718 HG13 ILE 718 -5.074 2.968 5.562 454 HG21 ILE 718 HG21 ILE 718 -3.668 -0.097 4.210 455 HG22 ILE 718 HG22 ILE 718 -4.315 0.123 5.836 456 HG23 ILE 718 HG23 ILE 718 -5.124 0.864 4.458 457 HD11 ILE 718 HD11 ILE 718 -3.284 2.739 7.927 458 HD12 ILE 718 HD12 ILE 718 -5.041 2.670 7.835 459 HD13 ILE 718 HD13 ILE 718 -4.083 1.263 7.382 460 H LYS 719 H LYS 719 -2.083 -0.248 7.480 461 HA LYS 719 HA LYS 719 -0.578 -2.290 6.150 462 HB2 LYS 719 HB2 LYS 719 -0.752 -3.521 8.136 463 HB3 LYS 719 HB3 LYS 719 -0.738 -1.843 8.676 464 HG2 LYS 719 HG2 LYS 719 -3.456 -2.566 8.126 465 HG3 LYS 719 HG3 LYS 719 -2.750 -3.827 9.134 466 HD2 LYS 719 HD2 LYS 719 -2.120 -2.248 10.818 467 HD3 LYS 719 HD3 LYS 719 -2.482 -0.880 9.765 468 HE2 LYS 719 HE2 LYS 719 -4.869 -1.557 9.734 469 HE3 LYS 719 HE3 LYS 719 -4.492 -2.877 10.843 470 HZ1 LYS 719 HZ1 LYS 719 -3.373 -0.584 11.955 471 HZ2 LYS 719 HZ2 LYS 719 -4.947 -0.130 11.420 472 HZ3 LYS 719 HZ3 LYS 719 -4.754 -1.443 12.496 473 H ILE 720 H ILE 720 -1.254 -4.353 5.549 474 HA ILE 720 HA ILE 720 -4.087 -4.464 4.716 475 HB ILE 720 HB ILE 720 -1.564 -5.598 3.526 476 HG12 ILE 720 HG12 ILE 720 -3.847 -4.021 2.318 477 HG13 ILE 720 HG13 ILE 720 -2.393 -3.276 2.986 478 HG21 ILE 720 HG21 ILE 720 -4.430 -6.308 2.807 479 HG22 ILE 720 HG22 ILE 720 -2.991 -6.815 1.921 480 HG23 ILE 720 HG23 ILE 720 -3.271 -7.404 3.559 481 HD11 ILE 720 HD11 ILE 720 -1.001 -4.247 1.355 482 HD12 ILE 720 HD12 ILE 720 -2.213 -5.453 0.917 483 HD13 ILE 720 HD13 ILE 720 -2.439 -3.769 0.452 484 H MET 721 H MET 721 -5.337 -6.079 5.411 485 HA MET 721 HA MET 721 -4.096 -8.059 7.224 486 HB2 MET 721 HB2 MET 721 -6.271 -6.362 7.570 487 HB3 MET 721 HB3 MET 721 -7.002 -7.924 7.238 488 HG2 MET 721 HG2 MET 721 -6.621 -8.433 9.412 489 HG3 MET 721 HG3 MET 721 -4.907 -8.515 9.009 490 HE1 MET 721 HE1 MET 721 -7.120 -7.519 11.398 491 HE2 MET 721 HE2 MET 721 -5.489 -7.846 11.972 492 HE3 MET 721 HE3 MET 721 -6.253 -6.284 12.303 493 H THR 722 H THR 722 -5.614 -10.090 7.349 494 HA THR 722 HA THR 722 -6.716 -10.974 4.836 495 HB THR 722 HB THR 722 -4.195 -11.243 4.582 496 HG1 THR 722 HG1 THR 722 -5.664 -12.417 3.345 497 HG21 THR 722 HG21 THR 722 -3.943 -12.022 7.006 498 HG22 THR 722 HG22 THR 722 -4.623 -13.562 6.478 499 HG23 THR 722 HG23 THR 722 -3.105 -12.987 5.793 500 H ALA 723 H ALA 723 -6.965 -13.503 5.028 501 HA ALA 723 HA ALA 723 -7.343 -14.661 7.546 502 HB1 ALA 723 HB1 ALA 723 -9.176 -13.462 8.188 503 HB2 ALA 723 HB2 ALA 723 -10.014 -14.606 7.140 504 HB3 ALA 723 HB3 ALA 723 -9.578 -13.007 6.532 505 H GLU 724 H GLU 724 -9.811 -14.737 5.040 506 HA GLU 724 HA GLU 724 -9.317 -17.560 4.578 507 HB2 GLU 724 HB2 GLU 724 -11.222 -15.835 3.012 508 HB3 GLU 724 HB3 GLU 724 -11.370 -17.543 3.438 509 HG2 GLU 724 HG2 GLU 724 -12.771 -16.693 5.056 510 HG3 GLU 724 HG3 GLU 724 -11.252 -16.491 5.922 511 H GLY 725 H GLY 725 -7.104 -15.968 3.862 512 HA2 GLY 725 HA2 GLY 725 -5.535 -15.992 2.147 513 HA3 GLY 725 HA3 GLY 725 -6.708 -16.829 1.136 514 H LEU 726 H LEU 726 -7.932 -14.017 2.583 515 HA LEU 726 HA LEU 726 -7.816 -12.609 0.006 516 HB2 LEU 726 HB2 LEU 726 -9.549 -12.114 2.440 517 HB3 LEU 726 HB3 LEU 726 -9.654 -11.239 0.915 518 HG LEU 726 HG LEU 726 -9.832 -14.228 0.873 519 HD11 LEU 726 HD11 LEU 726 -12.096 -14.282 1.488 520 HD12 LEU 726 HD12 LEU 726 -11.410 -13.157 2.658 521 HD13 LEU 726 HD13 LEU 726 -12.295 -12.544 1.261 522 HD21 LEU 726 HD21 LEU 726 -9.865 -13.344 -1.285 523 HD22 LEU 726 HD22 LEU 726 -11.586 -13.440 -0.922 524 HD23 LEU 726 HD23 LEU 726 -10.744 -11.898 -0.788 525 H TYR 727 H TYR 727 -7.783 -10.166 0.203 526 HA TYR 727 HA TYR 727 -5.799 -9.295 2.245 527 HB2 TYR 727 HB2 TYR 727 -5.959 -8.413 -0.653 528 HB3 TYR 727 HB3 TYR 727 -4.785 -7.855 0.539 529 HD1 TYR 727 HD2 TYR 727 -6.016 -10.869 -1.271 530 HD2 TYR 727 HD1 TYR 727 -2.827 -9.125 1.019 531 HE1 TYR 727 HE2 TYR 727 -4.573 -12.814 -1.799 532 HE2 TYR 727 HE1 TYR 727 -1.383 -11.071 0.483 533 HH TYR 727 HH TYR 727 -2.415 -13.898 -0.478 534 H ARG 728 H ARG 728 -6.209 -7.382 3.258 535 HA ARG 728 HA ARG 728 -8.163 -5.536 2.145 536 HB2 ARG 728 HB2 ARG 728 -9.237 -5.558 4.563 537 HB3 ARG 728 HB3 ARG 728 -9.780 -6.656 3.300 538 HG2 ARG 728 HG2 ARG 728 -8.938 -8.499 4.351 539 HG3 ARG 728 HG3 ARG 728 -7.488 -7.650 4.880 540 HD2 ARG 728 HD2 ARG 728 -8.573 -6.727 6.766 541 HD3 ARG 728 HD3 ARG 728 -10.173 -7.075 6.133 542 HE ARG 728 HE ARG 728 -8.390 -8.951 7.480 543 HH11 ARG 728 HH21 ARG 728 -11.188 -8.500 5.492 544 HH12 ARG 728 HH22 ARG 728 -11.886 -10.025 5.944 545 HH21 ARG 728 HH11 ARG 728 -9.300 -10.916 8.031 546 HH22 ARG 728 HH12 ARG 728 -10.826 -11.383 7.363 547 H ILE 729 H ILE 729 -7.852 -3.493 2.736 548 HA ILE 729 HA ILE 729 -5.437 -2.808 4.164 549 HB ILE 729 HB ILE 729 -6.567 -0.426 3.791 550 HG12 ILE 729 HG12 ILE 729 -8.703 -1.724 3.033 551 HG13 ILE 729 HG13 ILE 729 -8.190 -0.314 2.113 552 HG21 ILE 729 HG21 ILE 729 -4.950 -2.219 2.127 553 HG22 ILE 729 HG22 ILE 729 -5.789 -0.979 1.196 554 HG23 ILE 729 HG23 ILE 729 -4.712 -0.515 2.510 555 HD11 ILE 729 HD11 ILE 729 -8.669 -2.851 1.083 556 HD12 ILE 729 HD12 ILE 729 -7.816 -1.544 0.264 557 HD13 ILE 729 HD13 ILE 729 -6.909 -2.760 1.162 558 H THR 730 H THR 730 -8.790 -3.092 4.754 559 HA THR 730 HA THR 730 -8.377 -2.197 7.524 560 HB THR 730 HB THR 730 -9.638 -0.591 5.879 561 HG1 THR 730 HG1 THR 730 -10.456 -1.365 8.499 562 HG21 THR 730 HG21 THR 730 -11.150 -2.403 5.062 563 HG22 THR 730 HG22 THR 730 -11.878 -2.451 6.667 564 HG23 THR 730 HG23 THR 730 -12.004 -0.992 5.692 565 H GLU 731 H GLU 731 -9.149 -3.526 8.986 566 HA GLU 731 HA GLU 731 -9.632 -6.180 8.622 567 HB2 GLU 731 HB2 GLU 731 -10.653 -6.139 10.873 568 HB3 GLU 731 HB3 GLU 731 -9.210 -5.120 10.798 569 HG2 GLU 731 HG2 GLU 731 -11.972 -3.996 10.327 570 HG3 GLU 731 HG3 GLU 731 -11.280 -4.103 11.937 571 H LYS 732 H LYS 732 -11.811 -3.603 8.001 572 HA LYS 732 HA LYS 732 -14.239 -5.098 8.201 573 HB2 LYS 732 HB2 LYS 732 -13.862 -2.515 6.715 574 HB3 LYS 732 HB3 LYS 732 -15.316 -3.114 7.518 575 HG2 LYS 732 HG2 LYS 732 -13.423 -3.154 9.538 576 HG3 LYS 732 HG3 LYS 732 -13.011 -1.691 8.643 577 HD2 LYS 732 HD2 LYS 732 -15.401 -0.980 8.803 578 HD3 LYS 732 HD3 LYS 732 -15.721 -2.401 9.803 579 HE2 LYS 732 HE2 LYS 732 -13.383 -1.007 10.770 580 HE3 LYS 732 HE3 LYS 732 -14.755 0.102 10.675 581 HZ1 LYS 732 HZ1 LYS 732 -16.099 -1.654 11.862 582 HZ2 LYS 732 HZ2 LYS 732 -14.613 -2.506 12.121 583 HZ3 LYS 732 HZ3 LYS 732 -14.833 -0.928 12.798 584 H LYS 733 H LYS 733 -11.858 -4.995 5.704 585 HA LYS 733 HA LYS 733 -13.888 -6.027 3.782 586 HB2 LYS 733 HB2 LYS 733 -12.614 -3.692 3.413 587 HB3 LYS 733 HB3 LYS 733 -11.447 -4.790 2.661 588 HG2 LYS 733 HG2 LYS 733 -12.795 -4.692 0.826 589 HG3 LYS 733 HG3 LYS 733 -13.866 -5.756 1.722 590 HD2 LYS 733 HD2 LYS 733 -15.285 -3.987 1.078 591 HD3 LYS 733 HD3 LYS 733 -14.865 -3.593 2.744 592 HE2 LYS 733 HE2 LYS 733 -14.617 -1.875 0.604 593 HE3 LYS 733 HE3 LYS 733 -13.750 -1.715 2.130 594 HZ1 LYS 733 HZ1 LYS 733 -12.817 -3.030 -0.352 595 HZ2 LYS 733 HZ2 LYS 733 -12.125 -1.668 0.407 596 HZ3 LYS 733 HZ3 LYS 733 -12.023 -3.204 1.136 597 H ALA 734 H ALA 734 -12.361 -6.816 1.740 598 HA ALA 734 HA ALA 734 -10.101 -8.387 2.313 599 HB1 ALA 734 HB1 ALA 734 -12.760 -9.703 2.712 600 HB2 ALA 734 HB2 ALA 734 -11.269 -9.889 3.636 601 HB3 ALA 734 HB3 ALA 734 -11.425 -10.644 2.050 602 H PHE 735 H PHE 735 -9.131 -8.720 0.399 603 HA PHE 735 HA PHE 735 -10.797 -8.989 -2.048 604 HB2 PHE 735 HB2 PHE 735 -8.222 -7.507 -1.558 605 HB3 PHE 735 HB3 PHE 735 -8.592 -8.119 -3.174 606 HD1 PHE 735 HD2 PHE 735 -9.977 -6.040 -0.396 607 HD2 PHE 735 HD1 PHE 735 -10.060 -6.938 -4.592 608 HE1 PHE 735 HE2 PHE 735 -11.449 -4.092 -0.788 609 HE2 PHE 735 HE1 PHE 735 -11.532 -4.983 -4.986 610 HZ PHE 735 HZ PHE 735 -12.237 -3.565 -3.075 611 H ARG 736 H ARG 736 -9.748 -10.273 -3.772 612 HA ARG 736 HA ARG 736 -8.743 -12.748 -2.754 613 HB2 ARG 736 HB2 ARG 736 -8.676 -11.816 -5.611 614 HB3 ARG 736 HB3 ARG 736 -8.715 -13.475 -5.020 615 HG2 ARG 736 HG2 ARG 736 -10.965 -13.058 -4.059 616 HG3 ARG 736 HG3 ARG 736 -10.927 -11.422 -4.725 617 HD2 ARG 736 HD2 ARG 736 -10.582 -13.919 -6.383 618 HD3 ARG 736 HD3 ARG 736 -12.123 -13.094 -6.173 619 HE ARG 736 HE ARG 736 -9.711 -11.821 -7.417 620 HH11 ARG 736 HH21 ARG 736 -13.152 -12.304 -7.178 621 HH12 ARG 736 HH22 ARG 736 -13.516 -11.201 -8.452 622 HH21 ARG 736 HH11 ARG 736 -10.204 -10.373 -9.038 623 HH22 ARG 736 HH12 ARG 736 -11.865 -10.121 -9.501 624 H GLY 737 H GLY 737 -7.298 -9.895 -4.150 625 HA2 GLY 737 HA2 GLY 737 -4.663 -10.662 -3.292 626 HA3 GLY 737 HA3 GLY 737 -4.849 -10.728 -5.041 627 H LEU 738 H LEU 738 -3.197 -8.951 -3.412 628 HA LEU 738 HA LEU 738 -3.995 -6.409 -2.951 629 HB2 LEU 738 HB2 LEU 738 -1.516 -7.658 -3.933 630 HB3 LEU 738 HB3 LEU 738 -1.678 -5.962 -4.379 631 HG LEU 738 HG LEU 738 -0.534 -6.168 -2.227 632 HD11 LEU 738 HD11 LEU 738 -2.603 -4.493 -2.794 633 HD12 LEU 738 HD12 LEU 738 -3.148 -5.204 -1.277 634 HD13 LEU 738 HD13 LEU 738 -1.595 -4.373 -1.357 635 HD21 LEU 738 HD21 LEU 738 -3.030 -7.261 -0.978 636 HD22 LEU 738 HD22 LEU 738 -1.886 -8.370 -1.733 637 HD23 LEU 738 HD23 LEU 738 -1.366 -7.341 -0.400 638 H THR 739 H THR 739 -3.049 -7.668 -6.113 639 HA THR 739 HA THR 739 -3.478 -5.452 -7.701 640 HB THR 739 HB THR 739 -4.198 -8.260 -8.540 641 HG1 THR 739 HG1 THR 739 -1.660 -7.461 -9.016 642 HG21 THR 739 HG21 THR 739 -3.045 -5.852 -9.973 643 HG22 THR 739 HG22 THR 739 -3.213 -7.454 -10.691 644 HG23 THR 739 HG23 THR 739 -4.648 -6.550 -10.209 645 H GLU 740 H GLU 740 -5.908 -7.719 -6.465 646 HA GLU 740 HA GLU 740 -8.008 -6.541 -8.071 647 HB2 GLU 740 HB2 GLU 740 -8.600 -8.176 -5.631 648 HB3 GLU 740 HB3 GLU 740 -9.413 -8.169 -7.193 649 HG2 GLU 740 HG2 GLU 740 -6.739 -9.004 -7.653 650 HG3 GLU 740 HG3 GLU 740 -7.316 -9.906 -6.266 651 H LEU 741 H LEU 741 -6.523 -5.955 -5.037 652 HA LEU 741 HA LEU 741 -8.745 -4.403 -3.981 653 HB2 LEU 741 HB2 LEU 741 -7.496 -5.705 -2.390 654 HB3 LEU 741 HB3 LEU 741 -5.964 -5.068 -2.973 655 HG LEU 741 HG LEU 741 -6.946 -4.138 -0.756 656 HD11 LEU 741 HD11 LEU 741 -5.533 -2.385 -1.056 657 HD12 LEU 741 HD12 LEU 741 -5.198 -3.146 -2.612 658 HD13 LEU 741 HD13 LEU 741 -6.365 -1.827 -2.507 659 HD21 LEU 741 HD21 LEU 741 -8.289 -1.949 -2.064 660 HD22 LEU 741 HD22 LEU 741 -9.073 -3.452 -2.530 661 HD23 LEU 741 HD23 LEU 741 -8.913 -3.041 -0.832 662 H VAL 742 H VAL 742 -5.427 -3.922 -5.005 663 HA VAL 742 HA VAL 742 -5.296 -1.110 -4.780 664 HB VAL 742 HB VAL 742 -3.813 -3.083 -6.525 665 HG11 VAL 742 HG11 VAL 742 -3.720 -0.169 -6.385 666 HG12 VAL 742 HG12 VAL 742 -2.159 -0.910 -6.033 667 HG13 VAL 742 HG13 VAL 742 -2.981 -1.266 -7.554 668 HG21 VAL 742 HG21 VAL 742 -3.590 -3.519 -4.148 669 HG22 VAL 742 HG22 VAL 742 -2.082 -2.832 -4.758 670 HG23 VAL 742 HG23 VAL 742 -3.202 -1.825 -3.839 671 H GLU 743 H GLU 743 -5.618 -3.123 -7.663 672 HA GLU 743 HA GLU 743 -5.989 -1.002 -9.468 673 HB2 GLU 743 HB2 GLU 743 -6.898 -3.860 -9.771 674 HB3 GLU 743 HB3 GLU 743 -6.522 -2.722 -11.070 675 HG2 GLU 743 HG2 GLU 743 -4.423 -3.286 -8.996 676 HG3 GLU 743 HG3 GLU 743 -4.713 -4.488 -10.236 677 H PHE 744 H PHE 744 -8.189 -2.611 -7.347 678 HA PHE 744 HA PHE 744 -10.581 -1.845 -8.791 679 HB2 PHE 744 HB2 PHE 744 -10.688 -3.829 -7.471 680 HB3 PHE 744 HB3 PHE 744 -10.070 -3.001 -6.048 681 HD1 PHE 744 HD1 PHE 744 -12.896 -2.703 -8.516 682 HD2 PHE 744 HD2 PHE 744 -11.589 -2.298 -4.448 683 HE1 PHE 744 HE1 PHE 744 -15.208 -2.119 -7.830 684 HE2 PHE 744 HE2 PHE 744 -13.901 -1.717 -3.756 685 HZ PHE 744 HZ PHE 744 -15.710 -1.625 -5.452 686 H TYR 745 H TYR 745 -8.653 -0.621 -6.117 687 HA TYR 745 HA TYR 745 -10.567 1.370 -5.326 688 HB2 TYR 745 HB2 TYR 745 -7.737 0.714 -4.639 689 HB3 TYR 745 HB3 TYR 745 -8.349 2.319 -4.236 690 HD1 TYR 745 HD2 TYR 745 -10.846 -0.300 -4.408 691 HD2 TYR 745 HD1 TYR 745 -8.014 1.620 -1.811 692 HE1 TYR 745 HE2 TYR 745 -12.046 -1.193 -2.441 693 HE2 TYR 745 HE1 TYR 745 -9.226 0.719 0.158 694 HH TYR 745 HH TYR 745 -12.060 -0.076 0.332 695 H GLN 746 H GLN 746 -8.259 1.150 -7.855 696 HA GLN 746 HA GLN 746 -7.454 3.751 -8.326 697 HB2 GLN 746 HB2 GLN 746 -8.361 1.617 -10.260 698 HB3 GLN 746 HB3 GLN 746 -7.681 3.159 -10.786 699 HG2 GLN 746 HG2 GLN 746 -5.605 2.720 -9.634 700 HG3 GLN 746 HG3 GLN 746 -6.278 1.289 -8.854 701 HE21 GLN 746 HE21 GLN 746 -7.409 -0.185 -10.821 702 HE22 GLN 746 HE22 GLN 746 -6.287 -0.532 -12.054 703 H GLN 747 H GLN 747 -10.635 2.363 -8.689 704 HA GLN 747 HA GLN 747 -11.684 4.960 -9.654 705 HB2 GLN 747 HB2 GLN 747 -12.930 2.207 -9.884 706 HB3 GLN 747 HB3 GLN 747 -13.582 3.705 -10.550 707 HG2 GLN 747 HG2 GLN 747 -10.871 2.561 -11.288 708 HG3 GLN 747 HG3 GLN 747 -12.336 2.316 -12.235 709 HE21 GLN 747 HE21 GLN 747 -10.079 4.845 -11.092 710 HE22 GLN 747 HE22 GLN 747 -10.504 5.970 -12.290 711 H ASN 748 H ASN 748 -11.161 3.560 -6.863 712 HA ASN 748 HA ASN 748 -13.680 4.550 -5.678 713 HB2 ASN 748 HB2 ASN 748 -14.166 2.298 -5.474 714 HB3 ASN 748 HB3 ASN 748 -12.473 1.825 -5.404 715 HD21 ASN 748 HD21 ASN 748 -11.340 2.155 -3.311 716 HD22 ASN 748 HD22 ASN 748 -12.231 2.284 -1.865 717 H SER 749 H SER 749 -13.161 6.144 -4.351 718 HA SER 749 HA SER 749 -10.654 6.906 -3.528 719 HB2 SER 749 HB2 SER 749 -13.127 7.911 -3.211 720 HB3 SER 749 HB3 SER 749 -12.850 7.312 -1.586 721 HG SER 749 HG SER 749 -10.619 8.489 -2.307 722 H LEU 750 H LEU 750 -9.264 6.303 -1.951 723 HA LEU 750 HA LEU 750 -9.467 3.718 -0.829 724 HB2 LEU 750 HB2 LEU 750 -7.681 6.046 -0.142 725 HB3 LEU 750 HB3 LEU 750 -7.487 4.431 0.531 726 HG LEU 750 HG LEU 750 -7.804 4.212 -2.313 727 HD11 LEU 750 HD11 LEU 750 -5.355 5.783 -1.635 728 HD12 LEU 750 HD12 LEU 750 -6.189 5.622 -3.178 729 HD13 LEU 750 HD13 LEU 750 -6.867 6.642 -1.913 730 HD21 LEU 750 HD21 LEU 750 -5.311 3.818 -0.644 731 HD22 LEU 750 HD22 LEU 750 -6.663 2.685 -0.623 732 HD23 LEU 750 HD23 LEU 750 -5.770 2.963 -2.118 733 H LYS 751 H LYS 751 -10.366 6.855 0.428 734 HA LYS 751 HA LYS 751 -10.483 6.408 3.131 735 HB2 LYS 751 HB2 LYS 751 -12.352 8.011 3.212 736 HB3 LYS 751 HB3 LYS 751 -11.030 8.559 2.193 737 HG2 LYS 751 HG2 LYS 751 -12.527 7.283 0.335 738 HG3 LYS 751 HG3 LYS 751 -13.800 7.816 1.443 739 HD2 LYS 751 HD2 LYS 751 -12.815 10.100 1.422 740 HD3 LYS 751 HD3 LYS 751 -11.634 9.549 0.244 741 HE2 LYS 751 HE2 LYS 751 -14.012 8.806 -0.924 742 HE3 LYS 751 HE3 LYS 751 -14.413 10.347 -0.152 743 HZ1 LYS 751 HZ1 LYS 751 -13.493 10.908 -2.235 744 HZ2 LYS 751 HZ2 LYS 751 -12.234 11.194 -1.092 745 HZ3 LYS 751 HZ3 LYS 751 -12.214 9.770 -2.069 746 H ASP 752 H ASP 752 -12.251 4.803 0.683 747 HA ASP 752 HA ASP 752 -14.586 4.052 2.108 748 HB2 ASP 752 HB2 ASP 752 -14.918 2.420 0.479 749 HB3 ASP 752 HB3 ASP 752 -13.894 3.568 -0.380 750 H CYS 753 H CYS 753 -11.322 2.772 2.028 751 HA CYS 753 HA CYS 753 -11.934 1.031 4.350 752 HB2 CYS 753 HB2 CYS 753 -10.079 0.685 2.027 753 HB3 CYS 753 HB3 CYS 753 -9.672 -0.041 3.580 754 HG CYS 753 HG CYS 753 -12.502 -0.642 2.495 755 H PHE 754 H PHE 754 -9.640 3.226 2.806 756 HA PHE 754 HA PHE 754 -7.858 3.293 5.032 757 HB2 PHE 754 HB2 PHE 754 -8.272 5.101 2.657 758 HB3 PHE 754 HB3 PHE 754 -7.074 5.428 3.909 759 HD1 PHE 754 HD2 PHE 754 -8.245 2.411 1.995 760 HD2 PHE 754 HD1 PHE 754 -4.918 4.741 3.387 761 HE1 PHE 754 HE2 PHE 754 -6.682 0.810 0.938 762 HE2 PHE 754 HE1 PHE 754 -3.355 3.139 2.327 763 HZ PHE 754 HZ PHE 754 -4.233 1.173 1.102 764 H LYS 755 H LYS 755 -7.696 4.978 6.621 765 HA LYS 755 HA LYS 755 -10.314 5.947 7.365 766 HB2 LYS 755 HB2 LYS 755 -7.968 6.643 9.025 767 HB3 LYS 755 HB3 LYS 755 -9.538 5.985 9.487 768 HG2 LYS 755 HG2 LYS 755 -7.218 4.479 8.247 769 HG3 LYS 755 HG3 LYS 755 -7.886 4.261 9.855 770 HD2 LYS 755 HD2 LYS 755 -10.059 3.557 8.747 771 HD3 LYS 755 HD3 LYS 755 -9.185 3.555 7.221 772 HE2 LYS 755 HE2 LYS 755 -7.466 2.061 8.622 773 HE3 LYS 755 HE3 LYS 755 -8.942 1.680 9.523 774 HZ1 LYS 755 HZ1 LYS 755 -8.137 0.659 7.059 775 HZ2 LYS 755 HZ2 LYS 755 -9.620 0.343 7.866 776 HZ3 LYS 755 HZ3 LYS 755 -9.499 1.640 6.739 777 H SER 756 H SER 756 -7.151 7.654 7.282 778 HA SER 756 HA SER 756 -8.621 10.162 6.914 779 HB2 SER 756 HB2 SER 756 -6.825 11.201 7.831 780 HB3 SER 756 HB3 SER 756 -6.408 9.583 8.389 781 HG SER 756 HG SER 756 -4.659 10.524 7.294 782 H LEU 757 H LEU 757 -7.111 7.815 5.056 783 HA LEU 757 HA LEU 757 -6.017 9.346 2.927 784 HB2 LEU 757 HB2 LEU 757 -5.849 6.784 3.614 785 HB3 LEU 757 HB3 LEU 757 -7.177 6.645 2.468 786 HG LEU 757 HG LEU 757 -5.170 6.283 1.248 787 HD11 LEU 757 HD11 LEU 757 -6.922 7.823 0.272 788 HD12 LEU 757 HD12 LEU 757 -5.870 9.158 0.741 789 HD13 LEU 757 HD13 LEU 757 -5.302 7.958 -0.414 790 HD21 LEU 757 HD21 LEU 757 -3.297 7.834 1.299 791 HD22 LEU 757 HD22 LEU 757 -4.176 8.887 2.402 792 HD23 LEU 757 HD23 LEU 757 -3.665 7.282 2.938 793 H ASP 758 H ASP 758 -7.317 10.806 1.880 794 HA ASP 758 HA ASP 758 -9.926 9.802 0.940 795 HB2 ASP 758 HB2 ASP 758 -9.904 11.810 2.532 796 HB3 ASP 758 HB3 ASP 758 -9.242 12.727 1.181 797 H THR 759 H THR 759 -8.554 8.831 -0.780 798 HA THR 759 HA THR 759 -8.844 10.395 -3.141 799 HB THR 759 HB THR 759 -6.689 11.352 -2.319 800 HG1 THR 759 HG1 THR 759 -5.999 11.418 -4.336 801 HG21 THR 759 HG21 THR 759 -5.318 9.822 -1.338 802 HG22 THR 759 HG22 THR 759 -6.002 8.478 -2.252 803 HG23 THR 759 HG23 THR 759 -4.787 9.516 -2.991 804 H THR 760 H THR 760 -7.131 9.046 -4.856 805 HA THR 760 HA THR 760 -7.927 6.204 -4.521 806 HB THR 760 HB THR 760 -8.268 6.172 -7.026 807 HG1 THR 760 HG1 THR 760 -8.889 8.550 -7.569 808 HG21 THR 760 HG21 THR 760 -10.178 6.205 -5.531 809 HG22 THR 760 HG22 THR 760 -10.043 7.955 -5.344 810 HG23 THR 760 HG23 THR 760 -10.503 7.265 -6.902 811 H LEU 761 H LEU 761 -6.739 4.791 -6.157 812 HA LEU 761 HA LEU 761 -3.924 5.121 -5.803 813 HB2 LEU 761 HB2 LEU 761 -5.577 3.256 -7.534 814 HB3 LEU 761 HB3 LEU 761 -3.820 3.188 -7.471 815 HG LEU 761 HG LEU 761 -4.787 1.549 -5.918 816 HD11 LEU 761 HD11 LEU 761 -3.929 3.361 -3.834 817 HD12 LEU 761 HD12 LEU 761 -3.085 1.969 -4.511 818 HD13 LEU 761 HD13 LEU 761 -2.913 3.554 -5.258 819 HD21 LEU 761 HD21 LEU 761 -6.904 2.945 -5.571 820 HD22 LEU 761 HD22 LEU 761 -6.244 2.151 -4.142 821 HD23 LEU 761 HD23 LEU 761 -5.974 3.873 -4.394 822 H GLN 762 H GLN 762 -3.688 7.273 -6.631 823 HA GLN 762 HA GLN 762 -4.365 8.090 -9.225 824 HB2 GLN 762 HB2 GLN 762 -2.158 9.041 -7.394 825 HB3 GLN 762 HB3 GLN 762 -2.690 9.889 -8.844 826 HG2 GLN 762 HG2 GLN 762 -4.911 9.130 -7.081 827 HG3 GLN 762 HG3 GLN 762 -3.767 10.226 -6.318 828 HE21 GLN 762 HE21 GLN 762 -6.358 10.023 -8.565 829 HE22 GLN 762 HE22 GLN 762 -6.271 11.619 -9.138 830 H PHE 763 H PHE 763 -1.061 7.325 -8.100 831 HA PHE 763 HA PHE 763 -0.542 5.878 -10.565 832 HB2 PHE 763 HB2 PHE 763 1.663 7.607 -10.480 833 HB3 PHE 763 HB3 PHE 763 0.383 7.578 -11.689 834 HD1 PHE 763 HD1 PHE 763 1.440 9.106 -8.467 835 HD2 PHE 763 HD2 PHE 763 -1.277 9.293 -11.785 836 HE1 PHE 763 HE1 PHE 763 0.683 11.344 -7.717 837 HE2 PHE 763 HE2 PHE 763 -2.036 11.533 -11.036 838 HZ PHE 763 HZ PHE 763 -1.057 12.557 -9.002 839 HA PRO 764 HA PRO 764 2.111 3.620 -7.899 840 HB2 PRO 764 HB2 PRO 764 3.791 2.520 -9.777 841 HB3 PRO 764 HB3 PRO 764 2.139 1.946 -9.471 842 HG2 PRO 764 HG2 PRO 764 3.177 3.650 -11.663 843 HG3 PRO 764 HG3 PRO 764 1.888 2.436 -11.681 844 HD2 PRO 764 HD2 PRO 764 1.436 5.156 -11.622 845 HD3 PRO 764 HD3 PRO 764 0.288 3.942 -11.030 846 H PHE 765 H PHE 765 3.980 3.960 -6.778 847 HA PHE 765 HA PHE 765 5.479 6.302 -7.135 848 HB2 PHE 765 HB2 PHE 765 6.731 5.596 -5.321 849 HB3 PHE 765 HB3 PHE 765 5.268 4.635 -5.116 850 HD1 PHE 765 HD1 PHE 765 5.267 2.327 -6.463 851 HD2 PHE 765 HD2 PHE 765 8.783 4.494 -5.302 852 HE1 PHE 765 HE1 PHE 765 6.605 0.270 -6.693 853 HE2 PHE 765 HE2 PHE 765 10.130 2.426 -5.523 854 HZ PHE 765 HZ PHE 765 9.043 0.314 -6.221 855 H LYS 766 H LYS 766 5.854 3.125 -8.536 856 HA LYS 766 HA LYS 766 8.537 3.264 -9.317 857 HB2 LYS 766 HB2 LYS 766 6.145 1.711 -10.052 858 HB3 LYS 766 HB3 LYS 766 7.451 1.734 -11.226 859 HG2 LYS 766 HG2 LYS 766 8.421 1.398 -8.500 860 HG3 LYS 766 HG3 LYS 766 7.322 0.115 -8.988 861 HD2 LYS 766 HD2 LYS 766 9.630 -0.471 -9.603 862 HD3 LYS 766 HD3 LYS 766 8.666 -0.217 -11.058 863 HE2 LYS 766 HE2 LYS 766 10.149 2.113 -9.870 864 HE3 LYS 766 HE3 LYS 766 11.039 0.926 -10.820 865 HZ1 LYS 766 HZ1 LYS 766 10.348 2.062 -12.594 866 HZ2 LYS 766 HZ2 LYS 766 8.805 1.420 -12.309 867 HZ3 LYS 766 HZ3 LYS 766 9.202 2.966 -11.708 868 H GLU 767 H GLU 767 5.698 4.795 -10.584 869 HA GLU 767 HA GLU 767 6.612 5.178 -13.226 870 HB2 GLU 767 HB2 GLU 767 4.370 6.001 -11.622 871 HB3 GLU 767 HB3 GLU 767 5.000 7.397 -12.494 872 HG2 GLU 767 HG2 GLU 767 5.007 5.924 -14.576 873 HG3 GLU 767 HG3 GLU 767 4.073 4.759 -13.647 874 H1 ASP 338 H1 ASP 338 16.625 1.653 5.778 875 H2 ASP 338 H2 ASP 338 15.658 3.046 5.958 876 H3 ASP 338 H3 ASP 338 14.948 1.485 6.046 877 HA ASP 338 HA ASP 338 17.110 2.109 7.925 878 HB2 ASP 338 HB2 ASP 338 14.285 3.135 8.325 879 HB3 ASP 338 HB3 ASP 338 15.676 3.391 9.380 880 H THR 339 H THR 339 14.035 1.738 9.272 881 HA THR 339 HA THR 339 14.293 -1.212 9.391 882 HB THR 339 HB THR 339 13.662 -1.141 11.742 883 HG1 THR 339 HG1 THR 339 13.786 1.216 12.555 884 HG21 THR 339 HG21 THR 339 16.084 -0.815 11.054 885 HG22 THR 339 HG22 THR 339 15.841 0.914 11.308 886 HG23 THR 339 HG23 THR 339 15.675 -0.208 12.659 887 H GLU 340 H GLU 340 12.004 0.981 10.909 888 HA GLU 340 HA GLU 340 9.684 -0.386 10.556 889 HB2 GLU 340 HB2 GLU 340 9.937 1.789 11.760 890 HB3 GLU 340 HB3 GLU 340 9.907 2.610 10.199 891 HG2 GLU 340 HG2 GLU 340 7.692 0.826 10.228 892 HG3 GLU 340 HG3 GLU 340 7.682 1.676 11.770 893 H VAL 341 H VAL 341 8.834 -1.319 8.830 894 HA VAL 341 HA VAL 341 9.357 -0.358 6.154 895 HB VAL 341 HB VAL 341 9.318 -2.750 6.586 896 HG11 VAL 341 HG11 VAL 341 6.764 -3.578 6.923 897 HG12 VAL 341 HG12 VAL 341 7.878 -3.317 8.263 898 HG13 VAL 341 HG13 VAL 341 6.711 -2.069 7.831 899 HG21 VAL 341 HG21 VAL 341 7.393 -1.467 4.725 900 HG22 VAL 341 HG22 VAL 341 8.713 -2.581 4.389 901 HG23 VAL 341 HG23 VAL 341 7.170 -3.192 4.985 902 H TYR 342 H TYR 342 6.882 -0.094 8.517 903 HA TYR 342 HA TYR 342 5.602 2.102 7.633 904 HB2 TYR 342 HB2 TYR 342 3.384 0.964 6.738 905 HB3 TYR 342 HB3 TYR 342 4.674 1.449 5.653 906 HD1 TYR 342 HD2 TYR 342 4.356 -1.582 7.886 907 HD2 TYR 342 HD1 TYR 342 4.668 -0.033 3.888 908 HE1 TYR 342 HE2 TYR 342 4.477 -3.895 6.990 909 HE2 TYR 342 HE1 TYR 342 4.776 -2.332 3.009 910 HH TYR 342 HH TYR 342 4.413 -5.167 5.122 911 H GLU 343 H GLU 343 3.848 2.697 8.918 912 HA GLU 343 HA GLU 343 3.481 0.973 11.267 913 HB2 GLU 343 HB2 GLU 343 3.805 3.753 10.916 914 HB3 GLU 343 HB3 GLU 343 2.137 3.528 11.443 915 HG2 GLU 343 HG2 GLU 343 4.561 2.332 12.823 916 HG3 GLU 343 HG3 GLU 343 3.721 3.782 13.356 917 H SER 344 H SER 344 1.104 1.668 12.258 918 HA SER 344 HA SER 344 -0.836 0.821 10.173 919 HB2 SER 344 HB2 SER 344 -0.815 -0.958 11.684 920 HB3 SER 344 HB3 SER 344 -0.519 0.090 13.068 921 HG SER 344 HG SER 344 -2.653 0.959 12.701 922 HA PRO 345 HA PRO 345 -1.539 5.388 11.205 923 HB2 PRO 345 HB2 PRO 345 -3.356 4.465 8.961 924 HB3 PRO 345 HB3 PRO 345 -2.607 6.060 9.182 925 HG2 PRO 345 HG2 PRO 345 -1.563 4.192 7.588 926 HG3 PRO 345 HG3 PRO 345 -0.560 5.332 8.498 927 HD2 PRO 345 HD2 PRO 345 -0.786 2.433 8.849 928 HD3 PRO 345 HD3 PRO 345 0.376 3.557 9.589 929 H PTR 346 H PTR 346 -3.995 2.805 10.707 930 HA PTR 346 HA PTR 346 -5.173 3.256 13.266 931 HB2 PTR 346 HB2 PTR 346 -6.779 4.755 12.867 932 HB3 PTR 346 HB3 PTR 346 -7.392 3.796 11.526 933 HD1 PTR 346 HD1 PTR 346 -5.651 3.883 9.383 934 HD2 PTR 346 HD2 PTR 346 -6.200 6.937 12.345 935 HE1 PTR 346 HE1 PTR 346 -4.766 5.569 7.789 936 HE2 PTR 346 HE2 PTR 346 -5.315 8.627 10.765 937 H ALA 347 H ALA 347 -7.564 2.202 13.194 938 HA ALA 347 HA ALA 347 -8.156 0.059 11.450 939 HB1 ALA 347 HB1 ALA 347 -6.634 -1.487 12.056 940 HB2 ALA 347 HB2 ALA 347 -7.454 -1.558 13.615 941 HB3 ALA 347 HB3 ALA 347 -6.059 -0.499 13.401 942 H ASP 348 H ASP 348 -9.686 -1.542 12.561 943 HA ASP 348 HA ASP 348 -11.202 -0.147 14.700 944 HB2 ASP 348 HB2 ASP 348 -11.957 -0.434 12.033 945 HB3 ASP 348 HB3 ASP 348 -12.857 -1.688 12.878 946 HA PRO 349 HA PRO 349 -11.400 -4.162 16.575 947 HB2 PRO 349 HB2 PRO 349 -13.500 -3.838 18.251 948 HB3 PRO 349 HB3 PRO 349 -11.974 -2.961 18.472 949 HG2 PRO 349 HG2 PRO 349 -14.569 -2.002 17.413 950 HG3 PRO 349 HG3 PRO 349 -13.336 -1.138 18.344 951 HD2 PRO 349 HD2 PRO 349 -13.705 -0.991 15.555 952 HD3 PRO 349 HD3 PRO 349 -12.285 -0.412 16.450 953 H GLU 350 H GLU 350 -13.972 -3.017 14.628 954 HA GLU 350 HA GLU 350 -15.076 -5.749 14.389 955 HB2 GLU 350 HB2 GLU 350 -17.290 -4.705 13.910 956 HB3 GLU 350 HB3 GLU 350 -16.730 -4.407 15.554 957 HG2 GLU 350 HG2 GLU 350 -16.942 -2.194 15.191 958 HG3 GLU 350 HG3 GLU 350 -15.694 -2.301 13.958
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