NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
591142 | 2myz | 25465 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 HT1 GLY 1 1.388 -2.559 1.674 2 H2 GLY 1 HT2 GLY 1 3.040 -2.680 2.054 3 H3 GLY 1 HT3 GLY 1 2.162 -1.294 2.497 4 HA2 GLY 1 HA1 GLY 1 0.973 -2.407 4.151 5 HA3 GLY 1 HA2 GLY 1 1.452 -3.979 3.511 6 H GLU 2 HN GLU 2 2.291 -4.453 5.686 7 HA GLU 2 HA GLU 2 4.224 -2.972 7.083 8 HB2 GLU 2 HB2 GLU 2 3.941 -5.977 6.799 9 HB3 GLU 2 HB1 GLU 2 4.996 -5.194 7.976 10 HG2 GLU 2 HG2 GLU 2 3.035 -4.001 8.918 11 HG3 GLU 2 HG1 GLU 2 1.990 -4.841 7.772 12 H CGU 3 HN GLA 3 4.499 -4.192 3.963 13 HA CGU 3 HA GLA 3 7.340 -4.842 4.030 14 HB2 CGU 3 HB2 GLA 3 5.486 -4.237 1.702 15 HB3 CGU 3 HB3 GLA 3 5.884 -5.843 2.322 16 HG CGU 3 HG GLA 3 8.021 -3.937 1.336 17 H CGU 4 HN GLA 4 5.468 -2.143 2.601 18 HA CGU 4 HA GLA 4 7.574 -0.513 1.775 19 HB2 CGU 4 HB2 GLA 4 5.015 0.376 3.144 20 HB3 CGU 4 HB3 GLA 4 5.201 0.058 1.418 21 HG CGU 4 HG GLA 4 6.805 2.126 2.955 22 H LEU 5 HN LEU 5 6.355 -1.026 5.049 23 HA LEU 5 HA LEU 5 7.580 1.052 6.448 24 HB2 LEU 5 HB2 LEU 5 6.187 -1.101 7.212 25 HB3 LEU 5 HB1 LEU 5 7.808 -1.687 7.608 26 HG LEU 5 HG LEU 5 6.650 0.959 8.533 27 HD11 LEU 5 HD11 LEU 5 6.340 -0.058 10.677 28 HD12 LEU 5 HD12 LEU 5 7.209 -1.513 10.187 29 HD13 LEU 5 HD13 LEU 5 5.619 -1.164 9.508 30 HD21 LEU 5 HD21 LEU 5 8.918 1.337 8.656 31 HD22 LEU 5 HD22 LEU 5 9.306 -0.382 8.733 32 HD23 LEU 5 HD23 LEU 5 8.725 0.457 10.172 33 H ALA 6 HN ALA 6 9.066 -2.032 5.422 34 HA ALA 6 HA ALA 6 11.657 -1.250 6.540 35 HB1 ALA 6 HB1 ALA 6 10.597 -3.604 5.008 36 HB2 ALA 6 HB2 ALA 6 11.442 -3.563 6.555 37 HB3 ALA 6 HB3 ALA 6 12.340 -3.340 5.054 38 H CGU 7 HN GLA 7 10.307 -1.593 3.211 39 HA CGU 7 HA GLA 7 12.567 -0.960 1.701 40 HB2 CGU 7 HB2 GLA 7 11.038 0.109 0.069 41 HB3 CGU 7 HB3 GLA 7 9.768 0.156 1.292 42 HG CGU 7 HG GLA 7 9.851 -2.321 1.446 43 H ASN 8 HN ASN 8 10.697 1.032 3.811 44 HA ASN 8 HA ASN 8 11.266 3.643 3.206 45 HB2 ASN 8 HB2 ASN 8 10.225 2.403 5.340 46 HB3 ASN 8 HB1 ASN 8 11.818 2.751 6.004 47 HD21 ASN 8 HD21 ASN 8 11.230 4.438 7.424 48 HD22 ASN 8 HD22 ASN 8 10.580 5.927 6.894 49 H GLN 9 HN GLN 9 13.488 1.379 4.884 50 HA GLN 9 HA GLN 9 15.633 3.391 4.838 51 HB2 GLN 9 HB2 GLN 9 16.926 1.805 6.086 52 HB3 GLN 9 HB1 GLN 9 15.281 1.710 6.718 53 HG2 GLN 9 HG2 GLN 9 14.929 -0.185 5.004 54 HG3 GLN 9 HG1 GLN 9 16.686 -0.214 4.865 55 HE21 GLN 9 HE21 GLN 9 14.109 -1.531 6.612 56 HE22 GLN 9 HE22 GLN 9 14.975 -2.055 7.985 57 H CGU 10 HN GLA 10 14.923 0.283 3.242 58 HA CGU 10 HA GLA 10 17.266 -0.130 1.817 59 HB2 CGU 10 HB2 GLA 10 14.465 -0.380 0.685 60 HB3 CGU 10 HB3 GLA 10 15.250 -1.593 1.693 61 HG CGU 10 HG GLA 10 17.098 -1.706 -0.027 62 H PHE 11 HN PHE 11 14.965 2.407 1.422 63 HA PHE 11 HA PHE 11 15.305 3.350 -1.140 64 HB2 PHE 11 HB2 PHE 11 14.071 4.393 0.854 65 HB3 PHE 11 HB1 PHE 11 15.604 5.170 1.243 66 HD1 PHE 11 HD1 PHE 11 16.775 6.493 -0.661 67 HD2 PHE 11 HD2 PHE 11 12.632 5.360 -0.746 68 HE1 PHE 11 HE1 PHE 11 16.337 8.227 -2.378 69 HE2 PHE 11 HE2 PHE 11 12.194 7.095 -2.464 70 HZ PHE 11 HZ PHE 11 14.046 8.529 -3.280 71 H ALA 12 HN ALA 12 17.607 3.810 1.556 72 HA ALA 12 HA ALA 12 19.498 5.398 0.166 73 HB1 ALA 12 HB1 ALA 12 20.830 5.107 2.004 74 HB2 ALA 12 HB2 ALA 12 20.562 3.364 2.051 75 HB3 ALA 12 HB3 ALA 12 19.341 4.462 2.694 76 H ARG 13 HN ARG 13 18.938 1.922 0.081 77 HA ARG 13 HA ARG 13 21.421 1.450 -1.430 78 HB2 ARG 13 HB2 ARG 13 20.518 -0.241 0.184 79 HB3 ARG 13 HB1 ARG 13 19.122 -0.450 -0.873 80 HG2 ARG 13 HG2 ARG 13 21.780 -0.666 -2.175 81 HG3 ARG 13 HG1 ARG 13 21.355 -1.969 -1.066 82 HD2 ARG 13 HD2 ARG 13 19.244 -2.333 -2.277 83 HD3 ARG 13 HD1 ARG 13 19.639 -1.012 -3.379 84 HE ARG 13 HE ARG 13 21.737 -3.006 -3.333 85 HH11 ARG 13 HH11 ARG 13 19.187 -4.569 -3.798 86 HH12 ARG 13 HH12 ARG 13 19.068 -4.531 -5.526 87 HH21 ARG 13 HH21 ARG 13 21.341 -1.938 -5.890 88 HH22 ARG 13 HH22 ARG 13 20.284 -3.037 -6.710 89 H CGU 14 HN GLA 14 17.975 1.858 -2.067 90 HA CGU 14 HA GLA 14 17.717 0.822 -4.620 91 HB2 CGU 14 HB2 GLA 14 16.401 3.285 -4.614 92 HB3 CGU 14 HB3 GLA 14 16.450 2.805 -2.932 93 HG CGU 14 HG GLA 14 15.554 0.586 -3.566 94 H LEU 15 HN LEU 15 19.193 3.889 -3.611 95 HA LEU 15 HA LEU 15 19.558 5.149 -6.079 96 HB2 LEU 15 HB2 LEU 15 21.468 6.266 -5.094 97 HB3 LEU 15 HB1 LEU 15 20.261 6.039 -3.831 98 HG LEU 15 HG LEU 15 21.537 3.787 -3.380 99 HD11 LEU 15 HD11 LEU 15 23.441 3.455 -4.534 100 HD12 LEU 15 HD12 LEU 15 24.077 4.997 -3.965 101 HD13 LEU 15 HD13 LEU 15 23.134 4.929 -5.451 102 HD21 LEU 15 HD21 LEU 15 21.380 5.828 -1.893 103 HD22 LEU 15 HD22 LEU 15 22.862 6.416 -2.646 104 HD23 LEU 15 HD23 LEU 15 22.880 4.917 -1.717 105 H ALA 16 HN ALA 16 21.277 2.382 -4.736 106 HA ALA 16 HA ALA 16 23.531 2.177 -6.322 107 HB1 ALA 16 HB1 ALA 16 22.561 0.489 -4.610 108 HB2 ALA 16 HB2 ALA 16 23.462 -0.163 -5.979 109 HB3 ALA 16 HB3 ALA 16 21.699 -0.198 -5.986 110 H ASN 17 HN ASN 17 20.184 1.834 -7.333 111 HA ASN 17 HA ASN 17 20.545 0.540 -9.820 112 HB2 ASN 17 HB2 ASN 17 18.325 1.088 -8.843 113 HB3 ASN 17 HB1 ASN 17 18.611 2.793 -9.195 114 HD21 ASN 17 HD21 ASN 17 17.956 3.506 -11.239 115 HD22 ASN 17 HD22 ASN 17 17.598 2.478 -12.554 116 HN1 NH2 18 H1 NH2 18 19.470 3.774 -10.434 117 HN2 NH2 18 H2 NH2 18 20.840 4.297 -11.291 Start of MODEL 2 1 H1 GLY 1 HT1 GLY 1 0.378 -4.457 6.273 2 H2 GLY 1 HT2 GLY 1 2.026 -4.864 6.331 3 H3 GLY 1 HT3 GLY 1 1.411 -3.985 5.013 4 HA2 GLY 1 HA1 GLY 1 1.264 -2.033 6.170 5 HA3 GLY 1 HA2 GLY 1 1.139 -2.872 7.716 6 H GLU 2 HN GLU 2 3.332 -4.648 7.406 7 HA GLU 2 HA GLU 2 5.518 -2.851 8.079 8 HB2 GLU 2 HB2 GLU 2 5.523 -5.855 7.642 9 HB3 GLU 2 HB1 GLU 2 6.811 -4.921 8.403 10 HG2 GLU 2 HG2 GLU 2 3.958 -5.070 9.419 11 HG3 GLU 2 HG1 GLU 2 5.310 -5.993 10.078 12 H CGU 3 HN GLA 3 4.331 -4.182 5.168 13 HA CGU 3 HA GLA 3 6.727 -4.557 3.684 14 HB2 CGU 3 HB2 GLA 3 3.993 -3.600 2.781 15 HB3 CGU 3 HB3 GLA 3 4.586 -5.264 2.775 16 HG CGU 3 HG GLA 3 5.750 -2.968 1.164 17 H CGU 4 HN GLA 4 4.575 -1.696 3.500 18 HA CGU 4 HA GLA 4 6.335 0.012 2.153 19 HB2 CGU 4 HB2 GLA 4 4.459 0.827 4.393 20 HB3 CGU 4 HB3 GLA 4 3.951 0.528 2.731 21 HG CGU 4 HG GLA 4 5.592 2.291 1.994 22 H LEU 5 HN LEU 5 6.362 -0.990 5.509 23 HA LEU 5 HA LEU 5 8.149 1.036 6.489 24 HB2 LEU 5 HB2 LEU 5 6.686 -0.940 7.652 25 HB3 LEU 5 HB1 LEU 5 8.299 -1.661 7.705 26 HG LEU 5 HG LEU 5 7.560 1.089 8.744 27 HD11 LEU 5 HD11 LEU 5 8.257 -0.052 10.944 28 HD12 LEU 5 HD12 LEU 5 8.084 -1.575 10.071 29 HD13 LEU 5 HD13 LEU 5 6.691 -0.511 10.273 30 HD21 LEU 5 HD21 LEU 5 9.927 0.837 9.745 31 HD22 LEU 5 HD22 LEU 5 9.820 1.199 8.022 32 HD23 LEU 5 HD23 LEU 5 10.156 -0.448 8.558 33 H ALA 6 HN ALA 6 8.654 -2.033 4.830 34 HA ALA 6 HA ALA 6 11.546 -1.998 5.354 35 HB1 ALA 6 HB1 ALA 6 11.521 -4.139 4.564 36 HB2 ALA 6 HB2 ALA 6 10.519 -3.719 3.174 37 HB3 ALA 6 HB3 ALA 6 9.772 -3.999 4.748 38 H CGU 7 HN GLA 7 9.406 -1.465 2.509 39 HA CGU 7 HA GLA 7 11.317 -0.999 0.523 40 HB2 CGU 7 HB2 GLA 7 9.702 0.736 -0.381 41 HB3 CGU 7 HB3 GLA 7 8.758 0.537 1.095 42 HG CGU 7 HG GLA 7 8.535 -1.894 0.583 43 H ASN 8 HN ASN 8 10.490 0.881 3.296 44 HA ASN 8 HA ASN 8 11.468 3.413 2.914 45 HB2 ASN 8 HB2 ASN 8 10.699 2.013 5.061 46 HB3 ASN 8 HB1 ASN 8 12.439 1.916 5.313 47 HD21 ASN 8 HD21 ASN 8 12.788 3.415 6.955 48 HD22 ASN 8 HD22 ASN 8 12.331 5.060 6.871 49 H GLN 9 HN GLN 9 13.461 0.541 3.708 50 HA GLN 9 HA GLN 9 15.942 2.056 3.397 51 HB2 GLN 9 HB2 GLN 9 17.053 0.051 3.999 52 HB3 GLN 9 HB1 GLN 9 15.554 0.023 4.929 53 HG2 GLN 9 HG2 GLN 9 14.520 -1.371 3.120 54 HG3 GLN 9 HG1 GLN 9 16.093 -1.436 2.326 55 HE21 GLN 9 HE21 GLN 9 16.686 -1.316 5.620 56 HE22 GLN 9 HE22 GLN 9 16.815 -2.988 5.930 57 H CGU 10 HN GLA 10 14.218 -0.444 1.528 58 HA CGU 10 HA GLA 10 16.018 -0.922 -0.516 59 HB2 CGU 10 HB2 GLA 10 13.057 -0.435 -0.887 60 HB3 CGU 10 HB3 GLA 10 13.774 -1.961 -0.376 61 HG CGU 10 HG GLA 10 14.369 -0.546 -2.991 62 H PHE 11 HN PHE 11 14.430 2.007 0.186 63 HA PHE 11 HA PHE 11 14.901 3.182 -2.452 64 HB2 PHE 11 HB2 PHE 11 12.980 3.812 -1.087 65 HB3 PHE 11 HB1 PHE 11 14.057 4.367 0.190 66 HD1 PHE 11 HD1 PHE 11 15.800 6.202 -0.452 67 HD2 PHE 11 HD2 PHE 11 12.310 5.292 -2.787 68 HE1 PHE 11 HE1 PHE 11 15.965 8.413 -1.562 69 HE2 PHE 11 HE2 PHE 11 12.476 7.504 -3.896 70 HZ PHE 11 HZ PHE 11 14.303 9.064 -3.283 71 H ALA 12 HN ALA 12 16.295 3.497 0.817 72 HA ALA 12 HA ALA 12 18.218 5.504 0.120 73 HB1 ALA 12 HB1 ALA 12 18.469 5.430 2.354 74 HB2 ALA 12 HB2 ALA 12 19.287 3.876 2.191 75 HB3 ALA 12 HB3 ALA 12 17.540 3.932 2.429 76 H ARG 13 HN ARG 13 18.332 1.958 0.053 77 HA ARG 13 HA ARG 13 21.152 1.932 -0.721 78 HB2 ARG 13 HB2 ARG 13 19.034 -0.235 -0.651 79 HB3 ARG 13 HB1 ARG 13 20.721 -0.523 -1.077 80 HG2 ARG 13 HG2 ARG 13 20.017 0.877 1.495 81 HG3 ARG 13 HG1 ARG 13 19.992 -0.884 1.400 82 HD2 ARG 13 HD2 ARG 13 22.341 -0.808 0.516 83 HD3 ARG 13 HD1 ARG 13 22.349 0.932 0.817 84 HE ARG 13 HE ARG 13 22.683 -1.121 2.821 85 HH11 ARG 13 HH11 ARG 13 23.771 1.647 3.057 86 HH12 ARG 13 HH12 ARG 13 22.779 2.329 4.304 87 HH21 ARG 13 HH21 ARG 13 20.329 -0.115 4.054 88 HH22 ARG 13 HH22 ARG 13 20.827 1.331 4.867 89 H CGU 14 HN GLA 14 18.084 2.116 -2.355 90 HA CGU 14 HA GLA 14 18.633 1.031 -4.854 91 HB2 CGU 14 HB2 GLA 14 17.226 3.399 -5.292 92 HB3 CGU 14 HB3 GLA 14 16.821 2.950 -3.648 93 HG CGU 14 HG GLA 14 16.252 0.679 -4.422 94 H LEU 15 HN LEU 15 19.548 4.209 -3.542 95 HA LEU 15 HA LEU 15 20.542 5.466 -5.831 96 HB2 LEU 15 HB2 LEU 15 22.106 6.649 -4.327 97 HB3 LEU 15 HB1 LEU 15 20.508 6.523 -3.598 98 HG LEU 15 HG LEU 15 21.447 4.300 -2.565 99 HD11 LEU 15 HD11 LEU 15 23.625 3.872 -2.913 100 HD12 LEU 15 HD12 LEU 15 24.053 5.425 -2.199 101 HD13 LEU 15 HD13 LEU 15 23.748 5.305 -3.930 102 HD21 LEU 15 HD21 LEU 15 20.809 6.463 -1.395 103 HD22 LEU 15 HD22 LEU 15 22.500 6.945 -1.527 104 HD23 LEU 15 HD23 LEU 15 22.059 5.519 -0.586 105 H ALA 16 HN ALA 16 21.962 2.820 -3.989 106 HA ALA 16 HA ALA 16 24.596 2.779 -4.824 107 HB1 ALA 16 HB1 ALA 16 24.572 0.412 -4.537 108 HB2 ALA 16 HB2 ALA 16 22.866 0.303 -4.969 109 HB3 ALA 16 HB3 ALA 16 23.341 1.028 -3.433 110 H ASN 17 HN ASN 17 21.740 2.171 -6.775 111 HA ASN 17 HA ASN 17 21.579 1.464 -9.044 112 HB2 ASN 17 HB2 ASN 17 22.030 3.988 -8.939 113 HB3 ASN 17 HB1 ASN 17 23.693 3.597 -9.379 114 HD21 ASN 17 HD21 ASN 17 23.868 4.108 -11.580 115 HD22 ASN 17 HD22 ASN 17 22.768 3.595 -12.780 116 HN1 NH2 18 H1 NH2 18 22.833 -0.646 -8.459 117 HN2 NH2 18 H2 NH2 18 24.332 -0.878 -9.222 Start of MODEL 3 1 H1 GLY 1 HT1 GLY 1 1.440 -2.278 7.471 2 H2 GLY 1 HT2 GLY 1 1.572 -3.944 7.774 3 H3 GLY 1 HT3 GLY 1 0.256 -3.341 6.882 4 HA2 GLY 1 HA1 GLY 1 1.937 -4.410 5.464 5 HA3 GLY 1 HA2 GLY 1 1.679 -2.707 5.078 6 H GLU 2 HN GLU 2 3.862 -4.978 6.685 7 HA GLU 2 HA GLU 2 5.823 -3.019 7.465 8 HB2 GLU 2 HB2 GLU 2 7.344 -4.965 7.682 9 HB3 GLU 2 HB1 GLU 2 5.783 -5.279 8.440 10 HG2 GLU 2 HG2 GLU 2 5.039 -6.533 6.485 11 HG3 GLU 2 HG1 GLU 2 6.531 -6.141 5.631 12 H CGU 3 HN GLA 3 4.831 -4.051 4.429 13 HA CGU 3 HA GLA 3 7.300 -4.179 2.991 14 HB2 CGU 3 HB2 GLA 3 4.573 -3.245 2.039 15 HB3 CGU 3 HB3 GLA 3 5.149 -4.915 2.026 16 HG CGU 3 HG GLA 3 6.391 -2.593 0.511 17 H CGU 4 HN GLA 4 4.963 -1.465 2.908 18 HA CGU 4 HA GLA 4 6.706 0.457 1.837 19 HB2 CGU 4 HB2 GLA 4 4.550 0.958 3.913 20 HB3 CGU 4 HB3 GLA 4 4.254 0.783 2.182 21 HG CGU 4 HG GLA 4 6.037 2.889 3.454 22 H LEU 5 HN LEU 5 6.192 -0.417 5.251 23 HA LEU 5 HA LEU 5 7.890 1.546 6.401 24 HB2 LEU 5 HB2 LEU 5 6.306 -0.402 7.411 25 HB3 LEU 5 HB1 LEU 5 7.884 -1.166 7.623 26 HG LEU 5 HG LEU 5 7.337 1.671 8.509 27 HD11 LEU 5 HD11 LEU 5 7.405 0.214 10.817 28 HD12 LEU 5 HD12 LEU 5 6.551 -0.896 9.745 29 HD13 LEU 5 HD13 LEU 5 5.919 0.727 10.020 30 HD21 LEU 5 HD21 LEU 5 9.651 0.026 8.343 31 HD22 LEU 5 HD22 LEU 5 9.255 0.179 10.054 32 HD23 LEU 5 HD23 LEU 5 9.518 1.624 9.078 33 H ALA 6 HN ALA 6 8.611 -1.648 5.035 34 HA ALA 6 HA ALA 6 11.438 -1.470 5.787 35 HB1 ALA 6 HB1 ALA 6 11.661 -3.618 4.843 36 HB2 ALA 6 HB2 ALA 6 10.317 -3.371 3.728 37 HB3 ALA 6 HB3 ALA 6 10.004 -3.619 5.446 38 H CGU 7 HN GLA 7 9.478 -0.867 2.872 39 HA CGU 7 HA GLA 7 11.449 -0.702 0.900 40 HB2 CGU 7 HB2 GLA 7 10.095 1.250 -0.028 41 HB3 CGU 7 HB3 GLA 7 9.096 1.140 1.422 42 HG CGU 7 HG GLA 7 8.544 -1.198 0.873 43 H ASN 8 HN ASN 8 10.784 1.433 3.573 44 HA ASN 8 HA ASN 8 12.220 3.730 3.105 45 HB2 ASN 8 HB2 ASN 8 11.106 2.614 5.292 46 HB3 ASN 8 HB1 ASN 8 12.798 2.290 5.654 47 HD21 ASN 8 HD21 ASN 8 13.100 3.840 7.300 48 HD22 ASN 8 HD22 ASN 8 12.973 5.523 7.038 49 H GLN 9 HN GLN 9 13.568 0.599 4.180 50 HA GLN 9 HA GLN 9 16.314 1.513 4.057 51 HB2 GLN 9 HB2 GLN 9 15.039 -0.627 5.204 52 HB3 GLN 9 HB1 GLN 9 15.814 -1.383 3.812 53 HG2 GLN 9 HG2 GLN 9 17.981 -0.570 4.482 54 HG3 GLN 9 HG1 GLN 9 17.267 0.430 5.749 55 HE21 GLN 9 HE21 GLN 9 18.703 -2.594 5.165 56 HE22 GLN 9 HE22 GLN 9 18.188 -3.387 6.585 57 H CGU 10 HN GLA 10 14.189 -0.344 1.893 58 HA CGU 10 HA GLA 10 16.234 -0.890 -0.056 59 HB2 CGU 10 HB2 GLA 10 13.239 -0.738 -0.443 60 HB3 CGU 10 HB3 GLA 10 14.114 -2.172 0.083 61 HG CGU 10 HG GLA 10 14.506 -0.718 -2.548 62 H PHE 11 HN PHE 11 14.439 1.847 0.735 63 HA PHE 11 HA PHE 11 14.631 3.122 -1.892 64 HB2 PHE 11 HB2 PHE 11 12.770 3.547 -0.350 65 HB3 PHE 11 HB1 PHE 11 13.900 4.196 0.832 66 HD1 PHE 11 HD1 PHE 11 13.178 4.620 -2.833 67 HD2 PHE 11 HD2 PHE 11 14.061 6.520 0.916 68 HE1 PHE 11 HE1 PHE 11 13.055 6.841 -3.930 69 HE2 PHE 11 HE2 PHE 11 13.936 8.741 -0.180 70 HZ PHE 11 HZ PHE 11 13.434 8.901 -2.603 71 H ALA 12 HN ALA 12 16.497 2.986 1.063 72 HA ALA 12 HA ALA 12 18.099 5.349 0.403 73 HB1 ALA 12 HB1 ALA 12 19.239 3.463 2.341 74 HB2 ALA 12 HB2 ALA 12 17.590 3.952 2.732 75 HB3 ALA 12 HB3 ALA 12 18.848 5.173 2.532 76 H ARG 13 HN ARG 13 18.483 1.818 0.211 77 HA ARG 13 HA ARG 13 21.208 2.085 -0.849 78 HB2 ARG 13 HB2 ARG 13 20.639 0.139 0.542 79 HB3 ARG 13 HB1 ARG 13 19.401 -0.341 -0.620 80 HG2 ARG 13 HG2 ARG 13 21.155 -0.543 -2.371 81 HG3 ARG 13 HG1 ARG 13 22.378 -0.138 -1.168 82 HD2 ARG 13 HD2 ARG 13 20.471 -2.475 -0.887 83 HD3 ARG 13 HD1 ARG 13 22.095 -2.618 -1.569 84 HE ARG 13 HE ARG 13 22.276 -1.326 0.972 85 HH11 ARG 13 HH11 ARG 13 20.297 -3.542 1.550 86 HH12 ARG 13 HH12 ARG 13 21.352 -4.839 2.003 87 HH21 ARG 13 HH21 ARG 13 24.188 -3.353 0.673 88 HH22 ARG 13 HH22 ARG 13 23.554 -4.733 1.506 89 H CGU 14 HN GLA 14 17.969 1.896 -2.118 90 HA CGU 14 HA GLA 14 18.308 0.802 -4.634 91 HB2 CGU 14 HB2 GLA 14 16.718 3.077 -4.960 92 HB3 CGU 14 HB3 GLA 14 16.517 2.633 -3.279 93 HG CGU 14 HG GLA 14 15.991 0.329 -3.948 94 H LEU 15 HN LEU 15 19.118 4.101 -3.544 95 HA LEU 15 HA LEU 15 19.810 5.280 -5.982 96 HB2 LEU 15 HB2 LEU 15 21.360 6.688 -4.719 97 HB3 LEU 15 HB1 LEU 15 19.906 6.419 -3.761 98 HG LEU 15 HG LEU 15 21.228 4.379 -2.785 99 HD11 LEU 15 HD11 LEU 15 23.363 4.144 -3.457 100 HD12 LEU 15 HD12 LEU 15 23.727 5.769 -2.875 101 HD13 LEU 15 HD13 LEU 15 23.182 5.528 -4.533 102 HD21 LEU 15 HD21 LEU 15 21.837 7.279 -2.142 103 HD22 LEU 15 HD22 LEU 15 22.279 5.931 -1.094 104 HD23 LEU 15 HD23 LEU 15 20.580 6.273 -1.424 105 H ALA 16 HN ALA 16 21.550 2.869 -4.104 106 HA ALA 16 HA ALA 16 24.086 2.910 -5.262 107 HB1 ALA 16 HB1 ALA 16 22.953 1.268 -3.518 108 HB2 ALA 16 HB2 ALA 16 24.336 0.736 -4.474 109 HB3 ALA 16 HB3 ALA 16 22.703 0.268 -4.950 110 H ASN 17 HN ASN 17 21.064 1.687 -6.643 111 HA ASN 17 HA ASN 17 22.250 0.415 -8.931 112 HB2 ASN 17 HB2 ASN 17 19.907 0.013 -8.200 113 HB3 ASN 17 HB1 ASN 17 19.495 1.661 -8.677 114 HD21 ASN 17 HD21 ASN 17 18.659 1.812 -10.760 115 HD22 ASN 17 HD22 ASN 17 18.995 0.727 -12.031 116 HN1 NH2 18 H1 NH2 18 20.764 3.687 -8.575 117 HN2 NH2 18 H2 NH2 18 21.560 4.356 -9.917 Start of MODEL 4 1 H1 GLY 1 HT1 GLY 1 -0.392 -3.176 4.705 2 H2 GLY 1 HT2 GLY 1 0.641 -2.471 5.854 3 H3 GLY 1 HT3 GLY 1 0.440 -4.157 5.808 4 HA2 GLY 1 HA1 GLY 1 1.714 -4.423 3.931 5 HA3 GLY 1 HA2 GLY 1 1.461 -2.749 3.437 6 H GLU 2 HN GLU 2 2.713 -4.403 6.369 7 HA GLU 2 HA GLU 2 4.474 -2.305 7.124 8 HB2 GLU 2 HB2 GLU 2 4.849 -5.280 7.585 9 HB3 GLU 2 HB1 GLU 2 5.605 -3.980 8.505 10 HG2 GLU 2 HG2 GLU 2 3.369 -3.187 9.212 11 HG3 GLU 2 HG1 GLU 2 2.625 -4.516 8.318 12 H CGU 3 HN GLA 3 4.639 -4.512 4.514 13 HA CGU 3 HA GLA 3 7.443 -4.828 4.187 14 HB2 CGU 3 HB2 GLA 3 5.303 -4.542 2.053 15 HB3 CGU 3 HB3 GLA 3 5.790 -6.054 2.829 16 HG CGU 3 HG GLA 3 7.666 -4.260 1.254 17 H CGU 4 HN GLA 4 5.273 -2.325 2.842 18 HA CGU 4 HA GLA 4 7.241 -0.800 1.514 19 HB2 CGU 4 HB2 GLA 4 4.790 0.249 2.963 20 HB3 CGU 4 HB3 GLA 4 4.790 -0.406 1.325 21 HG CGU 4 HG GLA 4 6.438 1.975 2.240 22 H LEU 5 HN LEU 5 6.249 -0.755 4.926 23 HA LEU 5 HA LEU 5 7.724 1.536 5.726 24 HB2 LEU 5 HB2 LEU 5 6.072 -0.172 7.013 25 HB3 LEU 5 HB1 LEU 5 7.629 -0.763 7.605 26 HG LEU 5 HG LEU 5 6.669 2.112 7.720 27 HD11 LEU 5 HD11 LEU 5 5.951 0.002 9.351 28 HD12 LEU 5 HD12 LEU 5 5.932 1.702 9.824 29 HD13 LEU 5 HD13 LEU 5 7.328 0.695 10.207 30 HD21 LEU 5 HD21 LEU 5 9.015 2.234 7.539 31 HD22 LEU 5 HD22 LEU 5 9.254 0.739 8.444 32 HD23 LEU 5 HD23 LEU 5 8.754 2.206 9.283 33 H ALA 6 HN ALA 6 8.758 -1.711 4.956 34 HA ALA 6 HA ALA 6 11.379 -1.373 6.229 35 HB1 ALA 6 HB1 ALA 6 11.520 -3.491 4.371 36 HB2 ALA 6 HB2 ALA 6 9.875 -3.539 5.007 37 HB3 ALA 6 HB3 ALA 6 11.250 -3.626 6.109 38 H CGU 7 HN GLA 7 10.132 -1.484 2.857 39 HA CGU 7 HA GLA 7 12.514 -1.122 1.448 40 HB2 CGU 7 HB2 GLA 7 11.176 0.136 -0.227 41 HB3 CGU 7 HB3 GLA 7 9.872 0.297 0.950 42 HG CGU 7 HG GLA 7 9.698 -2.178 1.069 43 H ASN 8 HN ASN 8 10.806 1.046 3.519 44 HA ASN 8 HA ASN 8 11.695 3.586 2.980 45 HB2 ASN 8 HB2 ASN 8 10.414 2.460 5.045 46 HB3 ASN 8 HB1 ASN 8 12.007 2.589 5.782 47 HD21 ASN 8 HD21 ASN 8 11.367 4.286 7.250 48 HD22 ASN 8 HD22 ASN 8 11.031 5.868 6.704 49 H GLN 9 HN GLN 9 13.488 1.228 5.000 50 HA GLN 9 HA GLN 9 15.870 2.862 5.068 51 HB2 GLN 9 HB2 GLN 9 16.895 1.061 6.235 52 HB3 GLN 9 HB1 GLN 9 15.203 1.020 6.728 53 HG2 GLN 9 HG2 GLN 9 14.765 -0.715 5.004 54 HG3 GLN 9 HG1 GLN 9 16.478 -0.707 4.587 55 HE21 GLN 9 HE21 GLN 9 14.226 -2.318 6.486 56 HE22 GLN 9 HE22 GLN 9 15.285 -2.973 7.654 57 H CGU 10 HN GLA 10 14.714 0.278 2.968 58 HA CGU 10 HA GLA 10 17.198 -0.219 1.635 59 HB2 CGU 10 HB2 GLA 10 14.382 -0.450 0.544 60 HB3 CGU 10 HB3 GLA 10 15.234 -1.714 1.425 61 HG CGU 10 HG GLA 10 17.031 -1.604 -0.364 62 H PHE 11 HN PHE 11 14.852 2.301 1.372 63 HA PHE 11 HA PHE 11 15.190 3.375 -1.142 64 HB2 PHE 11 HB2 PHE 11 13.948 4.294 0.928 65 HB3 PHE 11 HB1 PHE 11 15.467 5.101 1.307 66 HD1 PHE 11 HD1 PHE 11 16.536 6.577 -0.523 67 HD2 PHE 11 HD2 PHE 11 12.464 5.217 -0.660 68 HE1 PHE 11 HE1 PHE 11 15.996 8.357 -2.166 69 HE2 PHE 11 HE2 PHE 11 11.924 6.997 -2.300 70 HZ PHE 11 HZ PHE 11 13.689 8.566 -3.053 71 H ALA 12 HN ALA 12 17.464 3.651 1.585 72 HA ALA 12 HA ALA 12 19.359 5.340 0.292 73 HB1 ALA 12 HB1 ALA 12 20.156 3.175 2.233 74 HB2 ALA 12 HB2 ALA 12 19.230 4.575 2.774 75 HB3 ALA 12 HB3 ALA 12 20.825 4.797 2.055 76 H ARG 13 HN ARG 13 18.766 1.886 0.062 77 HA ARG 13 HA ARG 13 21.273 1.417 -1.407 78 HB2 ARG 13 HB2 ARG 13 18.900 -0.399 -0.872 79 HB3 ARG 13 HB1 ARG 13 20.416 -0.904 -1.619 80 HG2 ARG 13 HG2 ARG 13 20.259 0.375 1.122 81 HG3 ARG 13 HG1 ARG 13 20.263 -1.370 0.864 82 HD2 ARG 13 HD2 ARG 13 22.413 -0.970 -0.513 83 HD3 ARG 13 HD1 ARG 13 22.452 0.619 0.257 84 HE ARG 13 HE ARG 13 23.198 -0.450 2.212 85 HH11 ARG 13 HH11 ARG 13 21.785 -2.680 0.006 86 HH12 ARG 13 HH12 ARG 13 21.957 -4.043 1.061 87 HH21 ARG 13 HH21 ARG 13 23.313 -2.191 3.662 88 HH22 ARG 13 HH22 ARG 13 22.822 -3.766 3.133 89 H CGU 14 HN GLA 14 17.933 2.154 -2.126 90 HA CGU 14 HA GLA 14 17.652 1.140 -4.707 91 HB2 CGU 14 HB2 GLA 14 16.494 3.658 -4.733 92 HB3 CGU 14 HB3 GLA 14 16.506 3.233 -3.036 93 HG CGU 14 HG GLA 14 15.486 1.037 -3.635 94 H LEU 15 HN LEU 15 19.264 4.111 -3.602 95 HA LEU 15 HA LEU 15 19.843 5.342 -6.045 96 HB2 LEU 15 HB2 LEU 15 21.855 6.255 -4.949 97 HB3 LEU 15 HB1 LEU 15 20.489 6.270 -3.835 98 HG LEU 15 HG LEU 15 21.377 3.900 -3.133 99 HD11 LEU 15 HD11 LEU 15 24.110 4.713 -3.437 100 HD12 LEU 15 HD12 LEU 15 23.355 4.694 -5.030 101 HD13 LEU 15 HD13 LEU 15 23.332 3.246 -4.026 102 HD21 LEU 15 HD21 LEU 15 22.839 4.989 -1.441 103 HD22 LEU 15 HD22 LEU 15 21.315 5.852 -1.648 104 HD23 LEU 15 HD23 LEU 15 22.790 6.480 -2.382 105 H ALA 16 HN ALA 16 21.303 2.488 -4.588 106 HA ALA 16 HA ALA 16 23.606 2.120 -6.093 107 HB1 ALA 16 HB1 ALA 16 23.426 -0.185 -5.626 108 HB2 ALA 16 HB2 ALA 16 21.665 -0.155 -5.710 109 HB3 ALA 16 HB3 ALA 16 22.495 0.565 -4.330 110 H ASN 17 HN ASN 17 20.339 2.173 -7.238 111 HA ASN 17 HA ASN 17 21.021 0.814 -9.767 112 HB2 ASN 17 HB2 ASN 17 18.764 0.591 -8.618 113 HB3 ASN 17 HB1 ASN 17 18.456 2.268 -9.074 114 HD21 ASN 17 HD21 ASN 17 17.264 2.392 -10.975 115 HD22 ASN 17 HD22 ASN 17 17.391 1.303 -12.283 116 HN1 NH2 18 H1 NH2 18 22.105 2.031 -11.313 117 HN2 NH2 18 H2 NH2 18 21.843 3.679 -11.622 Start of MODEL 5 1 H1 GLY 1 HT1 GLY 1 1.455 -3.426 7.686 2 H2 GLY 1 HT2 GLY 1 0.854 -4.504 6.519 3 H3 GLY 1 HT3 GLY 1 0.013 -3.070 6.867 4 HA2 GLY 1 HA1 GLY 1 1.677 -3.351 4.799 5 HA3 GLY 1 HA2 GLY 1 1.314 -1.807 5.570 6 H GLU 2 HN GLU 2 3.294 -4.594 6.622 7 HA GLU 2 HA GLU 2 5.365 -2.798 7.615 8 HB2 GLU 2 HB2 GLU 2 5.161 -5.808 7.379 9 HB3 GLU 2 HB1 GLU 2 6.594 -4.998 8.012 10 HG2 GLU 2 HG2 GLU 2 5.232 -5.557 9.908 11 HG3 GLU 2 HG1 GLU 2 5.068 -3.818 9.663 12 H CGU 3 HN GLA 3 4.663 -4.313 4.614 13 HA CGU 3 HA GLA 3 7.347 -4.585 3.608 14 HB2 CGU 3 HB2 GLA 3 4.758 -4.115 2.093 15 HB3 CGU 3 HB3 GLA 3 5.405 -5.695 2.548 16 HG CGU 3 HG GLA 3 6.825 -3.672 0.783 17 H CGU 4 HN GLA 4 4.959 -1.953 3.507 18 HA CGU 4 HA GLA 4 6.529 -0.219 1.833 19 HB2 CGU 4 HB2 GLA 4 4.530 0.679 3.919 20 HB3 CGU 4 HB3 GLA 4 4.035 -0.018 2.376 21 HG CGU 4 HG GLA 4 5.357 1.742 1.200 22 H LEU 5 HN LEU 5 6.106 -0.383 5.383 23 HA LEU 5 HA LEU 5 7.867 1.742 6.039 24 HB2 LEU 5 HB2 LEU 5 6.296 0.103 7.498 25 HB3 LEU 5 HB1 LEU 5 7.866 -0.649 7.807 26 HG LEU 5 HG LEU 5 7.231 2.291 8.186 27 HD11 LEU 5 HD11 LEU 5 6.312 0.395 9.806 28 HD12 LEU 5 HD12 LEU 5 6.988 1.889 10.458 29 HD13 LEU 5 HD13 LEU 5 7.969 0.425 10.408 30 HD21 LEU 5 HD21 LEU 5 9.714 0.618 8.410 31 HD22 LEU 5 HD22 LEU 5 9.507 1.994 9.495 32 HD23 LEU 5 HD23 LEU 5 9.521 2.241 7.748 33 H ALA 6 HN ALA 6 8.510 -1.520 4.975 34 HA ALA 6 HA ALA 6 11.302 -1.470 5.861 35 HB1 ALA 6 HB1 ALA 6 10.382 -3.646 5.772 36 HB2 ALA 6 HB2 ALA 6 11.387 -3.560 4.325 37 HB3 ALA 6 HB3 ALA 6 9.638 -3.366 4.198 38 H CGU 7 HN GLA 7 9.569 -1.134 2.729 39 HA CGU 7 HA GLA 7 11.732 -0.963 0.970 40 HB2 CGU 7 HB2 GLA 7 10.311 0.894 -0.182 41 HB3 CGU 7 HB3 GLA 7 9.135 0.573 1.093 42 HG CGU 7 HG GLA 7 9.127 -1.829 0.446 43 H ASN 8 HN ASN 8 10.703 1.237 3.434 44 HA ASN 8 HA ASN 8 11.903 3.651 2.929 45 HB2 ASN 8 HB2 ASN 8 10.804 2.494 5.100 46 HB3 ASN 8 HB1 ASN 8 12.497 2.409 5.573 47 HD21 ASN 8 HD21 ASN 8 10.301 4.149 6.667 48 HD22 ASN 8 HD22 ASN 8 10.868 5.751 6.501 49 H GLN 9 HN GLN 9 13.551 0.729 4.181 50 HA GLN 9 HA GLN 9 16.169 2.027 4.073 51 HB2 GLN 9 HB2 GLN 9 16.138 0.440 5.762 52 HB3 GLN 9 HB1 GLN 9 15.114 -0.666 4.848 53 HG2 GLN 9 HG2 GLN 9 17.492 -1.450 5.091 54 HG3 GLN 9 HG1 GLN 9 16.960 -1.294 3.417 55 HE21 GLN 9 HE21 GLN 9 18.731 -0.514 2.250 56 HE22 GLN 9 HE22 GLN 9 19.714 0.792 2.737 57 H CGU 10 HN GLA 10 14.624 -0.684 2.308 58 HA CGU 10 HA GLA 10 16.698 -1.137 0.457 59 HB2 CGU 10 HB2 GLA 10 13.733 -1.290 -0.125 60 HB3 CGU 10 HB3 GLA 10 14.645 -2.545 0.704 61 HG CGU 10 HG GLA 10 15.147 -1.535 -2.110 62 H PHE 11 HN PHE 11 14.717 1.539 0.826 63 HA PHE 11 HA PHE 11 14.870 2.466 -1.944 64 HB2 PHE 11 HB2 PHE 11 12.966 2.967 -0.475 65 HB3 PHE 11 HB1 PHE 11 14.040 3.849 0.606 66 HD1 PHE 11 HD1 PHE 11 15.409 5.806 -0.424 67 HD2 PHE 11 HD2 PHE 11 11.952 4.070 -2.289 68 HE1 PHE 11 HE1 PHE 11 15.136 7.843 -1.813 69 HE2 PHE 11 HE2 PHE 11 11.678 6.105 -3.678 70 HZ PHE 11 HZ PHE 11 13.270 7.992 -3.440 71 H ALA 12 HN ALA 12 16.657 2.941 1.050 72 HA ALA 12 HA ALA 12 18.083 5.297 0.144 73 HB1 ALA 12 HB1 ALA 12 17.774 4.047 2.569 74 HB2 ALA 12 HB2 ALA 12 18.969 5.302 2.235 75 HB3 ALA 12 HB3 ALA 12 19.426 3.600 2.144 76 H ARG 13 HN ARG 13 18.934 1.827 0.333 77 HA ARG 13 HA ARG 13 21.534 2.248 -0.894 78 HB2 ARG 13 HB2 ARG 13 19.880 -0.264 -0.498 79 HB3 ARG 13 HB1 ARG 13 21.544 -0.248 -1.082 80 HG2 ARG 13 HG2 ARG 13 20.891 1.191 1.465 81 HG3 ARG 13 HG1 ARG 13 21.046 -0.565 1.494 82 HD2 ARG 13 HD2 ARG 13 23.279 -0.307 0.349 83 HD3 ARG 13 HD1 ARG 13 23.128 1.438 0.584 84 HE ARG 13 HE ARG 13 22.728 0.231 3.109 85 HH11 ARG 13 HH21 ARG 13 24.884 -1.601 2.078 86 HH12 ARG 13 HH22 ARG 13 26.321 -0.774 2.577 87 HH21 ARG 13 HH11 ARG 13 24.704 2.237 3.162 88 HH22 ARG 13 HH12 ARG 13 26.219 1.399 3.190 89 H CGU 14 HN GLA 14 18.293 1.562 -2.079 90 HA CGU 14 HA GLA 14 18.770 0.546 -4.609 91 HB2 CGU 14 HB2 GLA 14 16.775 2.484 -4.882 92 HB3 CGU 14 HB3 GLA 14 16.703 2.008 -3.199 93 HG CGU 14 HG GLA 14 16.607 -0.353 -3.870 94 H LEU 15 HN LEU 15 19.064 3.899 -3.477 95 HA LEU 15 HA LEU 15 19.391 5.268 -5.885 96 HB2 LEU 15 HB2 LEU 15 20.741 6.872 -4.663 97 HB3 LEU 15 HB1 LEU 15 19.484 6.278 -3.581 98 HG LEU 15 HG LEU 15 21.272 4.487 -2.903 99 HD11 LEU 15 HD11 LEU 15 23.322 4.715 -3.801 100 HD12 LEU 15 HD12 LEU 15 23.434 6.348 -3.146 101 HD13 LEU 15 HD13 LEU 15 22.758 6.088 -4.752 102 HD21 LEU 15 HD21 LEU 15 21.766 7.345 -2.039 103 HD22 LEU 15 HD22 LEU 15 21.935 5.877 -1.076 104 HD23 LEU 15 HD23 LEU 15 20.333 6.444 -1.545 105 H ALA 16 HN ALA 16 21.654 3.105 -4.263 106 HA ALA 16 HA ALA 16 24.043 3.626 -5.600 107 HB1 ALA 16 HB1 ALA 16 22.969 0.830 -5.151 108 HB2 ALA 16 HB2 ALA 16 23.599 1.834 -3.845 109 HB3 ALA 16 HB3 ALA 16 24.656 1.344 -5.169 110 H ASN 17 HN ASN 17 21.231 1.809 -6.797 111 HA ASN 17 HA ASN 17 22.452 0.981 -9.266 112 HB2 ASN 17 HB2 ASN 17 20.429 -0.108 -8.437 113 HB3 ASN 17 HB1 ASN 17 19.537 1.408 -8.550 114 HD21 ASN 17 HD21 ASN 17 18.265 1.485 -10.395 115 HD22 ASN 17 HD22 ASN 17 18.665 0.777 -11.894 116 HN1 NH2 18 H1 NH2 18 21.524 4.087 -8.198 117 HN2 NH2 18 H2 NH2 18 21.431 4.842 -9.715 Start of MODEL 6 1 H1 GLY 1 HT1 GLY 1 1.551 -4.709 3.518 2 H2 GLY 1 HT2 GLY 1 0.520 -4.600 4.863 3 H3 GLY 1 HT3 GLY 1 2.109 -5.171 5.050 4 HA2 GLY 1 HA1 GLY 1 2.004 -2.569 3.848 5 HA3 GLY 1 HA2 GLY 1 1.296 -2.618 5.463 6 H GLU 2 HN GLU 2 3.262 -5.106 5.720 7 HA GLU 2 HA GLU 2 5.313 -3.615 7.134 8 HB2 GLU 2 HB2 GLU 2 5.050 -6.551 6.425 9 HB3 GLU 2 HB1 GLU 2 6.355 -5.898 7.416 10 HG2 GLU 2 HG2 GLU 2 3.414 -5.538 8.055 11 HG3 GLU 2 HG1 GLU 2 4.423 -6.805 8.753 12 H CGU 3 HN GLA 3 4.869 -4.458 3.881 13 HA CGU 3 HA GLA 3 7.684 -4.790 3.184 14 HB2 CGU 3 HB2 GLA 3 5.263 -4.178 1.453 15 HB3 CGU 3 HB3 GLA 3 5.922 -5.785 1.783 16 HG CGU 3 HG GLA 3 7.442 -3.532 0.425 17 H CGU 4 HN GLA 4 5.282 -2.207 2.553 18 HA CGU 4 HA GLA 4 7.180 -0.320 1.559 19 HB2 CGU 4 HB2 GLA 4 4.612 0.330 3.031 20 HB3 CGU 4 HB3 GLA 4 4.662 -0.174 1.340 21 HG CGU 4 HG GLA 4 6.095 2.239 2.503 22 H LEU 5 HN LEU 5 6.369 -1.321 4.795 23 HA LEU 5 HA LEU 5 7.336 1.001 6.186 24 HB2 LEU 5 HB2 LEU 5 6.047 -1.275 6.947 25 HB3 LEU 5 HB1 LEU 5 7.692 -1.638 7.485 26 HG LEU 5 HG LEU 5 6.196 0.915 8.142 27 HD11 LEU 5 HD11 LEU 5 6.147 -0.087 10.461 28 HD12 LEU 5 HD12 LEU 5 6.676 -1.610 9.747 29 HD13 LEU 5 HD13 LEU 5 5.120 -0.916 9.291 30 HD21 LEU 5 HD21 LEU 5 8.170 0.706 9.972 31 HD22 LEU 5 HD22 LEU 5 8.391 1.536 8.431 32 HD23 LEU 5 HD23 LEU 5 8.944 -0.128 8.623 33 H ALA 6 HN ALA 6 8.890 -1.959 5.008 34 HA ALA 6 HA ALA 6 11.469 -1.250 6.206 35 HB1 ALA 6 HB1 ALA 6 11.770 -3.459 5.874 36 HB2 ALA 6 HB2 ALA 6 11.843 -3.158 4.139 37 HB3 ALA 6 HB3 ALA 6 10.303 -3.551 4.901 38 H CGU 7 HN GLA 7 9.970 -1.108 2.958 39 HA CGU 7 HA GLA 7 12.153 -0.375 1.383 40 HB2 CGU 7 HB2 GLA 7 10.509 1.124 0.137 41 HB3 CGU 7 HB3 GLA 7 9.326 0.719 1.383 42 HG CGU 7 HG GLA 7 9.646 -1.698 0.851 43 H ASN 8 HN ASN 8 10.506 1.410 3.848 44 HA ASN 8 HA ASN 8 11.183 4.047 3.551 45 HB2 ASN 8 HB2 ASN 8 10.189 2.598 5.567 46 HB3 ASN 8 HB1 ASN 8 11.837 2.758 6.169 47 HD21 ASN 8 HD21 ASN 8 11.440 4.270 7.838 48 HD22 ASN 8 HD22 ASN 8 10.868 5.853 7.549 49 H GLN 9 HN GLN 9 13.347 1.524 4.898 50 HA GLN 9 HA GLN 9 15.608 3.412 4.857 51 HB2 GLN 9 HB2 GLN 9 16.889 1.591 5.857 52 HB3 GLN 9 HB1 GLN 9 15.346 1.743 6.696 53 HG2 GLN 9 HG2 GLN 9 14.417 -0.118 5.454 54 HG3 GLN 9 HG1 GLN 9 15.854 -0.211 4.435 55 HE21 GLN 9 HE21 GLN 9 17.367 -1.732 5.105 56 HE22 GLN 9 HE22 GLN 9 17.523 -2.319 6.699 57 H CGU 10 HN GLA 10 14.431 0.649 3.003 58 HA CGU 10 HA GLA 10 16.667 -0.035 1.507 59 HB2 CGU 10 HB2 GLA 10 13.912 0.378 0.325 60 HB3 CGU 10 HB3 GLA 10 14.366 -1.039 1.272 61 HG CGU 10 HG GLA 10 16.229 -1.446 -0.374 62 H PHE 11 HN PHE 11 14.791 2.873 1.357 63 HA PHE 11 HA PHE 11 15.399 4.014 -1.075 64 HB2 PHE 11 HB2 PHE 11 14.221 5.010 0.974 65 HB3 PHE 11 HB1 PHE 11 15.827 5.495 1.514 66 HD1 PHE 11 HD1 PHE 11 13.638 5.636 -1.534 67 HD2 PHE 11 HD2 PHE 11 16.685 7.554 0.810 68 HE1 PHE 11 HE1 PHE 11 13.555 7.606 -3.038 69 HE2 PHE 11 HE2 PHE 11 16.601 9.524 -0.693 70 HZ PHE 11 HZ PHE 11 15.037 9.551 -2.617 71 H ALA 12 HN ALA 12 17.629 3.267 1.522 72 HA ALA 12 HA ALA 12 19.798 4.918 0.531 73 HB1 ALA 12 HB1 ALA 12 21.058 3.022 2.010 74 HB2 ALA 12 HB2 ALA 12 19.422 2.880 2.650 75 HB3 ALA 12 HB3 ALA 12 20.262 4.429 2.714 76 H ARG 13 HN ARG 13 18.741 1.592 -0.019 77 HA ARG 13 HA ARG 13 21.170 0.978 -1.564 78 HB2 ARG 13 HB2 ARG 13 18.702 -0.548 -0.775 79 HB3 ARG 13 HB1 ARG 13 19.725 -1.154 -2.078 80 HG2 ARG 13 HG2 ARG 13 20.972 -0.321 0.529 81 HG3 ARG 13 HG1 ARG 13 20.210 -1.906 0.390 82 HD2 ARG 13 HD2 ARG 13 22.464 -2.307 -0.202 83 HD3 ARG 13 HD1 ARG 13 21.631 -2.186 -1.755 84 HE ARG 13 HE ARG 13 22.960 -0.301 -2.201 85 HH11 ARG 13 HH21 ARG 13 23.458 -1.289 1.003 86 HH12 ARG 13 HH22 ARG 13 24.142 0.212 1.530 87 HH21 ARG 13 HH11 ARG 13 23.498 1.860 -1.453 88 HH22 ARG 13 HH12 ARG 13 24.167 1.994 0.140 89 H CGU 14 HN GLA 14 17.859 2.005 -2.179 90 HA CGU 14 HA GLA 14 17.474 1.295 -4.816 91 HB2 CGU 14 HB2 GLA 14 16.670 3.963 -4.595 92 HB3 CGU 14 HB3 GLA 14 16.570 3.333 -2.965 93 HG CGU 14 HG GLA 14 15.256 1.422 -3.796 94 H LEU 15 HN LEU 15 19.477 3.939 -3.534 95 HA LEU 15 HA LEU 15 20.164 5.205 -5.956 96 HB2 LEU 15 HB2 LEU 15 22.195 5.951 -4.814 97 HB3 LEU 15 HB1 LEU 15 20.842 5.997 -3.685 98 HG LEU 15 HG LEU 15 21.626 3.516 -3.155 99 HD11 LEU 15 HD11 LEU 15 23.672 2.915 -3.895 100 HD12 LEU 15 HD12 LEU 15 24.375 4.454 -3.403 101 HD13 LEU 15 HD13 LEU 15 23.600 4.304 -4.979 102 HD21 LEU 15 HD21 LEU 15 23.001 4.430 -1.321 103 HD22 LEU 15 HD22 LEU 15 21.545 5.397 -1.550 104 HD23 LEU 15 HD23 LEU 15 23.094 5.980 -2.157 105 H ALA 16 HN ALA 16 21.279 2.176 -4.565 106 HA ALA 16 HA ALA 16 23.586 1.601 -5.986 107 HB1 ALA 16 HB1 ALA 16 23.034 -0.717 -5.770 108 HB2 ALA 16 HB2 ALA 16 21.305 -0.375 -5.764 109 HB3 ALA 16 HB3 ALA 16 22.298 0.080 -4.380 110 H ASN 17 HN ASN 17 20.240 1.401 -7.179 111 HA ASN 17 HA ASN 17 20.893 0.394 -9.779 112 HB2 ASN 17 HB2 ASN 17 18.603 0.332 -8.912 113 HB3 ASN 17 HB1 ASN 17 18.551 2.094 -8.869 114 HD21 ASN 17 HD21 ASN 17 17.431 2.915 -10.628 115 HD22 ASN 17 HD22 ASN 17 17.438 2.245 -12.198 116 HN1 NH2 18 H1 NH2 18 22.910 2.100 -9.724 117 HN2 NH2 18 H2 NH2 18 22.621 3.525 -10.599 Start of MODEL 7 1 H1 GLY 1 HT1 GLY 1 1.499 0.163 8.216 2 H2 GLY 1 HT2 GLY 1 2.545 -1.083 8.707 3 H3 GLY 1 HT3 GLY 1 1.157 -1.444 7.796 4 HA2 GLY 1 HA1 GLY 1 2.126 -0.961 5.857 5 HA3 GLY 1 HA2 GLY 1 2.923 0.457 6.537 6 H GLU 2 HN GLU 2 3.078 -2.942 7.600 7 HA GLU 2 HA GLU 2 5.773 -3.008 8.265 8 HB2 GLU 2 HB2 GLU 2 4.087 -5.194 7.015 9 HB3 GLU 2 HB1 GLU 2 5.684 -5.467 7.713 10 HG2 GLU 2 HG2 GLU 2 4.826 -4.439 9.857 11 HG3 GLU 2 HG1 GLU 2 3.214 -4.449 9.142 12 H CGU 3 HN GLA 3 4.503 -4.096 5.079 13 HA CGU 3 HA GLA 3 6.951 -4.454 3.784 14 HB2 CGU 3 HB2 GLA 3 4.390 -3.283 2.653 15 HB3 CGU 3 HB3 GLA 3 4.862 -4.987 2.657 16 HG CGU 3 HG GLA 3 6.315 -2.736 1.222 17 H CGU 4 HN GLA 4 5.054 -1.413 3.856 18 HA CGU 4 HA GLA 4 7.008 0.199 2.572 19 HB2 CGU 4 HB2 GLA 4 5.048 1.039 4.731 20 HB3 CGU 4 HB3 GLA 4 4.665 0.920 3.014 21 HG CGU 4 HG GLA 4 6.821 2.699 4.202 22 H LEU 5 HN LEU 5 6.707 -0.871 5.915 23 HA LEU 5 HA LEU 5 8.560 0.921 7.114 24 HB2 LEU 5 HB2 LEU 5 7.018 -1.097 8.053 25 HB3 LEU 5 HB1 LEU 5 8.590 -1.905 8.027 26 HG LEU 5 HG LEU 5 7.986 0.743 9.373 27 HD11 LEU 5 HD11 LEU 5 7.173 -0.674 10.962 28 HD12 LEU 5 HD12 LEU 5 8.878 -0.967 11.306 29 HD13 LEU 5 HD13 LEU 5 7.985 -2.076 10.264 30 HD21 LEU 5 HD21 LEU 5 10.247 0.861 8.709 31 HD22 LEU 5 HD22 LEU 5 10.504 -0.865 8.959 32 HD23 LEU 5 HD23 LEU 5 10.342 0.213 10.346 33 H ALA 6 HN ALA 6 9.014 -2.046 5.258 34 HA ALA 6 HA ALA 6 11.912 -2.061 5.752 35 HB1 ALA 6 HB1 ALA 6 10.506 -3.662 3.612 36 HB2 ALA 6 HB2 ALA 6 10.366 -4.115 5.310 37 HB3 ALA 6 HB3 ALA 6 11.949 -4.083 4.534 38 H CGU 7 HN GLA 7 9.706 -1.316 3.015 39 HA CGU 7 HA GLA 7 11.551 -0.814 0.985 40 HB2 CGU 7 HB2 GLA 7 9.978 0.954 0.178 41 HB3 CGU 7 HB3 GLA 7 9.124 0.860 1.718 42 HG CGU 7 HG GLA 7 8.588 -1.498 1.301 43 H ASN 8 HN ASN 8 10.930 0.954 3.886 44 HA ASN 8 HA ASN 8 12.004 3.456 3.576 45 HB2 ASN 8 HB2 ASN 8 11.277 1.997 5.698 46 HB3 ASN 8 HB1 ASN 8 13.020 1.809 5.856 47 HD21 ASN 8 HD21 ASN 8 13.293 3.181 7.685 48 HD22 ASN 8 HD22 ASN 8 13.006 4.864 7.630 49 H GLN 9 HN GLN 9 13.906 0.464 4.135 50 HA GLN 9 HA GLN 9 16.413 1.925 3.700 51 HB2 GLN 9 HB2 GLN 9 17.520 -0.141 4.199 52 HB3 GLN 9 HB1 GLN 9 16.152 -0.028 5.305 53 HG2 GLN 9 HG2 GLN 9 14.820 -1.466 3.797 54 HG3 GLN 9 HG1 GLN 9 16.201 -1.594 2.708 55 HE21 GLN 9 HE21 GLN 9 17.586 -1.437 5.700 56 HE22 GLN 9 HE22 GLN 9 17.670 -3.099 6.074 57 H CGU 10 HN GLA 10 14.329 -0.270 1.873 58 HA CGU 10 HA GLA 10 16.136 -0.787 -0.268 59 HB2 CGU 10 HB2 GLA 10 13.136 -0.530 -0.491 60 HB3 CGU 10 HB3 GLA 10 13.944 -1.972 0.120 61 HG CGU 10 HG GLA 10 14.361 -0.749 -2.623 62 H PHE 11 HN PHE 11 14.357 1.981 0.608 63 HA PHE 11 HA PHE 11 14.483 3.225 -2.038 64 HB2 PHE 11 HB2 PHE 11 12.620 3.671 -0.577 65 HB3 PHE 11 HB1 PHE 11 13.701 4.210 0.702 66 HD1 PHE 11 HD1 PHE 11 13.344 4.916 -2.976 67 HD2 PHE 11 HD2 PHE 11 13.711 6.521 0.992 68 HE1 PHE 11 HE1 PHE 11 13.306 7.218 -3.902 69 HE2 PHE 11 HE2 PHE 11 13.674 8.821 0.066 70 HZ PHE 11 HZ PHE 11 13.471 9.169 -2.380 71 H ALA 12 HN ALA 12 16.292 3.341 0.992 72 HA ALA 12 HA ALA 12 17.870 5.655 0.174 73 HB1 ALA 12 HB1 ALA 12 17.726 5.441 2.507 74 HB2 ALA 12 HB2 ALA 12 19.330 4.790 2.164 75 HB3 ALA 12 HB3 ALA 12 17.977 3.696 2.456 76 H ARG 13 HN ARG 13 18.249 2.138 0.093 77 HA ARG 13 HA ARG 13 21.008 2.366 -0.906 78 HB2 ARG 13 HB2 ARG 13 20.247 0.497 0.606 79 HB3 ARG 13 HB1 ARG 13 19.271 -0.109 -0.734 80 HG2 ARG 13 HG2 ARG 13 21.355 -0.188 -2.134 81 HG3 ARG 13 HG1 ARG 13 22.281 0.235 -0.693 82 HD2 ARG 13 HD2 ARG 13 21.444 -1.778 0.449 83 HD3 ARG 13 HD1 ARG 13 20.501 -2.204 -0.984 84 HE ARG 13 HE ARG 13 23.236 -1.869 -1.742 85 HH11 ARG 13 HH11 ARG 13 20.886 -4.035 -0.519 86 HH12 ARG 13 HH12 ARG 13 21.945 -5.406 -0.511 87 HH21 ARG 13 HH21 ARG 13 24.734 -3.592 -1.488 88 HH22 ARG 13 HH22 ARG 13 24.122 -5.155 -1.063 89 H CGU 14 HN GLA 14 17.796 2.081 -2.248 90 HA CGU 14 HA GLA 14 18.175 0.838 -4.670 91 HB2 CGU 14 HB2 GLA 14 16.676 3.142 -5.200 92 HB3 CGU 14 HB3 GLA 14 16.400 2.803 -3.505 93 HG CGU 14 HG GLA 14 15.878 0.449 -4.097 94 H LEU 15 HN LEU 15 18.970 4.222 -3.855 95 HA LEU 15 HA LEU 15 19.827 5.144 -6.347 96 HB2 LEU 15 HB2 LEU 15 21.756 6.190 -4.700 97 HB3 LEU 15 HB1 LEU 15 20.129 6.851 -4.867 98 HG LEU 15 HG LEU 15 20.694 4.636 -2.899 99 HD11 LEU 15 HD11 LEU 15 21.410 7.527 -2.728 100 HD12 LEU 15 HD12 LEU 15 22.173 6.134 -1.963 101 HD13 LEU 15 HD13 LEU 15 20.679 6.794 -1.299 102 HD21 LEU 15 HD21 LEU 15 18.405 6.048 -3.754 103 HD22 LEU 15 HD22 LEU 15 18.787 6.694 -2.157 104 HD23 LEU 15 HD23 LEU 15 18.524 4.964 -2.368 105 H ALA 16 HN ALA 16 21.437 2.908 -4.156 106 HA ALA 16 HA ALA 16 24.043 2.839 -5.092 107 HB1 ALA 16 HB1 ALA 16 24.040 0.419 -4.577 108 HB2 ALA 16 HB2 ALA 16 22.278 0.433 -4.534 109 HB3 ALA 16 HB3 ALA 16 23.197 1.335 -3.329 110 H ASN 17 HN ASN 17 21.148 1.761 -6.772 111 HA ASN 17 HA ASN 17 22.738 1.541 -9.254 112 HB2 ASN 17 HB2 ASN 17 21.067 -0.730 -8.136 113 HB3 ASN 17 HB1 ASN 17 21.693 -0.678 -9.785 114 HD21 ASN 17 HD21 ASN 17 22.402 -1.895 -6.751 115 HD22 ASN 17 HD22 ASN 17 24.097 -2.026 -6.902 116 HN1 NH2 18 H1 NH2 18 19.516 1.466 -7.699 117 HN2 NH2 18 H2 NH2 18 18.683 2.129 -9.021 Start of MODEL 8 1 H1 GLY 1 HT1 GLY 1 1.198 -0.435 5.156 2 H2 GLY 1 HT2 GLY 1 1.378 -1.297 6.608 3 H3 GLY 1 HT3 GLY 1 -0.008 -1.520 5.651 4 HA2 GLY 1 HA1 GLY 1 1.116 -3.342 4.969 5 HA3 GLY 1 HA2 GLY 1 1.811 -2.163 3.859 6 H GLU 2 HN GLU 2 2.505 -4.382 6.345 7 HA GLU 2 HA GLU 2 4.873 -3.210 7.458 8 HB2 GLU 2 HB2 GLU 2 5.445 -5.566 8.078 9 HB3 GLU 2 HB1 GLU 2 3.798 -5.123 8.527 10 HG2 GLU 2 HG2 GLU 2 3.002 -6.146 6.376 11 HG3 GLU 2 HG1 GLU 2 4.647 -6.715 6.092 12 H CGU 3 HN GLA 3 4.244 -4.079 4.314 13 HA CGU 3 HA GLA 3 6.959 -5.084 3.713 14 HB2 CGU 3 HB2 GLA 3 4.586 -4.488 1.917 15 HB3 CGU 3 HB3 GLA 3 5.070 -6.080 2.510 16 HG CGU 3 HG GLA 3 6.800 -4.282 0.779 17 H CGU 4 HN GLA 4 5.023 -2.163 3.379 18 HA CGU 4 HA GLA 4 7.026 -0.818 1.720 19 HB2 CGU 4 HB2 GLA 4 4.644 0.330 3.208 20 HB3 CGU 4 HB3 GLA 4 4.599 -0.287 1.556 21 HG CGU 4 HG GLA 4 6.415 1.389 0.989 22 H LEU 5 HN LEU 5 6.273 -1.089 5.137 23 HA LEU 5 HA LEU 5 7.659 1.206 6.085 24 HB2 LEU 5 HB2 LEU 5 6.228 -0.761 7.279 25 HB3 LEU 5 HB1 LEU 5 7.866 -1.274 7.699 26 HG LEU 5 HG LEU 5 6.797 1.528 8.136 27 HD11 LEU 5 HD11 LEU 5 6.599 -0.943 9.732 28 HD12 LEU 5 HD12 LEU 5 5.663 0.548 9.845 29 HD13 LEU 5 HD13 LEU 5 7.245 0.439 10.617 30 HD21 LEU 5 HD21 LEU 5 9.415 0.185 8.438 31 HD22 LEU 5 HD22 LEU 5 8.915 1.152 9.826 32 HD23 LEU 5 HD23 LEU 5 9.046 1.897 8.233 33 H ALA 6 HN ALA 6 8.823 -1.928 4.993 34 HA ALA 6 HA ALA 6 11.531 -1.444 6.024 35 HB1 ALA 6 HB1 ALA 6 10.957 -3.523 3.943 36 HB2 ALA 6 HB2 ALA 6 10.258 -3.735 5.547 37 HB3 ALA 6 HB3 ALA 6 12.007 -3.612 5.357 38 H CGU 7 HN GLA 7 9.869 -1.285 2.854 39 HA CGU 7 HA GLA 7 12.058 -0.911 1.158 40 HB2 CGU 7 HB2 GLA 7 10.611 0.579 -0.193 41 HB3 CGU 7 HB3 GLA 7 9.494 0.724 1.166 42 HG CGU 7 HG GLA 7 9.001 -1.654 1.078 43 H ASN 8 HN ASN 8 10.700 1.202 3.562 44 HA ASN 8 HA ASN 8 11.805 3.681 3.137 45 HB2 ASN 8 HB2 ASN 8 10.582 2.471 5.219 46 HB3 ASN 8 HB1 ASN 8 12.230 2.492 5.835 47 HD21 ASN 8 HD21 ASN 8 12.021 4.153 7.378 48 HD22 ASN 8 HD22 ASN 8 11.616 5.763 6.979 49 H GLN 9 HN GLN 9 13.488 0.898 4.651 50 HA GLN 9 HA GLN 9 16.018 2.250 4.878 51 HB2 GLN 9 HB2 GLN 9 16.882 0.199 5.598 52 HB3 GLN 9 HB1 GLN 9 15.174 0.033 6.006 53 HG2 GLN 9 HG2 GLN 9 14.830 -1.089 3.772 54 HG3 GLN 9 HG1 GLN 9 16.580 -1.072 3.557 55 HE21 GLN 9 HE21 GLN 9 16.400 -1.395 6.781 56 HE22 GLN 9 HE22 GLN 9 16.312 -3.093 6.928 57 H CGU 10 HN GLA 10 14.713 -0.025 2.450 58 HA CGU 10 HA GLA 10 16.965 -0.257 0.816 59 HB2 CGU 10 HB2 GLA 10 14.043 -0.426 0.380 60 HB3 CGU 10 HB3 GLA 10 15.307 -1.558 -0.081 61 HG CGU 10 HG GLA 10 15.984 0.177 -1.862 62 H PHE 11 HN PHE 11 14.628 2.304 0.979 63 HA PHE 11 HA PHE 11 15.080 3.878 -1.191 64 HB2 PHE 11 HB2 PHE 11 13.661 4.304 0.875 65 HB3 PHE 11 HB1 PHE 11 15.105 5.019 1.588 66 HD1 PHE 11 HD1 PHE 11 13.026 5.168 -1.528 67 HD2 PHE 11 HD2 PHE 11 15.568 7.288 1.209 68 HE1 PHE 11 HE1 PHE 11 12.589 7.277 -2.756 69 HE2 PHE 11 HE2 PHE 11 15.130 9.399 -0.018 70 HZ PHE 11 HZ PHE 11 13.640 9.393 -2.000 71 H ALA 12 HN ALA 12 17.441 3.303 1.351 72 HA ALA 12 HA ALA 12 19.106 5.576 0.572 73 HB1 ALA 12 HB1 ALA 12 20.191 5.143 2.499 74 HB2 ALA 12 HB2 ALA 12 20.466 3.459 2.055 75 HB3 ALA 12 HB3 ALA 12 18.944 3.936 2.806 76 H ARG 13 HN ARG 13 19.473 2.033 0.260 77 HA ARG 13 HA ARG 13 21.820 2.324 -1.468 78 HB2 ARG 13 HB2 ARG 13 20.141 0.047 -0.479 79 HB3 ARG 13 HB1 ARG 13 21.353 -0.204 -1.733 80 HG2 ARG 13 HG2 ARG 13 21.980 1.124 0.916 81 HG3 ARG 13 HG1 ARG 13 22.167 -0.609 0.649 82 HD2 ARG 13 HD2 ARG 13 23.548 0.160 -1.460 83 HD3 ARG 13 HD1 ARG 13 23.705 1.670 -0.557 84 HE ARG 13 HE ARG 13 24.361 -0.439 1.216 85 HH11 ARG 13 HH21 ARG 13 25.561 -1.214 -1.557 86 HH12 ARG 13 HH22 ARG 13 27.176 -0.624 -1.356 87 HH21 ARG 13 HH11 ARG 13 26.413 1.290 1.433 88 HH22 ARG 13 HH12 ARG 13 27.659 0.792 0.340 89 H CGU 14 HN GLA 14 18.401 1.945 -1.898 90 HA CGU 14 HA GLA 14 18.127 0.696 -4.337 91 HB2 CGU 14 HB2 GLA 14 16.539 2.137 -2.681 92 HB3 CGU 14 HB3 GLA 14 16.022 1.590 -4.271 93 HG CGU 14 HG GLA 14 17.400 4.212 -3.759 94 H LEU 15 HN LEU 15 19.064 4.033 -3.725 95 HA LEU 15 HA LEU 15 19.252 4.974 -6.383 96 HB2 LEU 15 HB2 LEU 15 20.830 6.628 -5.548 97 HB3 LEU 15 HB1 LEU 15 19.595 6.363 -4.319 98 HG LEU 15 HG LEU 15 21.241 4.561 -3.393 99 HD11 LEU 15 HD11 LEU 15 23.574 6.042 -4.078 100 HD12 LEU 15 HD12 LEU 15 22.756 5.640 -5.586 101 HD13 LEU 15 HD13 LEU 15 23.210 4.360 -4.463 102 HD21 LEU 15 HD21 LEU 15 22.277 6.239 -1.971 103 HD22 LEU 15 HD22 LEU 15 20.623 6.743 -2.316 104 HD23 LEU 15 HD23 LEU 15 21.969 7.498 -3.168 105 H ALA 16 HN ALA 16 21.349 2.832 -4.581 106 HA ALA 16 HA ALA 16 23.729 2.869 -6.005 107 HB1 ALA 16 HB1 ALA 16 23.330 1.343 -4.121 108 HB2 ALA 16 HB2 ALA 16 23.892 0.435 -5.524 109 HB3 ALA 16 HB3 ALA 16 22.182 0.422 -5.092 110 H ASN 17 HN ASN 17 20.659 1.371 -6.989 111 HA ASN 17 HA ASN 17 21.711 0.197 -9.407 112 HB2 ASN 17 HB2 ASN 17 19.613 -0.594 -8.410 113 HB3 ASN 17 HB1 ASN 17 18.875 0.985 -8.675 114 HD21 ASN 17 HD21 ASN 17 20.910 0.494 -11.273 115 HD22 ASN 17 HD22 ASN 17 19.797 -0.196 -12.367 116 HN1 NH2 18 H1 NH2 18 19.037 2.472 -9.777 117 HN2 NH2 18 H2 NH2 18 19.836 3.522 -10.843 Start of MODEL 9 1 H1 GLY 1 HT1 GLY 1 0.453 -3.289 7.780 2 H2 GLY 1 HT2 GLY 1 1.436 -4.669 7.919 3 H3 GLY 1 HT3 GLY 1 -0.071 -4.770 7.141 4 HA2 GLY 1 HA1 GLY 1 1.557 -4.741 5.442 5 HA3 GLY 1 HA2 GLY 1 0.774 -3.161 5.453 6 H GLU 2 HN GLU 2 3.494 -4.818 7.093 7 HA GLU 2 HA GLU 2 4.898 -2.298 7.519 8 HB2 GLU 2 HB2 GLU 2 5.803 -5.179 7.819 9 HB3 GLU 2 HB1 GLU 2 6.746 -3.776 8.320 10 HG2 GLU 2 HG2 GLU 2 5.624 -4.483 10.290 11 HG3 GLU 2 HG1 GLU 2 4.690 -3.102 9.712 12 H CGU 3 HN GLA 3 4.300 -3.850 4.747 13 HA CGU 3 HA GLA 3 6.759 -4.315 3.460 14 HB2 CGU 3 HB2 GLA 3 4.217 -3.116 2.317 15 HB3 CGU 3 HB3 GLA 3 4.628 -4.833 2.385 16 HG CGU 3 HG GLA 3 6.118 -2.688 0.836 17 H CGU 4 HN GLA 4 4.906 -1.240 3.534 18 HA CGU 4 HA GLA 4 6.868 0.315 2.180 19 HB2 CGU 4 HB2 GLA 4 4.978 1.275 4.351 20 HB3 CGU 4 HB3 GLA 4 4.512 1.046 2.665 21 HG CGU 4 HG GLA 4 6.386 2.633 2.039 22 H LEU 5 HN LEU 5 6.470 -0.474 5.617 23 HA LEU 5 HA LEU 5 8.392 1.242 6.734 24 HB2 LEU 5 HB2 LEU 5 6.824 -0.669 7.763 25 HB3 LEU 5 HB1 LEU 5 8.333 -1.587 7.684 26 HG LEU 5 HG LEU 5 7.999 1.119 9.005 27 HD11 LEU 5 HD11 LEU 5 6.959 -0.344 10.491 28 HD12 LEU 5 HD12 LEU 5 8.634 -0.435 11.039 29 HD13 LEU 5 HD13 LEU 5 7.971 -1.708 10.013 30 HD21 LEU 5 HD21 LEU 5 10.315 0.324 9.945 31 HD22 LEU 5 HD22 LEU 5 10.245 1.024 8.328 32 HD23 LEU 5 HD23 LEU 5 10.330 -0.725 8.527 33 H ALA 6 HN ALA 6 8.855 -1.895 5.119 34 HA ALA 6 HA ALA 6 11.743 -1.838 5.590 35 HB1 ALA 6 HB1 ALA 6 10.608 -3.594 3.468 36 HB2 ALA 6 HB2 ALA 6 10.014 -3.863 5.107 37 HB3 ALA 6 HB3 ALA 6 11.740 -3.981 4.764 38 H CGU 7 HN GLA 7 9.579 -1.299 2.770 39 HA CGU 7 HA GLA 7 11.470 -0.915 0.752 40 HB2 CGU 7 HB2 GLA 7 9.895 0.849 -0.153 41 HB3 CGU 7 HB3 GLA 7 8.970 0.706 1.343 42 HG CGU 7 HG GLA 7 8.692 -1.737 0.878 43 H ASN 8 HN ASN 8 10.735 1.044 3.512 44 HA ASN 8 HA ASN 8 11.829 3.524 3.064 45 HB2 ASN 8 HB2 ASN 8 11.008 2.223 5.254 46 HB3 ASN 8 HB1 ASN 8 12.741 2.035 5.492 47 HD21 ASN 8 HD21 ASN 8 13.178 3.545 7.106 48 HD22 ASN 8 HD22 ASN 8 12.820 5.212 6.985 49 H GLN 9 HN GLN 9 13.684 0.599 3.984 50 HA GLN 9 HA GLN 9 16.239 1.937 3.635 51 HB2 GLN 9 HB2 GLN 9 15.398 -0.331 4.943 52 HB3 GLN 9 HB1 GLN 9 16.219 -1.004 3.535 53 HG2 GLN 9 HG2 GLN 9 18.248 0.186 4.052 54 HG3 GLN 9 HG1 GLN 9 17.441 1.122 5.311 55 HE21 GLN 9 HE21 GLN 9 17.783 0.326 7.386 56 HE22 GLN 9 HE22 GLN 9 18.128 -1.302 7.766 57 H CGU 10 HN GLA 10 14.454 -0.543 1.768 58 HA CGU 10 HA GLA 10 16.295 -0.926 -0.298 59 HB2 CGU 10 HB2 GLA 10 13.283 -0.769 -0.520 60 HB3 CGU 10 HB3 GLA 10 14.218 -2.213 -0.145 61 HG CGU 10 HG GLA 10 14.390 -0.616 -2.715 62 H PHE 11 HN PHE 11 14.450 1.824 0.443 63 HA PHE 11 HA PHE 11 14.699 3.051 -2.200 64 HB2 PHE 11 HB2 PHE 11 12.816 3.488 -0.668 65 HB3 PHE 11 HB1 PHE 11 13.941 4.198 0.486 66 HD1 PHE 11 HD1 PHE 11 13.232 4.467 -3.198 67 HD2 PHE 11 HD2 PHE 11 14.031 6.530 0.483 68 HE1 PHE 11 HE1 PHE 11 13.064 6.642 -4.380 69 HE2 PHE 11 HE2 PHE 11 13.862 8.703 -0.696 70 HZ PHE 11 HZ PHE 11 13.379 8.759 -3.128 71 H ALA 12 HN ALA 12 16.351 3.236 0.931 72 HA ALA 12 HA ALA 12 18.047 5.461 0.171 73 HB1 ALA 12 HB1 ALA 12 18.016 3.467 2.418 74 HB2 ALA 12 HB2 ALA 12 17.879 5.224 2.490 75 HB3 ALA 12 HB3 ALA 12 19.443 4.473 2.169 76 H ARG 13 HN ARG 13 18.355 1.928 0.082 77 HA ARG 13 HA ARG 13 21.129 2.066 -0.854 78 HB2 ARG 13 HB2 ARG 13 20.358 0.150 0.499 79 HB3 ARG 13 HB1 ARG 13 19.198 -0.270 -0.762 80 HG2 ARG 13 HG2 ARG 13 20.977 -0.699 -2.347 81 HG3 ARG 13 HG1 ARG 13 22.189 -0.094 -1.215 82 HD2 ARG 13 HD2 ARG 13 21.649 -1.913 0.352 83 HD3 ARG 13 HD1 ARG 13 20.424 -2.519 -0.767 84 HE ARG 13 HE ARG 13 22.853 -2.391 -2.204 85 HH11 ARG 13 HH11 ARG 13 21.084 -4.840 -1.674 86 HH12 ARG 13 HH12 ARG 13 22.211 -5.890 -0.880 87 HH21 ARG 13 HH21 ARG 13 24.500 -3.370 -0.222 88 HH22 ARG 13 HH22 ARG 13 24.146 -5.058 -0.061 89 H CGU 14 HN GLA 14 17.943 1.996 -2.286 90 HA CGU 14 HA GLA 14 18.371 0.916 -4.791 91 HB2 CGU 14 HB2 GLA 14 16.905 3.265 -5.182 92 HB3 CGU 14 HB3 GLA 14 16.589 2.817 -3.520 93 HG CGU 14 HG GLA 14 15.964 0.563 -4.222 94 H LEU 15 HN LEU 15 19.305 4.117 -3.571 95 HA LEU 15 HA LEU 15 20.179 5.321 -5.956 96 HB2 LEU 15 HB2 LEU 15 21.607 6.707 -4.585 97 HB3 LEU 15 HB1 LEU 15 20.153 6.366 -3.648 98 HG LEU 15 HG LEU 15 21.531 4.306 -2.776 99 HD11 LEU 15 HD11 LEU 15 23.451 5.576 -4.439 100 HD12 LEU 15 HD12 LEU 15 23.701 4.207 -3.358 101 HD13 LEU 15 HD13 LEU 15 23.962 5.851 -2.774 102 HD21 LEU 15 HD21 LEU 15 22.227 5.618 -0.881 103 HD22 LEU 15 HD22 LEU 15 20.744 6.349 -1.494 104 HD23 LEU 15 HD23 LEU 15 22.305 7.087 -1.854 105 H ALA 16 HN ALA 16 21.681 2.791 -4.031 106 HA ALA 16 HA ALA 16 24.306 2.757 -4.900 107 HB1 ALA 16 HB1 ALA 16 24.158 0.249 -4.798 108 HB2 ALA 16 HB2 ALA 16 22.408 0.405 -4.639 109 HB3 ALA 16 HB3 ALA 16 23.467 1.050 -3.385 110 H ASN 17 HN ASN 17 21.443 2.160 -6.805 111 HA ASN 17 HA ASN 17 23.133 1.327 -9.115 112 HB2 ASN 17 HB2 ASN 17 21.259 -0.160 -8.690 113 HB3 ASN 17 HB1 ASN 17 20.137 1.201 -8.666 114 HD21 ASN 17 HD21 ASN 17 21.277 -1.239 -10.663 115 HD22 ASN 17 HD22 ASN 17 20.939 -0.526 -12.175 116 HN1 NH2 18 H1 NH2 18 20.245 3.447 -8.598 117 HN2 NH2 18 H2 NH2 18 20.749 4.642 -9.692 Start of MODEL 10 1 H1 GLY 1 HT1 GLY 1 2.132 -3.924 4.973 2 H2 GLY 1 HT2 GLY 1 1.529 -2.639 4.039 3 H3 GLY 1 HT3 GLY 1 0.681 -3.166 5.413 4 HA2 GLY 1 HA1 GLY 1 2.464 -1.107 5.323 5 HA3 GLY 1 HA2 GLY 1 1.870 -1.904 6.781 6 H GLU 2 HN GLU 2 3.057 -4.200 7.044 7 HA GLU 2 HA GLU 2 5.668 -3.792 7.863 8 HB2 GLU 2 HB2 GLU 2 5.988 -6.188 7.797 9 HB3 GLU 2 HB1 GLU 2 4.303 -5.888 8.224 10 HG2 GLU 2 HG2 GLU 2 4.156 -7.549 6.557 11 HG3 GLU 2 HG1 GLU 2 3.849 -6.053 5.673 12 H CGU 3 HN GLA 3 4.515 -4.012 4.617 13 HA CGU 3 HA GLA 3 7.150 -4.615 3.473 14 HB2 CGU 3 HB2 GLA 3 4.610 -3.664 2.114 15 HB3 CGU 3 HB3 GLA 3 5.047 -5.357 2.366 16 HG CGU 3 HG GLA 3 6.716 -3.347 0.819 17 H CGU 4 HN GLA 4 4.936 -1.794 3.446 18 HA CGU 4 HA GLA 4 6.717 -0.003 2.154 19 HB2 CGU 4 HB2 GLA 4 4.736 0.749 4.322 20 HB3 CGU 4 HB3 GLA 4 4.265 0.398 2.658 21 HG CGU 4 HG GLA 4 5.951 2.184 1.948 22 H LEU 5 HN LEU 5 6.243 -0.625 5.644 23 HA LEU 5 HA LEU 5 8.069 1.206 6.700 24 HB2 LEU 5 HB2 LEU 5 6.575 -0.712 7.808 25 HB3 LEU 5 HB1 LEU 5 8.119 -1.573 7.793 26 HG LEU 5 HG LEU 5 7.710 1.199 8.943 27 HD11 LEU 5 HD11 LEU 5 8.404 -0.510 11.006 28 HD12 LEU 5 HD12 LEU 5 7.286 -1.484 10.051 29 HD13 LEU 5 HD13 LEU 5 6.777 0.084 10.679 30 HD21 LEU 5 HD21 LEU 5 10.042 -0.589 8.487 31 HD22 LEU 5 HD22 LEU 5 9.986 0.232 10.048 32 HD23 LEU 5 HD23 LEU 5 9.972 1.172 8.555 33 H ALA 6 HN ALA 6 8.710 -1.917 5.152 34 HA ALA 6 HA ALA 6 11.578 -1.757 5.735 35 HB1 ALA 6 HB1 ALA 6 10.974 -3.982 5.561 36 HB2 ALA 6 HB2 ALA 6 11.476 -3.695 3.894 37 HB3 ALA 6 HB3 ALA 6 9.763 -3.669 4.317 38 H CGU 7 HN GLA 7 9.483 -1.309 2.849 39 HA CGU 7 HA GLA 7 11.415 -0.906 0.874 40 HB2 CGU 7 HB2 GLA 7 9.827 0.789 -0.109 41 HB3 CGU 7 HB3 GLA 7 8.879 0.692 1.375 42 HG CGU 7 HG GLA 7 8.579 -1.742 1.004 43 H ASN 8 HN ASN 8 10.582 1.063 3.595 44 HA ASN 8 HA ASN 8 11.633 3.560 3.143 45 HB2 ASN 8 HB2 ASN 8 10.795 2.270 5.333 46 HB3 ASN 8 HB1 ASN 8 12.527 2.118 5.606 47 HD21 ASN 8 HD21 ASN 8 12.942 3.662 7.180 48 HD22 ASN 8 HD22 ASN 8 12.547 5.318 7.036 49 H GLN 9 HN GLN 9 13.532 0.668 4.094 50 HA GLN 9 HA GLN 9 16.050 2.107 3.720 51 HB2 GLN 9 HB2 GLN 9 17.086 -0.123 4.177 52 HB3 GLN 9 HB1 GLN 9 15.951 0.384 5.425 53 HG2 GLN 9 HG2 GLN 9 14.282 -1.116 4.685 54 HG3 GLN 9 HG1 GLN 9 15.067 -1.354 3.123 55 HE21 GLN 9 HE21 GLN 9 14.484 -3.027 5.868 56 HE22 GLN 9 HE22 GLN 9 15.904 -3.967 5.967 57 H CGU 10 HN GLA 10 14.119 -0.207 1.874 58 HA CGU 10 HA GLA 10 16.077 -0.828 -0.098 59 HB2 CGU 10 HB2 GLA 10 13.095 -0.619 -0.537 60 HB3 CGU 10 HB3 GLA 10 13.883 -2.015 0.193 61 HG CGU 10 HG GLA 10 14.433 -0.918 -2.579 62 H PHE 11 HN PHE 11 14.333 2.000 0.513 63 HA PHE 11 HA PHE 11 14.569 3.074 -2.202 64 HB2 PHE 11 HB2 PHE 11 12.687 3.637 -0.739 65 HB3 PHE 11 HB1 PHE 11 13.801 4.338 0.430 66 HD1 PHE 11 HD1 PHE 11 15.341 6.256 -0.393 67 HD2 PHE 11 HD2 PHE 11 11.833 4.952 -2.502 68 HE1 PHE 11 HE1 PHE 11 15.284 8.406 -1.629 69 HE2 PHE 11 HE2 PHE 11 11.776 7.104 -3.737 70 HZ PHE 11 HZ PHE 11 13.500 8.829 -3.300 71 H ALA 12 HN ALA 12 16.362 3.170 0.807 72 HA ALA 12 HA ALA 12 18.021 5.440 -0.011 73 HB1 ALA 12 HB1 ALA 12 17.411 4.421 2.416 74 HB2 ALA 12 HB2 ALA 12 18.867 5.371 2.119 75 HB3 ALA 12 HB3 ALA 12 18.951 3.608 2.137 76 H ARG 13 HN ARG 13 18.287 1.908 -0.006 77 HA ARG 13 HA ARG 13 21.085 2.009 -0.891 78 HB2 ARG 13 HB2 ARG 13 20.196 0.142 0.524 79 HB3 ARG 13 HB1 ARG 13 19.181 -0.353 -0.832 80 HG2 ARG 13 HG2 ARG 13 21.255 -0.569 -2.231 81 HG3 ARG 13 HG1 ARG 13 22.210 -0.241 -0.785 82 HD2 ARG 13 HD2 ARG 13 20.265 -2.542 -1.141 83 HD3 ARG 13 HD1 ARG 13 22.027 -2.665 -1.157 84 HE ARG 13 HE ARG 13 21.353 -1.443 1.286 85 HH11 ARG 13 HH21 ARG 13 18.980 -3.235 1.217 86 HH12 ARG 13 HH22 ARG 13 19.584 -4.690 1.934 87 HH21 ARG 13 HH11 ARG 13 22.917 -3.822 1.521 88 HH22 ARG 13 HH12 ARG 13 21.814 -5.021 2.107 89 H CGU 14 HN GLA 14 17.916 1.875 -2.364 90 HA CGU 14 HA GLA 14 18.430 0.741 -4.844 91 HB2 CGU 14 HB2 GLA 14 16.849 2.988 -5.311 92 HB3 CGU 14 HB3 GLA 14 16.541 2.590 -3.635 93 HG CGU 14 HG GLA 14 16.157 0.221 -4.334 94 H LEU 15 HN LEU 15 19.151 4.020 -3.686 95 HA LEU 15 HA LEU 15 19.997 5.215 -6.080 96 HB2 LEU 15 HB2 LEU 15 21.346 6.694 -4.702 97 HB3 LEU 15 HB1 LEU 15 19.862 6.328 -3.825 98 HG LEU 15 HG LEU 15 21.256 4.349 -2.815 99 HD11 LEU 15 HD11 LEU 15 23.220 5.635 -4.437 100 HD12 LEU 15 HD12 LEU 15 23.444 4.278 -3.335 101 HD13 LEU 15 HD13 LEU 15 23.654 5.929 -2.754 102 HD21 LEU 15 HD21 LEU 15 21.941 7.176 -1.968 103 HD22 LEU 15 HD22 LEU 15 21.822 5.745 -0.944 104 HD23 LEU 15 HD23 LEU 15 20.369 6.438 -1.664 105 H ALA 16 HN ALA 16 21.619 2.836 -4.063 106 HA ALA 16 HA ALA 16 24.255 2.938 -4.888 107 HB1 ALA 16 HB1 ALA 16 22.565 0.425 -4.702 108 HB2 ALA 16 HB2 ALA 16 23.350 1.226 -3.341 109 HB3 ALA 16 HB3 ALA 16 24.325 0.493 -4.615 110 H ASN 17 HN ASN 17 21.471 1.944 -6.795 111 HA ASN 17 HA ASN 17 23.304 1.649 -9.144 112 HB2 ASN 17 HB2 ASN 17 20.690 0.187 -8.640 113 HB3 ASN 17 HB1 ASN 17 21.725 -0.003 -10.056 114 HD21 ASN 17 HD21 ASN 17 21.106 -1.237 -6.943 115 HD22 ASN 17 HD22 ASN 17 22.555 -2.115 -6.738 116 HN1 NH2 18 H1 NH2 18 19.722 1.807 -8.937 117 HN2 NH2 18 H2 NH2 18 19.574 3.217 -9.870 Start of MODEL 11 1 H1 GLY 1 HT1 GLY 1 1.124 -1.075 5.279 2 H2 GLY 1 HT2 GLY 1 2.004 -0.795 6.707 3 H3 GLY 1 HT3 GLY 1 0.461 -1.504 6.780 4 HA2 GLY 1 HA1 GLY 1 1.505 -3.455 6.836 5 HA3 GLY 1 HA2 GLY 1 1.795 -3.178 5.120 6 H GLU 2 HN GLU 2 3.479 -4.428 7.345 7 HA GLU 2 HA GLU 2 5.702 -2.754 7.932 8 HB2 GLU 2 HB2 GLU 2 6.955 -4.938 8.188 9 HB3 GLU 2 HB1 GLU 2 5.448 -4.851 9.103 10 HG2 GLU 2 HG2 GLU 2 5.381 -6.975 8.049 11 HG3 GLU 2 HG1 GLU 2 4.344 -5.953 7.055 12 H CGU 3 HN GLA 3 4.900 -4.640 5.064 13 HA CGU 3 HA GLA 3 7.423 -4.630 3.776 14 HB2 CGU 3 HB2 GLA 3 4.628 -4.441 2.614 15 HB3 CGU 3 HB3 GLA 3 5.580 -5.909 2.858 16 HG CGU 3 HG GLA 3 7.328 -4.827 1.307 17 H CGU 4 HN GLA 4 4.744 -2.324 3.156 18 HA CGU 4 HA GLA 4 6.216 -0.476 1.638 19 HB2 CGU 4 HB2 GLA 4 4.063 0.207 3.662 20 HB3 CGU 4 HB3 GLA 4 3.743 -0.385 2.032 21 HG CGU 4 HG GLA 4 5.251 2.153 2.737 22 H LEU 5 HN LEU 5 5.953 -0.780 5.162 23 HA LEU 5 HA LEU 5 7.444 1.590 5.794 24 HB2 LEU 5 HB2 LEU 5 6.018 -0.201 7.258 25 HB3 LEU 5 HB1 LEU 5 7.662 -0.729 7.628 26 HG LEU 5 HG LEU 5 6.692 2.132 7.855 27 HD11 LEU 5 HD11 LEU 5 5.651 0.500 9.490 28 HD12 LEU 5 HD12 LEU 5 6.600 1.784 10.238 29 HD13 LEU 5 HD13 LEU 5 7.277 0.163 10.082 30 HD21 LEU 5 HD21 LEU 5 9.296 0.738 8.154 31 HD22 LEU 5 HD22 LEU 5 8.910 1.916 9.407 32 HD23 LEU 5 HD23 LEU 5 8.962 2.413 7.715 33 H ALA 6 HN ALA 6 8.372 -1.656 4.861 34 HA ALA 6 HA ALA 6 11.151 -1.314 5.725 35 HB1 ALA 6 HB1 ALA 6 11.392 -3.455 4.238 36 HB2 ALA 6 HB2 ALA 6 9.628 -3.432 4.215 37 HB3 ALA 6 HB3 ALA 6 10.488 -3.566 5.749 38 H CGU 7 HN GLA 7 9.325 -1.054 2.670 39 HA CGU 7 HA GLA 7 11.397 -0.925 0.803 40 HB2 CGU 7 HB2 GLA 7 9.999 0.726 -0.439 41 HB3 CGU 7 HB3 GLA 7 8.991 0.921 0.995 42 HG CGU 7 HG GLA 7 8.375 -1.449 0.912 43 H ASN 8 HN ASN 8 10.463 1.358 3.253 44 HA ASN 8 HA ASN 8 11.757 3.711 2.671 45 HB2 ASN 8 HB2 ASN 8 10.613 2.613 4.875 46 HB3 ASN 8 HB1 ASN 8 12.305 2.573 5.360 47 HD21 ASN 8 HD21 ASN 8 10.047 4.324 6.333 48 HD22 ASN 8 HD22 ASN 8 10.599 5.926 6.118 49 H GLN 9 HN GLN 9 13.283 0.886 4.259 50 HA GLN 9 HA GLN 9 15.936 1.966 4.189 51 HB2 GLN 9 HB2 GLN 9 14.798 -0.165 5.417 52 HB3 GLN 9 HB1 GLN 9 15.622 -0.981 4.087 53 HG2 GLN 9 HG2 GLN 9 17.707 0.312 4.713 54 HG3 GLN 9 HG1 GLN 9 16.850 0.844 6.161 55 HE21 GLN 9 HE21 GLN 9 17.426 -0.427 7.921 56 HE22 GLN 9 HE22 GLN 9 17.725 -2.105 7.863 57 H CGU 10 HN GLA 10 14.255 -0.342 2.034 58 HA CGU 10 HA GLA 10 16.319 -1.010 0.322 59 HB2 CGU 10 HB2 GLA 10 13.395 -0.628 -0.042 60 HB3 CGU 10 HB3 GLA 10 14.380 -2.053 -0.354 61 HG CGU 10 HG GLA 10 14.260 0.438 -2.075 62 H PHE 11 HN PHE 11 14.411 1.912 0.277 63 HA PHE 11 HA PHE 11 15.311 3.199 -2.006 64 HB2 PHE 11 HB2 PHE 11 13.611 3.939 -0.321 65 HB3 PHE 11 HB1 PHE 11 14.946 4.472 0.695 66 HD1 PHE 11 HD1 PHE 11 13.918 4.750 -2.913 67 HD2 PHE 11 HD2 PHE 11 15.506 6.729 0.553 68 HE1 PHE 11 HE1 PHE 11 14.047 6.877 -4.185 69 HE2 PHE 11 HE2 PHE 11 15.635 8.853 -0.719 70 HZ PHE 11 HZ PHE 11 14.906 8.928 -3.088 71 H ALA 12 HN ALA 12 16.815 3.494 1.225 72 HA ALA 12 HA ALA 12 18.930 5.178 0.582 73 HB1 ALA 12 HB1 ALA 12 18.305 4.171 2.858 74 HB2 ALA 12 HB2 ALA 12 20.024 4.408 2.537 75 HB3 ALA 12 HB3 ALA 12 19.314 2.800 2.397 76 H ARG 13 HN ARG 13 18.882 1.631 0.133 77 HA ARG 13 HA ARG 13 21.618 1.713 -0.952 78 HB2 ARG 13 HB2 ARG 13 19.589 -0.442 -0.434 79 HB3 ARG 13 HB1 ARG 13 21.022 -0.774 -1.405 80 HG2 ARG 13 HG2 ARG 13 21.307 0.572 1.271 81 HG3 ARG 13 HG1 ARG 13 21.120 -1.180 1.184 82 HD2 ARG 13 HD2 ARG 13 23.051 -1.286 -0.380 83 HD3 ARG 13 HD1 ARG 13 23.261 0.460 -0.208 84 HE ARG 13 HE ARG 13 23.271 -0.679 2.395 85 HH11 ARG 13 HH21 ARG 13 25.095 -0.516 -0.525 86 HH12 ARG 13 HH22 ARG 13 26.609 -0.853 0.247 87 HH21 ARG 13 HH11 ARG 13 25.227 -1.186 3.409 88 HH22 ARG 13 HH12 ARG 13 26.683 -1.235 2.472 89 H CGU 14 HN GLA 14 18.382 0.959 -2.201 90 HA CGU 14 HA GLA 14 18.943 0.169 -4.776 91 HB2 CGU 14 HB2 GLA 14 16.752 0.926 -3.337 92 HB3 CGU 14 HB3 GLA 14 16.708 0.453 -5.029 93 HG CGU 14 HG GLA 14 17.181 3.264 -4.074 94 H LEU 15 HN LEU 15 18.926 3.426 -3.469 95 HA LEU 15 HA LEU 15 19.231 4.968 -5.782 96 HB2 LEU 15 HB2 LEU 15 20.382 6.614 -4.434 97 HB3 LEU 15 HB1 LEU 15 19.156 5.851 -3.426 98 HG LEU 15 HG LEU 15 21.074 4.220 -2.721 99 HD11 LEU 15 HD11 LEU 15 23.096 6.230 -2.871 100 HD12 LEU 15 HD12 LEU 15 22.469 5.997 -4.501 101 HD13 LEU 15 HD13 LEU 15 23.109 4.626 -3.598 102 HD21 LEU 15 HD21 LEU 15 20.028 5.865 -1.220 103 HD22 LEU 15 HD22 LEU 15 21.041 7.143 -1.889 104 HD23 LEU 15 HD23 LEU 15 21.773 5.837 -0.958 105 H ALA 16 HN ALA 16 21.621 2.915 -4.196 106 HA ALA 16 HA ALA 16 24.008 3.683 -5.365 107 HB1 ALA 16 HB1 ALA 16 24.192 1.809 -3.979 108 HB2 ALA 16 HB2 ALA 16 24.405 1.090 -5.575 109 HB3 ALA 16 HB3 ALA 16 22.847 0.978 -4.759 110 H ASN 17 HN ASN 17 21.226 2.287 -6.963 111 HA ASN 17 HA ASN 17 20.913 1.630 -9.215 112 HB2 ASN 17 HB2 ASN 17 21.064 4.206 -9.147 113 HB3 ASN 17 HB1 ASN 17 22.689 4.001 -9.802 114 HD21 ASN 17 HD21 ASN 17 19.396 4.247 -10.667 115 HD22 ASN 17 HD22 ASN 17 19.532 3.696 -12.276 116 HN1 NH2 18 H1 NH2 18 22.336 -0.338 -9.005 117 HN2 NH2 18 H2 NH2 18 23.834 -0.365 -9.804 Start of MODEL 12 1 H1 GLY 1 HT1 GLY 1 0.705 -2.982 4.689 2 H2 GLY 1 HT2 GLY 1 1.855 -4.232 4.688 3 H3 GLY 1 HT3 GLY 1 2.251 -2.709 4.050 4 HA2 GLY 1 HA1 GLY 1 2.003 -1.713 6.254 5 HA3 GLY 1 HA2 GLY 1 1.670 -3.322 6.896 6 H GLU 2 HN GLU 2 3.394 -4.773 7.153 7 HA GLU 2 HA GLU 2 5.945 -3.843 7.733 8 HB2 GLU 2 HB2 GLU 2 5.191 -6.122 8.284 9 HB3 GLU 2 HB1 GLU 2 5.233 -6.556 6.574 10 HG2 GLU 2 HG2 GLU 2 7.618 -6.260 6.474 11 HG3 GLU 2 HG1 GLU 2 7.653 -5.539 8.083 12 H CGU 3 HN GLA 3 4.550 -4.410 4.599 13 HA CGU 3 HA GLA 3 7.006 -4.609 3.107 14 HB2 CGU 3 HB2 GLA 3 4.211 -3.739 2.321 15 HB3 CGU 3 HB3 GLA 3 4.963 -5.314 2.045 16 HG CGU 3 HG GLA 3 5.793 -2.670 0.805 17 H CGU 4 HN GLA 4 4.756 -1.837 3.478 18 HA CGU 4 HA GLA 4 6.400 0.102 2.253 19 HB2 CGU 4 HB2 GLA 4 4.607 0.574 4.653 20 HB3 CGU 4 HB3 GLA 4 4.017 0.437 2.996 21 HG CGU 4 HG GLA 4 6.053 2.471 3.962 22 H LEU 5 HN LEU 5 6.257 -0.849 5.696 23 HA LEU 5 HA LEU 5 8.151 0.930 6.736 24 HB2 LEU 5 HB2 LEU 5 6.757 -1.088 7.810 25 HB3 LEU 5 HB1 LEU 5 8.308 -1.915 7.622 26 HG LEU 5 HG LEU 5 7.871 0.723 9.047 27 HD11 LEU 5 HD11 LEU 5 8.888 -1.800 10.317 28 HD12 LEU 5 HD12 LEU 5 7.153 -1.592 10.083 29 HD13 LEU 5 HD13 LEU 5 8.056 -0.436 11.062 30 HD21 LEU 5 HD21 LEU 5 10.050 0.894 8.237 31 HD22 LEU 5 HD22 LEU 5 10.302 -0.852 8.259 32 HD23 LEU 5 HD23 LEU 5 10.329 0.063 9.767 33 H ALA 6 HN ALA 6 8.648 -1.948 4.775 34 HA ALA 6 HA ALA 6 11.541 -1.961 5.215 35 HB1 ALA 6 HB1 ALA 6 10.821 -3.414 2.855 36 HB2 ALA 6 HB2 ALA 6 9.599 -3.732 4.086 37 HB3 ALA 6 HB3 ALA 6 11.298 -4.054 4.427 38 H CGU 7 HN GLA 7 9.329 -0.951 2.569 39 HA CGU 7 HA GLA 7 11.176 -0.280 0.588 40 HB2 CGU 7 HB2 GLA 7 9.619 1.534 -0.079 41 HB3 CGU 7 HB3 GLA 7 8.791 1.384 1.470 42 HG CGU 7 HG GLA 7 8.207 -0.951 0.938 43 H ASN 8 HN ASN 8 10.590 1.225 3.651 44 HA ASN 8 HA ASN 8 11.694 3.733 3.548 45 HB2 ASN 8 HB2 ASN 8 10.960 2.095 5.542 46 HB3 ASN 8 HB1 ASN 8 12.705 1.908 5.684 47 HD21 ASN 8 HD21 ASN 8 11.839 3.104 7.861 48 HD22 ASN 8 HD22 ASN 8 12.006 4.801 7.823 49 H GLN 9 HN GLN 9 13.585 0.720 4.013 50 HA GLN 9 HA GLN 9 16.104 2.141 3.630 51 HB2 GLN 9 HB2 GLN 9 17.108 -0.143 3.702 52 HB3 GLN 9 HB1 GLN 9 16.054 0.182 5.079 53 HG2 GLN 9 HG2 GLN 9 14.259 -1.088 4.104 54 HG3 GLN 9 HG1 GLN 9 15.123 -1.242 2.574 55 HE21 GLN 9 HE21 GLN 9 14.500 -2.828 5.509 56 HE22 GLN 9 HE22 GLN 9 15.774 -3.962 5.451 57 H CGU 10 HN GLA 10 14.004 0.108 1.635 58 HA CGU 10 HA GLA 10 15.680 -0.400 -0.535 59 HB2 CGU 10 HB2 GLA 10 12.782 0.435 -0.726 60 HB3 CGU 10 HB3 GLA 10 13.323 -1.195 -0.334 61 HG CGU 10 HG GLA 10 14.112 0.270 -2.864 62 H PHE 11 HN PHE 11 14.474 2.582 0.559 63 HA PHE 11 HA PHE 11 14.861 4.002 -1.963 64 HB2 PHE 11 HB2 PHE 11 13.195 4.640 -0.247 65 HB3 PHE 11 HB1 PHE 11 14.513 5.009 0.859 66 HD1 PHE 11 HD1 PHE 11 16.308 6.716 0.014 67 HD2 PHE 11 HD2 PHE 11 12.398 6.291 -1.713 68 HE1 PHE 11 HE1 PHE 11 16.506 8.975 -0.992 69 HE2 PHE 11 HE2 PHE 11 12.594 8.549 -2.718 70 HZ PHE 11 HZ PHE 11 14.647 9.891 -2.357 71 H ALA 12 HN ALA 12 16.644 3.616 1.090 72 HA ALA 12 HA ALA 12 18.743 5.476 0.346 73 HB1 ALA 12 HB1 ALA 12 17.973 4.206 2.686 74 HB2 ALA 12 HB2 ALA 12 19.443 5.159 2.474 75 HB3 ALA 12 HB3 ALA 12 19.492 3.407 2.279 76 H ARG 13 HN ARG 13 18.269 1.987 0.030 77 HA ARG 13 HA ARG 13 21.014 1.582 -0.931 78 HB2 ARG 13 HB2 ARG 13 18.679 -0.349 -1.011 79 HB3 ARG 13 HB1 ARG 13 20.390 -0.748 -1.147 80 HG2 ARG 13 HG2 ARG 13 19.297 0.669 1.283 81 HG3 ARG 13 HG1 ARG 13 19.277 -1.090 1.159 82 HD2 ARG 13 HD2 ARG 13 21.717 -1.100 0.805 83 HD3 ARG 13 HD1 ARG 13 21.743 0.663 0.920 84 HE ARG 13 HE ARG 13 21.804 -1.086 3.150 85 HH11 ARG 13 HH21 ARG 13 21.862 2.078 2.723 86 HH12 ARG 13 HH22 ARG 13 20.723 2.525 3.949 87 HH21 ARG 13 HH11 ARG 13 19.558 -0.707 4.418 88 HH22 ARG 13 HH12 ARG 13 19.419 0.948 4.910 89 H CGU 14 HN GLA 14 17.879 2.265 -2.315 90 HA CGU 14 HA GLA 14 18.109 1.218 -4.881 91 HB2 CGU 14 HB2 GLA 14 17.023 3.768 -5.158 92 HB3 CGU 14 HB3 GLA 14 16.668 3.333 -3.500 93 HG CGU 14 HG GLA 14 15.704 1.205 -4.262 94 H LEU 15 HN LEU 15 19.510 4.189 -3.527 95 HA LEU 15 HA LEU 15 20.588 5.326 -5.857 96 HB2 LEU 15 HB2 LEU 15 22.262 6.364 -4.400 97 HB3 LEU 15 HB1 LEU 15 20.701 6.351 -3.584 98 HG LEU 15 HG LEU 15 21.508 4.062 -2.605 99 HD11 LEU 15 HD11 LEU 15 23.803 4.867 -4.119 100 HD12 LEU 15 HD12 LEU 15 23.606 3.432 -3.116 101 HD13 LEU 15 HD13 LEU 15 24.226 4.922 -2.408 102 HD21 LEU 15 HD21 LEU 15 21.155 6.255 -1.386 103 HD22 LEU 15 HD22 LEU 15 22.862 6.605 -1.661 104 HD23 LEU 15 HD23 LEU 15 22.394 5.216 -0.680 105 H ALA 16 HN ALA 16 21.656 2.548 -3.992 106 HA ALA 16 HA ALA 16 24.254 2.136 -4.879 107 HB1 ALA 16 HB1 ALA 16 22.755 0.640 -3.384 108 HB2 ALA 16 HB2 ALA 16 23.939 -0.163 -4.415 109 HB3 ALA 16 HB3 ALA 16 22.242 -0.116 -4.893 110 H ASN 17 HN ASN 17 21.243 1.391 -6.632 111 HA ASN 17 HA ASN 17 21.005 0.565 -8.856 112 HB2 ASN 17 HB2 ASN 17 21.025 3.028 -9.038 113 HB3 ASN 17 HB1 ASN 17 22.781 3.000 -9.205 114 HD21 ASN 17 HD21 ASN 17 20.008 3.203 -11.033 115 HD22 ASN 17 HD22 ASN 17 20.587 2.537 -12.493 116 HN1 NH2 18 H1 NH2 18 22.202 -1.448 -8.911 117 HN2 NH2 18 H2 NH2 18 23.786 -1.535 -9.515 Start of MODEL 13 1 H1 GLY 1 HT1 GLY 1 0.803 -3.294 5.835 2 H2 GLY 1 HT2 GLY 1 0.383 -2.325 7.165 3 H3 GLY 1 HT3 GLY 1 1.680 -3.415 7.281 4 HA2 GLY 1 HA1 GLY 1 1.996 -1.585 5.103 5 HA3 GLY 1 HA2 GLY 1 1.871 -0.771 6.663 6 H GLU 2 HN GLU 2 3.011 -3.964 6.943 7 HA GLU 2 HA GLU 2 5.569 -3.110 7.938 8 HB2 GLU 2 HB2 GLU 2 4.499 -5.201 8.688 9 HB3 GLU 2 HB1 GLU 2 4.663 -5.870 7.063 10 HG2 GLU 2 HG2 GLU 2 6.484 -6.609 8.619 11 HG3 GLU 2 HG1 GLU 2 7.087 -5.747 7.202 12 H CGU 3 HN GLA 3 4.418 -3.931 4.761 13 HA CGU 3 HA GLA 3 6.993 -4.580 3.615 14 HB2 CGU 3 HB2 GLA 3 4.472 -3.532 2.286 15 HB3 CGU 3 HB3 GLA 3 4.886 -5.236 2.517 16 HG CGU 3 HG GLA 3 6.508 -3.231 0.913 17 H CGU 4 HN GLA 4 4.991 -1.611 3.500 18 HA CGU 4 HA GLA 4 6.984 -0.027 2.176 19 HB2 CGU 4 HB2 GLA 4 4.840 0.982 4.063 20 HB3 CGU 4 HB3 GLA 4 4.518 0.523 2.392 21 HG CGU 4 HG GLA 4 6.218 2.187 1.644 22 H LEU 5 HN LEU 5 6.362 -0.778 5.563 23 HA LEU 5 HA LEU 5 7.966 1.201 6.795 24 HB2 LEU 5 HB2 LEU 5 6.470 -0.839 7.731 25 HB3 LEU 5 HB1 LEU 5 8.077 -1.555 7.909 26 HG LEU 5 HG LEU 5 7.247 1.156 8.981 27 HD11 LEU 5 HD11 LEU 5 6.172 -0.640 10.233 28 HD12 LEU 5 HD12 LEU 5 7.490 0.025 11.198 29 HD13 LEU 5 HD13 LEU 5 7.702 -1.510 10.356 30 HD21 LEU 5 HD21 LEU 5 9.511 0.532 10.292 31 HD22 LEU 5 HD22 LEU 5 9.528 1.402 8.759 32 HD23 LEU 5 HD23 LEU 5 9.824 -0.336 8.790 33 H ALA 6 HN ALA 6 8.862 -1.859 5.259 34 HA ALA 6 HA ALA 6 11.662 -1.602 6.102 35 HB1 ALA 6 HB1 ALA 6 10.979 -3.447 3.881 36 HB2 ALA 6 HB2 ALA 6 10.128 -3.741 5.398 37 HB3 ALA 6 HB3 ALA 6 11.891 -3.750 5.361 38 H CGU 7 HN GLA 7 9.749 -0.985 3.150 39 HA CGU 7 HA GLA 7 11.759 -0.619 1.244 40 HB2 CGU 7 HB2 GLA 7 10.303 1.232 0.312 41 HB3 CGU 7 HB3 GLA 7 9.290 1.073 1.748 42 HG CGU 7 HG GLA 7 8.915 -1.321 1.189 43 H ASN 8 HN ASN 8 10.962 1.322 4.005 44 HA ASN 8 HA ASN 8 12.132 3.772 3.654 45 HB2 ASN 8 HB2 ASN 8 11.199 2.422 5.777 46 HB3 ASN 8 HB1 ASN 8 12.922 2.261 6.104 47 HD21 ASN 8 HD21 ASN 8 10.827 3.927 7.511 48 HD22 ASN 8 HD22 ASN 8 11.432 5.524 7.472 49 H GLN 9 HN GLN 9 13.901 0.771 4.514 50 HA GLN 9 HA GLN 9 16.473 2.169 4.207 51 HB2 GLN 9 HB2 GLN 9 17.468 -0.005 4.825 52 HB3 GLN 9 HB1 GLN 9 16.217 0.472 5.973 53 HG2 GLN 9 HG2 GLN 9 14.619 -1.024 4.974 54 HG3 GLN 9 HG1 GLN 9 15.698 -1.363 3.620 55 HE21 GLN 9 HE21 GLN 9 14.593 -2.764 6.396 56 HE22 GLN 9 HE22 GLN 9 15.948 -3.718 6.803 57 H CGU 10 HN GLA 10 14.517 -0.155 2.397 58 HA CGU 10 HA GLA 10 16.559 -0.787 0.473 59 HB2 CGU 10 HB2 GLA 10 13.581 -0.868 -0.003 60 HB3 CGU 10 HB3 GLA 10 14.435 -2.112 0.906 61 HG CGU 10 HG GLA 10 15.033 -1.294 -1.952 62 H PHE 11 HN PHE 11 14.672 1.940 0.995 63 HA PHE 11 HA PHE 11 14.664 2.862 -1.783 64 HB2 PHE 11 HB2 PHE 11 12.862 3.441 -0.246 65 HB3 PHE 11 HB1 PHE 11 14.010 4.236 0.824 66 HD1 PHE 11 HD1 PHE 11 13.109 4.250 -2.824 67 HD2 PHE 11 HD2 PHE 11 14.184 6.555 0.636 68 HE1 PHE 11 HE1 PHE 11 12.913 6.334 -4.153 69 HE2 PHE 11 HE2 PHE 11 13.987 8.640 -0.693 70 HZ PHE 11 HZ PHE 11 13.353 8.529 -3.088 71 H ALA 12 HN ALA 12 16.651 3.274 1.084 72 HA ALA 12 HA ALA 12 18.101 5.571 0.007 73 HB1 ALA 12 HB1 ALA 12 19.467 5.398 1.986 74 HB2 ALA 12 HB2 ALA 12 18.915 3.751 2.286 75 HB3 ALA 12 HB3 ALA 12 17.796 5.102 2.467 76 H ARG 13 HN ARG 13 18.649 2.067 0.208 77 HA ARG 13 HA ARG 13 21.326 2.348 -0.980 78 HB2 ARG 13 HB2 ARG 13 20.017 0.383 0.567 79 HB3 ARG 13 HB1 ARG 13 20.307 -0.360 -1.005 80 HG2 ARG 13 HG2 ARG 13 22.435 1.112 0.571 81 HG3 ARG 13 HG1 ARG 13 22.210 -0.636 0.626 82 HD2 ARG 13 HD2 ARG 13 22.573 -0.768 -1.810 83 HD3 ARG 13 HD1 ARG 13 22.790 0.984 -1.874 84 HE ARG 13 HE ARG 13 24.997 0.634 -1.150 85 HH11 ARG 13 HH11 ARG 13 24.351 -0.430 1.530 86 HH12 ARG 13 HH12 ARG 13 25.012 -2.031 1.479 87 HH21 ARG 13 HH21 ARG 13 25.260 -2.103 -1.978 88 HH22 ARG 13 HH22 ARG 13 25.526 -2.977 -0.508 89 H CGU 14 HN GLA 14 18.061 1.760 -2.065 90 HA CGU 14 HA GLA 14 18.443 0.390 -4.454 91 HB2 CGU 14 HB2 GLA 14 16.561 2.387 -4.955 92 HB3 CGU 14 HB3 GLA 14 16.489 2.146 -3.222 93 HG CGU 14 HG GLA 14 16.298 -0.300 -3.609 94 H LEU 15 HN LEU 15 18.910 3.843 -3.746 95 HA LEU 15 HA LEU 15 19.302 4.874 -6.308 96 HB2 LEU 15 HB2 LEU 15 20.755 6.547 -5.286 97 HB3 LEU 15 HB1 LEU 15 19.428 6.189 -4.182 98 HG LEU 15 HG LEU 15 21.063 4.405 -3.183 99 HD11 LEU 15 HD11 LEU 15 22.715 5.618 -5.186 100 HD12 LEU 15 HD12 LEU 15 23.147 4.356 -4.034 101 HD13 LEU 15 HD13 LEU 15 23.364 6.051 -3.606 102 HD21 LEU 15 HD21 LEU 15 21.549 7.377 -2.793 103 HD22 LEU 15 HD22 LEU 15 21.946 6.104 -1.638 104 HD23 LEU 15 HD23 LEU 15 20.260 6.449 -2.026 105 H ALA 16 HN ALA 16 21.458 2.831 -4.415 106 HA ALA 16 HA ALA 16 23.888 3.078 -5.710 107 HB1 ALA 16 HB1 ALA 16 23.797 1.479 -3.977 108 HB2 ALA 16 HB2 ALA 16 24.029 0.501 -5.426 109 HB3 ALA 16 HB3 ALA 16 22.426 0.641 -4.703 110 H ASN 17 HN ASN 17 20.908 2.099 -7.125 111 HA ASN 17 HA ASN 17 22.382 1.182 -9.564 112 HB2 ASN 17 HB2 ASN 17 19.562 0.500 -8.675 113 HB3 ASN 17 HB1 ASN 17 20.343 -0.080 -10.146 114 HD21 ASN 17 HD21 ASN 17 22.828 0.080 -7.976 115 HD22 ASN 17 HD22 ASN 17 22.756 -1.499 -7.334 116 HN1 NH2 18 H1 NH2 18 22.279 3.862 -9.518 117 HN2 NH2 18 H2 NH2 18 21.016 4.483 -10.466 Start of MODEL 14 1 H1 GLY 1 HT1 GLY 1 1.051 -5.169 3.840 2 H2 GLY 1 HT2 GLY 1 2.119 -5.533 5.110 3 H3 GLY 1 HT3 GLY 1 2.723 -5.212 3.555 4 HA2 GLY 1 HA1 GLY 1 1.906 -2.930 3.696 5 HA3 GLY 1 HA2 GLY 1 1.341 -3.274 5.331 6 H GLU 2 HN GLU 2 3.540 -4.915 6.150 7 HA GLU 2 HA GLU 2 5.361 -2.959 7.101 8 HB2 GLU 2 HB2 GLU 2 5.786 -5.941 6.738 9 HB3 GLU 2 HB1 GLU 2 6.808 -4.884 7.712 10 HG2 GLU 2 HG2 GLU 2 3.828 -5.174 8.161 11 HG3 GLU 2 HG1 GLU 2 5.031 -6.138 9.017 12 H CGU 3 HN GLA 3 5.480 -5.019 4.223 13 HA CGU 3 HA GLA 3 8.123 -4.646 3.399 14 HB2 CGU 3 HB2 GLA 3 5.579 -4.687 1.754 15 HB3 CGU 3 HB3 GLA 3 6.665 -6.042 2.088 16 HG CGU 3 HG GLA 3 7.342 -3.556 0.478 17 H CGU 4 HN GLA 4 5.362 -2.508 2.601 18 HA CGU 4 HA GLA 4 6.885 -0.490 1.311 19 HB2 CGU 4 HB2 GLA 4 4.428 0.016 3.007 20 HB3 CGU 4 HB3 GLA 4 4.345 -0.701 1.399 21 HG CGU 4 HG GLA 4 5.481 1.284 0.459 22 H LEU 5 HN LEU 5 5.994 -0.858 4.748 23 HA LEU 5 HA LEU 5 7.206 1.568 5.646 24 HB2 LEU 5 HB2 LEU 5 5.702 -0.354 6.835 25 HB3 LEU 5 HB1 LEU 5 7.299 -0.777 7.463 26 HG LEU 5 HG LEU 5 6.096 2.005 7.570 27 HD11 LEU 5 HD11 LEU 5 5.053 0.072 8.997 28 HD12 LEU 5 HD12 LEU 5 5.460 1.594 9.789 29 HD13 LEU 5 HD13 LEU 5 6.536 0.205 9.942 30 HD21 LEU 5 HD21 LEU 5 8.724 0.809 8.223 31 HD22 LEU 5 HD22 LEU 5 8.055 1.862 9.471 32 HD23 LEU 5 HD23 LEU 5 8.313 2.481 7.839 33 H ALA 6 HN ALA 6 8.519 -1.591 4.876 34 HA ALA 6 HA ALA 6 11.094 -1.067 6.164 35 HB1 ALA 6 HB1 ALA 6 11.524 -3.257 5.719 36 HB2 ALA 6 HB2 ALA 6 11.002 -3.116 4.040 37 HB3 ALA 6 HB3 ALA 6 9.809 -3.347 5.317 38 H CGU 7 HN GLA 7 9.751 -0.833 2.864 39 HA CGU 7 HA GLA 7 12.068 -0.474 1.345 40 HB2 CGU 7 HB2 GLA 7 10.734 1.157 -0.030 41 HB3 CGU 7 HB3 GLA 7 9.486 1.122 1.216 42 HG CGU 7 HG GLA 7 9.208 -1.303 0.883 43 H ASN 8 HN ASN 8 10.594 1.631 3.686 44 HA ASN 8 HA ASN 8 11.744 4.103 3.366 45 HB2 ASN 8 HB2 ASN 8 10.397 2.892 5.357 46 HB3 ASN 8 HB1 ASN 8 12.011 2.845 6.059 47 HD21 ASN 8 HD21 ASN 8 11.659 4.468 7.656 48 HD22 ASN 8 HD22 ASN 8 11.370 6.104 7.261 49 H GLN 9 HN GLN 9 13.316 1.286 4.924 50 HA GLN 9 HA GLN 9 15.861 2.637 5.216 51 HB2 GLN 9 HB2 GLN 9 14.751 0.383 6.298 52 HB3 GLN 9 HB1 GLN 9 15.858 -0.315 5.116 53 HG2 GLN 9 HG2 GLN 9 17.733 0.879 6.057 54 HG3 GLN 9 HG1 GLN 9 16.668 1.806 7.116 55 HE21 GLN 9 HE21 GLN 9 15.135 -1.007 7.272 56 HE22 GLN 9 HE22 GLN 9 15.987 -1.790 8.526 57 H CGU 10 HN GLA 10 14.616 0.173 2.950 58 HA CGU 10 HA GLA 10 16.939 -0.239 1.444 59 HB2 CGU 10 HB2 GLA 10 14.166 0.007 0.257 60 HB3 CGU 10 HB3 GLA 10 14.713 -1.410 1.154 61 HG CGU 10 HG GLA 10 16.638 -1.590 -0.474 62 H PHE 11 HN PHE 11 14.924 2.546 1.605 63 HA PHE 11 HA PHE 11 15.290 3.914 -0.753 64 HB2 PHE 11 HB2 PHE 11 14.235 4.690 1.445 65 HB3 PHE 11 HB1 PHE 11 15.855 5.192 1.919 66 HD1 PHE 11 HD1 PHE 11 17.159 6.627 0.099 67 HD2 PHE 11 HD2 PHE 11 12.888 6.218 0.297 68 HE1 PHE 11 HE1 PHE 11 16.899 8.718 -1.207 69 HE2 PHE 11 HE2 PHE 11 12.627 8.310 -1.008 70 HZ PHE 11 HZ PHE 11 14.633 9.560 -1.761 71 H ALA 12 HN ALA 12 17.753 3.339 1.739 72 HA ALA 12 HA ALA 12 19.732 5.048 0.477 73 HB1 ALA 12 HB1 ALA 12 21.171 4.383 2.190 74 HB2 ALA 12 HB2 ALA 12 20.462 2.770 2.295 75 HB3 ALA 12 HB3 ALA 12 19.593 4.160 2.946 76 H ARG 13 HN ARG 13 18.753 1.711 0.092 77 HA ARG 13 HA ARG 13 21.188 1.015 -1.409 78 HB2 ARG 13 HB2 ARG 13 18.787 -0.421 -0.414 79 HB3 ARG 13 HB1 ARG 13 19.522 -1.058 -1.884 80 HG2 ARG 13 HG2 ARG 13 21.253 -0.370 0.477 81 HG3 ARG 13 HG1 ARG 13 20.386 -1.905 0.440 82 HD2 ARG 13 HD2 ARG 13 22.289 -0.909 -1.703 83 HD3 ARG 13 HD1 ARG 13 22.652 -2.153 -0.502 84 HE ARG 13 HE ARG 13 20.289 -2.911 -1.908 85 HH11 ARG 13 HH21 ARG 13 22.756 -4.617 -1.455 86 HH12 ARG 13 HH22 ARG 13 23.301 -4.870 -3.080 87 HH21 ARG 13 HH11 ARG 13 21.378 -2.308 -4.406 88 HH22 ARG 13 HH12 ARG 13 22.521 -3.565 -4.749 89 H CGU 14 HN GLA 14 17.809 1.858 -2.110 90 HA CGU 14 HA GLA 14 17.563 1.118 -4.752 91 HB2 CGU 14 HB2 GLA 14 16.540 3.718 -4.553 92 HB3 CGU 14 HB3 GLA 14 16.433 3.062 -2.933 93 HG CGU 14 HG GLA 14 15.315 1.058 -3.831 94 H LEU 15 HN LEU 15 19.335 3.906 -3.431 95 HA LEU 15 HA LEU 15 19.938 5.307 -5.770 96 HB2 LEU 15 HB2 LEU 15 21.990 6.046 -4.660 97 HB3 LEU 15 HB1 LEU 15 20.683 5.972 -3.481 98 HG LEU 15 HG LEU 15 21.537 3.532 -3.060 99 HD11 LEU 15 HD11 LEU 15 23.403 2.909 -4.155 100 HD12 LEU 15 HD12 LEU 15 24.275 4.273 -3.462 101 HD13 LEU 15 HD13 LEU 15 23.431 4.457 -4.996 102 HD21 LEU 15 HD21 LEU 15 23.170 5.932 -2.171 103 HD22 LEU 15 HD22 LEU 15 23.062 4.382 -1.336 104 HD23 LEU 15 HD23 LEU 15 21.643 5.424 -1.449 105 H ALA 16 HN ALA 16 21.269 2.262 -4.612 106 HA ALA 16 HA ALA 16 23.502 1.929 -6.249 107 HB1 ALA 16 HB1 ALA 16 22.516 0.300 -4.528 108 HB2 ALA 16 HB2 ALA 16 23.211 -0.422 -5.980 109 HB3 ALA 16 HB3 ALA 16 21.461 -0.261 -5.825 110 H ASN 17 HN ASN 17 20.085 1.373 -7.088 111 HA ASN 17 HA ASN 17 20.883 0.914 -9.914 112 HB2 ASN 17 HB2 ASN 17 18.144 0.719 -8.623 113 HB3 ASN 17 HB1 ASN 17 18.582 0.169 -10.240 114 HD21 ASN 17 HD21 ASN 17 21.244 -0.419 -8.305 115 HD22 ASN 17 HD22 ASN 17 20.914 -2.034 -7.871 116 HN1 NH2 18 H1 NH2 18 17.749 2.113 -9.851 117 HN2 NH2 18 H2 NH2 18 18.072 3.733 -10.246 Start of MODEL 15 1 H1 GLY 1 HT1 GLY 1 0.133 -3.911 6.867 2 H2 GLY 1 HT2 GLY 1 1.524 -4.694 6.283 3 H3 GLY 1 HT3 GLY 1 0.122 -4.620 5.326 4 HA2 GLY 1 HA1 GLY 1 1.267 -2.937 4.358 5 HA3 GLY 1 HA2 GLY 1 0.464 -2.044 5.649 6 H GLU 2 HN GLU 2 2.745 -4.247 6.856 7 HA GLU 2 HA GLU 2 4.495 -2.044 7.675 8 HB2 GLU 2 HB2 GLU 2 5.673 -3.750 8.977 9 HB3 GLU 2 HB1 GLU 2 3.934 -3.919 9.217 10 HG2 GLU 2 HG2 GLU 2 4.668 -6.131 8.827 11 HG3 GLU 2 HG1 GLU 2 4.026 -5.614 7.266 12 H CGU 3 HN GLA 3 4.356 -4.262 5.067 13 HA CGU 3 HA GLA 3 7.077 -4.753 4.502 14 HB2 CGU 3 HB2 GLA 3 4.825 -4.177 2.548 15 HB3 CGU 3 HB3 GLA 3 5.261 -5.764 3.190 16 HG CGU 3 HG GLA 3 7.114 -3.992 1.562 17 H CGU 4 HN GLA 4 5.090 -2.103 3.136 18 HA CGU 4 HA GLA 4 7.081 -0.644 1.865 19 HB2 CGU 4 HB2 GLA 4 4.931 0.645 3.563 20 HB3 CGU 4 HB3 GLA 4 4.603 -0.091 1.994 21 HG CGU 4 HG GLA 4 6.327 1.423 0.986 22 H LEU 5 HN LEU 5 6.460 -0.884 5.323 23 HA LEU 5 HA LEU 5 8.027 1.282 6.244 24 HB2 LEU 5 HB2 LEU 5 6.574 -0.618 7.479 25 HB3 LEU 5 HB1 LEU 5 8.189 -1.288 7.741 26 HG LEU 5 HG LEU 5 7.302 1.522 8.452 27 HD11 LEU 5 HD11 LEU 5 8.243 -0.552 10.406 28 HD12 LEU 5 HD12 LEU 5 6.578 -0.614 9.831 29 HD13 LEU 5 HD13 LEU 5 7.168 0.820 10.670 30 HD21 LEU 5 HD21 LEU 5 9.594 1.699 7.948 31 HD22 LEU 5 HD22 LEU 5 9.944 0.074 8.538 32 HD23 LEU 5 HD23 LEU 5 9.603 1.372 9.682 33 H ALA 6 HN ALA 6 8.984 -1.993 5.257 34 HA ALA 6 HA ALA 6 11.786 -1.543 5.976 35 HB1 ALA 6 HB1 ALA 6 12.025 -3.774 5.601 36 HB2 ALA 6 HB2 ALA 6 11.188 -3.700 4.049 37 HB3 ALA 6 HB3 ALA 6 10.261 -3.795 5.548 38 H CGU 7 HN GLA 7 9.840 -1.508 2.972 39 HA CGU 7 HA GLA 7 11.846 -1.295 1.040 40 HB2 CGU 7 HB2 GLA 7 10.277 0.224 -0.206 41 HB3 CGU 7 HB3 GLA 7 9.275 0.311 1.243 42 HG CGU 7 HG GLA 7 8.944 -2.126 1.174 43 H ASN 8 HN ASN 8 10.825 0.979 3.455 44 HA ASN 8 HA ASN 8 11.874 3.418 2.755 45 HB2 ASN 8 HB2 ASN 8 10.937 2.381 5.046 46 HB3 ASN 8 HB1 ASN 8 12.655 2.326 5.425 47 HD21 ASN 8 HD21 ASN 8 12.823 4.061 6.874 48 HD22 ASN 8 HD22 ASN 8 12.433 5.675 6.470 49 H GLN 9 HN GLN 9 13.732 0.686 4.139 50 HA GLN 9 HA GLN 9 16.273 2.056 3.816 51 HB2 GLN 9 HB2 GLN 9 16.385 0.475 5.515 52 HB3 GLN 9 HB1 GLN 9 15.374 -0.680 4.648 53 HG2 GLN 9 HG2 GLN 9 17.793 -1.351 4.777 54 HG3 GLN 9 HG1 GLN 9 17.177 -1.214 3.131 55 HE21 GLN 9 HE21 GLN 9 18.703 -0.209 1.816 56 HE22 GLN 9 HE22 GLN 9 19.706 1.086 2.294 57 H CGU 10 HN GLA 10 14.473 -0.425 2.012 58 HA CGU 10 HA GLA 10 16.493 -1.004 0.096 59 HB2 CGU 10 HB2 GLA 10 13.504 -0.980 -0.361 60 HB3 CGU 10 HB3 GLA 10 14.380 -2.314 0.384 61 HG CGU 10 HG GLA 10 14.916 -1.221 -2.392 62 H PHE 11 HN PHE 11 14.565 1.729 0.583 63 HA PHE 11 HA PHE 11 14.788 2.743 -2.155 64 HB2 PHE 11 HB2 PHE 11 12.851 3.233 -0.729 65 HB3 PHE 11 HB1 PHE 11 13.908 4.042 0.424 66 HD1 PHE 11 HD1 PHE 11 13.241 4.076 -3.274 67 HD2 PHE 11 HD2 PHE 11 14.037 6.370 0.269 68 HE1 PHE 11 HE1 PHE 11 13.068 6.170 -4.591 69 HE2 PHE 11 HE2 PHE 11 13.864 8.465 -1.048 70 HZ PHE 11 HZ PHE 11 13.379 8.364 -3.479 71 H ALA 12 HN ALA 12 16.473 3.100 0.916 72 HA ALA 12 HA ALA 12 18.017 5.421 0.075 73 HB1 ALA 12 HB1 ALA 12 17.475 4.568 2.495 74 HB2 ALA 12 HB2 ALA 12 19.046 5.300 2.171 75 HB3 ALA 12 HB3 ALA 12 18.892 3.545 2.255 76 H ARG 13 HN ARG 13 18.480 1.918 0.036 77 HA ARG 13 HA ARG 13 21.266 2.204 -0.872 78 HB2 ARG 13 HB2 ARG 13 20.421 0.302 0.605 79 HB3 ARG 13 HB1 ARG 13 19.595 -0.322 -0.823 80 HG2 ARG 13 HG2 ARG 13 21.805 -0.315 -2.024 81 HG3 ARG 13 HG1 ARG 13 22.576 0.121 -0.497 82 HD2 ARG 13 HD2 ARG 13 20.994 -2.399 -1.082 83 HD3 ARG 13 HD1 ARG 13 22.726 -2.282 -0.745 84 HE ARG 13 HE ARG 13 20.632 -2.351 1.243 85 HH11 ARG 13 HH21 ARG 13 23.889 -1.655 0.504 86 HH12 ARG 13 HH22 ARG 13 24.290 -1.100 2.095 87 HH21 ARG 13 HH11 ARG 13 21.038 -1.334 3.281 88 HH22 ARG 13 HH12 ARG 13 22.674 -0.919 3.669 89 H CGU 14 HN GLA 14 18.090 1.869 -2.276 90 HA CGU 14 HA GLA 14 18.644 0.711 -4.747 91 HB2 CGU 14 HB2 GLA 14 16.857 2.796 -5.216 92 HB3 CGU 14 HB3 GLA 14 16.626 2.403 -3.525 93 HG CGU 14 HG GLA 14 16.335 0.042 -4.100 94 H LEU 15 HN LEU 15 19.102 4.078 -3.686 95 HA LEU 15 HA LEU 15 19.758 5.302 -6.106 96 HB2 LEU 15 HB2 LEU 15 21.298 6.756 -4.759 97 HB3 LEU 15 HB1 LEU 15 19.703 6.569 -4.033 98 HG LEU 15 HG LEU 15 20.858 4.508 -2.820 99 HD11 LEU 15 HD11 LEU 15 23.258 6.145 -2.580 100 HD12 LEU 15 HD12 LEU 15 23.036 5.558 -4.228 101 HD13 LEU 15 HD13 LEU 15 23.111 4.415 -2.887 102 HD21 LEU 15 HD21 LEU 15 21.183 7.437 -2.108 103 HD22 LEU 15 HD22 LEU 15 21.522 6.124 -0.981 104 HD23 LEU 15 HD23 LEU 15 19.888 6.352 -1.604 105 H ALA 16 HN ALA 16 21.678 3.068 -4.178 106 HA ALA 16 HA ALA 16 24.223 3.343 -5.252 107 HB1 ALA 16 HB1 ALA 16 22.841 0.672 -4.870 108 HB2 ALA 16 HB2 ALA 16 23.487 1.636 -3.542 109 HB3 ALA 16 HB3 ALA 16 24.573 0.999 -4.777 110 H ASN 17 HN ASN 17 21.361 2.648 -6.961 111 HA ASN 17 HA ASN 17 22.869 1.463 -9.242 112 HB2 ASN 17 HB2 ASN 17 19.876 1.784 -8.868 113 HB3 ASN 17 HB1 ASN 17 20.679 0.876 -10.150 114 HD21 ASN 17 HD21 ASN 17 19.193 0.480 -7.167 115 HD22 ASN 17 HD22 ASN 17 19.931 -0.983 -6.694 116 HN1 NH2 18 H1 NH2 18 19.934 3.185 -9.955 117 HN2 NH2 18 H2 NH2 18 20.656 4.529 -10.699 Start of MODEL 16 1 H1 GLY 1 HT1 GLY 1 0.071 -1.469 6.500 2 H2 GLY 1 HT2 GLY 1 0.675 -3.003 6.917 3 H3 GLY 1 HT3 GLY 1 -0.519 -2.853 5.718 4 HA2 GLY 1 HA1 GLY 1 1.316 -3.100 4.406 5 HA3 GLY 1 HA2 GLY 1 1.250 -1.346 4.567 6 H GLU 2 HN GLU 2 2.628 -4.220 6.200 7 HA GLU 2 HA GLU 2 4.687 -2.576 7.491 8 HB2 GLU 2 HB2 GLU 2 5.483 -4.671 8.436 9 HB3 GLU 2 HB1 GLU 2 3.724 -4.633 8.560 10 HG2 GLU 2 HG2 GLU 2 4.155 -6.788 7.716 11 HG3 GLU 2 HG1 GLU 2 3.755 -5.862 6.269 12 H CGU 3 HN GLA 3 4.294 -4.239 4.508 13 HA CGU 3 HA GLA 3 6.986 -4.946 3.912 14 HB2 CGU 3 HB2 GLA 3 4.767 -4.006 2.066 15 HB3 CGU 3 HB3 GLA 3 5.127 -5.680 2.505 16 HG CGU 3 HG GLA 3 7.030 -3.817 1.047 17 H CGU 4 HN GLA 4 5.201 -1.948 3.114 18 HA CGU 4 HA GLA 4 7.412 -0.574 1.955 19 HB2 CGU 4 HB2 GLA 4 5.232 0.802 3.525 20 HB3 CGU 4 HB3 GLA 4 4.899 0.055 1.962 21 HG CGU 4 HG GLA 4 7.099 2.094 2.413 22 H LEU 5 HN LEU 5 6.412 -1.004 5.303 23 HA LEU 5 HA LEU 5 7.856 1.019 6.586 24 HB2 LEU 5 HB2 LEU 5 6.387 -1.043 7.473 25 HB3 LEU 5 HB1 LEU 5 7.995 -1.709 7.777 26 HG LEU 5 HG LEU 5 7.076 1.025 8.708 27 HD11 LEU 5 HD11 LEU 5 6.015 -1.163 9.725 28 HD12 LEU 5 HD12 LEU 5 6.584 0.115 10.800 29 HD13 LEU 5 HD13 LEU 5 7.581 -1.313 10.525 30 HD21 LEU 5 HD21 LEU 5 9.417 1.104 8.593 31 HD22 LEU 5 HD22 LEU 5 9.591 -0.605 8.992 32 HD23 LEU 5 HD23 LEU 5 9.147 0.553 10.246 33 H ALA 6 HN ALA 6 9.053 -2.108 5.371 34 HA ALA 6 HA ALA 6 11.761 -1.563 6.353 35 HB1 ALA 6 HB1 ALA 6 10.454 -3.760 4.769 36 HB2 ALA 6 HB2 ALA 6 11.352 -3.859 6.284 37 HB3 ALA 6 HB3 ALA 6 12.212 -3.622 4.762 38 H CGU 7 HN GLA 7 10.163 -1.657 3.127 39 HA CGU 7 HA GLA 7 12.344 -1.087 1.481 40 HB2 CGU 7 HB2 GLA 7 10.734 0.229 0.066 41 HB3 CGU 7 HB3 GLA 7 9.555 0.116 1.374 42 HG CGU 7 HG GLA 7 9.711 -2.376 1.238 43 H ASN 8 HN ASN 8 10.747 0.898 3.814 44 HA ASN 8 HA ASN 8 11.430 3.504 3.303 45 HB2 ASN 8 HB2 ASN 8 10.454 2.240 5.444 46 HB3 ASN 8 HB1 ASN 8 12.118 2.401 5.998 47 HD21 ASN 8 HD21 ASN 8 12.098 4.109 7.431 48 HD22 ASN 8 HD22 ASN 8 11.438 5.651 7.104 49 H GLN 9 HN GLN 9 13.586 1.095 4.848 50 HA GLN 9 HA GLN 9 15.868 2.903 4.774 51 HB2 GLN 9 HB2 GLN 9 17.098 1.135 5.765 52 HB3 GLN 9 HB1 GLN 9 15.468 0.955 6.416 53 HG2 GLN 9 HG2 GLN 9 14.991 -0.699 4.586 54 HG3 GLN 9 HG1 GLN 9 16.689 -0.602 4.119 55 HE21 GLN 9 HE21 GLN 9 16.559 -0.156 7.445 56 HE22 GLN 9 HE22 GLN 9 16.834 -1.766 7.938 57 H CGU 10 HN GLA 10 14.747 0.155 2.819 58 HA CGU 10 HA GLA 10 17.004 -0.205 1.198 59 HB2 CGU 10 HB2 GLA 10 14.140 -0.258 0.220 60 HB3 CGU 10 HB3 GLA 10 14.903 -1.581 1.104 61 HG CGU 10 HG GLA 10 16.672 -1.668 -0.680 62 H PHE 11 HN PHE 11 14.654 2.349 1.161 63 HA PHE 11 HA PHE 11 14.953 3.545 -1.307 64 HB2 PHE 11 HB2 PHE 11 13.687 4.329 0.781 65 HB3 PHE 11 HB1 PHE 11 15.193 5.110 1.254 66 HD1 PHE 11 HD1 PHE 11 16.352 6.549 -0.668 67 HD2 PHE 11 HD2 PHE 11 12.179 5.539 -0.531 68 HE1 PHE 11 HE1 PHE 11 15.841 8.449 -2.179 69 HE2 PHE 11 HE2 PHE 11 11.669 7.438 -2.043 70 HZ PHE 11 HZ PHE 11 13.500 8.893 -2.866 71 H ALA 12 HN ALA 12 17.267 3.652 1.394 72 HA ALA 12 HA ALA 12 19.099 5.465 0.106 73 HB1 ALA 12 HB1 ALA 12 19.146 3.680 2.488 74 HB2 ALA 12 HB2 ALA 12 19.570 5.387 2.352 75 HB3 ALA 12 HB3 ALA 12 20.707 4.150 1.816 76 H ARG 13 HN ARG 13 18.589 2.009 -0.109 77 HA ARG 13 HA ARG 13 21.187 1.566 -1.418 78 HB2 ARG 13 HB2 ARG 13 20.104 -0.168 0.042 79 HB3 ARG 13 HB1 ARG 13 18.837 -0.333 -1.174 80 HG2 ARG 13 HG2 ARG 13 20.742 -0.754 -2.853 81 HG3 ARG 13 HG1 ARG 13 21.773 -0.980 -1.440 82 HD2 ARG 13 HD2 ARG 13 19.239 -2.529 -2.055 83 HD3 ARG 13 HD1 ARG 13 20.890 -3.142 -2.197 84 HE ARG 13 HE ARG 13 20.592 -2.218 0.454 85 HH11 ARG 13 HH21 ARG 13 19.594 -4.701 -1.706 86 HH12 ARG 13 HH22 ARG 13 19.065 -5.770 -0.450 87 HH21 ARG 13 HH11 ARG 13 19.766 -3.535 2.110 88 HH22 ARG 13 HH12 ARG 13 19.159 -5.108 1.712 89 H CGU 14 HN GLA 14 17.819 2.060 -2.361 90 HA CGU 14 HA GLA 14 17.783 1.104 -4.953 91 HB2 CGU 14 HB2 GLA 14 16.551 3.603 -5.035 92 HB3 CGU 14 HB3 GLA 14 16.420 3.112 -3.360 93 HG CGU 14 HG GLA 14 15.465 0.965 -4.054 94 H LEU 15 HN LEU 15 19.159 4.162 -3.759 95 HA LEU 15 HA LEU 15 19.879 5.381 -6.168 96 HB2 LEU 15 HB2 LEU 15 21.686 6.459 -4.943 97 HB3 LEU 15 HB1 LEU 15 20.293 6.313 -3.873 98 HG LEU 15 HG LEU 15 21.385 4.036 -3.172 99 HD11 LEU 15 HD11 LEU 15 23.403 3.571 -4.057 100 HD12 LEU 15 HD12 LEU 15 24.043 5.074 -3.396 101 HD13 LEU 15 HD13 LEU 15 23.335 5.054 -5.009 102 HD21 LEU 15 HD21 LEU 15 21.112 6.059 -1.739 103 HD22 LEU 15 HD22 LEU 15 22.646 6.675 -2.357 104 HD23 LEU 15 HD23 LEU 15 22.612 5.194 -1.398 105 H ALA 16 HN ALA 16 21.343 2.620 -4.550 106 HA ALA 16 HA ALA 16 23.773 2.353 -5.882 107 HB1 ALA 16 HB1 ALA 16 21.977 -0.042 -5.596 108 HB2 ALA 16 HB2 ALA 16 22.571 0.782 -4.155 109 HB3 ALA 16 HB3 ALA 16 23.712 0.085 -5.305 110 H ASN 17 HN ASN 17 20.533 1.503 -7.070 111 HA ASN 17 HA ASN 17 21.292 0.285 -9.509 112 HB2 ASN 17 HB2 ASN 17 18.975 0.263 -8.734 113 HB3 ASN 17 HB1 ASN 17 18.879 2.018 -8.892 114 HD21 ASN 17 HD21 ASN 17 17.988 -0.758 -10.478 115 HD22 ASN 17 HD22 ASN 17 17.990 -0.181 -12.084 116 HN1 NH2 18 H1 NH2 18 19.885 3.588 -9.528 117 HN2 NH2 18 H2 NH2 18 21.006 4.229 -10.631 Start of MODEL 17 1 H1 GLY 1 HT1 GLY 1 2.935 -0.666 4.863 2 H2 GLY 1 HT2 GLY 1 1.245 -0.488 4.863 3 H3 GLY 1 HT3 GLY 1 1.971 -1.734 3.965 4 HA2 GLY 1 HA1 GLY 1 1.367 -1.593 6.799 5 HA3 GLY 1 HA2 GLY 1 1.436 -2.994 5.731 6 H GLU 2 HN GLU 2 2.954 -4.344 6.589 7 HA GLU 2 HA GLU 2 5.304 -3.299 7.980 8 HB2 GLU 2 HB2 GLU 2 4.177 -5.405 8.684 9 HB3 GLU 2 HB1 GLU 2 4.643 -6.142 7.152 10 HG2 GLU 2 HG2 GLU 2 6.291 -6.816 8.759 11 HG3 GLU 2 HG1 GLU 2 7.051 -5.588 7.750 12 H CGU 3 HN GLA 3 4.503 -4.208 4.749 13 HA CGU 3 HA GLA 3 7.267 -4.749 3.941 14 HB2 CGU 3 HB2 GLA 3 4.709 -4.336 2.366 15 HB3 CGU 3 HB3 GLA 3 5.516 -5.870 2.708 16 HG CGU 3 HG GLA 3 6.626 -3.599 1.024 17 H CGU 4 HN GLA 4 4.908 -2.116 3.390 18 HA CGU 4 HA GLA 4 6.552 -0.412 1.870 19 HB2 CGU 4 HB2 GLA 4 4.643 0.524 4.027 20 HB3 CGU 4 HB3 GLA 4 4.108 -0.064 2.453 21 HG CGU 4 HG GLA 4 5.519 1.681 1.362 22 H LEU 5 HN LEU 5 6.177 -0.446 5.436 23 HA LEU 5 HA LEU 5 8.042 1.547 6.067 24 HB2 LEU 5 HB2 LEU 5 6.517 -0.089 7.556 25 HB3 LEU 5 HB1 LEU 5 8.069 -0.915 7.744 26 HG LEU 5 HG LEU 5 7.624 2.042 8.246 27 HD11 LEU 5 HD11 LEU 5 7.901 -0.277 10.184 28 HD12 LEU 5 HD12 LEU 5 6.447 0.683 9.918 29 HD13 LEU 5 HD13 LEU 5 7.873 1.428 10.640 30 HD21 LEU 5 HD21 LEU 5 9.893 1.474 9.525 31 HD22 LEU 5 HD22 LEU 5 9.894 1.877 7.809 32 HD23 LEU 5 HD23 LEU 5 9.976 0.190 8.318 33 H ALA 6 HN ALA 6 8.592 -1.687 4.875 34 HA ALA 6 HA ALA 6 11.423 -1.689 5.625 35 HB1 ALA 6 HB1 ALA 6 11.134 -3.648 3.694 36 HB2 ALA 6 HB2 ALA 6 9.518 -3.569 4.396 37 HB3 ALA 6 HB3 ALA 6 10.913 -3.895 5.426 38 H CGU 7 HN GLA 7 9.532 -1.183 2.620 39 HA CGU 7 HA GLA 7 11.589 -1.012 0.737 40 HB2 CGU 7 HB2 GLA 7 10.199 0.812 -0.351 41 HB3 CGU 7 HB3 GLA 7 9.152 0.768 1.068 42 HG CGU 7 HG GLA 7 8.755 -1.659 0.655 43 H ASN 8 HN ASN 8 10.754 1.141 3.324 44 HA ASN 8 HA ASN 8 12.053 3.514 2.852 45 HB2 ASN 8 HB2 ASN 8 10.965 2.377 5.026 46 HB3 ASN 8 HB1 ASN 8 12.659 2.119 5.425 47 HD21 ASN 8 HD21 ASN 8 12.913 3.692 7.049 48 HD22 ASN 8 HD22 ASN 8 12.712 5.366 6.779 49 H GLN 9 HN GLN 9 13.603 0.520 4.059 50 HA GLN 9 HA GLN 9 16.270 1.643 3.929 51 HB2 GLN 9 HB2 GLN 9 15.144 -0.529 5.166 52 HB3 GLN 9 HB1 GLN 9 16.010 -1.292 3.833 53 HG2 GLN 9 HG2 GLN 9 18.082 -0.184 4.494 54 HG3 GLN 9 HG1 GLN 9 17.233 0.698 5.764 55 HE21 GLN 9 HE21 GLN 9 19.137 -2.015 5.255 56 HE22 GLN 9 HE22 GLN 9 18.657 -2.935 6.609 57 H CGU 10 HN GLA 10 14.443 -0.647 1.880 58 HA CGU 10 HA GLA 10 16.520 -1.105 -0.009 59 HB2 CGU 10 HB2 GLA 10 13.529 -1.111 -0.447 60 HB3 CGU 10 HB3 GLA 10 14.487 -2.488 0.086 61 HG CGU 10 HG GLA 10 14.691 -1.049 -2.571 62 H PHE 11 HN PHE 11 14.507 1.574 0.519 63 HA PHE 11 HA PHE 11 14.810 2.690 -2.163 64 HB2 PHE 11 HB2 PHE 11 12.837 3.114 -0.784 65 HB3 PHE 11 HB1 PHE 11 13.849 3.882 0.435 66 HD1 PHE 11 HD1 PHE 11 13.386 4.071 -3.291 67 HD2 PHE 11 HD2 PHE 11 13.872 6.213 0.400 68 HE1 PHE 11 HE1 PHE 11 13.230 6.220 -4.518 69 HE2 PHE 11 HE2 PHE 11 13.717 8.362 -0.827 70 HZ PHE 11 HZ PHE 11 13.393 8.366 -3.286 71 H ALA 12 HN ALA 12 16.066 3.532 1.080 72 HA ALA 12 HA ALA 12 17.698 5.694 0.280 73 HB1 ALA 12 HB1 ALA 12 18.220 3.655 2.467 74 HB2 ALA 12 HB2 ALA 12 17.277 5.135 2.642 75 HB3 ALA 12 HB3 ALA 12 19.009 5.226 2.328 76 H ARG 13 HN ARG 13 18.336 2.208 0.193 77 HA ARG 13 HA ARG 13 21.088 2.652 -0.744 78 HB2 ARG 13 HB2 ARG 13 19.460 0.122 -0.376 79 HB3 ARG 13 HB1 ARG 13 21.151 0.152 -0.875 80 HG2 ARG 13 HG2 ARG 13 20.230 1.533 1.648 81 HG3 ARG 13 HG1 ARG 13 20.673 -0.175 1.641 82 HD2 ARG 13 HD2 ARG 13 22.876 0.498 0.589 83 HD3 ARG 13 HD1 ARG 13 22.431 2.179 0.897 84 HE ARG 13 HE ARG 13 22.851 1.823 3.199 85 HH11 ARG 13 HH21 ARG 13 24.334 -0.588 1.578 86 HH12 ARG 13 HH22 ARG 13 24.203 -1.798 2.810 87 HH21 ARG 13 HH11 ARG 13 21.977 0.029 4.741 88 HH22 ARG 13 HH12 ARG 13 22.869 -1.450 4.599 89 H CGU 14 HN GLA 14 17.944 2.115 -2.177 90 HA CGU 14 HA GLA 14 18.472 0.879 -4.565 91 HB2 CGU 14 HB2 GLA 14 16.885 3.112 -5.177 92 HB3 CGU 14 HB3 GLA 14 16.553 2.750 -3.499 93 HG CGU 14 HG GLA 14 16.107 0.416 -4.071 94 H LEU 15 HN LEU 15 19.229 4.254 -3.707 95 HA LEU 15 HA LEU 15 20.012 5.245 -6.200 96 HB2 LEU 15 HB2 LEU 15 22.025 6.085 -4.377 97 HB3 LEU 15 HB1 LEU 15 20.587 6.974 -4.876 98 HG LEU 15 HG LEU 15 20.546 4.893 -2.680 99 HD11 LEU 15 HD11 LEU 15 21.152 7.846 -2.605 100 HD12 LEU 15 HD12 LEU 15 21.993 6.528 -1.789 101 HD13 LEU 15 HD13 LEU 15 20.405 7.045 -1.222 102 HD21 LEU 15 HD21 LEU 15 18.678 7.228 -3.004 103 HD22 LEU 15 HD22 LEU 15 18.382 5.668 -2.238 104 HD23 LEU 15 HD23 LEU 15 18.442 5.789 -3.995 105 H ALA 16 HN ALA 16 21.738 2.998 -4.096 106 HA ALA 16 HA ALA 16 24.291 2.957 -5.163 107 HB1 ALA 16 HB1 ALA 16 22.655 0.455 -4.661 108 HB2 ALA 16 HB2 ALA 16 23.383 1.422 -3.377 109 HB3 ALA 16 HB3 ALA 16 24.409 0.617 -4.565 110 H ASN 17 HN ASN 17 21.367 2.360 -6.848 111 HA ASN 17 HA ASN 17 22.955 1.426 -9.203 112 HB2 ASN 17 HB2 ASN 17 20.146 0.539 -8.476 113 HB3 ASN 17 HB1 ASN 17 21.086 -0.003 -9.867 114 HD21 ASN 17 HD21 ASN 17 20.143 -1.108 -6.938 115 HD22 ASN 17 HD22 ASN 17 21.498 -2.049 -6.511 116 HN1 NH2 18 H1 NH2 18 19.899 1.526 -10.313 117 HN2 NH2 18 H2 NH2 18 19.784 3.152 -10.787 Start of MODEL 18 1 H1 GLY 1 HT1 GLY 1 1.063 -4.492 5.887 2 H2 GLY 1 HT2 GLY 1 1.497 -4.231 4.265 3 H3 GLY 1 HT3 GLY 1 0.013 -3.653 4.854 4 HA2 GLY 1 HA1 GLY 1 1.659 -1.870 4.625 5 HA3 GLY 1 HA2 GLY 1 1.119 -2.092 6.289 6 H GLU 2 HN GLU 2 2.650 -4.642 6.527 7 HA GLU 2 HA GLU 2 5.075 -3.577 7.592 8 HB2 GLU 2 HB2 GLU 2 4.382 -6.420 6.789 9 HB3 GLU 2 HB1 GLU 2 5.781 -5.962 7.761 10 HG2 GLU 2 HG2 GLU 2 4.328 -5.041 9.491 11 HG3 GLU 2 HG1 GLU 2 2.902 -5.369 8.506 12 H CGU 3 HN GLA 3 4.224 -3.742 4.429 13 HA CGU 3 HA GLA 3 6.823 -4.652 3.372 14 HB2 CGU 3 HB2 GLA 3 4.389 -3.470 1.995 15 HB3 CGU 3 HB3 GLA 3 4.805 -5.185 2.092 16 HG CGU 3 HG GLA 3 6.467 -3.030 0.739 17 H CGU 4 HN GLA 4 4.909 -1.632 3.092 18 HA CGU 4 HA GLA 4 6.936 -0.005 2.024 19 HB2 CGU 4 HB2 GLA 4 5.012 1.024 4.109 20 HB3 CGU 4 HB3 GLA 4 4.445 0.544 2.508 21 HG CGU 4 HG GLA 4 5.986 2.139 1.460 22 H LEU 5 HN LEU 5 6.385 -1.011 5.360 23 HA LEU 5 HA LEU 5 8.053 0.762 6.744 24 HB2 LEU 5 HB2 LEU 5 6.640 -1.392 7.486 25 HB3 LEU 5 HB1 LEU 5 8.247 -2.128 7.448 26 HG LEU 5 HG LEU 5 7.549 0.416 8.940 27 HD11 LEU 5 HD11 LEU 5 6.546 -1.147 10.301 28 HD12 LEU 5 HD12 LEU 5 8.205 -1.329 10.871 29 HD13 LEU 5 HD13 LEU 5 7.546 -2.468 9.697 30 HD21 LEU 5 HD21 LEU 5 9.831 0.588 8.553 31 HD22 LEU 5 HD22 LEU 5 10.053 -1.161 8.469 32 HD23 LEU 5 HD23 LEU 5 9.841 -0.373 10.032 33 H ALA 6 HN ALA 6 8.947 -2.092 4.830 34 HA ALA 6 HA ALA 6 11.779 -1.804 5.545 35 HB1 ALA 6 HB1 ALA 6 10.366 -3.961 4.820 36 HB2 ALA 6 HB2 ALA 6 12.092 -3.829 4.481 37 HB3 ALA 6 HB3 ALA 6 10.916 -3.472 3.217 38 H CGU 7 HN GLA 7 9.720 -1.114 2.695 39 HA CGU 7 HA GLA 7 11.651 -0.444 0.793 40 HB2 CGU 7 HB2 GLA 7 10.028 1.342 0.020 41 HB3 CGU 7 HB3 GLA 7 9.061 0.994 1.454 42 HG CGU 7 HG GLA 7 8.827 -1.353 0.731 43 H ASN 8 HN ASN 8 10.756 1.204 3.701 44 HA ASN 8 HA ASN 8 11.724 3.764 3.519 45 HB2 ASN 8 HB2 ASN 8 10.910 2.240 5.553 46 HB3 ASN 8 HB1 ASN 8 12.643 2.099 5.828 47 HD21 ASN 8 HD21 ASN 8 12.879 3.450 7.635 48 HD22 ASN 8 HD22 ASN 8 12.495 5.115 7.631 49 H GLN 9 HN GLN 9 13.738 0.909 4.323 50 HA GLN 9 HA GLN 9 16.179 2.502 3.972 51 HB2 GLN 9 HB2 GLN 9 17.337 0.346 4.503 52 HB3 GLN 9 HB1 GLN 9 16.170 0.835 5.731 53 HG2 GLN 9 HG2 GLN 9 14.485 -0.670 4.679 54 HG3 GLN 9 HG1 GLN 9 15.715 -1.208 3.537 55 HE21 GLN 9 HE21 GLN 9 16.606 -3.160 4.173 56 HE22 GLN 9 HE22 GLN 9 16.887 -3.632 5.788 57 H CGU 10 HN GLA 10 14.718 -0.328 2.323 58 HA CGU 10 HA GLA 10 16.625 -0.743 0.346 59 HB2 CGU 10 HB2 GLA 10 13.638 -0.716 -0.121 60 HB3 CGU 10 HB3 GLA 10 14.523 -2.060 0.593 61 HG CGU 10 HG GLA 10 14.956 -0.909 -2.177 62 H PHE 11 HN PHE 11 14.795 2.006 0.898 63 HA PHE 11 HA PHE 11 14.935 3.053 -1.830 64 HB2 PHE 11 HB2 PHE 11 13.075 3.611 -0.375 65 HB3 PHE 11 HB1 PHE 11 14.177 4.292 0.817 66 HD1 PHE 11 HD1 PHE 11 15.697 6.241 0.071 67 HD2 PHE 11 HD2 PHE 11 12.235 4.964 -2.125 68 HE1 PHE 11 HE1 PHE 11 15.637 8.423 -1.102 69 HE2 PHE 11 HE2 PHE 11 12.174 7.147 -3.300 70 HZ PHE 11 HZ PHE 11 13.876 8.877 -2.788 71 H ALA 12 HN ALA 12 16.771 3.343 1.165 72 HA ALA 12 HA ALA 12 18.314 5.641 0.313 73 HB1 ALA 12 HB1 ALA 12 18.239 5.279 2.654 74 HB2 ALA 12 HB2 ALA 12 19.878 4.824 2.189 75 HB3 ALA 12 HB3 ALA 12 18.667 3.577 2.487 76 H ARG 13 HN ARG 13 18.893 2.121 0.267 77 HA ARG 13 HA ARG 13 21.507 2.510 -1.018 78 HB2 ARG 13 HB2 ARG 13 21.165 0.646 0.564 79 HB3 ARG 13 HB1 ARG 13 19.933 -0.030 -0.502 80 HG2 ARG 13 HG2 ARG 13 21.626 -0.210 -2.312 81 HG3 ARG 13 HG1 ARG 13 22.853 0.398 -1.201 82 HD2 ARG 13 HD2 ARG 13 22.457 -1.514 0.300 83 HD3 ARG 13 HD1 ARG 13 21.213 -2.122 -0.798 84 HE ARG 13 HE ARG 13 23.701 -1.759 -2.206 85 HH11 ARG 13 HH21 ARG 13 22.165 -3.691 0.198 86 HH12 ARG 13 HH22 ARG 13 22.997 -5.143 -0.245 87 HH21 ARG 13 HH11 ARG 13 24.735 -3.664 -2.856 88 HH22 ARG 13 HH12 ARG 13 24.448 -5.129 -1.980 89 H CGU 14 HN GLA 14 18.206 1.962 -2.022 90 HA CGU 14 HA GLA 14 18.428 0.697 -4.454 91 HB2 CGU 14 HB2 GLA 14 16.720 2.878 -4.858 92 HB3 CGU 14 HB3 GLA 14 16.644 2.555 -3.140 93 HG CGU 14 HG GLA 14 16.255 0.148 -3.665 94 H LEU 15 HN LEU 15 19.107 4.138 -3.753 95 HA LEU 15 HA LEU 15 19.600 5.072 -6.342 96 HB2 LEU 15 HB2 LEU 15 21.231 6.644 -5.307 97 HB3 LEU 15 HB1 LEU 15 19.736 6.539 -4.381 98 HG LEU 15 HG LEU 15 20.973 4.663 -3.050 99 HD11 LEU 15 HD11 LEU 15 23.111 4.266 -3.624 100 HD12 LEU 15 HD12 LEU 15 23.516 5.938 -3.241 101 HD13 LEU 15 HD13 LEU 15 23.025 5.503 -4.876 102 HD21 LEU 15 HD21 LEU 15 21.394 7.639 -2.888 103 HD22 LEU 15 HD22 LEU 15 22.180 6.575 -1.722 104 HD23 LEU 15 HD23 LEU 15 20.422 6.597 -1.849 105 H ALA 16 HN ALA 16 21.559 2.958 -4.341 106 HA ALA 16 HA ALA 16 24.033 3.035 -5.626 107 HB1 ALA 16 HB1 ALA 16 24.342 0.736 -4.901 108 HB2 ALA 16 HB2 ALA 16 22.599 0.507 -4.761 109 HB3 ALA 16 HB3 ALA 16 23.436 1.596 -3.655 110 H ASN 17 HN ASN 17 21.024 1.544 -6.725 111 HA ASN 17 HA ASN 17 22.228 0.187 -8.990 112 HB2 ASN 17 HB2 ASN 17 20.063 -0.532 -8.045 113 HB3 ASN 17 HB1 ASN 17 19.347 1.011 -8.512 114 HD21 ASN 17 HD21 ASN 17 18.175 0.821 -10.412 115 HD22 ASN 17 HD22 ASN 17 18.580 -0.198 -11.721 116 HN1 NH2 18 H1 NH2 18 23.503 2.196 -9.733 117 HN2 NH2 18 H2 NH2 18 22.716 3.280 -10.775 Start of MODEL 19 1 H1 GLY 1 HT1 GLY 1 3.268 -0.608 3.332 2 H2 GLY 1 HT2 GLY 1 2.847 0.783 4.212 3 H3 GLY 1 HT3 GLY 1 1.712 0.051 3.181 4 HA2 GLY 1 HA1 GLY 1 1.435 -0.383 5.642 5 HA3 GLY 1 HA2 GLY 1 1.429 -1.787 4.575 6 H GLU 2 HN GLU 2 2.512 -3.395 5.617 7 HA GLU 2 HA GLU 2 4.709 -2.805 7.458 8 HB2 GLU 2 HB2 GLU 2 3.716 -5.472 6.406 9 HB3 GLU 2 HB1 GLU 2 4.790 -5.234 7.784 10 HG2 GLU 2 HG2 GLU 2 2.509 -5.572 8.589 11 HG3 GLU 2 HG1 GLU 2 3.001 -3.908 8.906 12 H CGU 3 HN GLA 3 4.363 -4.331 4.256 13 HA CGU 3 HA GLA 3 7.100 -5.037 3.910 14 HB2 CGU 3 HB2 GLA 3 4.997 -4.263 1.865 15 HB3 CGU 3 HB3 GLA 3 5.402 -5.899 2.400 16 HG CGU 3 HG GLA 3 7.214 -3.988 0.892 17 H CGU 4 HN GLA 4 5.353 -2.102 2.833 18 HA CGU 4 HA GLA 4 7.657 -0.790 1.769 19 HB2 CGU 4 HB2 GLA 4 5.208 0.508 3.000 20 HB3 CGU 4 HB3 GLA 4 5.275 -0.114 1.350 21 HG CGU 4 HG GLA 4 7.244 1.411 0.945 22 H LEU 5 HN LEU 5 6.412 -1.097 5.030 23 HA LEU 5 HA LEU 5 7.668 1.022 6.350 24 HB2 LEU 5 HB2 LEU 5 6.237 -1.087 7.190 25 HB3 LEU 5 HB1 LEU 5 7.850 -1.668 7.623 26 HG LEU 5 HG LEU 5 6.790 1.062 8.398 27 HD11 LEU 5 HD11 LEU 5 7.142 -1.050 10.448 28 HD12 LEU 5 HD12 LEU 5 5.775 -1.273 9.356 29 HD13 LEU 5 HD13 LEU 5 5.904 0.198 10.320 30 HD21 LEU 5 HD21 LEU 5 8.702 0.530 10.177 31 HD22 LEU 5 HD22 LEU 5 9.095 1.214 8.599 32 HD23 LEU 5 HD23 LEU 5 9.288 -0.516 8.885 33 H ALA 6 HN ALA 6 9.085 -2.059 5.280 34 HA ALA 6 HA ALA 6 11.690 -1.392 6.448 35 HB1 ALA 6 HB1 ALA 6 10.964 -3.747 6.255 36 HB2 ALA 6 HB2 ALA 6 12.446 -3.470 5.339 37 HB3 ALA 6 HB3 ALA 6 10.900 -3.588 4.499 38 H CGU 7 HN GLA 7 10.275 -1.501 3.148 39 HA CGU 7 HA GLA 7 12.532 -0.920 1.608 40 HB2 CGU 7 HB2 GLA 7 11.020 0.296 0.069 41 HB3 CGU 7 HB3 GLA 7 9.786 0.355 1.331 42 HG CGU 7 HG GLA 7 9.698 -2.107 1.367 43 H ASN 8 HN ASN 8 10.811 1.070 3.854 44 HA ASN 8 HA ASN 8 11.520 3.674 3.362 45 HB2 ASN 8 HB2 ASN 8 10.449 2.423 5.462 46 HB3 ASN 8 HB1 ASN 8 12.086 2.579 6.090 47 HD21 ASN 8 HD21 ASN 8 11.838 4.256 7.587 48 HD22 ASN 8 HD22 ASN 8 11.272 5.816 7.187 49 H GLN 9 HN GLN 9 13.623 1.206 4.882 50 HA GLN 9 HA GLN 9 15.904 3.040 4.911 51 HB2 GLN 9 HB2 GLN 9 16.068 1.563 6.692 52 HB3 GLN 9 HB1 GLN 9 15.379 0.222 5.779 53 HG2 GLN 9 HG2 GLN 9 17.832 -0.040 6.237 54 HG3 GLN 9 HG1 GLN 9 17.435 -0.050 4.519 55 HE21 GLN 9 HE21 GLN 9 17.184 3.045 6.071 56 HE22 GLN 9 HE22 GLN 9 18.643 3.697 5.473 57 H CGU 10 HN GLA 10 14.937 0.132 3.087 58 HA CGU 10 HA GLA 10 17.211 -0.224 1.513 59 HB2 CGU 10 HB2 GLA 10 14.359 -0.391 0.508 60 HB3 CGU 10 HB3 GLA 10 15.158 -1.660 1.435 61 HG CGU 10 HG GLA 10 16.943 -1.726 -0.347 62 H PHE 11 HN PHE 11 14.853 2.305 1.375 63 HA PHE 11 HA PHE 11 15.099 3.409 -1.136 64 HB2 PHE 11 HB2 PHE 11 13.901 4.293 0.954 65 HB3 PHE 11 HB1 PHE 11 15.430 5.074 1.354 66 HD1 PHE 11 HD1 PHE 11 13.243 4.605 -1.669 67 HD2 PHE 11 HD2 PHE 11 15.680 7.279 0.648 68 HE1 PHE 11 HE1 PHE 11 12.721 6.446 -3.245 69 HE2 PHE 11 HE2 PHE 11 15.156 9.121 -0.929 70 HZ PHE 11 HZ PHE 11 13.677 8.705 -2.875 71 H ALA 12 HN ALA 12 17.421 3.853 1.548 72 HA ALA 12 HA ALA 12 19.255 5.512 0.165 73 HB1 ALA 12 HB1 ALA 12 19.148 4.580 2.682 74 HB2 ALA 12 HB2 ALA 12 20.638 5.209 1.976 75 HB3 ALA 12 HB3 ALA 12 20.355 3.469 2.034 76 H ARG 13 HN ARG 13 18.783 2.024 0.028 77 HA ARG 13 HA ARG 13 21.271 1.643 -1.498 78 HB2 ARG 13 HB2 ARG 13 20.543 -0.132 0.031 79 HB3 ARG 13 HB1 ARG 13 19.021 -0.286 -0.849 80 HG2 ARG 13 HG2 ARG 13 20.192 -0.992 -2.858 81 HG3 ARG 13 HG1 ARG 13 21.755 -0.697 -2.095 82 HD2 ARG 13 HD2 ARG 13 21.243 -3.089 -2.019 83 HD3 ARG 13 HD1 ARG 13 21.214 -2.421 -0.382 84 HE ARG 13 HE ARG 13 18.578 -2.239 -1.261 85 HH11 ARG 13 HH11 ARG 13 20.652 -4.809 -1.953 86 HH12 ARG 13 HH12 ARG 13 19.663 -6.027 -1.218 87 HH21 ARG 13 HH21 ARG 13 17.414 -3.758 0.134 88 HH22 ARG 13 HH22 ARG 13 17.828 -5.431 -0.036 89 H CGU 14 HN GLA 14 17.813 1.988 -2.146 90 HA CGU 14 HA GLA 14 17.550 0.966 -4.687 91 HB2 CGU 14 HB2 GLA 14 16.320 3.484 -4.722 92 HB3 CGU 14 HB3 GLA 14 16.321 3.005 -3.039 93 HG CGU 14 HG GLA 14 15.377 0.809 -3.708 94 H LEU 15 HN LEU 15 19.048 4.052 -3.732 95 HA LEU 15 HA LEU 15 19.530 5.131 -6.289 96 HB2 LEU 15 HB2 LEU 15 21.397 6.342 -5.250 97 HB3 LEU 15 HB1 LEU 15 20.021 6.304 -4.150 98 HG LEU 15 HG LEU 15 21.166 4.090 -3.274 99 HD11 LEU 15 HD11 LEU 15 23.765 5.319 -3.616 100 HD12 LEU 15 HD12 LEU 15 23.056 4.951 -5.187 101 HD13 LEU 15 HD13 LEU 15 23.258 3.672 -3.992 102 HD21 LEU 15 HD21 LEU 15 20.789 6.093 -1.914 103 HD22 LEU 15 HD22 LEU 15 22.180 6.884 -2.657 104 HD23 LEU 15 HD23 LEU 15 22.415 5.476 -1.621 105 H ALA 16 HN ALA 16 21.111 2.502 -4.594 106 HA ALA 16 HA ALA 16 23.520 2.198 -5.942 107 HB1 ALA 16 HB1 ALA 16 22.689 0.658 -4.172 108 HB2 ALA 16 HB2 ALA 16 23.282 -0.220 -5.582 109 HB3 ALA 16 HB3 ALA 16 21.546 -0.027 -5.329 110 H ASN 17 HN ASN 17 20.318 1.969 -7.251 111 HA ASN 17 HA ASN 17 21.433 1.658 -9.947 112 HB2 ASN 17 HB2 ASN 17 19.550 -0.420 -8.785 113 HB3 ASN 17 HB1 ASN 17 20.025 -0.320 -10.482 114 HD21 ASN 17 HD21 ASN 17 20.817 -1.832 -7.579 115 HD22 ASN 17 HD22 ASN 17 22.432 -2.251 -7.935 116 HN1 NH2 18 H1 NH2 18 20.399 3.716 -10.369 117 HN2 NH2 18 H2 NH2 18 18.711 3.881 -10.434
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