NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
650569 | 6vnz | 30719 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ALA 1 H1 ALA 1 13.007 26.396 36.212 2 H2 ALA 1 H2 ALA 1 12.859 25.802 34.682 3 H3 ALA 1 H3 ALA 1 12.797 27.426 34.942 4 HA ALA 1 HA ALA 1 15.070 27.447 35.698 5 HB1 ALA 1 HB1 ALA 1 15.081 24.530 34.815 6 HB2 ALA 1 HB2 ALA 1 16.478 25.470 35.378 7 HB3 ALA 1 HB3 ALA 1 15.155 25.101 36.498 8 H PHE 2 H PHE 2 16.727 27.992 34.196 9 HA PHE 2 HA PHE 2 15.860 28.041 31.331 10 HB2 PHE 2 HB2 PHE 2 17.837 29.736 32.893 11 HB3 PHE 2 HB3 PHE 2 17.485 29.925 31.194 12 HD1 PHE 2 HD1 PHE 2 16.585 30.976 34.483 13 HD2 PHE 2 HD2 PHE 2 14.993 30.364 30.521 14 HE1 PHE 2 HE1 PHE 2 14.696 32.502 35.003 15 HE2 PHE 2 HE2 PHE 2 13.106 31.882 31.044 16 HZ PHE 2 HZ PHE 2 12.954 32.956 33.288 17 H CYS 3 H CYS 3 17.830 28.132 29.775 18 HA CYS 3 HA CYS 3 19.571 25.773 30.149 19 HB2 CYS 3 HB2 CYS 3 19.481 28.043 28.104 20 HB3 CYS 3 HB3 CYS 3 20.691 26.779 28.104 21 H ASN 4 H ASN 4 21.906 25.918 30.424 22 HA ASN 4 HA ASN 4 22.986 28.410 31.628 23 HB2 ASN 4 HB2 ASN 4 24.398 25.860 30.699 24 HB3 ASN 4 HB3 ASN 4 25.119 27.239 31.499 25 HD21 ASN 4 HD21 ASN 4 23.337 26.430 34.642 26 HD22 ASN 4 HD22 ASN 4 23.834 27.829 33.698 27 H LEU 5 H LEU 5 21.949 29.335 29.514 28 HA LEU 5 HA LEU 5 22.871 28.716 26.964 29 HB2 LEU 5 HB2 LEU 5 20.894 30.327 28.031 30 HB3 LEU 5 HB3 LEU 5 21.936 31.509 27.265 31 HG LEU 5 HG LEU 5 20.724 29.021 25.967 32 HD11 LEU 5 HD11 LEU 5 20.072 31.953 25.482 33 HD12 LEU 5 HD12 LEU 5 19.293 30.555 24.723 34 HD13 LEU 5 HD13 LEU 5 19.088 30.842 26.459 35 HD21 LEU 5 HD21 LEU 5 22.407 31.228 24.734 36 HD22 LEU 5 HD22 LEU 5 22.776 29.490 24.778 37 HD23 LEU 5 HD23 LEU 5 21.439 30.078 23.798 38 H ARG 6 H ARG 6 24.284 31.120 29.206 39 HA ARG 6 HA ARG 6 26.204 32.149 27.243 40 HB2 ARG 6 HB2 ARG 6 26.425 31.989 30.278 41 HB3 ARG 6 HB3 ARG 6 27.482 32.920 29.218 42 HG2 ARG 6 HG2 ARG 6 24.517 33.422 29.714 43 HG3 ARG 6 HG3 ARG 6 25.891 34.342 30.310 44 HD2 ARG 6 HD2 ARG 6 25.147 35.682 28.582 45 HD3 ARG 6 HD3 ARG 6 26.499 34.813 27.874 46 HE ARG 6 HE ARG 6 25.062 33.826 26.349 47 HH11 ARG 6 HH11 ARG 6 22.988 35.093 28.954 48 HH12 ARG 6 HH12 ARG 6 21.562 34.789 27.954 49 HH21 ARG 6 HH21 ARG 6 23.160 33.629 25.225 50 HH22 ARG 6 HH22 ARG 6 21.643 34.001 26.074 51 H ARG 7 H ARG 7 26.344 29.418 29.496 52 HA ARG 7 HA ARG 7 29.097 28.717 28.791 53 HB2 ARG 7 HB2 ARG 7 27.825 28.147 30.979 54 HB3 ARG 7 HB3 ARG 7 27.053 26.857 30.077 55 HG2 ARG 7 HG2 ARG 7 30.055 27.036 29.866 56 HG3 ARG 7 HG3 ARG 7 29.405 26.631 31.458 57 HD2 ARG 7 HD2 ARG 7 28.926 25.093 28.883 58 HD3 ARG 7 HD3 ARG 7 30.026 24.629 30.175 59 HE ARG 7 HE ARG 7 27.155 24.262 30.047 60 HH11 ARG 7 HH11 ARG 7 29.809 24.396 32.442 61 HH12 ARG 7 HH12 ARG 7 28.980 23.163 33.384 62 HH21 ARG 7 HH21 ARG 7 26.178 22.918 31.550 63 HH22 ARG 7 HH22 ARG 7 27.143 22.395 32.917 64 H CYS 8 H CYS 8 25.894 27.572 27.832 65 HA CYS 8 HA CYS 8 26.572 25.605 25.911 66 HB2 CYS 8 HB2 CYS 8 24.376 27.704 25.921 67 HB3 CYS 8 HB3 CYS 8 24.378 26.312 24.884 68 H GLU 9 H GLU 9 26.124 29.141 25.293 69 HA GLU 9 HA GLU 9 27.025 29.163 22.583 70 HB2 GLU 9 HB2 GLU 9 27.148 31.241 24.795 71 HB3 GLU 9 HB3 GLU 9 27.615 31.596 23.136 72 HG2 GLU 9 HG2 GLU 9 25.411 31.345 22.300 73 HG3 GLU 9 HG3 GLU 9 24.845 30.531 23.744 74 H LEU 10 H LEU 10 28.947 29.908 25.559 75 HA LEU 10 HA LEU 10 31.443 30.254 24.279 76 HB2 LEU 10 HB2 LEU 10 30.470 29.673 27.063 77 HB3 LEU 10 HB3 LEU 10 32.141 29.315 26.763 78 HG LEU 10 HG LEU 10 31.652 31.579 27.736 79 HD11 LEU 10 HD11 LEU 10 33.233 31.423 25.160 80 HD12 LEU 10 HD12 LEU 10 33.408 32.682 26.409 81 HD13 LEU 10 HD13 LEU 10 33.811 30.998 26.782 82 HD21 LEU 10 HD21 LEU 10 30.855 32.346 24.903 83 HD22 LEU 10 HD22 LEU 10 29.753 32.276 26.294 84 HD23 LEU 10 HD23 LEU 10 31.091 33.436 26.278 85 H SER 11 H SER 11 30.047 27.216 25.562 86 HA SER 11 HA SER 11 32.280 25.561 24.916 87 HB2 SER 11 HB2 SER 11 29.329 24.779 24.945 88 HB3 SER 11 HB3 SER 11 30.714 23.680 25.079 89 HG SER 11 HG SER 11 29.825 25.665 26.887 90 H CYS 12 H CYS 12 29.792 26.850 22.762 91 HA CYS 12 HA CYS 12 30.752 25.005 20.600 92 HB2 CYS 12 HB2 CYS 12 28.301 26.760 20.635 93 HB3 CYS 12 HB3 CYS 12 28.802 25.617 19.421 94 H ARG 13 H ARG 13 30.926 28.338 21.549 95 HA ARG 13 HA ARG 13 31.549 29.537 19.034 96 HB2 ARG 13 HB2 ARG 13 31.108 30.699 21.210 97 HB3 ARG 13 HB3 ARG 13 32.696 30.168 21.784 98 HG2 ARG 13 HG2 ARG 13 33.750 31.436 19.854 99 HG3 ARG 13 HG3 ARG 13 32.125 31.938 19.353 100 HD2 ARG 13 HD2 ARG 13 33.032 33.742 20.636 101 HD3 ARG 13 HD3 ARG 13 31.827 32.943 21.653 102 HE ARG 13 HE ARG 13 34.514 31.872 22.042 103 HH11 ARG 13 HH11 ARG 13 32.235 34.276 23.206 104 HH12 ARG 13 HH12 ARG 13 33.248 34.723 24.554 105 HH21 ARG 13 HH21 ARG 13 35.808 32.529 23.743 106 HH22 ARG 13 HH22 ARG 13 35.270 33.838 24.771 107 H SER 14 H SER 14 33.606 27.630 21.255 108 HA SER 14 HA SER 14 36.019 27.870 19.729 109 HB2 SER 14 HB2 SER 14 35.026 25.579 21.454 110 HB3 SER 14 HB3 SER 14 36.651 25.702 20.766 111 HG SER 14 HG SER 14 36.580 26.457 22.865 112 H LEU 15 H LEU 15 33.093 26.110 18.978 113 HA LEU 15 HA LEU 15 34.378 24.502 16.839 114 HB2 LEU 15 HB2 LEU 15 31.507 24.441 17.804 115 HB3 LEU 15 HB3 LEU 15 32.314 23.267 16.771 116 HG LEU 15 HG LEU 15 32.896 23.774 19.725 117 HD11 LEU 15 HD11 LEU 15 31.887 21.572 20.073 118 HD12 LEU 15 HD12 LEU 15 30.733 22.668 19.299 119 HD13 LEU 15 HD13 LEU 15 31.550 21.429 18.329 120 HD21 LEU 15 HD21 LEU 15 34.292 21.751 19.617 121 HD22 LEU 15 HD22 LEU 15 34.024 21.649 17.855 122 HD23 LEU 15 HD23 LEU 15 34.935 23.000 18.552 123 H GLY 16 H GLY 16 33.053 27.563 17.151 124 HA2 GLY 16 HA2 GLY 16 32.624 29.144 15.518 125 HA3 GLY 16 HA3 GLY 16 32.745 27.903 14.269 126 H LEU 17 H LEU 17 30.475 27.798 17.036 127 HA LEU 17 HA LEU 17 28.181 27.977 15.108 128 HB2 LEU 17 HB2 LEU 17 28.129 26.486 17.710 129 HB3 LEU 17 HB3 LEU 17 27.051 26.311 16.356 130 HG LEU 17 HG LEU 17 29.908 25.387 16.538 131 HD11 LEU 17 HD11 LEU 17 27.308 23.834 16.539 132 HD12 LEU 17 HD12 LEU 17 28.911 23.104 16.341 133 HD13 LEU 17 HD13 LEU 17 28.535 23.955 17.828 134 HD21 LEU 17 HD21 LEU 17 27.913 24.820 14.287 135 HD22 LEU 17 HD22 LEU 17 29.246 25.984 14.143 136 HD23 LEU 17 HD23 LEU 17 29.597 24.275 14.368 137 H LEU 18 H LEU 18 26.115 28.597 16.030 138 HA LEU 18 HA LEU 18 26.230 30.612 18.252 139 HB2 LEU 18 HB2 LEU 18 24.235 30.166 16.008 140 HB3 LEU 18 HB3 LEU 18 23.988 31.300 17.338 141 HG LEU 18 HG LEU 18 26.300 31.443 15.369 142 HD11 LEU 18 HD11 LEU 18 24.141 31.831 14.249 143 HD12 LEU 18 HD12 LEU 18 23.723 33.057 15.464 144 HD13 LEU 18 HD13 LEU 18 25.085 33.323 14.353 145 HD21 LEU 18 HD21 LEU 18 26.537 33.769 16.221 146 HD22 LEU 18 HD22 LEU 18 25.294 33.440 17.442 147 HD23 LEU 18 HD23 LEU 18 26.846 32.575 17.484 148 H GLY 19 H GLY 19 25.744 29.721 20.168 149 HA2 GLY 19 HA2 GLY 19 23.976 27.430 20.507 150 HA3 GLY 19 HA3 GLY 19 24.675 28.397 21.774 151 H ALA 20 H ALA 20 21.912 27.268 21.002 152 HA ALA 20 HA ALA 20 20.268 29.539 21.944 153 HB1 ALA 20 HB1 ALA 20 20.024 29.288 19.491 154 HB2 ALA 20 HB2 ALA 20 19.622 27.569 19.720 155 HB3 ALA 20 HB3 ALA 20 18.536 28.822 20.333 156 H CYS 21 H CYS 21 18.012 28.463 22.429 157 HA CYS 21 HA CYS 21 18.389 26.062 24.187 158 HB2 CYS 21 HB2 CYS 21 18.776 28.190 25.383 159 HB3 CYS 21 HB3 CYS 21 17.157 28.723 24.938 160 H ILE 22 H ILE 22 16.689 24.739 24.582 161 HA ILE 22 HA ILE 22 13.938 25.518 23.716 162 HB ILE 22 HB ILE 22 15.191 22.790 23.312 163 HG12 ILE 22 HG12 ILE 22 14.007 24.791 21.324 164 HG13 ILE 22 HG13 ILE 22 15.723 24.505 21.585 165 HG21 ILE 22 HG21 ILE 22 12.989 22.077 22.457 166 HG22 ILE 22 HG22 ILE 22 12.851 22.556 24.131 167 HG23 ILE 22 HG23 ILE 22 12.300 23.668 22.854 168 HD11 ILE 22 HD11 ILE 22 15.429 22.132 20.854 169 HD12 ILE 22 HD12 ILE 22 13.754 22.536 20.396 170 HD13 ILE 22 HD13 ILE 22 15.109 23.354 19.611 171 H GLY 23 H GLY 23 12.842 25.818 25.553 172 HA2 GLY 23 HA2 GLY 23 11.995 25.499 27.690 173 HA3 GLY 23 HA3 GLY 23 12.597 23.837 27.665 174 H GLU 24 H GLU 24 14.485 23.366 28.618 175 HA GLU 24 HA GLU 24 16.312 25.507 29.593 176 HB2 GLU 24 HB2 GLU 24 16.547 24.511 31.710 177 HB3 GLU 24 HB3 GLU 24 14.810 24.471 31.397 178 HG2 GLU 24 HG2 GLU 24 15.181 22.079 30.519 179 HG3 GLU 24 HG3 GLU 24 16.805 22.173 31.183 180 H GLU 25 H GLU 25 16.169 23.202 27.335 181 HA GLU 25 HA GLU 25 18.874 22.078 27.870 182 HB2 GLU 25 HB2 GLU 25 16.643 21.018 26.097 183 HB3 GLU 25 HB3 GLU 25 18.254 20.312 26.234 184 HG2 GLU 25 HG2 GLU 25 16.124 20.473 28.400 185 HG3 GLU 25 HG3 GLU 25 16.710 19.044 27.590 186 H CYS 26 H CYS 26 20.541 22.724 26.580 187 HA CYS 26 HA CYS 26 19.837 24.547 24.353 188 HB2 CYS 26 HB2 CYS 26 21.972 25.538 24.645 189 HB3 CYS 26 HB3 CYS 26 21.108 25.457 26.167 190 H LYS 27 H LYS 27 20.692 24.614 22.396 191 HA LYS 27 HA LYS 27 22.683 22.599 21.493 192 HB2 LYS 27 HB2 LYS 27 19.978 22.984 20.143 193 HB3 LYS 27 HB3 LYS 27 21.368 22.203 19.382 194 HG2 LYS 27 HG2 LYS 27 21.368 20.423 20.968 195 HG3 LYS 27 HG3 LYS 27 20.057 21.180 21.908 196 HD2 LYS 27 HD2 LYS 27 18.491 20.980 20.085 197 HD3 LYS 27 HD3 LYS 27 19.770 20.448 18.965 198 HE2 LYS 27 HE2 LYS 27 20.205 18.493 20.370 199 HE3 LYS 27 HE3 LYS 27 18.932 18.998 21.496 200 HZ1 LYS 27 HZ1 LYS 27 18.140 17.328 19.902 201 HZ2 LYS 27 HZ2 LYS 27 17.318 18.733 19.717 202 HZ3 LYS 27 HZ3 LYS 27 18.499 18.303 18.632 203 H CYS 28 H CYS 28 23.990 23.265 19.881 204 HA CYS 28 HA CYS 28 23.739 26.079 18.929 205 HB2 CYS 28 HB2 CYS 28 26.220 26.062 18.902 206 HB3 CYS 28 HB3 CYS 28 25.511 25.875 20.511 207 H VAL 29 H VAL 29 24.489 26.573 16.798 208 HA VAL 29 HA VAL 29 24.716 24.348 14.853 209 HB VAL 29 HB VAL 29 22.891 25.348 13.462 210 HG11 VAL 29 HG11 VAL 29 22.497 23.334 14.876 211 HG12 VAL 29 HG12 VAL 29 21.891 24.396 16.168 212 HG13 VAL 29 HG13 VAL 29 21.045 24.314 14.612 213 HG21 VAL 29 HG21 VAL 29 22.117 26.840 15.992 214 HG22 VAL 29 HG22 VAL 29 22.799 27.583 14.526 215 HG23 VAL 29 HG23 VAL 29 21.218 26.795 14.466 216 HA PRO 30 HA PRO 30 27.316 27.265 12.785 217 HB2 PRO 30 HB2 PRO 30 27.433 26.335 10.231 218 HB3 PRO 30 HB3 PRO 30 28.101 25.441 11.625 219 HG2 PRO 30 HG2 PRO 30 25.407 25.042 10.288 220 HG3 PRO 30 HG3 PRO 30 26.631 23.809 10.712 221 HD2 PRO 30 HD2 PRO 30 24.500 24.347 12.320 222 HD3 PRO 30 HD3 PRO 30 26.094 23.903 12.995 223 H TYR 31 H TYR 31 27.447 29.007 11.340 224 HA TYR 31 HA TYR 31 25.359 30.780 11.545 225 HB2 TYR 31 HB2 TYR 31 27.557 31.003 9.474 226 HB3 TYR 31 HB3 TYR 31 26.698 32.315 10.252 227 HD1 TYR 31 HD1 TYR 31 29.748 31.903 10.025 228 HD2 TYR 31 HD2 TYR 31 26.897 31.057 13.153 229 HE1 TYR 31 HE1 TYR 31 31.562 32.027 11.729 230 HE2 TYR 31 HE2 TYR 31 28.707 31.183 14.837 231 HH TYR 31 HH TYR 31 30.925 31.514 15.226 Start of MODEL 2 1 H1 ALA 1 H1 ALA 1 18.155 22.541 39.034 2 H2 ALA 1 H2 ALA 1 19.575 22.190 39.796 3 H3 ALA 1 H3 ALA 1 19.283 21.624 38.278 4 HA ALA 1 HA ALA 1 19.519 24.466 38.997 5 HB1 ALA 1 HB1 ALA 1 21.696 23.329 39.239 6 HB2 ALA 1 HB2 ALA 1 21.555 22.692 37.585 7 HB3 ALA 1 HB3 ALA 1 21.706 24.441 37.859 8 H PHE 2 H PHE 2 19.522 25.945 37.170 9 HA PHE 2 HA PHE 2 17.822 24.956 34.932 10 HB2 PHE 2 HB2 PHE 2 18.466 27.778 35.843 11 HB3 PHE 2 HB3 PHE 2 17.348 27.334 34.557 12 HD1 PHE 2 HD1 PHE 2 15.251 26.007 35.103 13 HD2 PHE 2 HD2 PHE 2 17.761 27.705 38.172 14 HE1 PHE 2 HE1 PHE 2 13.420 25.740 36.755 15 HE2 PHE 2 HE2 PHE 2 15.922 27.446 39.815 16 HZ PHE 2 HZ PHE 2 13.749 26.458 39.115 17 H CYS 3 H CYS 3 18.217 25.759 32.717 18 HA CYS 3 HA CYS 3 20.868 25.172 31.835 19 HB2 CYS 3 HB2 CYS 3 18.723 24.873 30.571 20 HB3 CYS 3 HB3 CYS 3 18.685 26.620 30.299 21 H ASN 4 H ASN 4 22.431 26.509 30.694 22 HA ASN 4 HA ASN 4 22.346 29.414 31.344 23 HB2 ASN 4 HB2 ASN 4 23.997 27.975 32.742 24 HB3 ASN 4 HB3 ASN 4 24.882 27.802 31.238 25 HD21 ASN 4 HD21 ASN 4 24.645 31.495 32.980 26 HD22 ASN 4 HD22 ASN 4 23.447 30.256 33.378 27 H LEU 5 H LEU 5 21.941 30.314 29.568 28 HA LEU 5 HA LEU 5 22.492 29.481 26.887 29 HB2 LEU 5 HB2 LEU 5 20.704 31.032 27.474 30 HB3 LEU 5 HB3 LEU 5 21.860 32.213 28.068 31 HG LEU 5 HG LEU 5 22.750 32.558 25.807 32 HD11 LEU 5 HD11 LEU 5 22.382 30.359 24.775 33 HD12 LEU 5 HD12 LEU 5 20.617 30.566 24.942 34 HD13 LEU 5 HD13 LEU 5 21.550 31.607 23.850 35 HD21 LEU 5 HD21 LEU 5 20.748 33.626 24.845 36 HD22 LEU 5 HD22 LEU 5 19.706 32.707 25.943 37 HD23 LEU 5 HD23 LEU 5 20.841 33.916 26.589 38 H ARG 6 H ARG 6 24.285 31.699 29.076 39 HA ARG 6 HA ARG 6 26.311 32.453 27.151 40 HB2 ARG 6 HB2 ARG 6 26.505 32.263 30.194 41 HB3 ARG 6 HB3 ARG 6 27.680 33.043 29.151 42 HG2 ARG 6 HG2 ARG 6 24.789 33.956 29.522 43 HG3 ARG 6 HG3 ARG 6 26.210 34.623 30.311 44 HD2 ARG 6 HD2 ARG 6 25.902 36.129 28.599 45 HD3 ARG 6 HD3 ARG 6 27.124 35.065 27.925 46 HE ARG 6 HE ARG 6 25.559 34.247 26.343 47 HH11 ARG 6 HH11 ARG 6 23.796 36.344 28.574 48 HH12 ARG 6 HH12 ARG 6 22.582 36.693 27.356 49 HH21 ARG 6 HH21 ARG 6 24.067 34.676 24.972 50 HH22 ARG 6 HH22 ARG 6 22.678 35.703 25.336 51 H ARG 7 H ARG 7 26.301 29.771 29.548 52 HA ARG 7 HA ARG 7 28.796 28.674 28.686 53 HB2 ARG 7 HB2 ARG 7 27.472 28.089 30.804 54 HB3 ARG 7 HB3 ARG 7 26.427 27.102 29.780 55 HG2 ARG 7 HG2 ARG 7 28.068 25.737 30.902 56 HG3 ARG 7 HG3 ARG 7 28.361 25.673 29.165 57 HD2 ARG 7 HD2 ARG 7 29.825 27.722 30.827 58 HD3 ARG 7 HD3 ARG 7 30.325 26.031 30.959 59 HE ARG 7 HE ARG 7 30.360 26.218 28.324 60 HH11 ARG 7 HH11 ARG 7 31.600 28.758 30.459 61 HH12 ARG 7 HH12 ARG 7 32.785 29.256 29.270 62 HH21 ARG 7 HH21 ARG 7 32.176 26.560 27.217 63 HH22 ARG 7 HH22 ARG 7 33.197 27.937 27.535 64 H CYS 8 H CYS 8 25.469 27.900 27.643 65 HA CYS 8 HA CYS 8 26.083 25.944 25.713 66 HB2 CYS 8 HB2 CYS 8 23.848 26.483 26.589 67 HB3 CYS 8 HB3 CYS 8 23.894 28.056 25.805 68 H GLU 9 H GLU 9 25.996 29.512 25.208 69 HA GLU 9 HA GLU 9 26.745 29.387 22.427 70 HB2 GLU 9 HB2 GLU 9 27.075 31.529 24.587 71 HB3 GLU 9 HB3 GLU 9 27.590 31.783 22.919 72 HG2 GLU 9 HG2 GLU 9 25.349 31.505 22.083 73 HG3 GLU 9 HG3 GLU 9 24.732 31.078 23.675 74 H LEU 10 H LEU 10 28.796 29.846 25.389 75 HA LEU 10 HA LEU 10 31.203 30.006 23.806 76 HB2 LEU 10 HB2 LEU 10 30.521 30.090 26.716 77 HB3 LEU 10 HB3 LEU 10 32.167 29.725 26.289 78 HG LEU 10 HG LEU 10 31.649 32.146 26.720 79 HD11 LEU 10 HD11 LEU 10 33.725 31.397 25.653 80 HD12 LEU 10 HD12 LEU 10 32.928 31.467 24.071 81 HD13 LEU 10 HD13 LEU 10 33.177 32.958 24.995 82 HD21 LEU 10 HD21 LEU 10 30.558 32.177 23.899 83 HD22 LEU 10 HD22 LEU 10 29.551 32.340 25.367 84 HD23 LEU 10 HD23 LEU 10 30.796 33.560 24.971 85 H SER 11 H SER 11 29.726 27.225 25.488 86 HA SER 11 HA SER 11 31.949 25.432 25.036 87 HB2 SER 11 HB2 SER 11 28.968 24.920 25.384 88 HB3 SER 11 HB3 SER 11 30.208 23.652 25.335 89 HG SER 11 HG SER 11 31.198 24.547 27.131 90 H CYS 12 H CYS 12 29.682 26.799 22.815 91 HA CYS 12 HA CYS 12 30.546 24.881 20.694 92 HB2 CYS 12 HB2 CYS 12 28.264 26.879 20.650 93 HB3 CYS 12 HB3 CYS 12 28.706 25.736 19.433 94 H ARG 13 H ARG 13 31.187 28.040 21.803 95 HA ARG 13 HA ARG 13 31.987 29.420 19.438 96 HB2 ARG 13 HB2 ARG 13 31.890 30.294 21.819 97 HB3 ARG 13 HB3 ARG 13 33.369 29.409 22.166 98 HG2 ARG 13 HG2 ARG 13 33.840 31.749 21.805 99 HG3 ARG 13 HG3 ARG 13 34.613 30.780 20.551 100 HD2 ARG 13 HD2 ARG 13 33.547 32.923 19.750 101 HD3 ARG 13 HD3 ARG 13 33.011 31.476 18.902 102 HE ARG 13 HE ARG 13 30.877 31.635 19.913 103 HH11 ARG 13 HH11 ARG 13 32.826 34.338 21.161 104 HH12 ARG 13 HH12 ARG 13 31.377 35.094 21.776 105 HH21 ARG 13 HH21 ARG 13 29.274 32.562 20.784 106 HH22 ARG 13 HH22 ARG 13 29.426 34.113 21.622 107 H SER 14 H SER 14 33.598 26.905 21.301 108 HA SER 14 HA SER 14 36.083 26.759 19.865 109 HB2 SER 14 HB2 SER 14 36.212 24.550 20.945 110 HB3 SER 14 HB3 SER 14 35.699 25.792 22.110 111 HG SER 14 HG SER 14 34.496 23.604 21.762 112 H LEU 15 H LEU 15 32.902 25.800 18.932 113 HA LEU 15 HA LEU 15 33.913 24.131 16.669 114 HB2 LEU 15 HB2 LEU 15 31.119 24.287 17.845 115 HB3 LEU 15 HB3 LEU 15 31.677 23.173 16.596 116 HG LEU 15 HG LEU 15 32.531 23.220 19.523 117 HD11 LEU 15 HD11 LEU 15 31.305 21.096 19.664 118 HD12 LEU 15 HD12 LEU 15 30.236 22.418 19.162 119 HD13 LEU 15 HD13 LEU 15 30.824 21.247 17.957 120 HD21 LEU 15 HD21 LEU 15 34.375 22.383 18.073 121 HD22 LEU 15 HD22 LEU 15 33.681 21.108 19.077 122 HD23 LEU 15 HD23 LEU 15 33.257 21.205 17.354 123 H GLY 16 H GLY 16 33.027 27.248 17.360 124 HA2 GLY 16 HA2 GLY 16 32.556 29.074 16.060 125 HA3 GLY 16 HA3 GLY 16 32.793 28.076 14.623 126 H LEU 17 H LEU 17 30.361 27.779 17.252 127 HA LEU 17 HA LEU 17 28.160 28.137 15.256 128 HB2 LEU 17 HB2 LEU 17 27.929 26.373 17.671 129 HB3 LEU 17 HB3 LEU 17 26.954 26.352 16.236 130 HG LEU 17 HG LEU 17 29.772 25.392 16.510 131 HD11 LEU 17 HD11 LEU 17 27.188 23.836 16.303 132 HD12 LEU 17 HD12 LEU 17 28.810 23.122 16.172 133 HD13 LEU 17 HD13 LEU 17 28.330 23.905 17.672 134 HD21 LEU 17 HD21 LEU 17 27.853 24.983 14.163 135 HD22 LEU 17 HD22 LEU 17 29.226 26.110 14.132 136 HD23 LEU 17 HD23 LEU 17 29.516 24.375 14.265 137 H LEU 18 H LEU 18 26.263 29.104 15.931 138 HA LEU 18 HA LEU 18 26.254 30.798 18.359 139 HB2 LEU 18 HB2 LEU 18 24.199 30.343 16.152 140 HB3 LEU 18 HB3 LEU 18 24.027 31.501 17.471 141 HG LEU 18 HG LEU 18 26.197 31.586 15.336 142 HD11 LEU 18 HD11 LEU 18 24.947 33.495 14.445 143 HD12 LEU 18 HD12 LEU 18 23.952 32.032 14.431 144 HD13 LEU 18 HD13 LEU 18 23.691 33.274 15.679 145 HD21 LEU 18 HD21 LEU 18 25.440 33.594 17.508 146 HD22 LEU 18 HD22 LEU 18 26.968 32.689 17.397 147 HD23 LEU 18 HD23 LEU 18 26.571 33.904 16.180 148 H GLY 19 H GLY 19 25.696 29.880 20.239 149 HA2 GLY 19 HA2 GLY 19 23.867 27.572 20.336 150 HA3 GLY 19 HA3 GLY 19 24.756 28.219 21.685 151 H ALA 20 H ALA 20 21.951 27.453 21.195 152 HA ALA 20 HA ALA 20 20.724 29.636 22.742 153 HB1 ALA 20 HB1 ALA 20 18.625 29.444 21.438 154 HB2 ALA 20 HB2 ALA 20 19.964 30.037 20.439 155 HB3 ALA 20 HB3 ALA 20 19.433 28.348 20.299 156 H CYS 21 H CYS 21 19.538 28.808 24.457 157 HA CYS 21 HA CYS 21 19.258 25.843 24.616 158 HB2 CYS 21 HB2 CYS 21 20.534 26.999 26.404 159 HB3 CYS 21 HB3 CYS 21 19.038 27.781 26.921 160 H ILE 22 H ILE 22 17.387 24.822 24.810 161 HA ILE 22 HA ILE 22 14.846 26.393 24.602 162 HB ILE 22 HB ILE 22 15.698 24.045 22.909 163 HG12 ILE 22 HG12 ILE 22 15.080 26.942 22.178 164 HG13 ILE 22 HG13 ILE 22 16.689 26.217 22.220 165 HG21 ILE 22 HG21 ILE 22 13.267 23.951 23.563 166 HG22 ILE 22 HG22 ILE 22 13.055 25.548 22.815 167 HG23 ILE 22 HG23 ILE 22 13.524 24.142 21.840 168 HD11 ILE 22 HD11 ILE 22 14.473 25.507 20.275 169 HD12 ILE 22 HD12 ILE 22 15.996 26.345 19.949 170 HD13 ILE 22 HD13 ILE 22 16.021 24.630 20.419 171 H GLY 23 H GLY 23 13.656 25.989 26.283 172 HA2 GLY 23 HA2 GLY 23 12.655 24.952 28.088 173 HA3 GLY 23 HA3 GLY 23 13.139 23.378 27.442 174 H GLU 24 H GLU 24 14.958 22.424 28.251 175 HA GLU 24 HA GLU 24 16.842 24.004 29.940 176 HB2 GLU 24 HB2 GLU 24 17.021 22.255 31.541 177 HB3 GLU 24 HB3 GLU 24 15.316 22.662 31.333 178 HG2 GLU 24 HG2 GLU 24 15.107 20.674 29.783 179 HG3 GLU 24 HG3 GLU 24 16.772 20.255 30.153 180 H GLU 25 H GLU 25 16.651 22.440 27.071 181 HA GLU 25 HA GLU 25 19.300 21.094 27.294 182 HB2 GLU 25 HB2 GLU 25 17.403 19.686 26.644 183 HB3 GLU 25 HB3 GLU 25 17.122 20.716 25.237 184 HG2 GLU 25 HG2 GLU 25 19.366 20.124 24.361 185 HG3 GLU 25 HG3 GLU 25 19.675 19.168 25.810 186 H CYS 26 H CYS 26 21.003 22.025 26.375 187 HA CYS 26 HA CYS 26 20.839 24.429 24.745 188 HB2 CYS 26 HB2 CYS 26 22.636 24.185 26.327 189 HB3 CYS 26 HB3 CYS 26 23.083 22.616 25.661 190 H LYS 27 H LYS 27 21.248 24.709 22.571 191 HA LYS 27 HA LYS 27 22.377 22.519 20.986 192 HB2 LYS 27 HB2 LYS 27 20.725 22.598 19.213 193 HB3 LYS 27 HB3 LYS 27 19.976 22.153 20.727 194 HG2 LYS 27 HG2 LYS 27 18.454 23.502 19.666 195 HG3 LYS 27 HG3 LYS 27 19.125 24.555 20.911 196 HD2 LYS 27 HD2 LYS 27 20.301 25.864 19.317 197 HD3 LYS 27 HD3 LYS 27 20.321 24.551 18.115 198 HE2 LYS 27 HE2 LYS 27 17.796 24.760 18.042 199 HE3 LYS 27 HE3 LYS 27 17.976 26.288 18.933 200 HZ1 LYS 27 HZ1 LYS 27 19.556 26.935 17.083 201 HZ2 LYS 27 HZ2 LYS 27 19.041 25.582 16.269 202 HZ3 LYS 27 HZ3 LYS 27 17.985 26.798 16.587 203 H CYS 28 H CYS 28 23.495 23.275 19.085 204 HA CYS 28 HA CYS 28 23.603 26.198 18.681 205 HB2 CYS 28 HB2 CYS 28 26.065 26.197 18.812 206 HB3 CYS 28 HB3 CYS 28 25.260 25.964 20.352 207 H VAL 29 H VAL 29 24.386 26.886 16.671 208 HA VAL 29 HA VAL 29 24.680 24.835 14.546 209 HB VAL 29 HB VAL 29 22.964 25.752 13.182 210 HG11 VAL 29 HG11 VAL 29 21.743 25.436 15.944 211 HG12 VAL 29 HG12 VAL 29 20.968 25.179 14.365 212 HG13 VAL 29 HG13 VAL 29 22.260 24.089 14.899 213 HG21 VAL 29 HG21 VAL 29 21.400 27.535 13.988 214 HG22 VAL 29 HG22 VAL 29 22.518 27.847 15.333 215 HG23 VAL 29 HG23 VAL 29 23.034 28.118 13.658 216 HA PRO 30 HA PRO 30 27.686 27.533 12.868 217 HB2 PRO 30 HB2 PRO 30 26.503 27.153 10.127 218 HB3 PRO 30 HB3 PRO 30 28.196 26.954 10.670 219 HG2 PRO 30 HG2 PRO 30 26.625 24.785 10.255 220 HG3 PRO 30 HG3 PRO 30 27.698 24.854 11.691 221 HD2 PRO 30 HD2 PRO 30 24.735 25.458 11.530 222 HD3 PRO 30 HD3 PRO 30 25.628 24.471 12.726 223 H TYR 31 H TYR 31 28.161 29.601 11.917 224 HA TYR 31 HA TYR 31 26.270 31.684 12.333 225 HB2 TYR 31 HB2 TYR 31 28.777 31.777 10.616 226 HB3 TYR 31 HB3 TYR 31 27.946 33.132 11.353 227 HD1 TYR 31 HD1 TYR 31 30.722 30.996 11.672 228 HD2 TYR 31 HD2 TYR 31 27.712 33.007 14.015 229 HE1 TYR 31 HE1 TYR 31 32.231 30.938 13.661 230 HE2 TYR 31 HE2 TYR 31 29.205 32.900 16.018 231 HH TYR 31 HH TYR 31 32.531 31.580 15.838 Start of MODEL 3 1 H1 ALA 1 H1 ALA 1 14.232 22.888 36.786 2 H2 ALA 1 H2 ALA 1 14.708 21.362 37.205 3 H3 ALA 1 H3 ALA 1 14.263 21.696 35.654 4 HA ALA 1 HA ALA 1 16.558 22.903 37.018 5 HB1 ALA 1 HB1 ALA 1 16.496 20.636 34.981 6 HB2 ALA 1 HB2 ALA 1 17.963 21.472 35.533 7 HB3 ALA 1 HB3 ALA 1 17.007 20.532 36.684 8 H PHE 2 H PHE 2 17.983 24.075 35.596 9 HA PHE 2 HA PHE 2 16.591 25.333 33.251 10 HB2 PHE 2 HB2 PHE 2 18.735 26.442 35.097 11 HB3 PHE 2 HB3 PHE 2 17.947 27.315 33.798 12 HD1 PHE 2 HD1 PHE 2 18.002 26.991 37.246 13 HD2 PHE 2 HD2 PHE 2 15.200 27.201 33.974 14 HE1 PHE 2 HE1 PHE 2 16.266 27.829 38.791 15 HE2 PHE 2 HE2 PHE 2 13.459 28.050 35.524 16 HZ PHE 2 HZ PHE 2 14.001 28.405 37.926 17 H CYS 3 H CYS 3 18.051 26.265 31.610 18 HA CYS 3 HA CYS 3 20.594 24.749 31.177 19 HB2 CYS 3 HB2 CYS 3 20.367 25.492 28.808 20 HB3 CYS 3 HB3 CYS 3 19.219 24.312 29.353 21 H ASN 4 H ASN 4 22.173 26.270 29.845 22 HA ASN 4 HA ASN 4 22.160 29.036 30.908 23 HB2 ASN 4 HB2 ASN 4 23.744 27.409 32.203 24 HB3 ASN 4 HB3 ASN 4 24.651 27.360 30.719 25 HD21 ASN 4 HD21 ASN 4 24.392 30.799 32.893 26 HD22 ASN 4 HD22 ASN 4 23.545 29.320 33.355 27 H LEU 5 H LEU 5 21.928 30.220 29.292 28 HA LEU 5 HA LEU 5 22.475 29.680 26.563 29 HB2 LEU 5 HB2 LEU 5 20.871 31.374 27.331 30 HB3 LEU 5 HB3 LEU 5 22.173 32.319 28.051 31 HG LEU 5 HG LEU 5 23.130 32.763 25.818 32 HD11 LEU 5 HD11 LEU 5 22.411 30.765 24.572 33 HD12 LEU 5 HD12 LEU 5 20.701 31.233 24.782 34 HD13 LEU 5 HD13 LEU 5 21.796 32.212 23.786 35 HD21 LEU 5 HD21 LEU 5 21.347 34.257 25.024 36 HD22 LEU 5 HD22 LEU 5 20.155 33.393 26.022 37 HD23 LEU 5 HD23 LEU 5 21.473 34.309 26.786 38 H ARG 6 H ARG 6 24.597 31.360 28.996 39 HA ARG 6 HA ARG 6 26.502 32.038 26.876 40 HB2 ARG 6 HB2 ARG 6 27.963 32.792 28.668 41 HB3 ARG 6 HB3 ARG 6 26.399 33.607 28.595 42 HG2 ARG 6 HG2 ARG 6 25.614 32.348 30.551 43 HG3 ARG 6 HG3 ARG 6 27.163 31.478 30.631 44 HD2 ARG 6 HD2 ARG 6 26.813 34.488 30.919 45 HD3 ARG 6 HD3 ARG 6 27.014 33.340 32.254 46 HE ARG 6 HE ARG 6 29.147 32.808 30.574 47 HH11 ARG 6 HH11 ARG 6 28.134 35.662 32.375 48 HH12 ARG 6 HH12 ARG 6 29.708 36.410 32.268 49 HH21 ARG 6 HH21 ARG 6 31.216 33.723 30.706 50 HH22 ARG 6 HH22 ARG 6 31.408 35.255 31.535 51 H ARG 7 H ARG 7 26.409 29.484 29.400 52 HA ARG 7 HA ARG 7 28.853 28.209 28.551 53 HB2 ARG 7 HB2 ARG 7 27.526 27.521 30.576 54 HB3 ARG 7 HB3 ARG 7 26.295 26.857 29.493 55 HG2 ARG 7 HG2 ARG 7 27.752 25.199 28.605 56 HG3 ARG 7 HG3 ARG 7 29.182 25.908 29.361 57 HD2 ARG 7 HD2 ARG 7 26.814 24.867 30.961 58 HD3 ARG 7 HD3 ARG 7 28.140 23.824 30.440 59 HE ARG 7 HE ARG 7 29.406 25.968 31.688 60 HH11 ARG 7 HH11 ARG 7 27.006 23.565 32.771 61 HH12 ARG 7 HH12 ARG 7 27.536 23.779 34.435 62 HH21 ARG 7 HH21 ARG 7 30.143 25.826 33.851 63 HH22 ARG 7 HH22 ARG 7 29.111 24.959 34.982 64 H CYS 8 H CYS 8 25.520 27.828 27.284 65 HA CYS 8 HA CYS 8 26.196 25.798 25.411 66 HB2 CYS 8 HB2 CYS 8 23.913 26.405 26.315 67 HB3 CYS 8 HB3 CYS 8 23.939 27.849 25.300 68 H GLU 9 H GLU 9 26.200 29.351 25.053 69 HA GLU 9 HA GLU 9 27.009 29.327 22.262 70 HB2 GLU 9 HB2 GLU 9 27.193 31.344 24.537 71 HB3 GLU 9 HB3 GLU 9 27.829 31.703 22.942 72 HG2 GLU 9 HG2 GLU 9 24.992 30.704 23.039 73 HG3 GLU 9 HG3 GLU 9 25.302 32.279 23.760 74 H LEU 10 H LEU 10 28.959 29.920 25.268 75 HA LEU 10 HA LEU 10 31.364 30.165 23.727 76 HB2 LEU 10 HB2 LEU 10 30.713 30.073 26.675 77 HB3 LEU 10 HB3 LEU 10 32.379 29.956 26.165 78 HG LEU 10 HG LEU 10 31.756 32.229 26.806 79 HD11 LEU 10 HD11 LEU 10 32.441 32.057 23.847 80 HD12 LEU 10 HD12 LEU 10 32.801 33.388 24.958 81 HD13 LEU 10 HD13 LEU 10 33.589 31.822 25.185 82 HD21 LEU 10 HD21 LEU 10 30.007 32.331 24.315 83 HD22 LEU 10 HD22 LEU 10 29.423 32.332 25.997 84 HD23 LEU 10 HD23 LEU 10 30.403 33.675 25.399 85 H SER 11 H SER 11 29.976 27.308 25.338 86 HA SER 11 HA SER 11 32.348 25.676 25.019 87 HB2 SER 11 HB2 SER 11 30.845 23.763 25.245 88 HB3 SER 11 HB3 SER 11 30.510 24.988 26.482 89 HG SER 11 HG SER 11 28.725 25.602 25.469 90 H CYS 12 H CYS 12 29.679 26.539 22.838 91 HA CYS 12 HA CYS 12 30.678 24.734 20.723 92 HB2 CYS 12 HB2 CYS 12 28.310 26.625 20.843 93 HB3 CYS 12 HB3 CYS 12 28.697 25.516 19.547 94 H ARG 13 H ARG 13 30.948 28.134 21.548 95 HA ARG 13 HA ARG 13 31.788 29.167 19.038 96 HB2 ARG 13 HB2 ARG 13 31.209 30.414 21.174 97 HB3 ARG 13 HB3 ARG 13 32.842 30.048 21.753 98 HG2 ARG 13 HG2 ARG 13 33.817 31.243 19.836 99 HG3 ARG 13 HG3 ARG 13 32.224 31.468 19.113 100 HD2 ARG 13 HD2 ARG 13 33.193 32.667 21.738 101 HD3 ARG 13 HD3 ARG 13 33.071 33.502 20.181 102 HE ARG 13 HE ARG 13 30.495 32.588 20.624 103 HH11 ARG 13 HH11 ARG 13 32.700 34.786 22.342 104 HH12 ARG 13 HH12 ARG 13 31.331 35.723 22.936 105 HH21 ARG 13 HH21 ARG 13 28.898 34.037 21.337 106 HH22 ARG 13 HH22 ARG 13 29.357 35.275 22.478 107 H SER 14 H SER 14 33.469 27.007 21.196 108 HA SER 14 HA SER 14 36.132 27.276 20.198 109 HB2 SER 14 HB2 SER 14 36.461 24.982 20.930 110 HB3 SER 14 HB3 SER 14 35.569 25.883 22.159 111 HG SER 14 HG SER 14 33.805 24.695 21.776 112 H LEU 15 H LEU 15 33.285 25.626 18.862 113 HA LEU 15 HA LEU 15 34.735 24.758 16.429 114 HB2 LEU 15 HB2 LEU 15 31.827 24.383 17.244 115 HB3 LEU 15 HB3 LEU 15 32.657 23.595 15.908 116 HG LEU 15 HG LEU 15 33.133 23.158 18.888 117 HD11 LEU 15 HD11 LEU 15 32.386 20.877 18.361 118 HD12 LEU 15 HD12 LEU 15 31.140 22.069 17.964 119 HD13 LEU 15 HD13 LEU 15 32.118 21.340 16.669 120 HD21 LEU 15 HD21 LEU 15 34.710 21.354 18.155 121 HD22 LEU 15 HD22 LEU 15 34.626 21.995 16.500 122 HD23 LEU 15 HD23 LEU 15 35.310 22.980 17.818 123 H GLY 16 H GLY 16 32.638 27.294 17.504 124 HA2 GLY 16 HA2 GLY 16 32.357 29.376 16.398 125 HA3 GLY 16 HA3 GLY 16 32.698 28.620 14.843 126 H LEU 17 H LEU 17 30.275 27.894 17.444 127 HA LEU 17 HA LEU 17 28.092 28.088 15.396 128 HB2 LEU 17 HB2 LEU 17 27.958 26.452 17.910 129 HB3 LEU 17 HB3 LEU 17 26.930 26.341 16.511 130 HG LEU 17 HG LEU 17 29.796 25.451 16.711 131 HD11 LEU 17 HD11 LEU 17 28.885 23.174 16.431 132 HD12 LEU 17 HD12 LEU 17 28.357 23.951 17.915 133 HD13 LEU 17 HD13 LEU 17 27.241 23.835 16.531 134 HD21 LEU 17 HD21 LEU 17 27.842 25.016 14.405 135 HD22 LEU 17 HD22 LEU 17 29.196 26.164 14.366 136 HD23 LEU 17 HD23 LEU 17 29.518 24.436 14.498 137 H LEU 18 H LEU 18 26.062 28.832 16.060 138 HA LEU 18 HA LEU 18 25.948 30.759 18.316 139 HB2 LEU 18 HB2 LEU 18 23.999 29.927 16.126 140 HB3 LEU 18 HB3 LEU 18 23.552 31.017 17.437 141 HG LEU 18 HG LEU 18 25.814 31.574 15.484 142 HD11 LEU 18 HD11 LEU 18 24.260 33.147 14.419 143 HD12 LEU 18 HD12 LEU 18 23.636 31.494 14.332 144 HD13 LEU 18 HD13 LEU 18 22.958 32.630 15.519 145 HD21 LEU 18 HD21 LEU 18 25.534 33.914 16.309 146 HD22 LEU 18 HD22 LEU 18 24.372 33.336 17.522 147 HD23 LEU 18 HD23 LEU 18 26.072 32.825 17.587 148 H GLY 19 H GLY 19 25.791 29.782 20.254 149 HA2 GLY 19 HA2 GLY 19 24.095 27.429 20.722 150 HA3 GLY 19 HA3 GLY 19 24.920 28.357 21.939 151 H ALA 20 H ALA 20 22.182 27.287 21.687 152 HA ALA 20 HA ALA 20 20.743 29.647 22.702 153 HB1 ALA 20 HB1 ALA 20 20.007 29.338 20.357 154 HB2 ALA 20 HB2 ALA 20 19.586 27.643 20.718 155 HB3 ALA 20 HB3 ALA 20 18.709 28.963 21.507 156 H CYS 21 H CYS 21 19.525 29.219 24.397 157 HA CYS 21 HA CYS 21 19.475 26.479 25.602 158 HB2 CYS 21 HB2 CYS 21 20.766 27.546 27.095 159 HB3 CYS 21 HB3 CYS 21 20.151 29.143 26.691 160 H ILE 22 H ILE 22 17.581 25.589 25.525 161 HA ILE 22 HA ILE 22 15.127 27.263 25.130 162 HB ILE 22 HB ILE 22 15.762 24.535 23.955 163 HG12 ILE 22 HG12 ILE 22 15.729 27.281 22.628 164 HG13 ILE 22 HG13 ILE 22 17.163 26.303 22.936 165 HG21 ILE 22 HG21 ILE 22 13.428 26.426 23.390 166 HG22 ILE 22 HG22 ILE 22 13.692 24.820 22.671 167 HG23 ILE 22 HG23 ILE 22 13.313 24.957 24.376 168 HD11 ILE 22 HD11 ILE 22 14.945 25.674 20.966 169 HD12 ILE 22 HD12 ILE 22 16.638 26.063 20.636 170 HD13 ILE 22 HD13 ILE 22 16.228 24.524 21.425 171 H GLY 23 H GLY 23 14.459 27.353 27.233 172 HA2 GLY 23 HA2 GLY 23 13.131 26.781 28.986 173 HA3 GLY 23 HA3 GLY 23 12.818 25.232 28.207 174 H GLU 24 H GLU 24 15.071 23.917 28.245 175 HA GLU 24 HA GLU 24 16.556 24.019 30.779 176 HB2 GLU 24 HB2 GLU 24 15.869 21.894 31.622 177 HB3 GLU 24 HB3 GLU 24 14.403 22.789 31.263 178 HG2 GLU 24 HG2 GLU 24 14.443 21.551 28.962 179 HG3 GLU 24 HG3 GLU 24 15.616 20.470 29.719 180 H GLU 25 H GLU 25 16.426 23.168 27.458 181 HA GLU 25 HA GLU 25 18.790 21.385 27.651 182 HB2 GLU 25 HB2 GLU 25 18.177 20.413 25.608 183 HB3 GLU 25 HB3 GLU 25 16.762 20.377 26.648 184 HG2 GLU 25 HG2 GLU 25 15.755 22.217 25.391 185 HG3 GLU 25 HG3 GLU 25 17.218 22.412 24.416 186 H CYS 26 H CYS 26 20.363 21.607 25.829 187 HA CYS 26 HA CYS 26 20.619 24.407 24.801 188 HB2 CYS 26 HB2 CYS 26 22.244 24.396 26.450 189 HB3 CYS 26 HB3 CYS 26 22.579 22.677 26.256 190 H LYS 27 H LYS 27 20.982 24.621 22.723 191 HA LYS 27 HA LYS 27 22.371 22.495 21.211 192 HB2 LYS 27 HB2 LYS 27 20.806 22.675 19.294 193 HB3 LYS 27 HB3 LYS 27 20.167 21.825 20.696 194 HG2 LYS 27 HG2 LYS 27 18.656 23.566 21.238 195 HG3 LYS 27 HG3 LYS 27 19.544 24.766 20.285 196 HD2 LYS 27 HD2 LYS 27 17.498 24.161 19.122 197 HD3 LYS 27 HD3 LYS 27 18.925 23.680 18.211 198 HE2 LYS 27 HE2 LYS 27 18.602 21.311 19.152 199 HE3 LYS 27 HE3 LYS 27 17.065 21.877 19.822 200 HZ1 LYS 27 HZ1 LYS 27 16.543 22.582 17.454 201 HZ2 LYS 27 HZ2 LYS 27 17.831 21.709 16.956 202 HZ3 LYS 27 HZ3 LYS 27 16.563 20.963 17.702 203 H CYS 28 H CYS 28 23.551 23.188 19.461 204 HA CYS 28 HA CYS 28 23.766 26.111 19.073 205 HB2 CYS 28 HB2 CYS 28 26.205 25.999 19.213 206 HB3 CYS 28 HB3 CYS 28 25.392 25.731 20.743 207 H VAL 29 H VAL 29 24.328 26.772 17.024 208 HA VAL 29 HA VAL 29 24.298 24.622 14.947 209 HB VAL 29 HB VAL 29 22.614 25.845 13.713 210 HG11 VAL 29 HG11 VAL 29 21.959 24.053 15.291 211 HG12 VAL 29 HG12 VAL 29 21.628 25.285 16.530 212 HG13 VAL 29 HG13 VAL 29 20.696 25.265 15.019 213 HG21 VAL 29 HG21 VAL 29 22.374 27.698 16.101 214 HG22 VAL 29 HG22 VAL 29 22.952 28.138 14.481 215 HG23 VAL 29 HG23 VAL 29 21.279 27.624 14.708 216 HA PRO 30 HA PRO 30 27.269 27.010 12.829 217 HB2 PRO 30 HB2 PRO 30 27.002 26.224 10.214 218 HB3 PRO 30 HB3 PRO 30 27.644 25.170 11.503 219 HG2 PRO 30 HG2 PRO 30 24.805 25.263 10.446 220 HG3 PRO 30 HG3 PRO 30 25.847 23.827 10.700 221 HD2 PRO 30 HD2 PRO 30 24.011 24.602 12.541 222 HD3 PRO 30 HD3 PRO 30 25.594 23.948 13.046 223 H TYR 31 H TYR 31 27.613 28.856 11.794 224 HA TYR 31 HA TYR 31 25.546 30.782 11.217 225 HB2 TYR 31 HB2 TYR 31 28.535 30.682 10.630 226 HB3 TYR 31 HB3 TYR 31 27.525 32.034 10.184 227 HD1 TYR 31 HD1 TYR 31 28.736 30.087 13.141 228 HD2 TYR 31 HD2 TYR 31 27.033 33.760 11.706 229 HE1 TYR 31 HE1 TYR 31 29.105 31.125 15.377 230 HE2 TYR 31 HE2 TYR 31 27.405 34.810 13.955 231 HH TYR 31 HH TYR 31 28.078 34.460 16.147 Start of MODEL 4 1 H1 ALA 1 H1 ALA 1 12.901 21.571 33.352 2 H2 ALA 1 H2 ALA 1 13.320 20.044 33.783 3 H3 ALA 1 H3 ALA 1 13.353 20.462 32.207 4 HA ALA 1 HA ALA 1 15.104 21.426 34.365 5 HB1 ALA 1 HB1 ALA 1 15.788 19.946 31.802 6 HB2 ALA 1 HB2 ALA 1 16.931 20.435 33.064 7 HB3 ALA 1 HB3 ALA 1 15.695 19.214 33.419 8 H PHE 2 H PHE 2 16.986 22.741 33.490 9 HA PHE 2 HA PHE 2 15.970 24.866 31.641 10 HB2 PHE 2 HB2 PHE 2 17.569 25.176 34.194 11 HB3 PHE 2 HB3 PHE 2 17.051 26.471 33.138 12 HD1 PHE 2 HD1 PHE 2 16.052 24.228 35.849 13 HD2 PHE 2 HD2 PHE 2 14.605 27.031 32.910 14 HE1 PHE 2 HE1 PHE 2 13.930 24.460 37.116 15 HE2 PHE 2 HE2 PHE 2 12.500 27.277 34.185 16 HZ PHE 2 HZ PHE 2 12.149 25.994 36.295 17 H CYS 3 H CYS 3 17.513 26.174 30.596 18 HA CYS 3 HA CYS 3 19.889 24.819 29.562 19 HB2 CYS 3 HB2 CYS 3 18.625 27.563 29.193 20 HB3 CYS 3 HB3 CYS 3 19.977 26.991 28.242 21 H ASN 4 H ASN 4 22.003 25.878 29.434 22 HA ASN 4 HA ASN 4 22.524 28.231 31.204 23 HB2 ASN 4 HB2 ASN 4 24.404 25.830 30.867 24 HB3 ASN 4 HB3 ASN 4 24.917 27.422 31.350 25 HD21 ASN 4 HD21 ASN 4 22.952 27.075 34.521 26 HD22 ASN 4 HD22 ASN 4 22.592 28.067 33.114 27 H LEU 5 H LEU 5 21.850 29.330 29.343 28 HA LEU 5 HA LEU 5 22.710 28.982 26.732 29 HB2 LEU 5 HB2 LEU 5 20.819 30.365 27.436 30 HB3 LEU 5 HB3 LEU 5 21.905 31.487 28.257 31 HG LEU 5 HG LEU 5 22.886 32.159 26.073 32 HD11 LEU 5 HD11 LEU 5 21.703 31.495 23.985 33 HD12 LEU 5 HD12 LEU 5 22.507 30.122 24.745 34 HD13 LEU 5 HD13 LEU 5 20.743 30.325 24.908 35 HD21 LEU 5 HD21 LEU 5 20.967 33.444 25.318 36 HD22 LEU 5 HD22 LEU 5 19.851 32.348 26.161 37 HD23 LEU 5 HD23 LEU 5 20.973 33.373 27.083 38 H ARG 6 H ARG 6 24.345 30.962 29.242 39 HA ARG 6 HA ARG 6 26.369 32.044 27.462 40 HB2 ARG 6 HB2 ARG 6 26.312 31.594 30.479 41 HB3 ARG 6 HB3 ARG 6 27.670 32.346 29.654 42 HG2 ARG 6 HG2 ARG 6 24.823 33.457 29.653 43 HG3 ARG 6 HG3 ARG 6 26.148 33.973 30.695 44 HD2 ARG 6 HD2 ARG 6 26.337 35.574 29.073 45 HD3 ARG 6 HD3 ARG 6 27.454 34.382 28.447 46 HE ARG 6 HE ARG 6 25.999 33.935 26.643 47 HH11 ARG 6 HH11 ARG 6 24.572 34.594 25.212 48 HH12 ARG 6 HH12 ARG 6 23.199 35.626 25.674 49 HH21 ARG 6 HH21 ARG 6 24.400 36.218 28.815 50 HH22 ARG 6 HH22 ARG 6 23.178 36.553 27.603 51 H ARG 7 H ARG 7 26.574 29.251 29.682 52 HA ARG 7 HA ARG 7 29.221 28.537 28.792 53 HB2 ARG 7 HB2 ARG 7 28.154 27.673 30.949 54 HB3 ARG 7 HB3 ARG 7 27.128 26.643 29.979 55 HG2 ARG 7 HG2 ARG 7 29.040 25.366 30.820 56 HG3 ARG 7 HG3 ARG 7 29.090 25.453 29.067 57 HD2 ARG 7 HD2 ARG 7 31.324 25.730 29.878 58 HD3 ARG 7 HD3 ARG 7 30.820 27.271 29.234 59 HE ARG 7 HE ARG 7 30.789 28.198 31.408 60 HH11 ARG 7 HH11 ARG 7 31.608 24.735 31.675 61 HH12 ARG 7 HH12 ARG 7 32.130 25.007 33.344 62 HH21 ARG 7 HH21 ARG 7 31.481 28.283 33.539 63 HH22 ARG 7 HH22 ARG 7 32.068 26.789 34.273 64 H CYS 8 H CYS 8 26.031 27.365 27.857 65 HA CYS 8 HA CYS 8 26.696 25.392 25.992 66 HB2 CYS 8 HB2 CYS 8 24.450 25.742 26.727 67 HB3 CYS 8 HB3 CYS 8 24.479 27.426 26.212 68 H GLU 9 H GLU 9 26.184 28.933 25.318 69 HA GLU 9 HA GLU 9 26.860 28.548 22.541 70 HB2 GLU 9 HB2 GLU 9 26.370 30.716 22.205 71 HB3 GLU 9 HB3 GLU 9 25.341 30.331 23.577 72 HG2 GLU 9 HG2 GLU 9 26.971 31.488 25.063 73 HG3 GLU 9 HG3 GLU 9 27.963 31.856 23.639 74 H LEU 10 H LEU 10 28.697 29.844 25.276 75 HA LEU 10 HA LEU 10 31.131 30.448 23.915 76 HB2 LEU 10 HB2 LEU 10 30.383 29.803 26.770 77 HB3 LEU 10 HB3 LEU 10 32.064 29.737 26.359 78 HG LEU 10 HG LEU 10 31.298 31.899 27.353 79 HD11 LEU 10 HD11 LEU 10 33.422 31.688 26.175 80 HD12 LEU 10 HD12 LEU 10 32.623 31.987 24.621 81 HD13 LEU 10 HD13 LEU 10 32.700 33.268 25.853 82 HD21 LEU 10 HD21 LEU 10 30.308 33.613 25.940 83 HD22 LEU 10 HD22 LEU 10 30.127 32.468 24.599 84 HD23 LEU 10 HD23 LEU 10 29.189 32.259 26.096 85 H SER 11 H SER 11 30.152 27.319 25.399 86 HA SER 11 HA SER 11 32.580 25.923 24.739 87 HB2 SER 11 HB2 SER 11 31.014 25.218 26.483 88 HB3 SER 11 HB3 SER 11 29.751 24.963 25.268 89 HG SER 11 HG SER 11 32.199 23.517 25.577 90 H CYS 12 H CYS 12 29.675 26.622 22.815 91 HA CYS 12 HA CYS 12 30.614 24.895 20.600 92 HB2 CYS 12 HB2 CYS 12 28.282 26.827 20.672 93 HB3 CYS 12 HB3 CYS 12 28.677 25.681 19.432 94 H ARG 13 H ARG 13 30.834 28.310 21.528 95 HA ARG 13 HA ARG 13 31.496 29.413 18.981 96 HB2 ARG 13 HB2 ARG 13 30.922 30.588 21.204 97 HB3 ARG 13 HB3 ARG 13 32.605 30.318 21.668 98 HG2 ARG 13 HG2 ARG 13 33.287 31.624 19.598 99 HG3 ARG 13 HG3 ARG 13 31.565 31.859 19.238 100 HD2 ARG 13 HD2 ARG 13 32.315 33.840 20.350 101 HD3 ARG 13 HD3 ARG 13 31.310 32.940 21.498 102 HE ARG 13 HE ARG 13 34.103 32.223 21.755 103 HH11 ARG 13 HH11 ARG 13 31.819 34.708 22.768 104 HH12 ARG 13 HH12 ARG 13 32.987 35.459 23.832 105 HH21 ARG 13 HH21 ARG 13 35.357 32.987 23.428 106 HH22 ARG 13 HH22 ARG 13 34.980 34.519 24.179 107 H SER 14 H SER 14 33.429 27.587 21.274 108 HA SER 14 HA SER 14 36.011 27.954 20.126 109 HB2 SER 14 HB2 SER 14 35.373 26.824 22.320 110 HB3 SER 14 HB3 SER 14 34.942 25.389 21.368 111 HG SER 14 HG SER 14 37.439 26.750 21.499 112 H LEU 15 H LEU 15 33.327 25.827 19.162 113 HA LEU 15 HA LEU 15 34.786 24.714 16.845 114 HB2 LEU 15 HB2 LEU 15 31.854 24.406 17.583 115 HB3 LEU 15 HB3 LEU 15 32.787 23.427 16.465 116 HG LEU 15 HG LEU 15 33.049 23.486 19.500 117 HD11 LEU 15 HD11 LEU 15 32.206 21.184 19.319 118 HD12 LEU 15 HD12 LEU 15 31.064 22.320 18.597 119 HD13 LEU 15 HD13 LEU 15 32.112 21.332 17.553 120 HD21 LEU 15 HD21 LEU 15 34.634 21.596 19.218 121 HD22 LEU 15 HD22 LEU 15 34.609 21.836 17.456 122 HD23 LEU 15 HD23 LEU 15 35.276 23.087 18.530 123 H GLY 16 H GLY 16 32.821 27.457 17.523 124 HA2 GLY 16 HA2 GLY 16 32.269 29.225 16.109 125 HA3 GLY 16 HA3 GLY 16 32.678 28.258 14.694 126 H LEU 17 H LEU 17 30.308 27.356 17.278 127 HA LEU 17 HA LEU 17 28.123 27.655 15.237 128 HB2 LEU 17 HB2 LEU 17 27.763 25.930 17.647 129 HB3 LEU 17 HB3 LEU 17 26.911 25.902 16.140 130 HG LEU 17 HG LEU 17 29.660 24.886 16.720 131 HD11 LEU 17 HD11 LEU 17 28.675 22.671 16.102 132 HD12 LEU 17 HD12 LEU 17 27.966 23.395 17.536 133 HD13 LEU 17 HD13 LEU 17 27.081 23.451 15.995 134 HD21 LEU 17 HD21 LEU 17 29.702 23.971 14.405 135 HD22 LEU 17 HD22 LEU 17 28.119 24.711 14.070 136 HD23 LEU 17 HD23 LEU 17 29.548 25.718 14.331 137 H LEU 18 H LEU 18 26.183 28.562 15.828 138 HA LEU 18 HA LEU 18 26.207 30.544 18.027 139 HB2 LEU 18 HB2 LEU 18 24.139 29.798 15.912 140 HB3 LEU 18 HB3 LEU 18 23.985 31.145 17.033 141 HG LEU 18 HG LEU 18 26.206 30.896 14.965 142 HD11 LEU 18 HD11 LEU 18 23.632 32.517 14.875 143 HD12 LEU 18 HD12 LEU 18 24.947 32.556 13.680 144 HD13 LEU 18 HD13 LEU 18 23.996 31.081 13.894 145 HD21 LEU 18 HD21 LEU 18 26.820 32.375 16.844 146 HD22 LEU 18 HD22 LEU 18 26.498 33.322 15.386 147 HD23 LEU 18 HD23 LEU 18 25.279 33.251 16.672 148 H GLY 19 H GLY 19 25.665 29.825 20.086 149 HA2 GLY 19 HA2 GLY 19 23.819 27.545 20.426 150 HA3 GLY 19 HA3 GLY 19 24.633 28.403 21.701 151 H ALA 20 H ALA 20 21.782 27.537 21.127 152 HA ALA 20 HA ALA 20 20.507 29.883 22.319 153 HB1 ALA 20 HB1 ALA 20 19.377 28.453 19.877 154 HB2 ALA 20 HB2 ALA 20 18.548 29.690 20.835 155 HB3 ALA 20 HB3 ALA 20 20.007 30.120 19.920 156 H CYS 21 H CYS 21 18.724 29.405 23.523 157 HA CYS 21 HA CYS 21 18.611 26.679 24.688 158 HB2 CYS 21 HB2 CYS 21 18.784 28.584 26.179 159 HB3 CYS 21 HB3 CYS 21 17.323 29.295 25.482 160 H ILE 22 H ILE 22 17.123 25.171 24.161 161 HA ILE 22 HA ILE 22 14.559 26.002 22.862 162 HB ILE 22 HB ILE 22 16.354 23.717 21.992 163 HG12 ILE 22 HG12 ILE 22 17.294 25.872 21.246 164 HG13 ILE 22 HG13 ILE 22 16.755 24.865 19.925 165 HG21 ILE 22 HG21 ILE 22 14.718 23.505 20.099 166 HG22 ILE 22 HG22 ILE 22 14.025 23.102 21.661 167 HG23 ILE 22 HG23 ILE 22 13.657 24.667 20.921 168 HD11 ILE 22 HD11 ILE 22 14.792 26.251 19.549 169 HD12 ILE 22 HD12 ILE 22 15.151 27.230 20.984 170 HD13 ILE 22 HD13 ILE 22 16.241 27.262 19.588 171 H GLY 23 H GLY 23 13.346 25.845 24.590 172 HA2 GLY 23 HA2 GLY 23 12.054 24.933 26.215 173 HA3 GLY 23 HA3 GLY 23 12.389 23.332 25.551 174 H GLU 24 H GLU 24 13.695 22.066 26.610 175 HA GLU 24 HA GLU 24 14.467 22.839 29.349 176 HB2 GLU 24 HB2 GLU 24 14.551 20.485 29.808 177 HB3 GLU 24 HB3 GLU 24 13.092 20.819 28.881 178 HG2 GLU 24 HG2 GLU 24 14.191 19.976 26.825 179 HG3 GLU 24 HG3 GLU 24 15.715 19.765 27.691 180 H GLU 25 H GLU 25 16.218 22.675 26.470 181 HA GLU 25 HA GLU 25 18.721 22.435 27.916 182 HB2 GLU 25 HB2 GLU 25 18.152 20.101 27.452 183 HB3 GLU 25 HB3 GLU 25 18.006 20.456 25.733 184 HG2 GLU 25 HG2 GLU 25 20.082 19.336 26.144 185 HG3 GLU 25 HG3 GLU 25 20.448 20.972 25.653 186 H CYS 26 H CYS 26 20.565 23.265 26.804 187 HA CYS 26 HA CYS 26 19.865 24.989 24.479 188 HB2 CYS 26 HB2 CYS 26 20.683 26.132 26.405 189 HB3 CYS 26 HB3 CYS 26 22.154 25.162 26.435 190 H LYS 27 H LYS 27 20.680 24.866 22.578 191 HA LYS 27 HA LYS 27 22.792 22.885 21.861 192 HB2 LYS 27 HB2 LYS 27 21.355 22.189 19.911 193 HB3 LYS 27 HB3 LYS 27 20.845 21.605 21.493 194 HG2 LYS 27 HG2 LYS 27 18.992 23.121 21.600 195 HG3 LYS 27 HG3 LYS 27 19.602 24.085 20.259 196 HD2 LYS 27 HD2 LYS 27 17.695 22.732 19.554 197 HD3 LYS 27 HD3 LYS 27 19.156 22.271 18.676 198 HE2 LYS 27 HE2 LYS 27 19.454 20.320 20.161 199 HE3 LYS 27 HE3 LYS 27 18.033 20.794 21.105 200 HZ1 LYS 27 HZ1 LYS 27 17.891 20.189 18.202 201 HZ2 LYS 27 HZ2 LYS 27 17.675 19.051 19.382 202 HZ3 LYS 27 HZ3 LYS 27 16.635 20.332 19.238 203 H CYS 28 H CYS 28 23.694 23.224 19.733 204 HA CYS 28 HA CYS 28 23.567 26.084 18.886 205 HB2 CYS 28 HB2 CYS 28 26.015 26.141 18.926 206 HB3 CYS 28 HB3 CYS 28 25.288 25.864 20.510 207 H VAL 29 H VAL 29 24.325 26.591 16.755 208 HA VAL 29 HA VAL 29 24.337 24.291 14.870 209 HB VAL 29 HB VAL 29 22.642 25.290 13.465 210 HG11 VAL 29 HG11 VAL 29 20.690 24.781 14.772 211 HG12 VAL 29 HG12 VAL 29 21.981 23.657 15.224 212 HG13 VAL 29 HG13 VAL 29 21.564 25.016 16.295 213 HG21 VAL 29 HG21 VAL 29 22.864 27.666 13.974 214 HG22 VAL 29 HG22 VAL 29 21.206 27.134 14.268 215 HG23 VAL 29 HG23 VAL 29 22.307 27.389 15.636 216 HA PRO 30 HA PRO 30 27.231 26.661 12.410 217 HB2 PRO 30 HB2 PRO 30 25.764 25.574 10.014 218 HB3 PRO 30 HB3 PRO 30 27.510 25.520 10.390 219 HG2 PRO 30 HG2 PRO 30 25.984 23.310 10.673 220 HG3 PRO 30 HG3 PRO 30 27.225 23.708 11.903 221 HD2 PRO 30 HD2 PRO 30 24.243 24.262 11.989 222 HD3 PRO 30 HD3 PRO 30 25.306 23.548 13.236 223 H TYR 31 H TYR 31 27.330 28.345 10.724 224 HA TYR 31 HA TYR 31 25.309 30.354 11.016 225 HB2 TYR 31 HB2 TYR 31 27.400 30.361 8.840 226 HB3 TYR 31 HB3 TYR 31 26.674 31.731 9.659 227 HD1 TYR 31 HD1 TYR 31 29.686 30.577 9.187 228 HD2 TYR 31 HD2 TYR 31 27.031 31.037 12.545 229 HE1 TYR 31 HE1 TYR 31 31.643 30.583 10.728 230 HE2 TYR 31 HE2 TYR 31 28.991 31.063 14.088 231 HH TYR 31 HH TYR 31 31.262 31.000 14.264 Start of MODEL 5 1 H1 ALA 1 H1 ALA 1 13.180 22.469 33.702 2 H2 ALA 1 H2 ALA 1 13.002 23.304 35.118 3 H3 ALA 1 H3 ALA 1 13.279 21.684 35.137 4 HA ALA 1 HA ALA 1 15.267 22.885 35.721 5 HB1 ALA 1 HB1 ALA 1 15.490 20.700 34.586 6 HB2 ALA 1 HB2 ALA 1 15.431 21.506 33.002 7 HB3 ALA 1 HB3 ALA 1 16.786 21.805 34.093 8 H PHE 2 H PHE 2 17.094 24.166 34.897 9 HA PHE 2 HA PHE 2 16.328 26.252 32.875 10 HB2 PHE 2 HB2 PHE 2 18.364 26.426 35.112 11 HB3 PHE 2 HB3 PHE 2 17.887 27.724 34.025 12 HD1 PHE 2 HD1 PHE 2 17.519 26.604 37.272 13 HD2 PHE 2 HD2 PHE 2 15.124 28.043 33.984 14 HE1 PHE 2 HE1 PHE 2 15.746 27.290 38.859 15 HE2 PHE 2 HE2 PHE 2 13.353 28.727 35.584 16 HZ PHE 2 HZ PHE 2 13.659 28.362 38.023 17 H CYS 3 H CYS 3 18.372 27.240 31.806 18 HA CYS 3 HA CYS 3 20.436 25.191 31.209 19 HB2 CYS 3 HB2 CYS 3 20.187 25.836 28.814 20 HB3 CYS 3 HB3 CYS 3 18.853 24.911 29.497 21 H ASN 4 H ASN 4 22.429 25.890 30.914 22 HA ASN 4 HA ASN 4 23.078 28.677 31.648 23 HB2 ASN 4 HB2 ASN 4 24.664 26.100 31.417 24 HB3 ASN 4 HB3 ASN 4 25.450 27.670 31.426 25 HD21 ASN 4 HD21 ASN 4 24.788 28.465 34.801 26 HD22 ASN 4 HD22 ASN 4 25.141 29.094 33.200 27 H LEU 5 H LEU 5 22.195 29.610 29.762 28 HA LEU 5 HA LEU 5 22.942 28.977 27.143 29 HB2 LEU 5 HB2 LEU 5 20.965 30.277 27.810 30 HB3 LEU 5 HB3 LEU 5 21.990 31.634 28.263 31 HG LEU 5 HG LEU 5 22.721 31.886 25.913 32 HD11 LEU 5 HD11 LEU 5 21.457 30.664 24.120 33 HD12 LEU 5 HD12 LEU 5 22.521 29.605 25.041 34 HD13 LEU 5 HD13 LEU 5 20.767 29.603 25.364 35 HD21 LEU 5 HD21 LEU 5 20.743 33.108 26.731 36 HD22 LEU 5 HD22 LEU 5 20.569 32.689 25.017 37 HD23 LEU 5 HD23 LEU 5 19.694 31.756 26.249 38 H ARG 6 H ARG 6 24.670 31.221 29.362 39 HA ARG 6 HA ARG 6 26.637 32.128 27.437 40 HB2 ARG 6 HB2 ARG 6 26.757 31.726 30.451 41 HB3 ARG 6 HB3 ARG 6 28.166 32.201 29.545 42 HG2 ARG 6 HG2 ARG 6 25.627 33.865 29.473 43 HG3 ARG 6 HG3 ARG 6 26.842 34.014 30.734 44 HD2 ARG 6 HD2 ARG 6 27.434 35.692 29.262 45 HD3 ARG 6 HD3 ARG 6 28.568 34.393 28.861 46 HE ARG 6 HE ARG 6 26.163 34.277 27.239 47 HH11 ARG 6 HH11 ARG 6 29.122 36.244 27.438 48 HH12 ARG 6 HH12 ARG 6 28.993 36.700 25.772 49 HH21 ARG 6 HH21 ARG 6 26.026 34.978 25.263 50 HH22 ARG 6 HH22 ARG 6 27.259 35.996 24.536 51 H ARG 7 H ARG 7 26.782 29.311 29.671 52 HA ARG 7 HA ARG 7 29.265 28.308 28.636 53 HB2 ARG 7 HB2 ARG 7 28.451 27.480 30.748 54 HB3 ARG 7 HB3 ARG 7 26.970 26.855 30.014 55 HG2 ARG 7 HG2 ARG 7 28.042 25.085 28.955 56 HG3 ARG 7 HG3 ARG 7 29.642 25.831 29.040 57 HD2 ARG 7 HD2 ARG 7 28.163 24.985 31.548 58 HD3 ARG 7 HD3 ARG 7 29.121 23.851 30.578 59 HE ARG 7 HE ARG 7 30.851 25.957 30.920 60 HH11 ARG 7 HH11 ARG 7 29.271 23.793 33.240 61 HH12 ARG 7 HH12 ARG 7 30.500 24.202 34.448 62 HH21 ARG 7 HH21 ARG 7 32.312 26.224 32.435 63 HH22 ARG 7 HH22 ARG 7 32.204 25.358 33.969 64 H CYS 8 H CYS 8 25.926 27.539 27.724 65 HA CYS 8 HA CYS 8 26.453 25.663 25.692 66 HB2 CYS 8 HB2 CYS 8 24.229 26.309 26.712 67 HB3 CYS 8 HB3 CYS 8 24.280 27.799 25.768 68 H GLU 9 H GLU 9 26.185 29.246 25.304 69 HA GLU 9 HA GLU 9 26.867 29.220 22.491 70 HB2 GLU 9 HB2 GLU 9 26.920 31.312 24.716 71 HB3 GLU 9 HB3 GLU 9 27.484 31.711 23.108 72 HG2 GLU 9 HG2 GLU 9 24.758 30.448 23.265 73 HG3 GLU 9 HG3 GLU 9 24.933 32.059 23.954 74 H LEU 10 H LEU 10 28.879 29.977 25.399 75 HA LEU 10 HA LEU 10 31.211 30.598 23.845 76 HB2 LEU 10 HB2 LEU 10 30.660 30.166 26.795 77 HB3 LEU 10 HB3 LEU 10 32.307 30.251 26.240 78 HG LEU 10 HG LEU 10 31.501 32.380 27.126 79 HD11 LEU 10 HD11 LEU 10 33.339 32.269 25.452 80 HD12 LEU 10 HD12 LEU 10 32.152 32.595 24.168 81 HD13 LEU 10 HD13 LEU 10 32.455 33.799 25.430 82 HD21 LEU 10 HD21 LEU 10 30.068 33.865 25.805 83 HD22 LEU 10 HD22 LEU 10 29.701 32.551 24.678 84 HD23 LEU 10 HD23 LEU 10 29.173 32.454 26.375 85 H SER 11 H SER 11 30.035 27.516 25.113 86 HA SER 11 HA SER 11 32.587 26.137 24.616 87 HB2 SER 11 HB2 SER 11 29.827 24.889 24.840 88 HB3 SER 11 HB3 SER 11 31.411 24.104 25.029 89 HG SER 11 HG SER 11 30.096 25.971 26.662 90 H CYS 12 H CYS 12 29.530 26.687 22.754 91 HA CYS 12 HA CYS 12 30.491 24.886 20.636 92 HB2 CYS 12 HB2 CYS 12 28.087 26.729 20.731 93 HB3 CYS 12 HB3 CYS 12 28.462 25.541 19.503 94 H ARG 13 H ARG 13 30.527 28.380 21.222 95 HA ARG 13 HA ARG 13 31.446 29.228 18.638 96 HB2 ARG 13 HB2 ARG 13 31.633 30.322 21.468 97 HB3 ARG 13 HB3 ARG 13 32.337 31.143 20.082 98 HG2 ARG 13 HG2 ARG 13 30.180 31.234 18.930 99 HG3 ARG 13 HG3 ARG 13 29.420 30.318 20.230 100 HD2 ARG 13 HD2 ARG 13 30.056 32.191 21.820 101 HD3 ARG 13 HD3 ARG 13 30.599 33.116 20.410 102 HE ARG 13 HE ARG 13 27.781 32.062 20.637 103 HH11 ARG 13 HH11 ARG 13 29.776 34.987 20.206 104 HH12 ARG 13 HH12 ARG 13 28.326 35.892 19.825 105 HH21 ARG 13 HH21 ARG 13 26.154 33.356 20.294 106 HH22 ARG 13 HH22 ARG 13 26.427 35.069 19.885 107 H SER 14 H SER 14 33.021 27.309 21.001 108 HA SER 14 HA SER 14 35.779 27.831 20.341 109 HB2 SER 14 HB2 SER 14 34.933 26.382 22.246 110 HB3 SER 14 HB3 SER 14 34.493 25.162 21.036 111 HG SER 14 HG SER 14 36.947 25.936 22.016 112 H LEU 15 H LEU 15 33.301 25.697 18.889 113 HA LEU 15 HA LEU 15 35.063 24.898 16.657 114 HB2 LEU 15 HB2 LEU 15 32.112 24.317 17.116 115 HB3 LEU 15 HB3 LEU 15 33.189 23.516 15.980 116 HG LEU 15 HG LEU 15 33.274 23.328 19.024 117 HD11 LEU 15 HD11 LEU 15 31.475 22.045 17.910 118 HD12 LEU 15 HD12 LEU 15 32.682 21.251 16.874 119 HD13 LEU 15 HD13 LEU 15 32.691 20.983 18.630 120 HD21 LEU 15 HD21 LEU 15 35.032 21.599 18.663 121 HD22 LEU 15 HD22 LEU 15 35.112 22.053 16.948 122 HD23 LEU 15 HD23 LEU 15 35.577 23.217 18.215 123 H GLY 16 H GLY 16 32.470 27.158 17.313 124 HA2 GLY 16 HA2 GLY 16 32.263 29.189 15.978 125 HA3 GLY 16 HA3 GLY 16 32.612 28.265 14.521 126 H LEU 17 H LEU 17 30.311 27.441 17.177 127 HA LEU 17 HA LEU 17 28.049 27.678 15.229 128 HB2 LEU 17 HB2 LEU 17 27.769 26.040 17.696 129 HB3 LEU 17 HB3 LEU 17 26.983 25.856 16.176 130 HG LEU 17 HG LEU 17 29.780 25.006 16.864 131 HD11 LEU 17 HD11 LEU 17 27.251 23.408 16.334 132 HD12 LEU 17 HD12 LEU 17 28.873 22.715 16.537 133 HD13 LEU 17 HD13 LEU 17 28.125 23.579 17.874 134 HD21 LEU 17 HD21 LEU 17 28.199 24.508 14.289 135 HD22 LEU 17 HD22 LEU 17 29.593 25.597 14.404 136 HD23 LEU 17 HD23 LEU 17 29.814 23.866 14.650 137 H LEU 18 H LEU 18 26.121 28.656 15.974 138 HA LEU 18 HA LEU 18 26.337 30.364 18.417 139 HB2 LEU 18 HB2 LEU 18 24.143 30.132 16.316 140 HB3 LEU 18 HB3 LEU 18 24.097 31.204 17.715 141 HG LEU 18 HG LEU 18 26.094 31.328 15.438 142 HD11 LEU 18 HD11 LEU 18 23.799 33.183 16.209 143 HD12 LEU 18 HD12 LEU 18 24.929 33.414 14.856 144 HD13 LEU 18 HD13 LEU 18 23.799 32.044 14.850 145 HD21 LEU 18 HD21 LEU 18 27.128 32.193 17.526 146 HD22 LEU 18 HD22 LEU 18 26.767 33.516 16.414 147 HD23 LEU 18 HD23 LEU 18 25.698 33.217 17.799 148 H GLY 19 H GLY 19 25.563 29.767 20.285 149 HA2 GLY 19 HA2 GLY 19 23.859 27.358 20.530 150 HA3 GLY 19 HA3 GLY 19 24.646 28.176 21.844 151 H ALA 20 H ALA 20 21.921 27.239 21.333 152 HA ALA 20 HA ALA 20 20.373 29.562 22.271 153 HB1 ALA 20 HB1 ALA 20 19.564 27.535 20.129 154 HB2 ALA 20 HB2 ALA 20 18.482 28.737 20.854 155 HB3 ALA 20 HB3 ALA 20 19.857 29.272 19.870 156 H CYS 21 H CYS 21 18.347 28.680 23.299 157 HA CYS 21 HA CYS 21 18.594 25.884 24.286 158 HB2 CYS 21 HB2 CYS 21 19.586 27.015 26.083 159 HB3 CYS 21 HB3 CYS 21 18.367 28.296 26.067 160 H ILE 22 H ILE 22 16.912 24.806 23.810 161 HA ILE 22 HA ILE 22 14.318 26.098 23.122 162 HB ILE 22 HB ILE 22 15.316 23.248 22.747 163 HG12 ILE 22 HG12 ILE 22 14.983 25.416 20.632 164 HG13 ILE 22 HG13 ILE 22 16.534 24.972 21.353 165 HG21 ILE 22 HG21 ILE 22 13.322 22.954 21.304 166 HG22 ILE 22 HG22 ILE 22 12.837 23.368 22.939 167 HG23 ILE 22 HG23 ILE 22 12.810 24.612 21.671 168 HD11 ILE 22 HD11 ILE 22 16.406 23.835 19.277 169 HD12 ILE 22 HD12 ILE 22 16.204 22.617 20.540 170 HD13 ILE 22 HD13 ILE 22 14.793 23.192 19.613 171 H GLY 23 H GLY 23 13.006 26.385 24.863 172 HA2 GLY 23 HA2 GLY 23 11.786 25.987 26.747 173 HA3 GLY 23 HA3 GLY 23 12.060 24.255 26.516 174 H GLU 24 H GLU 24 14.108 23.393 27.290 175 HA GLU 24 HA GLU 24 15.581 24.859 29.400 176 HB2 GLU 24 HB2 GLU 24 15.312 23.131 31.044 177 HB3 GLU 24 HB3 GLU 24 13.715 23.669 30.528 178 HG2 GLU 24 HG2 GLU 24 13.600 21.653 29.003 179 HG3 GLU 24 HG3 GLU 24 15.149 21.111 29.650 180 H GLU 25 H GLU 25 15.862 23.271 26.571 181 HA GLU 25 HA GLU 25 18.239 21.625 27.303 182 HB2 GLU 25 HB2 GLU 25 16.336 21.532 24.952 183 HB3 GLU 25 HB3 GLU 25 17.804 20.574 25.043 184 HG2 GLU 25 HG2 GLU 25 15.629 20.403 27.177 185 HG3 GLU 25 HG3 GLU 25 15.590 19.457 25.699 186 H CYS 26 H CYS 26 20.139 22.608 26.882 187 HA CYS 26 HA CYS 26 20.586 24.701 24.937 188 HB2 CYS 26 HB2 CYS 26 22.123 24.601 26.702 189 HB3 CYS 26 HB3 CYS 26 22.319 22.852 26.563 190 H LYS 27 H LYS 27 21.069 24.637 22.853 191 HA LYS 27 HA LYS 27 22.284 22.300 21.528 192 HB2 LYS 27 HB2 LYS 27 19.733 23.655 20.531 193 HB3 LYS 27 HB3 LYS 27 20.728 22.589 19.549 194 HG2 LYS 27 HG2 LYS 27 19.224 21.732 22.041 195 HG3 LYS 27 HG3 LYS 27 18.723 21.528 20.369 196 HD2 LYS 27 HD2 LYS 27 20.992 20.234 20.052 197 HD3 LYS 27 HD3 LYS 27 20.977 20.114 21.830 198 HE2 LYS 27 HE2 LYS 27 18.613 19.271 21.655 199 HE3 LYS 27 HE3 LYS 27 18.780 19.322 19.891 200 HZ1 LYS 27 HZ1 LYS 27 20.619 17.651 20.148 201 HZ2 LYS 27 HZ2 LYS 27 20.265 17.542 21.753 202 HZ3 LYS 27 HZ3 LYS 27 19.156 17.085 20.674 203 H CYS 28 H CYS 28 23.388 22.970 19.522 204 HA CYS 28 HA CYS 28 23.532 25.867 18.996 205 HB2 CYS 28 HB2 CYS 28 26.009 25.843 19.081 206 HB3 CYS 28 HB3 CYS 28 25.235 25.724 20.652 207 H VAL 29 H VAL 29 24.391 26.407 16.891 208 HA VAL 29 HA VAL 29 24.657 24.161 14.979 209 HB VAL 29 HB VAL 29 22.871 24.906 13.543 210 HG11 VAL 29 HG11 VAL 29 21.726 24.602 16.349 211 HG12 VAL 29 HG12 VAL 29 20.926 24.249 14.812 212 HG13 VAL 29 HG13 VAL 29 22.300 23.258 15.326 213 HG21 VAL 29 HG21 VAL 29 22.258 26.994 15.657 214 HG22 VAL 29 HG22 VAL 29 22.815 27.302 13.997 215 HG23 VAL 29 HG23 VAL 29 21.220 26.602 14.277 216 HA PRO 30 HA PRO 30 27.569 26.653 12.960 217 HB2 PRO 30 HB2 PRO 30 26.339 25.928 10.303 218 HB3 PRO 30 HB3 PRO 30 28.045 25.819 10.819 219 HG2 PRO 30 HG2 PRO 30 26.492 23.604 10.732 220 HG3 PRO 30 HG3 PRO 30 27.612 23.861 12.106 221 HD2 PRO 30 HD2 PRO 30 24.630 24.361 11.983 222 HD3 PRO 30 HD3 PRO 30 25.610 23.602 13.270 223 H TYR 31 H TYR 31 28.072 28.542 11.824 224 HA TYR 31 HA TYR 31 26.185 30.709 11.654 225 HB2 TYR 31 HB2 TYR 31 28.881 30.408 10.286 226 HB3 TYR 31 HB3 TYR 31 28.030 31.905 10.601 227 HD1 TYR 31 HD1 TYR 31 30.928 31.053 11.299 228 HD2 TYR 31 HD2 TYR 31 27.290 31.203 13.581 229 HE1 TYR 31 HE1 TYR 31 32.255 31.442 13.364 230 HE2 TYR 31 HE2 TYR 31 28.622 31.565 15.667 231 HH TYR 31 HH TYR 31 32.189 31.645 15.670 Start of MODEL 6 1 H1 ALA 1 H1 ALA 1 16.321 17.949 34.295 2 H2 ALA 1 H2 ALA 1 15.678 18.999 33.201 3 H3 ALA 1 H3 ALA 1 15.596 19.341 34.806 4 HA ALA 1 HA ALA 1 17.994 19.469 34.938 5 HB1 ALA 1 HB1 ALA 1 18.399 18.006 32.949 6 HB2 ALA 1 HB2 ALA 1 17.857 19.330 31.895 7 HB3 ALA 1 HB3 ALA 1 19.313 19.523 32.889 8 H PHE 2 H PHE 2 19.185 21.523 34.357 9 HA PHE 2 HA PHE 2 17.450 23.674 33.208 10 HB2 PHE 2 HB2 PHE 2 19.477 24.083 35.415 11 HB3 PHE 2 HB3 PHE 2 18.366 25.266 34.745 12 HD1 PHE 2 HD1 PHE 2 15.798 24.751 34.993 13 HD2 PHE 2 HD2 PHE 2 18.894 22.916 37.374 14 HE1 PHE 2 HE1 PHE 2 14.119 24.159 36.719 15 HE2 PHE 2 HE2 PHE 2 17.222 22.322 39.098 16 HZ PHE 2 HZ PHE 2 14.826 22.961 38.783 17 H CYS 3 H CYS 3 18.555 25.296 31.959 18 HA CYS 3 HA CYS 3 21.274 24.496 31.083 19 HB2 CYS 3 HB2 CYS 3 20.775 25.364 28.953 20 HB3 CYS 3 HB3 CYS 3 19.514 24.245 29.433 21 H ASN 4 H ASN 4 22.628 26.153 30.188 22 HA ASN 4 HA ASN 4 22.577 28.839 31.550 23 HB2 ASN 4 HB2 ASN 4 24.805 26.820 31.084 24 HB3 ASN 4 HB3 ASN 4 25.122 28.535 31.379 25 HD21 ASN 4 HD21 ASN 4 23.972 28.237 34.846 26 HD22 ASN 4 HD22 ASN 4 23.771 29.342 33.497 27 H LEU 5 H LEU 5 21.731 29.945 29.788 28 HA LEU 5 HA LEU 5 22.258 29.490 27.072 29 HB2 LEU 5 HB2 LEU 5 20.460 30.853 27.998 30 HB3 LEU 5 HB3 LEU 5 21.596 32.057 28.569 31 HG LEU 5 HG LEU 5 20.231 32.617 26.553 32 HD11 LEU 5 HD11 LEU 5 22.296 33.867 27.113 33 HD12 LEU 5 HD12 LEU 5 23.208 32.810 26.010 34 HD13 LEU 5 HD13 LEU 5 21.924 33.843 25.385 35 HD21 LEU 5 HD21 LEU 5 22.112 30.777 25.030 36 HD22 LEU 5 HD22 LEU 5 20.395 30.443 25.387 37 HD23 LEU 5 HD23 LEU 5 20.844 31.817 24.361 38 H ARG 6 H ARG 6 24.070 31.627 29.287 39 HA ARG 6 HA ARG 6 25.934 32.560 27.257 40 HB2 ARG 6 HB2 ARG 6 25.936 32.641 30.299 41 HB3 ARG 6 HB3 ARG 6 27.207 33.382 29.348 42 HG2 ARG 6 HG2 ARG 6 24.335 34.152 28.761 43 HG3 ARG 6 HG3 ARG 6 25.145 34.770 30.198 44 HD2 ARG 6 HD2 ARG 6 25.376 36.374 28.406 45 HD3 ARG 6 HD3 ARG 6 26.947 35.725 28.876 46 HE ARG 6 HE ARG 6 25.543 34.525 26.521 47 HH11 ARG 6 HH11 ARG 6 28.307 36.525 27.577 48 HH12 ARG 6 HH12 ARG 6 28.890 36.542 25.917 49 HH21 ARG 6 HH21 ARG 6 26.475 34.626 24.605 50 HH22 ARG 6 HH22 ARG 6 27.954 35.579 24.358 51 H ARG 7 H ARG 7 26.021 29.770 29.332 52 HA ARG 7 HA ARG 7 28.819 29.061 28.646 53 HB2 ARG 7 HB2 ARG 7 27.856 28.268 30.773 54 HB3 ARG 7 HB3 ARG 7 26.557 27.464 29.899 55 HG2 ARG 7 HG2 ARG 7 28.229 25.860 30.673 56 HG3 ARG 7 HG3 ARG 7 28.048 25.858 28.921 57 HD2 ARG 7 HD2 ARG 7 30.401 25.626 29.700 58 HD3 ARG 7 HD3 ARG 7 30.109 26.957 28.581 59 HE ARG 7 HE ARG 7 30.199 27.437 31.542 60 HH11 ARG 7 HH11 ARG 7 31.880 27.885 28.494 61 HH12 ARG 7 HH12 ARG 7 32.482 29.475 29.003 62 HH21 ARG 7 HH21 ARG 7 31.188 29.442 32.106 63 HH22 ARG 7 HH22 ARG 7 32.239 30.192 30.907 64 H CYS 8 H CYS 8 25.547 28.017 27.701 65 HA CYS 8 HA CYS 8 26.197 26.045 25.830 66 HB2 CYS 8 HB2 CYS 8 23.948 26.488 26.645 67 HB3 CYS 8 HB3 CYS 8 23.926 28.065 25.852 68 H GLU 9 H GLU 9 25.797 29.582 25.118 69 HA GLU 9 HA GLU 9 26.616 29.437 22.384 70 HB2 GLU 9 HB2 GLU 9 26.906 31.632 24.515 71 HB3 GLU 9 HB3 GLU 9 27.360 31.870 22.829 72 HG2 GLU 9 HG2 GLU 9 25.102 31.428 22.075 73 HG3 GLU 9 HG3 GLU 9 24.555 31.116 23.733 74 H LEU 10 H LEU 10 28.694 30.034 25.305 75 HA LEU 10 HA LEU 10 31.094 30.333 23.749 76 HB2 LEU 10 HB2 LEU 10 30.368 30.251 26.657 77 HB3 LEU 10 HB3 LEU 10 32.039 29.925 26.248 78 HG LEU 10 HG LEU 10 31.579 32.291 26.829 79 HD11 LEU 10 HD11 LEU 10 32.970 33.256 25.093 80 HD12 LEU 10 HD12 LEU 10 33.546 31.642 25.492 81 HD13 LEU 10 HD13 LEU 10 32.637 31.910 23.987 82 HD21 LEU 10 HD21 LEU 10 29.371 32.556 25.661 83 HD22 LEU 10 HD22 LEU 10 30.540 33.809 25.255 84 HD23 LEU 10 HD23 LEU 10 30.211 32.507 24.096 85 H SER 11 H SER 11 29.700 27.484 25.341 86 HA SER 11 HA SER 11 31.967 25.758 24.908 87 HB2 SER 11 HB2 SER 11 30.004 25.355 26.462 88 HB3 SER 11 HB3 SER 11 29.023 25.003 25.027 89 HG SER 11 HG SER 11 31.331 23.642 26.001 90 H CYS 12 H CYS 12 29.136 26.632 22.896 91 HA CYS 12 HA CYS 12 29.913 24.881 20.681 92 HB2 CYS 12 HB2 CYS 12 27.886 27.126 20.977 93 HB3 CYS 12 HB3 CYS 12 28.136 26.191 19.504 94 H ARG 13 H ARG 13 30.608 28.207 21.658 95 HA ARG 13 HA ARG 13 31.726 29.178 19.216 96 HB2 ARG 13 HB2 ARG 13 31.241 30.305 21.614 97 HB3 ARG 13 HB3 ARG 13 32.942 29.932 21.865 98 HG2 ARG 13 HG2 ARG 13 33.143 32.037 20.951 99 HG3 ARG 13 HG3 ARG 13 33.180 31.096 19.465 100 HD2 ARG 13 HD2 ARG 13 31.611 32.803 19.021 101 HD3 ARG 13 HD3 ARG 13 30.599 31.415 19.397 102 HE ARG 13 HE ARG 13 31.319 33.317 21.594 103 HH11 ARG 13 HH11 ARG 13 28.613 32.102 19.716 104 HH12 ARG 13 HH12 ARG 13 27.567 33.389 20.212 105 HH21 ARG 13 HH21 ARG 13 29.984 34.764 22.310 106 HH22 ARG 13 HH22 ARG 13 28.309 34.843 21.760 107 H SER 14 H SER 14 33.025 26.817 21.441 108 HA SER 14 HA SER 14 35.749 26.921 20.476 109 HB2 SER 14 HB2 SER 14 35.132 25.762 22.573 110 HB3 SER 14 HB3 SER 14 34.327 24.501 21.613 111 HG SER 14 HG SER 14 36.349 23.743 21.768 112 H LEU 15 H LEU 15 32.869 25.059 19.422 113 HA LEU 15 HA LEU 15 34.290 23.825 17.163 114 HB2 LEU 15 HB2 LEU 15 31.325 23.860 17.809 115 HB3 LEU 15 HB3 LEU 15 32.150 22.813 16.655 116 HG LEU 15 HG LEU 15 32.396 22.748 19.692 117 HD11 LEU 15 HD11 LEU 15 31.327 20.744 17.659 118 HD12 LEU 15 HD12 LEU 15 31.436 20.495 19.410 119 HD13 LEU 15 HD13 LEU 15 30.350 21.737 18.767 120 HD21 LEU 15 HD21 LEU 15 33.854 21.040 17.630 121 HD22 LEU 15 HD22 LEU 15 34.604 22.195 18.760 122 HD23 LEU 15 HD23 LEU 15 33.818 20.743 19.382 123 H GLY 16 H GLY 16 32.427 26.704 17.699 124 HA2 GLY 16 HA2 GLY 16 32.634 28.623 16.358 125 HA3 GLY 16 HA3 GLY 16 33.049 27.645 14.954 126 H LEU 17 H LEU 17 30.181 27.222 17.083 127 HA LEU 17 HA LEU 17 28.410 28.311 14.961 128 HB2 LEU 17 HB2 LEU 17 26.805 26.366 15.745 129 HB3 LEU 17 HB3 LEU 17 27.839 26.255 14.341 130 HG LEU 17 HG LEU 17 28.722 25.129 17.022 131 HD11 LEU 17 HD11 LEU 17 27.076 23.725 14.866 132 HD12 LEU 17 HD12 LEU 17 27.751 22.975 16.329 133 HD13 LEU 17 HD13 LEU 17 26.480 24.188 16.468 134 HD21 LEU 17 HD21 LEU 17 30.450 25.155 15.191 135 HD22 LEU 17 HD22 LEU 17 29.939 23.509 15.557 136 HD23 LEU 17 HD23 LEU 17 29.317 24.332 14.117 137 H LEU 18 H LEU 18 26.350 29.019 15.622 138 HA LEU 18 HA LEU 18 26.455 30.594 18.066 139 HB2 LEU 18 HB2 LEU 18 24.356 30.156 15.899 140 HB3 LEU 18 HB3 LEU 18 24.136 31.284 17.232 141 HG LEU 18 HG LEU 18 26.477 31.478 15.320 142 HD11 LEU 18 HD11 LEU 18 23.826 32.941 15.167 143 HD12 LEU 18 HD12 LEU 18 25.235 33.179 14.114 144 HD13 LEU 18 HD13 LEU 18 24.351 31.643 14.069 145 HD21 LEU 18 HD21 LEU 18 26.777 32.739 17.412 146 HD22 LEU 18 HD22 LEU 18 26.452 33.862 16.087 147 HD23 LEU 18 HD23 LEU 18 25.161 33.460 17.228 148 H GLY 19 H GLY 19 25.690 30.013 20.043 149 HA2 GLY 19 HA2 GLY 19 23.901 27.638 20.229 150 HA3 GLY 19 HA3 GLY 19 24.823 28.282 21.536 151 H ALA 20 H ALA 20 22.108 27.490 21.324 152 HA ALA 20 HA ALA 20 20.918 29.636 22.878 153 HB1 ALA 20 HB1 ALA 20 18.764 29.582 21.657 154 HB2 ALA 20 HB2 ALA 20 20.066 30.179 20.619 155 HB3 ALA 20 HB3 ALA 20 19.468 28.517 20.430 156 H CYS 21 H CYS 21 19.125 28.819 24.147 157 HA CYS 21 HA CYS 21 19.142 25.841 24.517 158 HB2 CYS 21 HB2 CYS 21 20.089 26.845 26.436 159 HB3 CYS 21 HB3 CYS 21 18.797 28.059 26.531 160 H ILE 22 H ILE 22 17.348 24.722 24.278 161 HA ILE 22 HA ILE 22 14.746 26.132 23.836 162 HB ILE 22 HB ILE 22 15.479 23.277 23.131 163 HG12 ILE 22 HG12 ILE 22 16.913 24.575 21.748 164 HG13 ILE 22 HG13 ILE 22 15.561 24.034 20.768 165 HG21 ILE 22 HG21 ILE 22 13.131 25.040 22.281 166 HG22 ILE 22 HG22 ILE 22 13.448 23.380 21.746 167 HG23 ILE 22 HG23 ILE 22 13.056 23.700 23.436 168 HD11 ILE 22 HD11 ILE 22 14.529 26.324 20.991 169 HD12 ILE 22 HD12 ILE 22 15.985 26.849 21.861 170 HD13 ILE 22 HD13 ILE 22 16.111 26.317 20.184 171 H GLY 23 H GLY 23 14.118 26.512 25.923 172 HA2 GLY 23 HA2 GLY 23 13.112 26.085 27.942 173 HA3 GLY 23 HA3 GLY 23 13.001 24.380 27.487 174 H GLU 24 H GLU 24 14.861 23.045 27.812 175 HA GLU 24 HA GLU 24 16.924 23.999 29.747 176 HB2 GLU 24 HB2 GLU 24 16.715 22.098 31.114 177 HB3 GLU 24 HB3 GLU 24 15.094 22.764 30.920 178 HG2 GLU 24 HG2 GLU 24 14.702 20.999 29.113 179 HG3 GLU 24 HG3 GLU 24 16.272 20.309 29.530 180 H GLU 25 H GLU 25 16.522 22.788 26.685 181 HA GLU 25 HA GLU 25 18.956 21.060 26.810 182 HB2 GLU 25 HB2 GLU 25 16.964 21.309 24.541 183 HB3 GLU 25 HB3 GLU 25 18.278 20.148 24.693 184 HG2 GLU 25 HG2 GLU 25 15.741 20.293 26.366 185 HG3 GLU 25 HG3 GLU 25 16.127 19.107 25.128 186 H CYS 26 H CYS 26 20.845 22.065 26.288 187 HA CYS 26 HA CYS 26 20.924 24.480 24.637 188 HB2 CYS 26 HB2 CYS 26 22.541 24.272 26.370 189 HB3 CYS 26 HB3 CYS 26 23.013 22.657 25.826 190 H LYS 27 H LYS 27 21.189 24.672 22.533 191 HA LYS 27 HA LYS 27 22.288 22.488 20.815 192 HB2 LYS 27 HB2 LYS 27 19.712 24.072 20.390 193 HB3 LYS 27 HB3 LYS 27 20.536 23.189 19.097 194 HG2 LYS 27 HG2 LYS 27 20.198 21.088 20.162 195 HG3 LYS 27 HG3 LYS 27 19.527 21.830 21.625 196 HD2 LYS 27 HD2 LYS 27 17.558 22.532 20.538 197 HD3 LYS 27 HD3 LYS 27 18.260 22.367 18.908 198 HE2 LYS 27 HE2 LYS 27 18.346 20.000 19.082 199 HE3 LYS 27 HE3 LYS 27 17.841 20.017 20.784 200 HZ1 LYS 27 HZ1 LYS 27 15.671 20.735 20.158 201 HZ2 LYS 27 HZ2 LYS 27 16.122 21.062 18.595 202 HZ3 LYS 27 HZ3 LYS 27 16.025 19.522 19.109 203 H CYS 28 H CYS 28 23.287 23.324 18.858 204 HA CYS 28 HA CYS 28 23.383 26.254 18.597 205 HB2 CYS 28 HB2 CYS 28 25.909 26.019 17.998 206 HB3 CYS 28 HB3 CYS 28 25.382 26.316 19.630 207 H VAL 29 H VAL 29 24.018 27.040 16.504 208 HA VAL 29 HA VAL 29 23.694 25.112 14.268 209 HB VAL 29 HB VAL 29 22.008 26.466 13.207 210 HG11 VAL 29 HG11 VAL 29 21.110 25.857 16.049 211 HG12 VAL 29 HG12 VAL 29 20.101 25.968 14.594 212 HG13 VAL 29 HG13 VAL 29 21.281 24.656 14.743 213 HG21 VAL 29 HG21 VAL 29 22.036 28.216 15.693 214 HG22 VAL 29 HG22 VAL 29 22.526 28.704 14.055 215 HG23 VAL 29 HG23 VAL 29 20.838 28.296 14.383 216 HA PRO 30 HA PRO 30 26.738 27.540 12.204 217 HB2 PRO 30 HB2 PRO 30 25.014 27.306 9.722 218 HB3 PRO 30 HB3 PRO 30 26.775 27.053 9.890 219 HG2 PRO 30 HG2 PRO 30 25.191 24.910 9.839 220 HG3 PRO 30 HG3 PRO 30 26.429 24.990 11.119 221 HD2 PRO 30 HD2 PRO 30 23.484 25.740 11.335 222 HD3 PRO 30 HD3 PRO 30 24.465 24.682 12.392 223 H TYR 31 H TYR 31 27.271 29.558 11.373 224 HA TYR 31 HA TYR 31 25.555 31.792 12.027 225 HB2 TYR 31 HB2 TYR 31 28.275 31.526 10.720 226 HB3 TYR 31 HB3 TYR 31 27.479 33.076 10.917 227 HD1 TYR 31 HD1 TYR 31 28.656 30.115 12.945 228 HD2 TYR 31 HD2 TYR 31 27.770 34.324 12.873 229 HE1 TYR 31 HE1 TYR 31 29.643 30.369 15.216 230 HE2 TYR 31 HE2 TYR 31 28.780 34.576 15.132 231 HH TYR 31 HH TYR 31 29.764 33.516 16.900 Start of MODEL 7 1 H1 ALA 1 H1 ALA 1 11.742 28.558 33.029 2 H2 ALA 1 H2 ALA 1 12.054 28.148 34.590 3 H3 ALA 1 H3 ALA 1 10.959 27.290 33.711 4 HA ALA 1 HA ALA 1 12.905 26.013 33.892 5 HB1 ALA 1 HB1 ALA 1 13.426 25.659 31.515 6 HB2 ALA 1 HB2 ALA 1 11.686 25.824 31.778 7 HB3 ALA 1 HB3 ALA 1 12.609 27.187 31.104 8 H PHE 2 H PHE 2 15.084 25.750 33.907 9 HA PHE 2 HA PHE 2 16.770 28.228 33.737 10 HB2 PHE 2 HB2 PHE 2 17.109 25.850 35.584 11 HB3 PHE 2 HB3 PHE 2 18.120 27.284 35.529 12 HD1 PHE 2 HD1 PHE 2 17.001 29.571 36.045 13 HD2 PHE 2 HD2 PHE 2 15.204 25.782 37.018 14 HE1 PHE 2 HE1 PHE 2 15.599 30.685 37.771 15 HE2 PHE 2 HE2 PHE 2 13.787 26.887 38.720 16 HZ PHE 2 HZ PHE 2 13.998 29.334 39.129 17 H CYS 3 H CYS 3 18.704 28.151 32.685 18 HA CYS 3 HA CYS 3 19.820 25.655 31.593 19 HB2 CYS 3 HB2 CYS 3 17.972 26.279 30.088 20 HB3 CYS 3 HB3 CYS 3 18.661 27.882 29.866 21 H ASN 4 H ASN 4 21.990 25.832 31.078 22 HA ASN 4 HA ASN 4 23.327 28.449 31.549 23 HB2 ASN 4 HB2 ASN 4 24.617 25.745 31.170 24 HB3 ASN 4 HB3 ASN 4 25.411 27.287 31.433 25 HD21 ASN 4 HD21 ASN 4 24.309 27.535 34.897 26 HD22 ASN 4 HD22 ASN 4 24.757 28.507 33.518 27 H LEU 5 H LEU 5 22.066 29.125 29.656 28 HA LEU 5 HA LEU 5 22.800 28.566 26.939 29 HB2 LEU 5 HB2 LEU 5 20.775 29.789 27.547 30 HB3 LEU 5 HB3 LEU 5 21.725 31.048 28.334 31 HG LEU 5 HG LEU 5 22.686 31.727 26.147 32 HD11 LEU 5 HD11 LEU 5 21.681 30.869 24.060 33 HD12 LEU 5 HD12 LEU 5 22.529 29.581 24.913 34 HD13 LEU 5 HD13 LEU 5 20.754 29.669 24.990 35 HD21 LEU 5 HD21 LEU 5 20.670 32.817 27.008 36 HD22 LEU 5 HD22 LEU 5 20.606 32.699 25.247 37 HD23 LEU 5 HD23 LEU 5 19.643 31.583 26.250 38 H ARG 6 H ARG 6 24.204 30.760 29.422 39 HA ARG 6 HA ARG 6 26.189 32.008 27.777 40 HB2 ARG 6 HB2 ARG 6 26.250 31.231 30.732 41 HB3 ARG 6 HB3 ARG 6 27.467 32.232 29.959 42 HG2 ARG 6 HG2 ARG 6 24.520 32.903 30.347 43 HG3 ARG 6 HG3 ARG 6 25.899 33.619 31.178 44 HD2 ARG 6 HD2 ARG 6 25.149 33.927 28.250 45 HD3 ARG 6 HD3 ARG 6 25.106 35.160 29.514 46 HE ARG 6 HE ARG 6 27.783 34.142 29.261 47 HH11 ARG 6 HH11 ARG 6 25.613 36.285 27.483 48 HH12 ARG 6 HH12 ARG 6 26.995 37.217 26.894 49 HH21 ARG 6 HH21 ARG 6 29.346 35.238 28.349 50 HH22 ARG 6 HH22 ARG 6 28.992 36.418 27.073 51 H ARG 7 H ARG 7 26.615 29.058 29.766 52 HA ARG 7 HA ARG 7 29.250 28.467 28.793 53 HB2 ARG 7 HB2 ARG 7 28.338 27.507 30.878 54 HB3 ARG 7 HB3 ARG 7 27.134 26.595 29.963 55 HG2 ARG 7 HG2 ARG 7 28.700 25.115 29.058 56 HG3 ARG 7 HG3 ARG 7 30.061 26.216 29.280 57 HD2 ARG 7 HD2 ARG 7 28.575 24.979 31.621 58 HD3 ARG 7 HD3 ARG 7 29.958 24.201 30.833 59 HE ARG 7 HE ARG 7 30.708 26.876 31.458 60 HH11 ARG 7 HH11 ARG 7 30.115 23.866 33.285 61 HH12 ARG 7 HH12 ARG 7 31.423 24.312 34.369 62 HH21 ARG 7 HH21 ARG 7 32.238 27.223 32.923 63 HH22 ARG 7 HH22 ARG 7 32.521 26.042 34.207 64 H CYS 8 H CYS 8 26.053 27.350 27.752 65 HA CYS 8 HA CYS 8 26.852 25.601 25.670 66 HB2 CYS 8 HB2 CYS 8 24.568 25.801 26.540 67 HB3 CYS 8 HB3 CYS 8 24.443 27.432 25.886 68 H GLU 9 H GLU 9 26.159 29.177 25.360 69 HA GLU 9 HA GLU 9 26.824 29.211 22.556 70 HB2 GLU 9 HB2 GLU 9 26.739 31.433 24.661 71 HB3 GLU 9 HB3 GLU 9 27.131 31.703 22.955 72 HG2 GLU 9 HG2 GLU 9 24.899 30.568 22.414 73 HG3 GLU 9 HG3 GLU 9 24.481 30.746 24.106 74 H LEU 10 H LEU 10 28.824 30.054 25.457 75 HA LEU 10 HA LEU 10 31.117 30.847 23.903 76 HB2 LEU 10 HB2 LEU 10 30.584 30.169 26.798 77 HB3 LEU 10 HB3 LEU 10 32.239 30.218 26.264 78 HG LEU 10 HG LEU 10 31.484 32.317 27.303 79 HD11 LEU 10 HD11 LEU 10 32.494 33.832 25.698 80 HD12 LEU 10 HD12 LEU 10 33.382 32.306 25.740 81 HD13 LEU 10 HD13 LEU 10 32.277 32.662 24.387 82 HD21 LEU 10 HD21 LEU 10 29.172 32.466 26.457 83 HD22 LEU 10 HD22 LEU 10 30.108 33.922 26.098 84 HD23 LEU 10 HD23 LEU 10 29.788 32.745 24.814 85 H SER 11 H SER 11 30.179 27.692 25.249 86 HA SER 11 HA SER 11 32.583 26.282 24.491 87 HB2 SER 11 HB2 SER 11 30.999 25.478 26.209 88 HB3 SER 11 HB3 SER 11 29.749 25.293 24.984 89 HG SER 11 HG SER 11 30.587 23.335 25.172 90 H CYS 12 H CYS 12 29.480 26.924 22.753 91 HA CYS 12 HA CYS 12 30.210 25.133 20.556 92 HB2 CYS 12 HB2 CYS 12 28.015 27.204 20.908 93 HB3 CYS 12 HB3 CYS 12 28.233 26.195 19.473 94 H ARG 13 H ARG 13 30.478 28.649 21.203 95 HA ARG 13 HA ARG 13 31.441 29.425 18.605 96 HB2 ARG 13 HB2 ARG 13 31.663 30.513 21.438 97 HB3 ARG 13 HB3 ARG 13 32.464 31.283 20.089 98 HG2 ARG 13 HG2 ARG 13 30.361 31.625 18.897 99 HG3 ARG 13 HG3 ARG 13 29.479 30.682 20.100 100 HD2 ARG 13 HD2 ARG 13 29.070 33.021 20.497 101 HD3 ARG 13 HD3 ARG 13 30.033 32.382 21.839 102 HE ARG 13 HE ARG 13 31.869 33.404 19.954 103 HH11 ARG 13 HH11 ARG 13 29.284 34.941 21.847 104 HH12 ARG 13 HH12 ARG 13 30.174 36.462 21.808 105 HH21 ARG 13 HH21 ARG 13 32.791 35.339 19.987 106 HH22 ARG 13 HH22 ARG 13 31.971 36.691 20.795 107 H SER 14 H SER 14 33.137 28.073 21.431 108 HA SER 14 HA SER 14 35.791 28.190 20.418 109 HB2 SER 14 HB2 SER 14 35.227 27.624 22.742 110 HB3 SER 14 HB3 SER 14 34.478 26.114 22.208 111 HG SER 14 HG SER 14 37.193 26.849 22.206 112 H LEU 15 H LEU 15 33.163 25.992 19.542 113 HA LEU 15 HA LEU 15 34.909 24.302 17.838 114 HB2 LEU 15 HB2 LEU 15 31.891 24.217 18.182 115 HB3 LEU 15 HB3 LEU 15 32.920 22.997 17.447 116 HG LEU 15 HG LEU 15 32.796 23.746 20.397 117 HD11 LEU 15 HD11 LEU 15 31.939 21.463 20.663 118 HD12 LEU 15 HD12 LEU 15 30.907 22.396 19.567 119 HD13 LEU 15 HD13 LEU 15 32.045 21.199 18.910 120 HD21 LEU 15 HD21 LEU 15 35.108 23.136 19.877 121 HD22 LEU 15 HD22 LEU 15 34.324 21.823 20.764 122 HD23 LEU 15 HD23 LEU 15 34.545 21.691 19.006 123 H GLY 16 H GLY 16 32.570 26.921 17.496 124 HA2 GLY 16 HA2 GLY 16 32.822 28.378 15.510 125 HA3 GLY 16 HA3 GLY 16 32.980 26.943 14.515 126 H LEU 17 H LEU 17 30.501 27.273 17.100 127 HA LEU 17 HA LEU 17 28.416 27.799 15.083 128 HB2 LEU 17 HB2 LEU 17 27.077 25.936 16.426 129 HB3 LEU 17 HB3 LEU 17 27.890 25.674 14.902 130 HG LEU 17 HG LEU 17 29.072 24.875 17.590 131 HD11 LEU 17 HD11 LEU 17 28.266 22.628 17.048 132 HD12 LEU 17 HD12 LEU 17 26.898 23.738 17.030 133 HD13 LEU 17 HD13 LEU 17 27.596 23.201 15.501 134 HD21 LEU 17 HD21 LEU 17 30.331 23.200 16.134 135 HD22 LEU 17 HD22 LEU 17 29.781 24.101 14.708 136 HD23 LEU 17 HD23 LEU 17 30.856 24.848 15.908 137 H LEU 18 H LEU 18 26.403 28.496 15.834 138 HA LEU 18 HA LEU 18 26.582 30.211 18.259 139 HB2 LEU 18 HB2 LEU 18 24.675 30.077 15.891 140 HB3 LEU 18 HB3 LEU 18 24.453 31.193 17.239 141 HG LEU 18 HG LEU 18 26.924 31.146 15.487 142 HD11 LEU 18 HD11 LEU 18 25.964 33.097 14.347 143 HD12 LEU 18 HD12 LEU 18 24.941 31.670 14.141 144 HD13 LEU 18 HD13 LEU 18 24.474 32.938 15.303 145 HD21 LEU 18 HD21 LEU 18 27.304 32.258 17.655 146 HD22 LEU 18 HD22 LEU 18 27.275 33.427 16.337 147 HD23 LEU 18 HD23 LEU 18 25.857 33.278 17.381 148 H GLY 19 H GLY 19 25.209 30.033 19.997 149 HA2 GLY 19 HA2 GLY 19 23.534 27.555 20.112 150 HA3 GLY 19 HA3 GLY 19 24.360 28.252 21.476 151 H ALA 20 H ALA 20 21.549 27.520 20.819 152 HA ALA 20 HA ALA 20 20.346 29.781 22.261 153 HB1 ALA 20 HB1 ALA 20 19.769 30.140 19.881 154 HB2 ALA 20 HB2 ALA 20 19.065 28.508 19.804 155 HB3 ALA 20 HB3 ALA 20 18.341 29.747 20.853 156 H CYS 21 H CYS 21 18.850 29.183 23.734 157 HA CYS 21 HA CYS 21 18.522 26.256 24.263 158 HB2 CYS 21 HB2 CYS 21 20.000 27.463 25.855 159 HB3 CYS 21 HB3 CYS 21 18.617 28.452 26.347 160 H ILE 22 H ILE 22 16.651 25.353 24.448 161 HA ILE 22 HA ILE 22 14.168 27.039 24.645 162 HB ILE 22 HB ILE 22 14.546 24.285 23.439 163 HG12 ILE 22 HG12 ILE 22 13.741 26.941 22.176 164 HG13 ILE 22 HG13 ILE 22 15.338 26.194 22.026 165 HG21 ILE 22 HG21 ILE 22 12.136 24.371 22.899 166 HG22 ILE 22 HG22 ILE 22 12.375 24.421 24.639 167 HG23 ILE 22 HG23 ILE 22 11.999 25.920 23.758 168 HD11 ILE 22 HD11 ILE 22 12.729 25.128 20.866 169 HD12 ILE 22 HD12 ILE 22 14.149 25.741 20.011 170 HD13 ILE 22 HD13 ILE 22 14.261 24.217 20.904 171 H GLY 23 H GLY 23 13.534 27.182 26.641 172 HA2 GLY 23 HA2 GLY 23 13.103 26.761 28.835 173 HA3 GLY 23 HA3 GLY 23 12.845 25.080 28.385 174 H GLU 24 H GLU 24 14.368 23.613 28.881 175 HA GLU 24 HA GLU 24 16.803 24.475 30.393 176 HB2 GLU 24 HB2 GLU 24 16.681 22.572 31.710 177 HB3 GLU 24 HB3 GLU 24 15.031 23.156 31.585 178 HG2 GLU 24 HG2 GLU 24 14.597 21.382 29.839 179 HG3 GLU 24 HG3 GLU 24 16.239 20.793 30.076 180 H GLU 25 H GLU 25 16.080 23.246 27.326 181 HA GLU 25 HA GLU 25 18.600 21.638 27.157 182 HB2 GLU 25 HB2 GLU 25 16.087 21.514 25.490 183 HB3 GLU 25 HB3 GLU 25 17.615 20.751 25.049 184 HG2 GLU 25 HG2 GLU 25 17.533 19.584 27.341 185 HG3 GLU 25 HG3 GLU 25 15.832 20.075 27.405 186 H CYS 26 H CYS 26 20.278 22.563 26.157 187 HA CYS 26 HA CYS 26 19.779 24.737 24.180 188 HB2 CYS 26 HB2 CYS 26 21.095 25.248 26.259 189 HB3 CYS 26 HB3 CYS 26 22.351 24.173 25.652 190 H LYS 27 H LYS 27 20.505 24.738 22.169 191 HA LYS 27 HA LYS 27 22.430 22.662 21.265 192 HB2 LYS 27 HB2 LYS 27 19.745 23.189 19.896 193 HB3 LYS 27 HB3 LYS 27 21.094 22.305 19.166 194 HG2 LYS 27 HG2 LYS 27 20.970 20.710 21.136 195 HG3 LYS 27 HG3 LYS 27 19.471 21.558 21.600 196 HD2 LYS 27 HD2 LYS 27 18.762 21.084 19.099 197 HD3 LYS 27 HD3 LYS 27 20.028 19.842 19.151 198 HE2 LYS 27 HE2 LYS 27 17.690 20.176 21.060 199 HE3 LYS 27 HE3 LYS 27 17.764 18.990 19.745 200 HZ1 LYS 27 HZ1 LYS 27 18.335 17.938 21.816 201 HZ2 LYS 27 HZ2 LYS 27 19.704 17.985 20.898 202 HZ3 LYS 27 HZ3 LYS 27 19.499 19.025 22.160 203 H CYS 28 H CYS 28 23.652 23.202 19.464 204 HA CYS 28 HA CYS 28 23.445 26.029 18.561 205 HB2 CYS 28 HB2 CYS 28 25.939 26.120 18.556 206 HB3 CYS 28 HB3 CYS 28 25.203 26.097 20.123 207 H VAL 29 H VAL 29 24.215 26.598 16.526 208 HA VAL 29 HA VAL 29 24.446 24.407 14.509 209 HB VAL 29 HB VAL 29 22.711 25.343 13.134 210 HG11 VAL 29 HG11 VAL 29 22.011 23.728 14.888 211 HG12 VAL 29 HG12 VAL 29 21.554 25.094 15.933 212 HG13 VAL 29 HG13 VAL 29 20.732 24.836 14.387 213 HG21 VAL 29 HG21 VAL 29 22.304 27.463 15.267 214 HG22 VAL 29 HG22 VAL 29 22.913 27.727 13.619 215 HG23 VAL 29 HG23 VAL 29 21.251 27.191 13.865 216 HA PRO 30 HA PRO 30 27.500 26.650 12.474 217 HB2 PRO 30 HB2 PRO 30 25.812 26.647 9.937 218 HB3 PRO 30 HB3 PRO 30 27.547 26.288 10.117 219 HG2 PRO 30 HG2 PRO 30 25.835 24.239 9.995 220 HG3 PRO 30 HG3 PRO 30 27.087 24.217 11.277 221 HD2 PRO 30 HD2 PRO 30 24.176 25.070 11.475 222 HD3 PRO 30 HD3 PRO 30 25.115 24.005 12.558 223 H TYR 31 H TYR 31 28.322 28.576 11.616 224 HA TYR 31 HA TYR 31 27.029 31.040 12.324 225 HB2 TYR 31 HB2 TYR 31 29.464 30.469 10.584 226 HB3 TYR 31 HB3 TYR 31 28.966 32.061 11.118 227 HD1 TYR 31 HD1 TYR 31 31.637 31.434 11.517 228 HD2 TYR 31 HD2 TYR 31 28.313 30.384 14.032 229 HE1 TYR 31 HE1 TYR 31 33.153 31.390 13.495 230 HE2 TYR 31 HE2 TYR 31 29.814 30.404 16.024 231 HH TYR 31 HH TYR 31 33.333 30.986 15.738 Start of MODEL 8 1 H1 ALA 1 H1 ALA 1 14.546 21.570 34.502 2 H2 ALA 1 H2 ALA 1 13.397 22.484 35.235 3 H3 ALA 1 H3 ALA 1 14.413 21.536 36.130 4 HA ALA 1 HA ALA 1 14.963 23.886 36.251 5 HB1 ALA 1 HB1 ALA 1 16.701 22.201 36.677 6 HB2 ALA 1 HB2 ALA 1 17.033 22.066 34.941 7 HB3 ALA 1 HB3 ALA 1 17.398 23.568 35.807 8 H PHE 2 H PHE 2 16.474 25.495 34.960 9 HA PHE 2 HA PHE 2 15.598 25.673 32.107 10 HB2 PHE 2 HB2 PHE 2 16.312 27.896 34.033 11 HB3 PHE 2 HB3 PHE 2 15.961 28.111 32.324 12 HD1 PHE 2 HD1 PHE 2 14.533 27.778 35.635 13 HD2 PHE 2 HD2 PHE 2 13.658 27.331 31.432 14 HE1 PHE 2 HE1 PHE 2 12.106 27.786 36.121 15 HE2 PHE 2 HE2 PHE 2 11.227 27.377 31.933 16 HZ PHE 2 HZ PHE 2 10.453 27.589 34.285 17 H CYS 3 H CYS 3 17.046 26.386 30.545 18 HA CYS 3 HA CYS 3 19.533 25.155 30.563 19 HB2 CYS 3 HB2 CYS 3 19.767 26.100 28.375 20 HB3 CYS 3 HB3 CYS 3 18.084 25.781 28.621 21 H ASN 4 H ASN 4 21.642 25.933 30.190 22 HA ASN 4 HA ASN 4 22.425 28.587 31.326 23 HB2 ASN 4 HB2 ASN 4 23.776 25.884 31.289 24 HB3 ASN 4 HB3 ASN 4 24.731 27.344 31.260 25 HD21 ASN 4 HD21 ASN 4 23.955 28.384 34.542 26 HD22 ASN 4 HD22 ASN 4 24.505 28.872 32.935 27 H LEU 5 H LEU 5 21.727 29.526 29.361 28 HA LEU 5 HA LEU 5 22.622 28.742 26.776 29 HB2 LEU 5 HB2 LEU 5 20.695 30.179 27.077 30 HB3 LEU 5 HB3 LEU 5 21.693 31.409 27.848 31 HG LEU 5 HG LEU 5 22.897 31.819 25.720 32 HD11 LEU 5 HD11 LEU 5 20.894 29.849 24.527 33 HD12 LEU 5 HD12 LEU 5 21.973 30.912 23.609 34 HD13 LEU 5 HD13 LEU 5 22.662 29.628 24.608 35 HD21 LEU 5 HD21 LEU 5 20.895 33.121 26.331 36 HD22 LEU 5 HD22 LEU 5 21.053 32.931 24.579 37 HD23 LEU 5 HD23 LEU 5 19.882 31.945 25.466 38 H ARG 6 H ARG 6 24.227 30.897 29.190 39 HA ARG 6 HA ARG 6 26.284 31.734 27.343 40 HB2 ARG 6 HB2 ARG 6 26.150 31.737 30.377 41 HB3 ARG 6 HB3 ARG 6 27.486 32.408 29.430 42 HG2 ARG 6 HG2 ARG 6 25.947 33.956 28.280 43 HG3 ARG 6 HG3 ARG 6 24.563 33.283 29.142 44 HD2 ARG 6 HD2 ARG 6 25.301 35.419 30.106 45 HD3 ARG 6 HD3 ARG 6 25.416 34.090 31.274 46 HE ARG 6 HE ARG 6 27.916 34.144 30.125 47 HH11 ARG 6 HH11 ARG 6 26.112 36.802 31.578 48 HH12 ARG 6 HH12 ARG 6 27.536 37.368 32.424 49 HH21 ARG 6 HH21 ARG 6 29.666 35.155 30.924 50 HH22 ARG 6 HH22 ARG 6 29.474 36.662 31.831 51 H ARG 7 H ARG 7 26.303 29.000 29.757 52 HA ARG 7 HA ARG 7 28.953 28.129 29.093 53 HB2 ARG 7 HB2 ARG 7 27.654 27.193 31.014 54 HB3 ARG 7 HB3 ARG 7 26.515 26.469 29.881 55 HG2 ARG 7 HG2 ARG 7 27.999 24.752 30.606 56 HG3 ARG 7 HG3 ARG 7 28.396 25.060 28.923 57 HD2 ARG 7 HD2 ARG 7 29.906 26.514 31.095 58 HD3 ARG 7 HD3 ARG 7 30.239 24.788 30.812 59 HE ARG 7 HE ARG 7 30.429 25.943 28.294 60 HH11 ARG 7 HH11 ARG 7 32.082 26.351 31.365 61 HH12 ARG 7 HH12 ARG 7 33.602 26.747 30.596 62 HH21 ARG 7 HH21 ARG 7 32.406 26.118 27.411 63 HH22 ARG 7 HH22 ARG 7 33.792 26.603 28.384 64 H CYS 8 H CYS 8 25.814 27.254 27.748 65 HA CYS 8 HA CYS 8 26.626 25.408 25.764 66 HB2 CYS 8 HB2 CYS 8 24.348 25.761 26.492 67 HB3 CYS 8 HB3 CYS 8 24.368 27.412 25.945 68 H GLU 9 H GLU 9 26.097 28.965 25.353 69 HA GLU 9 HA GLU 9 26.947 29.119 22.635 70 HB2 GLU 9 HB2 GLU 9 26.776 31.083 24.953 71 HB3 GLU 9 HB3 GLU 9 27.469 31.606 23.421 72 HG2 GLU 9 HG2 GLU 9 24.762 30.283 23.352 73 HG3 GLU 9 HG3 GLU 9 24.884 31.909 23.971 74 H LEU 10 H LEU 10 28.846 29.646 25.670 75 HA LEU 10 HA LEU 10 31.274 30.300 24.264 76 HB2 LEU 10 HB2 LEU 10 30.504 29.673 27.119 77 HB3 LEU 10 HB3 LEU 10 32.184 29.618 26.699 78 HG LEU 10 HG LEU 10 31.412 31.788 27.663 79 HD11 LEU 10 HD11 LEU 10 32.664 31.940 24.889 80 HD12 LEU 10 HD12 LEU 10 32.736 33.186 26.151 81 HD13 LEU 10 HD13 LEU 10 33.510 31.625 26.421 82 HD21 LEU 10 HD21 LEU 10 30.141 32.290 24.936 83 HD22 LEU 10 HD22 LEU 10 29.265 32.094 26.473 84 HD23 LEU 10 HD23 LEU 10 30.354 33.463 26.246 85 H SER 11 H SER 11 30.104 27.099 25.544 86 HA SER 11 HA SER 11 32.514 25.715 24.775 87 HB2 SER 11 HB2 SER 11 29.659 24.722 25.068 88 HB3 SER 11 HB3 SER 11 31.083 23.684 24.833 89 HG SER 11 HG SER 11 30.665 23.871 27.023 90 H CYS 12 H CYS 12 29.741 26.768 22.806 91 HA CYS 12 HA CYS 12 30.686 25.154 20.503 92 HB2 CYS 12 HB2 CYS 12 28.350 27.073 20.593 93 HB3 CYS 12 HB3 CYS 12 28.717 25.925 19.399 94 H ARG 13 H ARG 13 30.931 28.458 21.632 95 HA ARG 13 HA ARG 13 31.650 29.785 19.230 96 HB2 ARG 13 HB2 ARG 13 31.222 30.733 21.582 97 HB3 ARG 13 HB3 ARG 13 32.865 30.271 22.001 98 HG2 ARG 13 HG2 ARG 13 33.762 31.817 20.370 99 HG3 ARG 13 HG3 ARG 13 32.175 32.113 19.651 100 HD2 ARG 13 HD2 ARG 13 32.820 32.777 22.565 101 HD3 ARG 13 HD3 ARG 13 33.072 33.911 21.228 102 HE ARG 13 HE ARG 13 30.451 33.143 20.886 103 HH11 ARG 13 HH11 ARG 13 32.098 34.733 23.614 104 HH12 ARG 13 HH12 ARG 13 30.650 35.648 23.960 105 HH21 ARG 13 HH21 ARG 13 28.844 34.481 21.341 106 HH22 ARG 13 HH22 ARG 13 28.869 35.460 22.796 107 H SER 14 H SER 14 33.551 27.629 21.285 108 HA SER 14 HA SER 14 36.075 27.867 19.961 109 HB2 SER 14 HB2 SER 14 34.864 25.375 21.208 110 HB3 SER 14 HB3 SER 14 36.582 25.730 20.982 111 HG SER 14 HG SER 14 35.573 26.112 23.127 112 H LEU 15 H LEU 15 33.112 26.377 18.874 113 HA LEU 15 HA LEU 15 34.460 24.713 16.794 114 HB2 LEU 15 HB2 LEU 15 31.620 24.534 17.856 115 HB3 LEU 15 HB3 LEU 15 32.441 23.377 16.812 116 HG LEU 15 HG LEU 15 33.066 23.961 19.731 117 HD11 LEU 15 HD11 LEU 15 32.217 21.640 20.045 118 HD12 LEU 15 HD12 LEU 15 30.980 22.701 19.363 119 HD13 LEU 15 HD13 LEU 15 31.838 21.549 18.316 120 HD21 LEU 15 HD21 LEU 15 34.585 21.995 19.578 121 HD22 LEU 15 HD22 LEU 15 34.312 21.928 17.825 122 HD23 LEU 15 HD23 LEU 15 35.142 23.321 18.555 123 H GLY 16 H GLY 16 33.084 27.697 16.977 124 HA2 GLY 16 HA2 GLY 16 32.381 29.163 15.320 125 HA3 GLY 16 HA3 GLY 16 32.623 27.890 14.119 126 H LEU 17 H LEU 17 30.427 27.590 16.917 127 HA LEU 17 HA LEU 17 28.079 27.696 15.059 128 HB2 LEU 17 HB2 LEU 17 27.945 26.083 17.568 129 HB3 LEU 17 HB3 LEU 17 27.008 25.927 16.119 130 HG LEU 17 HG LEU 17 29.844 25.083 16.563 131 HD11 LEU 17 HD11 LEU 17 28.410 23.596 17.721 132 HD12 LEU 17 HD12 LEU 17 27.295 23.464 16.336 133 HD13 LEU 17 HD13 LEU 17 28.924 22.763 16.264 134 HD21 LEU 17 HD21 LEU 17 29.480 25.611 14.126 135 HD22 LEU 17 HD22 LEU 17 29.517 23.863 14.316 136 HD23 LEU 17 HD23 LEU 17 27.965 24.686 14.150 137 H LEU 18 H LEU 18 26.254 28.718 15.767 138 HA LEU 18 HA LEU 18 26.449 30.419 18.196 139 HB2 LEU 18 HB2 LEU 18 24.692 31.695 17.288 140 HB3 LEU 18 HB3 LEU 18 25.823 31.383 15.993 141 HG LEU 18 HG LEU 18 24.060 29.326 15.572 142 HD11 LEU 18 HD11 LEU 18 22.433 31.713 16.538 143 HD12 LEU 18 HD12 LEU 18 21.788 30.231 15.797 144 HD13 LEU 18 HD13 LEU 18 22.560 30.160 17.387 145 HD21 LEU 18 HD21 LEU 18 23.884 32.165 14.513 146 HD22 LEU 18 HD22 LEU 18 24.799 30.799 13.823 147 HD23 LEU 18 HD23 LEU 18 23.036 30.761 13.823 148 H GLY 19 H GLY 19 25.391 29.907 20.053 149 HA2 GLY 19 HA2 GLY 19 23.804 27.453 20.224 150 HA3 GLY 19 HA3 GLY 19 24.240 28.481 21.547 151 H ALA 20 H ALA 20 21.771 27.206 21.170 152 HA ALA 20 HA ALA 20 19.883 29.451 21.378 153 HB1 ALA 20 HB1 ALA 20 19.788 28.813 18.986 154 HB2 ALA 20 HB2 ALA 20 19.492 27.119 19.438 155 HB3 ALA 20 HB3 ALA 20 18.291 28.376 19.824 156 H CYS 21 H CYS 21 18.517 29.122 23.002 157 HA CYS 21 HA CYS 21 18.705 26.628 24.601 158 HB2 CYS 21 HB2 CYS 21 19.150 28.676 25.739 159 HB3 CYS 21 HB3 CYS 21 17.708 29.429 25.115 160 H ILE 22 H ILE 22 17.137 25.090 24.616 161 HA ILE 22 HA ILE 22 14.476 25.584 23.520 162 HB ILE 22 HB ILE 22 15.808 23.755 22.644 163 HG12 ILE 22 HG12 ILE 22 13.608 22.485 24.245 164 HG13 ILE 22 HG13 ILE 22 13.269 23.722 23.025 165 HG21 ILE 22 HG21 ILE 22 17.232 23.075 24.457 166 HG22 ILE 22 HG22 ILE 22 15.839 22.637 25.483 167 HG23 ILE 22 HG23 ILE 22 16.234 21.697 24.042 168 HD11 ILE 22 HD11 ILE 22 14.394 22.332 21.300 169 HD12 ILE 22 HD12 ILE 22 14.656 21.056 22.511 170 HD13 ILE 22 HD13 ILE 22 13.008 21.502 22.039 171 H GLY 23 H GLY 23 15.040 26.971 25.838 172 HA2 GLY 23 HA2 GLY 23 14.031 27.551 27.803 173 HA3 GLY 23 HA3 GLY 23 12.926 26.188 27.626 174 H GLU 24 H GLU 24 14.036 23.974 28.058 175 HA GLU 24 HA GLU 24 15.157 24.019 30.760 176 HB2 GLU 24 HB2 GLU 24 14.847 21.650 30.730 177 HB3 GLU 24 HB3 GLU 24 13.408 22.413 30.065 178 HG2 GLU 24 HG2 GLU 24 14.144 21.837 27.772 179 HG3 GLU 24 HG3 GLU 24 15.638 21.167 28.420 180 H GLU 25 H GLU 25 16.424 23.536 27.527 181 HA GLU 25 HA GLU 25 19.160 22.942 28.547 182 HB2 GLU 25 HB2 GLU 25 17.330 21.165 26.992 183 HB3 GLU 25 HB3 GLU 25 18.930 21.271 26.348 184 HG2 GLU 25 HG2 GLU 25 18.383 20.643 29.276 185 HG3 GLU 25 HG3 GLU 25 18.554 19.414 28.011 186 H CYS 26 H CYS 26 20.666 22.773 26.445 187 HA CYS 26 HA CYS 26 19.866 24.664 24.336 188 HB2 CYS 26 HB2 CYS 26 20.596 26.159 26.064 189 HB3 CYS 26 HB3 CYS 26 22.100 25.296 26.283 190 H LYS 27 H LYS 27 20.925 24.578 22.516 191 HA LYS 27 HA LYS 27 23.121 22.622 21.960 192 HB2 LYS 27 HB2 LYS 27 20.453 22.889 20.504 193 HB3 LYS 27 HB3 LYS 27 21.808 21.947 19.912 194 HG2 LYS 27 HG2 LYS 27 20.583 21.304 22.605 195 HG3 LYS 27 HG3 LYS 27 19.793 20.801 21.126 196 HD2 LYS 27 HD2 LYS 27 22.671 20.078 21.752 197 HD3 LYS 27 HD3 LYS 27 21.265 19.094 22.206 198 HE2 LYS 27 HE2 LYS 27 20.583 19.041 19.779 199 HE3 LYS 27 HE3 LYS 27 22.128 19.814 19.377 200 HZ1 LYS 27 HZ1 LYS 27 21.874 17.205 20.793 201 HZ2 LYS 27 HZ2 LYS 27 22.189 17.353 19.204 202 HZ3 LYS 27 HZ3 LYS 27 23.280 17.886 20.302 203 H CYS 28 H CYS 28 23.884 23.062 19.585 204 HA CYS 28 HA CYS 28 23.593 25.927 18.806 205 HB2 CYS 28 HB2 CYS 28 26.070 26.101 18.692 206 HB3 CYS 28 HB3 CYS 28 25.391 25.997 20.304 207 H VAL 29 H VAL 29 24.481 26.506 16.713 208 HA VAL 29 HA VAL 29 24.516 24.362 14.677 209 HB VAL 29 HB VAL 29 22.794 25.480 13.353 210 HG11 VAL 29 HG11 VAL 29 22.175 23.620 14.887 211 HG12 VAL 29 HG12 VAL 29 21.707 24.827 16.122 212 HG13 VAL 29 HG13 VAL 29 20.854 24.751 14.565 213 HG21 VAL 29 HG21 VAL 29 22.944 27.782 14.162 214 HG22 VAL 29 HG22 VAL 29 21.304 27.176 14.376 215 HG23 VAL 29 HG23 VAL 29 22.388 27.292 15.778 216 HA PRO 30 HA PRO 30 27.484 26.901 12.636 217 HB2 PRO 30 HB2 PRO 30 26.259 26.181 9.987 218 HB3 PRO 30 HB3 PRO 30 27.955 26.010 10.530 219 HG2 PRO 30 HG2 PRO 30 26.331 23.848 10.404 220 HG3 PRO 30 HG3 PRO 30 27.432 24.063 11.805 221 HD2 PRO 30 HD2 PRO 30 24.478 24.737 11.615 222 HD3 PRO 30 HD3 PRO 30 25.360 23.836 12.891 223 H TYR 31 H TYR 31 27.917 28.905 11.691 224 HA TYR 31 HA TYR 31 25.860 30.898 11.569 225 HB2 TYR 31 HB2 TYR 31 28.604 31.148 10.319 226 HB3 TYR 31 HB3 TYR 31 27.587 32.414 10.945 227 HD1 TYR 31 HD1 TYR 31 30.597 31.193 11.473 228 HD2 TYR 31 HD2 TYR 31 26.925 31.577 13.692 229 HE1 TYR 31 HE1 TYR 31 31.884 31.247 13.594 230 HE2 TYR 31 HE2 TYR 31 28.197 31.590 15.823 231 HH TYR 31 HH TYR 31 30.338 31.412 16.799 Start of MODEL 9 1 H1 ALA 1 H1 ALA 1 20.015 17.873 31.115 2 H2 ALA 1 H2 ALA 1 21.571 18.050 31.590 3 H3 ALA 1 H3 ALA 1 20.864 19.210 30.656 4 HA ALA 1 HA ALA 1 19.244 19.614 32.434 5 HB1 ALA 1 HB1 ALA 1 19.563 17.413 33.565 6 HB2 ALA 1 HB2 ALA 1 21.175 17.948 34.096 7 HB3 ALA 1 HB3 ALA 1 19.726 18.780 34.677 8 H PHE 2 H PHE 2 19.750 21.149 34.229 9 HA PHE 2 HA PHE 2 20.595 23.142 34.858 10 HB2 PHE 2 HB2 PHE 2 23.232 21.654 34.667 11 HB3 PHE 2 HB3 PHE 2 23.014 23.225 35.416 12 HD1 PHE 2 HD1 PHE 2 21.672 23.510 37.475 13 HD2 PHE 2 HD2 PHE 2 22.531 19.617 35.826 14 HE1 PHE 2 HE1 PHE 2 21.076 22.461 39.649 15 HE2 PHE 2 HE2 PHE 2 21.925 18.567 37.994 16 HZ PHE 2 HZ PHE 2 21.205 19.990 39.906 17 H CYS 3 H CYS 3 19.727 23.906 32.745 18 HA CYS 3 HA CYS 3 21.527 24.531 30.597 19 HB2 CYS 3 HB2 CYS 3 18.739 25.220 31.303 20 HB3 CYS 3 HB3 CYS 3 19.577 26.528 30.495 21 H ASN 4 H ASN 4 22.561 26.339 29.999 22 HA ASN 4 HA ASN 4 22.328 28.906 31.325 23 HB2 ASN 4 HB2 ASN 4 24.161 27.678 32.645 24 HB3 ASN 4 HB3 ASN 4 25.036 27.576 31.116 25 HD21 ASN 4 HD21 ASN 4 24.462 31.291 32.733 26 HD22 ASN 4 HD22 ASN 4 23.339 29.968 33.111 27 H LEU 5 H LEU 5 21.995 30.151 29.687 28 HA LEU 5 HA LEU 5 22.368 29.422 26.957 29 HB2 LEU 5 HB2 LEU 5 20.680 31.033 27.653 30 HB3 LEU 5 HB3 LEU 5 21.915 32.120 28.288 31 HG LEU 5 HG LEU 5 22.771 32.551 26.021 32 HD11 LEU 5 HD11 LEU 5 22.223 30.429 24.899 33 HD12 LEU 5 HD12 LEU 5 20.473 30.775 25.084 34 HD13 LEU 5 HD13 LEU 5 21.501 31.786 24.045 35 HD21 LEU 5 HD21 LEU 5 20.839 33.824 25.194 36 HD22 LEU 5 HD22 LEU 5 19.747 32.893 26.245 37 HD23 LEU 5 HD23 LEU 5 20.979 33.970 26.951 38 H ARG 6 H ARG 6 24.344 31.450 29.112 39 HA ARG 6 HA ARG 6 26.311 32.162 27.096 40 HB2 ARG 6 HB2 ARG 6 26.354 32.157 30.131 41 HB3 ARG 6 HB3 ARG 6 27.765 32.622 29.195 42 HG2 ARG 6 HG2 ARG 6 25.091 33.982 28.678 43 HG3 ARG 6 HG3 ARG 6 26.086 34.418 30.064 44 HD2 ARG 6 HD2 ARG 6 26.725 35.962 28.501 45 HD3 ARG 6 HD3 ARG 6 28.030 34.776 28.445 46 HE ARG 6 HE ARG 6 26.174 34.075 26.399 47 HH11 ARG 6 HH11 ARG 6 28.262 36.849 27.096 48 HH12 ARG 6 HH12 ARG 6 28.060 37.433 25.429 49 HH21 ARG 6 HH21 ARG 6 26.218 34.828 24.335 50 HH22 ARG 6 HH22 ARG 6 27.115 36.319 23.964 51 H ARG 7 H ARG 7 26.410 29.537 29.571 52 HA ARG 7 HA ARG 7 28.937 28.513 28.694 53 HB2 ARG 7 HB2 ARG 7 27.607 27.926 30.836 54 HB3 ARG 7 HB3 ARG 7 26.729 26.756 29.830 55 HG2 ARG 7 HG2 ARG 7 28.942 25.684 29.248 56 HG3 ARG 7 HG3 ARG 7 29.738 26.881 30.267 57 HD2 ARG 7 HD2 ARG 7 29.585 25.093 31.748 58 HD3 ARG 7 HD3 ARG 7 28.160 26.017 32.166 59 HE ARG 7 HE ARG 7 26.778 24.398 31.187 60 HH11 ARG 7 HH11 ARG 7 30.109 23.452 30.487 61 HH12 ARG 7 HH12 ARG 7 29.603 21.838 30.015 62 HH21 ARG 7 HH21 ARG 7 26.316 22.246 30.971 63 HH22 ARG 7 HH22 ARG 7 27.485 21.195 30.230 64 H CYS 8 H CYS 8 25.648 27.752 27.563 65 HA CYS 8 HA CYS 8 26.391 25.722 25.705 66 HB2 CYS 8 HB2 CYS 8 24.112 26.144 26.519 67 HB3 CYS 8 HB3 CYS 8 24.084 27.699 25.682 68 H GLU 9 H GLU 9 26.081 29.297 25.213 69 HA GLU 9 HA GLU 9 26.919 29.224 22.450 70 HB2 GLU 9 HB2 GLU 9 26.985 31.384 24.614 71 HB3 GLU 9 HB3 GLU 9 27.561 31.677 22.973 72 HG2 GLU 9 HG2 GLU 9 25.399 31.122 22.034 73 HG3 GLU 9 HG3 GLU 9 24.746 30.741 23.638 74 H LEU 10 H LEU 10 28.795 29.841 25.453 75 HA LEU 10 HA LEU 10 31.284 30.332 24.146 76 HB2 LEU 10 HB2 LEU 10 30.357 29.761 26.968 77 HB3 LEU 10 HB3 LEU 10 32.058 29.783 26.632 78 HG LEU 10 HG LEU 10 30.973 31.925 27.521 79 HD11 LEU 10 HD11 LEU 10 32.774 32.012 25.081 80 HD12 LEU 10 HD12 LEU 10 32.569 33.317 26.278 81 HD13 LEU 10 HD13 LEU 10 33.259 31.770 26.775 82 HD21 LEU 10 HD21 LEU 10 30.220 33.578 25.906 83 HD22 LEU 10 HD22 LEU 10 30.286 32.392 24.590 84 HD23 LEU 10 HD23 LEU 10 29.112 32.214 25.908 85 H SER 11 H SER 11 29.908 27.272 25.378 86 HA SER 11 HA SER 11 32.308 25.726 24.921 87 HB2 SER 11 HB2 SER 11 30.466 25.037 26.447 88 HB3 SER 11 HB3 SER 11 29.402 24.801 25.058 89 HG SER 11 HG SER 11 30.563 23.057 24.442 90 H CYS 12 H CYS 12 29.712 26.792 22.765 91 HA CYS 12 HA CYS 12 30.688 25.029 20.574 92 HB2 CYS 12 HB2 CYS 12 28.278 26.862 20.594 93 HB3 CYS 12 HB3 CYS 12 28.759 25.762 19.370 94 H ARG 13 H ARG 13 30.985 28.306 21.628 95 HA ARG 13 HA ARG 13 31.688 29.672 19.245 96 HB2 ARG 13 HB2 ARG 13 31.454 30.736 21.440 97 HB3 ARG 13 HB3 ARG 13 32.869 29.872 22.056 98 HG2 ARG 13 HG2 ARG 13 34.346 31.055 20.518 99 HG3 ARG 13 HG3 ARG 13 32.977 31.847 19.735 100 HD2 ARG 13 HD2 ARG 13 33.783 32.190 22.647 101 HD3 ARG 13 HD3 ARG 13 34.192 33.309 21.337 102 HE ARG 13 HE ARG 13 31.403 33.101 21.231 103 HH11 ARG 13 HH11 ARG 13 33.661 34.176 23.753 104 HH12 ARG 13 HH12 ARG 13 32.420 35.273 24.373 105 HH21 ARG 13 HH21 ARG 13 30.004 34.425 22.196 106 HH22 ARG 13 HH22 ARG 13 30.525 35.412 23.585 107 H SER 14 H SER 14 33.594 27.387 21.196 108 HA SER 14 HA SER 14 36.012 27.511 19.672 109 HB2 SER 14 HB2 SER 14 34.798 25.217 21.268 110 HB3 SER 14 HB3 SER 14 36.475 25.276 20.682 111 HG SER 14 HG SER 14 36.057 26.068 22.929 112 H LEU 15 H LEU 15 32.999 25.746 19.123 113 HA LEU 15 HA LEU 15 34.036 24.241 16.811 114 HB2 LEU 15 HB2 LEU 15 31.221 24.442 17.937 115 HB3 LEU 15 HB3 LEU 15 31.805 23.263 16.769 116 HG LEU 15 HG LEU 15 32.644 23.507 19.688 117 HD11 LEU 15 HD11 LEU 15 30.991 21.400 18.243 118 HD12 LEU 15 HD12 LEU 15 31.428 21.386 19.960 119 HD13 LEU 15 HD13 LEU 15 30.347 22.644 19.340 120 HD21 LEU 15 HD21 LEU 15 34.517 22.612 18.379 121 HD22 LEU 15 HD22 LEU 15 33.779 21.315 19.320 122 HD23 LEU 15 HD23 LEU 15 33.439 21.445 17.579 123 H GLY 16 H GLY 16 33.005 27.408 17.229 124 HA2 GLY 16 HA2 GLY 16 32.555 29.070 15.681 125 HA3 GLY 16 HA3 GLY 16 32.750 27.898 14.373 126 H LEU 17 H LEU 17 30.435 27.814 17.100 127 HA LEU 17 HA LEU 17 28.138 28.103 15.215 128 HB2 LEU 17 HB2 LEU 17 27.945 26.278 17.570 129 HB3 LEU 17 HB3 LEU 17 27.025 26.234 16.102 130 HG LEU 17 HG LEU 17 29.871 25.360 16.459 131 HD11 LEU 17 HD11 LEU 17 28.952 23.068 16.164 132 HD12 LEU 17 HD12 LEU 17 28.523 23.865 17.666 133 HD13 LEU 17 HD13 LEU 17 27.319 23.746 16.348 134 HD21 LEU 17 HD21 LEU 17 29.335 25.919 14.041 135 HD22 LEU 17 HD22 LEU 17 29.620 24.204 14.262 136 HD23 LEU 17 HD23 LEU 17 27.954 24.806 14.124 137 H LEU 18 H LEU 18 26.298 29.073 16.031 138 HA LEU 18 HA LEU 18 26.440 30.695 18.514 139 HB2 LEU 18 HB2 LEU 18 24.210 30.167 16.495 140 HB3 LEU 18 HB3 LEU 18 24.078 31.280 17.856 141 HG LEU 18 HG LEU 18 26.137 31.591 15.646 142 HD11 LEU 18 HD11 LEU 18 23.914 31.666 14.670 143 HD12 LEU 18 HD12 LEU 18 23.399 32.852 15.884 144 HD13 LEU 18 HD13 LEU 18 24.651 33.274 14.687 145 HD21 LEU 18 HD21 LEU 18 26.677 32.819 17.731 146 HD22 LEU 18 HD22 LEU 18 26.233 33.926 16.423 147 HD23 LEU 18 HD23 LEU 18 25.063 33.561 17.706 148 H GLY 19 H GLY 19 25.750 29.871 20.466 149 HA2 GLY 19 HA2 GLY 19 24.075 27.402 20.462 150 HA3 GLY 19 HA3 GLY 19 24.998 27.977 21.815 151 H ALA 20 H ALA 20 22.277 27.113 21.558 152 HA ALA 20 HA ALA 20 21.070 29.250 23.196 153 HB1 ALA 20 HB1 ALA 20 19.560 27.706 21.051 154 HB2 ALA 20 HB2 ALA 20 18.850 28.825 22.231 155 HB3 ALA 20 HB3 ALA 20 19.971 29.439 21.003 156 H CYS 21 H CYS 21 20.360 28.445 25.090 157 HA CYS 21 HA CYS 21 20.164 25.482 25.413 158 HB2 CYS 21 HB2 CYS 21 21.790 26.926 26.816 159 HB3 CYS 21 HB3 CYS 21 20.349 27.358 27.755 160 H ILE 22 H ILE 22 18.287 24.557 25.884 161 HA ILE 22 HA ILE 22 15.840 26.278 26.099 162 HB ILE 22 HB ILE 22 16.182 23.658 24.604 163 HG12 ILE 22 HG12 ILE 22 17.429 25.366 23.399 164 HG13 ILE 22 HG13 ILE 22 15.984 24.896 22.529 165 HG21 ILE 22 HG21 ILE 22 13.940 24.233 23.657 166 HG22 ILE 22 HG22 ILE 22 13.890 23.942 25.394 167 HG23 ILE 22 HG23 ILE 22 13.830 25.603 24.782 168 HD11 ILE 22 HD11 ILE 22 14.844 26.979 23.166 169 HD12 ILE 22 HD12 ILE 22 16.242 27.468 24.149 170 HD13 ILE 22 HD13 ILE 22 16.406 27.321 22.397 171 H GLY 23 H GLY 23 15.686 26.180 28.286 172 HA2 GLY 23 HA2 GLY 23 14.795 25.452 30.259 173 HA3 GLY 23 HA3 GLY 23 14.250 23.993 29.439 174 H GLU 24 H GLU 24 16.323 22.565 28.850 175 HA GLU 24 HA GLU 24 18.142 22.278 31.205 176 HB2 GLU 24 HB2 GLU 24 17.522 19.959 31.493 177 HB3 GLU 24 HB3 GLU 24 16.080 20.965 31.628 178 HG2 GLU 24 HG2 GLU 24 15.577 20.405 29.188 179 HG3 GLU 24 HG3 GLU 24 16.931 19.273 29.231 180 H GLU 25 H GLU 25 17.734 22.038 27.786 181 HA GLU 25 HA GLU 25 20.204 20.395 27.467 182 HB2 GLU 25 HB2 GLU 25 18.315 19.107 26.756 183 HB3 GLU 25 HB3 GLU 25 17.613 20.481 25.912 184 HG2 GLU 25 HG2 GLU 25 18.396 18.997 24.269 185 HG3 GLU 25 HG3 GLU 25 19.451 20.391 24.217 186 H CYS 26 H CYS 26 21.778 21.141 26.098 187 HA CYS 26 HA CYS 26 21.456 23.867 24.929 188 HB2 CYS 26 HB2 CYS 26 23.303 23.749 26.376 189 HB3 CYS 26 HB3 CYS 26 23.822 22.191 25.728 190 H LYS 27 H LYS 27 21.534 24.290 22.818 191 HA LYS 27 HA LYS 27 22.530 22.272 20.878 192 HB2 LYS 27 HB2 LYS 27 20.651 22.710 19.366 193 HB3 LYS 27 HB3 LYS 27 20.134 21.945 20.870 194 HG2 LYS 27 HG2 LYS 27 19.376 24.139 21.757 195 HG3 LYS 27 HG3 LYS 27 19.852 24.931 20.246 196 HD2 LYS 27 HD2 LYS 27 17.806 22.702 20.458 197 HD3 LYS 27 HD3 LYS 27 17.429 24.422 20.486 198 HE2 LYS 27 HE2 LYS 27 18.251 24.766 18.247 199 HE3 LYS 27 HE3 LYS 27 18.951 23.134 18.181 200 HZ1 LYS 27 HZ1 LYS 27 16.040 23.627 18.435 201 HZ2 LYS 27 HZ2 LYS 27 16.814 23.338 17.001 202 HZ3 LYS 27 HZ3 LYS 27 16.798 22.190 18.194 203 H CYS 28 H CYS 28 23.767 23.112 19.273 204 HA CYS 28 HA CYS 28 23.653 26.048 18.833 205 HB2 CYS 28 HB2 CYS 28 26.136 26.082 18.715 206 HB3 CYS 28 HB3 CYS 28 25.443 25.860 20.305 207 H VAL 29 H VAL 29 24.518 26.842 16.828 208 HA VAL 29 HA VAL 29 24.264 24.962 14.551 209 HB VAL 29 HB VAL 29 22.647 26.399 13.447 210 HG11 VAL 29 HG11 VAL 29 21.624 25.564 16.189 211 HG12 VAL 29 HG12 VAL 29 20.688 25.755 14.700 212 HG13 VAL 29 HG13 VAL 29 21.885 24.458 14.816 213 HG21 VAL 29 HG21 VAL 29 23.090 28.569 14.522 214 HG22 VAL 29 HG22 VAL 29 21.389 28.115 14.690 215 HG23 VAL 29 HG23 VAL 29 22.488 27.937 16.070 216 HA PRO 30 HA PRO 30 27.685 26.969 12.964 217 HB2 PRO 30 HB2 PRO 30 26.511 26.894 10.197 218 HB3 PRO 30 HB3 PRO 30 28.117 26.328 10.760 219 HG2 PRO 30 HG2 PRO 30 26.124 24.549 10.324 220 HG3 PRO 30 HG3 PRO 30 27.156 24.400 11.790 221 HD2 PRO 30 HD2 PRO 30 24.391 25.621 11.554 222 HD3 PRO 30 HD3 PRO 30 25.032 24.473 12.765 223 H TYR 31 H TYR 31 28.622 28.864 12.713 224 HA TYR 31 HA TYR 31 27.413 31.389 12.771 225 HB2 TYR 31 HB2 TYR 31 30.164 30.378 11.970 226 HB3 TYR 31 HB3 TYR 31 29.789 32.079 11.985 227 HD1 TYR 31 HD1 TYR 31 28.001 31.013 14.774 228 HD2 TYR 31 HD2 TYR 31 32.035 31.511 13.367 229 HE1 TYR 31 HE1 TYR 31 28.770 31.426 17.112 230 HE2 TYR 31 HE2 TYR 31 32.805 31.887 15.707 231 HH TYR 31 HH TYR 31 31.962 32.574 17.828 Start of MODEL 10 1 H1 ALA 1 H1 ALA 1 13.962 22.043 35.014 2 H2 ALA 1 H2 ALA 1 14.170 20.406 34.833 3 H3 ALA 1 H3 ALA 1 14.268 21.404 33.526 4 HA ALA 1 HA ALA 1 16.115 21.359 35.802 5 HB1 ALA 1 HB1 ALA 1 16.430 19.411 34.328 6 HB2 ALA 1 HB2 ALA 1 16.544 20.486 32.909 7 HB3 ALA 1 HB3 ALA 1 17.791 20.537 34.174 8 H PHE 2 H PHE 2 17.954 22.772 35.633 9 HA PHE 2 HA PHE 2 17.362 25.408 34.494 10 HB2 PHE 2 HB2 PHE 2 19.781 24.265 35.941 11 HB3 PHE 2 HB3 PHE 2 19.606 25.950 35.474 12 HD1 PHE 2 HD1 PHE 2 17.474 27.223 36.309 13 HD2 PHE 2 HD2 PHE 2 19.149 23.696 38.150 14 HE1 PHE 2 HE1 PHE 2 16.490 27.882 38.485 15 HE2 PHE 2 HE2 PHE 2 18.170 24.382 40.324 16 HZ PHE 2 HZ PHE 2 16.851 26.474 40.500 17 H CYS 3 H CYS 3 19.143 26.589 33.364 18 HA CYS 3 HA CYS 3 21.028 25.023 31.765 19 HB2 CYS 3 HB2 CYS 3 18.929 25.094 30.410 20 HB3 CYS 3 HB3 CYS 3 18.998 26.852 30.410 21 H ASN 4 H ASN 4 22.799 26.259 31.025 22 HA ASN 4 HA ASN 4 22.858 29.156 31.778 23 HB2 ASN 4 HB2 ASN 4 24.537 27.570 33.032 24 HB3 ASN 4 HB3 ASN 4 25.318 27.468 31.469 25 HD21 ASN 4 HD21 ASN 4 25.334 31.109 33.334 26 HD22 ASN 4 HD22 ASN 4 23.982 30.002 33.632 27 H LEU 5 H LEU 5 22.129 29.929 29.972 28 HA LEU 5 HA LEU 5 22.634 29.128 27.283 29 HB2 LEU 5 HB2 LEU 5 20.770 30.584 27.977 30 HB3 LEU 5 HB3 LEU 5 21.911 31.840 28.473 31 HG LEU 5 HG LEU 5 22.641 32.115 26.118 32 HD11 LEU 5 HD11 LEU 5 20.427 30.102 25.554 33 HD12 LEU 5 HD12 LEU 5 21.212 31.116 24.331 34 HD13 LEU 5 HD13 LEU 5 22.163 29.900 25.189 35 HD21 LEU 5 HD21 LEU 5 20.586 33.214 25.339 36 HD22 LEU 5 HD22 LEU 5 19.627 32.307 26.529 37 HD23 LEU 5 HD23 LEU 5 20.824 33.501 27.070 38 H ARG 6 H ARG 6 24.394 31.418 29.411 39 HA ARG 6 HA ARG 6 26.351 32.249 27.460 40 HB2 ARG 6 HB2 ARG 6 26.567 32.002 30.497 41 HB3 ARG 6 HB3 ARG 6 27.750 32.808 29.476 42 HG2 ARG 6 HG2 ARG 6 24.849 33.688 29.839 43 HG3 ARG 6 HG3 ARG 6 26.264 34.381 30.614 44 HD2 ARG 6 HD2 ARG 6 25.945 35.882 28.902 45 HD3 ARG 6 HD3 ARG 6 27.147 34.814 28.203 46 HE ARG 6 HE ARG 6 25.538 33.969 26.664 47 HH11 ARG 6 HH11 ARG 6 23.846 36.221 28.866 48 HH12 ARG 6 HH12 ARG 6 22.531 36.335 27.689 49 HH21 ARG 6 HH21 ARG 6 23.826 34.289 25.353 50 HH22 ARG 6 HH22 ARG 6 22.507 35.338 25.903 51 H ARG 7 H ARG 7 26.614 29.512 29.829 52 HA ARG 7 HA ARG 7 29.124 28.661 28.718 53 HB2 ARG 7 HB2 ARG 7 28.127 27.909 30.980 54 HB3 ARG 7 HB3 ARG 7 27.104 26.818 30.058 55 HG2 ARG 7 HG2 ARG 7 29.132 25.711 30.962 56 HG3 ARG 7 HG3 ARG 7 29.018 25.581 29.215 57 HD2 ARG 7 HD2 ARG 7 31.337 26.038 30.081 58 HD3 ARG 7 HD3 ARG 7 30.767 27.194 28.873 59 HE ARG 7 HE ARG 7 30.425 27.815 31.766 60 HH11 ARG 7 HH11 ARG 7 32.644 28.443 29.129 61 HH12 ARG 7 HH12 ARG 7 32.837 30.133 29.604 62 HH21 ARG 7 HH21 ARG 7 30.537 30.019 32.127 63 HH22 ARG 7 HH22 ARG 7 31.670 30.985 31.232 64 H CYS 8 H CYS 8 25.796 27.739 27.914 65 HA CYS 8 HA CYS 8 26.369 25.715 26.010 66 HB2 CYS 8 HB2 CYS 8 24.145 26.259 27.004 67 HB3 CYS 8 HB3 CYS 8 24.120 27.774 26.096 68 H GLU 9 H GLU 9 26.115 29.272 25.492 69 HA GLU 9 HA GLU 9 26.685 29.187 22.675 70 HB2 GLU 9 HB2 GLU 9 27.026 31.296 24.836 71 HB3 GLU 9 HB3 GLU 9 27.390 31.635 23.154 72 HG2 GLU 9 HG2 GLU 9 25.155 31.364 22.471 73 HG3 GLU 9 HG3 GLU 9 24.659 30.604 23.958 74 H LEU 10 H LEU 10 28.855 29.880 25.476 75 HA LEU 10 HA LEU 10 31.171 30.263 23.847 76 HB2 LEU 10 HB2 LEU 10 30.624 29.949 26.795 77 HB3 LEU 10 HB3 LEU 10 32.270 29.728 26.256 78 HG LEU 10 HG LEU 10 31.830 32.001 27.061 79 HD11 LEU 10 HD11 LEU 10 32.525 31.961 24.094 80 HD12 LEU 10 HD12 LEU 10 32.979 33.189 25.292 81 HD13 LEU 10 HD13 LEU 10 33.635 31.554 25.424 82 HD21 LEU 10 HD21 LEU 10 29.522 32.351 26.277 83 HD22 LEU 10 HD22 LEU 10 30.604 33.633 25.726 84 HD23 LEU 10 HD23 LEU 10 30.082 32.371 24.590 85 H SER 11 H SER 11 29.953 27.332 25.487 86 HA SER 11 HA SER 11 32.265 25.734 24.932 87 HB2 SER 11 HB2 SER 11 30.379 25.278 26.605 88 HB3 SER 11 HB3 SER 11 29.445 24.660 25.233 89 HG SER 11 HG SER 11 30.521 22.859 25.768 90 H CYS 12 H CYS 12 29.639 26.729 22.807 91 HA CYS 12 HA CYS 12 30.596 24.810 20.713 92 HB2 CYS 12 HB2 CYS 12 28.218 26.682 20.618 93 HB3 CYS 12 HB3 CYS 12 28.692 25.479 19.461 94 H ARG 13 H ARG 13 30.809 28.189 21.569 95 HA ARG 13 HA ARG 13 31.369 29.314 19.017 96 HB2 ARG 13 HB2 ARG 13 30.895 30.533 21.148 97 HB3 ARG 13 HB3 ARG 13 32.532 30.160 21.710 98 HG2 ARG 13 HG2 ARG 13 33.507 31.444 19.883 99 HG3 ARG 13 HG3 ARG 13 31.940 31.661 19.110 100 HD2 ARG 13 HD2 ARG 13 32.705 32.753 21.847 101 HD3 ARG 13 HD3 ARG 13 32.731 33.683 20.341 102 HE ARG 13 HE ARG 13 30.157 32.757 20.373 103 HH11 ARG 13 HH11 ARG 13 32.005 34.613 22.751 104 HH12 ARG 13 HH12 ARG 13 30.543 35.282 23.443 105 HH21 ARG 13 HH21 ARG 13 28.353 33.720 21.305 106 HH22 ARG 13 HH22 ARG 13 28.557 34.735 22.712 107 H SER 14 H SER 14 33.423 27.324 21.086 108 HA SER 14 HA SER 14 35.895 27.830 19.660 109 HB2 SER 14 HB2 SER 14 36.642 25.726 20.761 110 HB3 SER 14 HB3 SER 14 35.965 26.901 21.872 111 HG SER 14 HG SER 14 34.816 25.289 22.481 112 H LEU 15 H LEU 15 33.096 25.954 18.832 113 HA LEU 15 HA LEU 15 34.515 24.458 16.691 114 HB2 LEU 15 HB2 LEU 15 31.588 24.431 17.512 115 HB3 LEU 15 HB3 LEU 15 32.365 23.330 16.379 116 HG LEU 15 HG LEU 15 32.914 23.493 19.382 117 HD11 LEU 15 HD11 LEU 15 30.699 22.570 18.811 118 HD12 LEU 15 HD12 LEU 15 31.466 21.406 17.707 119 HD13 LEU 15 HD13 LEU 15 31.777 21.321 19.454 120 HD21 LEU 15 HD21 LEU 15 33.962 21.572 17.261 121 HD22 LEU 15 HD22 LEU 15 34.929 22.749 18.190 122 HD23 LEU 15 HD23 LEU 15 34.175 21.380 19.013 123 H GLY 16 H GLY 16 32.919 27.450 17.098 124 HA2 GLY 16 HA2 GLY 16 32.691 29.130 15.487 125 HA3 GLY 16 HA3 GLY 16 32.714 27.931 14.204 126 H LEU 17 H LEU 17 30.505 27.570 16.940 127 HA LEU 17 HA LEU 17 28.198 27.945 15.073 128 HB2 LEU 17 HB2 LEU 17 28.152 26.451 17.688 129 HB3 LEU 17 HB3 LEU 17 26.997 26.359 16.379 130 HG LEU 17 HG LEU 17 29.775 25.230 16.501 131 HD11 LEU 17 HD11 LEU 17 28.192 23.877 17.660 132 HD12 LEU 17 HD12 LEU 17 27.066 23.889 16.281 133 HD13 LEU 17 HD13 LEU 17 28.626 23.054 16.172 134 HD21 LEU 17 HD21 LEU 17 29.385 24.229 14.255 135 HD22 LEU 17 HD22 LEU 17 27.819 25.055 14.146 136 HD23 LEU 17 HD23 LEU 17 29.333 25.984 14.131 137 H LEU 18 H LEU 18 26.194 28.642 16.010 138 HA LEU 18 HA LEU 18 26.353 30.650 18.226 139 HB2 LEU 18 HB2 LEU 18 24.288 30.085 16.042 140 HB3 LEU 18 HB3 LEU 18 24.021 31.215 17.369 141 HG LEU 18 HG LEU 18 26.258 31.482 15.338 142 HD11 LEU 18 HD11 LEU 18 24.048 31.696 14.276 143 HD12 LEU 18 HD12 LEU 18 23.589 32.921 15.478 144 HD13 LEU 18 HD13 LEU 18 24.895 33.244 14.323 145 HD21 LEU 18 HD21 LEU 18 25.140 33.416 17.421 146 HD22 LEU 18 HD22 LEU 18 26.759 32.681 17.429 147 HD23 LEU 18 HD23 LEU 18 26.321 33.843 16.174 148 H GLY 19 H GLY 19 25.858 29.755 20.175 149 HA2 GLY 19 HA2 GLY 19 23.997 27.476 20.370 150 HA3 GLY 19 HA3 GLY 19 24.880 28.202 21.691 151 H ALA 20 H ALA 20 22.101 27.357 21.292 152 HA ALA 20 HA ALA 20 20.827 29.630 22.658 153 HB1 ALA 20 HB1 ALA 20 19.550 28.000 20.410 154 HB2 ALA 20 HB2 ALA 20 18.705 29.160 21.455 155 HB3 ALA 20 HB3 ALA 20 19.966 29.728 20.351 156 H CYS 21 H CYS 21 19.155 28.859 24.080 157 HA CYS 21 HA CYS 21 19.314 25.934 24.713 158 HB2 CYS 21 HB2 CYS 21 20.682 27.217 26.301 159 HB3 CYS 21 HB3 CYS 21 19.211 28.042 26.871 160 H ILE 22 H ILE 22 17.564 25.129 24.035 161 HA ILE 22 HA ILE 22 15.115 26.692 23.724 162 HB ILE 22 HB ILE 22 15.628 23.766 23.082 163 HG12 ILE 22 HG12 ILE 22 17.279 25.008 21.835 164 HG13 ILE 22 HG13 ILE 22 16.003 24.469 20.749 165 HG21 ILE 22 HG21 ILE 22 13.504 25.762 22.153 166 HG22 ILE 22 HG22 ILE 22 13.755 24.137 21.464 167 HG23 ILE 22 HG23 ILE 22 13.258 24.308 23.154 168 HD11 ILE 22 HD11 ILE 22 15.039 26.767 20.708 169 HD12 ILE 22 HD12 ILE 22 16.336 27.318 21.813 170 HD13 ILE 22 HD13 ILE 22 16.739 26.731 20.184 171 H GLY 23 H GLY 23 14.479 27.178 25.737 172 HA2 GLY 23 HA2 GLY 23 13.328 26.925 27.754 173 HA3 GLY 23 HA3 GLY 23 13.056 25.209 27.381 174 H GLU 24 H GLU 24 14.470 23.708 28.149 175 HA GLU 24 HA GLU 24 16.811 24.573 29.795 176 HB2 GLU 24 HB2 GLU 24 16.541 22.519 31.011 177 HB3 GLU 24 HB3 GLU 24 15.017 23.388 30.988 178 HG2 GLU 24 HG2 GLU 24 14.186 21.903 29.204 179 HG3 GLU 24 HG3 GLU 24 15.717 21.068 29.157 180 H GLU 25 H GLU 25 16.144 23.198 26.728 181 HA GLU 25 HA GLU 25 18.382 21.256 26.780 182 HB2 GLU 25 HB2 GLU 25 16.389 21.986 24.627 183 HB3 GLU 25 HB3 GLU 25 17.601 20.740 24.477 184 HG2 GLU 25 HG2 GLU 25 15.295 20.728 26.461 185 HG3 GLU 25 HG3 GLU 25 15.352 19.842 24.945 186 H CYS 26 H CYS 26 20.342 22.223 26.646 187 HA CYS 26 HA CYS 26 20.940 24.484 24.937 188 HB2 CYS 26 HB2 CYS 26 22.323 24.128 26.839 189 HB3 CYS 26 HB3 CYS 26 22.644 22.449 26.381 190 H LYS 27 H LYS 27 21.471 24.591 22.854 191 HA LYS 27 HA LYS 27 22.854 22.468 21.471 192 HB2 LYS 27 HB2 LYS 27 21.182 22.323 19.572 193 HB3 LYS 27 HB3 LYS 27 20.837 21.466 21.056 194 HG2 LYS 27 HG2 LYS 27 19.306 23.552 21.645 195 HG3 LYS 27 HG3 LYS 27 19.470 23.923 19.933 196 HD2 LYS 27 HD2 LYS 27 17.452 22.642 20.188 197 HD3 LYS 27 HD3 LYS 27 18.638 21.541 19.459 198 HE2 LYS 27 HE2 LYS 27 19.139 20.637 21.754 199 HE3 LYS 27 HE3 LYS 27 17.925 21.721 22.436 200 HZ1 LYS 27 HZ1 LYS 27 17.349 19.595 20.434 201 HZ2 LYS 27 HZ2 LYS 27 17.141 19.423 22.043 202 HZ3 LYS 27 HZ3 LYS 27 16.219 20.517 21.242 203 H CYS 28 H CYS 28 23.534 23.112 19.282 204 HA CYS 28 HA CYS 28 23.625 26.025 18.835 205 HB2 CYS 28 HB2 CYS 28 26.122 25.992 18.888 206 HB3 CYS 28 HB3 CYS 28 25.349 25.822 20.459 207 H VAL 29 H VAL 29 24.392 26.645 16.792 208 HA VAL 29 HA VAL 29 24.561 24.515 14.721 209 HB VAL 29 HB VAL 29 22.762 25.517 13.451 210 HG11 VAL 29 HG11 VAL 29 22.248 23.676 15.035 211 HG12 VAL 29 HG12 VAL 29 21.758 24.897 16.237 212 HG13 VAL 29 HG13 VAL 29 20.866 24.750 14.711 213 HG21 VAL 29 HG21 VAL 29 22.830 27.849 14.201 214 HG22 VAL 29 HG22 VAL 29 21.208 27.164 14.411 215 HG23 VAL 29 HG23 VAL 29 22.276 27.345 15.816 216 HA PRO 30 HA PRO 30 27.248 27.310 12.529 217 HB2 PRO 30 HB2 PRO 30 25.647 26.672 10.050 218 HB3 PRO 30 HB3 PRO 30 27.422 26.671 10.276 219 HG2 PRO 30 HG2 PRO 30 26.059 24.339 10.259 220 HG3 PRO 30 HG3 PRO 30 27.340 24.618 11.483 221 HD2 PRO 30 HD2 PRO 30 24.362 24.865 11.829 222 HD3 PRO 30 HD3 PRO 30 25.568 24.088 12.899 223 H TYR 31 H TYR 31 27.367 29.376 11.770 224 HA TYR 31 HA TYR 31 25.261 31.292 12.139 225 HB2 TYR 31 HB2 TYR 31 27.994 31.398 10.782 226 HB3 TYR 31 HB3 TYR 31 26.923 32.784 10.882 227 HD1 TYR 31 HD1 TYR 31 27.465 34.351 12.464 228 HD2 TYR 31 HD2 TYR 31 28.359 30.241 13.328 229 HE1 TYR 31 HE1 TYR 31 28.518 35.027 14.592 230 HE2 TYR 31 HE2 TYR 31 29.420 30.911 15.449 231 HH TYR 31 HH TYR 31 29.626 34.335 16.476 Start of MODEL 11 1 H1 ALA 1 H1 ALA 1 16.593 30.197 39.277 2 H2 ALA 1 H2 ALA 1 15.791 29.090 38.329 3 H3 ALA 1 H3 ALA 1 15.641 30.694 38.040 4 HA ALA 1 HA ALA 1 17.895 30.919 37.397 5 HB1 ALA 1 HB1 ALA 1 19.354 28.978 37.240 6 HB2 ALA 1 HB2 ALA 1 18.773 29.136 38.904 7 HB3 ALA 1 HB3 ALA 1 18.074 27.912 37.827 8 H PHE 2 H PHE 2 18.186 30.987 35.168 9 HA PHE 2 HA PHE 2 16.221 29.580 33.442 10 HB2 PHE 2 HB2 PHE 2 18.363 31.671 32.894 11 HB3 PHE 2 HB3 PHE 2 17.312 30.975 31.666 12 HD1 PHE 2 HD1 PHE 2 17.599 33.585 34.142 13 HD2 PHE 2 HD2 PHE 2 14.787 31.225 31.876 14 HE1 PHE 2 HE1 PHE 2 15.846 35.303 34.525 15 HE2 PHE 2 HE2 PHE 2 13.031 32.941 32.264 16 HZ PHE 2 HZ PHE 2 13.566 34.983 33.584 17 H CYS 3 H CYS 3 17.498 28.935 31.243 18 HA CYS 3 HA CYS 3 19.336 26.753 31.761 19 HB2 CYS 3 HB2 CYS 3 17.794 27.011 29.803 20 HB3 CYS 3 HB3 CYS 3 18.762 28.389 29.266 21 H ASN 4 H ASN 4 21.680 26.739 31.448 22 HA ASN 4 HA ASN 4 23.042 29.331 31.700 23 HB2 ASN 4 HB2 ASN 4 24.122 26.509 31.398 24 HB3 ASN 4 HB3 ASN 4 25.081 27.955 31.601 25 HD21 ASN 4 HD21 ASN 4 23.866 28.482 35.042 26 HD22 ASN 4 HD22 ASN 4 24.278 29.408 33.625 27 H LEU 5 H LEU 5 21.966 30.115 29.724 28 HA LEU 5 HA LEU 5 22.524 29.046 27.147 29 HB2 LEU 5 HB2 LEU 5 20.584 30.448 27.603 30 HB3 LEU 5 HB3 LEU 5 21.634 31.807 28.027 31 HG LEU 5 HG LEU 5 22.462 31.937 25.704 32 HD11 LEU 5 HD11 LEU 5 22.156 29.574 24.998 33 HD12 LEU 5 HD12 LEU 5 20.388 29.780 25.131 34 HD13 LEU 5 HD13 LEU 5 21.322 30.684 23.920 35 HD21 LEU 5 HD21 LEU 5 20.526 33.265 26.423 36 HD22 LEU 5 HD22 LEU 5 20.379 32.803 24.725 37 HD23 LEU 5 HD23 LEU 5 19.429 31.946 25.962 38 H ARG 6 H ARG 6 24.239 31.593 29.029 39 HA ARG 6 HA ARG 6 26.136 32.180 26.906 40 HB2 ARG 6 HB2 ARG 6 26.126 32.580 29.904 41 HB3 ARG 6 HB3 ARG 6 27.615 32.833 29.012 42 HG2 ARG 6 HG2 ARG 6 25.040 34.243 28.187 43 HG3 ARG 6 HG3 ARG 6 26.079 34.847 29.480 44 HD2 ARG 6 HD2 ARG 6 26.777 36.039 27.602 45 HD3 ARG 6 HD3 ARG 6 28.026 34.822 27.867 46 HE ARG 6 HE ARG 6 25.995 33.960 25.944 47 HH11 ARG 6 HH11 ARG 6 28.975 35.877 26.134 48 HH12 ARG 6 HH12 ARG 6 29.172 35.833 24.401 49 HH21 ARG 6 HH21 ARG 6 26.312 33.993 23.869 50 HH22 ARG 6 HH22 ARG 6 27.705 34.789 23.129 51 H ARG 7 H ARG 7 26.327 29.762 29.577 52 HA ARG 7 HA ARG 7 28.877 28.711 28.749 53 HB2 ARG 7 HB2 ARG 7 27.740 28.292 30.944 54 HB3 ARG 7 HB3 ARG 7 26.599 27.215 30.107 55 HG2 ARG 7 HG2 ARG 7 28.455 25.708 29.476 56 HG3 ARG 7 HG3 ARG 7 29.618 26.840 30.171 57 HD2 ARG 7 HD2 ARG 7 29.312 25.118 31.789 58 HD3 ARG 7 HD3 ARG 7 28.500 26.567 32.400 59 HE ARG 7 HE ARG 7 26.724 24.752 30.918 60 HH11 ARG 7 HH11 ARG 7 28.094 25.322 34.149 61 HH12 ARG 7 HH12 ARG 7 26.889 24.278 34.881 62 HH21 ARG 7 HH21 ARG 7 25.162 23.564 32.052 63 HH22 ARG 7 HH22 ARG 7 25.311 23.449 33.795 64 H CYS 8 H CYS 8 25.575 27.745 27.880 65 HA CYS 8 HA CYS 8 26.149 25.689 26.013 66 HB2 CYS 8 HB2 CYS 8 23.975 27.799 26.141 67 HB3 CYS 8 HB3 CYS 8 23.957 26.520 24.966 68 H GLU 9 H GLU 9 25.876 29.219 25.305 69 HA GLU 9 HA GLU 9 26.539 28.991 22.513 70 HB2 GLU 9 HB2 GLU 9 26.599 31.283 24.520 71 HB3 GLU 9 HB3 GLU 9 26.998 31.512 22.817 72 HG2 GLU 9 HG2 GLU 9 24.827 30.840 22.089 73 HG3 GLU 9 HG3 GLU 9 24.328 30.334 23.697 74 H LEU 10 H LEU 10 28.611 29.783 25.361 75 HA LEU 10 HA LEU 10 31.034 30.142 23.837 76 HB2 LEU 10 HB2 LEU 10 30.301 29.809 26.750 77 HB3 LEU 10 HB3 LEU 10 31.957 29.541 26.303 78 HG LEU 10 HG LEU 10 31.538 31.814 27.127 79 HD11 LEU 10 HD11 LEU 10 32.876 32.963 25.472 80 HD12 LEU 10 HD12 LEU 10 33.450 31.298 25.652 81 HD13 LEU 10 HD13 LEU 10 32.466 31.756 24.239 82 HD21 LEU 10 HD21 LEU 10 30.030 32.299 24.528 83 HD22 LEU 10 HD22 LEU 10 29.334 32.319 26.167 84 HD23 LEU 10 HD23 LEU 10 30.539 33.526 25.707 85 H SER 11 H SER 11 29.603 27.293 25.408 86 HA SER 11 HA SER 11 31.643 25.393 25.008 87 HB2 SER 11 HB2 SER 11 29.607 25.004 26.313 88 HB3 SER 11 HB3 SER 11 28.614 25.145 24.849 89 HG SER 11 HG SER 11 28.808 23.078 24.873 90 H CYS 12 H CYS 12 29.221 26.619 22.673 91 HA CYS 12 HA CYS 12 30.364 24.876 20.562 92 HB2 CYS 12 HB2 CYS 12 27.993 26.752 20.451 93 HB3 CYS 12 HB3 CYS 12 28.587 25.710 19.191 94 H ARG 13 H ARG 13 30.682 28.204 21.576 95 HA ARG 13 HA ARG 13 31.735 29.295 19.130 96 HB2 ARG 13 HB2 ARG 13 31.241 30.545 21.301 97 HB3 ARG 13 HB3 ARG 13 32.733 29.855 21.944 98 HG2 ARG 13 HG2 ARG 13 33.840 30.937 19.774 99 HG3 ARG 13 HG3 ARG 13 32.336 31.853 19.672 100 HD2 ARG 13 HD2 ARG 13 34.017 33.152 20.846 101 HD3 ARG 13 HD3 ARG 13 32.753 32.683 22.003 102 HE ARG 13 HE ARG 13 34.793 30.680 22.040 103 HH11 ARG 13 HH11 ARG 13 34.418 33.994 23.224 104 HH12 ARG 13 HH12 ARG 13 35.630 33.680 24.462 105 HH21 ARG 13 HH21 ARG 13 36.109 30.416 23.619 106 HH22 ARG 13 HH22 ARG 13 36.599 31.771 24.639 107 H SER 14 H SER 14 33.168 27.125 21.538 108 HA SER 14 HA SER 14 35.808 26.904 20.529 109 HB2 SER 14 HB2 SER 14 34.088 24.674 21.707 110 HB3 SER 14 HB3 SER 14 35.889 24.821 21.753 111 HG SER 14 HG SER 14 34.591 25.485 23.698 112 H LEU 15 H LEU 15 32.852 25.859 19.048 113 HA LEU 15 HA LEU 15 34.293 24.358 16.920 114 HB2 LEU 15 HB2 LEU 15 31.347 24.263 17.594 115 HB3 LEU 15 HB3 LEU 15 32.219 23.209 16.480 116 HG LEU 15 HG LEU 15 32.473 23.262 19.519 117 HD11 LEU 15 HD11 LEU 15 30.361 22.308 18.702 118 HD12 LEU 15 HD12 LEU 15 31.274 21.202 17.651 119 HD13 LEU 15 HD13 LEU 15 31.409 21.068 19.420 120 HD21 LEU 15 HD21 LEU 15 33.803 21.441 17.491 121 HD22 LEU 15 HD22 LEU 15 34.631 22.606 18.546 122 HD23 LEU 15 HD23 LEU 15 33.816 21.195 19.247 123 H GLY 16 H GLY 16 33.211 27.356 17.586 124 HA2 GLY 16 HA2 GLY 16 33.045 29.219 16.254 125 HA3 GLY 16 HA3 GLY 16 33.039 28.211 14.809 126 H LEU 17 H LEU 17 30.541 27.450 17.176 127 HA LEU 17 HA LEU 17 28.537 28.388 15.179 128 HB2 LEU 17 HB2 LEU 17 27.950 26.419 17.362 129 HB3 LEU 17 HB3 LEU 17 27.180 26.589 15.815 130 HG LEU 17 HG LEU 17 29.860 25.398 16.424 131 HD11 LEU 17 HD11 LEU 17 28.072 23.897 16.960 132 HD12 LEU 17 HD12 LEU 17 27.282 24.172 15.386 133 HD13 LEU 17 HD13 LEU 17 28.838 23.322 15.487 134 HD21 LEU 17 HD21 LEU 17 29.890 26.554 14.155 135 HD22 LEU 17 HD22 LEU 17 30.062 24.808 14.061 136 HD23 LEU 17 HD23 LEU 17 28.493 25.564 13.685 137 H LEU 18 H LEU 18 26.464 29.068 15.847 138 HA LEU 18 HA LEU 18 26.292 30.748 18.292 139 HB2 LEU 18 HB2 LEU 18 24.354 30.090 16.020 140 HB3 LEU 18 HB3 LEU 18 23.923 31.095 17.406 141 HG LEU 18 HG LEU 18 26.145 31.767 15.455 142 HD11 LEU 18 HD11 LEU 18 23.306 32.831 15.619 143 HD12 LEU 18 HD12 LEU 18 24.595 33.415 14.538 144 HD13 LEU 18 HD13 LEU 18 23.955 31.771 14.346 145 HD21 LEU 18 HD21 LEU 18 24.760 33.403 17.620 146 HD22 LEU 18 HD22 LEU 18 26.455 32.862 17.638 147 HD23 LEU 18 HD23 LEU 18 25.919 34.041 16.434 148 H GLY 19 H GLY 19 25.602 29.835 20.187 149 HA2 GLY 19 HA2 GLY 19 23.997 27.322 20.142 150 HA3 GLY 19 HA3 GLY 19 24.637 28.081 21.564 151 H ALA 20 H ALA 20 22.001 27.110 21.103 152 HA ALA 20 HA ALA 20 20.542 29.429 22.114 153 HB1 ALA 20 HB1 ALA 20 19.937 29.383 19.717 154 HB2 ALA 20 HB2 ALA 20 19.498 27.665 19.858 155 HB3 ALA 20 HB3 ALA 20 18.558 28.899 20.725 156 H CYS 21 H CYS 21 18.866 28.787 23.530 157 HA CYS 21 HA CYS 21 18.881 25.907 24.344 158 HB2 CYS 21 HB2 CYS 21 20.075 27.413 25.939 159 HB3 CYS 21 HB3 CYS 21 18.529 28.202 26.275 160 H ILE 22 H ILE 22 17.070 24.855 24.702 161 HA ILE 22 HA ILE 22 14.451 26.295 24.395 162 HB ILE 22 HB ILE 22 15.133 23.446 23.603 163 HG12 ILE 22 HG12 ILE 22 16.141 25.025 22.033 164 HG13 ILE 22 HG13 ILE 22 14.828 24.132 21.296 165 HG21 ILE 22 HG21 ILE 22 12.849 23.468 22.575 166 HG22 ILE 22 HG22 ILE 22 12.813 23.572 24.335 167 HG23 ILE 22 HG23 ILE 22 12.533 25.027 23.364 168 HD11 ILE 22 HD11 ILE 22 13.357 26.096 21.445 169 HD12 ILE 22 HD12 ILE 22 14.620 27.013 22.289 170 HD13 ILE 22 HD13 ILE 22 14.857 26.511 20.616 171 H GLY 23 H GLY 23 14.180 26.772 26.478 172 HA2 GLY 23 HA2 GLY 23 13.286 26.513 28.578 173 HA3 GLY 23 HA3 GLY 23 13.035 24.800 28.229 174 H GLU 24 H GLU 24 15.354 23.644 28.054 175 HA GLU 24 HA GLU 24 17.250 24.553 30.130 176 HB2 GLU 24 HB2 GLU 24 17.068 22.692 31.543 177 HB3 GLU 24 HB3 GLU 24 15.458 23.349 31.371 178 HG2 GLU 24 HG2 GLU 24 14.850 21.525 29.833 179 HG3 GLU 24 HG3 GLU 24 16.509 20.894 29.894 180 H GLU 25 H GLU 25 16.648 22.457 27.348 181 HA GLU 25 HA GLU 25 19.488 21.584 27.467 182 HB2 GLU 25 HB2 GLU 25 17.947 19.729 27.327 183 HB3 GLU 25 HB3 GLU 25 17.198 20.418 25.888 184 HG2 GLU 25 HG2 GLU 25 18.664 18.593 25.272 185 HG3 GLU 25 HG3 GLU 25 19.278 20.095 24.606 186 H CYS 26 H CYS 26 20.899 22.059 25.806 187 HA CYS 26 HA CYS 26 19.987 24.159 23.896 188 HB2 CYS 26 HB2 CYS 26 21.940 25.448 24.460 189 HB3 CYS 26 HB3 CYS 26 20.927 25.151 25.867 190 H LYS 27 H LYS 27 20.683 24.202 21.974 191 HA LYS 27 HA LYS 27 22.960 22.510 21.046 192 HB2 LYS 27 HB2 LYS 27 20.154 22.506 19.869 193 HB3 LYS 27 HB3 LYS 27 21.584 21.875 19.035 194 HG2 LYS 27 HG2 LYS 27 21.953 20.213 20.828 195 HG3 LYS 27 HG3 LYS 27 20.565 20.856 21.719 196 HD2 LYS 27 HD2 LYS 27 19.841 18.882 20.610 197 HD3 LYS 27 HD3 LYS 27 19.072 20.265 19.825 198 HE2 LYS 27 HE2 LYS 27 20.867 20.132 18.037 199 HE3 LYS 27 HE3 LYS 27 21.454 18.652 18.796 200 HZ1 LYS 27 HZ1 LYS 27 19.304 17.619 18.342 201 HZ2 LYS 27 HZ2 LYS 27 18.703 19.071 17.753 202 HZ3 LYS 27 HZ3 LYS 27 19.862 18.286 16.955 203 H CYS 28 H CYS 28 23.894 23.131 19.110 204 HA CYS 28 HA CYS 28 23.539 26.031 18.513 205 HB2 CYS 28 HB2 CYS 28 26.020 26.106 18.410 206 HB3 CYS 28 HB3 CYS 28 25.341 25.792 19.995 207 H VAL 29 H VAL 29 24.476 26.820 16.518 208 HA VAL 29 HA VAL 29 24.376 24.971 14.199 209 HB VAL 29 HB VAL 29 22.652 26.340 13.121 210 HG11 VAL 29 HG11 VAL 29 21.614 25.346 15.787 211 HG12 VAL 29 HG12 VAL 29 20.722 25.508 14.267 212 HG13 VAL 29 HG13 VAL 29 22.011 24.298 14.399 213 HG21 VAL 29 HG21 VAL 29 21.257 27.908 14.398 214 HG22 VAL 29 HG22 VAL 29 22.355 27.767 15.783 215 HG23 VAL 29 HG23 VAL 29 22.924 28.488 14.259 216 HA PRO 30 HA PRO 30 27.398 27.749 12.581 217 HB2 PRO 30 HB2 PRO 30 27.061 27.578 9.854 218 HB3 PRO 30 HB3 PRO 30 27.758 26.277 10.866 219 HG2 PRO 30 HG2 PRO 30 24.901 26.560 9.899 220 HG3 PRO 30 HG3 PRO 30 25.959 25.113 9.824 221 HD2 PRO 30 HD2 PRO 30 24.148 25.409 11.805 222 HD3 PRO 30 HD3 PRO 30 25.756 24.719 12.150 223 H TYR 31 H TYR 31 27.800 29.726 11.501 224 HA TYR 31 HA TYR 31 25.746 31.764 11.824 225 HB2 TYR 31 HB2 TYR 31 28.627 31.770 10.940 226 HB3 TYR 31 HB3 TYR 31 27.636 33.199 10.839 227 HD1 TYR 31 HD1 TYR 31 28.553 30.557 13.404 228 HD2 TYR 31 HD2 TYR 31 27.760 34.730 12.575 229 HE1 TYR 31 HE1 TYR 31 29.185 31.157 15.750 230 HE2 TYR 31 HE2 TYR 31 28.396 35.302 14.906 231 HH TYR 31 HH TYR 31 28.735 34.372 17.067 Start of MODEL 12 1 H1 ALA 1 H1 ALA 1 16.761 23.474 39.631 2 H2 ALA 1 H2 ALA 1 15.885 23.251 38.248 3 H3 ALA 1 H3 ALA 1 16.275 24.759 38.738 4 HA ALA 1 HA ALA 1 18.622 24.307 38.426 5 HB1 ALA 1 HB1 ALA 1 18.525 21.878 38.789 6 HB2 ALA 1 HB2 ALA 1 17.582 21.673 37.301 7 HB3 ALA 1 HB3 ALA 1 19.262 22.242 37.216 8 H PHE 2 H PHE 2 18.868 25.943 36.960 9 HA PHE 2 HA PHE 2 17.164 25.930 34.512 10 HB2 PHE 2 HB2 PHE 2 18.832 28.135 35.743 11 HB3 PHE 2 HB3 PHE 2 17.773 28.287 34.340 12 HD1 PHE 2 HD1 PHE 2 15.261 27.967 34.626 13 HD2 PHE 2 HD2 PHE 2 17.946 28.312 37.981 14 HE1 PHE 2 HE1 PHE 2 13.348 28.528 36.109 15 HE2 PHE 2 HE2 PHE 2 16.025 28.843 39.458 16 HZ PHE 2 HZ PHE 2 13.727 28.989 38.521 17 H CYS 3 H CYS 3 18.005 26.167 32.424 18 HA CYS 3 HA CYS 3 20.648 25.106 31.876 19 HB2 CYS 3 HB2 CYS 3 18.581 24.926 30.427 20 HB3 CYS 3 HB3 CYS 3 18.811 26.616 29.986 21 H ASN 4 H ASN 4 22.305 26.361 30.502 22 HA ASN 4 HA ASN 4 22.371 29.254 31.204 23 HB2 ASN 4 HB2 ASN 4 23.931 27.691 32.640 24 HB3 ASN 4 HB3 ASN 4 24.888 27.637 31.171 25 HD21 ASN 4 HD21 ASN 4 24.460 31.204 33.128 26 HD22 ASN 4 HD22 ASN 4 23.338 29.888 33.449 27 H LEU 5 H LEU 5 21.914 30.096 29.391 28 HA LEU 5 HA LEU 5 22.676 29.304 26.763 29 HB2 LEU 5 HB2 LEU 5 20.825 30.851 27.242 30 HB3 LEU 5 HB3 LEU 5 21.964 32.035 27.893 31 HG LEU 5 HG LEU 5 22.983 32.345 25.681 32 HD11 LEU 5 HD11 LEU 5 21.835 31.364 23.672 33 HD12 LEU 5 HD12 LEU 5 22.658 30.150 24.649 34 HD13 LEU 5 HD13 LEU 5 20.891 30.328 24.767 35 HD21 LEU 5 HD21 LEU 5 21.060 33.436 24.582 36 HD22 LEU 5 HD22 LEU 5 19.943 32.540 25.631 37 HD23 LEU 5 HD23 LEU 5 21.051 33.736 26.327 38 H ARG 6 H ARG 6 24.335 31.475 29.122 39 HA ARG 6 HA ARG 6 26.394 32.301 27.256 40 HB2 ARG 6 HB2 ARG 6 26.574 32.182 30.302 41 HB3 ARG 6 HB3 ARG 6 27.645 33.057 29.223 42 HG2 ARG 6 HG2 ARG 6 24.787 33.701 29.947 43 HG3 ARG 6 HG3 ARG 6 26.224 34.687 30.131 44 HD2 ARG 6 HD2 ARG 6 24.778 34.012 27.536 45 HD3 ARG 6 HD3 ARG 6 24.816 35.563 28.378 46 HE ARG 6 HE ARG 6 27.503 34.798 27.813 47 HH11 ARG 6 HH11 ARG 6 24.701 36.027 26.063 48 HH12 ARG 6 HH12 ARG 6 25.706 36.625 24.757 49 HH21 ARG 6 HH21 ARG 6 28.652 35.732 26.310 50 HH22 ARG 6 HH22 ARG 6 27.943 36.617 24.976 51 H ARG 7 H ARG 7 26.344 29.602 29.591 52 HA ARG 7 HA ARG 7 28.938 28.582 28.841 53 HB2 ARG 7 HB2 ARG 7 27.382 27.953 30.879 54 HB3 ARG 7 HB3 ARG 7 26.671 26.789 29.755 55 HG2 ARG 7 HG2 ARG 7 29.355 26.274 29.380 56 HG3 ARG 7 HG3 ARG 7 29.376 26.899 31.031 57 HD2 ARG 7 HD2 ARG 7 29.112 24.627 31.405 58 HD3 ARG 7 HD3 ARG 7 27.445 25.180 31.459 59 HE ARG 7 HE ARG 7 27.001 24.125 29.393 60 HH11 ARG 7 HH11 ARG 7 30.507 23.927 29.934 61 HH12 ARG 7 HH12 ARG 7 30.656 22.690 28.708 62 HH21 ARG 7 HH21 ARG 7 27.361 22.392 28.005 63 HH22 ARG 7 HH22 ARG 7 29.026 21.860 27.746 64 H CYS 8 H CYS 8 25.671 27.752 27.665 65 HA CYS 8 HA CYS 8 26.418 25.710 25.847 66 HB2 CYS 8 HB2 CYS 8 24.159 26.049 26.639 67 HB3 CYS 8 HB3 CYS 8 24.086 27.649 25.922 68 H GLU 9 H GLU 9 26.037 29.235 25.237 69 HA GLU 9 HA GLU 9 26.721 29.212 22.453 70 HB2 GLU 9 HB2 GLU 9 26.962 31.248 24.714 71 HB3 GLU 9 HB3 GLU 9 27.536 31.645 23.112 72 HG2 GLU 9 HG2 GLU 9 24.697 30.645 23.394 73 HG3 GLU 9 HG3 GLU 9 25.091 32.280 23.936 74 H LEU 10 H LEU 10 28.859 29.872 25.318 75 HA LEU 10 HA LEU 10 31.152 30.130 23.588 76 HB2 LEU 10 HB2 LEU 10 30.691 30.187 26.554 77 HB3 LEU 10 HB3 LEU 10 32.326 29.956 25.982 78 HG LEU 10 HG LEU 10 31.737 32.324 26.455 79 HD11 LEU 10 HD11 LEU 10 32.539 31.806 23.559 80 HD12 LEU 10 HD12 LEU 10 32.839 33.266 24.510 81 HD13 LEU 10 HD13 LEU 10 33.616 31.750 24.973 82 HD21 LEU 10 HD21 LEU 10 30.430 33.647 24.937 83 HD22 LEU 10 HD22 LEU 10 30.107 32.265 23.880 84 HD23 LEU 10 HD23 LEU 10 29.409 32.331 25.521 85 H SER 11 H SER 11 29.934 27.346 25.433 86 HA SER 11 HA SER 11 32.187 25.650 25.000 87 HB2 SER 11 HB2 SER 11 30.376 25.100 26.549 88 HB3 SER 11 HB3 SER 11 29.219 25.004 25.209 89 HG SER 11 HG SER 11 29.804 23.049 24.936 90 H CYS 12 H CYS 12 29.598 26.650 22.791 91 HA CYS 12 HA CYS 12 30.578 24.795 20.691 92 HB2 CYS 12 HB2 CYS 12 28.211 26.683 20.704 93 HB3 CYS 12 HB3 CYS 12 28.644 25.540 19.468 94 H ARG 13 H ARG 13 30.830 28.230 21.524 95 HA ARG 13 HA ARG 13 31.659 29.261 19.055 96 HB2 ARG 13 HB2 ARG 13 31.370 30.352 21.449 97 HB3 ARG 13 HB3 ARG 13 33.079 29.952 21.650 98 HG2 ARG 13 HG2 ARG 13 33.096 32.158 20.810 99 HG3 ARG 13 HG3 ARG 13 33.427 31.191 19.376 100 HD2 ARG 13 HD2 ARG 13 31.774 32.767 18.718 101 HD3 ARG 13 HD3 ARG 13 30.879 31.259 18.919 102 HE ARG 13 HE ARG 13 31.068 33.365 21.052 103 HH11 ARG 13 HH11 ARG 13 28.868 31.170 19.300 104 HH12 ARG 13 HH12 ARG 13 27.523 31.831 20.181 105 HH21 ARG 13 HH21 ARG 13 29.346 34.224 21.815 106 HH22 ARG 13 HH22 ARG 13 27.752 33.758 21.239 107 H SER 14 H SER 14 33.438 27.131 21.251 108 HA SER 14 HA SER 14 35.992 27.186 20.093 109 HB2 SER 14 HB2 SER 14 34.473 24.743 21.085 110 HB3 SER 14 HB3 SER 14 36.236 24.914 20.967 111 HG SER 14 HG SER 14 35.367 25.250 23.072 112 H LEU 15 H LEU 15 33.036 25.881 18.712 113 HA LEU 15 HA LEU 15 34.467 24.552 16.463 114 HB2 LEU 15 HB2 LEU 15 31.549 24.372 17.259 115 HB3 LEU 15 HB3 LEU 15 32.402 23.347 16.109 116 HG LEU 15 HG LEU 15 32.805 23.413 19.137 117 HD11 LEU 15 HD11 LEU 15 31.763 21.194 19.086 118 HD12 LEU 15 HD12 LEU 15 30.662 22.417 18.433 119 HD13 LEU 15 HD13 LEU 15 31.525 21.326 17.331 120 HD21 LEU 15 HD21 LEU 15 34.170 21.385 18.796 121 HD22 LEU 15 HD22 LEU 15 34.017 21.580 17.036 122 HD23 LEU 15 HD23 LEU 15 34.903 22.788 18.004 123 H GLY 16 H GLY 16 33.080 27.522 17.150 124 HA2 GLY 16 HA2 GLY 16 32.762 29.321 15.731 125 HA3 GLY 16 HA3 GLY 16 32.733 28.258 14.327 126 H LEU 17 H LEU 17 30.572 27.835 17.160 127 HA LEU 17 HA LEU 17 28.251 28.346 15.341 128 HB2 LEU 17 HB2 LEU 17 28.172 26.605 17.776 129 HB3 LEU 17 HB3 LEU 17 27.098 26.581 16.406 130 HG LEU 17 HG LEU 17 29.918 25.574 16.545 131 HD11 LEU 17 HD11 LEU 17 28.910 23.351 16.153 132 HD12 LEU 17 HD12 LEU 17 28.361 24.099 17.648 133 HD13 LEU 17 HD13 LEU 17 27.297 24.085 16.221 134 HD21 LEU 17 HD21 LEU 17 29.655 24.684 14.278 135 HD22 LEU 17 HD22 LEU 17 27.997 25.322 14.182 136 HD23 LEU 17 HD23 LEU 17 29.387 26.426 14.211 137 H LEU 18 H LEU 18 26.268 28.918 16.229 138 HA LEU 18 HA LEU 18 26.187 30.654 18.640 139 HB2 LEU 18 HB2 LEU 18 24.271 30.126 16.326 140 HB3 LEU 18 HB3 LEU 18 23.835 31.094 17.737 141 HG LEU 18 HG LEU 18 26.159 31.775 15.906 142 HD11 LEU 18 HD11 LEU 18 24.661 33.469 14.928 143 HD12 LEU 18 HD12 LEU 18 24.035 31.829 14.658 144 HD13 LEU 18 HD13 LEU 18 23.320 32.860 15.918 145 HD21 LEU 18 HD21 LEU 18 25.830 34.052 16.951 146 HD22 LEU 18 HD22 LEU 18 24.662 33.326 18.066 147 HD23 LEU 18 HD23 LEU 18 26.366 32.825 18.108 148 H GLY 19 H GLY 19 25.602 29.669 20.483 149 HA2 GLY 19 HA2 GLY 19 23.938 27.199 20.485 150 HA3 GLY 19 HA3 GLY 19 24.750 27.879 21.866 151 H ALA 20 H ALA 20 21.964 26.983 21.321 152 HA ALA 20 HA ALA 20 20.625 29.116 22.827 153 HB1 ALA 20 HB1 ALA 20 19.545 27.901 20.248 154 HB2 ALA 20 HB2 ALA 20 18.592 28.860 21.391 155 HB3 ALA 20 HB3 ALA 20 19.954 29.606 20.532 156 H CYS 21 H CYS 21 19.109 28.245 24.274 157 HA CYS 21 HA CYS 21 19.046 25.249 24.457 158 HB2 CYS 21 HB2 CYS 21 20.743 26.130 25.957 159 HB3 CYS 21 HB3 CYS 21 19.541 27.165 26.741 160 H ILE 22 H ILE 22 17.044 24.628 24.081 161 HA ILE 22 HA ILE 22 14.723 26.123 25.122 162 HB ILE 22 HB ILE 22 14.894 23.592 23.455 163 HG12 ILE 22 HG12 ILE 22 14.075 26.419 22.615 164 HG13 ILE 22 HG13 ILE 22 15.694 25.783 22.388 165 HG21 ILE 22 HG21 ILE 22 12.454 23.947 23.069 166 HG22 ILE 22 HG22 ILE 22 12.787 23.642 24.761 167 HG23 ILE 22 HG23 ILE 22 12.470 25.301 24.216 168 HD11 ILE 22 HD11 ILE 22 14.773 23.912 21.013 169 HD12 ILE 22 HD12 ILE 22 13.184 24.719 21.071 170 HD13 ILE 22 HD13 ILE 22 14.571 25.534 20.326 171 H GLY 23 H GLY 23 14.498 25.959 27.232 172 HA2 GLY 23 HA2 GLY 23 13.894 25.095 29.259 173 HA3 GLY 23 HA3 GLY 23 13.667 23.509 28.517 174 H GLU 24 H GLU 24 15.774 22.368 27.977 175 HA GLU 24 HA GLU 24 17.912 22.759 30.024 176 HB2 GLU 24 HB2 GLU 24 17.636 20.560 30.928 177 HB3 GLU 24 HB3 GLU 24 16.094 21.409 31.042 178 HG2 GLU 24 HG2 GLU 24 15.261 20.167 29.058 179 HG3 GLU 24 HG3 GLU 24 16.831 19.373 28.887 180 H GLU 25 H GLU 25 17.249 21.971 26.779 181 HA GLU 25 HA GLU 25 19.733 20.323 26.536 182 HB2 GLU 25 HB2 GLU 25 17.391 20.614 24.633 183 HB3 GLU 25 HB3 GLU 25 18.881 19.742 24.280 184 HG2 GLU 25 HG2 GLU 25 16.855 19.083 26.438 185 HG3 GLU 25 HG3 GLU 25 17.109 18.205 24.933 186 H CYS 26 H CYS 26 21.499 21.311 25.857 187 HA CYS 26 HA CYS 26 21.394 23.943 24.543 188 HB2 CYS 26 HB2 CYS 26 23.140 23.569 26.168 189 HB3 CYS 26 HB3 CYS 26 23.661 22.095 25.333 190 H LYS 27 H LYS 27 21.122 24.192 22.431 191 HA LYS 27 HA LYS 27 22.252 22.183 20.518 192 HB2 LYS 27 HB2 LYS 27 19.780 22.108 20.703 193 HB3 LYS 27 HB3 LYS 27 19.720 23.809 20.224 194 HG2 LYS 27 HG2 LYS 27 20.764 23.205 18.032 195 HG3 LYS 27 HG3 LYS 27 20.821 21.515 18.567 196 HD2 LYS 27 HD2 LYS 27 18.894 21.656 17.220 197 HD3 LYS 27 HD3 LYS 27 18.281 21.648 18.876 198 HE2 LYS 27 HE2 LYS 27 18.017 24.130 18.775 199 HE3 LYS 27 HE3 LYS 27 18.679 24.123 17.128 200 HZ1 LYS 27 HZ1 LYS 27 16.296 24.148 16.994 201 HZ2 LYS 27 HZ2 LYS 27 16.800 22.652 16.506 202 HZ3 LYS 27 HZ3 LYS 27 16.152 22.827 17.982 203 H CYS 28 H CYS 28 23.739 23.003 19.257 204 HA CYS 28 HA CYS 28 23.771 25.941 18.749 205 HB2 CYS 28 HB2 CYS 28 26.230 25.917 18.921 206 HB3 CYS 28 HB3 CYS 28 25.380 25.688 20.439 207 H VAL 29 H VAL 29 24.488 26.706 16.805 208 HA VAL 29 HA VAL 29 24.895 24.786 14.586 209 HB VAL 29 HB VAL 29 23.016 25.606 13.319 210 HG11 VAL 29 HG11 VAL 29 22.622 23.698 14.907 211 HG12 VAL 29 HG12 VAL 29 21.928 24.862 16.072 212 HG13 VAL 29 HG13 VAL 29 21.179 24.610 14.482 213 HG21 VAL 29 HG21 VAL 29 21.279 27.066 14.294 214 HG22 VAL 29 HG22 VAL 29 22.315 27.349 15.712 215 HG23 VAL 29 HG23 VAL 29 22.822 27.899 14.102 216 HA PRO 30 HA PRO 30 27.532 27.878 13.090 217 HB2 PRO 30 HB2 PRO 30 26.386 27.693 10.313 218 HB3 PRO 30 HB3 PRO 30 28.077 27.495 10.866 219 HG2 PRO 30 HG2 PRO 30 26.594 25.334 10.212 220 HG3 PRO 30 HG3 PRO 30 27.673 25.297 11.644 221 HD2 PRO 30 HD2 PRO 30 24.683 25.784 11.557 222 HD3 PRO 30 HD3 PRO 30 25.636 24.736 12.644 223 H TYR 31 H TYR 31 27.819 30.086 12.585 224 HA TYR 31 HA TYR 31 25.697 31.991 12.851 225 HB2 TYR 31 HB2 TYR 31 28.489 32.167 11.658 226 HB3 TYR 31 HB3 TYR 31 27.423 33.543 11.774 227 HD1 TYR 31 HD1 TYR 31 26.775 34.512 13.961 228 HD2 TYR 31 HD2 TYR 31 29.753 31.415 13.621 229 HE1 TYR 31 HE1 TYR 31 27.813 35.276 16.101 230 HE2 TYR 31 HE2 TYR 31 30.775 32.167 15.762 231 HH TYR 31 HH TYR 31 29.414 34.814 17.730 Start of MODEL 13 1 H1 ALA 1 H1 ALA 1 15.520 19.091 34.743 2 H2 ALA 1 H2 ALA 1 14.924 19.953 33.461 3 H3 ALA 1 H3 ALA 1 14.943 20.629 34.936 4 HA ALA 1 HA ALA 1 17.298 20.702 35.022 5 HB1 ALA 1 HB1 ALA 1 17.193 19.447 32.239 6 HB2 ALA 1 HB2 ALA 1 18.651 19.964 33.115 7 HB3 ALA 1 HB3 ALA 1 17.687 18.609 33.725 8 H PHE 2 H PHE 2 18.218 22.710 34.450 9 HA PHE 2 HA PHE 2 16.732 24.324 32.428 10 HB2 PHE 2 HB2 PHE 2 18.557 25.348 34.612 11 HB3 PHE 2 HB3 PHE 2 17.470 26.278 33.573 12 HD1 PHE 2 HD1 PHE 2 17.842 25.090 36.821 13 HD2 PHE 2 HD2 PHE 2 14.879 25.428 33.714 14 HE1 PHE 2 HE1 PHE 2 16.036 24.938 38.514 15 HE2 PHE 2 HE2 PHE 2 13.096 25.302 35.422 16 HZ PHE 2 HZ PHE 2 13.656 25.041 37.830 17 H CYS 3 H CYS 3 17.868 25.653 30.963 18 HA CYS 3 HA CYS 3 20.319 24.655 29.830 19 HB2 CYS 3 HB2 CYS 3 18.829 27.282 29.569 20 HB3 CYS 3 HB3 CYS 3 20.230 26.871 28.590 21 H ASN 4 H ASN 4 22.331 25.757 29.615 22 HA ASN 4 HA ASN 4 22.992 27.957 31.527 23 HB2 ASN 4 HB2 ASN 4 24.552 25.392 31.013 24 HB3 ASN 4 HB3 ASN 4 25.359 26.907 31.377 25 HD21 ASN 4 HD21 ASN 4 23.108 26.283 34.619 26 HD22 ASN 4 HD22 ASN 4 22.332 26.619 33.077 27 H LEU 5 H LEU 5 22.230 29.118 29.614 28 HA LEU 5 HA LEU 5 23.284 28.628 27.047 29 HB2 LEU 5 HB2 LEU 5 21.133 29.740 27.565 30 HB3 LEU 5 HB3 LEU 5 22.019 31.164 28.114 31 HG LEU 5 HG LEU 5 22.935 31.476 25.834 32 HD11 LEU 5 HD11 LEU 5 21.173 29.113 25.070 33 HD12 LEU 5 HD12 LEU 5 21.939 30.236 23.921 34 HD13 LEU 5 HD13 LEU 5 22.948 29.210 24.934 35 HD21 LEU 5 HD21 LEU 5 20.821 32.172 24.767 36 HD22 LEU 5 HD22 LEU 5 19.900 31.159 25.900 37 HD23 LEU 5 HD23 LEU 5 20.810 32.564 26.491 38 H ARG 6 H ARG 6 24.577 30.749 29.604 39 HA ARG 6 HA ARG 6 26.659 31.910 27.919 40 HB2 ARG 6 HB2 ARG 6 26.356 31.607 30.929 41 HB3 ARG 6 HB3 ARG 6 27.806 32.285 30.213 42 HG2 ARG 6 HG2 ARG 6 25.021 33.475 29.891 43 HG3 ARG 6 HG3 ARG 6 26.263 34.002 31.021 44 HD2 ARG 6 HD2 ARG 6 26.506 35.530 29.288 45 HD3 ARG 6 HD3 ARG 6 27.790 34.360 28.959 46 HE ARG 6 HE ARG 6 25.208 33.833 27.639 47 HH11 ARG 6 HH11 ARG 6 28.314 35.453 27.110 48 HH12 ARG 6 HH12 ARG 6 28.041 35.474 25.380 49 HH21 ARG 6 HH21 ARG 6 24.974 33.990 25.485 50 HH22 ARG 6 HH22 ARG 6 26.285 34.568 24.489 51 H ARG 7 H ARG 7 26.476 28.790 29.490 52 HA ARG 7 HA ARG 7 29.335 28.233 28.853 53 HB2 ARG 7 HB2 ARG 7 28.232 27.221 30.867 54 HB3 ARG 7 HB3 ARG 7 27.174 26.303 29.818 55 HG2 ARG 7 HG2 ARG 7 30.181 26.128 29.403 56 HG3 ARG 7 HG3 ARG 7 29.473 25.307 30.784 57 HD2 ARG 7 HD2 ARG 7 28.667 24.793 27.893 58 HD3 ARG 7 HD3 ARG 7 29.772 23.808 28.853 59 HE ARG 7 HE ARG 7 27.513 23.968 30.436 60 HH11 ARG 7 HH11 ARG 7 28.103 22.650 27.180 61 HH12 ARG 7 HH12 ARG 7 26.799 21.504 27.404 62 HH21 ARG 7 HH21 ARG 7 25.792 22.565 30.464 63 HH22 ARG 7 HH22 ARG 7 25.449 21.590 29.062 64 H CYS 8 H CYS 8 26.101 27.249 27.762 65 HA CYS 8 HA CYS 8 26.866 25.546 25.663 66 HB2 CYS 8 HB2 CYS 8 24.566 25.807 26.560 67 HB3 CYS 8 HB3 CYS 8 24.480 27.412 25.839 68 H GLU 9 H GLU 9 26.253 29.129 25.396 69 HA GLU 9 HA GLU 9 27.042 29.231 22.634 70 HB2 GLU 9 HB2 GLU 9 26.824 31.289 24.863 71 HB3 GLU 9 HB3 GLU 9 27.488 31.750 23.311 72 HG2 GLU 9 HG2 GLU 9 24.808 30.351 23.326 73 HG3 GLU 9 HG3 GLU 9 24.905 32.032 23.851 74 H LEU 10 H LEU 10 29.039 29.917 25.642 75 HA LEU 10 HA LEU 10 31.292 30.656 23.961 76 HB2 LEU 10 HB2 LEU 10 30.871 30.294 26.916 77 HB3 LEU 10 HB3 LEU 10 32.503 30.340 26.316 78 HG LEU 10 HG LEU 10 31.741 32.526 27.122 79 HD11 LEU 10 HD11 LEU 10 33.537 32.360 25.437 80 HD12 LEU 10 HD12 LEU 10 32.335 32.568 24.144 81 HD13 LEU 10 HD13 LEU 10 32.617 33.865 25.313 82 HD21 LEU 10 HD21 LEU 10 29.897 32.626 24.707 83 HD22 LEU 10 HD22 LEU 10 29.368 32.453 26.400 84 HD23 LEU 10 HD23 LEU 10 30.218 33.920 25.875 85 H SER 11 H SER 11 30.354 27.570 25.438 86 HA SER 11 HA SER 11 32.859 26.253 24.719 87 HB2 SER 11 HB2 SER 11 30.133 25.208 25.545 88 HB3 SER 11 HB3 SER 11 31.507 24.167 25.157 89 HG SER 11 HG SER 11 31.606 26.236 27.130 90 H CYS 12 H CYS 12 29.701 26.735 23.005 91 HA CYS 12 HA CYS 12 30.601 24.984 20.803 92 HB2 CYS 12 HB2 CYS 12 28.177 26.777 20.999 93 HB3 CYS 12 HB3 CYS 12 28.513 25.645 19.748 94 H ARG 13 H ARG 13 30.564 28.461 21.495 95 HA ARG 13 HA ARG 13 31.177 29.445 18.883 96 HB2 ARG 13 HB2 ARG 13 30.512 30.850 20.745 97 HB3 ARG 13 HB3 ARG 13 31.986 30.461 21.641 98 HG2 ARG 13 HG2 ARG 13 33.359 31.634 20.027 99 HG3 ARG 13 HG3 ARG 13 31.992 31.855 18.924 100 HD2 ARG 13 HD2 ARG 13 32.163 32.999 21.740 101 HD3 ARG 13 HD3 ARG 13 32.580 33.902 20.276 102 HE ARG 13 HE ARG 13 30.061 33.074 19.695 103 HH11 ARG 13 HH11 ARG 13 31.319 34.941 22.412 104 HH12 ARG 13 HH12 ARG 13 29.714 35.529 22.831 105 HH21 ARG 13 HH21 ARG 13 28.096 33.884 20.298 106 HH22 ARG 13 HH22 ARG 13 27.946 34.884 21.719 107 H SER 14 H SER 14 33.286 27.985 21.346 108 HA SER 14 HA SER 14 35.777 28.301 20.021 109 HB2 SER 14 HB2 SER 14 35.442 27.386 22.332 110 HB3 SER 14 HB3 SER 14 34.856 25.873 21.605 111 HG SER 14 HG SER 14 37.402 27.111 21.319 112 H LEU 15 H LEU 15 33.135 26.049 19.430 113 HA LEU 15 HA LEU 15 34.534 24.552 17.317 114 HB2 LEU 15 HB2 LEU 15 31.652 24.246 18.213 115 HB3 LEU 15 HB3 LEU 15 32.668 23.071 17.408 116 HG LEU 15 HG LEU 15 32.925 24.029 20.284 117 HD11 LEU 15 HD11 LEU 15 31.013 22.530 19.872 118 HD12 LEU 15 HD12 LEU 15 32.095 21.339 19.115 119 HD13 LEU 15 HD13 LEU 15 32.258 21.727 20.839 120 HD21 LEU 15 HD21 LEU 15 34.618 22.231 20.529 121 HD22 LEU 15 HD22 LEU 15 34.540 21.944 18.774 122 HD23 LEU 15 HD23 LEU 15 35.166 23.481 19.410 123 H GLY 16 H GLY 16 33.148 27.507 17.284 124 HA2 GLY 16 HA2 GLY 16 32.647 28.890 15.513 125 HA3 GLY 16 HA3 GLY 16 32.791 27.527 14.413 126 H LEU 17 H LEU 17 30.468 27.519 17.110 127 HA LEU 17 HA LEU 17 28.235 27.520 15.118 128 HB2 LEU 17 HB2 LEU 17 28.126 26.397 17.899 129 HB3 LEU 17 HB3 LEU 17 27.076 26.028 16.555 130 HG LEU 17 HG LEU 17 29.914 25.142 16.983 131 HD11 LEU 17 HD11 LEU 17 28.929 22.858 16.928 132 HD12 LEU 17 HD12 LEU 17 28.400 23.853 18.277 133 HD13 LEU 17 HD13 LEU 17 27.316 23.597 16.883 134 HD21 LEU 17 HD21 LEU 17 28.077 24.469 14.617 135 HD22 LEU 17 HD22 LEU 17 29.518 25.498 14.505 136 HD23 LEU 17 HD23 LEU 17 29.694 23.789 14.894 137 H LEU 18 H LEU 18 26.097 28.081 16.017 138 HA LEU 18 HA LEU 18 26.058 30.373 17.956 139 HB2 LEU 18 HB2 LEU 18 24.002 29.641 15.836 140 HB3 LEU 18 HB3 LEU 18 24.000 31.077 16.863 141 HG LEU 18 HG LEU 18 26.047 30.437 14.702 142 HD11 LEU 18 HD11 LEU 18 23.830 30.913 13.772 143 HD12 LEU 18 HD12 LEU 18 23.750 32.420 14.716 144 HD13 LEU 18 HD13 LEU 18 24.958 32.233 13.430 145 HD21 LEU 18 HD21 LEU 18 25.639 32.986 16.316 146 HD22 LEU 18 HD22 LEU 18 27.023 31.878 16.448 147 HD23 LEU 18 HD23 LEU 18 26.761 32.785 14.955 148 H GLY 19 H GLY 19 25.293 29.775 19.909 149 HA2 GLY 19 HA2 GLY 19 23.605 27.421 20.323 150 HA3 GLY 19 HA3 GLY 19 24.295 28.472 21.539 151 H ALA 20 H ALA 20 21.523 27.314 20.841 152 HA ALA 20 HA ALA 20 20.151 29.600 22.036 153 HB1 ALA 20 HB1 ALA 20 19.051 28.118 19.615 154 HB2 ALA 20 HB2 ALA 20 18.173 29.326 20.568 155 HB3 ALA 20 HB3 ALA 20 19.612 29.804 19.648 156 H CYS 21 H CYS 21 18.578 29.130 23.414 157 HA CYS 21 HA CYS 21 18.332 26.306 24.391 158 HB2 CYS 21 HB2 CYS 21 19.316 27.783 26.018 159 HB3 CYS 21 HB3 CYS 21 18.057 28.989 25.749 160 H ILE 22 H ILE 22 16.450 25.268 24.503 161 HA ILE 22 HA ILE 22 13.885 26.783 24.502 162 HB ILE 22 HB ILE 22 14.409 24.349 22.755 163 HG12 ILE 22 HG12 ILE 22 13.670 27.214 22.002 164 HG13 ILE 22 HG13 ILE 22 15.254 26.479 21.781 165 HG21 ILE 22 HG21 ILE 22 12.034 24.543 22.097 166 HG22 ILE 22 HG22 ILE 22 12.154 24.264 23.819 167 HG23 ILE 22 HG23 ILE 22 11.815 25.903 23.216 168 HD11 ILE 22 HD11 ILE 22 12.716 25.723 20.308 169 HD12 ILE 22 HD12 ILE 22 14.181 26.474 19.664 170 HD13 ILE 22 HD13 ILE 22 14.236 24.792 20.232 171 H GLY 23 H GLY 23 12.916 26.348 26.360 172 HA2 GLY 23 HA2 GLY 23 11.982 25.242 28.112 173 HA3 GLY 23 HA3 GLY 23 12.125 23.760 27.159 174 H GLU 24 H GLU 24 13.760 22.370 27.553 175 HA GLU 24 HA GLU 24 15.286 22.688 30.115 176 HB2 GLU 24 HB2 GLU 24 15.037 20.280 30.357 177 HB3 GLU 24 HB3 GLU 24 13.452 20.995 30.080 178 HG2 GLU 24 HG2 GLU 24 13.542 20.323 27.699 179 HG3 GLU 24 HG3 GLU 24 15.165 19.677 27.910 180 H GLU 25 H GLU 25 15.987 22.790 26.842 181 HA GLU 25 HA GLU 25 18.630 21.521 27.194 182 HB2 GLU 25 HB2 GLU 25 17.254 19.759 26.372 183 HB3 GLU 25 HB3 GLU 25 16.564 20.798 25.131 184 HG2 GLU 25 HG2 GLU 25 18.038 19.227 24.106 185 HG3 GLU 25 HG3 GLU 25 18.698 20.839 23.908 186 H CYS 26 H CYS 26 20.288 22.275 25.862 187 HA CYS 26 HA CYS 26 19.677 24.644 24.137 188 HB2 CYS 26 HB2 CYS 26 20.953 25.200 26.188 189 HB3 CYS 26 HB3 CYS 26 22.233 24.118 25.652 190 H LYS 27 H LYS 27 20.181 24.578 22.090 191 HA LYS 27 HA LYS 27 22.016 22.454 21.018 192 HB2 LYS 27 HB2 LYS 27 19.632 22.116 20.434 193 HB3 LYS 27 HB3 LYS 27 19.578 23.733 19.729 194 HG2 LYS 27 HG2 LYS 27 21.336 23.057 18.077 195 HG3 LYS 27 HG3 LYS 27 21.371 21.450 18.811 196 HD2 LYS 27 HD2 LYS 27 20.034 21.298 16.858 197 HD3 LYS 27 HD3 LYS 27 18.921 21.214 18.232 198 HE2 LYS 27 HE2 LYS 27 18.231 23.515 17.919 199 HE3 LYS 27 HE3 LYS 27 19.535 23.812 16.756 200 HZ1 LYS 27 HZ1 LYS 27 17.275 21.947 16.301 201 HZ2 LYS 27 HZ2 LYS 27 17.374 23.455 15.699 202 HZ3 LYS 27 HZ3 LYS 27 18.461 22.281 15.225 203 H CYS 28 H CYS 28 23.723 23.153 19.930 204 HA CYS 28 HA CYS 28 23.736 25.932 18.882 205 HB2 CYS 28 HB2 CYS 28 26.184 25.935 19.167 206 HB3 CYS 28 HB3 CYS 28 25.314 25.866 20.684 207 H VAL 29 H VAL 29 24.445 26.316 16.811 208 HA VAL 29 HA VAL 29 24.697 23.939 15.029 209 HB VAL 29 HB VAL 29 22.963 24.833 13.543 210 HG11 VAL 29 HG11 VAL 29 22.403 23.139 15.293 211 HG12 VAL 29 HG12 VAL 29 21.846 24.471 16.334 212 HG13 VAL 29 HG13 VAL 29 21.040 24.153 14.788 213 HG21 VAL 29 HG21 VAL 29 22.336 26.842 15.742 214 HG22 VAL 29 HG22 VAL 29 23.047 27.231 14.163 215 HG23 VAL 29 HG23 VAL 29 21.412 26.571 14.250 216 HA PRO 30 HA PRO 30 27.538 26.245 12.544 217 HB2 PRO 30 HB2 PRO 30 25.973 25.282 10.144 218 HB3 PRO 30 HB3 PRO 30 27.738 25.227 10.426 219 HG2 PRO 30 HG2 PRO 30 26.282 22.996 10.756 220 HG3 PRO 30 HG3 PRO 30 27.514 23.428 11.990 221 HD2 PRO 30 HD2 PRO 30 24.521 23.915 12.066 222 HD3 PRO 30 HD3 PRO 30 25.593 23.229 13.323 223 H TYR 31 H TYR 31 27.847 27.983 11.027 224 HA TYR 31 HA TYR 31 26.039 30.207 11.282 225 HB2 TYR 31 HB2 TYR 31 28.413 29.759 9.428 226 HB3 TYR 31 HB3 TYR 31 27.637 31.298 9.701 227 HD1 TYR 31 HD1 TYR 31 30.517 30.930 9.891 228 HD2 TYR 31 HD2 TYR 31 27.495 30.519 12.941 229 HE1 TYR 31 HE1 TYR 31 32.202 31.478 11.641 230 HE2 TYR 31 HE2 TYR 31 29.175 31.106 14.677 231 HH TYR 31 HH TYR 31 31.315 32.144 14.945 Start of MODEL 14 1 H1 ALA 1 H1 ALA 1 11.446 25.447 31.221 2 H2 ALA 1 H2 ALA 1 12.508 25.602 29.985 3 H3 ALA 1 H3 ALA 1 11.847 26.942 30.644 4 HA ALA 1 HA ALA 1 12.963 26.550 32.719 5 HB1 ALA 1 HB1 ALA 1 14.692 24.725 32.810 6 HB2 ALA 1 HB2 ALA 1 13.021 24.131 32.716 7 HB3 ALA 1 HB3 ALA 1 14.071 24.099 31.274 8 H PHE 2 H PHE 2 15.030 27.398 33.153 9 HA PHE 2 HA PHE 2 16.199 28.870 30.865 10 HB2 PHE 2 HB2 PHE 2 16.631 29.102 33.860 11 HB3 PHE 2 HB3 PHE 2 17.287 30.170 32.635 12 HD1 PHE 2 HD1 PHE 2 14.589 29.689 34.895 13 HD2 PHE 2 HD2 PHE 2 15.523 31.290 31.004 14 HE1 PHE 2 HE1 PHE 2 12.584 31.131 35.014 15 HE2 PHE 2 HE2 PHE 2 13.522 32.747 31.131 16 HZ PHE 2 HZ PHE 2 12.036 32.670 33.126 17 H CYS 3 H CYS 3 17.548 27.478 29.728 18 HA CYS 3 HA CYS 3 19.512 25.743 30.823 19 HB2 CYS 3 HB2 CYS 3 19.878 27.324 28.260 20 HB3 CYS 3 HB3 CYS 3 20.502 25.734 28.655 21 H ASN 4 H ASN 4 21.863 25.971 30.886 22 HA ASN 4 HA ASN 4 22.971 28.587 31.582 23 HB2 ASN 4 HB2 ASN 4 24.255 25.868 31.069 24 HB3 ASN 4 HB3 ASN 4 25.150 27.317 31.405 25 HD21 ASN 4 HD21 ASN 4 23.903 27.535 34.856 26 HD22 ASN 4 HD22 ASN 4 24.212 28.581 33.488 27 H LEU 5 H LEU 5 22.118 29.610 29.650 28 HA LEU 5 HA LEU 5 22.845 28.779 27.036 29 HB2 LEU 5 HB2 LEU 5 20.828 30.053 27.553 30 HB3 LEU 5 HB3 LEU 5 21.800 31.440 28.047 31 HG LEU 5 HG LEU 5 22.609 31.757 25.763 32 HD11 LEU 5 HD11 LEU 5 22.640 29.476 24.876 33 HD12 LEU 5 HD12 LEU 5 20.868 29.367 25.032 34 HD13 LEU 5 HD13 LEU 5 21.615 30.496 23.872 35 HD21 LEU 5 HD21 LEU 5 20.477 32.800 26.465 36 HD22 LEU 5 HD22 LEU 5 20.470 32.417 24.734 37 HD23 LEU 5 HD23 LEU 5 19.581 31.387 25.876 38 H ARG 6 H ARG 6 24.462 31.105 29.214 39 HA ARG 6 HA ARG 6 26.413 31.978 27.210 40 HB2 ARG 6 HB2 ARG 6 26.610 31.937 30.256 41 HB3 ARG 6 HB3 ARG 6 27.779 32.678 29.181 42 HG2 ARG 6 HG2 ARG 6 24.878 33.552 29.495 43 HG3 ARG 6 HG3 ARG 6 26.296 34.313 30.212 44 HD2 ARG 6 HD2 ARG 6 25.906 35.687 28.402 45 HD3 ARG 6 HD3 ARG 6 27.162 34.621 27.788 46 HE ARG 6 HE ARG 6 25.626 33.727 26.233 47 HH11 ARG 6 HH11 ARG 6 23.700 35.536 28.601 48 HH12 ARG 6 HH12 ARG 6 22.331 35.513 27.490 49 HH21 ARG 6 HH21 ARG 6 23.885 33.893 24.986 50 HH22 ARG 6 HH22 ARG 6 22.389 34.628 25.620 51 H ARG 7 H ARG 7 26.395 29.302 29.584 52 HA ARG 7 HA ARG 7 29.070 28.408 28.913 53 HB2 ARG 7 HB2 ARG 7 27.506 27.730 30.922 54 HB3 ARG 7 HB3 ARG 7 26.834 26.557 29.809 55 HG2 ARG 7 HG2 ARG 7 28.428 25.290 30.816 56 HG3 ARG 7 HG3 ARG 7 29.383 25.864 29.449 57 HD2 ARG 7 HD2 ARG 7 29.363 27.052 32.277 58 HD3 ARG 7 HD3 ARG 7 30.558 25.922 31.663 59 HE ARG 7 HE ARG 7 31.518 27.570 30.284 60 HH11 ARG 7 HH11 ARG 7 28.937 29.065 32.178 61 HH12 ARG 7 HH12 ARG 7 29.622 30.645 31.979 62 HH21 ARG 7 HH21 ARG 7 32.277 29.458 30.067 63 HH22 ARG 7 HH22 ARG 7 31.542 30.877 30.834 64 H CYS 8 H CYS 8 25.902 27.377 27.761 65 HA CYS 8 HA CYS 8 26.715 25.489 25.803 66 HB2 CYS 8 HB2 CYS 8 24.417 25.810 26.546 67 HB3 CYS 8 HB3 CYS 8 24.406 27.448 25.900 68 H GLU 9 H GLU 9 26.211 29.062 25.362 69 HA GLU 9 HA GLU 9 27.037 29.109 22.636 70 HB2 GLU 9 HB2 GLU 9 26.915 31.187 24.848 71 HB3 GLU 9 HB3 GLU 9 27.592 31.586 23.275 72 HG2 GLU 9 HG2 GLU 9 25.504 30.944 22.143 73 HG3 GLU 9 HG3 GLU 9 24.764 30.537 23.695 74 H LEU 10 H LEU 10 29.024 29.758 25.614 75 HA LEU 10 HA LEU 10 31.415 30.333 24.143 76 HB2 LEU 10 HB2 LEU 10 30.703 29.807 27.023 77 HB3 LEU 10 HB3 LEU 10 32.373 29.605 26.583 78 HG LEU 10 HG LEU 10 31.913 31.818 27.509 79 HD11 LEU 10 HD11 LEU 10 33.185 33.105 25.903 80 HD12 LEU 10 HD12 LEU 10 33.810 31.453 25.955 81 HD13 LEU 10 HD13 LEU 10 32.790 31.974 24.597 82 HD21 LEU 10 HD21 LEU 10 29.673 32.280 26.648 83 HD22 LEU 10 HD22 LEU 10 30.795 33.559 26.184 84 HD23 LEU 10 HD23 LEU 10 30.292 32.347 24.986 85 H SER 11 H SER 11 30.249 27.237 25.529 86 HA SER 11 HA SER 11 32.548 25.660 24.910 87 HB2 SER 11 HB2 SER 11 30.694 24.895 26.306 88 HB3 SER 11 HB3 SER 11 29.582 24.951 24.931 89 HG SER 11 HG SER 11 30.722 22.886 25.636 90 H CYS 12 H CYS 12 29.820 26.682 22.864 91 HA CYS 12 HA CYS 12 30.746 25.033 20.595 92 HB2 CYS 12 HB2 CYS 12 28.362 26.896 20.812 93 HB3 CYS 12 HB3 CYS 12 28.739 25.812 19.516 94 H ARG 13 H ARG 13 30.991 28.373 21.624 95 HA ARG 13 HA ARG 13 31.520 29.680 19.154 96 HB2 ARG 13 HB2 ARG 13 31.208 30.742 21.414 97 HB3 ARG 13 HB3 ARG 13 32.823 30.189 21.871 98 HG2 ARG 13 HG2 ARG 13 33.767 31.533 19.963 99 HG3 ARG 13 HG3 ARG 13 32.140 32.114 19.591 100 HD2 ARG 13 HD2 ARG 13 33.616 32.514 22.233 101 HD3 ARG 13 HD3 ARG 13 33.491 33.716 20.934 102 HE ARG 13 HE ARG 13 30.849 32.957 21.566 103 HH11 ARG 13 HH11 ARG 13 33.408 34.702 23.309 104 HH12 ARG 13 HH12 ARG 13 32.157 35.602 24.178 105 HH21 ARG 13 HH21 ARG 13 29.515 34.074 22.744 106 HH22 ARG 13 HH22 ARG 13 30.121 35.294 23.889 107 H SER 14 H SER 14 33.638 27.710 21.209 108 HA SER 14 HA SER 14 36.049 28.080 19.665 109 HB2 SER 14 HB2 SER 14 35.177 25.782 21.459 110 HB3 SER 14 HB3 SER 14 36.817 26.006 20.824 111 HG SER 14 HG SER 14 37.085 27.805 22.008 112 H LEU 15 H LEU 15 33.219 26.155 19.055 113 HA LEU 15 HA LEU 15 34.512 24.564 16.902 114 HB2 LEU 15 HB2 LEU 15 31.707 24.414 18.069 115 HB3 LEU 15 HB3 LEU 15 32.419 23.284 16.930 116 HG LEU 15 HG LEU 15 33.274 23.723 19.822 117 HD11 LEU 15 HD11 LEU 15 31.889 21.388 18.432 118 HD12 LEU 15 HD12 LEU 15 32.402 21.431 20.127 119 HD13 LEU 15 HD13 LEU 15 31.136 22.531 19.569 120 HD21 LEU 15 HD21 LEU 15 34.705 21.716 19.485 121 HD22 LEU 15 HD22 LEU 15 34.329 21.744 17.751 122 HD23 LEU 15 HD23 LEU 15 35.246 23.073 18.498 123 H GLY 16 H GLY 16 33.025 27.523 17.242 124 HA2 GLY 16 HA2 GLY 16 32.411 29.093 15.680 125 HA3 GLY 16 HA3 GLY 16 32.590 27.907 14.392 126 H LEU 17 H LEU 17 30.380 27.540 17.226 127 HA LEU 17 HA LEU 17 28.089 27.669 15.297 128 HB2 LEU 17 HB2 LEU 17 27.837 25.993 17.728 129 HB3 LEU 17 HB3 LEU 17 27.078 25.813 16.184 130 HG LEU 17 HG LEU 17 29.918 25.134 16.856 131 HD11 LEU 17 HD11 LEU 17 27.487 23.357 16.533 132 HD12 LEU 17 HD12 LEU 17 29.163 22.759 16.559 133 HD13 LEU 17 HD13 LEU 17 28.518 23.588 17.969 134 HD21 LEU 17 HD21 LEU 17 28.284 24.411 14.360 135 HD22 LEU 17 HD22 LEU 17 29.560 25.638 14.377 136 HD23 LEU 17 HD23 LEU 17 29.971 23.948 14.663 137 H LEU 18 H LEU 18 26.227 28.601 15.847 138 HA LEU 18 HA LEU 18 26.040 30.547 18.057 139 HB2 LEU 18 HB2 LEU 18 24.266 29.622 15.752 140 HB3 LEU 18 HB3 LEU 18 23.692 30.770 16.943 141 HG LEU 18 HG LEU 18 26.222 31.282 15.389 142 HD11 LEU 18 HD11 LEU 18 23.395 32.046 14.583 143 HD12 LEU 18 HD12 LEU 18 24.886 32.599 13.790 144 HD13 LEU 18 HD13 LEU 18 24.445 30.883 13.744 145 HD21 LEU 18 HD21 LEU 18 24.252 33.202 16.662 146 HD22 LEU 18 HD22 LEU 18 25.820 32.725 17.348 147 HD23 LEU 18 HD23 LEU 18 25.762 33.608 15.819 148 H GLY 19 H GLY 19 25.440 29.787 20.082 149 HA2 GLY 19 HA2 GLY 19 23.683 27.450 20.410 150 HA3 GLY 19 HA3 GLY 19 24.362 28.419 21.685 151 H ALA 20 H ALA 20 21.614 27.380 21.126 152 HA ALA 20 HA ALA 20 20.206 29.726 22.164 153 HB1 ALA 20 HB1 ALA 20 18.282 29.422 20.676 154 HB2 ALA 20 HB2 ALA 20 19.738 29.797 19.734 155 HB3 ALA 20 HB3 ALA 20 19.131 28.129 19.804 156 H CYS 21 H CYS 21 18.648 29.184 23.629 157 HA CYS 21 HA CYS 21 18.675 26.421 24.707 158 HB2 CYS 21 HB2 CYS 21 19.063 28.229 26.240 159 HB3 CYS 21 HB3 CYS 21 17.565 29.016 25.752 160 H ILE 22 H ILE 22 17.066 24.956 24.419 161 HA ILE 22 HA ILE 22 14.432 25.897 23.339 162 HB ILE 22 HB ILE 22 16.030 23.481 22.450 163 HG12 ILE 22 HG12 ILE 22 15.393 26.064 20.947 164 HG13 ILE 22 HG13 ILE 22 16.972 25.646 21.609 165 HG21 ILE 22 HG21 ILE 22 13.549 23.139 22.423 166 HG22 ILE 22 HG22 ILE 22 13.373 24.596 21.435 167 HG23 ILE 22 HG23 ILE 22 14.218 23.162 20.804 168 HD11 ILE 22 HD11 ILE 22 17.079 23.653 20.142 169 HD12 ILE 22 HD12 ILE 22 15.585 24.203 19.339 170 HD13 ILE 22 HD13 ILE 22 17.043 25.205 19.279 171 H GLY 23 H GLY 23 13.386 25.847 25.217 172 HA2 GLY 23 HA2 GLY 23 11.899 25.000 26.716 173 HA3 GLY 23 HA3 GLY 23 12.174 23.393 26.047 174 H GLU 24 H GLU 24 14.696 22.834 26.645 175 HA GLU 24 HA GLU 24 15.365 23.290 29.486 176 HB2 GLU 24 HB2 GLU 24 15.240 20.906 30.075 177 HB3 GLU 24 HB3 GLU 24 13.649 21.502 29.605 178 HG2 GLU 24 HG2 GLU 24 13.912 20.490 27.352 179 HG3 GLU 24 HG3 GLU 24 15.531 19.937 27.778 180 H GLU 25 H GLU 25 16.262 22.060 26.292 181 HA GLU 25 HA GLU 25 19.059 21.659 27.258 182 HB2 GLU 25 HB2 GLU 25 17.458 20.038 25.297 183 HB3 GLU 25 HB3 GLU 25 19.226 20.070 25.258 184 HG2 GLU 25 HG2 GLU 25 19.273 19.391 27.664 185 HG3 GLU 25 HG3 GLU 25 17.529 19.176 27.620 186 H CYS 26 H CYS 26 20.493 22.983 26.385 187 HA CYS 26 HA CYS 26 19.709 24.759 24.185 188 HB2 CYS 26 HB2 CYS 26 20.830 25.660 26.143 189 HB3 CYS 26 HB3 CYS 26 22.218 24.604 25.883 190 H LYS 27 H LYS 27 20.286 24.675 22.159 191 HA LYS 27 HA LYS 27 22.193 22.566 21.183 192 HB2 LYS 27 HB2 LYS 27 19.907 22.024 20.601 193 HB3 LYS 27 HB3 LYS 27 19.604 23.657 19.998 194 HG2 LYS 27 HG2 LYS 27 21.047 23.334 18.088 195 HG3 LYS 27 HG3 LYS 27 21.733 21.867 18.785 196 HD2 LYS 27 HD2 LYS 27 20.245 21.162 17.093 197 HD3 LYS 27 HD3 LYS 27 19.506 20.783 18.661 198 HE2 LYS 27 HE2 LYS 27 18.093 22.828 18.464 199 HE3 LYS 27 HE3 LYS 27 18.819 23.171 16.881 200 HZ1 LYS 27 HZ1 LYS 27 16.713 21.973 16.660 201 HZ2 LYS 27 HZ2 LYS 27 17.922 21.074 16.079 202 HZ3 LYS 27 HZ3 LYS 27 17.300 20.707 17.557 203 H CYS 28 H CYS 28 23.673 23.163 19.616 204 HA CYS 28 HA CYS 28 23.685 26.014 18.842 205 HB2 CYS 28 HB2 CYS 28 26.126 26.093 19.014 206 HB3 CYS 28 HB3 CYS 28 25.333 25.854 20.565 207 H VAL 29 H VAL 29 24.504 26.524 16.758 208 HA VAL 29 HA VAL 29 24.685 24.259 14.851 209 HB VAL 29 HB VAL 29 22.956 25.093 13.428 210 HG11 VAL 29 HG11 VAL 29 21.804 24.912 16.235 211 HG12 VAL 29 HG12 VAL 29 20.972 24.601 14.707 212 HG13 VAL 29 HG13 VAL 29 22.274 23.520 15.226 213 HG21 VAL 29 HG21 VAL 29 21.426 26.911 14.098 214 HG22 VAL 29 HG22 VAL 29 22.460 27.263 15.497 215 HG23 VAL 29 HG23 VAL 29 23.069 27.507 13.851 216 HA PRO 30 HA PRO 30 27.723 26.654 12.801 217 HB2 PRO 30 HB2 PRO 30 26.408 25.871 10.204 218 HB3 PRO 30 HB3 PRO 30 28.139 25.786 10.649 219 HG2 PRO 30 HG2 PRO 30 26.626 23.549 10.679 220 HG3 PRO 30 HG3 PRO 30 27.764 23.870 12.026 221 HD2 PRO 30 HD2 PRO 30 24.773 24.328 11.938 222 HD3 PRO 30 HD3 PRO 30 25.781 23.621 13.232 223 H TYR 31 H TYR 31 28.179 28.599 11.721 224 HA TYR 31 HA TYR 31 26.178 30.661 11.678 225 HB2 TYR 31 HB2 TYR 31 28.925 30.626 10.380 226 HB3 TYR 31 HB3 TYR 31 27.972 32.053 10.771 227 HD1 TYR 31 HD1 TYR 31 27.281 30.639 13.662 228 HD2 TYR 31 HD2 TYR 31 30.835 31.696 11.487 229 HE1 TYR 31 HE1 TYR 31 28.538 30.832 15.803 230 HE2 TYR 31 HE2 TYR 31 32.100 31.863 13.615 231 HH TYR 31 HH TYR 31 32.025 31.591 15.941 Start of MODEL 15 1 H1 ALA 1 H1 ALA 1 17.133 23.507 38.160 2 H2 ALA 1 H2 ALA 1 16.513 24.917 38.712 3 H3 ALA 1 H3 ALA 1 17.604 24.086 39.625 4 HA ALA 1 HA ALA 1 18.606 26.017 38.586 5 HB1 ALA 1 HB1 ALA 1 20.567 24.886 37.657 6 HB2 ALA 1 HB2 ALA 1 20.026 24.068 39.132 7 HB3 ALA 1 HB3 ALA 1 19.673 23.358 37.539 8 H PHE 2 H PHE 2 18.221 27.430 36.985 9 HA PHE 2 HA PHE 2 16.954 26.603 34.479 10 HB2 PHE 2 HB2 PHE 2 17.982 29.316 35.381 11 HB3 PHE 2 HB3 PHE 2 16.971 29.005 33.982 12 HD1 PHE 2 HD1 PHE 2 16.908 29.904 37.430 13 HD2 PHE 2 HD2 PHE 2 14.693 27.745 34.424 14 HE1 PHE 2 HE1 PHE 2 14.855 30.050 38.823 15 HE2 PHE 2 HE2 PHE 2 12.654 27.904 35.823 16 HZ PHE 2 HZ PHE 2 12.731 29.046 38.030 17 H CYS 3 H CYS 3 17.778 27.374 32.375 18 HA CYS 3 HA CYS 3 20.201 25.957 31.868 19 HB2 CYS 3 HB2 CYS 3 18.158 26.077 30.432 20 HB3 CYS 3 HB3 CYS 3 18.599 27.723 29.979 21 H ASN 4 H ASN 4 22.232 26.545 31.414 22 HA ASN 4 HA ASN 4 23.143 29.329 31.820 23 HB2 ASN 4 HB2 ASN 4 24.566 26.641 31.579 24 HB3 ASN 4 HB3 ASN 4 25.397 28.192 31.595 25 HD21 ASN 4 HD21 ASN 4 24.575 28.848 35.050 26 HD22 ASN 4 HD22 ASN 4 25.071 29.589 33.525 27 H LEU 5 H LEU 5 22.121 30.107 29.885 28 HA LEU 5 HA LEU 5 22.644 29.190 27.295 29 HB2 LEU 5 HB2 LEU 5 20.851 30.786 27.984 30 HB3 LEU 5 HB3 LEU 5 22.077 32.040 28.209 31 HG LEU 5 HG LEU 5 22.654 31.892 25.792 32 HD11 LEU 5 HD11 LEU 5 20.324 29.930 25.718 33 HD12 LEU 5 HD12 LEU 5 21.026 30.709 24.293 34 HD13 LEU 5 HD13 LEU 5 22.015 29.603 25.240 35 HD21 LEU 5 HD21 LEU 5 21.016 33.539 26.559 36 HD22 LEU 5 HD22 LEU 5 20.578 32.944 24.957 37 HD23 LEU 5 HD23 LEU 5 19.700 32.352 26.384 38 H ARG 6 H ARG 6 24.554 31.556 29.198 39 HA ARG 6 HA ARG 6 26.540 32.133 27.217 40 HB2 ARG 6 HB2 ARG 6 26.680 31.972 30.255 41 HB3 ARG 6 HB3 ARG 6 28.033 32.528 29.286 42 HG2 ARG 6 HG2 ARG 6 25.334 33.899 29.087 43 HG3 ARG 6 HG3 ARG 6 26.454 34.254 30.402 44 HD2 ARG 6 HD2 ARG 6 26.775 35.898 28.693 45 HD3 ARG 6 HD3 ARG 6 28.198 34.850 28.774 46 HE ARG 6 HE ARG 6 26.101 34.216 26.765 47 HH11 ARG 6 HH11 ARG 6 29.294 35.662 27.243 48 HH12 ARG 6 HH12 ARG 6 29.532 35.793 25.509 49 HH21 ARG 6 HH21 ARG 6 26.639 34.089 24.703 50 HH22 ARG 6 HH22 ARG 6 28.195 34.644 24.114 51 H ARG 7 H ARG 7 26.623 29.547 29.703 52 HA ARG 7 HA ARG 7 29.128 28.440 28.778 53 HB2 ARG 7 HB2 ARG 7 28.149 28.040 31.025 54 HB3 ARG 7 HB3 ARG 7 26.877 27.054 30.298 55 HG2 ARG 7 HG2 ARG 7 28.213 25.242 30.000 56 HG3 ARG 7 HG3 ARG 7 29.622 26.198 29.524 57 HD2 ARG 7 HD2 ARG 7 28.653 25.986 32.399 58 HD3 ARG 7 HD3 ARG 7 29.889 24.933 31.683 59 HE ARG 7 HE ARG 7 30.821 27.455 31.073 60 HH11 ARG 7 HH11 ARG 7 29.981 26.069 34.220 61 HH12 ARG 7 HH12 ARG 7 31.143 27.137 34.997 62 HH21 ARG 7 HH21 ARG 7 32.207 28.578 32.080 63 HH22 ARG 7 HH22 ARG 7 32.459 28.463 33.812 64 H CYS 8 H CYS 8 25.777 27.736 27.892 65 HA CYS 8 HA CYS 8 26.336 25.661 25.986 66 HB2 CYS 8 HB2 CYS 8 24.083 26.207 26.830 67 HB3 CYS 8 HB3 CYS 8 24.163 27.791 26.076 68 H GLU 9 H GLU 9 26.037 29.211 25.378 69 HA GLU 9 HA GLU 9 26.727 29.071 22.613 70 HB2 GLU 9 HB2 GLU 9 26.877 31.289 24.694 71 HB3 GLU 9 HB3 GLU 9 27.259 31.559 22.994 72 HG2 GLU 9 HG2 GLU 9 25.039 30.928 22.290 73 HG3 GLU 9 HG3 GLU 9 24.566 30.471 23.916 74 H LEU 10 H LEU 10 28.821 29.801 25.441 75 HA LEU 10 HA LEU 10 31.203 30.364 23.986 76 HB2 LEU 10 HB2 LEU 10 30.503 29.638 26.836 77 HB3 LEU 10 HB3 LEU 10 32.162 29.466 26.362 78 HG LEU 10 HG LEU 10 31.657 31.601 27.488 79 HD11 LEU 10 HD11 LEU 10 33.641 31.286 26.042 80 HD12 LEU 10 HD12 LEU 10 32.703 31.899 24.659 81 HD13 LEU 10 HD13 LEU 10 33.057 32.956 26.043 82 HD21 LEU 10 HD21 LEU 10 30.256 32.382 24.893 83 HD22 LEU 10 HD22 LEU 10 29.497 32.216 26.492 84 HD23 LEU 10 HD23 LEU 10 30.716 33.463 26.218 85 H SER 11 H SER 11 30.037 27.244 25.382 86 HA SER 11 HA SER 11 32.382 25.744 24.728 87 HB2 SER 11 HB2 SER 11 30.671 24.923 26.246 88 HB3 SER 11 HB3 SER 11 29.474 24.906 24.937 89 HG SER 11 HG SER 11 31.841 23.343 25.153 90 H CYS 12 H CYS 12 29.560 26.634 22.746 91 HA CYS 12 HA CYS 12 30.495 24.930 20.517 92 HB2 CYS 12 HB2 CYS 12 28.133 26.816 20.650 93 HB3 CYS 12 HB3 CYS 12 28.499 25.653 19.423 94 H ARG 13 H ARG 13 30.689 28.346 21.422 95 HA ARG 13 HA ARG 13 31.431 29.335 18.822 96 HB2 ARG 13 HB2 ARG 13 30.784 30.756 20.765 97 HB3 ARG 13 HB3 ARG 13 32.341 30.386 21.535 98 HG2 ARG 13 HG2 ARG 13 33.551 31.445 19.671 99 HG3 ARG 13 HG3 ARG 13 32.057 31.587 18.738 100 HD2 ARG 13 HD2 ARG 13 32.589 33.735 19.621 101 HD3 ARG 13 HD3 ARG 13 31.146 33.138 20.462 102 HE ARG 13 HE ARG 13 33.423 32.388 22.007 103 HH11 ARG 13 HH11 ARG 13 31.845 35.377 21.063 104 HH12 ARG 13 HH12 ARG 13 32.438 36.219 22.469 105 HH21 ARG 13 HH21 ARG 13 34.135 33.440 23.676 106 HH22 ARG 13 HH22 ARG 13 33.725 35.123 23.983 107 H SER 14 H SER 14 33.337 27.659 21.314 108 HA SER 14 HA SER 14 35.893 27.840 20.064 109 HB2 SER 14 HB2 SER 14 34.709 25.509 21.627 110 HB3 SER 14 HB3 SER 14 36.437 25.821 21.330 111 HG SER 14 HG SER 14 35.720 26.600 23.380 112 H LEU 15 H LEU 15 33.060 26.143 19.030 113 HA LEU 15 HA LEU 15 34.495 24.554 16.964 114 HB2 LEU 15 HB2 LEU 15 31.603 24.325 17.866 115 HB3 LEU 15 HB3 LEU 15 32.509 23.180 16.894 116 HG LEU 15 HG LEU 15 33.052 23.787 19.839 117 HD11 LEU 15 HD11 LEU 15 31.609 21.458 18.532 118 HD12 LEU 15 HD12 LEU 15 32.035 21.590 20.256 119 HD13 LEU 15 HD13 LEU 15 30.876 22.721 19.538 120 HD21 LEU 15 HD21 LEU 15 35.061 22.951 18.686 121 HD22 LEU 15 HD22 LEU 15 34.399 21.714 19.760 122 HD23 LEU 15 HD23 LEU 15 34.125 21.599 18.010 123 H GLY 16 H GLY 16 33.200 27.555 17.204 124 HA2 GLY 16 HA2 GLY 16 32.582 29.107 15.630 125 HA3 GLY 16 HA3 GLY 16 32.771 27.891 14.367 126 H LEU 17 H LEU 17 30.471 27.592 17.113 127 HA LEU 17 HA LEU 17 28.203 27.944 15.180 128 HB2 LEU 17 HB2 LEU 17 27.877 26.249 17.600 129 HB3 LEU 17 HB3 LEU 17 27.052 26.148 16.081 130 HG LEU 17 HG LEU 17 29.847 25.214 16.658 131 HD11 LEU 17 HD11 LEU 17 28.889 22.935 16.389 132 HD12 LEU 17 HD12 LEU 17 28.303 23.815 17.795 133 HD13 LEU 17 HD13 LEU 17 27.269 23.664 16.351 134 HD21 LEU 17 HD21 LEU 17 29.732 24.066 14.450 135 HD22 LEU 17 HD22 LEU 17 28.093 24.699 14.189 136 HD23 LEU 17 HD23 LEU 17 29.486 25.794 14.203 137 H LEU 18 H LEU 18 26.329 28.889 15.881 138 HA LEU 18 HA LEU 18 26.312 30.701 18.225 139 HB2 LEU 18 HB2 LEU 18 24.286 29.910 16.084 140 HB3 LEU 18 HB3 LEU 18 23.896 31.006 17.401 141 HG LEU 18 HG LEU 18 26.169 31.563 15.479 142 HD11 LEU 18 HD11 LEU 18 23.237 32.320 15.240 143 HD12 LEU 18 HD12 LEU 18 24.556 33.032 14.264 144 HD13 LEU 18 HD13 LEU 18 24.181 31.308 14.139 145 HD21 LEU 18 HD21 LEU 18 26.164 32.899 17.563 146 HD22 LEU 18 HD22 LEU 18 25.765 33.915 16.176 147 HD23 LEU 18 HD23 LEU 18 24.481 33.368 17.276 148 H GLY 19 H GLY 19 25.651 29.945 20.221 149 HA2 GLY 19 HA2 GLY 19 23.987 27.492 20.377 150 HA3 GLY 19 HA3 GLY 19 24.676 28.320 21.731 151 H ALA 20 H ALA 20 22.073 27.304 21.422 152 HA ALA 20 HA ALA 20 20.576 29.583 22.463 153 HB1 ALA 20 HB1 ALA 20 18.559 28.994 21.158 154 HB2 ALA 20 HB2 ALA 20 19.881 29.503 20.090 155 HB3 ALA 20 HB3 ALA 20 19.491 27.776 20.258 156 H CYS 21 H CYS 21 18.867 28.842 23.872 157 HA CYS 21 HA CYS 21 18.904 25.940 24.537 158 HB2 CYS 21 HB2 CYS 21 20.283 27.148 26.150 159 HB3 CYS 21 HB3 CYS 21 18.875 28.123 26.625 160 H ILE 22 H ILE 22 17.091 24.981 24.428 161 HA ILE 22 HA ILE 22 14.521 26.486 24.229 162 HB ILE 22 HB ILE 22 15.273 23.632 23.465 163 HG12 ILE 22 HG12 ILE 22 14.722 26.064 21.695 164 HG13 ILE 22 HG13 ILE 22 16.319 25.392 22.019 165 HG21 ILE 22 HG21 ILE 22 13.060 23.509 22.410 166 HG22 ILE 22 HG22 ILE 22 12.860 23.865 24.113 167 HG23 ILE 22 HG23 ILE 22 12.693 25.173 22.922 168 HD11 ILE 22 HD11 ILE 22 15.611 23.229 20.979 169 HD12 ILE 22 HD12 ILE 22 14.094 24.020 20.477 170 HD13 ILE 22 HD13 ILE 22 15.644 24.616 19.872 171 H GLY 23 H GLY 23 13.941 26.871 26.329 172 HA2 GLY 23 HA2 GLY 23 13.183 26.574 28.451 173 HA3 GLY 23 HA3 GLY 23 12.838 24.902 28.022 174 H GLU 24 H GLU 24 14.887 23.502 27.958 175 HA GLU 24 HA GLU 24 16.868 24.097 30.103 176 HB2 GLU 24 HB2 GLU 24 16.417 22.034 31.251 177 HB3 GLU 24 HB3 GLU 24 14.904 22.924 31.100 178 HG2 GLU 24 HG2 GLU 24 14.483 21.477 28.970 179 HG3 GLU 24 HG3 GLU 24 15.832 20.487 29.515 180 H GLU 25 H GLU 25 16.299 22.966 26.957 181 HA GLU 25 HA GLU 25 18.650 21.146 26.932 182 HB2 GLU 25 HB2 GLU 25 16.617 20.230 26.049 183 HB3 GLU 25 HB3 GLU 25 16.404 21.608 24.953 184 HG2 GLU 25 HG2 GLU 25 18.289 20.961 23.618 185 HG3 GLU 25 HG3 GLU 25 18.848 19.816 24.840 186 H CYS 26 H CYS 26 20.521 22.017 26.363 187 HA CYS 26 HA CYS 26 20.746 24.501 24.776 188 HB2 CYS 26 HB2 CYS 26 22.339 24.299 26.511 189 HB3 CYS 26 HB3 CYS 26 22.698 22.627 26.095 190 H LYS 27 H LYS 27 21.201 24.638 22.676 191 HA LYS 27 HA LYS 27 22.271 22.347 21.124 192 HB2 LYS 27 HB2 LYS 27 19.877 24.024 20.247 193 HB3 LYS 27 HB3 LYS 27 20.708 22.839 19.250 194 HG2 LYS 27 HG2 LYS 27 19.259 22.117 21.828 195 HG3 LYS 27 HG3 LYS 27 18.477 22.132 20.250 196 HD2 LYS 27 HD2 LYS 27 20.969 20.473 20.762 197 HD3 LYS 27 HD3 LYS 27 19.339 19.882 21.092 198 HE2 LYS 27 HE2 LYS 27 18.719 20.433 18.708 199 HE3 LYS 27 HE3 LYS 27 20.427 20.800 18.393 200 HZ1 LYS 27 HZ1 LYS 27 19.817 18.525 17.782 201 HZ2 LYS 27 HZ2 LYS 27 20.967 18.496 18.944 202 HZ3 LYS 27 HZ3 LYS 27 19.423 18.153 19.334 203 H CYS 28 H CYS 28 23.486 23.078 19.248 204 HA CYS 28 HA CYS 28 23.627 25.989 18.844 205 HB2 CYS 28 HB2 CYS 28 26.103 25.950 18.903 206 HB3 CYS 28 HB3 CYS 28 25.288 25.781 20.452 207 H VAL 29 H VAL 29 24.464 26.670 16.828 208 HA VAL 29 HA VAL 29 24.509 24.626 14.676 209 HB VAL 29 HB VAL 29 22.739 25.738 13.468 210 HG11 VAL 29 HG11 VAL 29 20.833 24.992 14.731 211 HG12 VAL 29 HG12 VAL 29 22.164 23.869 15.031 212 HG13 VAL 29 HG13 VAL 29 21.720 25.080 16.259 213 HG21 VAL 29 HG21 VAL 29 21.259 27.408 14.527 214 HG22 VAL 29 HG22 VAL 29 22.363 27.511 15.912 215 HG23 VAL 29 HG23 VAL 29 22.892 28.036 14.300 216 HA PRO 30 HA PRO 30 27.436 27.168 12.648 217 HB2 PRO 30 HB2 PRO 30 25.814 26.778 10.127 218 HB3 PRO 30 HB3 PRO 30 27.586 26.635 10.342 219 HG2 PRO 30 HG2 PRO 30 26.077 24.411 10.283 220 HG3 PRO 30 HG3 PRO 30 27.309 24.579 11.581 221 HD2 PRO 30 HD2 PRO 30 24.327 25.126 11.732 222 HD3 PRO 30 HD3 PRO 30 25.370 24.204 12.856 223 H TYR 31 H TYR 31 27.953 29.203 11.886 224 HA TYR 31 HA TYR 31 26.147 31.416 12.211 225 HB2 TYR 31 HB2 TYR 31 28.874 31.234 10.865 226 HB3 TYR 31 HB3 TYR 31 28.017 32.727 11.182 227 HD1 TYR 31 HD1 TYR 31 30.645 30.827 12.347 228 HD2 TYR 31 HD2 TYR 31 27.186 32.964 13.764 229 HE1 TYR 31 HE1 TYR 31 31.738 31.132 14.565 230 HE2 TYR 31 HE2 TYR 31 28.262 33.226 15.998 231 HH TYR 31 HH TYR 31 30.156 32.901 17.243 Start of MODEL 16 1 H1 ALA 1 H1 ALA 1 12.107 28.717 34.708 2 H2 ALA 1 H2 ALA 1 11.117 27.448 34.411 3 H3 ALA 1 H3 ALA 1 11.758 28.315 33.155 4 HA ALA 1 HA ALA 1 13.192 26.588 35.053 5 HB1 ALA 1 HB1 ALA 1 13.773 25.219 33.090 6 HB2 ALA 1 HB2 ALA 1 12.017 25.351 33.262 7 HB3 ALA 1 HB3 ALA 1 12.865 26.312 32.029 8 H PHE 2 H PHE 2 15.494 26.365 34.697 9 HA PHE 2 HA PHE 2 16.742 28.865 33.614 10 HB2 PHE 2 HB2 PHE 2 17.840 27.006 35.734 11 HB3 PHE 2 HB3 PHE 2 18.484 28.569 35.247 12 HD1 PHE 2 HD1 PHE 2 16.847 27.028 37.847 13 HD2 PHE 2 HD2 PHE 2 16.442 30.515 35.340 14 HE1 PHE 2 HE1 PHE 2 15.546 28.162 39.624 15 HE2 PHE 2 HE2 PHE 2 15.155 31.646 37.127 16 HZ PHE 2 HZ PHE 2 14.699 30.478 39.278 17 H CYS 3 H CYS 3 18.597 28.809 32.389 18 HA CYS 3 HA CYS 3 19.607 26.179 31.411 19 HB2 CYS 3 HB2 CYS 3 17.845 27.047 29.899 20 HB3 CYS 3 HB3 CYS 3 18.807 28.496 29.632 21 H ASN 4 H ASN 4 21.814 26.112 31.096 22 HA ASN 4 HA ASN 4 23.404 28.559 31.599 23 HB2 ASN 4 HB2 ASN 4 24.304 25.715 31.049 24 HB3 ASN 4 HB3 ASN 4 25.331 27.114 31.249 25 HD21 ASN 4 HD21 ASN 4 24.883 27.548 34.718 26 HD22 ASN 4 HD22 ASN 4 25.179 28.407 33.196 27 H LEU 5 H LEU 5 22.123 29.419 29.723 28 HA LEU 5 HA LEU 5 22.634 28.689 27.006 29 HB2 LEU 5 HB2 LEU 5 20.736 30.045 27.663 30 HB3 LEU 5 HB3 LEU 5 21.787 31.301 28.310 31 HG LEU 5 HG LEU 5 22.587 31.869 26.058 32 HD11 LEU 5 HD11 LEU 5 21.481 30.935 24.059 33 HD12 LEU 5 HD12 LEU 5 22.377 29.680 24.912 34 HD13 LEU 5 HD13 LEU 5 20.602 29.769 25.070 35 HD21 LEU 5 HD21 LEU 5 19.550 31.715 26.293 36 HD22 LEU 5 HD22 LEU 5 20.589 32.975 26.981 37 HD23 LEU 5 HD23 LEU 5 20.457 32.808 25.225 38 H ARG 6 H ARG 6 24.341 31.030 29.144 39 HA ARG 6 HA ARG 6 26.280 31.912 27.198 40 HB2 ARG 6 HB2 ARG 6 26.192 31.804 30.242 41 HB3 ARG 6 HB3 ARG 6 27.561 32.467 29.379 42 HG2 ARG 6 HG2 ARG 6 24.682 33.481 29.169 43 HG3 ARG 6 HG3 ARG 6 25.938 34.179 30.192 44 HD2 ARG 6 HD2 ARG 6 25.958 34.071 27.145 45 HD3 ARG 6 HD3 ARG 6 25.689 35.492 28.168 46 HE ARG 6 HE ARG 6 28.211 34.202 28.784 47 HH11 ARG 6 HH11 ARG 6 26.848 36.265 26.298 48 HH12 ARG 6 HH12 ARG 6 28.417 36.952 25.948 49 HH21 ARG 6 HH21 ARG 6 30.059 35.215 28.395 50 HH22 ARG 6 HH22 ARG 6 30.136 36.559 27.241 51 H ARG 7 H ARG 7 26.411 29.171 29.569 52 HA ARG 7 HA ARG 7 29.123 28.481 28.839 53 HB2 ARG 7 HB2 ARG 7 27.796 27.812 30.944 54 HB3 ARG 7 HB3 ARG 7 27.001 26.596 29.920 55 HG2 ARG 7 HG2 ARG 7 29.236 25.594 29.410 56 HG3 ARG 7 HG3 ARG 7 30.000 26.835 30.411 57 HD2 ARG 7 HD2 ARG 7 29.789 24.891 31.794 58 HD3 ARG 7 HD3 ARG 7 28.595 26.064 32.364 59 HE ARG 7 HE ARG 7 27.519 24.190 30.379 60 HH11 ARG 7 HH11 ARG 7 27.695 24.791 33.824 61 HH12 ARG 7 HH12 ARG 7 27.036 23.222 34.222 62 HH21 ARG 7 HH21 ARG 7 26.736 22.214 30.956 63 HH22 ARG 7 HH22 ARG 7 26.335 21.881 32.610 64 H CYS 8 H CYS 8 25.959 27.375 27.715 65 HA CYS 8 HA CYS 8 26.797 25.397 25.860 66 HB2 CYS 8 HB2 CYS 8 24.486 25.659 26.586 67 HB3 CYS 8 HB3 CYS 8 24.421 27.283 25.909 68 H GLU 9 H GLU 9 26.073 28.894 25.289 69 HA GLU 9 HA GLU 9 26.865 29.032 22.582 70 HB2 GLU 9 HB2 GLU 9 26.816 31.055 24.853 71 HB3 GLU 9 HB3 GLU 9 27.393 31.496 23.255 72 HG2 GLU 9 HG2 GLU 9 24.812 30.109 23.051 73 HG3 GLU 9 HG3 GLU 9 24.718 31.473 24.164 74 H LEU 10 H LEU 10 28.951 29.841 25.470 75 HA LEU 10 HA LEU 10 31.194 30.393 23.780 76 HB2 LEU 10 HB2 LEU 10 30.810 29.963 26.740 77 HB3 LEU 10 HB3 LEU 10 32.436 29.940 26.096 78 HG LEU 10 HG LEU 10 31.870 32.124 26.972 79 HD11 LEU 10 HD11 LEU 10 32.696 33.472 25.177 80 HD12 LEU 10 HD12 LEU 10 33.454 31.881 25.035 81 HD13 LEU 10 HD13 LEU 10 32.130 32.343 23.942 82 HD21 LEU 10 HD21 LEU 10 29.477 32.292 26.534 83 HD22 LEU 10 HD22 LEU 10 30.335 33.660 25.832 84 HD23 LEU 10 HD23 LEU 10 29.764 32.358 24.778 85 H SER 11 H SER 11 30.271 27.324 25.402 86 HA SER 11 HA SER 11 32.562 25.843 24.541 87 HB2 SER 11 HB2 SER 11 31.041 25.071 26.297 88 HB3 SER 11 HB3 SER 11 29.703 24.966 25.132 89 HG SER 11 HG SER 11 30.952 22.987 25.729 90 H CYS 12 H CYS 12 29.660 26.769 22.740 91 HA CYS 12 HA CYS 12 30.384 24.996 20.477 92 HB2 CYS 12 HB2 CYS 12 28.152 27.028 20.834 93 HB3 CYS 12 HB3 CYS 12 28.355 25.953 19.464 94 H ARG 13 H ARG 13 30.599 28.482 21.318 95 HA ARG 13 HA ARG 13 31.259 29.442 18.715 96 HB2 ARG 13 HB2 ARG 13 31.552 30.431 21.563 97 HB3 ARG 13 HB3 ARG 13 32.200 31.351 20.208 98 HG2 ARG 13 HG2 ARG 13 30.051 31.533 19.135 99 HG3 ARG 13 HG3 ARG 13 29.316 30.401 20.271 100 HD2 ARG 13 HD2 ARG 13 29.753 31.974 22.140 101 HD3 ARG 13 HD3 ARG 13 30.458 33.127 20.995 102 HE ARG 13 HE ARG 13 27.600 32.169 20.973 103 HH11 ARG 13 HH11 ARG 13 29.847 34.786 20.099 104 HH12 ARG 13 HH12 ARG 13 28.540 35.672 19.352 105 HH21 ARG 13 HH21 ARG 13 26.112 33.454 20.396 106 HH22 ARG 13 HH22 ARG 13 26.458 35.092 19.833 107 H SER 14 H SER 14 33.283 28.183 21.325 108 HA SER 14 HA SER 14 35.813 28.719 20.008 109 HB2 SER 14 HB2 SER 14 35.421 28.244 22.460 110 HB3 SER 14 HB3 SER 14 35.250 26.542 22.038 111 HG SER 14 HG SER 14 37.349 26.460 21.475 112 H LEU 15 H LEU 15 33.335 26.560 19.142 113 HA LEU 15 HA LEU 15 35.141 25.002 17.356 114 HB2 LEU 15 HB2 LEU 15 32.299 24.323 18.186 115 HB3 LEU 15 HB3 LEU 15 33.417 23.308 17.266 116 HG LEU 15 HG LEU 15 33.743 24.091 20.192 117 HD11 LEU 15 HD11 LEU 15 33.237 21.755 20.637 118 HD12 LEU 15 HD12 LEU 15 31.893 22.520 19.757 119 HD13 LEU 15 HD13 LEU 15 33.026 21.445 18.899 120 HD21 LEU 15 HD21 LEU 15 35.382 22.216 18.445 121 HD22 LEU 15 HD22 LEU 15 35.946 23.730 19.185 122 HD23 LEU 15 HD23 LEU 15 35.516 22.358 20.212 123 H GLY 16 H GLY 16 33.188 27.663 17.360 124 HA2 GLY 16 HA2 GLY 16 32.544 29.020 15.647 125 HA3 GLY 16 HA3 GLY 16 32.907 27.770 14.471 126 H LEU 17 H LEU 17 30.603 27.369 17.186 127 HA LEU 17 HA LEU 17 28.322 27.582 15.282 128 HB2 LEU 17 HB2 LEU 17 27.507 25.767 17.286 129 HB3 LEU 17 HB3 LEU 17 27.669 25.510 15.568 130 HG LEU 17 HG LEU 17 29.885 24.981 17.517 131 HD11 LEU 17 HD11 LEU 17 29.290 22.602 17.244 132 HD12 LEU 17 HD12 LEU 17 28.004 23.529 18.002 133 HD13 LEU 17 HD13 LEU 17 27.861 23.072 16.295 134 HD21 LEU 17 HD21 LEU 17 29.429 23.966 14.654 135 HD22 LEU 17 HD22 LEU 17 30.639 25.175 15.082 136 HD23 LEU 17 HD23 LEU 17 30.793 23.543 15.708 137 H LEU 18 H LEU 18 26.403 28.357 16.001 138 HA LEU 18 HA LEU 18 26.492 30.234 18.314 139 HB2 LEU 18 HB2 LEU 18 24.667 29.880 15.895 140 HB3 LEU 18 HB3 LEU 18 24.378 31.069 17.130 141 HG LEU 18 HG LEU 18 26.877 30.949 15.398 142 HD11 LEU 18 HD11 LEU 18 24.855 31.473 14.097 143 HD12 LEU 18 HD12 LEU 18 24.434 32.774 15.234 144 HD13 LEU 18 HD13 LEU 18 25.903 32.887 14.239 145 HD21 LEU 18 HD21 LEU 18 25.871 33.110 17.322 146 HD22 LEU 18 HD22 LEU 18 27.331 32.115 17.521 147 HD23 LEU 18 HD23 LEU 18 27.242 33.280 16.205 148 H GLY 19 H GLY 19 25.223 29.984 20.109 149 HA2 GLY 19 HA2 GLY 19 23.433 27.594 20.229 150 HA3 GLY 19 HA3 GLY 19 24.252 28.319 21.588 151 H ALA 20 H ALA 20 21.411 27.622 20.831 152 HA ALA 20 HA ALA 20 20.214 29.859 22.305 153 HB1 ALA 20 HB1 ALA 20 18.220 29.852 20.869 154 HB2 ALA 20 HB2 ALA 20 19.665 30.300 19.938 155 HB3 ALA 20 HB3 ALA 20 18.984 28.663 19.787 156 H CYS 21 H CYS 21 18.421 29.241 23.522 157 HA CYS 21 HA CYS 21 18.248 26.326 24.146 158 HB2 CYS 21 HB2 CYS 21 19.766 27.583 25.640 159 HB3 CYS 21 HB3 CYS 21 18.412 28.592 26.155 160 H ILE 22 H ILE 22 16.470 25.407 24.880 161 HA ILE 22 HA ILE 22 13.911 26.973 24.973 162 HB ILE 22 HB ILE 22 14.363 24.108 24.091 163 HG12 ILE 22 HG12 ILE 22 15.081 25.676 22.347 164 HG13 ILE 22 HG13 ILE 22 13.656 24.775 21.880 165 HG21 ILE 22 HG21 ILE 22 11.794 25.720 24.368 166 HG22 ILE 22 HG22 ILE 22 11.919 24.186 23.481 167 HG23 ILE 22 HG23 ILE 22 12.224 24.224 25.217 168 HD11 ILE 22 HD11 ILE 22 13.527 27.122 21.161 169 HD12 ILE 22 HD12 ILE 22 12.220 26.748 22.295 170 HD13 ILE 22 HD13 ILE 22 13.642 27.673 22.840 171 H GLY 23 H GLY 23 13.869 27.432 27.094 172 HA2 GLY 23 HA2 GLY 23 13.265 27.155 29.283 173 HA3 GLY 23 HA3 GLY 23 12.941 25.462 28.977 174 H GLU 24 H GLU 24 14.941 24.109 28.719 175 HA GLU 24 HA GLU 24 17.207 24.831 30.499 176 HB2 GLU 24 HB2 GLU 24 16.968 22.874 31.808 177 HB3 GLU 24 HB3 GLU 24 15.360 23.593 31.711 178 HG2 GLU 24 HG2 GLU 24 15.042 21.954 29.653 179 HG3 GLU 24 HG3 GLU 24 16.460 21.135 30.289 180 H GLU 25 H GLU 25 16.240 23.475 27.498 181 HA GLU 25 HA GLU 25 18.755 21.878 27.242 182 HB2 GLU 25 HB2 GLU 25 16.054 21.564 25.925 183 HB3 GLU 25 HB3 GLU 25 17.509 20.830 25.267 184 HG2 GLU 25 HG2 GLU 25 16.401 20.312 28.054 185 HG3 GLU 25 HG3 GLU 25 16.191 19.264 26.655 186 H CYS 26 H CYS 26 20.283 22.610 25.943 187 HA CYS 26 HA CYS 26 19.653 24.858 24.083 188 HB2 CYS 26 HB2 CYS 26 20.958 25.434 26.084 189 HB3 CYS 26 HB3 CYS 26 22.185 24.266 25.618 190 H LYS 27 H LYS 27 19.884 24.587 22.036 191 HA LYS 27 HA LYS 27 21.762 22.540 20.916 192 HB2 LYS 27 HB2 LYS 27 19.525 22.029 20.296 193 HB3 LYS 27 HB3 LYS 27 19.153 23.698 19.890 194 HG2 LYS 27 HG2 LYS 27 20.580 23.583 17.896 195 HG3 LYS 27 HG3 LYS 27 21.170 21.986 18.385 196 HD2 LYS 27 HD2 LYS 27 19.546 21.614 16.682 197 HD3 LYS 27 HD3 LYS 27 18.831 21.123 18.218 198 HE2 LYS 27 HE2 LYS 27 17.686 23.415 18.283 199 HE3 LYS 27 HE3 LYS 27 18.239 23.645 16.618 200 HZ1 LYS 27 HZ1 LYS 27 16.008 22.713 16.605 201 HZ2 LYS 27 HZ2 LYS 27 17.003 21.546 16.067 202 HZ3 LYS 27 HZ3 LYS 27 16.452 21.484 17.608 203 H CYS 28 H CYS 28 23.428 23.219 19.802 204 HA CYS 28 HA CYS 28 23.455 25.994 18.757 205 HB2 CYS 28 HB2 CYS 28 25.870 26.083 19.049 206 HB3 CYS 28 HB3 CYS 28 25.018 25.879 20.584 207 H VAL 29 H VAL 29 24.533 26.384 16.794 208 HA VAL 29 HA VAL 29 24.721 24.091 14.922 209 HB VAL 29 HB VAL 29 23.141 25.129 13.362 210 HG11 VAL 29 HG11 VAL 29 21.785 24.682 16.060 211 HG12 VAL 29 HG12 VAL 29 21.098 24.470 14.439 212 HG13 VAL 29 HG13 VAL 29 22.373 23.382 14.991 213 HG21 VAL 29 HG21 VAL 29 21.571 26.887 14.157 214 HG22 VAL 29 HG22 VAL 29 22.522 27.080 15.639 215 HG23 VAL 29 HG23 VAL 29 23.221 27.480 14.053 216 HA PRO 30 HA PRO 30 27.999 26.463 13.247 217 HB2 PRO 30 HB2 PRO 30 27.125 25.614 10.490 218 HB3 PRO 30 HB3 PRO 30 28.752 25.524 11.252 219 HG2 PRO 30 HG2 PRO 30 27.224 23.302 11.071 220 HG3 PRO 30 HG3 PRO 30 28.113 23.657 12.588 221 HD2 PRO 30 HD2 PRO 30 25.189 24.170 11.966 222 HD3 PRO 30 HD3 PRO 30 25.934 23.436 13.413 223 H TYR 31 H TYR 31 28.632 28.346 12.101 224 HA TYR 31 HA TYR 31 26.800 30.463 11.689 225 HB2 TYR 31 HB2 TYR 31 29.458 30.105 10.279 226 HB3 TYR 31 HB3 TYR 31 28.613 31.613 10.564 227 HD1 TYR 31 HD1 TYR 31 31.494 30.241 11.368 228 HD2 TYR 31 HD2 TYR 31 27.971 31.598 13.427 229 HE1 TYR 31 HE1 TYR 31 32.853 30.645 13.411 230 HE2 TYR 31 HE2 TYR 31 29.332 31.999 15.485 231 HH TYR 31 HH TYR 31 31.504 32.134 16.344 Start of MODEL 17 1 H1 ALA 1 H1 ALA 1 15.303 23.960 38.983 2 H2 ALA 1 H2 ALA 1 15.969 22.915 37.912 3 H3 ALA 1 H3 ALA 1 14.863 24.044 37.411 4 HA ALA 1 HA ALA 1 16.387 25.809 38.115 5 HB1 ALA 1 HB1 ALA 1 18.748 25.274 38.386 6 HB2 ALA 1 HB2 ALA 1 17.799 24.390 39.597 7 HB3 ALA 1 HB3 ALA 1 18.418 23.544 38.164 8 H PHE 2 H PHE 2 17.254 26.942 36.449 9 HA PHE 2 HA PHE 2 16.680 25.884 33.819 10 HB2 PHE 2 HB2 PHE 2 17.630 28.618 34.727 11 HB3 PHE 2 HB3 PHE 2 16.939 28.231 33.156 12 HD1 PHE 2 HD1 PHE 2 16.202 29.041 36.643 13 HD2 PHE 2 HD2 PHE 2 14.522 27.404 33.021 14 HE1 PHE 2 HE1 PHE 2 13.922 29.253 37.600 15 HE2 PHE 2 HE2 PHE 2 12.244 27.649 33.967 16 HZ PHE 2 HZ PHE 2 11.942 28.561 36.266 17 H CYS 3 H CYS 3 18.053 26.275 31.920 18 HA CYS 3 HA CYS 3 20.632 25.024 32.230 19 HB2 CYS 3 HB2 CYS 3 20.723 25.184 29.793 20 HB3 CYS 3 HB3 CYS 3 19.168 24.566 30.354 21 H ASN 4 H ASN 4 22.642 25.781 31.285 22 HA ASN 4 HA ASN 4 23.276 28.618 31.867 23 HB2 ASN 4 HB2 ASN 4 24.986 26.153 31.311 24 HB3 ASN 4 HB3 ASN 4 25.600 27.807 31.495 25 HD21 ASN 4 HD21 ASN 4 24.979 28.035 34.966 26 HD22 ASN 4 HD22 ASN 4 25.357 28.904 33.479 27 H LEU 5 H LEU 5 21.996 29.360 30.008 28 HA LEU 5 HA LEU 5 22.469 28.755 27.310 29 HB2 LEU 5 HB2 LEU 5 20.572 29.960 28.173 30 HB3 LEU 5 HB3 LEU 5 21.567 31.300 28.704 31 HG LEU 5 HG LEU 5 20.143 31.663 26.704 32 HD11 LEU 5 HD11 LEU 5 22.083 33.120 27.220 33 HD12 LEU 5 HD12 LEU 5 23.052 32.164 26.067 34 HD13 LEU 5 HD13 LEU 5 21.632 33.049 25.507 35 HD21 LEU 5 HD21 LEU 5 22.176 30.026 25.180 36 HD22 LEU 5 HD22 LEU 5 20.517 29.509 25.583 37 HD23 LEU 5 HD23 LEU 5 20.781 30.925 24.542 38 H ARG 6 H ARG 6 24.165 31.245 29.270 39 HA ARG 6 HA ARG 6 25.874 32.196 27.135 40 HB2 ARG 6 HB2 ARG 6 26.162 32.186 30.165 41 HB3 ARG 6 HB3 ARG 6 27.301 33.011 29.110 42 HG2 ARG 6 HG2 ARG 6 24.321 33.677 29.191 43 HG3 ARG 6 HG3 ARG 6 25.521 34.410 30.246 44 HD2 ARG 6 HD2 ARG 6 25.394 35.984 28.582 45 HD3 ARG 6 HD3 ARG 6 26.791 35.055 28.074 46 HE ARG 6 HE ARG 6 25.509 34.094 26.266 47 HH11 ARG 6 HH11 ARG 6 23.344 36.170 28.172 48 HH12 ARG 6 HH12 ARG 6 22.211 36.184 26.829 49 HH21 ARG 6 HH21 ARG 6 24.121 34.444 24.665 50 HH22 ARG 6 HH22 ARG 6 22.718 35.503 24.917 51 H ARG 7 H ARG 7 26.377 29.633 29.525 52 HA ARG 7 HA ARG 7 29.077 28.959 28.667 53 HB2 ARG 7 HB2 ARG 7 27.957 28.398 30.915 54 HB3 ARG 7 HB3 ARG 7 27.125 27.089 30.042 55 HG2 ARG 7 HG2 ARG 7 29.356 26.132 29.422 56 HG3 ARG 7 HG3 ARG 7 30.136 27.447 30.305 57 HD2 ARG 7 HD2 ARG 7 30.117 25.480 31.704 58 HD3 ARG 7 HD3 ARG 7 29.027 26.690 32.404 59 HE ARG 7 HE ARG 7 27.635 24.838 30.621 60 HH11 ARG 7 HH11 ARG 7 28.787 25.015 33.977 61 HH12 ARG 7 HH12 ARG 7 27.849 23.615 34.392 62 HH21 ARG 7 HH21 ARG 7 26.379 23.273 31.307 63 HH22 ARG 7 HH22 ARG 7 26.302 22.855 33.017 64 H CYS 8 H CYS 8 25.875 27.658 27.858 65 HA CYS 8 HA CYS 8 26.576 25.616 26.068 66 HB2 CYS 8 HB2 CYS 8 24.325 25.905 26.850 67 HB3 CYS 8 HB3 CYS 8 24.244 27.539 26.209 68 H GLU 9 H GLU 9 26.097 29.119 25.325 69 HA GLU 9 HA GLU 9 26.949 29.012 22.586 70 HB2 GLU 9 HB2 GLU 9 27.121 31.226 24.664 71 HB3 GLU 9 HB3 GLU 9 27.493 31.450 22.956 72 HG2 GLU 9 HG2 GLU 9 25.230 30.944 22.308 73 HG3 GLU 9 HG3 GLU 9 24.769 30.519 23.951 74 H LEU 10 H LEU 10 28.879 29.899 25.520 75 HA LEU 10 HA LEU 10 31.280 30.399 24.106 76 HB2 LEU 10 HB2 LEU 10 30.473 29.955 26.961 77 HB3 LEU 10 HB3 LEU 10 32.145 29.653 26.626 78 HG LEU 10 HG LEU 10 31.771 31.910 27.442 79 HD11 LEU 10 HD11 LEU 10 33.168 33.065 25.874 80 HD12 LEU 10 HD12 LEU 10 33.676 31.371 25.922 81 HD13 LEU 10 HD13 LEU 10 32.717 31.968 24.551 82 HD21 LEU 10 HD21 LEU 10 30.790 33.662 26.024 83 HD22 LEU 10 HD22 LEU 10 30.267 32.446 24.838 84 HD23 LEU 10 HD23 LEU 10 29.587 32.458 26.485 85 H SER 11 H SER 11 30.160 27.310 25.488 86 HA SER 11 HA SER 11 32.581 25.857 24.862 87 HB2 SER 11 HB2 SER 11 30.842 25.187 26.549 88 HB3 SER 11 HB3 SER 11 29.768 24.777 25.210 89 HG SER 11 HG SER 11 30.844 22.936 25.811 90 H CYS 12 H CYS 12 29.704 26.691 22.925 91 HA CYS 12 HA CYS 12 30.597 24.899 20.725 92 HB2 CYS 12 HB2 CYS 12 28.259 26.827 20.791 93 HB3 CYS 12 HB3 CYS 12 28.690 25.686 19.549 94 H ARG 13 H ARG 13 30.926 28.300 21.629 95 HA ARG 13 HA ARG 13 31.643 29.344 19.080 96 HB2 ARG 13 HB2 ARG 13 31.196 30.618 21.231 97 HB3 ARG 13 HB3 ARG 13 32.833 30.202 21.751 98 HG2 ARG 13 HG2 ARG 13 33.768 31.398 19.786 99 HG3 ARG 13 HG3 ARG 13 32.136 31.652 19.150 100 HD2 ARG 13 HD2 ARG 13 32.810 33.714 20.092 101 HD3 ARG 13 HD3 ARG 13 31.608 33.028 21.195 102 HE ARG 13 HE ARG 13 34.191 32.209 22.080 103 HH11 ARG 13 HH11 ARG 13 32.434 35.228 21.795 104 HH12 ARG 13 HH12 ARG 13 33.112 35.873 23.273 105 HH21 ARG 13 HH21 ARG 13 35.213 33.195 23.831 106 HH22 ARG 13 HH22 ARG 13 34.744 34.811 24.301 107 H SER 14 H SER 14 33.474 27.289 21.279 108 HA SER 14 HA SER 14 36.042 27.321 20.107 109 HB2 SER 14 HB2 SER 14 34.528 24.828 20.983 110 HB3 SER 14 HB3 SER 14 36.282 25.085 20.996 111 HG SER 14 HG SER 14 35.071 25.252 23.006 112 H LEU 15 H LEU 15 33.043 25.922 18.867 113 HA LEU 15 HA LEU 15 34.435 24.586 16.592 114 HB2 LEU 15 HB2 LEU 15 31.625 24.107 17.625 115 HB3 LEU 15 HB3 LEU 15 32.516 23.133 16.459 116 HG LEU 15 HG LEU 15 33.159 23.440 19.423 117 HD11 LEU 15 HD11 LEU 15 31.120 22.128 18.994 118 HD12 LEU 15 HD12 LEU 15 32.016 21.087 17.864 119 HD13 LEU 15 HD13 LEU 15 32.434 21.100 19.588 120 HD21 LEU 15 HD21 LEU 15 34.757 21.593 19.105 121 HD22 LEU 15 HD22 LEU 15 34.423 21.576 17.364 122 HD23 LEU 15 HD23 LEU 15 35.222 22.977 18.108 123 H GLY 16 H GLY 16 33.226 27.478 17.149 124 HA2 GLY 16 HA2 GLY 16 32.592 29.197 15.765 125 HA3 GLY 16 HA3 GLY 16 32.804 28.102 14.395 126 H LEU 17 H LEU 17 30.461 27.861 17.090 127 HA LEU 17 HA LEU 17 28.220 27.895 15.115 128 HB2 LEU 17 HB2 LEU 17 28.177 26.589 17.819 129 HB3 LEU 17 HB3 LEU 17 27.106 26.274 16.480 130 HG LEU 17 HG LEU 17 29.994 25.479 16.734 131 HD11 LEU 17 HD11 LEU 17 27.478 23.810 16.777 132 HD12 LEU 17 HD12 LEU 17 29.125 23.161 16.634 133 HD13 LEU 17 HD13 LEU 17 28.679 24.050 18.076 134 HD21 LEU 17 HD21 LEU 17 29.724 24.208 14.625 135 HD22 LEU 17 HD22 LEU 17 28.043 24.759 14.486 136 HD23 LEU 17 HD23 LEU 17 29.392 25.907 14.312 137 H LEU 18 H LEU 18 26.111 28.483 15.951 138 HA LEU 18 HA LEU 18 26.058 30.681 17.997 139 HB2 LEU 18 HB2 LEU 18 23.991 29.879 15.907 140 HB3 LEU 18 HB3 LEU 18 23.883 31.257 17.007 141 HG LEU 18 HG LEU 18 25.969 30.894 14.823 142 HD11 LEU 18 HD11 LEU 18 23.707 31.218 13.925 143 HD12 LEU 18 HD12 LEU 18 23.516 32.678 14.918 144 HD13 LEU 18 HD13 LEU 18 24.736 32.628 13.627 145 HD21 LEU 18 HD21 LEU 18 26.486 33.266 15.200 146 HD22 LEU 18 HD22 LEU 18 25.328 33.317 16.551 147 HD23 LEU 18 HD23 LEU 18 26.800 32.333 16.668 148 H GLY 19 H GLY 19 25.663 29.823 19.985 149 HA2 GLY 19 HA2 GLY 19 23.859 27.535 20.328 150 HA3 GLY 19 HA3 GLY 19 24.781 28.336 21.571 151 H ALA 20 H ALA 20 22.011 27.417 21.296 152 HA ALA 20 HA ALA 20 20.813 29.568 22.876 153 HB1 ALA 20 HB1 ALA 20 19.878 29.737 20.530 154 HB2 ALA 20 HB2 ALA 20 19.241 28.087 20.746 155 HB3 ALA 20 HB3 ALA 20 18.670 29.401 21.782 156 H CYS 21 H CYS 21 18.824 28.538 24.013 157 HA CYS 21 HA CYS 21 19.145 25.624 24.577 158 HB2 CYS 21 HB2 CYS 21 20.407 26.569 26.354 159 HB3 CYS 21 HB3 CYS 21 19.189 27.844 26.616 160 H ILE 22 H ILE 22 17.363 24.591 24.367 161 HA ILE 22 HA ILE 22 14.796 26.048 24.071 162 HB ILE 22 HB ILE 22 15.571 23.219 23.265 163 HG12 ILE 22 HG12 ILE 22 15.400 25.718 21.519 164 HG13 ILE 22 HG13 ILE 22 16.902 24.945 22.032 165 HG21 ILE 22 HG21 ILE 22 13.103 23.611 23.620 166 HG22 ILE 22 HG22 ILE 22 13.174 24.925 22.433 167 HG23 ILE 22 HG23 ILE 22 13.499 23.246 21.951 168 HD11 ILE 22 HD11 ILE 22 16.225 22.854 20.847 169 HD12 ILE 22 HD12 ILE 22 14.830 23.736 20.174 170 HD13 ILE 22 HD13 ILE 22 16.476 24.258 19.795 171 H GLY 23 H GLY 23 14.120 26.336 26.169 172 HA2 GLY 23 HA2 GLY 23 12.823 25.836 28.008 173 HA3 GLY 23 HA3 GLY 23 12.722 24.165 27.450 174 H GLU 24 H GLU 24 15.001 23.064 27.644 175 HA GLU 24 HA GLU 24 16.678 23.926 29.906 176 HB2 GLU 24 HB2 GLU 24 16.578 21.857 31.123 177 HB3 GLU 24 HB3 GLU 24 14.951 22.515 30.979 178 HG2 GLU 24 HG2 GLU 24 14.531 20.914 29.068 179 HG3 GLU 24 HG3 GLU 24 16.121 20.207 29.366 180 H GLU 25 H GLU 25 16.438 22.494 26.791 181 HA GLU 25 HA GLU 25 18.999 21.001 27.068 182 HB2 GLU 25 HB2 GLU 25 16.923 20.915 24.864 183 HB3 GLU 25 HB3 GLU 25 18.316 19.852 25.038 184 HG2 GLU 25 HG2 GLU 25 15.978 19.949 26.999 185 HG3 GLU 25 HG3 GLU 25 16.087 18.872 25.621 186 H CYS 26 H CYS 26 20.813 21.941 26.400 187 HA CYS 26 HA CYS 26 20.964 24.336 24.822 188 HB2 CYS 26 HB2 CYS 26 22.644 23.817 26.422 189 HB3 CYS 26 HB3 CYS 26 22.946 22.233 25.705 190 H LYS 27 H LYS 27 21.429 24.710 22.714 191 HA LYS 27 HA LYS 27 21.990 22.543 20.783 192 HB2 LYS 27 HB2 LYS 27 19.562 22.604 20.743 193 HB3 LYS 27 HB3 LYS 27 19.558 24.367 20.653 194 HG2 LYS 27 HG2 LYS 27 18.986 23.561 18.484 195 HG3 LYS 27 HG3 LYS 27 20.622 24.189 18.369 196 HD2 LYS 27 HD2 LYS 27 20.766 22.183 17.202 197 HD3 LYS 27 HD3 LYS 27 21.385 21.730 18.794 198 HE2 LYS 27 HE2 LYS 27 19.033 20.933 19.379 199 HE3 LYS 27 HE3 LYS 27 18.582 21.268 17.690 200 HZ1 LYS 27 HZ1 LYS 27 20.380 19.733 17.030 201 HZ2 LYS 27 HZ2 LYS 27 20.660 19.355 18.591 202 HZ3 LYS 27 HZ3 LYS 27 19.215 18.967 17.883 203 H CYS 28 H CYS 28 23.543 23.213 19.494 204 HA CYS 28 HA CYS 28 23.679 26.088 18.738 205 HB2 CYS 28 HB2 CYS 28 26.126 26.040 18.842 206 HB3 CYS 28 HB3 CYS 28 25.328 25.856 20.404 207 H VAL 29 H VAL 29 24.528 26.609 16.708 208 HA VAL 29 HA VAL 29 24.406 24.413 14.714 209 HB VAL 29 HB VAL 29 22.815 25.543 13.363 210 HG11 VAL 29 HG11 VAL 29 21.905 24.118 15.219 211 HG12 VAL 29 HG12 VAL 29 21.677 25.590 16.185 212 HG13 VAL 29 HG13 VAL 29 20.796 25.381 14.665 213 HG21 VAL 29 HG21 VAL 29 23.344 27.900 13.782 214 HG22 VAL 29 HG22 VAL 29 21.635 27.577 14.043 215 HG23 VAL 29 HG23 VAL 29 22.712 27.754 15.442 216 HA PRO 30 HA PRO 30 27.749 26.427 12.734 217 HB2 PRO 30 HB2 PRO 30 26.406 25.829 10.099 218 HB3 PRO 30 HB3 PRO 30 28.089 25.488 10.609 219 HG2 PRO 30 HG2 PRO 30 26.299 23.491 10.594 220 HG3 PRO 30 HG3 PRO 30 27.405 23.677 11.994 221 HD2 PRO 30 HD2 PRO 30 24.528 24.613 11.748 222 HD3 PRO 30 HD3 PRO 30 25.317 23.691 13.063 223 H TYR 31 H TYR 31 28.493 28.261 11.606 224 HA TYR 31 HA TYR 31 26.782 30.607 11.386 225 HB2 TYR 31 HB2 TYR 31 29.588 30.018 10.385 226 HB3 TYR 31 HB3 TYR 31 28.792 31.572 10.210 227 HD1 TYR 31 HD1 TYR 31 27.746 30.593 13.407 228 HD2 TYR 31 HD2 TYR 31 31.269 31.839 11.243 229 HE1 TYR 31 HE1 TYR 31 28.791 31.326 15.524 230 HE2 TYR 31 HE2 TYR 31 32.330 32.533 13.379 231 HH TYR 31 HH TYR 31 30.624 32.317 16.512 Start of MODEL 18 1 H1 ALA 1 H1 ALA 1 16.968 21.944 36.519 2 H2 ALA 1 H2 ALA 1 17.410 20.363 36.502 3 H3 ALA 1 H3 ALA 1 16.653 21.019 35.199 4 HA ALA 1 HA ALA 1 19.295 21.823 36.203 5 HB1 ALA 1 HB1 ALA 1 18.619 20.072 33.797 6 HB2 ALA 1 HB2 ALA 1 20.235 20.677 34.230 7 HB3 ALA 1 HB3 ALA 1 19.398 19.545 35.308 8 H PHE 2 H PHE 2 19.087 24.004 35.990 9 HA PHE 2 HA PHE 2 17.581 25.423 34.147 10 HB2 PHE 2 HB2 PHE 2 20.219 26.405 35.278 11 HB3 PHE 2 HB3 PHE 2 18.824 27.361 34.797 12 HD1 PHE 2 HD1 PHE 2 20.551 26.268 37.590 13 HD2 PHE 2 HD2 PHE 2 16.518 26.513 36.066 14 HE1 PHE 2 HE1 PHE 2 19.665 26.194 39.907 15 HE2 PHE 2 HE2 PHE 2 15.648 26.418 38.388 16 HZ PHE 2 HZ PHE 2 17.213 26.276 40.310 17 H CYS 3 H CYS 3 17.843 26.391 32.167 18 HA CYS 3 HA CYS 3 19.612 25.192 30.267 19 HB2 CYS 3 HB2 CYS 3 17.302 26.221 29.917 20 HB3 CYS 3 HB3 CYS 3 18.082 27.799 29.928 21 H ASN 4 H ASN 4 21.801 25.491 30.333 22 HA ASN 4 HA ASN 4 22.944 28.003 31.350 23 HB2 ASN 4 HB2 ASN 4 24.341 25.463 30.439 24 HB3 ASN 4 HB3 ASN 4 25.063 26.873 31.197 25 HD21 ASN 4 HD21 ASN 4 23.481 26.173 34.432 26 HD22 ASN 4 HD22 ASN 4 23.898 27.520 33.397 27 H LEU 5 H LEU 5 21.918 29.151 29.532 28 HA LEU 5 HA LEU 5 22.549 28.750 26.828 29 HB2 LEU 5 HB2 LEU 5 20.646 30.058 27.608 30 HB3 LEU 5 HB3 LEU 5 21.720 31.274 28.301 31 HG LEU 5 HG LEU 5 22.503 31.924 26.066 32 HD11 LEU 5 HD11 LEU 5 22.271 29.848 24.790 33 HD12 LEU 5 HD12 LEU 5 20.508 29.852 25.040 34 HD13 LEU 5 HD13 LEU 5 21.284 31.100 24.040 35 HD21 LEU 5 HD21 LEU 5 19.463 31.836 26.224 36 HD22 LEU 5 HD22 LEU 5 20.507 33.011 27.063 37 HD23 LEU 5 HD23 LEU 5 20.448 32.983 25.296 38 H ARG 6 H ARG 6 24.391 30.787 29.179 39 HA ARG 6 HA ARG 6 26.206 31.760 27.070 40 HB2 ARG 6 HB2 ARG 6 26.595 31.765 30.082 41 HB3 ARG 6 HB3 ARG 6 27.593 32.604 28.886 42 HG2 ARG 6 HG2 ARG 6 25.524 33.910 28.189 43 HG3 ARG 6 HG3 ARG 6 24.694 33.189 29.574 44 HD2 ARG 6 HD2 ARG 6 27.085 35.058 29.563 45 HD3 ARG 6 HD3 ARG 6 25.494 35.366 30.250 46 HE ARG 6 HE ARG 6 27.700 33.747 31.388 47 HH11 ARG 6 HH11 ARG 6 24.281 34.508 31.833 48 HH12 ARG 6 HH12 ARG 6 24.399 34.260 33.555 49 HH21 ARG 6 HH21 ARG 6 27.708 33.363 33.543 50 HH22 ARG 6 HH22 ARG 6 26.217 33.492 34.459 51 H ARG 7 H ARG 7 26.379 29.126 29.564 52 HA ARG 7 HA ARG 7 29.099 28.474 28.853 53 HB2 ARG 7 HB2 ARG 7 27.705 27.724 30.944 54 HB3 ARG 7 HB3 ARG 7 27.124 26.431 29.901 55 HG2 ARG 7 HG2 ARG 7 28.952 25.504 31.036 56 HG3 ARG 7 HG3 ARG 7 29.616 25.851 29.449 57 HD2 ARG 7 HD2 ARG 7 29.862 27.851 31.729 58 HD3 ARG 7 HD3 ARG 7 30.899 26.437 31.688 59 HE ARG 7 HE ARG 7 31.568 27.238 29.333 60 HH11 ARG 7 HH11 ARG 7 30.828 29.625 31.846 61 HH12 ARG 7 HH12 ARG 7 32.341 30.445 31.573 62 HH21 ARG 7 HH21 ARG 7 33.312 28.483 28.931 63 HH22 ARG 7 HH22 ARG 7 33.610 29.918 29.910 64 H CYS 8 H CYS 8 26.005 27.280 27.663 65 HA CYS 8 HA CYS 8 26.882 25.478 25.649 66 HB2 CYS 8 HB2 CYS 8 24.583 25.719 26.397 67 HB3 CYS 8 HB3 CYS 8 24.552 27.395 25.880 68 H GLU 9 H GLU 9 26.109 29.029 25.218 69 HA GLU 9 HA GLU 9 27.009 29.215 22.540 70 HB2 GLU 9 HB2 GLU 9 26.786 31.201 24.826 71 HB3 GLU 9 HB3 GLU 9 27.520 31.691 23.311 72 HG2 GLU 9 HG2 GLU 9 24.960 30.296 22.855 73 HG3 GLU 9 HG3 GLU 9 24.784 31.690 23.915 74 H LEU 10 H LEU 10 28.921 29.682 25.539 75 HA LEU 10 HA LEU 10 31.403 30.305 24.276 76 HB2 LEU 10 HB2 LEU 10 30.479 29.386 27.001 77 HB3 LEU 10 HB3 LEU 10 32.161 29.166 26.626 78 HG LEU 10 HG LEU 10 31.730 31.223 27.875 79 HD11 LEU 10 HD11 LEU 10 33.167 32.655 26.520 80 HD12 LEU 10 HD12 LEU 10 33.733 30.977 26.495 81 HD13 LEU 10 HD13 LEU 10 32.871 31.649 25.095 82 HD21 LEU 10 HD21 LEU 10 30.863 33.236 26.763 83 HD22 LEU 10 HD22 LEU 10 30.359 32.264 25.367 84 HD23 LEU 10 HD23 LEU 10 29.614 32.018 26.966 85 H SER 11 H SER 11 30.185 27.123 25.473 86 HA SER 11 HA SER 11 32.453 25.599 24.642 87 HB2 SER 11 HB2 SER 11 30.729 24.879 26.274 88 HB3 SER 11 HB3 SER 11 29.560 24.702 24.954 89 HG SER 11 HG SER 11 30.691 22.987 24.172 90 H CYS 12 H CYS 12 29.922 26.968 22.755 91 HA CYS 12 HA CYS 12 30.598 25.316 20.378 92 HB2 CYS 12 HB2 CYS 12 28.303 27.229 20.889 93 HB3 CYS 12 HB3 CYS 12 28.541 26.244 19.491 94 H ARG 13 H ARG 13 31.054 28.605 21.614 95 HA ARG 13 HA ARG 13 31.626 29.927 19.153 96 HB2 ARG 13 HB2 ARG 13 31.254 30.936 21.468 97 HB3 ARG 13 HB3 ARG 13 32.906 30.465 21.874 98 HG2 ARG 13 HG2 ARG 13 33.757 31.938 20.068 99 HG3 ARG 13 HG3 ARG 13 32.100 32.273 19.549 100 HD2 ARG 13 HD2 ARG 13 32.824 34.162 20.823 101 HD3 ARG 13 HD3 ARG 13 31.637 33.292 21.810 102 HE ARG 13 HE ARG 13 34.400 32.480 22.308 103 HH11 ARG 13 HH11 ARG 13 32.008 34.885 23.408 104 HH12 ARG 13 HH12 ARG 13 33.033 35.298 24.763 105 HH21 ARG 13 HH21 ARG 13 35.555 33.149 23.969 106 HH22 ARG 13 HH22 ARG 13 34.804 34.094 25.257 107 H SER 14 H SER 14 33.663 27.894 21.237 108 HA SER 14 HA SER 14 36.103 28.138 19.712 109 HB2 SER 14 HB2 SER 14 36.715 26.111 21.082 110 HB3 SER 14 HB3 SER 14 36.221 27.539 22.003 111 HG SER 14 HG SER 14 35.174 25.715 22.804 112 H LEU 15 H LEU 15 33.188 26.431 19.076 113 HA LEU 15 HA LEU 15 34.506 24.580 17.127 114 HB2 LEU 15 HB2 LEU 15 31.684 24.608 18.237 115 HB3 LEU 15 HB3 LEU 15 32.350 23.388 17.164 116 HG LEU 15 HG LEU 15 33.230 23.966 20.028 117 HD11 LEU 15 HD11 LEU 15 32.152 21.814 20.541 118 HD12 LEU 15 HD12 LEU 15 30.979 22.951 19.851 119 HD13 LEU 15 HD13 LEU 15 31.638 21.641 18.852 120 HD21 LEU 15 HD21 LEU 15 35.082 23.038 18.665 121 HD22 LEU 15 HD22 LEU 15 34.508 21.885 19.867 122 HD23 LEU 15 HD23 LEU 15 34.041 21.685 18.160 123 H GLY 16 H GLY 16 32.950 27.581 17.203 124 HA2 GLY 16 HA2 GLY 16 32.442 29.016 15.445 125 HA3 GLY 16 HA3 GLY 16 32.647 27.704 14.286 126 H LEU 17 H LEU 17 30.448 27.601 17.108 127 HA LEU 17 HA LEU 17 28.104 27.626 15.259 128 HB2 LEU 17 HB2 LEU 17 27.736 25.987 17.658 129 HB3 LEU 17 HB3 LEU 17 27.268 25.657 16.038 130 HG LEU 17 HG LEU 17 30.009 25.256 17.112 131 HD11 LEU 17 HD11 LEU 17 27.744 23.287 16.860 132 HD12 LEU 17 HD12 LEU 17 29.443 22.795 17.010 133 HD13 LEU 17 HD13 LEU 17 28.707 23.731 18.297 134 HD21 LEU 17 HD21 LEU 17 30.374 23.819 15.111 135 HD22 LEU 17 HD22 LEU 17 28.690 24.059 14.610 136 HD23 LEU 17 HD23 LEU 17 29.842 25.400 14.549 137 H LEU 18 H LEU 18 26.272 28.648 15.913 138 HA LEU 18 HA LEU 18 26.412 30.351 18.331 139 HB2 LEU 18 HB2 LEU 18 24.495 31.492 17.511 140 HB3 LEU 18 HB3 LEU 18 25.782 31.547 16.323 141 HG LEU 18 HG LEU 18 23.623 29.458 15.994 142 HD11 LEU 18 HD11 LEU 18 22.217 31.109 14.797 143 HD12 LEU 18 HD12 LEU 18 22.361 31.505 16.528 144 HD13 LEU 18 HD13 LEU 18 23.300 32.404 15.323 145 HD21 LEU 18 HD21 LEU 18 24.978 31.291 13.973 146 HD22 LEU 18 HD22 LEU 18 25.558 29.656 14.362 147 HD23 LEU 18 HD23 LEU 18 23.967 29.876 13.630 148 H GLY 19 H GLY 19 25.105 30.088 20.082 149 HA2 GLY 19 HA2 GLY 19 23.510 27.585 20.252 150 HA3 GLY 19 HA3 GLY 19 24.160 28.473 21.604 151 H ALA 20 H ALA 20 21.482 27.462 21.183 152 HA ALA 20 HA ALA 20 19.961 29.849 21.939 153 HB1 ALA 20 HB1 ALA 20 19.547 29.702 19.513 154 HB2 ALA 20 HB2 ALA 20 19.116 27.985 19.672 155 HB3 ALA 20 HB3 ALA 20 18.094 29.227 20.414 156 H CYS 21 H CYS 21 18.371 29.355 23.408 157 HA CYS 21 HA CYS 21 18.505 26.705 24.684 158 HB2 CYS 21 HB2 CYS 21 18.477 28.751 26.020 159 HB3 CYS 21 HB3 CYS 21 16.817 29.068 25.468 160 H ILE 22 H ILE 22 17.237 25.016 24.238 161 HA ILE 22 HA ILE 22 14.664 25.439 22.762 162 HB ILE 22 HB ILE 22 16.666 23.160 22.557 163 HG12 ILE 22 HG12 ILE 22 17.497 25.117 21.361 164 HG13 ILE 22 HG13 ILE 22 17.035 23.839 20.261 165 HG21 ILE 22 HG21 ILE 22 14.438 22.254 22.312 166 HG22 ILE 22 HG22 ILE 22 13.968 23.547 21.193 167 HG23 ILE 22 HG23 ILE 22 15.179 22.338 20.716 168 HD11 ILE 22 HD11 ILE 22 14.962 25.043 19.661 169 HD12 ILE 22 HD12 ILE 22 15.376 26.335 20.808 170 HD13 ILE 22 HD13 ILE 22 16.398 26.044 19.395 171 H GLY 23 H GLY 23 13.081 25.231 24.151 172 HA2 GLY 23 HA2 GLY 23 11.738 24.484 25.854 173 HA3 GLY 23 HA3 GLY 23 12.553 22.911 25.756 174 H GLU 24 H GLU 24 14.081 22.421 27.198 175 HA GLU 24 HA GLU 24 14.576 24.273 29.509 176 HB2 GLU 24 HB2 GLU 24 14.761 22.337 30.843 177 HB3 GLU 24 HB3 GLU 24 13.386 22.017 29.783 178 HG2 GLU 24 HG2 GLU 24 15.064 20.768 28.274 179 HG3 GLU 24 HG3 GLU 24 16.242 20.930 29.571 180 H GLU 25 H GLU 25 16.315 23.095 26.789 181 HA GLU 25 HA GLU 25 18.927 23.375 28.194 182 HB2 GLU 25 HB2 GLU 25 18.192 21.000 28.337 183 HB3 GLU 25 HB3 GLU 25 18.076 20.964 26.575 184 HG2 GLU 25 HG2 GLU 25 20.668 21.723 26.780 185 HG3 GLU 25 HG3 GLU 25 20.507 20.988 28.362 186 H CYS 26 H CYS 26 20.531 24.253 26.988 187 HA CYS 26 HA CYS 26 19.837 25.311 24.380 188 HB2 CYS 26 HB2 CYS 26 20.946 26.688 25.988 189 HB3 CYS 26 HB3 CYS 26 22.288 25.559 26.125 190 H LYS 27 H LYS 27 20.501 24.943 22.489 191 HA LYS 27 HA LYS 27 22.401 22.717 21.826 192 HB2 LYS 27 HB2 LYS 27 20.027 22.101 21.442 193 HB3 LYS 27 HB3 LYS 27 19.790 23.554 20.474 194 HG2 LYS 27 HG2 LYS 27 21.423 22.690 18.783 195 HG3 LYS 27 HG3 LYS 27 21.687 21.273 19.809 196 HD2 LYS 27 HD2 LYS 27 20.179 20.634 18.070 197 HD3 LYS 27 HD3 LYS 27 19.305 20.673 19.603 198 HE2 LYS 27 HE2 LYS 27 17.908 21.550 17.823 199 HE3 LYS 27 HE3 LYS 27 18.269 22.820 18.989 200 HZ1 LYS 27 HZ1 LYS 27 19.880 23.739 17.483 201 HZ2 LYS 27 HZ2 LYS 27 19.669 22.501 16.378 202 HZ3 LYS 27 HZ3 LYS 27 18.481 23.569 16.680 203 H CYS 28 H CYS 28 23.746 23.156 19.985 204 HA CYS 28 HA CYS 28 23.597 25.924 18.902 205 HB2 CYS 28 HB2 CYS 28 26.016 26.134 18.995 206 HB3 CYS 28 HB3 CYS 28 25.293 25.948 20.592 207 H VAL 29 H VAL 29 24.537 26.341 16.920 208 HA VAL 29 HA VAL 29 24.622 24.104 14.964 209 HB VAL 29 HB VAL 29 23.008 25.247 13.542 210 HG11 VAL 29 HG11 VAL 29 21.817 24.693 16.289 211 HG12 VAL 29 HG12 VAL 29 20.983 24.627 14.723 212 HG13 VAL 29 HG13 VAL 29 22.262 23.454 15.090 213 HG21 VAL 29 HG21 VAL 29 22.520 27.128 15.908 214 HG22 VAL 29 HG22 VAL 29 23.170 27.577 14.323 215 HG23 VAL 29 HG23 VAL 29 21.508 27.010 14.453 216 HA PRO 30 HA PRO 30 27.927 26.503 13.436 217 HB2 PRO 30 HB2 PRO 30 28.136 25.773 10.786 218 HB3 PRO 30 HB3 PRO 30 28.578 24.720 12.163 219 HG2 PRO 30 HG2 PRO 30 25.998 24.756 10.597 220 HG3 PRO 30 HG3 PRO 30 26.980 23.335 11.080 221 HD2 PRO 30 HD2 PRO 30 24.769 24.112 12.474 222 HD3 PRO 30 HD3 PRO 30 26.201 23.466 13.314 223 H TYR 31 H TYR 31 28.461 28.432 12.474 224 HA TYR 31 HA TYR 31 26.517 30.376 12.018 225 HB2 TYR 31 HB2 TYR 31 29.346 30.309 10.924 226 HB3 TYR 31 HB3 TYR 31 28.359 31.748 11.118 227 HD1 TYR 31 HD1 TYR 31 27.285 31.267 13.947 228 HD2 TYR 31 HD2 TYR 31 31.216 30.866 12.240 229 HE1 TYR 31 HE1 TYR 31 28.300 31.692 16.185 230 HE2 TYR 31 HE2 TYR 31 32.222 31.362 14.448 231 HH TYR 31 HH TYR 31 31.856 31.706 16.662 Start of MODEL 19 1 H1 ALA 1 H1 ALA 1 14.299 25.625 36.424 2 H2 ALA 1 H2 ALA 1 14.189 24.168 37.169 3 H3 ALA 1 H3 ALA 1 14.591 24.233 35.575 4 HA ALA 1 HA ALA 1 16.192 25.328 37.786 5 HB1 ALA 1 HB1 ALA 1 16.660 22.808 36.134 6 HB2 ALA 1 HB2 ALA 1 17.783 23.492 37.329 7 HB3 ALA 1 HB3 ALA 1 16.203 22.870 37.855 8 H PHE 2 H PHE 2 18.089 26.457 37.169 9 HA PHE 2 HA PHE 2 17.750 27.859 34.699 10 HB2 PHE 2 HB2 PHE 2 20.142 27.895 36.557 11 HB3 PHE 2 HB3 PHE 2 19.742 29.101 35.344 12 HD1 PHE 2 HD1 PHE 2 19.720 28.516 38.760 13 HD2 PHE 2 HD2 PHE 2 17.169 30.059 35.634 14 HE1 PHE 2 HE1 PHE 2 18.480 29.866 40.434 15 HE2 PHE 2 HE2 PHE 2 15.931 31.400 37.317 16 HZ PHE 2 HZ PHE 2 16.589 31.308 39.714 17 H CYS 3 H CYS 3 18.237 27.210 32.712 18 HA CYS 3 HA CYS 3 20.417 25.408 32.034 19 HB2 CYS 3 HB2 CYS 3 18.335 25.613 30.705 20 HB3 CYS 3 HB3 CYS 3 18.744 27.286 30.314 21 H ASN 4 H ASN 4 22.508 25.915 31.470 22 HA ASN 4 HA ASN 4 23.501 28.654 31.944 23 HB2 ASN 4 HB2 ASN 4 24.914 26.054 31.248 24 HB3 ASN 4 HB3 ASN 4 25.689 27.623 31.498 25 HD21 ASN 4 HD21 ASN 4 24.167 27.017 35.088 26 HD22 ASN 4 HD22 ASN 4 23.492 28.007 33.841 27 H LEU 5 H LEU 5 22.216 29.546 30.184 28 HA LEU 5 HA LEU 5 22.552 28.919 27.463 29 HB2 LEU 5 HB2 LEU 5 20.729 30.291 28.329 30 HB3 LEU 5 HB3 LEU 5 21.853 31.561 28.781 31 HG LEU 5 HG LEU 5 22.400 32.001 26.426 32 HD11 LEU 5 HD11 LEU 5 20.320 29.849 25.802 33 HD12 LEU 5 HD12 LEU 5 21.050 30.976 24.625 34 HD13 LEU 5 HD13 LEU 5 22.060 29.776 25.418 35 HD21 LEU 5 HD21 LEU 5 19.391 31.908 26.954 36 HD22 LEU 5 HD22 LEU 5 20.504 33.193 27.443 37 HD23 LEU 5 HD23 LEU 5 20.219 32.914 25.729 38 H ARG 6 H ARG 6 24.603 31.247 29.407 39 HA ARG 6 HA ARG 6 26.152 31.980 27.086 40 HB2 ARG 6 HB2 ARG 6 27.309 33.313 28.443 41 HB3 ARG 6 HB3 ARG 6 25.858 33.120 29.425 42 HG2 ARG 6 HG2 ARG 6 27.098 31.325 30.731 43 HG3 ARG 6 HG3 ARG 6 28.565 31.779 29.832 44 HD2 ARG 6 HD2 ARG 6 26.887 33.545 31.639 45 HD3 ARG 6 HD3 ARG 6 28.504 32.883 31.978 46 HE ARG 6 HE ARG 6 28.450 34.496 29.575 47 HH11 ARG 6 HH11 ARG 6 28.636 34.766 33.054 48 HH12 ARG 6 HH12 ARG 6 29.467 36.311 33.004 49 HH21 ARG 6 HH21 ARG 6 29.476 36.380 29.531 50 HH22 ARG 6 HH22 ARG 6 30.069 37.157 30.995 51 H ARG 7 H ARG 7 26.644 29.487 29.573 52 HA ARG 7 HA ARG 7 29.169 28.560 28.546 53 HB2 ARG 7 HB2 ARG 7 28.055 27.968 30.824 54 HB3 ARG 7 HB3 ARG 7 27.121 26.784 29.914 55 HG2 ARG 7 HG2 ARG 7 28.837 25.479 30.681 56 HG3 ARG 7 HG3 ARG 7 29.468 25.896 29.098 57 HD2 ARG 7 HD2 ARG 7 30.167 27.237 31.755 58 HD3 ARG 7 HD3 ARG 7 31.162 26.040 30.942 59 HE ARG 7 HE ARG 7 30.984 28.868 30.393 60 HH11 ARG 7 HH11 ARG 7 31.922 25.811 28.855 61 HH12 ARG 7 HH12 ARG 7 32.795 26.678 27.601 62 HH21 ARG 7 HH21 ARG 7 32.415 29.749 28.866 63 HH22 ARG 7 HH22 ARG 7 33.045 28.686 27.602 64 H CYS 8 H CYS 8 25.853 27.553 27.817 65 HA CYS 8 HA CYS 8 26.331 25.647 25.782 66 HB2 CYS 8 HB2 CYS 8 24.139 26.023 26.686 67 HB3 CYS 8 HB3 CYS 8 24.171 27.713 26.245 68 H GLU 9 H GLU 9 25.853 29.207 25.297 69 HA GLU 9 HA GLU 9 26.486 29.276 22.537 70 HB2 GLU 9 HB2 GLU 9 26.660 31.262 24.845 71 HB3 GLU 9 HB3 GLU 9 27.266 31.734 23.275 72 HG2 GLU 9 HG2 GLU 9 24.509 30.579 23.282 73 HG3 GLU 9 HG3 GLU 9 24.714 32.113 24.120 74 H LEU 10 H LEU 10 28.724 29.903 25.305 75 HA LEU 10 HA LEU 10 30.974 30.433 23.589 76 HB2 LEU 10 HB2 LEU 10 30.552 30.045 26.568 77 HB3 LEU 10 HB3 LEU 10 32.172 30.078 25.923 78 HG LEU 10 HG LEU 10 31.532 32.228 26.835 79 HD11 LEU 10 HD11 LEU 10 31.880 32.411 23.825 80 HD12 LEU 10 HD12 LEU 10 32.389 33.581 25.054 81 HD13 LEU 10 HD13 LEU 10 33.184 32.004 24.972 82 HD21 LEU 10 HD21 LEU 10 30.047 33.761 25.594 83 HD22 LEU 10 HD22 LEU 10 29.495 32.425 24.568 84 HD23 LEU 10 HD23 LEU 10 29.163 32.428 26.321 85 H SER 11 H SER 11 29.892 27.439 25.212 86 HA SER 11 HA SER 11 32.282 25.929 24.624 87 HB2 SER 11 HB2 SER 11 30.665 25.283 26.349 88 HB3 SER 11 HB3 SER 11 29.418 25.049 25.107 89 HG SER 11 HG SER 11 31.883 23.616 25.346 90 H CYS 12 H CYS 12 29.438 26.772 22.706 91 HA CYS 12 HA CYS 12 30.271 25.056 20.452 92 HB2 CYS 12 HB2 CYS 12 28.011 27.056 20.763 93 HB3 CYS 12 HB3 CYS 12 28.256 25.991 19.392 94 H ARG 13 H ARG 13 30.463 28.531 21.375 95 HA ARG 13 HA ARG 13 31.369 29.579 18.909 96 HB2 ARG 13 HB2 ARG 13 30.848 30.939 20.966 97 HB3 ARG 13 HB3 ARG 13 32.362 30.378 21.686 98 HG2 ARG 13 HG2 ARG 13 33.626 31.414 19.760 99 HG3 ARG 13 HG3 ARG 13 32.095 31.964 19.089 100 HD2 ARG 13 HD2 ARG 13 32.957 33.830 20.194 101 HD3 ARG 13 HD3 ARG 13 31.739 33.199 21.317 102 HE ARG 13 HE ARG 13 34.165 31.975 22.064 103 HH11 ARG 13 HH11 ARG 13 32.971 35.312 21.976 104 HH12 ARG 13 HH12 ARG 13 34.076 35.739 23.290 105 HH21 ARG 13 HH21 ARG 13 35.457 32.686 23.667 106 HH22 ARG 13 HH22 ARG 13 35.384 34.380 24.156 107 H SER 14 H SER 14 33.210 27.947 21.480 108 HA SER 14 HA SER 14 35.781 28.242 20.384 109 HB2 SER 14 HB2 SER 14 35.322 27.417 22.661 110 HB3 SER 14 HB3 SER 14 34.666 25.904 21.988 111 HG SER 14 HG SER 14 36.851 25.669 22.583 112 H LEU 15 H LEU 15 33.236 26.052 19.381 113 HA LEU 15 HA LEU 15 34.938 24.464 17.579 114 HB2 LEU 15 HB2 LEU 15 31.909 24.556 17.869 115 HB3 LEU 15 HB3 LEU 15 32.844 23.317 17.071 116 HG LEU 15 HG LEU 15 32.831 23.911 20.063 117 HD11 LEU 15 HD11 LEU 15 31.683 21.598 18.466 118 HD12 LEU 15 HD12 LEU 15 31.683 21.742 20.235 119 HD13 LEU 15 HD13 LEU 15 30.754 22.889 19.255 120 HD21 LEU 15 HD21 LEU 15 34.239 21.674 18.549 121 HD22 LEU 15 HD22 LEU 15 35.037 23.044 19.356 122 HD23 LEU 15 HD23 LEU 15 34.152 21.863 20.311 123 H GLY 16 H GLY 16 32.554 27.078 17.371 124 HA2 GLY 16 HA2 GLY 16 32.720 28.649 15.426 125 HA3 GLY 16 HA3 GLY 16 32.919 27.248 14.382 126 H LEU 17 H LEU 17 30.550 27.334 17.065 127 HA LEU 17 HA LEU 17 28.342 27.733 15.132 128 HB2 LEU 17 HB2 LEU 17 27.378 25.860 17.004 129 HB3 LEU 17 HB3 LEU 17 27.549 25.687 15.278 130 HG LEU 17 HG LEU 17 29.694 24.861 17.221 131 HD11 LEU 17 HD11 LEU 17 28.861 22.575 16.862 132 HD12 LEU 17 HD12 LEU 17 27.611 23.595 17.565 133 HD13 LEU 17 HD13 LEU 17 27.548 23.201 15.840 134 HD21 LEU 17 HD21 LEU 17 29.212 24.159 14.271 135 HD22 LEU 17 HD22 LEU 17 30.609 25.043 14.897 136 HD23 LEU 17 HD23 LEU 17 30.403 23.357 15.312 137 H LEU 18 H LEU 18 26.510 28.729 15.910 138 HA LEU 18 HA LEU 18 26.796 30.246 18.447 139 HB2 LEU 18 HB2 LEU 18 24.848 31.474 17.703 140 HB3 LEU 18 HB3 LEU 18 26.160 31.588 16.544 141 HG LEU 18 HG LEU 18 24.095 29.477 16.008 142 HD11 LEU 18 HD11 LEU 18 22.508 31.101 15.059 143 HD12 LEU 18 HD12 LEU 18 22.664 31.297 16.809 144 HD13 LEU 18 HD13 LEU 18 23.480 32.440 15.716 145 HD21 LEU 18 HD21 LEU 18 25.944 29.979 14.415 146 HD22 LEU 18 HD22 LEU 18 24.340 30.234 13.731 147 HD23 LEU 18 HD23 LEU 18 25.313 31.636 14.242 148 H GLY 19 H GLY 19 25.241 30.122 20.163 149 HA2 GLY 19 HA2 GLY 19 23.599 27.597 20.133 150 HA3 GLY 19 HA3 GLY 19 24.523 28.137 21.516 151 H ALA 20 H ALA 20 21.746 27.386 21.354 152 HA ALA 20 HA ALA 20 20.667 29.625 22.876 153 HB1 ALA 20 HB1 ALA 20 19.752 29.993 20.621 154 HB2 ALA 20 HB2 ALA 20 19.180 28.313 20.557 155 HB3 ALA 20 HB3 ALA 20 18.475 29.449 21.725 156 H CYS 21 H CYS 21 18.797 28.823 24.178 157 HA CYS 21 HA CYS 21 18.925 25.888 24.690 158 HB2 CYS 21 HB2 CYS 21 20.291 26.989 26.344 159 HB3 CYS 21 HB3 CYS 21 18.908 27.974 26.873 160 H ILE 22 H ILE 22 17.149 24.937 24.316 161 HA ILE 22 HA ILE 22 14.603 26.352 24.002 162 HB ILE 22 HB ILE 22 15.221 23.414 23.579 163 HG12 ILE 22 HG12 ILE 22 16.786 24.575 22.171 164 HG13 ILE 22 HG13 ILE 22 15.510 23.896 21.190 165 HG21 ILE 22 HG21 ILE 22 13.001 25.199 22.491 166 HG22 ILE 22 HG22 ILE 22 13.283 23.504 22.031 167 HG23 ILE 22 HG23 ILE 22 12.818 23.910 23.686 168 HD11 ILE 22 HD11 ILE 22 14.464 26.131 20.940 169 HD12 ILE 22 HD12 ILE 22 15.734 26.840 21.968 170 HD13 ILE 22 HD13 ILE 22 16.150 26.126 20.403 171 H GLY 23 H GLY 23 14.501 26.949 26.229 172 HA2 GLY 23 HA2 GLY 23 13.567 26.837 28.344 173 HA3 GLY 23 HA3 GLY 23 12.963 25.222 27.998 174 H GLU 24 H GLU 24 14.484 23.466 28.066 175 HA GLU 24 HA GLU 24 16.489 23.764 30.256 176 HB2 GLU 24 HB2 GLU 24 15.852 21.637 30.994 177 HB3 GLU 24 HB3 GLU 24 14.343 22.455 30.600 178 HG2 GLU 24 HG2 GLU 24 14.438 21.266 28.317 179 HG3 GLU 24 HG3 GLU 24 15.776 20.320 28.950 180 H GLU 25 H GLU 25 16.426 22.980 26.879 181 HA GLU 25 HA GLU 25 18.996 21.471 27.164 182 HB2 GLU 25 HB2 GLU 25 18.478 20.143 25.276 183 HB3 GLU 25 HB3 GLU 25 17.263 19.964 26.537 184 HG2 GLU 25 HG2 GLU 25 15.671 21.328 25.252 185 HG3 GLU 25 HG3 GLU 25 16.895 21.647 24.020 186 H CYS 26 H CYS 26 20.733 22.222 26.254 187 HA CYS 26 HA CYS 26 20.740 24.599 24.567 188 HB2 CYS 26 HB2 CYS 26 22.501 24.239 26.182 189 HB3 CYS 26 HB3 CYS 26 22.859 22.650 25.492 190 H LYS 27 H LYS 27 20.846 24.717 22.401 191 HA LYS 27 HA LYS 27 21.894 22.456 20.804 192 HB2 LYS 27 HB2 LYS 27 19.313 23.888 20.042 193 HB3 LYS 27 HB3 LYS 27 20.172 22.679 19.083 194 HG2 LYS 27 HG2 LYS 27 18.882 22.102 21.769 195 HG3 LYS 27 HG3 LYS 27 18.102 21.850 20.216 196 HD2 LYS 27 HD2 LYS 27 20.751 20.549 20.924 197 HD3 LYS 27 HD3 LYS 27 19.181 19.813 21.290 198 HE2 LYS 27 HE2 LYS 27 18.637 19.974 18.812 199 HE3 LYS 27 HE3 LYS 27 20.304 20.513 18.540 200 HZ1 LYS 27 HZ1 LYS 27 20.120 18.143 18.222 201 HZ2 LYS 27 HZ2 LYS 27 21.052 18.416 19.538 202 HZ3 LYS 27 HZ3 LYS 27 19.481 17.918 19.725 203 H CYS 28 H CYS 28 23.378 23.150 19.433 204 HA CYS 28 HA CYS 28 23.378 26.024 18.650 205 HB2 CYS 28 HB2 CYS 28 25.832 26.053 18.851 206 HB3 CYS 28 HB3 CYS 28 24.996 25.912 20.379 207 H VAL 29 H VAL 29 24.419 26.604 16.719 208 HA VAL 29 HA VAL 29 24.353 24.521 14.595 209 HB VAL 29 HB VAL 29 22.765 25.783 13.281 210 HG11 VAL 29 HG11 VAL 29 20.734 25.400 14.514 211 HG12 VAL 29 HG12 VAL 29 21.878 24.108 14.899 212 HG13 VAL 29 HG13 VAL 29 21.585 25.423 16.069 213 HG21 VAL 29 HG21 VAL 29 22.559 27.730 15.615 214 HG22 VAL 29 HG22 VAL 29 23.229 28.074 14.005 215 HG23 VAL 29 HG23 VAL 29 21.514 27.706 14.178 216 HA PRO 30 HA PRO 30 27.763 26.733 13.122 217 HB2 PRO 30 HB2 PRO 30 27.853 26.225 10.430 218 HB3 PRO 30 HB3 PRO 30 28.132 24.996 11.705 219 HG2 PRO 30 HG2 PRO 30 25.563 25.535 10.194 220 HG3 PRO 30 HG3 PRO 30 26.378 23.966 10.491 221 HD2 PRO 30 HD2 PRO 30 24.326 24.833 12.044 222 HD3 PRO 30 HD3 PRO 30 25.701 23.940 12.750 223 H TYR 31 H TYR 31 28.657 28.447 11.860 224 HA TYR 31 HA TYR 31 26.999 30.784 11.651 225 HB2 TYR 31 HB2 TYR 31 29.797 30.334 10.607 226 HB3 TYR 31 HB3 TYR 31 29.016 31.888 10.876 227 HD1 TYR 31 HD1 TYR 31 31.692 30.705 11.984 228 HD2 TYR 31 HD2 TYR 31 27.754 31.191 13.663 229 HE1 TYR 31 HE1 TYR 31 32.668 30.790 14.257 230 HE2 TYR 31 HE2 TYR 31 28.733 31.251 15.945 231 HH TYR 31 HH TYR 31 30.669 31.422 17.141 Start of MODEL 20 1 H1 ALA 1 H1 ALA 1 13.870 26.359 38.544 2 H2 ALA 1 H2 ALA 1 13.941 25.200 37.368 3 H3 ALA 1 H3 ALA 1 13.311 26.673 37.034 4 HA ALA 1 HA ALA 1 15.433 27.728 37.388 5 HB1 ALA 1 HB1 ALA 1 17.443 26.252 37.586 6 HB2 ALA 1 HB2 ALA 1 16.361 26.104 38.986 7 HB3 ALA 1 HB3 ALA 1 16.377 24.842 37.729 8 H PHE 2 H PHE 2 16.935 27.993 35.617 9 HA PHE 2 HA PHE 2 16.101 26.558 33.121 10 HB2 PHE 2 HB2 PHE 2 16.907 29.448 33.527 11 HB3 PHE 2 HB3 PHE 2 16.667 28.696 31.958 12 HD1 PHE 2 HD1 PHE 2 15.000 30.185 34.821 13 HD2 PHE 2 HD2 PHE 2 14.426 27.695 31.349 14 HE1 PHE 2 HE1 PHE 2 12.563 30.540 34.969 15 HE2 PHE 2 HE2 PHE 2 11.967 28.049 31.498 16 HZ PHE 2 HZ PHE 2 11.031 29.467 33.310 17 H CYS 3 H CYS 3 17.495 26.543 31.375 18 HA CYS 3 HA CYS 3 20.021 25.378 31.764 19 HB2 CYS 3 HB2 CYS 3 20.083 25.502 29.288 20 HB3 CYS 3 HB3 CYS 3 18.577 24.894 29.932 21 H ASN 4 H ASN 4 22.029 26.037 30.642 22 HA ASN 4 HA ASN 4 22.934 28.627 31.782 23 HB2 ASN 4 HB2 ASN 4 24.337 26.056 30.960 24 HB3 ASN 4 HB3 ASN 4 25.160 27.542 31.447 25 HD21 ASN 4 HD21 ASN 4 24.377 27.250 34.865 26 HD22 ASN 4 HD22 ASN 4 25.175 28.174 33.584 27 H LEU 5 H LEU 5 21.974 29.840 30.049 28 HA LEU 5 HA LEU 5 22.379 29.448 27.322 29 HB2 LEU 5 HB2 LEU 5 20.790 30.984 28.598 30 HB3 LEU 5 HB3 LEU 5 22.058 32.199 28.593 31 HG LEU 5 HG LEU 5 21.050 30.867 26.046 32 HD11 LEU 5 HD11 LEU 5 19.461 32.732 25.777 33 HD12 LEU 5 HD12 LEU 5 19.095 31.764 27.213 34 HD13 LEU 5 HD13 LEU 5 19.900 33.334 27.393 35 HD21 LEU 5 HD21 LEU 5 21.681 33.055 25.007 36 HD22 LEU 5 HD22 LEU 5 22.316 33.599 26.571 37 HD23 LEU 5 HD23 LEU 5 23.070 32.238 25.709 38 H ARG 6 H ARG 6 24.534 31.317 29.513 39 HA ARG 6 HA ARG 6 26.267 32.156 27.313 40 HB2 ARG 6 HB2 ARG 6 27.848 32.818 29.069 41 HB3 ARG 6 HB3 ARG 6 26.259 33.561 29.218 42 HG2 ARG 6 HG2 ARG 6 25.681 32.227 31.118 43 HG3 ARG 6 HG3 ARG 6 27.064 31.147 30.893 44 HD2 ARG 6 HD2 ARG 6 27.339 34.108 31.484 45 HD3 ARG 6 HD3 ARG 6 27.342 32.846 32.734 46 HE ARG 6 HE ARG 6 29.254 31.891 31.090 47 HH11 ARG 6 HH11 ARG 6 28.991 35.134 32.440 48 HH12 ARG 6 HH12 ARG 6 30.700 35.445 32.217 49 HH21 ARG 6 HH21 ARG 6 31.320 32.259 31.008 50 HH22 ARG 6 HH22 ARG 6 32.033 33.798 31.508 51 H ARG 7 H ARG 7 26.464 29.473 29.645 52 HA ARG 7 HA ARG 7 29.036 28.530 28.723 53 HB2 ARG 7 HB2 ARG 7 27.873 28.002 30.936 54 HB3 ARG 7 HB3 ARG 7 26.849 26.867 30.037 55 HG2 ARG 7 HG2 ARG 7 28.837 25.559 29.380 56 HG3 ARG 7 HG3 ARG 7 29.899 26.774 30.112 57 HD2 ARG 7 HD2 ARG 7 29.731 24.928 31.637 58 HD3 ARG 7 HD3 ARG 7 28.877 26.306 32.340 59 HE ARG 7 HE ARG 7 27.401 24.177 30.825 60 HH11 ARG 7 HH11 ARG 7 27.796 25.808 33.995 61 HH12 ARG 7 HH12 ARG 7 26.359 25.012 34.582 62 HH21 ARG 7 HH21 ARG 7 25.778 23.174 31.756 63 HH22 ARG 7 HH22 ARG 7 25.308 23.479 33.418 64 H CYS 8 H CYS 8 25.705 27.683 27.833 65 HA CYS 8 HA CYS 8 26.206 25.746 25.848 66 HB2 CYS 8 HB2 CYS 8 24.007 26.182 26.737 67 HB3 CYS 8 HB3 CYS 8 24.047 27.850 26.175 68 H GLU 9 H GLU 9 25.897 29.322 25.344 69 HA GLU 9 HA GLU 9 26.623 29.318 22.575 70 HB2 GLU 9 HB2 GLU 9 26.752 31.310 24.868 71 HB3 GLU 9 HB3 GLU 9 27.607 31.709 23.397 72 HG2 GLU 9 HG2 GLU 9 24.747 30.861 23.074 73 HG3 GLU 9 HG3 GLU 9 25.050 32.405 23.874 74 H LEU 10 H LEU 10 28.799 29.878 25.438 75 HA LEU 10 HA LEU 10 31.110 30.251 23.813 76 HB2 LEU 10 HB2 LEU 10 30.574 29.796 26.739 77 HB3 LEU 10 HB3 LEU 10 32.200 29.500 26.190 78 HG LEU 10 HG LEU 10 31.879 31.757 27.111 79 HD11 LEU 10 HD11 LEU 10 32.652 31.788 24.166 80 HD12 LEU 10 HD12 LEU 10 33.132 32.955 25.410 81 HD13 LEU 10 HD13 LEU 10 33.695 31.273 25.513 82 HD21 LEU 10 HD21 LEU 10 30.786 33.523 25.830 83 HD22 LEU 10 HD22 LEU 10 30.226 32.354 24.623 84 HD23 LEU 10 HD23 LEU 10 29.615 32.280 26.291 85 H SER 11 H SER 11 29.892 27.274 25.359 86 HA SER 11 HA SER 11 32.180 25.665 24.715 87 HB2 SER 11 HB2 SER 11 29.302 24.761 25.120 88 HB3 SER 11 HB3 SER 11 30.753 23.748 25.251 89 HG SER 11 HG SER 11 29.780 25.810 26.879 90 H CYS 12 H CYS 12 29.411 26.636 22.788 91 HA CYS 12 HA CYS 12 30.060 24.785 20.560 92 HB2 CYS 12 HB2 CYS 12 27.996 26.977 20.998 93 HB3 CYS 12 HB3 CYS 12 28.175 26.079 19.506 94 H ARG 13 H ARG 13 30.359 28.227 21.388 95 HA ARG 13 HA ARG 13 31.026 29.232 18.816 96 HB2 ARG 13 HB2 ARG 13 30.129 30.445 20.770 97 HB3 ARG 13 HB3 ARG 13 31.691 30.334 21.585 98 HG2 ARG 13 HG2 ARG 13 32.711 31.827 20.015 99 HG3 ARG 13 HG3 ARG 13 31.364 31.668 18.877 100 HD2 ARG 13 HD2 ARG 13 31.077 32.903 21.635 101 HD3 ARG 13 HD3 ARG 13 31.374 33.836 20.170 102 HE ARG 13 HE ARG 13 28.852 32.506 20.944 103 HH11 ARG 13 HH11 ARG 13 30.508 34.001 18.158 104 HH12 ARG 13 HH12 ARG 13 28.937 34.279 17.411 105 HH21 ARG 13 HH21 ARG 13 27.043 32.808 19.765 106 HH22 ARG 13 HH22 ARG 13 27.178 33.665 18.211 107 H SER 14 H SER 14 33.092 27.863 21.335 108 HA SER 14 HA SER 14 35.613 28.418 20.050 109 HB2 SER 14 HB2 SER 14 35.403 27.654 22.395 110 HB3 SER 14 HB3 SER 14 34.874 26.052 21.813 111 HG SER 14 HG SER 14 37.147 26.064 22.128 112 H LEU 15 H LEU 15 33.137 25.986 19.373 113 HA LEU 15 HA LEU 15 34.891 24.484 17.512 114 HB2 LEU 15 HB2 LEU 15 32.018 23.957 18.349 115 HB3 LEU 15 HB3 LEU 15 33.077 22.866 17.460 116 HG LEU 15 HG LEU 15 33.461 23.775 20.342 117 HD11 LEU 15 HD11 LEU 15 32.894 21.442 20.899 118 HD12 LEU 15 HD12 LEU 15 31.563 22.238 20.047 119 HD13 LEU 15 HD13 LEU 15 32.609 21.091 19.179 120 HD21 LEU 15 HD21 LEU 15 35.648 23.291 19.327 121 HD22 LEU 15 HD22 LEU 15 35.202 21.994 20.438 122 HD23 LEU 15 HD23 LEU 15 35.032 21.749 18.687 123 H GLY 16 H GLY 16 32.976 27.204 17.280 124 HA2 GLY 16 HA2 GLY 16 32.755 28.441 15.292 125 HA3 GLY 16 HA3 GLY 16 32.952 26.988 14.323 126 H LEU 17 H LEU 17 30.529 27.274 16.942 127 HA LEU 17 HA LEU 17 28.406 27.910 15.021 128 HB2 LEU 17 HB2 LEU 17 26.957 26.090 16.066 129 HB3 LEU 17 HB3 LEU 17 28.036 25.703 14.738 130 HG LEU 17 HG LEU 17 28.527 24.985 17.655 131 HD11 LEU 17 HD11 LEU 17 26.547 23.866 16.606 132 HD12 LEU 17 HD12 LEU 17 27.587 23.295 15.290 133 HD13 LEU 17 HD13 LEU 17 27.850 22.728 16.953 134 HD21 LEU 17 HD21 LEU 17 30.665 24.907 16.577 135 HD22 LEU 17 HD22 LEU 17 30.087 23.258 16.610 136 HD23 LEU 17 HD23 LEU 17 29.977 24.193 15.096 137 H LEU 18 H LEU 18 26.612 28.888 15.826 138 HA LEU 18 HA LEU 18 27.085 30.240 18.424 139 HB2 LEU 18 HB2 LEU 18 25.651 31.963 17.655 140 HB3 LEU 18 HB3 LEU 18 26.776 31.566 16.375 141 HG LEU 18 HG LEU 18 24.661 30.001 15.622 142 HD11 LEU 18 HD11 LEU 18 23.459 32.532 16.831 143 HD12 LEU 18 HD12 LEU 18 22.590 31.274 15.921 144 HD13 LEU 18 HD13 LEU 18 23.266 30.914 17.522 145 HD21 LEU 18 HD21 LEU 18 25.798 31.574 14.149 146 HD22 LEU 18 HD22 LEU 18 24.051 31.808 14.047 147 HD23 LEU 18 HD23 LEU 18 25.039 32.952 14.984 148 H GLY 19 H GLY 19 25.751 30.094 20.191 149 HA2 GLY 19 HA2 GLY 19 23.940 27.714 20.101 150 HA3 GLY 19 HA3 GLY 19 24.841 28.247 21.495 151 H ALA 20 H ALA 20 22.171 27.447 21.345 152 HA ALA 20 HA ALA 20 20.974 29.724 22.790 153 HB1 ALA 20 HB1 ALA 20 18.796 29.324 21.685 154 HB2 ALA 20 HB2 ALA 20 20.026 29.789 20.488 155 HB3 ALA 20 HB3 ALA 20 19.535 28.092 20.644 156 H CYS 21 H CYS 21 20.462 28.942 24.817 157 HA CYS 21 HA CYS 21 20.005 26.058 25.131 158 HB2 CYS 21 HB2 CYS 21 20.557 26.210 27.240 159 HB3 CYS 21 HB3 CYS 21 21.462 27.570 26.665 160 H ILE 22 H ILE 22 18.102 25.162 25.753 161 HA ILE 22 HA ILE 22 15.630 26.809 25.327 162 HB ILE 22 HB ILE 22 16.357 24.142 24.092 163 HG12 ILE 22 HG12 ILE 22 15.735 26.689 22.544 164 HG13 ILE 22 HG13 ILE 22 17.368 26.393 23.112 165 HG21 ILE 22 HG21 ILE 22 13.817 25.814 23.785 166 HG22 ILE 22 HG22 ILE 22 14.206 24.357 22.854 167 HG23 ILE 22 HG23 ILE 22 13.929 24.235 24.585 168 HD11 ILE 22 HD11 ILE 22 17.457 24.234 21.925 169 HD12 ILE 22 HD12 ILE 22 15.860 24.586 21.227 170 HD13 ILE 22 HD13 ILE 22 17.235 25.637 20.861 171 H GLY 23 H GLY 23 15.224 26.908 27.515 172 HA2 GLY 23 HA2 GLY 23 14.117 26.304 29.438 173 HA3 GLY 23 HA3 GLY 23 13.709 24.767 28.687 174 H GLU 24 H GLU 24 15.672 23.242 28.519 175 HA GLU 24 HA GLU 24 17.300 23.197 31.044 176 HB2 GLU 24 HB2 GLU 24 16.639 20.969 31.506 177 HB3 GLU 24 HB3 GLU 24 15.146 21.850 31.167 178 HG2 GLU 24 HG2 GLU 24 15.373 20.991 28.744 179 HG3 GLU 24 HG3 GLU 24 16.638 19.914 29.341 180 H GLU 25 H GLU 25 17.348 22.881 27.635 181 HA GLU 25 HA GLU 25 19.825 21.193 27.635 182 HB2 GLU 25 HB2 GLU 25 19.083 20.109 25.684 183 HB3 GLU 25 HB3 GLU 25 17.697 20.120 26.777 184 HG2 GLU 25 HG2 GLU 25 16.889 22.199 25.515 185 HG3 GLU 25 HG3 GLU 25 18.152 21.880 24.327 186 H CYS 26 H CYS 26 21.183 21.504 25.666 187 HA CYS 26 HA CYS 26 21.163 24.323 24.645 188 HB2 CYS 26 HB2 CYS 26 23.007 23.934 26.176 189 HB3 CYS 26 HB3 CYS 26 23.466 22.474 25.300 190 H LYS 27 H LYS 27 21.168 24.665 22.512 191 HA LYS 27 HA LYS 27 22.150 22.571 20.638 192 HB2 LYS 27 HB2 LYS 27 19.650 22.462 20.835 193 HB3 LYS 27 HB3 LYS 27 19.567 24.153 20.322 194 HG2 LYS 27 HG2 LYS 27 20.692 23.489 18.163 195 HG3 LYS 27 HG3 LYS 27 20.622 21.802 18.689 196 HD2 LYS 27 HD2 LYS 27 18.229 23.659 18.323 197 HD3 LYS 27 HD3 LYS 27 18.784 22.468 17.129 198 HE2 LYS 27 HE2 LYS 27 18.382 20.645 18.804 199 HE3 LYS 27 HE3 LYS 27 17.730 21.853 19.927 200 HZ1 LYS 27 HZ1 LYS 27 15.907 20.839 18.720 201 HZ2 LYS 27 HZ2 LYS 27 16.054 22.374 18.165 202 HZ3 LYS 27 HZ3 LYS 27 16.620 21.129 17.276 203 H CYS 28 H CYS 28 23.446 23.399 19.072 204 HA CYS 28 HA CYS 28 23.424 26.337 18.568 205 HB2 CYS 28 HB2 CYS 28 25.954 26.130 18.284 206 HB3 CYS 28 HB3 CYS 28 25.318 26.225 19.895 207 H VAL 29 H VAL 29 24.218 27.068 16.575 208 HA VAL 29 HA VAL 29 23.858 25.130 14.346 209 HB VAL 29 HB VAL 29 22.466 26.678 13.159 210 HG11 VAL 29 HG11 VAL 29 20.448 26.547 14.500 211 HG12 VAL 29 HG12 VAL 29 21.397 25.069 14.724 212 HG13 VAL 29 HG13 VAL 29 21.385 26.322 15.985 213 HG21 VAL 29 HG21 VAL 29 21.537 28.710 14.231 214 HG22 VAL 29 HG22 VAL 29 22.685 28.517 15.572 215 HG23 VAL 29 HG23 VAL 29 23.274 28.840 13.928 216 HA PRO 30 HA PRO 30 27.481 26.812 12.554 217 HB2 PRO 30 HB2 PRO 30 26.072 26.705 9.894 218 HB3 PRO 30 HB3 PRO 30 27.684 26.055 10.337 219 HG2 PRO 30 HG2 PRO 30 25.591 24.386 10.123 220 HG3 PRO 30 HG3 PRO 30 26.695 24.230 11.531 221 HD2 PRO 30 HD2 PRO 30 24.025 25.660 11.384 222 HD3 PRO 30 HD3 PRO 30 24.608 24.477 12.588 223 H TYR 31 H TYR 31 28.473 28.646 11.743 224 HA TYR 31 HA TYR 31 27.118 31.197 11.868 225 HB2 TYR 31 HB2 TYR 31 29.847 30.459 10.750 226 HB3 TYR 31 HB3 TYR 31 29.302 32.079 11.144 227 HD1 TYR 31 HD1 TYR 31 31.849 30.858 12.056 228 HD2 TYR 31 HD2 TYR 31 27.961 30.952 13.919 229 HE1 TYR 31 HE1 TYR 31 32.920 30.769 14.294 230 HE2 TYR 31 HE2 TYR 31 29.032 30.862 16.162 231 HH TYR 31 HH TYR 31 32.528 31.099 16.587
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