NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
637398 | 6d8r | 30461 | 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 19.248 34.630 37.921 2 H2 ALA 1 H2 ALA 1 20.420 33.491 37.697 3 H3 ALA 1 H3 ALA 1 19.058 33.114 38.547 4 HA ALA 1 HA ALA 1 18.959 32.141 36.404 5 HB1 ALA 1 HB1 ALA 1 16.838 32.848 37.492 6 HB2 ALA 1 HB2 ALA 1 16.974 34.439 36.716 7 HB3 ALA 1 HB3 ALA 1 16.750 32.981 35.730 8 H PHE 2 H PHE 2 21.108 32.960 35.526 9 HA PHE 2 HA PHE 2 21.016 35.230 33.688 10 HB2 PHE 2 HB2 PHE 2 23.107 33.078 34.094 11 HB3 PHE 2 HB3 PHE 2 23.290 34.534 33.124 12 HD1 PHE 2 HD1 PHE 2 22.331 36.748 34.660 13 HD2 PHE 2 HD2 PHE 2 24.513 33.266 35.981 14 HE1 PHE 2 HE1 PHE 2 23.227 38.034 36.557 15 HE2 PHE 2 HE2 PHE 2 25.451 34.578 37.868 16 HZ PHE 2 HZ PHE 2 24.823 36.972 38.153 17 H CYS 3 H CYS 3 18.925 33.703 32.942 18 HA CYS 3 HA CYS 3 19.529 31.949 30.689 19 HB2 CYS 3 HB2 CYS 3 17.025 33.332 31.700 20 HB3 CYS 3 HB3 CYS 3 17.062 32.452 30.181 21 H ASN 4 H ASN 4 20.043 32.523 28.704 22 HA ASN 4 HA ASN 4 19.352 35.251 27.644 23 HB2 ASN 4 HB2 ASN 4 21.859 33.535 27.383 24 HB3 ASN 4 HB3 ASN 4 21.465 34.799 26.221 25 HD21 ASN 4 HD21 ASN 4 22.118 37.513 28.411 26 HD22 ASN 4 HD22 ASN 4 21.249 36.982 26.971 27 H LEU 5 H LEU 5 17.289 34.346 26.946 28 HA LEU 5 HA LEU 5 16.951 31.902 25.725 29 HB2 LEU 5 HB2 LEU 5 15.263 33.469 26.674 30 HB3 LEU 5 HB3 LEU 5 15.313 34.406 25.193 31 HG LEU 5 HG LEU 5 13.356 32.949 25.490 32 HD11 LEU 5 HD11 LEU 5 14.927 31.977 23.097 33 HD12 LEU 5 HD12 LEU 5 13.176 32.050 23.293 34 HD13 LEU 5 HD13 LEU 5 14.106 33.550 23.190 35 HD21 LEU 5 HD21 LEU 5 15.200 30.564 25.111 36 HD22 LEU 5 HD22 LEU 5 14.467 31.068 26.659 37 HD23 LEU 5 HD23 LEU 5 13.441 30.553 25.312 38 H ARG 6 H ARG 6 17.706 34.947 23.935 39 HA ARG 6 HA ARG 6 17.614 33.713 21.346 40 HB2 ARG 6 HB2 ARG 6 18.989 35.582 20.515 41 HB3 ARG 6 HB3 ARG 6 17.563 36.067 21.427 42 HG2 ARG 6 HG2 ARG 6 18.917 36.615 23.366 43 HG3 ARG 6 HG3 ARG 6 20.387 36.028 22.582 44 HD2 ARG 6 HD2 ARG 6 20.286 38.477 22.557 45 HD3 ARG 6 HD3 ARG 6 20.249 37.821 20.924 46 HE ARG 6 HE ARG 6 17.990 38.461 20.659 47 HH11 ARG 6 HH11 ARG 6 19.180 39.810 23.749 48 HH12 ARG 6 HH12 ARG 6 17.782 40.862 23.792 49 HH21 ARG 6 HH21 ARG 6 16.195 39.540 21.127 50 HH22 ARG 6 HH22 ARG 6 16.236 40.780 22.373 51 H ARG 7 H ARG 7 20.358 33.798 23.625 52 HA ARG 7 HA ARG 7 22.203 32.318 21.899 53 HB2 ARG 7 HB2 ARG 7 22.105 32.809 24.912 54 HB3 ARG 7 HB3 ARG 7 23.365 31.868 24.142 55 HG2 ARG 7 HG2 ARG 7 22.774 34.728 23.302 56 HG3 ARG 7 HG3 ARG 7 23.881 34.331 24.626 57 HD2 ARG 7 HD2 ARG 7 25.376 33.148 23.213 58 HD3 ARG 7 HD3 ARG 7 24.219 33.080 21.877 59 HE ARG 7 HE ARG 7 24.603 35.804 22.402 60 HH11 ARG 7 HH11 ARG 7 26.697 33.171 21.328 61 HH12 ARG 7 HH12 ARG 7 27.651 34.266 20.358 62 HH21 ARG 7 HH21 ARG 7 25.949 37.082 21.317 63 HH22 ARG 7 HH22 ARG 7 27.359 36.465 20.482 64 H CYS 8 H CYS 8 19.840 31.398 24.385 65 HA CYS 8 HA CYS 8 20.459 28.649 24.507 66 HB2 CYS 8 HB2 CYS 8 19.008 29.973 26.058 67 HB3 CYS 8 HB3 CYS 8 17.750 30.001 24.820 68 H GLU 9 H GLU 9 17.962 30.261 22.476 69 HA GLU 9 HA GLU 9 17.189 28.060 20.857 70 HB2 GLU 9 HB2 GLU 9 17.435 31.042 20.329 71 HB3 GLU 9 HB3 GLU 9 16.699 29.956 19.172 72 HG2 GLU 9 HG2 GLU 9 15.657 30.018 22.024 73 HG3 GLU 9 HG3 GLU 9 15.254 31.315 20.891 74 H LEU 10 H LEU 10 19.963 30.373 20.328 75 HA LEU 10 HA LEU 10 20.802 29.298 17.846 76 HB2 LEU 10 HB2 LEU 10 21.041 31.614 18.540 77 HB3 LEU 10 HB3 LEU 10 21.850 31.131 20.032 78 HG LEU 10 HG LEU 10 23.703 30.289 18.786 79 HD11 LEU 10 HD11 LEU 10 22.322 31.609 16.401 80 HD12 LEU 10 HD12 LEU 10 23.987 30.995 16.373 81 HD13 LEU 10 HD13 LEU 10 22.642 29.869 16.565 82 HD21 LEU 10 HD21 LEU 10 24.660 32.511 18.169 83 HD22 LEU 10 HD22 LEU 10 23.025 33.207 18.227 84 HD23 LEU 10 HD23 LEU 10 23.779 32.553 19.700 85 H SER 11 H SER 11 21.506 28.404 21.203 86 HA SER 11 HA SER 11 23.770 26.668 20.555 87 HB2 SER 11 HB2 SER 11 23.423 27.587 22.832 88 HB3 SER 11 HB3 SER 11 21.894 26.707 22.961 89 HG SER 11 HG SER 11 24.494 25.830 23.222 90 H CYS 12 H CYS 12 20.217 26.228 20.929 91 HA CYS 12 HA CYS 12 20.401 23.362 20.552 92 HB2 CYS 12 HB2 CYS 12 17.964 25.151 20.396 93 HB3 CYS 12 HB3 CYS 12 18.001 23.383 20.568 94 H ARG 13 H ARG 13 20.243 26.031 18.261 95 HA ARG 13 HA ARG 13 19.334 24.703 15.940 96 HB2 ARG 13 HB2 ARG 13 21.588 26.747 16.415 97 HB3 ARG 13 HB3 ARG 13 21.075 26.237 14.843 98 HG2 ARG 13 HG2 ARG 13 19.523 27.937 16.759 99 HG3 ARG 13 HG3 ARG 13 20.140 28.337 15.172 100 HD2 ARG 13 HD2 ARG 13 17.932 28.035 14.644 101 HD3 ARG 13 HD3 ARG 13 18.510 26.391 14.369 102 HE ARG 13 HE ARG 13 17.255 25.667 16.205 103 HH11 ARG 13 HH11 ARG 13 17.238 29.216 16.262 104 HH12 ARG 13 HH12 ARG 13 15.795 29.166 17.267 105 HH21 ARG 13 HH21 ARG 13 15.941 25.841 17.936 106 HH22 ARG 13 HH22 ARG 13 15.400 27.411 18.498 107 H SER 14 H SER 14 22.505 24.493 17.557 108 HA SER 14 HA SER 14 23.799 22.971 15.545 109 HB2 SER 14 HB2 SER 14 25.446 22.425 17.210 110 HB3 SER 14 HB3 SER 14 24.935 24.103 17.446 111 HG SER 14 HG SER 14 23.705 23.479 19.202 112 H LEU 15 H LEU 15 21.374 21.944 17.780 113 HA LEU 15 HA LEU 15 21.747 19.052 17.097 114 HB2 LEU 15 HB2 LEU 15 20.171 20.396 19.328 115 HB3 LEU 15 HB3 LEU 15 20.284 18.661 19.063 116 HG LEU 15 HG LEU 15 22.605 20.492 19.831 117 HD11 LEU 15 HD11 LEU 15 22.458 19.369 22.007 118 HD12 LEU 15 HD12 LEU 15 20.946 20.202 21.628 119 HD13 LEU 15 HD13 LEU 15 21.050 18.433 21.455 120 HD21 LEU 15 HD21 LEU 15 23.818 18.362 20.264 121 HD22 LEU 15 HD22 LEU 15 22.462 17.450 19.561 122 HD23 LEU 15 HD23 LEU 15 23.428 18.557 18.556 123 H GLY 16 H GLY 16 20.004 21.740 16.112 124 HA2 GLY 16 HA2 GLY 16 18.235 21.970 14.673 125 HA3 GLY 16 HA3 GLY 16 17.922 20.241 14.736 126 H LEU 17 H LEU 17 17.985 21.923 17.830 127 HA LEU 17 HA LEU 17 15.042 21.373 18.035 128 HB2 LEU 17 HB2 LEU 17 16.740 21.700 20.484 129 HB3 LEU 17 HB3 LEU 17 15.222 20.854 20.290 130 HG LEU 17 HG LEU 17 17.903 19.994 19.293 131 HD11 LEU 17 HD11 LEU 17 17.972 19.787 21.631 132 HD12 LEU 17 HD12 LEU 17 16.313 19.144 21.718 133 HD13 LEU 17 HD13 LEU 17 17.637 18.160 21.049 134 HD21 LEU 17 HD21 LEU 17 15.257 18.462 19.398 135 HD22 LEU 17 HD22 LEU 17 16.036 19.033 17.906 136 HD23 LEU 17 HD23 LEU 17 16.803 17.768 18.883 137 H LEU 18 H LEU 18 14.099 22.541 19.910 138 HA LEU 18 HA LEU 18 14.454 25.501 19.761 139 HB2 LEU 18 HB2 LEU 18 12.287 23.702 20.883 140 HB3 LEU 18 HB3 LEU 18 12.353 25.420 21.271 141 HG LEU 18 HG LEU 18 12.221 24.370 18.435 142 HD11 LEU 18 HD11 LEU 18 10.215 23.636 19.677 143 HD12 LEU 18 HD12 LEU 18 9.945 25.307 20.232 144 HD13 LEU 18 HD13 LEU 18 9.806 24.903 18.510 145 HD21 LEU 18 HD21 LEU 18 11.366 26.653 17.949 146 HD22 LEU 18 HD22 LEU 18 11.683 27.106 19.642 147 HD23 LEU 18 HD23 LEU 18 13.020 26.650 18.560 148 H GLY 19 H GLY 19 14.612 26.688 21.695 149 HA2 GLY 19 HA2 GLY 19 15.898 25.272 24.026 150 HA3 GLY 19 HA3 GLY 19 16.517 26.784 23.382 151 H LYS 20 H LYS 20 15.254 25.837 26.045 152 HA LYS 20 HA LYS 20 13.354 28.121 26.485 153 HB2 LYS 20 HB2 LYS 20 12.962 25.180 26.986 154 HB3 LYS 20 HB3 LYS 20 12.455 26.261 28.263 155 HG2 LYS 20 HG2 LYS 20 10.601 25.646 26.891 156 HG3 LYS 20 HG3 LYS 20 10.866 27.388 26.819 157 HD2 LYS 20 HD2 LYS 20 11.664 27.283 24.587 158 HD3 LYS 20 HD3 LYS 20 11.962 25.540 24.680 159 HE2 LYS 20 HE2 LYS 20 10.028 26.033 23.265 160 HE3 LYS 20 HE3 LYS 20 9.565 25.073 24.674 161 HZ1 LYS 20 HZ1 LYS 20 8.036 26.932 24.157 162 HZ2 LYS 20 HZ2 LYS 20 8.602 26.988 25.681 163 HZ3 LYS 20 HZ3 LYS 20 9.208 28.023 24.547 164 H CYS 21 H CYS 21 13.387 29.030 28.545 165 HA CYS 21 HA CYS 21 15.820 28.570 30.201 166 HB2 CYS 21 HB2 CYS 21 15.267 30.870 29.675 167 HB3 CYS 21 HB3 CYS 21 13.618 30.645 30.263 168 H ILE 22 H ILE 22 15.691 27.023 31.714 169 HA ILE 22 HA ILE 22 13.105 25.842 32.403 170 HB ILE 22 HB ILE 22 15.964 25.168 33.163 171 HG12 ILE 22 HG12 ILE 22 15.759 24.915 30.821 172 HG13 ILE 22 HG13 ILE 22 15.652 23.324 31.538 173 HG21 ILE 22 HG21 ILE 22 13.437 23.541 33.614 174 HG22 ILE 22 HG22 ILE 22 15.094 22.912 33.758 175 HG23 ILE 22 HG23 ILE 22 14.543 24.184 34.843 176 HD11 ILE 22 HD11 ILE 22 13.165 23.359 31.227 177 HD12 ILE 22 HD12 ILE 22 13.338 24.914 30.378 178 HD13 ILE 22 HD13 ILE 22 14.083 23.457 29.714 179 H GLY 23 H GLY 23 15.188 28.110 33.947 180 HA2 GLY 23 HA2 GLY 23 13.283 29.257 35.537 181 HA3 GLY 23 HA3 GLY 23 13.927 27.983 36.584 182 H GLU 24 H GLU 24 16.550 27.935 35.902 183 HA GLU 24 HA GLU 24 17.610 30.657 36.543 184 HB2 GLU 24 HB2 GLU 24 18.613 27.919 37.395 185 HB3 GLU 24 HB3 GLU 24 19.440 29.437 37.695 186 HG2 GLU 24 HG2 GLU 24 16.709 28.628 38.789 187 HG3 GLU 24 HG3 GLU 24 18.230 28.672 39.689 188 H LYS 25 H LYS 25 17.951 27.815 34.503 189 HA LYS 25 HA LYS 25 19.975 29.200 32.793 190 HB2 LYS 25 HB2 LYS 25 20.060 26.354 33.877 191 HB3 LYS 25 HB3 LYS 25 21.036 26.917 32.524 192 HG2 LYS 25 HG2 LYS 25 22.064 28.651 34.055 193 HG3 LYS 25 HG3 LYS 25 21.181 27.897 35.393 194 HD2 LYS 25 HD2 LYS 25 23.363 26.930 35.429 195 HD3 LYS 25 HD3 LYS 25 22.288 25.690 34.770 196 HE2 LYS 25 HE2 LYS 25 22.971 26.540 32.438 197 HE3 LYS 25 HE3 LYS 25 24.210 27.509 33.232 198 HZ1 LYS 25 HZ1 LYS 25 24.957 25.330 32.394 199 HZ2 LYS 25 HZ2 LYS 25 25.240 25.448 34.006 200 HZ3 LYS 25 HZ3 LYS 25 23.971 24.551 33.400 201 H CYS 26 H CYS 26 20.275 28.159 30.712 202 HA CYS 26 HA CYS 26 17.796 27.506 29.296 203 HB2 CYS 26 HB2 CYS 26 19.404 28.915 28.211 204 HB3 CYS 26 HB3 CYS 26 20.726 27.822 28.609 205 H LYS 27 H LYS 27 17.113 25.514 28.544 206 HA LYS 27 HA LYS 27 19.111 23.371 28.002 207 HB2 LYS 27 HB2 LYS 27 16.395 22.930 29.232 208 HB3 LYS 27 HB3 LYS 27 17.489 21.689 28.609 209 HG2 LYS 27 HG2 LYS 27 19.259 22.524 30.248 210 HG3 LYS 27 HG3 LYS 27 17.984 23.539 30.985 211 HD2 LYS 27 HD2 LYS 27 16.585 21.443 31.094 212 HD3 LYS 27 HD3 LYS 27 18.049 20.548 30.617 213 HE2 LYS 27 HE2 LYS 27 19.237 21.511 32.611 214 HE3 LYS 27 HE3 LYS 27 17.736 22.309 33.111 215 HZ1 LYS 27 HZ1 LYS 27 16.738 20.106 33.386 216 HZ2 LYS 27 HZ2 LYS 27 18.095 19.383 32.818 217 HZ3 LYS 27 HZ3 LYS 27 18.166 20.197 34.244 218 H CYS 28 H CYS 28 18.567 22.064 26.174 219 HA CYS 28 HA CYS 28 16.636 23.237 24.280 220 HB2 CYS 28 HB2 CYS 28 18.343 20.751 23.997 221 HB3 CYS 28 HB3 CYS 28 17.427 21.574 22.722 222 H VAL 29 H VAL 29 14.789 22.121 23.476 223 HA VAL 29 HA VAL 29 13.632 20.237 25.469 224 HB VAL 29 HB VAL 29 11.436 20.721 24.472 225 HG11 VAL 29 HG11 VAL 29 12.219 21.740 26.571 226 HG12 VAL 29 HG12 VAL 29 12.952 23.079 25.667 227 HG13 VAL 29 HG13 VAL 29 11.188 22.851 25.666 228 HG21 VAL 29 HG21 VAL 29 12.811 23.107 23.166 229 HG22 VAL 29 HG22 VAL 29 12.163 21.701 22.289 230 HG23 VAL 29 HG23 VAL 29 11.076 22.751 23.199 231 HA PRO 30 HA PRO 30 14.413 16.962 22.662 232 HB2 PRO 30 HB2 PRO 30 12.046 15.576 23.926 233 HB3 PRO 30 HB3 PRO 30 13.705 14.962 23.645 234 HG2 PRO 30 HG2 PRO 30 12.960 15.768 26.111 235 HG3 PRO 30 HG3 PRO 30 14.577 16.197 25.467 236 HD2 PRO 30 HD2 PRO 30 12.086 17.913 25.577 237 HD3 PRO 30 HD3 PRO 30 13.781 18.316 25.983 238 H TYR 31 H TYR 31 13.794 16.175 20.668 239 HA TYR 31 HA TYR 31 11.177 17.093 19.523 240 HB2 TYR 31 HB2 TYR 31 13.906 16.661 18.344 241 HB3 TYR 31 HB3 TYR 31 12.493 16.353 17.359 242 HD1 TYR 31 HD1 TYR 31 12.917 18.013 15.743 243 HD2 TYR 31 HD2 TYR 31 12.539 19.128 19.895 244 HE1 TYR 31 HE1 TYR 31 12.666 20.394 15.082 245 HE2 TYR 31 HE2 TYR 31 12.229 21.498 19.220 246 HH TYR 31 HH TYR 31 12.548 22.574 15.834 Start of MODEL 2 1 H1 ALA 1 H1 ALA 1 26.122 32.274 34.550 2 H2 ALA 1 H2 ALA 1 27.189 31.790 33.396 3 H3 ALA 1 H3 ALA 1 25.939 30.798 33.823 4 HA ALA 1 HA ALA 1 25.694 33.421 32.536 5 HB1 ALA 1 HB1 ALA 1 26.571 31.710 30.987 6 HB2 ALA 1 HB2 ALA 1 25.203 30.639 31.379 7 HB3 ALA 1 HB3 ALA 1 24.919 32.189 30.551 8 H PHE 2 H PHE 2 23.672 34.262 32.396 9 HA PHE 2 HA PHE 2 21.534 33.024 34.070 10 HB2 PHE 2 HB2 PHE 2 21.880 35.823 32.935 11 HB3 PHE 2 HB3 PHE 2 20.538 35.298 33.952 12 HD1 PHE 2 HD1 PHE 2 23.864 36.650 33.983 13 HD2 PHE 2 HD2 PHE 2 21.120 34.223 36.261 14 HE1 PHE 2 HE1 PHE 2 25.226 37.011 36.025 15 HE2 PHE 2 HE2 PHE 2 22.505 34.553 38.285 16 HZ PHE 2 HZ PHE 2 24.565 35.940 38.176 17 H CYS 3 H CYS 3 19.213 33.931 32.983 18 HA CYS 3 HA CYS 3 18.891 32.298 30.593 19 HB2 CYS 3 HB2 CYS 3 17.021 32.513 32.083 20 HB3 CYS 3 HB3 CYS 3 17.067 34.268 32.001 21 H ASN 4 H ASN 4 19.831 32.937 28.785 22 HA ASN 4 HA ASN 4 19.264 35.606 27.582 23 HB2 ASN 4 HB2 ASN 4 21.835 33.962 27.415 24 HB3 ASN 4 HB3 ASN 4 21.451 35.354 26.396 25 HD21 ASN 4 HD21 ASN 4 21.709 37.356 29.693 26 HD22 ASN 4 HD22 ASN 4 20.218 36.569 29.169 27 H LEU 5 H LEU 5 17.324 34.214 27.212 28 HA LEU 5 HA LEU 5 17.146 31.818 26.067 29 HB2 LEU 5 HB2 LEU 5 15.267 33.140 26.895 30 HB3 LEU 5 HB3 LEU 5 15.361 34.195 25.510 31 HG LEU 5 HG LEU 5 14.677 32.420 23.963 32 HD11 LEU 5 HD11 LEU 5 14.538 30.647 26.475 33 HD12 LEU 5 HD12 LEU 5 13.947 30.237 24.841 34 HD13 LEU 5 HD13 LEU 5 15.654 30.437 25.102 35 HD21 LEU 5 HD21 LEU 5 12.906 32.554 26.482 36 HD22 LEU 5 HD22 LEU 5 12.926 33.711 25.131 37 HD23 LEU 5 HD23 LEU 5 12.393 32.060 24.850 38 H ARG 6 H ARG 6 17.563 34.740 23.964 39 HA ARG 6 HA ARG 6 17.429 33.219 21.511 40 HB2 ARG 6 HB2 ARG 6 18.696 35.927 22.107 41 HB3 ARG 6 HB3 ARG 6 18.572 35.216 20.494 42 HG2 ARG 6 HG2 ARG 6 16.118 35.020 20.738 43 HG3 ARG 6 HG3 ARG 6 16.187 35.797 22.321 44 HD2 ARG 6 HD2 ARG 6 17.122 37.112 19.733 45 HD3 ARG 6 HD3 ARG 6 15.489 37.252 20.394 46 HE ARG 6 HE ARG 6 17.452 38.009 22.379 47 HH11 ARG 6 HH11 ARG 6 15.676 39.305 19.596 48 HH12 ARG 6 HH12 ARG 6 16.060 40.946 20.091 49 HH21 ARG 6 HH21 ARG 6 17.661 40.125 22.969 50 HH22 ARG 6 HH22 ARG 6 17.104 41.392 21.877 51 H ARG 7 H ARG 7 20.250 33.886 23.608 52 HA ARG 7 HA ARG 7 22.107 32.473 21.830 53 HB2 ARG 7 HB2 ARG 7 22.346 33.391 24.731 54 HB3 ARG 7 HB3 ARG 7 23.640 32.602 23.810 55 HG2 ARG 7 HG2 ARG 7 23.519 34.337 22.060 56 HG3 ARG 7 HG3 ARG 7 22.230 35.153 22.956 57 HD2 ARG 7 HD2 ARG 7 23.774 35.570 24.840 58 HD3 ARG 7 HD3 ARG 7 25.083 34.794 23.938 59 HE ARG 7 HE ARG 7 23.664 37.339 23.307 60 HH11 ARG 7 HH11 ARG 7 26.149 35.070 22.211 61 HH12 ARG 7 HH12 ARG 7 26.642 36.119 20.912 62 HH21 ARG 7 HH21 ARG 7 24.531 38.695 21.674 63 HH22 ARG 7 HH22 ARG 7 25.619 37.957 20.507 64 H CYS 8 H CYS 8 19.955 31.438 24.389 65 HA CYS 8 HA CYS 8 21.010 28.719 24.497 66 HB2 CYS 8 HB2 CYS 8 19.658 29.753 26.297 67 HB3 CYS 8 HB3 CYS 8 18.269 29.815 25.216 68 H GLU 9 H GLU 9 18.258 30.248 22.758 69 HA GLU 9 HA GLU 9 17.323 28.019 21.316 70 HB2 GLU 9 HB2 GLU 9 17.308 31.008 20.857 71 HB3 GLU 9 HB3 GLU 9 16.656 29.951 19.625 72 HG2 GLU 9 HG2 GLU 9 15.704 29.722 22.503 73 HG3 GLU 9 HG3 GLU 9 15.063 30.957 21.413 74 H LEU 10 H LEU 10 19.942 30.327 20.308 75 HA LEU 10 HA LEU 10 20.372 28.869 17.861 76 HB2 LEU 10 HB2 LEU 10 22.128 30.298 17.382 77 HB3 LEU 10 HB3 LEU 10 20.912 31.244 18.213 78 HG LEU 10 HG LEU 10 22.439 30.769 20.344 79 HD11 LEU 10 HD11 LEU 10 24.103 29.298 19.182 80 HD12 LEU 10 HD12 LEU 10 24.452 30.617 18.048 81 HD13 LEU 10 HD13 LEU 10 24.841 30.785 19.768 82 HD21 LEU 10 HD21 LEU 10 23.178 32.755 18.151 83 HD22 LEU 10 HD22 LEU 10 21.945 32.995 19.407 84 HD23 LEU 10 HD23 LEU 10 23.654 32.873 19.858 85 H SER 11 H SER 11 21.669 28.359 21.132 86 HA SER 11 HA SER 11 23.695 26.456 20.347 87 HB2 SER 11 HB2 SER 11 23.640 27.459 22.600 88 HB3 SER 11 HB3 SER 11 22.145 26.567 22.963 89 HG SER 11 HG SER 11 23.251 24.757 23.176 90 H CYS 12 H CYS 12 20.215 26.071 21.231 91 HA CYS 12 HA CYS 12 20.211 23.230 20.717 92 HB2 CYS 12 HB2 CYS 12 17.920 25.215 20.766 93 HB3 CYS 12 HB3 CYS 12 17.771 23.458 20.847 94 H ARG 13 H ARG 13 19.617 26.068 18.607 95 HA ARG 13 HA ARG 13 18.757 24.662 16.271 96 HB2 ARG 13 HB2 ARG 13 18.711 27.159 16.510 97 HB3 ARG 13 HB3 ARG 13 20.481 27.168 16.382 98 HG2 ARG 13 HG2 ARG 13 20.294 26.116 14.112 99 HG3 ARG 13 HG3 ARG 13 18.542 26.249 14.212 100 HD2 ARG 13 HD2 ARG 13 20.464 28.604 14.444 101 HD3 ARG 13 HD3 ARG 13 19.829 28.042 12.907 102 HE ARG 13 HE ARG 13 18.302 29.415 15.072 103 HH11 ARG 13 HH11 ARG 13 18.034 27.983 11.811 104 HH12 ARG 13 HH12 ARG 13 16.667 29.046 11.487 105 HH21 ARG 13 HH21 ARG 13 16.624 30.600 14.470 106 HH22 ARG 13 HH22 ARG 13 15.929 30.412 12.846 107 H SER 14 H SER 14 22.045 25.282 17.471 108 HA SER 14 HA SER 14 23.390 24.022 15.297 109 HB2 SER 14 HB2 SER 14 25.349 24.181 16.542 110 HB3 SER 14 HB3 SER 14 24.380 25.536 17.131 111 HG SER 14 HG SER 14 23.774 24.165 18.931 112 H LEU 15 H LEU 15 21.436 22.519 17.652 113 HA LEU 15 HA LEU 15 22.724 19.844 17.307 114 HB2 LEU 15 HB2 LEU 15 21.106 21.075 19.563 115 HB3 LEU 15 HB3 LEU 15 21.560 19.376 19.522 116 HG LEU 15 HG LEU 15 23.668 21.566 19.399 117 HD11 LEU 15 HD11 LEU 15 22.480 20.281 21.889 118 HD12 LEU 15 HD12 LEU 15 23.911 21.339 21.828 119 HD13 LEU 15 HD13 LEU 15 22.324 21.985 21.402 120 HD21 LEU 15 HD21 LEU 15 23.744 18.681 20.392 121 HD22 LEU 15 HD22 LEU 15 24.349 19.237 18.822 122 HD23 LEU 15 HD23 LEU 15 25.111 19.809 20.314 123 H GLY 16 H GLY 16 20.074 21.591 16.244 124 HA2 GLY 16 HA2 GLY 16 18.464 20.804 14.760 125 HA3 GLY 16 HA3 GLY 16 18.754 19.149 15.281 126 H LEU 17 H LEU 17 17.892 21.809 17.507 127 HA LEU 17 HA LEU 17 15.054 21.155 17.619 128 HB2 LEU 17 HB2 LEU 17 15.047 20.497 19.984 129 HB3 LEU 17 HB3 LEU 17 15.819 19.316 18.939 130 HG LEU 17 HG LEU 17 17.326 21.243 20.738 131 HD11 LEU 17 HD11 LEU 17 17.634 19.186 22.156 132 HD12 LEU 17 HD12 LEU 17 15.951 19.717 22.055 133 HD13 LEU 17 HD13 LEU 17 16.497 18.334 21.096 134 HD21 LEU 17 HD21 LEU 17 19.167 19.529 20.537 135 HD22 LEU 17 HD22 LEU 17 18.252 18.787 19.206 136 HD23 LEU 17 HD23 LEU 17 18.865 20.457 19.082 137 H LEU 18 H LEU 18 14.025 22.460 19.600 138 HA LEU 18 HA LEU 18 15.205 25.210 19.495 139 HB2 LEU 18 HB2 LEU 18 12.432 24.427 20.412 140 HB3 LEU 18 HB3 LEU 18 13.058 26.046 20.198 141 HG LEU 18 HG LEU 18 12.712 24.044 17.964 142 HD11 LEU 18 HD11 LEU 18 11.018 26.456 18.724 143 HD12 LEU 18 HD12 LEU 18 10.770 25.404 17.308 144 HD13 LEU 18 HD13 LEU 18 10.557 24.753 18.942 145 HD21 LEU 18 HD21 LEU 18 13.334 27.022 17.902 146 HD22 LEU 18 HD22 LEU 18 14.431 25.707 17.427 147 HD23 LEU 18 HD23 LEU 18 12.973 26.016 16.478 148 H GLY 19 H GLY 19 14.733 26.495 21.468 149 HA2 GLY 19 HA2 GLY 19 15.808 25.078 23.908 150 HA3 GLY 19 HA3 GLY 19 16.535 26.543 23.276 151 H LYS 20 H LYS 20 15.432 25.911 25.944 152 HA LYS 20 HA LYS 20 13.928 28.424 26.311 153 HB2 LYS 20 HB2 LYS 20 12.944 25.710 27.275 154 HB3 LYS 20 HB3 LYS 20 12.432 27.216 28.016 155 HG2 LYS 20 HG2 LYS 20 11.938 26.442 25.113 156 HG3 LYS 20 HG3 LYS 20 10.765 26.394 26.433 157 HD2 LYS 20 HD2 LYS 20 10.994 28.856 26.741 158 HD3 LYS 20 HD3 LYS 20 12.105 28.916 25.363 159 HE2 LYS 20 HE2 LYS 20 10.335 27.941 23.912 160 HE3 LYS 20 HE3 LYS 20 9.212 28.042 25.284 161 HZ1 LYS 20 HZ1 LYS 20 9.006 29.992 23.873 162 HZ2 LYS 20 HZ2 LYS 20 9.674 30.471 25.317 163 HZ3 LYS 20 HZ3 LYS 20 10.605 30.300 23.966 164 H CYS 21 H CYS 21 14.100 29.358 28.394 165 HA CYS 21 HA CYS 21 16.611 28.690 29.720 166 HB2 CYS 21 HB2 CYS 21 14.458 30.748 30.255 167 HB3 CYS 21 HB3 CYS 21 15.924 30.559 31.223 168 H ILE 22 H ILE 22 16.588 26.814 30.810 169 HA ILE 22 HA ILE 22 14.682 26.351 33.040 170 HB ILE 22 HB ILE 22 15.341 24.417 30.789 171 HG12 ILE 22 HG12 ILE 22 12.675 25.581 31.702 172 HG13 ILE 22 HG13 ILE 22 13.542 25.989 30.220 173 HG21 ILE 22 HG21 ILE 22 13.760 23.830 33.328 174 HG22 ILE 22 HG22 ILE 22 14.023 22.712 31.976 175 HG23 ILE 22 HG23 ILE 22 15.379 23.196 32.952 176 HD11 ILE 22 HD11 ILE 22 11.781 24.550 29.596 177 HD12 ILE 22 HD12 ILE 22 13.287 23.625 29.438 178 HD13 ILE 22 HD13 ILE 22 12.198 23.351 30.822 179 H GLY 23 H GLY 23 15.611 25.400 34.780 180 HA2 GLY 23 HA2 GLY 23 17.064 24.731 36.329 181 HA3 GLY 23 HA3 GLY 23 17.845 23.771 35.079 182 H GLU 24 H GLU 24 19.577 24.531 34.076 183 HA GLU 24 HA GLU 24 21.232 26.601 35.373 184 HB2 GLU 24 HB2 GLU 24 23.025 25.926 33.997 185 HB3 GLU 24 HB3 GLU 24 22.292 24.492 34.679 186 HG2 GLU 24 HG2 GLU 24 21.313 25.315 31.950 187 HG3 GLU 24 HG3 GLU 24 22.999 24.828 32.066 188 H LYS 25 H LYS 25 18.806 27.416 34.123 189 HA LYS 25 HA LYS 25 17.803 28.890 32.773 190 HB2 LYS 25 HB2 LYS 25 20.449 30.357 32.904 191 HB3 LYS 25 HB3 LYS 25 18.870 31.046 32.549 192 HG2 LYS 25 HG2 LYS 25 19.640 29.798 35.218 193 HG3 LYS 25 HG3 LYS 25 19.632 31.526 34.846 194 HD2 LYS 25 HD2 LYS 25 17.197 31.424 34.378 195 HD3 LYS 25 HD3 LYS 25 17.178 29.710 34.815 196 HE2 LYS 25 HE2 LYS 25 17.791 30.155 37.084 197 HE3 LYS 25 HE3 LYS 25 18.238 31.825 36.709 198 HZ1 LYS 25 HZ1 LYS 25 16.061 31.642 37.808 199 HZ2 LYS 25 HZ2 LYS 25 15.894 32.318 36.301 200 HZ3 LYS 25 HZ3 LYS 25 15.460 30.770 36.600 201 H CYS 26 H CYS 26 19.351 26.823 31.419 202 HA CYS 26 HA CYS 26 18.267 27.401 28.823 203 HB2 CYS 26 HB2 CYS 26 20.369 28.573 28.452 204 HB3 CYS 26 HB3 CYS 26 21.284 27.165 28.987 205 H LYS 27 H LYS 27 17.284 25.553 28.311 206 HA LYS 27 HA LYS 27 18.848 23.111 27.909 207 HB2 LYS 27 HB2 LYS 27 17.344 23.315 30.203 208 HB3 LYS 27 HB3 LYS 27 16.097 22.755 29.093 209 HG2 LYS 27 HG2 LYS 27 17.159 20.963 30.333 210 HG3 LYS 27 HG3 LYS 27 17.431 20.742 28.608 211 HD2 LYS 27 HD2 LYS 27 19.722 21.029 28.800 212 HD3 LYS 27 HD3 LYS 27 19.563 22.288 30.053 213 HE2 LYS 27 HE2 LYS 27 18.981 20.705 31.718 214 HE3 LYS 27 HE3 LYS 27 19.020 19.366 30.552 215 HZ1 LYS 27 HZ1 LYS 27 21.082 19.411 31.764 216 HZ2 LYS 27 HZ2 LYS 27 21.428 19.886 30.223 217 HZ3 LYS 27 HZ3 LYS 27 21.356 20.999 31.434 218 H CYS 28 H CYS 28 17.624 21.521 26.459 219 HA CYS 28 HA CYS 28 16.145 23.138 24.446 220 HB2 CYS 28 HB2 CYS 28 17.634 20.575 24.002 221 HB3 CYS 28 HB3 CYS 28 16.904 21.640 22.798 222 H VAL 29 H VAL 29 14.385 22.315 23.285 223 HA VAL 29 HA VAL 29 12.480 20.976 25.044 224 HB VAL 29 HB VAL 29 10.786 21.530 23.428 225 HG11 VAL 29 HG11 VAL 29 10.922 23.938 23.491 226 HG12 VAL 29 HG12 VAL 29 11.568 23.273 24.997 227 HG13 VAL 29 HG13 VAL 29 12.676 23.892 23.748 228 HG21 VAL 29 HG21 VAL 29 11.945 21.118 21.304 229 HG22 VAL 29 HG22 VAL 29 11.223 22.726 21.358 230 HG23 VAL 29 HG23 VAL 29 12.974 22.533 21.593 231 HA PRO 30 HA PRO 30 12.931 16.967 23.541 232 HB2 PRO 30 HB2 PRO 30 10.538 15.718 23.996 233 HB3 PRO 30 HB3 PRO 30 11.618 16.307 25.287 234 HG2 PRO 30 HG2 PRO 30 9.201 17.706 24.130 235 HG3 PRO 30 HG3 PRO 30 9.615 17.456 25.862 236 HD2 PRO 30 HD2 PRO 30 10.162 19.779 24.545 237 HD3 PRO 30 HD3 PRO 30 11.264 19.139 25.791 238 H TYR 31 H TYR 31 13.417 17.170 21.432 239 HA TYR 31 HA TYR 31 11.356 16.486 19.349 240 HB2 TYR 31 HB2 TYR 31 14.109 17.759 19.220 241 HB3 TYR 31 HB3 TYR 31 13.416 16.935 17.836 242 HD1 TYR 31 HD1 TYR 31 13.890 19.063 16.685 243 HD2 TYR 31 HD2 TYR 31 10.885 18.759 19.752 244 HE1 TYR 31 HE1 TYR 31 12.776 21.106 15.805 245 HE2 TYR 31 HE2 TYR 31 9.771 20.772 18.868 246 HH TYR 31 HH TYR 31 9.842 22.457 17.320 Start of MODEL 3 1 H1 ALA 1 H1 ALA 1 23.787 37.499 37.378 2 H2 ALA 1 H2 ALA 1 23.459 35.884 37.412 3 H3 ALA 1 H3 ALA 1 22.255 36.993 37.636 4 HA ALA 1 HA ALA 1 22.628 37.867 35.422 5 HB1 ALA 1 HB1 ALA 1 23.905 36.549 33.803 6 HB2 ALA 1 HB2 ALA 1 24.953 37.021 35.157 7 HB3 ALA 1 HB3 ALA 1 24.314 35.359 35.042 8 H PHE 2 H PHE 2 21.131 37.361 33.902 9 HA PHE 2 HA PHE 2 19.007 35.501 34.608 10 HB2 PHE 2 HB2 PHE 2 19.457 37.131 32.083 11 HB3 PHE 2 HB3 PHE 2 17.940 36.413 32.605 12 HD1 PHE 2 HD1 PHE 2 19.106 39.445 32.064 13 HD2 PHE 2 HD2 PHE 2 17.764 37.167 35.466 14 HE1 PHE 2 HE1 PHE 2 18.428 41.544 33.204 15 HE2 PHE 2 HE2 PHE 2 17.146 39.239 36.610 16 HZ PHE 2 HZ PHE 2 17.432 41.456 35.483 17 H CYS 3 H CYS 3 18.066 33.958 32.827 18 HA CYS 3 HA CYS 3 20.055 32.287 31.542 19 HB2 CYS 3 HB2 CYS 3 18.171 31.147 30.604 20 HB3 CYS 3 HB3 CYS 3 17.755 31.564 32.260 21 H ASN 4 H ASN 4 20.444 32.150 29.205 22 HA ASN 4 HA ASN 4 19.920 34.693 27.700 23 HB2 ASN 4 HB2 ASN 4 22.236 32.779 27.349 24 HB3 ASN 4 HB3 ASN 4 21.999 34.330 26.539 25 HD21 ASN 4 HD21 ASN 4 23.013 36.261 29.393 26 HD22 ASN 4 HD22 ASN 4 22.168 36.318 27.853 27 H LEU 5 H LEU 5 17.782 33.530 27.408 28 HA LEU 5 HA LEU 5 17.448 31.073 26.159 29 HB2 LEU 5 HB2 LEU 5 15.769 32.398 27.383 30 HB3 LEU 5 HB3 LEU 5 15.667 33.531 26.052 31 HG LEU 5 HG LEU 5 13.799 31.883 26.325 32 HD11 LEU 5 HD11 LEU 5 15.053 31.710 23.564 33 HD12 LEU 5 HD12 LEU 5 13.357 31.563 24.012 34 HD13 LEU 5 HD13 LEU 5 14.172 33.121 24.200 35 HD21 LEU 5 HD21 LEU 5 13.983 29.638 25.524 36 HD22 LEU 5 HD22 LEU 5 15.684 29.853 25.078 37 HD23 LEU 5 HD23 LEU 5 15.202 29.878 26.789 38 H ARG 6 H ARG 6 17.714 34.251 24.461 39 HA ARG 6 HA ARG 6 17.222 33.063 21.848 40 HB2 ARG 6 HB2 ARG 6 18.530 35.716 22.569 41 HB3 ARG 6 HB3 ARG 6 18.092 35.226 20.951 42 HG2 ARG 6 HG2 ARG 6 16.220 35.751 23.288 43 HG3 ARG 6 HG3 ARG 6 16.405 36.711 21.818 44 HD2 ARG 6 HD2 ARG 6 15.246 33.911 22.014 45 HD3 ARG 6 HD3 ARG 6 14.347 35.376 21.746 46 HE ARG 6 HE ARG 6 15.865 33.797 19.793 47 HH11 ARG 6 HH11 ARG 6 14.168 36.852 20.210 48 HH12 ARG 6 HH12 ARG 6 14.101 37.079 18.502 49 HH21 ARG 6 HH21 ARG 6 16.089 34.432 17.728 50 HH22 ARG 6 HH22 ARG 6 15.343 35.928 17.164 51 H ARG 7 H ARG 7 20.282 33.706 23.560 52 HA ARG 7 HA ARG 7 21.978 32.703 21.414 53 HB2 ARG 7 HB2 ARG 7 22.738 34.272 23.155 54 HB3 ARG 7 HB3 ARG 7 22.417 33.087 24.405 55 HG2 ARG 7 HG2 ARG 7 24.790 33.343 23.947 56 HG3 ARG 7 HG3 ARG 7 24.265 31.692 23.671 57 HD2 ARG 7 HD2 ARG 7 24.513 33.668 21.367 58 HD3 ARG 7 HD3 ARG 7 25.925 32.826 22.018 59 HE ARG 7 HE ARG 7 23.729 31.022 21.413 60 HH11 ARG 7 HH11 ARG 7 26.431 32.638 19.731 61 HH12 ARG 7 HH12 ARG 7 26.565 31.255 18.660 62 HH21 ARG 7 HH21 ARG 7 24.383 29.286 20.260 63 HH22 ARG 7 HH22 ARG 7 25.578 29.472 19.012 64 H CYS 8 H CYS 8 20.478 31.282 24.293 65 HA CYS 8 HA CYS 8 21.568 28.665 24.175 66 HB2 CYS 8 HB2 CYS 8 20.424 29.510 26.132 67 HB3 CYS 8 HB3 CYS 8 18.957 29.784 25.206 68 H GLU 9 H GLU 9 18.405 29.878 22.778 69 HA GLU 9 HA GLU 9 17.867 27.359 21.567 70 HB2 GLU 9 HB2 GLU 9 16.135 28.276 20.416 71 HB3 GLU 9 HB3 GLU 9 16.170 29.135 21.949 72 HG2 GLU 9 HG2 GLU 9 17.017 31.120 20.868 73 HG3 GLU 9 HG3 GLU 9 17.208 30.266 19.339 74 H LEU 10 H LEU 10 19.687 30.135 20.226 75 HA LEU 10 HA LEU 10 20.140 28.967 17.637 76 HB2 LEU 10 HB2 LEU 10 21.943 30.770 19.293 77 HB3 LEU 10 HB3 LEU 10 22.289 30.319 17.618 78 HG LEU 10 HG LEU 10 19.759 31.703 18.488 79 HD11 LEU 10 HD11 LEU 10 21.692 33.138 18.967 80 HD12 LEU 10 HD12 LEU 10 22.308 32.892 17.317 81 HD13 LEU 10 HD13 LEU 10 20.794 33.783 17.583 82 HD21 LEU 10 HD21 LEU 10 19.502 30.596 16.311 83 HD22 LEU 10 HD22 LEU 10 19.588 32.340 16.077 84 HD23 LEU 10 HD23 LEU 10 21.013 31.334 15.735 85 H SER 11 H SER 11 21.876 28.518 20.661 86 HA SER 11 HA SER 11 23.923 26.720 19.646 87 HB2 SER 11 HB2 SER 11 22.817 27.103 22.458 88 HB3 SER 11 HB3 SER 11 24.184 26.052 22.047 89 HG SER 11 HG SER 11 25.190 27.881 22.470 90 H CYS 12 H CYS 12 20.639 26.141 20.950 91 HA CYS 12 HA CYS 12 20.743 23.253 20.740 92 HB2 CYS 12 HB2 CYS 12 18.403 25.157 20.770 93 HB3 CYS 12 HB3 CYS 12 18.289 23.449 20.976 94 H ARG 13 H ARG 13 19.704 25.880 18.462 95 HA ARG 13 HA ARG 13 18.516 24.225 16.516 96 HB2 ARG 13 HB2 ARG 13 19.739 27.018 16.570 97 HB3 ARG 13 HB3 ARG 13 19.034 26.337 15.122 98 HG2 ARG 13 HG2 ARG 13 17.450 26.511 17.715 99 HG3 ARG 13 HG3 ARG 13 17.535 27.850 16.567 100 HD2 ARG 13 HD2 ARG 13 16.515 25.036 15.989 101 HD3 ARG 13 HD3 ARG 13 15.510 26.436 16.371 102 HE ARG 13 HE ARG 13 17.249 26.158 13.950 103 HH11 ARG 13 HH11 ARG 13 14.732 28.069 15.461 104 HH12 ARG 13 HH12 ARG 13 14.045 28.514 13.919 105 HH21 ARG 13 HH21 ARG 13 16.437 27.060 12.033 106 HH22 ARG 13 HH22 ARG 13 14.899 27.916 12.119 107 H SER 14 H SER 14 21.913 25.274 16.930 108 HA SER 14 HA SER 14 22.952 24.030 14.582 109 HB2 SER 14 HB2 SER 14 24.252 24.271 17.318 110 HB3 SER 14 HB3 SER 14 25.095 23.935 15.796 111 HG SER 14 HG SER 14 24.260 25.967 15.032 112 H LEU 15 H LEU 15 21.619 22.520 17.421 113 HA LEU 15 HA LEU 15 22.703 19.856 16.670 114 HB2 LEU 15 HB2 LEU 15 21.073 20.663 19.107 115 HB3 LEU 15 HB3 LEU 15 21.910 19.140 18.850 116 HG LEU 15 HG LEU 15 23.224 21.863 19.233 117 HD11 LEU 15 HD11 LEU 15 22.133 21.031 21.264 118 HD12 LEU 15 HD12 LEU 15 23.014 19.494 21.114 119 HD13 LEU 15 HD13 LEU 15 23.898 21.004 21.420 120 HD21 LEU 15 HD21 LEU 15 24.508 19.118 19.081 121 HD22 LEU 15 HD22 LEU 15 24.657 20.409 17.866 122 HD23 LEU 15 HD23 LEU 15 25.328 20.634 19.490 123 H GLY 16 H GLY 16 19.891 21.812 16.346 124 HA2 GLY 16 HA2 GLY 16 18.350 21.206 14.586 125 HA3 GLY 16 HA3 GLY 16 18.342 19.545 15.158 126 H LEU 17 H LEU 17 18.071 21.942 17.701 127 HA LEU 17 HA LEU 17 15.120 21.680 17.817 128 HB2 LEU 17 HB2 LEU 17 15.271 20.900 20.131 129 HB3 LEU 17 HB3 LEU 17 15.801 19.722 18.957 130 HG LEU 17 HG LEU 17 17.707 21.372 20.662 131 HD11 LEU 17 HD11 LEU 17 17.823 19.335 22.102 132 HD12 LEU 17 HD12 LEU 17 16.206 20.040 22.103 133 HD13 LEU 17 HD13 LEU 17 16.531 18.591 21.139 134 HD21 LEU 17 HD21 LEU 17 19.253 19.450 20.277 135 HD22 LEU 17 HD22 LEU 17 18.073 18.736 19.156 136 HD23 LEU 17 HD23 LEU 17 18.858 20.282 18.788 137 H LEU 18 H LEU 18 14.139 22.938 19.689 138 HA LEU 18 HA LEU 18 15.365 25.651 19.763 139 HB2 LEU 18 HB2 LEU 18 12.577 24.527 20.172 140 HB3 LEU 18 HB3 LEU 18 12.999 26.099 20.800 141 HG LEU 18 HG LEU 18 13.689 26.870 18.531 142 HD11 LEU 18 HD11 LEU 18 12.774 25.623 16.570 143 HD12 LEU 18 HD12 LEU 18 14.085 24.755 17.352 144 HD13 LEU 18 HD13 LEU 18 12.404 24.238 17.622 145 HD21 LEU 18 HD21 LEU 18 11.342 27.122 17.761 146 HD22 LEU 18 HD22 LEU 18 10.840 25.839 18.894 147 HD23 LEU 18 HD23 LEU 18 11.505 27.379 19.501 148 H GLY 19 H GLY 19 14.894 26.932 21.847 149 HA2 GLY 19 HA2 GLY 19 15.801 25.363 24.229 150 HA3 GLY 19 HA3 GLY 19 16.151 27.049 23.937 151 H LYS 20 H LYS 20 15.002 25.828 26.334 152 HA LYS 20 HA LYS 20 12.791 27.780 26.698 153 HB2 LYS 20 HB2 LYS 20 11.871 25.508 26.499 154 HB3 LYS 20 HB3 LYS 20 13.017 24.939 27.727 155 HG2 LYS 20 HG2 LYS 20 11.952 26.608 29.344 156 HG3 LYS 20 HG3 LYS 20 10.726 26.916 28.111 157 HD2 LYS 20 HD2 LYS 20 11.473 24.199 29.163 158 HD3 LYS 20 HD3 LYS 20 10.240 25.195 29.956 159 HE2 LYS 20 HE2 LYS 20 10.105 24.062 27.126 160 HE3 LYS 20 HE3 LYS 20 9.220 23.455 28.527 161 HZ1 LYS 20 HZ1 LYS 20 8.034 25.607 28.621 162 HZ2 LYS 20 HZ2 LYS 20 8.839 26.130 27.300 163 HZ3 LYS 20 HZ3 LYS 20 7.821 24.860 27.166 164 H CYS 21 H CYS 21 12.999 28.988 28.465 165 HA CYS 21 HA CYS 21 15.478 28.860 30.092 166 HB2 CYS 21 HB2 CYS 21 14.907 30.964 29.039 167 HB3 CYS 21 HB3 CYS 21 13.285 30.918 29.718 168 H ILE 22 H ILE 22 15.523 28.478 32.267 169 HA ILE 22 HA ILE 22 12.963 28.192 33.755 170 HB ILE 22 HB ILE 22 14.132 26.075 33.226 171 HG12 ILE 22 HG12 ILE 22 13.851 26.610 36.210 172 HG13 ILE 22 HG13 ILE 22 12.513 26.365 35.083 173 HG21 ILE 22 HG21 ILE 22 16.482 26.890 33.496 174 HG22 ILE 22 HG22 ILE 22 16.227 26.950 35.254 175 HG23 ILE 22 HG23 ILE 22 16.146 25.413 34.377 176 HD11 ILE 22 HD11 ILE 22 13.512 24.123 34.493 177 HD12 ILE 22 HD12 ILE 22 14.679 24.371 35.814 178 HD13 ILE 22 HD13 ILE 22 12.948 24.273 36.174 179 H GLY 23 H GLY 23 14.506 30.597 33.367 180 HA2 GLY 23 HA2 GLY 23 14.345 32.463 34.847 181 HA3 GLY 23 HA3 GLY 23 14.766 31.437 36.215 182 H GLU 24 H GLU 24 16.999 30.613 36.313 183 HA GLU 24 HA GLU 24 18.937 32.696 35.496 184 HB2 GLU 24 HB2 GLU 24 19.223 30.263 37.304 185 HB3 GLU 24 HB3 GLU 24 20.488 31.459 36.981 186 HG2 GLU 24 HG2 GLU 24 18.887 33.255 37.762 187 HG3 GLU 24 HG3 GLU 24 17.814 31.978 38.337 188 H LYS 25 H LYS 25 18.118 29.508 34.407 189 HA LYS 25 HA LYS 25 20.384 29.509 32.466 190 HB2 LYS 25 HB2 LYS 25 19.577 27.177 34.259 191 HB3 LYS 25 HB3 LYS 25 20.738 27.072 32.944 192 HG2 LYS 25 HG2 LYS 25 21.099 28.779 35.441 193 HG3 LYS 25 HG3 LYS 25 21.805 27.194 35.162 194 HD2 LYS 25 HD2 LYS 25 23.132 28.006 33.307 195 HD3 LYS 25 HD3 LYS 25 22.378 29.609 33.389 196 HE2 LYS 25 HE2 LYS 25 23.253 29.894 35.703 197 HE3 LYS 25 HE3 LYS 25 24.050 28.318 35.580 198 HZ1 LYS 25 HZ1 LYS 25 25.276 29.225 33.644 199 HZ2 LYS 25 HZ2 LYS 25 24.675 30.732 33.939 200 HZ3 LYS 25 HZ3 LYS 25 25.657 29.993 35.015 201 H CYS 26 H CYS 26 20.073 27.609 30.890 202 HA CYS 26 HA CYS 26 17.220 27.373 30.044 203 HB2 CYS 26 HB2 CYS 26 18.212 29.321 28.963 204 HB3 CYS 26 HB3 CYS 26 19.575 28.358 28.417 205 H LYS 27 H LYS 27 16.655 25.611 28.852 206 HA LYS 27 HA LYS 27 18.653 23.436 28.314 207 HB2 LYS 27 HB2 LYS 27 15.894 23.245 29.524 208 HB3 LYS 27 HB3 LYS 27 16.824 21.878 28.882 209 HG2 LYS 27 HG2 LYS 27 18.738 22.531 30.423 210 HG3 LYS 27 HG3 LYS 27 17.653 23.722 31.184 211 HD2 LYS 27 HD2 LYS 27 16.068 21.967 31.721 212 HD3 LYS 27 HD3 LYS 27 17.092 20.773 30.873 213 HE2 LYS 27 HE2 LYS 27 18.947 21.224 32.461 214 HE3 LYS 27 HE3 LYS 27 17.936 22.388 33.317 215 HZ1 LYS 27 HZ1 LYS 27 17.953 20.240 34.411 216 HZ2 LYS 27 HZ2 LYS 27 16.444 20.579 33.926 217 HZ3 LYS 27 HZ3 LYS 27 17.368 19.487 33.083 218 H CYS 28 H CYS 28 18.176 22.068 26.484 219 HA CYS 28 HA CYS 28 16.527 23.393 24.410 220 HB2 CYS 28 HB2 CYS 28 17.982 20.799 24.065 221 HB3 CYS 28 HB3 CYS 28 17.358 21.861 22.854 222 H VAL 29 H VAL 29 14.636 22.560 23.495 223 HA VAL 29 HA VAL 29 13.207 20.478 25.079 224 HB VAL 29 HB VAL 29 11.142 21.320 24.037 225 HG11 VAL 29 HG11 VAL 29 10.980 23.342 25.405 226 HG12 VAL 29 HG12 VAL 29 11.828 22.048 26.276 227 HG13 VAL 29 HG13 VAL 29 12.751 23.396 25.572 228 HG21 VAL 29 HG21 VAL 29 12.104 22.454 22.015 229 HG22 VAL 29 HG22 VAL 29 11.029 23.489 22.962 230 HG23 VAL 29 HG23 VAL 29 12.781 23.702 23.082 231 HA PRO 30 HA PRO 30 13.936 17.687 21.879 232 HB2 PRO 30 HB2 PRO 30 12.022 15.750 22.193 233 HB3 PRO 30 HB3 PRO 30 13.363 16.035 23.348 234 HG2 PRO 30 HG2 PRO 30 10.505 17.057 23.517 235 HG3 PRO 30 HG3 PRO 30 11.478 16.267 24.791 236 HD2 PRO 30 HD2 PRO 30 11.251 18.968 24.650 237 HD3 PRO 30 HD3 PRO 30 12.789 18.197 25.142 238 H TYR 31 H TYR 31 13.782 18.032 19.833 239 HA TYR 31 HA TYR 31 11.180 17.993 18.360 240 HB2 TYR 31 HB2 TYR 31 13.662 19.674 17.966 241 HB3 TYR 31 HB3 TYR 31 12.740 19.159 16.578 242 HD1 TYR 31 HD1 TYR 31 12.014 20.758 19.940 243 HD2 TYR 31 HD2 TYR 31 11.217 20.602 15.709 244 HE1 TYR 31 HE1 TYR 31 10.467 22.707 20.153 245 HE2 TYR 31 HE2 TYR 31 9.706 22.551 15.913 246 HH TYR 31 HH TYR 31 8.947 24.178 17.249 Start of MODEL 4 1 H1 ALA 1 H1 ALA 1 16.731 36.780 37.383 2 H2 ALA 1 H2 ALA 1 15.204 37.244 36.955 3 H3 ALA 1 H3 ALA 1 16.501 38.066 36.378 4 HA ALA 1 HA ALA 1 16.052 35.228 35.857 5 HB1 ALA 1 HB1 ALA 1 14.121 36.392 34.963 6 HB2 ALA 1 HB2 ALA 1 15.163 37.565 34.120 7 HB3 ALA 1 HB3 ALA 1 15.158 35.852 33.632 8 H PHE 2 H PHE 2 18.297 34.735 35.936 9 HA PHE 2 HA PHE 2 20.247 36.167 34.396 10 HB2 PHE 2 HB2 PHE 2 20.558 33.281 35.250 11 HB3 PHE 2 HB3 PHE 2 21.801 34.479 34.977 12 HD1 PHE 2 HD1 PHE 2 20.500 32.655 37.517 13 HD2 PHE 2 HD2 PHE 2 21.118 36.800 36.472 14 HE1 PHE 2 HE1 PHE 2 20.496 33.264 39.916 15 HE2 PHE 2 HE2 PHE 2 21.116 37.393 38.843 16 HZ PHE 2 HZ PHE 2 20.794 35.643 40.603 17 H CYS 3 H CYS 3 17.791 34.483 33.230 18 HA CYS 3 HA CYS 3 18.663 32.611 31.339 19 HB2 CYS 3 HB2 CYS 3 16.386 32.755 32.040 20 HB3 CYS 3 HB3 CYS 3 16.258 34.442 31.565 21 H ASN 4 H ASN 4 19.619 32.669 29.468 22 HA ASN 4 HA ASN 4 19.369 35.012 27.625 23 HB2 ASN 4 HB2 ASN 4 21.683 33.088 28.049 24 HB3 ASN 4 HB3 ASN 4 21.486 34.032 26.571 25 HD21 ASN 4 HD21 ASN 4 22.450 37.091 28.014 26 HD22 ASN 4 HD22 ASN 4 21.388 36.406 26.783 27 H LEU 5 H LEU 5 17.237 33.960 27.349 28 HA LEU 5 HA LEU 5 16.727 31.508 26.110 29 HB2 LEU 5 HB2 LEU 5 14.974 32.906 27.012 30 HB3 LEU 5 HB3 LEU 5 15.393 34.235 25.943 31 HG LEU 5 HG LEU 5 14.606 32.903 23.975 32 HD11 LEU 5 HD11 LEU 5 14.902 30.614 24.908 33 HD12 LEU 5 HD12 LEU 5 13.626 30.960 26.111 34 HD13 LEU 5 HD13 LEU 5 13.246 30.903 24.378 35 HD21 LEU 5 HD21 LEU 5 13.123 34.502 25.098 36 HD22 LEU 5 HD22 LEU 5 12.206 33.093 24.534 37 HD23 LEU 5 HD23 LEU 5 12.624 33.247 26.251 38 H ARG 6 H ARG 6 17.300 34.657 24.446 39 HA ARG 6 HA ARG 6 17.002 33.500 21.815 40 HB2 ARG 6 HB2 ARG 6 18.286 36.143 22.636 41 HB3 ARG 6 HB3 ARG 6 17.770 35.705 21.007 42 HG2 ARG 6 HG2 ARG 6 15.936 36.065 23.427 43 HG3 ARG 6 HG3 ARG 6 16.128 37.165 22.070 44 HD2 ARG 6 HD2 ARG 6 15.230 35.443 20.543 45 HD3 ARG 6 HD3 ARG 6 15.121 34.302 21.892 46 HE ARG 6 HE ARG 6 13.541 36.792 22.151 47 HH11 ARG 6 HH11 ARG 6 13.417 33.332 21.297 48 HH12 ARG 6 HH12 ARG 6 11.714 33.288 21.713 49 HH21 ARG 6 HH21 ARG 6 11.408 36.558 22.488 50 HH22 ARG 6 HH22 ARG 6 10.652 34.960 22.357 51 H ARG 7 H ARG 7 19.861 33.776 23.829 52 HA ARG 7 HA ARG 7 21.648 32.773 21.734 53 HB2 ARG 7 HB2 ARG 7 22.424 34.022 23.778 54 HB3 ARG 7 HB3 ARG 7 21.937 32.615 24.746 55 HG2 ARG 7 HG2 ARG 7 23.524 31.187 23.307 56 HG3 ARG 7 HG3 ARG 7 24.047 32.692 22.549 57 HD2 ARG 7 HD2 ARG 7 25.597 32.028 24.269 58 HD3 ARG 7 HD3 ARG 7 24.790 33.534 24.760 59 HE ARG 7 HE ARG 7 23.415 31.194 25.791 60 HH11 ARG 7 HH11 ARG 7 26.441 32.888 26.359 61 HH12 ARG 7 HH12 ARG 7 26.509 32.320 28.005 62 HH21 ARG 7 HH21 ARG 7 23.456 30.701 27.875 63 HH22 ARG 7 HH22 ARG 7 24.790 31.215 28.896 64 H CYS 8 H CYS 8 19.726 31.269 24.364 65 HA CYS 8 HA CYS 8 20.671 28.623 24.050 66 HB2 CYS 8 HB2 CYS 8 19.401 29.506 25.977 67 HB3 CYS 8 HB3 CYS 8 17.952 29.595 24.970 68 H GLU 9 H GLU 9 17.972 30.284 22.370 69 HA GLU 9 HA GLU 9 17.109 28.116 20.741 70 HB2 GLU 9 HB2 GLU 9 17.144 31.125 20.238 71 HB3 GLU 9 HB3 GLU 9 16.325 29.954 19.196 72 HG2 GLU 9 HG2 GLU 9 14.962 29.187 21.140 73 HG3 GLU 9 HG3 GLU 9 15.681 30.454 22.131 74 H LEU 10 H LEU 10 19.965 30.220 20.224 75 HA LEU 10 HA LEU 10 20.481 28.774 17.686 76 HB2 LEU 10 HB2 LEU 10 22.247 30.290 17.237 77 HB3 LEU 10 HB3 LEU 10 20.719 31.098 17.513 78 HG LEU 10 HG LEU 10 21.547 31.742 19.810 79 HD11 LEU 10 HD11 LEU 10 23.432 30.197 20.173 80 HD12 LEU 10 HD12 LEU 10 24.216 30.759 18.681 81 HD13 LEU 10 HD13 LEU 10 24.053 31.836 20.083 82 HD21 LEU 10 HD21 LEU 10 22.919 33.579 18.957 83 HD22 LEU 10 HD22 LEU 10 23.166 32.705 17.424 84 HD23 LEU 10 HD23 LEU 10 21.545 33.274 17.885 85 H SER 11 H SER 11 21.390 28.519 21.010 86 HA SER 11 HA SER 11 23.793 26.947 20.584 87 HB2 SER 11 HB2 SER 11 23.274 28.168 22.669 88 HB3 SER 11 HB3 SER 11 21.920 27.069 22.977 89 HG SER 11 HG SER 11 23.265 25.497 23.510 90 H CYS 12 H CYS 12 20.387 26.066 21.294 91 HA CYS 12 HA CYS 12 20.785 23.214 21.031 92 HB2 CYS 12 HB2 CYS 12 18.277 24.929 20.943 93 HB3 CYS 12 HB3 CYS 12 18.305 23.166 21.024 94 H ARG 13 H ARG 13 20.453 25.721 18.689 95 HA ARG 13 HA ARG 13 19.324 24.356 16.477 96 HB2 ARG 13 HB2 ARG 13 19.879 26.824 16.786 97 HB3 ARG 13 HB3 ARG 13 21.557 26.404 16.420 98 HG2 ARG 13 HG2 ARG 13 20.862 25.622 14.169 99 HG3 ARG 13 HG3 ARG 13 19.167 25.948 14.572 100 HD2 ARG 13 HD2 ARG 13 20.097 27.788 13.251 101 HD3 ARG 13 HD3 ARG 13 19.690 28.339 14.887 102 HE ARG 13 HE ARG 13 22.480 27.460 14.550 103 HH11 ARG 13 HH11 ARG 13 20.415 30.353 14.356 104 HH12 ARG 13 HH12 ARG 13 21.849 31.324 14.019 105 HH21 ARG 13 HH21 ARG 13 24.132 28.873 14.378 106 HH22 ARG 13 HH22 ARG 13 23.772 30.574 14.133 107 H SER 14 H SER 14 22.577 24.071 17.876 108 HA SER 14 HA SER 14 23.701 22.616 15.636 109 HB2 SER 14 HB2 SER 14 25.172 23.557 17.336 110 HB3 SER 14 HB3 SER 14 24.435 22.522 18.580 111 HG SER 14 HG SER 14 25.781 21.604 16.230 112 H LEU 15 H LEU 15 21.710 21.651 18.389 113 HA LEU 15 HA LEU 15 21.703 18.805 17.634 114 HB2 LEU 15 HB2 LEU 15 20.003 20.220 19.711 115 HB3 LEU 15 HB3 LEU 15 20.312 18.497 19.573 116 HG LEU 15 HG LEU 15 22.312 20.646 20.401 117 HD11 LEU 15 HD11 LEU 15 20.607 20.065 22.091 118 HD12 LEU 15 HD12 LEU 15 21.049 18.347 21.953 119 HD13 LEU 15 HD13 LEU 15 22.222 19.531 22.575 120 HD21 LEU 15 HD21 LEU 15 23.854 18.787 20.916 121 HD22 LEU 15 HD22 LEU 15 22.712 17.627 20.207 122 HD23 LEU 15 HD23 LEU 15 23.506 18.850 19.187 123 H GLY 16 H GLY 16 20.389 21.392 16.150 124 HA2 GLY 16 HA2 GLY 16 18.668 21.703 14.688 125 HA3 GLY 16 HA3 GLY 16 18.263 19.995 14.836 126 H LEU 17 H LEU 17 18.222 21.972 17.772 127 HA LEU 17 HA LEU 17 15.221 21.984 17.717 128 HB2 LEU 17 HB2 LEU 17 16.669 21.956 20.335 129 HB3 LEU 17 HB3 LEU 17 15.055 21.393 19.949 130 HG LEU 17 HG LEU 17 17.656 20.062 19.303 131 HD11 LEU 17 HD11 LEU 17 17.412 19.859 21.603 132 HD12 LEU 17 HD12 LEU 17 15.658 19.557 21.504 133 HD13 LEU 17 HD13 LEU 17 16.843 18.325 20.990 134 HD21 LEU 17 HD21 LEU 17 16.274 18.045 18.747 135 HD22 LEU 17 HD22 LEU 17 14.788 18.977 19.065 136 HD23 LEU 17 HD23 LEU 17 15.834 19.385 17.693 137 H LEU 18 H LEU 18 14.410 23.368 19.462 138 HA LEU 18 HA LEU 18 15.631 26.100 19.522 139 HB2 LEU 18 HB2 LEU 18 12.778 25.105 19.936 140 HB3 LEU 18 HB3 LEU 18 13.290 26.657 20.540 141 HG LEU 18 HG LEU 18 12.098 26.915 18.489 142 HD11 LEU 18 HD11 LEU 18 13.920 28.502 19.010 143 HD12 LEU 18 HD12 LEU 18 15.041 27.531 18.021 144 HD13 LEU 18 HD13 LEU 18 13.648 28.322 17.274 145 HD21 LEU 18 HD21 LEU 18 12.671 24.754 17.387 146 HD22 LEU 18 HD22 LEU 18 12.859 26.178 16.351 147 HD23 LEU 18 HD23 LEU 18 14.295 25.404 17.029 148 H GLY 19 H GLY 19 14.928 27.113 21.803 149 HA2 GLY 19 HA2 GLY 19 15.432 25.229 24.016 150 HA3 GLY 19 HA3 GLY 19 16.626 26.501 23.766 151 H LYS 20 H LYS 20 15.300 26.168 26.104 152 HA LYS 20 HA LYS 20 13.990 28.767 26.500 153 HB2 LYS 20 HB2 LYS 20 12.027 28.060 27.445 154 HB3 LYS 20 HB3 LYS 20 12.161 27.201 25.915 155 HG2 LYS 20 HG2 LYS 20 12.998 25.167 27.186 156 HG3 LYS 20 HG3 LYS 20 12.714 26.079 28.680 157 HD2 LYS 20 HD2 LYS 20 10.298 26.478 27.650 158 HD3 LYS 20 HD3 LYS 20 10.709 25.051 26.677 159 HE2 LYS 20 HE2 LYS 20 11.228 23.804 28.744 160 HE3 LYS 20 HE3 LYS 20 10.902 25.262 29.702 161 HZ1 LYS 20 HZ1 LYS 20 9.014 23.580 29.535 162 HZ2 LYS 20 HZ2 LYS 20 8.598 25.120 29.158 163 HZ3 LYS 20 HZ3 LYS 20 8.866 23.999 27.964 164 H CYS 21 H CYS 21 13.739 29.257 28.870 165 HA CYS 21 HA CYS 21 16.212 28.329 30.244 166 HB2 CYS 21 HB2 CYS 21 14.445 30.775 30.466 167 HB3 CYS 21 HB3 CYS 21 15.751 30.425 31.586 168 H ILE 22 H ILE 22 16.024 26.857 31.818 169 HA ILE 22 HA ILE 22 13.691 26.996 33.703 170 HB ILE 22 HB ILE 22 15.108 24.473 32.794 171 HG12 ILE 22 HG12 ILE 22 12.227 25.356 32.317 172 HG13 ILE 22 HG13 ILE 22 13.500 25.370 31.097 173 HG21 ILE 22 HG21 ILE 22 13.537 23.287 34.264 174 HG22 ILE 22 HG22 ILE 22 14.489 24.416 35.200 175 HG23 ILE 22 HG23 ILE 22 12.816 24.829 34.767 176 HD11 ILE 22 HD11 ILE 22 13.754 22.899 31.336 177 HD12 ILE 22 HD12 ILE 22 12.345 22.898 32.421 178 HD13 ILE 22 HD13 ILE 22 12.166 23.413 30.744 179 H GLY 23 H GLY 23 14.326 27.483 35.737 180 HA2 GLY 23 HA2 GLY 23 15.728 28.133 37.431 181 HA3 GLY 23 HA3 GLY 23 16.784 26.770 37.022 182 H GLU 24 H GLU 24 15.890 29.547 34.955 183 HA GLU 24 HA GLU 24 17.047 30.938 33.654 184 HB2 GLU 24 HB2 GLU 24 19.237 31.037 35.729 185 HB3 GLU 24 HB3 GLU 24 18.766 32.252 34.548 186 HG2 GLU 24 HG2 GLU 24 17.175 31.392 36.996 187 HG3 GLU 24 HG3 GLU 24 18.052 32.895 36.763 188 H LYS 25 H LYS 25 18.141 27.889 33.968 189 HA LYS 25 HA LYS 25 20.594 28.176 32.335 190 HB2 LYS 25 HB2 LYS 25 20.513 26.772 34.388 191 HB3 LYS 25 HB3 LYS 25 19.344 25.715 33.594 192 HG2 LYS 25 HG2 LYS 25 20.969 25.105 31.887 193 HG3 LYS 25 HG3 LYS 25 22.144 26.270 32.518 194 HD2 LYS 25 HD2 LYS 25 21.059 23.936 34.160 195 HD3 LYS 25 HD3 LYS 25 22.516 23.838 33.162 196 HE2 LYS 25 HE2 LYS 25 23.567 25.662 34.422 197 HE3 LYS 25 HE3 LYS 25 22.124 25.851 35.428 198 HZ1 LYS 25 HZ1 LYS 25 22.482 23.684 36.345 199 HZ2 LYS 25 HZ2 LYS 25 23.688 23.337 35.301 200 HZ3 LYS 25 HZ3 LYS 25 23.912 24.489 36.454 201 H CYS 26 H CYS 26 20.728 27.673 30.268 202 HA CYS 26 HA CYS 26 18.501 27.303 28.561 203 HB2 CYS 26 HB2 CYS 26 20.617 28.206 27.804 204 HB3 CYS 26 HB3 CYS 26 21.445 26.699 28.174 205 H LYS 27 H LYS 27 17.138 25.657 28.488 206 HA LYS 27 HA LYS 27 18.168 22.840 28.255 207 HB2 LYS 27 HB2 LYS 27 15.549 23.893 29.394 208 HB3 LYS 27 HB3 LYS 27 15.661 22.291 28.682 209 HG2 LYS 27 HG2 LYS 27 15.890 22.059 31.041 210 HG3 LYS 27 HG3 LYS 27 17.421 21.636 30.270 211 HD2 LYS 27 HD2 LYS 27 18.407 23.746 30.923 212 HD3 LYS 27 HD3 LYS 27 16.856 24.387 31.431 213 HE2 LYS 27 HE2 LYS 27 18.186 23.799 33.357 214 HE3 LYS 27 HE3 LYS 27 16.761 22.756 33.290 215 HZ1 LYS 27 HZ1 LYS 27 18.103 20.960 32.564 216 HZ2 LYS 27 HZ2 LYS 27 19.404 21.939 32.233 217 HZ3 LYS 27 HZ3 LYS 27 18.950 21.658 33.791 218 H CYS 28 H CYS 28 17.801 21.872 26.346 219 HA CYS 28 HA CYS 28 16.535 23.420 24.202 220 HB2 CYS 28 HB2 CYS 28 17.516 20.564 24.131 221 HB3 CYS 28 HB3 CYS 28 17.082 21.595 22.753 222 H VAL 29 H VAL 29 14.623 22.841 23.016 223 HA VAL 29 HA VAL 29 12.501 22.183 24.856 224 HB VAL 29 HB VAL 29 10.959 22.471 22.969 225 HG11 VAL 29 HG11 VAL 29 11.703 24.388 24.331 226 HG12 VAL 29 HG12 VAL 29 13.051 24.672 23.211 227 HG13 VAL 29 HG13 VAL 29 11.374 24.859 22.662 228 HG21 VAL 29 HG21 VAL 29 13.438 23.042 21.303 229 HG22 VAL 29 HG22 VAL 29 12.352 21.650 21.095 230 HG23 VAL 29 HG23 VAL 29 11.757 23.291 20.817 231 HA PRO 30 HA PRO 30 12.520 17.847 24.254 232 HB2 PRO 30 HB2 PRO 30 10.456 17.038 25.738 233 HB3 PRO 30 HB3 PRO 30 11.773 18.016 26.439 234 HG2 PRO 30 HG2 PRO 30 9.099 19.039 25.403 235 HG3 PRO 30 HG3 PRO 30 9.833 19.332 27.016 236 HD2 PRO 30 HD2 PRO 30 10.131 21.088 24.926 237 HD3 PRO 30 HD3 PRO 30 11.425 20.801 26.131 238 H TYR 31 H TYR 31 11.866 18.777 21.888 239 HA TYR 31 HA TYR 31 9.337 17.678 20.818 240 HB2 TYR 31 HB2 TYR 31 11.701 18.995 19.439 241 HB3 TYR 31 HB3 TYR 31 10.204 18.514 18.660 242 HD1 TYR 31 HD1 TYR 31 10.990 21.077 18.066 243 HD2 TYR 31 HD2 TYR 31 8.900 19.802 21.615 244 HE1 TYR 31 HE1 TYR 31 10.047 23.369 18.348 245 HE2 TYR 31 HE2 TYR 31 8.009 22.094 21.913 246 HH TYR 31 HH TYR 31 7.862 24.196 21.056 Start of MODEL 5 1 H1 ALA 1 H1 ALA 1 20.795 35.202 39.407 2 H2 ALA 1 H2 ALA 1 19.435 34.426 38.918 3 H3 ALA 1 H3 ALA 1 19.598 36.035 38.610 4 HA ALA 1 HA ALA 1 21.425 35.624 37.128 5 HB1 ALA 1 HB1 ALA 1 22.015 33.297 36.536 6 HB2 ALA 1 HB2 ALA 1 22.365 33.676 38.229 7 HB3 ALA 1 HB3 ALA 1 20.935 32.700 37.819 8 H PHE 2 H PHE 2 20.267 36.481 35.479 9 HA PHE 2 HA PHE 2 17.691 35.380 34.621 10 HB2 PHE 2 HB2 PHE 2 19.477 37.544 33.462 11 HB3 PHE 2 HB3 PHE 2 17.877 37.124 32.864 12 HD1 PHE 2 HD1 PHE 2 15.911 37.169 34.543 13 HD2 PHE 2 HD2 PHE 2 19.671 39.184 35.193 14 HE1 PHE 2 HE1 PHE 2 14.814 38.696 36.146 15 HE2 PHE 2 HE2 PHE 2 18.560 40.730 36.788 16 HZ PHE 2 HZ PHE 2 16.121 40.509 37.246 17 H CYS 3 H CYS 3 17.186 34.252 32.785 18 HA CYS 3 HA CYS 3 18.956 32.420 31.528 19 HB2 CYS 3 HB2 CYS 3 16.313 33.655 30.667 20 HB3 CYS 3 HB3 CYS 3 17.058 32.267 29.876 21 H ASN 4 H ASN 4 20.281 32.546 29.747 22 HA ASN 4 HA ASN 4 20.308 35.003 28.052 23 HB2 ASN 4 HB2 ASN 4 22.103 32.551 27.973 24 HB3 ASN 4 HB3 ASN 4 22.247 33.996 26.972 25 HD21 ASN 4 HD21 ASN 4 23.498 36.019 29.727 26 HD22 ASN 4 HD22 ASN 4 22.361 36.174 28.407 27 H LEU 5 H LEU 5 17.983 34.375 27.562 28 HA LEU 5 HA LEU 5 17.201 31.987 26.380 29 HB2 LEU 5 HB2 LEU 5 16.000 34.407 27.100 30 HB3 LEU 5 HB3 LEU 5 15.699 34.343 25.371 31 HG LEU 5 HG LEU 5 15.082 32.116 27.349 32 HD11 LEU 5 HD11 LEU 5 12.719 32.809 27.134 33 HD12 LEU 5 HD12 LEU 5 13.709 34.114 27.794 34 HD13 LEU 5 HD13 LEU 5 13.202 34.164 26.091 35 HD21 LEU 5 HD21 LEU 5 14.229 32.478 24.439 36 HD22 LEU 5 HD22 LEU 5 15.296 31.210 25.088 37 HD23 LEU 5 HD23 LEU 5 13.595 31.237 25.542 38 H ARG 6 H ARG 6 18.432 34.839 24.630 39 HA ARG 6 HA ARG 6 17.947 33.808 21.945 40 HB2 ARG 6 HB2 ARG 6 18.385 36.236 22.551 41 HB3 ARG 6 HB3 ARG 6 20.075 35.826 22.818 42 HG2 ARG 6 HG2 ARG 6 20.227 35.024 20.451 43 HG3 ARG 6 HG3 ARG 6 18.549 35.517 20.193 44 HD2 ARG 6 HD2 ARG 6 20.881 37.340 20.929 45 HD3 ARG 6 HD3 ARG 6 20.173 37.166 19.323 46 HE ARG 6 HE ARG 6 18.024 37.896 20.909 47 HH11 ARG 6 HH11 ARG 6 21.114 39.475 20.197 48 HH12 ARG 6 HH12 ARG 6 20.345 41.039 20.121 49 HH21 ARG 6 HH21 ARG 6 17.348 39.875 21.356 50 HH22 ARG 6 HH22 ARG 6 18.226 41.287 20.797 51 H ARG 7 H ARG 7 20.851 33.813 24.041 52 HA ARG 7 HA ARG 7 22.518 32.243 22.261 53 HB2 ARG 7 HB2 ARG 7 22.682 32.413 25.295 54 HB3 ARG 7 HB3 ARG 7 23.950 31.902 24.193 55 HG2 ARG 7 HG2 ARG 7 24.001 34.231 23.216 56 HG3 ARG 7 HG3 ARG 7 22.796 34.718 24.434 57 HD2 ARG 7 HD2 ARG 7 24.407 33.795 26.189 58 HD3 ARG 7 HD3 ARG 7 25.630 33.708 24.912 59 HE ARG 7 HE ARG 7 24.901 36.295 24.698 60 HH11 ARG 7 HH11 ARG 7 25.919 34.433 27.543 61 HH12 ARG 7 HH12 ARG 7 26.332 35.919 28.400 62 HH21 ARG 7 HH21 ARG 7 25.392 38.091 26.019 63 HH22 ARG 7 HH22 ARG 7 26.103 37.774 27.606 64 H CYS 8 H CYS 8 20.090 31.318 24.621 65 HA CYS 8 HA CYS 8 20.686 28.482 24.618 66 HB2 CYS 8 HB2 CYS 8 19.552 29.500 26.479 67 HB3 CYS 8 HB3 CYS 8 18.275 30.120 25.441 68 H GLU 9 H GLU 9 18.039 30.374 22.992 69 HA GLU 9 HA GLU 9 16.932 28.219 21.522 70 HB2 GLU 9 HB2 GLU 9 17.113 31.199 20.886 71 HB3 GLU 9 HB3 GLU 9 16.279 30.030 19.868 72 HG2 GLU 9 HG2 GLU 9 14.899 29.378 21.919 73 HG3 GLU 9 HG3 GLU 9 15.565 30.792 22.719 74 H LEU 10 H LEU 10 19.532 30.487 20.464 75 HA LEU 10 HA LEU 10 19.825 29.217 17.899 76 HB2 LEU 10 HB2 LEU 10 21.773 30.973 19.448 77 HB3 LEU 10 HB3 LEU 10 21.905 30.583 17.731 78 HG LEU 10 HG LEU 10 19.583 32.087 18.993 79 HD11 LEU 10 HD11 LEU 10 20.539 34.088 17.935 80 HD12 LEU 10 HD12 LEU 10 21.688 33.379 19.081 81 HD13 LEU 10 HD13 LEU 10 21.915 33.133 17.335 82 HD21 LEU 10 HD21 LEU 10 19.020 32.705 16.652 83 HD22 LEU 10 HD22 LEU 10 20.295 31.613 16.068 84 HD23 LEU 10 HD23 LEU 10 18.881 30.971 16.935 85 H SER 11 H SER 11 21.386 28.618 20.968 86 HA SER 11 HA SER 11 23.395 26.779 19.942 87 HB2 SER 11 HB2 SER 11 23.695 27.955 22.053 88 HB3 SER 11 HB3 SER 11 22.285 27.125 22.743 89 HG SER 11 HG SER 11 24.737 25.982 21.861 90 H CYS 12 H CYS 12 20.089 26.239 21.382 91 HA CYS 12 HA CYS 12 20.255 23.347 21.073 92 HB2 CYS 12 HB2 CYS 12 17.841 25.182 21.169 93 HB3 CYS 12 HB3 CYS 12 17.755 23.422 21.160 94 H ARG 13 H ARG 13 19.168 26.018 18.919 95 HA ARG 13 HA ARG 13 18.309 24.358 16.764 96 HB2 ARG 13 HB2 ARG 13 19.170 27.243 17.094 97 HB3 ARG 13 HB3 ARG 13 18.824 26.595 15.507 98 HG2 ARG 13 HG2 ARG 13 16.566 26.118 16.004 99 HG3 ARG 13 HG3 ARG 13 16.827 26.187 17.748 100 HD2 ARG 13 HD2 ARG 13 15.535 28.094 16.896 101 HD3 ARG 13 HD3 ARG 13 17.003 28.573 17.746 102 HE ARG 13 HE ARG 13 17.848 28.561 15.128 103 HH11 ARG 13 HH11 ARG 13 15.197 30.206 16.733 104 HH12 ARG 13 HH12 ARG 13 15.255 31.528 15.568 105 HH21 ARG 13 HH21 ARG 13 17.981 30.310 13.902 106 HH22 ARG 13 HH22 ARG 13 16.743 31.559 13.950 107 H SER 14 H SER 14 21.569 25.640 17.542 108 HA SER 14 HA SER 14 22.882 24.570 15.242 109 HB2 SER 14 HB2 SER 14 23.907 26.170 16.871 110 HB3 SER 14 HB3 SER 14 23.999 24.861 18.058 111 HG SER 14 HG SER 14 25.332 25.111 15.571 112 H LEU 15 H LEU 15 22.047 23.057 18.370 113 HA LEU 15 HA LEU 15 23.125 20.441 17.644 114 HB2 LEU 15 HB2 LEU 15 21.257 21.332 19.874 115 HB3 LEU 15 HB3 LEU 15 21.960 19.726 19.740 116 HG LEU 15 HG LEU 15 23.614 22.272 20.053 117 HD11 LEU 15 HD11 LEU 15 22.198 21.888 22.026 118 HD12 LEU 15 HD12 LEU 15 22.785 20.209 22.133 119 HD13 LEU 15 HD13 LEU 15 23.901 21.571 22.387 120 HD21 LEU 15 HD21 LEU 15 25.411 20.712 20.697 121 HD22 LEU 15 HD22 LEU 15 24.354 19.330 20.333 122 HD23 LEU 15 HD23 LEU 15 24.888 20.429 19.034 123 H GLY 16 H GLY 16 20.372 22.040 16.525 124 HA2 GLY 16 HA2 GLY 16 18.989 21.199 14.850 125 HA3 GLY 16 HA3 GLY 16 19.326 19.549 15.341 126 H LEU 17 H LEU 17 18.175 21.901 17.762 127 HA LEU 17 HA LEU 17 15.360 21.049 17.518 128 HB2 LEU 17 HB2 LEU 17 15.281 20.319 19.853 129 HB3 LEU 17 HB3 LEU 17 16.089 19.202 18.768 130 HG LEU 17 HG LEU 17 17.502 21.037 20.748 131 HD11 LEU 17 HD11 LEU 17 16.717 18.087 20.939 132 HD12 LEU 17 HD12 LEU 17 17.704 18.955 22.127 133 HD13 LEU 17 HD13 LEU 17 16.008 19.409 21.881 134 HD21 LEU 17 HD21 LEU 17 19.111 20.308 19.131 135 HD22 LEU 17 HD22 LEU 17 19.341 19.302 20.548 136 HD23 LEU 17 HD23 LEU 17 18.476 18.645 19.137 137 H LEU 18 H LEU 18 13.970 22.070 19.269 138 HA LEU 18 HA LEU 18 14.610 24.947 19.335 139 HB2 LEU 18 HB2 LEU 18 12.172 23.286 20.003 140 HB3 LEU 18 HB3 LEU 18 12.323 24.934 20.590 141 HG LEU 18 HG LEU 18 12.586 25.763 18.268 142 HD11 LEU 18 HD11 LEU 18 13.416 23.810 17.065 143 HD12 LEU 18 HD12 LEU 18 11.937 22.897 17.467 144 HD13 LEU 18 HD13 LEU 18 11.866 24.302 16.383 145 HD21 LEU 18 HD21 LEU 18 10.392 25.719 19.408 146 HD22 LEU 18 HD22 LEU 18 10.228 25.499 17.662 147 HD23 LEU 18 HD23 LEU 18 10.081 24.101 18.749 148 H GLY 19 H GLY 19 14.587 26.226 21.224 149 HA2 GLY 19 HA2 GLY 19 15.696 24.852 23.658 150 HA3 GLY 19 HA3 GLY 19 16.341 26.352 23.003 151 H LYS 20 H LYS 20 15.456 25.821 25.669 152 HA LYS 20 HA LYS 20 13.785 28.193 26.111 153 HB2 LYS 20 HB2 LYS 20 12.098 27.125 27.421 154 HB3 LYS 20 HB3 LYS 20 12.106 26.479 25.777 155 HG2 LYS 20 HG2 LYS 20 13.407 24.503 26.602 156 HG3 LYS 20 HG3 LYS 20 13.309 25.118 28.260 157 HD2 LYS 20 HD2 LYS 20 10.918 24.752 26.487 158 HD3 LYS 20 HD3 LYS 20 11.602 23.395 27.438 159 HE2 LYS 20 HE2 LYS 20 11.267 24.951 29.493 160 HE3 LYS 20 HE3 LYS 20 10.233 25.920 28.427 161 HZ1 LYS 20 HZ1 LYS 20 9.007 23.825 27.958 162 HZ2 LYS 20 HZ2 LYS 20 9.920 23.046 29.091 163 HZ3 LYS 20 HZ3 LYS 20 8.887 24.256 29.546 164 H CYS 21 H CYS 21 13.442 28.414 28.551 165 HA CYS 21 HA CYS 21 15.683 27.343 30.195 166 HB2 CYS 21 HB2 CYS 21 16.611 29.324 29.122 167 HB3 CYS 21 HB3 CYS 21 15.250 30.297 29.670 168 H ILE 22 H ILE 22 15.031 26.825 32.163 169 HA ILE 22 HA ILE 22 12.251 27.248 32.913 170 HB ILE 22 HB ILE 22 14.525 25.937 34.442 171 HG12 ILE 22 HG12 ILE 22 12.252 24.638 32.869 172 HG13 ILE 22 HG13 ILE 22 13.873 24.870 32.226 173 HG21 ILE 22 HG21 ILE 22 11.525 25.863 34.988 174 HG22 ILE 22 HG22 ILE 22 12.779 24.921 35.840 175 HG23 ILE 22 HG23 ILE 22 12.751 26.660 35.992 176 HD11 ILE 22 HD11 ILE 22 14.815 23.493 34.086 177 HD12 ILE 22 HD12 ILE 22 13.149 23.102 34.584 178 HD13 ILE 22 HD13 ILE 22 13.732 22.621 32.986 179 H GLY 23 H GLY 23 15.322 28.465 34.194 180 HA2 GLY 23 HA2 GLY 23 14.130 31.015 34.861 181 HA3 GLY 23 HA3 GLY 23 14.359 30.042 36.314 182 H GLU 24 H GLU 24 16.967 29.004 34.728 183 HA GLU 24 HA GLU 24 18.667 31.446 34.972 184 HB2 GLU 24 HB2 GLU 24 20.172 30.436 36.612 185 HB3 GLU 24 HB3 GLU 24 18.544 30.666 37.274 186 HG2 GLU 24 HG2 GLU 24 18.064 28.265 37.019 187 HG3 GLU 24 HG3 GLU 24 19.618 27.998 36.245 188 H LYS 25 H LYS 25 18.342 28.147 33.812 189 HA LYS 25 HA LYS 25 20.556 28.619 31.924 190 HB2 LYS 25 HB2 LYS 25 21.666 26.548 32.287 191 HB3 LYS 25 HB3 LYS 25 21.606 27.403 33.819 192 HG2 LYS 25 HG2 LYS 25 19.842 25.936 34.645 193 HG3 LYS 25 HG3 LYS 25 19.633 25.203 33.048 194 HD2 LYS 25 HD2 LYS 25 20.823 23.641 34.293 195 HD3 LYS 25 HD3 LYS 25 21.985 24.331 33.170 196 HE2 LYS 25 HE2 LYS 25 23.002 25.672 34.920 197 HE3 LYS 25 HE3 LYS 25 21.673 25.317 36.034 198 HZ1 LYS 25 HZ1 LYS 25 23.619 23.315 35.021 199 HZ2 LYS 25 HZ2 LYS 25 23.552 23.915 36.557 200 HZ3 LYS 25 HZ3 LYS 25 22.328 22.995 36.005 201 H CYS 26 H CYS 26 20.581 27.428 30.119 202 HA CYS 26 HA CYS 26 18.091 26.968 28.878 203 HB2 CYS 26 HB2 CYS 26 20.194 27.803 27.874 204 HB3 CYS 26 HB3 CYS 26 20.890 26.194 28.011 205 H LYS 27 H LYS 27 16.923 25.194 28.274 206 HA LYS 27 HA LYS 27 17.985 22.460 28.361 207 HB2 LYS 27 HB2 LYS 27 16.474 22.992 30.349 208 HB3 LYS 27 HB3 LYS 27 15.221 23.492 29.209 209 HG2 LYS 27 HG2 LYS 27 14.672 21.287 29.907 210 HG3 LYS 27 HG3 LYS 27 15.256 21.157 28.253 211 HD2 LYS 27 HD2 LYS 27 17.599 20.692 29.415 212 HD3 LYS 27 HD3 LYS 27 16.606 20.357 30.850 213 HE2 LYS 27 HE2 LYS 27 15.187 18.851 29.350 214 HE3 LYS 27 HE3 LYS 27 16.406 19.085 28.089 215 HZ1 LYS 27 HZ1 LYS 27 17.022 17.912 30.766 216 HZ2 LYS 27 HZ2 LYS 27 16.632 16.999 29.470 217 HZ3 LYS 27 HZ3 LYS 27 18.003 17.892 29.446 218 H CYS 28 H CYS 28 17.461 21.312 26.463 219 HA CYS 28 HA CYS 28 15.925 22.809 24.377 220 HB2 CYS 28 HB2 CYS 28 17.621 20.358 24.001 221 HB3 CYS 28 HB3 CYS 28 16.963 21.441 22.777 222 H VAL 29 H VAL 29 14.434 21.570 22.969 223 HA VAL 29 HA VAL 29 12.959 19.459 24.484 224 HB VAL 29 HB VAL 29 10.896 20.327 23.436 225 HG11 VAL 29 HG11 VAL 29 12.370 22.234 25.284 226 HG12 VAL 29 HG12 VAL 29 10.612 22.128 25.064 227 HG13 VAL 29 HG13 VAL 29 11.493 20.769 25.787 228 HG21 VAL 29 HG21 VAL 29 11.940 21.708 21.630 229 HG22 VAL 29 HG22 VAL 29 10.754 22.580 22.615 230 HG23 VAL 29 HG23 VAL 29 12.484 22.851 22.876 231 HA PRO 30 HA PRO 30 13.840 16.953 21.069 232 HB2 PRO 30 HB2 PRO 30 11.424 15.286 21.736 233 HB3 PRO 30 HB3 PRO 30 13.122 14.784 21.486 234 HG2 PRO 30 HG2 PRO 30 12.119 14.996 23.983 235 HG3 PRO 30 HG3 PRO 30 13.763 15.622 23.627 236 HD2 PRO 30 HD2 PRO 30 11.167 17.176 23.799 237 HD3 PRO 30 HD3 PRO 30 12.757 17.512 24.536 238 H TYR 31 H TYR 31 13.663 17.202 19.016 239 HA TYR 31 HA TYR 31 11.141 16.953 17.480 240 HB2 TYR 31 HB2 TYR 31 13.179 19.200 17.305 241 HB3 TYR 31 HB3 TYR 31 12.227 18.723 15.921 242 HD1 TYR 31 HD1 TYR 31 12.076 20.247 19.270 243 HD2 TYR 31 HD2 TYR 31 9.851 19.175 15.739 244 HE1 TYR 31 HE1 TYR 31 10.220 21.735 19.989 245 HE2 TYR 31 HE2 TYR 31 7.994 20.694 16.453 246 HH TYR 31 HH TYR 31 7.248 22.175 18.023 Start of MODEL 6 1 H1 ALA 1 H1 ALA 1 24.797 33.345 36.480 2 H2 ALA 1 H2 ALA 1 26.272 33.656 35.849 3 H3 ALA 1 H3 ALA 1 25.361 32.416 35.240 4 HA ALA 1 HA ALA 1 24.752 35.282 35.084 5 HB1 ALA 1 HB1 ALA 1 25.099 35.034 32.656 6 HB2 ALA 1 HB2 ALA 1 26.568 34.613 33.555 7 HB3 ALA 1 HB3 ALA 1 25.540 33.330 32.873 8 H PHE 2 H PHE 2 22.827 35.855 33.986 9 HA PHE 2 HA PHE 2 20.499 34.216 34.501 10 HB2 PHE 2 HB2 PHE 2 21.047 36.843 33.100 11 HB3 PHE 2 HB3 PHE 2 19.466 36.097 33.014 12 HD1 PHE 2 HD1 PHE 2 17.933 36.126 34.804 13 HD2 PHE 2 HD2 PHE 2 21.990 37.429 35.457 14 HE1 PHE 2 HE1 PHE 2 17.307 36.922 37.053 15 HE2 PHE 2 HE2 PHE 2 21.356 38.205 37.727 16 HZ PHE 2 HZ PHE 2 19.018 37.972 38.527 17 H CYS 3 H CYS 3 18.856 33.671 32.842 18 HA CYS 3 HA CYS 3 19.887 32.259 30.498 19 HB2 CYS 3 HB2 CYS 3 17.129 32.994 31.533 20 HB3 CYS 3 HB3 CYS 3 17.363 32.223 29.983 21 H ASN 4 H ASN 4 20.090 33.024 28.480 22 HA ASN 4 HA ASN 4 18.618 35.465 27.584 23 HB2 ASN 4 HB2 ASN 4 21.471 34.559 27.130 24 HB3 ASN 4 HB3 ASN 4 20.650 35.582 25.960 25 HD21 ASN 4 HD21 ASN 4 20.798 38.478 27.918 26 HD22 ASN 4 HD22 ASN 4 20.196 37.704 26.452 27 H LEU 5 H LEU 5 16.887 34.457 26.750 28 HA LEU 5 HA LEU 5 16.771 31.852 25.673 29 HB2 LEU 5 HB2 LEU 5 14.897 33.088 26.572 30 HB3 LEU 5 HB3 LEU 5 14.936 34.256 25.260 31 HG LEU 5 HG LEU 5 14.533 31.305 24.684 32 HD11 LEU 5 HD11 LEU 5 12.909 31.879 26.431 33 HD12 LEU 5 HD12 LEU 5 12.368 33.286 25.492 34 HD13 LEU 5 HD13 LEU 5 12.096 31.640 24.878 35 HD21 LEU 5 HD21 LEU 5 13.525 33.852 23.317 36 HD22 LEU 5 HD22 LEU 5 14.770 32.755 22.680 37 HD23 LEU 5 HD23 LEU 5 13.114 32.200 22.824 38 H ARG 6 H ARG 6 17.207 34.954 23.947 39 HA ARG 6 HA ARG 6 16.977 33.887 21.282 40 HB2 ARG 6 HB2 ARG 6 16.717 36.290 21.988 41 HB3 ARG 6 HB3 ARG 6 18.469 36.381 22.222 42 HG2 ARG 6 HG2 ARG 6 18.850 35.894 19.853 43 HG3 ARG 6 HG3 ARG 6 17.110 35.666 19.596 44 HD2 ARG 6 HD2 ARG 6 18.344 38.278 20.558 45 HD3 ARG 6 HD3 ARG 6 18.126 37.895 18.858 46 HE ARG 6 HE ARG 6 16.040 38.652 20.767 47 HH11 ARG 6 HH11 ARG 6 16.529 36.988 17.665 48 HH12 ARG 6 HH12 ARG 6 14.945 37.524 17.110 49 HH21 ARG 6 HH21 ARG 6 14.021 39.219 19.868 50 HH22 ARG 6 HH22 ARG 6 13.661 38.639 18.240 51 H ARG 7 H ARG 7 19.669 33.954 23.533 52 HA ARG 7 HA ARG 7 21.576 32.943 21.478 53 HB2 ARG 7 HB2 ARG 7 21.988 33.402 24.453 54 HB3 ARG 7 HB3 ARG 7 23.232 32.977 23.265 55 HG2 ARG 7 HG2 ARG 7 22.586 35.150 22.031 56 HG3 ARG 7 HG3 ARG 7 21.677 35.585 23.482 57 HD2 ARG 7 HD2 ARG 7 24.671 35.099 23.242 58 HD3 ARG 7 HD3 ARG 7 23.851 36.634 23.540 59 HE ARG 7 HE ARG 7 23.842 34.320 25.477 60 HH11 ARG 7 HH11 ARG 7 24.229 37.818 25.112 61 HH12 ARG 7 HH12 ARG 7 24.152 38.018 26.857 62 HH21 ARG 7 HH21 ARG 7 23.990 34.672 27.525 63 HH22 ARG 7 HH22 ARG 7 24.218 36.266 28.196 64 H CYS 8 H CYS 8 19.694 31.695 24.214 65 HA CYS 8 HA CYS 8 20.823 29.062 24.350 66 HB2 CYS 8 HB2 CYS 8 19.332 30.012 26.058 67 HB3 CYS 8 HB3 CYS 8 18.022 30.086 24.908 68 H GLU 9 H GLU 9 18.173 30.401 22.333 69 HA GLU 9 HA GLU 9 17.410 28.168 20.848 70 HB2 GLU 9 HB2 GLU 9 17.819 31.096 20.138 71 HB3 GLU 9 HB3 GLU 9 17.166 29.962 18.950 72 HG2 GLU 9 HG2 GLU 9 15.871 30.269 21.679 73 HG3 GLU 9 HG3 GLU 9 15.528 31.374 20.362 74 H LEU 10 H LEU 10 20.304 30.204 20.254 75 HA LEU 10 HA LEU 10 21.047 28.905 17.789 76 HB2 LEU 10 HB2 LEU 10 22.866 30.346 19.764 77 HB3 LEU 10 HB3 LEU 10 23.163 30.084 18.055 78 HG LEU 10 HG LEU 10 20.938 31.837 19.191 79 HD11 LEU 10 HD11 LEU 10 23.605 32.563 17.936 80 HD12 LEU 10 HD12 LEU 10 22.337 33.709 18.433 81 HD13 LEU 10 HD13 LEU 10 23.176 32.731 19.651 82 HD21 LEU 10 HD21 LEU 10 21.965 31.546 16.337 83 HD22 LEU 10 HD22 LEU 10 20.388 30.963 16.931 84 HD23 LEU 10 HD23 LEU 10 20.731 32.695 16.892 85 H SER 11 H SER 11 21.883 28.336 21.168 86 HA SER 11 HA SER 11 23.917 26.333 20.763 87 HB2 SER 11 HB2 SER 11 23.560 27.749 22.815 88 HB3 SER 11 HB3 SER 11 22.121 26.778 23.185 89 HG SER 11 HG SER 11 23.780 25.903 24.304 90 H CYS 12 H CYS 12 20.379 26.165 21.072 91 HA CYS 12 HA CYS 12 20.338 23.225 20.977 92 HB2 CYS 12 HB2 CYS 12 18.134 25.290 20.729 93 HB3 CYS 12 HB3 CYS 12 17.895 23.562 20.895 94 H ARG 13 H ARG 13 20.070 25.884 18.599 95 HA ARG 13 HA ARG 13 18.990 24.356 16.447 96 HB2 ARG 13 HB2 ARG 13 19.016 26.812 16.507 97 HB3 ARG 13 HB3 ARG 13 20.777 26.818 16.390 98 HG2 ARG 13 HG2 ARG 13 20.673 25.835 14.132 99 HG3 ARG 13 HG3 ARG 13 18.925 25.628 14.287 100 HD2 ARG 13 HD2 ARG 13 19.366 27.520 12.883 101 HD3 ARG 13 HD3 ARG 13 18.637 28.090 14.388 102 HE ARG 13 HE ARG 13 21.415 28.259 14.790 103 HH11 ARG 13 HH11 ARG 13 19.176 29.788 12.523 104 HH12 ARG 13 HH12 ARG 13 20.198 31.197 12.371 105 HH21 ARG 13 HH21 ARG 13 22.627 30.020 14.534 106 HH22 ARG 13 HH22 ARG 13 22.147 31.290 13.441 107 H SER 14 H SER 14 22.428 24.827 17.395 108 HA SER 14 HA SER 14 23.442 23.332 15.174 109 HB2 SER 14 HB2 SER 14 25.529 23.164 16.419 110 HB3 SER 14 HB3 SER 14 24.860 24.802 16.492 111 HG SER 14 HG SER 14 25.103 24.595 18.528 112 H LEU 15 H LEU 15 21.972 22.240 18.163 113 HA LEU 15 HA LEU 15 22.720 19.416 17.733 114 HB2 LEU 15 HB2 LEU 15 20.892 20.745 19.769 115 HB3 LEU 15 HB3 LEU 15 21.386 19.054 19.781 116 HG LEU 15 HG LEU 15 23.271 21.439 20.101 117 HD11 LEU 15 HD11 LEU 15 21.760 21.183 22.011 118 HD12 LEU 15 HD12 LEU 15 22.193 19.459 22.145 119 HD13 LEU 15 HD13 LEU 15 23.418 20.711 22.437 120 HD21 LEU 15 HD21 LEU 15 23.760 18.440 20.382 121 HD22 LEU 15 HD22 LEU 15 24.461 19.521 19.151 122 HD23 LEU 15 HD23 LEU 15 24.903 19.717 20.845 123 H GLY 16 H GLY 16 20.096 21.508 16.818 124 HA2 GLY 16 HA2 GLY 16 18.667 20.980 15.007 125 HA3 GLY 16 HA3 GLY 16 18.757 19.270 15.383 126 H LEU 17 H LEU 17 18.003 21.804 17.775 127 HA LEU 17 HA LEU 17 15.112 21.338 17.661 128 HB2 LEU 17 HB2 LEU 17 14.964 20.798 20.080 129 HB3 LEU 17 HB3 LEU 17 15.577 19.515 19.057 130 HG LEU 17 HG LEU 17 17.355 21.246 20.821 131 HD11 LEU 17 HD11 LEU 17 17.294 19.287 22.372 132 HD12 LEU 17 HD12 LEU 17 15.692 20.006 22.168 133 HD13 LEU 17 HD13 LEU 17 16.100 18.506 21.321 134 HD21 LEU 17 HD21 LEU 17 18.870 19.221 20.706 135 HD22 LEU 17 HD22 LEU 17 17.825 18.571 19.427 136 HD23 LEU 17 HD23 LEU 17 18.722 20.088 19.191 137 H LEU 18 H LEU 18 14.089 22.674 19.619 138 HA LEU 18 HA LEU 18 15.186 25.429 19.356 139 HB2 LEU 18 HB2 LEU 18 12.463 24.425 20.236 140 HB3 LEU 18 HB3 LEU 18 12.940 26.123 20.219 141 HG LEU 18 HG LEU 18 12.900 24.347 17.765 142 HD11 LEU 18 HD11 LEU 18 10.872 26.416 18.700 143 HD12 LEU 18 HD12 LEU 18 10.822 25.526 17.168 144 HD13 LEU 18 HD13 LEU 18 10.626 24.653 18.695 145 HD21 LEU 18 HD21 LEU 18 14.379 26.231 17.424 146 HD22 LEU 18 HD22 LEU 18 12.892 26.518 16.523 147 HD23 LEU 18 HD23 LEU 18 13.166 27.362 18.063 148 H GLY 19 H GLY 19 15.063 26.847 21.117 149 HA2 GLY 19 HA2 GLY 19 16.039 25.609 23.684 150 HA3 GLY 19 HA3 GLY 19 16.623 27.119 23.010 151 H LYS 20 H LYS 20 15.473 26.355 25.649 152 HA LYS 20 HA LYS 20 13.774 28.724 26.118 153 HB2 LYS 20 HB2 LYS 20 12.999 25.865 26.846 154 HB3 LYS 20 HB3 LYS 20 12.258 27.288 27.563 155 HG2 LYS 20 HG2 LYS 20 12.082 26.509 24.630 156 HG3 LYS 20 HG3 LYS 20 10.858 26.272 25.877 157 HD2 LYS 20 HD2 LYS 20 10.851 28.791 26.236 158 HD3 LYS 20 HD3 LYS 20 11.836 28.937 24.768 159 HE2 LYS 20 HE2 LYS 20 10.109 27.735 23.474 160 HE3 LYS 20 HE3 LYS 20 9.147 27.508 24.951 161 HZ1 LYS 20 HZ1 LYS 20 9.801 30.105 23.685 162 HZ2 LYS 20 HZ2 LYS 20 8.341 29.401 23.675 163 HZ3 LYS 20 HZ3 LYS 20 8.998 29.959 25.104 164 H CYS 21 H CYS 21 13.516 29.074 28.517 165 HA CYS 21 HA CYS 21 15.961 28.253 30.047 166 HB2 CYS 21 HB2 CYS 21 15.585 30.678 29.701 167 HB3 CYS 21 HB3 CYS 21 14.004 30.526 30.451 168 H ILE 22 H ILE 22 15.777 27.123 31.996 169 HA ILE 22 HA ILE 22 13.186 27.073 33.384 170 HB ILE 22 HB ILE 22 13.355 25.066 31.927 171 HG12 ILE 22 HG12 ILE 22 13.431 24.428 34.912 172 HG13 ILE 22 HG13 ILE 22 12.061 25.160 34.059 173 HG21 ILE 22 HG21 ILE 22 14.955 23.322 32.321 174 HG22 ILE 22 HG22 ILE 22 15.881 24.809 32.131 175 HG23 ILE 22 HG23 ILE 22 15.615 24.156 33.757 176 HD11 ILE 22 HD11 ILE 22 13.255 22.415 33.537 177 HD12 ILE 22 HD12 ILE 22 11.647 22.794 34.201 178 HD13 ILE 22 HD13 ILE 22 12.030 23.194 32.508 179 H GLY 23 H GLY 23 13.360 27.226 35.504 180 HA2 GLY 23 HA2 GLY 23 14.154 28.001 37.477 181 HA3 GLY 23 HA3 GLY 23 15.411 26.776 37.324 182 H GLU 24 H GLU 24 17.281 27.277 36.369 183 HA GLU 24 HA GLU 24 18.207 30.134 36.443 184 HB2 GLU 24 HB2 GLU 24 19.685 27.729 37.577 185 HB3 GLU 24 HB3 GLU 24 20.155 29.420 37.702 186 HG2 GLU 24 HG2 GLU 24 18.075 29.857 39.050 187 HG3 GLU 24 HG3 GLU 24 17.753 28.118 39.049 188 H LYS 25 H LYS 25 17.922 27.590 34.298 189 HA LYS 25 HA LYS 25 20.386 28.342 32.817 190 HB2 LYS 25 HB2 LYS 25 21.002 25.964 32.515 191 HB3 LYS 25 HB3 LYS 25 21.137 26.516 34.180 192 HG2 LYS 25 HG2 LYS 25 19.174 25.314 34.842 193 HG3 LYS 25 HG3 LYS 25 18.656 25.041 33.172 194 HD2 LYS 25 HD2 LYS 25 19.558 22.999 34.227 195 HD3 LYS 25 HD3 LYS 25 20.456 23.499 32.783 196 HE2 LYS 25 HE2 LYS 25 22.273 24.394 34.099 197 HE3 LYS 25 HE3 LYS 25 21.374 24.162 35.605 198 HZ1 LYS 25 HZ1 LYS 25 21.780 21.898 35.558 199 HZ2 LYS 25 HZ2 LYS 25 21.921 21.812 33.931 200 HZ3 LYS 25 HZ3 LYS 25 23.146 22.430 34.819 201 H CYS 26 H CYS 26 20.586 27.695 30.706 202 HA CYS 26 HA CYS 26 18.165 27.527 29.079 203 HB2 CYS 26 HB2 CYS 26 20.091 28.672 28.204 204 HB3 CYS 26 HB3 CYS 26 21.131 27.301 28.557 205 H LYS 27 H LYS 27 17.108 25.750 28.431 206 HA LYS 27 HA LYS 27 18.433 23.149 28.101 207 HB2 LYS 27 HB2 LYS 27 15.989 23.610 29.848 208 HB3 LYS 27 HB3 LYS 27 16.331 22.054 29.113 209 HG2 LYS 27 HG2 LYS 27 18.124 23.466 31.114 210 HG3 LYS 27 HG3 LYS 27 16.963 22.196 31.496 211 HD2 LYS 27 HD2 LYS 27 19.245 21.908 29.568 212 HD3 LYS 27 HD3 LYS 27 19.282 21.356 31.261 213 HE2 LYS 27 HE2 LYS 27 17.249 19.909 30.700 214 HE3 LYS 27 HE3 LYS 27 17.496 20.344 29.005 215 HZ1 LYS 27 HZ1 LYS 27 19.795 19.340 29.292 216 HZ2 LYS 27 HZ2 LYS 27 19.255 18.692 30.707 217 HZ3 LYS 27 HZ3 LYS 27 18.515 18.309 29.294 218 H CYS 28 H CYS 28 17.820 22.150 26.307 219 HA CYS 28 HA CYS 28 16.073 23.583 24.474 220 HB2 CYS 28 HB2 CYS 28 17.395 20.890 24.119 221 HB3 CYS 28 HB3 CYS 28 16.781 21.968 22.861 222 H VAL 29 H VAL 29 14.199 22.691 23.373 223 HA VAL 29 HA VAL 29 12.526 21.120 25.257 224 HB VAL 29 HB VAL 29 10.616 21.729 23.806 225 HG11 VAL 29 HG11 VAL 29 12.197 23.998 25.080 226 HG12 VAL 29 HG12 VAL 29 10.449 24.000 24.737 227 HG13 VAL 29 HG13 VAL 29 11.116 22.867 25.922 228 HG21 VAL 29 HG21 VAL 29 10.761 23.632 22.316 229 HG22 VAL 29 HG22 VAL 29 12.505 23.784 22.586 230 HG23 VAL 29 HG23 VAL 29 11.849 22.370 21.723 231 HA PRO 30 HA PRO 30 13.436 17.519 23.030 232 HB2 PRO 30 HB2 PRO 30 10.702 16.515 23.824 233 HB3 PRO 30 HB3 PRO 30 12.285 15.679 23.927 234 HG2 PRO 30 HG2 PRO 30 11.215 16.820 26.134 235 HG3 PRO 30 HG3 PRO 30 12.957 17.049 25.777 236 HD2 PRO 30 HD2 PRO 30 10.661 18.956 25.251 237 HD3 PRO 30 HD3 PRO 30 12.279 19.267 25.944 238 H TYR 31 H TYR 31 13.446 16.872 21.061 239 HA TYR 31 HA TYR 31 11.104 16.933 19.203 240 HB2 TYR 31 HB2 TYR 31 13.978 17.762 18.862 241 HB3 TYR 31 HB3 TYR 31 13.198 16.953 17.526 242 HD1 TYR 31 HD1 TYR 31 12.686 19.878 19.832 243 HD2 TYR 31 HD2 TYR 31 11.881 18.086 16.011 244 HE1 TYR 31 HE1 TYR 31 11.656 22.012 19.046 245 HE2 TYR 31 HE2 TYR 31 10.858 20.203 15.217 246 HH TYR 31 HH TYR 31 10.818 22.443 15.623 Start of MODEL 7 1 H1 ALA 1 H1 ALA 1 13.969 35.873 37.137 2 H2 ALA 1 H2 ALA 1 14.928 36.298 38.409 3 H3 ALA 1 H3 ALA 1 14.935 34.746 37.838 4 HA ALA 1 HA ALA 1 15.874 37.161 36.493 5 HB1 ALA 1 HB1 ALA 1 18.104 36.239 36.612 6 HB2 ALA 1 HB2 ALA 1 17.417 36.214 38.248 7 HB3 ALA 1 HB3 ALA 1 17.501 34.717 37.301 8 H PHE 2 H PHE 2 16.058 37.170 34.365 9 HA PHE 2 HA PHE 2 14.984 34.989 32.751 10 HB2 PHE 2 HB2 PHE 2 16.267 37.661 32.081 11 HB3 PHE 2 HB3 PHE 2 15.600 36.552 30.895 12 HD1 PHE 2 HD1 PHE 2 13.137 35.743 31.264 13 HD2 PHE 2 HD2 PHE 2 14.808 39.313 33.012 14 HE1 PHE 2 HE1 PHE 2 10.861 36.675 31.533 15 HE2 PHE 2 HE2 PHE 2 12.521 40.259 33.243 16 HZ PHE 2 HZ PHE 2 10.543 38.944 32.493 17 H CYS 3 H CYS 3 16.041 33.811 31.106 18 HA CYS 3 HA CYS 3 18.927 33.269 31.498 19 HB2 CYS 3 HB2 CYS 3 16.798 31.942 29.777 20 HB3 CYS 3 HB3 CYS 3 18.462 31.422 29.928 21 H ASN 4 H ASN 4 20.279 32.962 29.529 22 HA ASN 4 HA ASN 4 20.034 35.063 27.516 23 HB2 ASN 4 HB2 ASN 4 21.920 32.667 27.708 24 HB3 ASN 4 HB3 ASN 4 22.070 34.010 26.570 25 HD21 ASN 4 HD21 ASN 4 23.085 36.385 29.078 26 HD22 ASN 4 HD22 ASN 4 22.138 36.248 27.596 27 H LEU 5 H LEU 5 17.656 33.980 27.177 28 HA LEU 5 HA LEU 5 17.334 31.594 25.747 29 HB2 LEU 5 HB2 LEU 5 15.608 32.821 26.973 30 HB3 LEU 5 HB3 LEU 5 15.598 34.092 25.775 31 HG LEU 5 HG LEU 5 13.684 32.512 25.737 32 HD11 LEU 5 HD11 LEU 5 13.425 32.351 23.371 33 HD12 LEU 5 HD12 LEU 5 14.245 33.873 23.746 34 HD13 LEU 5 HD13 LEU 5 15.159 32.501 23.084 35 HD21 LEU 5 HD21 LEU 5 14.912 30.419 26.193 36 HD22 LEU 5 HD22 LEU 5 13.867 30.312 24.772 37 HD23 LEU 5 HD23 LEU 5 15.618 30.485 24.559 38 H ARG 6 H ARG 6 17.714 34.881 24.359 39 HA ARG 6 HA ARG 6 17.485 34.237 21.633 40 HB2 ARG 6 HB2 ARG 6 18.685 36.298 21.176 41 HB3 ARG 6 HB3 ARG 6 17.530 36.534 22.481 42 HG2 ARG 6 HG2 ARG 6 19.280 36.680 24.132 43 HG3 ARG 6 HG3 ARG 6 20.486 36.012 23.037 44 HD2 ARG 6 HD2 ARG 6 20.837 38.374 23.296 45 HD3 ARG 6 HD3 ARG 6 20.421 37.981 21.624 46 HE ARG 6 HE ARG 6 17.985 38.681 22.787 47 HH11 ARG 6 HH11 ARG 6 21.026 40.385 22.250 48 HH12 ARG 6 HH12 ARG 6 20.214 41.945 22.291 49 HH21 ARG 6 HH21 ARG 6 17.089 40.567 22.672 50 HH22 ARG 6 HH22 ARG 6 18.026 42.067 22.693 51 H ARG 7 H ARG 7 20.192 33.569 23.693 52 HA ARG 7 HA ARG 7 21.996 32.800 21.453 53 HB2 ARG 7 HB2 ARG 7 22.891 34.144 23.311 54 HB3 ARG 7 HB3 ARG 7 22.347 32.957 24.482 55 HG2 ARG 7 HG2 ARG 7 24.798 32.918 24.012 56 HG3 ARG 7 HG3 ARG 7 23.981 31.369 23.837 57 HD2 ARG 7 HD2 ARG 7 25.684 31.816 22.090 58 HD3 ARG 7 HD3 ARG 7 24.080 31.451 21.455 59 HE ARG 7 HE ARG 7 24.470 34.312 21.684 60 HH11 ARG 7 HH11 ARG 7 25.419 31.606 19.623 61 HH12 ARG 7 HH12 ARG 7 25.607 32.668 18.241 62 HH21 ARG 7 HH21 ARG 7 24.617 35.493 19.948 63 HH22 ARG 7 HH22 ARG 7 24.986 34.804 18.368 64 H CYS 8 H CYS 8 20.250 31.394 24.205 65 HA CYS 8 HA CYS 8 21.044 28.701 23.960 66 HB2 CYS 8 HB2 CYS 8 19.784 29.696 25.818 67 HB3 CYS 8 HB3 CYS 8 18.384 29.911 24.767 68 H GLU 9 H GLU 9 18.272 30.339 22.261 69 HA GLU 9 HA GLU 9 17.464 28.009 20.808 70 HB2 GLU 9 HB2 GLU 9 17.189 30.962 20.114 71 HB3 GLU 9 HB3 GLU 9 16.418 29.625 19.242 72 HG2 GLU 9 HG2 GLU 9 15.339 28.909 21.407 73 HG3 GLU 9 HG3 GLU 9 15.890 30.431 22.116 74 H LEU 10 H LEU 10 20.212 30.103 20.189 75 HA LEU 10 HA LEU 10 20.603 29.072 17.439 76 HB2 LEU 10 HB2 LEU 10 22.387 30.818 19.185 77 HB3 LEU 10 HB3 LEU 10 22.638 30.461 17.480 78 HG LEU 10 HG LEU 10 20.226 31.958 18.594 79 HD11 LEU 10 HD11 LEU 10 22.709 33.003 17.188 80 HD12 LEU 10 HD12 LEU 10 21.272 33.955 17.631 81 HD13 LEU 10 HD13 LEU 10 22.282 33.242 18.900 82 HD21 LEU 10 HD21 LEU 10 19.727 30.872 16.446 83 HD22 LEU 10 HD22 LEU 10 19.849 32.620 16.238 84 HD23 LEU 10 HD23 LEU 10 21.196 31.576 15.726 85 H SER 11 H SER 11 21.887 28.593 20.709 86 HA SER 11 HA SER 11 23.888 26.647 20.024 87 HB2 SER 11 HB2 SER 11 23.824 27.694 22.232 88 HB3 SER 11 HB3 SER 11 22.251 26.943 22.572 89 HG SER 11 HG SER 11 24.711 25.620 22.046 90 H CYS 12 H CYS 12 20.405 26.202 20.952 91 HA CYS 12 HA CYS 12 20.522 23.354 20.631 92 HB2 CYS 12 HB2 CYS 12 18.060 25.107 20.443 93 HB3 CYS 12 HB3 CYS 12 18.126 23.379 20.797 94 H ARG 13 H ARG 13 20.155 25.925 18.272 95 HA ARG 13 HA ARG 13 19.066 24.400 16.090 96 HB2 ARG 13 HB2 ARG 13 19.377 26.928 16.231 97 HB3 ARG 13 HB3 ARG 13 21.082 26.659 15.848 98 HG2 ARG 13 HG2 ARG 13 20.347 25.491 13.731 99 HG3 ARG 13 HG3 ARG 13 18.682 25.953 14.101 100 HD2 ARG 13 HD2 ARG 13 21.020 27.884 13.730 101 HD3 ARG 13 HD3 ARG 13 19.861 27.449 12.469 102 HE ARG 13 HE ARG 13 18.290 28.400 14.589 103 HH11 ARG 13 HH11 ARG 13 20.701 29.763 12.410 104 HH12 ARG 13 HH12 ARG 13 19.937 31.325 12.424 105 HH21 ARG 13 HH21 ARG 13 17.661 30.452 14.839 106 HH22 ARG 13 HH22 ARG 13 18.305 31.731 13.807 107 H SER 14 H SER 14 22.379 24.556 17.386 108 HA SER 14 HA SER 14 23.629 23.048 15.287 109 HB2 SER 14 HB2 SER 14 25.486 22.790 16.741 110 HB3 SER 14 HB3 SER 14 24.831 24.406 17.043 111 HG SER 14 HG SER 14 23.844 23.614 18.923 112 H LEU 15 H LEU 15 21.542 22.033 17.874 113 HA LEU 15 HA LEU 15 22.111 19.139 17.471 114 HB2 LEU 15 HB2 LEU 15 20.173 20.457 19.390 115 HB3 LEU 15 HB3 LEU 15 20.759 18.800 19.426 116 HG LEU 15 HG LEU 15 22.373 21.324 20.034 117 HD11 LEU 15 HD11 LEU 15 20.733 20.691 21.765 118 HD12 LEU 15 HD12 LEU 15 21.425 19.055 21.830 119 HD13 LEU 15 HD13 LEU 15 22.396 20.458 22.322 120 HD21 LEU 15 HD21 LEU 15 23.225 18.403 20.206 121 HD22 LEU 15 HD22 LEU 15 23.855 19.599 19.049 122 HD23 LEU 15 HD23 LEU 15 24.164 19.800 20.776 123 H GLY 16 H GLY 16 19.995 21.608 16.397 124 HA2 GLY 16 HA2 GLY 16 18.412 21.452 14.670 125 HA3 GLY 16 HA3 GLY 16 18.179 19.734 14.993 126 H LEU 17 H LEU 17 18.094 21.893 17.772 127 HA LEU 17 HA LEU 17 15.112 21.616 17.909 128 HB2 LEU 17 HB2 LEU 17 16.618 21.765 20.468 129 HB3 LEU 17 HB3 LEU 17 15.134 20.930 20.071 130 HG LEU 17 HG LEU 17 17.959 20.046 19.532 131 HD11 LEU 17 HD11 LEU 17 17.308 19.920 21.895 132 HD12 LEU 17 HD12 LEU 17 15.881 18.961 21.466 133 HD13 LEU 17 HD13 LEU 17 17.510 18.306 21.213 134 HD21 LEU 17 HD21 LEU 17 16.450 19.024 17.807 135 HD22 LEU 17 HD22 LEU 17 16.965 17.818 18.975 136 HD23 LEU 17 HD23 LEU 17 15.335 18.525 19.085 137 H LEU 18 H LEU 18 14.545 22.968 20.058 138 HA LEU 18 HA LEU 18 15.661 25.722 19.982 139 HB2 LEU 18 HB2 LEU 18 12.745 24.899 20.287 140 HB3 LEU 18 HB3 LEU 18 13.339 26.527 20.597 141 HG LEU 18 HG LEU 18 13.611 25.130 17.919 142 HD11 LEU 18 HD11 LEU 18 11.563 27.177 18.836 143 HD12 LEU 18 HD12 LEU 18 11.742 26.539 17.182 144 HD13 LEU 18 HD13 LEU 18 11.252 25.460 18.500 145 HD21 LEU 18 HD21 LEU 18 15.260 26.914 18.214 146 HD22 LEU 18 HD22 LEU 18 14.021 27.420 17.072 147 HD23 LEU 18 HD23 LEU 18 13.979 28.042 18.737 148 H GLY 19 H GLY 19 14.733 26.794 22.159 149 HA2 GLY 19 HA2 GLY 19 15.148 24.905 24.420 150 HA3 GLY 19 HA3 GLY 19 16.271 26.247 24.256 151 H LYS 20 H LYS 20 14.956 25.815 26.532 152 HA LYS 20 HA LYS 20 13.111 28.122 26.905 153 HB2 LYS 20 HB2 LYS 20 12.608 25.263 27.855 154 HB3 LYS 20 HB3 LYS 20 11.674 26.660 28.377 155 HG2 LYS 20 HG2 LYS 20 11.822 25.691 25.486 156 HG3 LYS 20 HG3 LYS 20 10.567 25.250 26.639 157 HD2 LYS 20 HD2 LYS 20 9.780 27.511 26.838 158 HD3 LYS 20 HD3 LYS 20 11.142 28.142 25.888 159 HE2 LYS 20 HE2 LYS 20 10.416 27.038 23.903 160 HE3 LYS 20 HE3 LYS 20 9.168 26.122 24.754 161 HZ1 LYS 20 HZ1 LYS 20 8.409 28.210 23.521 162 HZ2 LYS 20 HZ2 LYS 20 7.893 28.038 25.061 163 HZ3 LYS 20 HZ3 LYS 20 9.118 29.070 24.739 164 H CYS 21 H CYS 21 13.262 29.107 28.859 165 HA CYS 21 HA CYS 21 15.593 28.577 30.562 166 HB2 CYS 21 HB2 CYS 21 14.860 30.845 29.805 167 HB3 CYS 21 HB3 CYS 21 13.378 30.646 30.725 168 H ILE 22 H ILE 22 15.554 27.224 32.330 169 HA ILE 22 HA ILE 22 13.137 27.017 34.003 170 HB ILE 22 HB ILE 22 12.986 25.417 32.103 171 HG12 ILE 22 HG12 ILE 22 13.326 24.049 34.806 172 HG13 ILE 22 HG13 ILE 22 11.913 24.993 34.303 173 HG21 ILE 22 HG21 ILE 22 14.475 23.571 31.825 174 HG22 ILE 22 HG22 ILE 22 15.513 24.988 31.953 175 HG23 ILE 22 HG23 ILE 22 15.301 23.920 33.355 176 HD11 ILE 22 HD11 ILE 22 12.937 22.425 33.031 177 HD12 ILE 22 HD12 ILE 22 11.417 22.669 33.906 178 HD13 ILE 22 HD13 ILE 22 11.665 23.446 32.323 179 H GLY 23 H GLY 23 13.516 26.607 36.077 180 HA2 GLY 23 HA2 GLY 23 14.511 26.156 38.089 181 HA3 GLY 23 HA3 GLY 23 15.770 25.260 37.240 182 H GLU 24 H GLU 24 17.416 26.600 36.154 183 HA GLU 24 HA GLU 24 17.864 29.351 37.025 184 HB2 GLU 24 HB2 GLU 24 20.026 29.056 38.010 185 HB3 GLU 24 HB3 GLU 24 18.865 28.128 38.916 186 HG2 GLU 24 HG2 GLU 24 20.406 26.684 36.743 187 HG3 GLU 24 HG3 GLU 24 21.291 27.213 38.158 188 H LYS 25 H LYS 25 17.837 27.337 34.465 189 HA LYS 25 HA LYS 25 19.888 28.774 32.933 190 HB2 LYS 25 HB2 LYS 25 21.103 26.690 32.299 191 HB3 LYS 25 HB3 LYS 25 21.336 27.218 33.964 192 HG2 LYS 25 HG2 LYS 25 19.755 25.512 34.773 193 HG3 LYS 25 HG3 LYS 25 19.453 24.972 33.108 194 HD2 LYS 25 HD2 LYS 25 21.664 24.093 32.890 195 HD3 LYS 25 HD3 LYS 25 22.264 25.032 34.261 196 HE2 LYS 25 HE2 LYS 25 22.075 22.705 34.890 197 HE3 LYS 25 HE3 LYS 25 20.981 23.731 35.840 198 HZ1 LYS 25 HZ1 LYS 25 19.142 22.961 34.524 199 HZ2 LYS 25 HZ2 LYS 25 20.091 22.171 33.473 200 HZ3 LYS 25 HZ3 LYS 25 19.977 21.630 35.031 201 H CYS 26 H CYS 26 19.950 28.089 30.612 202 HA CYS 26 HA CYS 26 17.218 27.399 29.734 203 HB2 CYS 26 HB2 CYS 26 18.449 29.337 28.797 204 HB3 CYS 26 HB3 CYS 26 19.579 28.206 28.049 205 H LYS 27 H LYS 27 16.575 25.499 29.021 206 HA LYS 27 HA LYS 27 18.439 23.225 28.580 207 HB2 LYS 27 HB2 LYS 27 16.930 23.051 30.388 208 HB3 LYS 27 HB3 LYS 27 15.554 23.593 29.412 209 HG2 LYS 27 HG2 LYS 27 15.489 21.599 28.147 210 HG3 LYS 27 HG3 LYS 27 17.108 21.085 28.699 211 HD2 LYS 27 HD2 LYS 27 16.368 20.793 30.932 212 HD3 LYS 27 HD3 LYS 27 14.775 21.534 30.585 213 HE2 LYS 27 HE2 LYS 27 14.325 19.756 28.924 214 HE3 LYS 27 HE3 LYS 27 15.867 18.987 29.342 215 HZ1 LYS 27 HZ1 LYS 27 13.524 19.331 31.135 216 HZ2 LYS 27 HZ2 LYS 27 14.107 17.911 30.552 217 HZ3 LYS 27 HZ3 LYS 27 14.990 18.744 31.641 218 H CYS 28 H CYS 28 18.431 22.214 26.555 219 HA CYS 28 HA CYS 28 16.767 23.349 24.379 220 HB2 CYS 28 HB2 CYS 28 18.717 21.029 24.331 221 HB3 CYS 28 HB3 CYS 28 17.852 21.692 22.940 222 H VAL 29 H VAL 29 14.927 22.341 23.532 223 HA VAL 29 HA VAL 29 13.833 20.185 25.291 224 HB VAL 29 HB VAL 29 11.619 21.134 24.911 225 HG11 VAL 29 HG11 VAL 29 12.968 21.754 26.895 226 HG12 VAL 29 HG12 VAL 29 13.615 23.156 26.020 227 HG13 VAL 29 HG13 VAL 29 11.887 23.056 26.386 228 HG21 VAL 29 HG21 VAL 29 13.023 23.504 23.611 229 HG22 VAL 29 HG22 VAL 29 12.034 22.304 22.755 230 HG23 VAL 29 HG23 VAL 29 11.296 23.344 23.979 231 HA PRO 30 HA PRO 30 13.664 17.524 21.946 232 HB2 PRO 30 HB2 PRO 30 11.642 15.753 22.578 233 HB3 PRO 30 HB3 PRO 30 13.220 15.828 23.416 234 HG2 PRO 30 HG2 PRO 30 10.610 17.115 24.267 235 HG3 PRO 30 HG3 PRO 30 11.741 16.140 25.254 236 HD2 PRO 30 HD2 PRO 30 11.806 18.840 25.316 237 HD3 PRO 30 HD3 PRO 30 13.325 17.899 25.337 238 H TYR 31 H TYR 31 13.072 17.785 19.947 239 HA TYR 31 HA TYR 31 10.218 18.189 19.163 240 HB2 TYR 31 HB2 TYR 31 12.686 19.554 18.108 241 HB3 TYR 31 HB3 TYR 31 11.358 19.226 17.035 242 HD1 TYR 31 HD1 TYR 31 9.269 20.420 17.122 243 HD2 TYR 31 HD2 TYR 31 12.323 21.082 20.104 244 HE1 TYR 31 HE1 TYR 31 8.000 22.399 17.966 245 HE2 TYR 31 HE2 TYR 31 11.065 23.095 20.928 246 HH TYR 31 HH TYR 31 7.791 23.799 19.934 Start of MODEL 8 1 H1 ALA 1 H1 ALA 1 28.617 34.176 33.993 2 H2 ALA 1 H2 ALA 1 27.521 33.013 34.388 3 H3 ALA 1 H3 ALA 1 27.336 34.549 34.965 4 HA ALA 1 HA ALA 1 26.979 35.407 32.781 5 HB1 ALA 1 HB1 ALA 1 28.346 33.767 31.546 6 HB2 ALA 1 HB2 ALA 1 27.183 32.482 31.942 7 HB3 ALA 1 HB3 ALA 1 26.702 33.832 30.890 8 H PHE 2 H PHE 2 24.815 35.484 31.885 9 HA PHE 2 HA PHE 2 22.780 34.180 33.659 10 HB2 PHE 2 HB2 PHE 2 22.612 36.696 32.000 11 HB3 PHE 2 HB3 PHE 2 21.308 35.990 32.960 12 HD1 PHE 2 HD1 PHE 2 24.135 38.213 33.060 13 HD2 PHE 2 HD2 PHE 2 21.695 35.601 35.473 14 HE1 PHE 2 HE1 PHE 2 24.898 39.383 35.114 15 HE2 PHE 2 HE2 PHE 2 22.491 36.744 37.517 16 HZ PHE 2 HZ PHE 2 24.075 38.663 37.339 17 H CYS 3 H CYS 3 20.863 33.229 32.773 18 HA CYS 3 HA CYS 3 21.202 32.029 30.158 19 HB2 CYS 3 HB2 CYS 3 20.051 30.918 32.044 20 HB3 CYS 3 HB3 CYS 3 18.705 32.061 31.886 21 H ASN 4 H ASN 4 20.240 32.527 28.218 22 HA ASN 4 HA ASN 4 18.593 34.986 27.949 23 HB2 ASN 4 HB2 ASN 4 21.389 34.550 26.849 24 HB3 ASN 4 HB3 ASN 4 20.218 35.551 26.004 25 HD21 ASN 4 HD21 ASN 4 21.913 37.078 29.329 26 HD22 ASN 4 HD22 ASN 4 22.270 35.411 28.913 27 H LEU 5 H LEU 5 16.876 34.305 26.999 28 HA LEU 5 HA LEU 5 16.330 31.834 25.858 29 HB2 LEU 5 HB2 LEU 5 14.605 33.338 26.603 30 HB3 LEU 5 HB3 LEU 5 15.081 34.570 25.436 31 HG LEU 5 HG LEU 5 14.287 33.159 23.566 32 HD11 LEU 5 HD11 LEU 5 12.892 31.171 24.041 33 HD12 LEU 5 HD12 LEU 5 14.564 30.911 24.536 34 HD13 LEU 5 HD13 LEU 5 13.313 31.281 25.760 35 HD21 LEU 5 HD21 LEU 5 11.891 33.367 24.047 36 HD22 LEU 5 HD22 LEU 5 12.235 33.560 25.778 37 HD23 LEU 5 HD23 LEU 5 12.781 34.791 24.625 38 H ARG 6 H ARG 6 17.244 34.810 24.024 39 HA ARG 6 HA ARG 6 17.061 33.470 21.460 40 HB2 ARG 6 HB2 ARG 6 18.474 36.058 22.273 41 HB3 ARG 6 HB3 ARG 6 18.378 35.457 20.615 42 HG2 ARG 6 HG2 ARG 6 15.841 35.414 20.885 43 HG3 ARG 6 HG3 ARG 6 16.054 36.338 22.378 44 HD2 ARG 6 HD2 ARG 6 16.973 37.165 19.583 45 HD3 ARG 6 HD3 ARG 6 15.520 37.749 20.399 46 HE ARG 6 HE ARG 6 17.452 38.416 22.210 47 HH11 ARG 6 HH11 ARG 6 16.765 39.438 18.881 48 HH12 ARG 6 HH12 ARG 6 17.869 40.794 19.070 49 HH21 ARG 6 HH21 ARG 6 18.822 40.264 22.223 50 HH22 ARG 6 HH22 ARG 6 18.849 41.239 20.764 51 H ARG 7 H ARG 7 19.758 33.873 23.741 52 HA ARG 7 HA ARG 7 21.757 32.720 21.932 53 HB2 ARG 7 HB2 ARG 7 22.258 34.271 23.877 54 HB3 ARG 7 HB3 ARG 7 21.862 32.925 24.968 55 HG2 ARG 7 HG2 ARG 7 23.657 31.555 23.859 56 HG3 ARG 7 HG3 ARG 7 24.075 32.946 22.859 57 HD2 ARG 7 HD2 ARG 7 24.184 32.849 25.902 58 HD3 ARG 7 HD3 ARG 7 25.559 32.587 24.842 59 HE ARG 7 HE ARG 7 24.056 35.193 25.093 60 HH11 ARG 7 HH11 ARG 7 27.142 33.681 24.214 61 HH12 ARG 7 HH12 ARG 7 28.000 35.150 24.640 62 HH21 ARG 7 HH21 ARG 7 25.166 36.934 25.348 63 HH22 ARG 7 HH22 ARG 7 26.919 36.956 25.258 64 H CYS 8 H CYS 8 19.615 31.474 24.439 65 HA CYS 8 HA CYS 8 20.632 28.809 24.566 66 HB2 CYS 8 HB2 CYS 8 19.318 29.748 26.346 67 HB3 CYS 8 HB3 CYS 8 17.974 30.095 25.262 68 H GLU 9 H GLU 9 17.753 30.117 22.742 69 HA GLU 9 HA GLU 9 17.158 27.589 21.594 70 HB2 GLU 9 HB2 GLU 9 15.537 28.685 20.327 71 HB3 GLU 9 HB3 GLU 9 15.670 29.605 21.839 72 HG2 GLU 9 HG2 GLU 9 17.133 31.225 20.636 73 HG3 GLU 9 HG3 GLU 9 16.713 30.396 19.131 74 H LEU 10 H LEU 10 19.243 30.191 20.359 75 HA LEU 10 HA LEU 10 19.843 28.707 17.904 76 HB2 LEU 10 HB2 LEU 10 21.321 30.397 17.298 77 HB3 LEU 10 HB3 LEU 10 19.926 31.150 18.036 78 HG LEU 10 HG LEU 10 21.402 31.327 20.177 79 HD11 LEU 10 HD11 LEU 10 23.353 29.971 19.602 80 HD12 LEU 10 HD12 LEU 10 23.558 30.847 18.075 81 HD13 LEU 10 HD13 LEU 10 23.847 31.648 19.633 82 HD21 LEU 10 HD21 LEU 10 20.714 33.232 18.805 83 HD22 LEU 10 HD22 LEU 10 22.390 33.439 19.311 84 HD23 LEU 10 HD23 LEU 10 22.012 32.901 17.652 85 H SER 11 H SER 11 21.154 28.582 21.158 86 HA SER 11 HA SER 11 23.500 27.010 20.413 87 HB2 SER 11 HB2 SER 11 22.058 27.249 23.080 88 HB3 SER 11 HB3 SER 11 23.603 26.422 22.799 89 HG SER 11 HG SER 11 22.978 29.171 22.521 90 H CYS 12 H CYS 12 20.098 26.216 21.346 91 HA CYS 12 HA CYS 12 20.428 23.353 21.149 92 HB2 CYS 12 HB2 CYS 12 17.996 25.134 20.797 93 HB3 CYS 12 HB3 CYS 12 17.940 23.383 20.888 94 H ARG 13 H ARG 13 19.901 25.873 18.697 95 HA ARG 13 HA ARG 13 19.225 24.203 16.480 96 HB2 ARG 13 HB2 ARG 13 19.110 26.727 16.601 97 HB3 ARG 13 HB3 ARG 13 20.851 26.767 16.395 98 HG2 ARG 13 HG2 ARG 13 20.715 25.839 14.189 99 HG3 ARG 13 HG3 ARG 13 19.013 25.407 14.400 100 HD2 ARG 13 HD2 ARG 13 19.205 27.382 12.989 101 HD3 ARG 13 HD3 ARG 13 18.386 27.760 14.510 102 HE ARG 13 HE ARG 13 21.231 28.302 14.699 103 HH11 ARG 13 HH11 ARG 13 18.287 29.749 13.401 104 HH12 ARG 13 HH12 ARG 13 18.926 31.369 13.613 105 HH21 ARG 13 HH21 ARG 13 21.957 30.336 14.832 106 HH22 ARG 13 HH22 ARG 13 20.927 31.682 14.392 107 H SER 14 H SER 14 22.380 24.873 17.933 108 HA SER 14 HA SER 14 23.973 23.619 15.916 109 HB2 SER 14 HB2 SER 14 25.763 23.676 17.435 110 HB3 SER 14 HB3 SER 14 24.802 25.115 17.798 111 HG SER 14 HG SER 14 23.937 24.039 19.590 112 H LEU 15 H LEU 15 21.789 22.175 18.146 113 HA LEU 15 HA LEU 15 22.888 19.438 17.639 114 HB2 LEU 15 HB2 LEU 15 20.851 20.397 19.676 115 HB3 LEU 15 HB3 LEU 15 21.447 18.749 19.505 116 HG LEU 15 HG LEU 15 23.122 21.172 20.326 117 HD11 LEU 15 HD11 LEU 15 23.103 20.163 22.558 118 HD12 LEU 15 HD12 LEU 15 21.458 20.539 22.027 119 HD13 LEU 15 HD13 LEU 15 22.043 18.861 21.982 120 HD21 LEU 15 HD21 LEU 15 23.820 18.203 20.299 121 HD22 LEU 15 HD22 LEU 15 24.518 19.447 19.241 122 HD23 LEU 15 HD23 LEU 15 24.824 19.501 20.981 123 H GLY 16 H GLY 16 20.117 21.562 17.090 124 HA2 GLY 16 HA2 GLY 16 19.093 21.224 14.851 125 HA3 GLY 16 HA3 GLY 16 18.921 19.515 15.234 126 H LEU 17 H LEU 17 18.180 21.958 17.682 127 HA LEU 17 HA LEU 17 15.284 21.788 17.246 128 HB2 LEU 17 HB2 LEU 17 14.855 20.954 19.513 129 HB3 LEU 17 HB3 LEU 17 15.579 19.761 18.454 130 HG LEU 17 HG LEU 17 17.089 21.269 20.621 131 HD11 LEU 17 HD11 LEU 17 16.842 19.138 21.916 132 HD12 LEU 17 HD12 LEU 17 15.278 19.900 21.584 133 HD13 LEU 17 HD13 LEU 17 15.789 18.510 20.625 134 HD21 LEU 17 HD21 LEU 17 18.653 19.296 20.497 135 HD22 LEU 17 HD22 LEU 17 17.806 18.779 19.026 136 HD23 LEU 17 HD23 LEU 17 18.683 20.323 19.071 137 H LEU 18 H LEU 18 14.128 23.000 19.143 138 HA LEU 18 HA LEU 18 15.447 25.668 19.409 139 HB2 LEU 18 HB2 LEU 18 12.558 24.743 19.426 140 HB3 LEU 18 HB3 LEU 18 13.047 26.327 20.002 141 HG LEU 18 HG LEU 18 13.990 26.913 17.809 142 HD11 LEU 18 HD11 LEU 18 12.873 24.227 16.890 143 HD12 LEU 18 HD12 LEU 18 13.294 25.562 15.801 144 HD13 LEU 18 HD13 LEU 18 14.558 24.801 16.750 145 HD21 LEU 18 HD21 LEU 18 11.120 25.904 17.692 146 HD22 LEU 18 HD22 LEU 18 11.662 27.417 18.445 147 HD23 LEU 18 HD23 LEU 18 11.838 27.195 16.698 148 H GLY 19 H GLY 19 14.754 26.908 21.522 149 HA2 GLY 19 HA2 GLY 19 14.431 25.198 23.868 150 HA3 GLY 19 HA3 GLY 19 16.074 25.807 23.703 151 H LYS 20 H LYS 20 14.913 26.309 25.930 152 HA LYS 20 HA LYS 20 14.276 29.193 26.043 153 HB2 LYS 20 HB2 LYS 20 12.303 28.903 27.373 154 HB3 LYS 20 HB3 LYS 20 12.111 28.193 25.765 155 HG2 LYS 20 HG2 LYS 20 12.551 25.947 26.661 156 HG3 LYS 20 HG3 LYS 20 12.849 26.618 28.278 157 HD2 LYS 20 HD2 LYS 20 10.549 27.409 28.430 158 HD3 LYS 20 HD3 LYS 20 10.217 26.823 26.767 159 HE2 LYS 20 HE2 LYS 20 10.970 24.565 27.411 160 HE3 LYS 20 HE3 LYS 20 11.312 25.127 29.049 161 HZ1 LYS 20 HZ1 LYS 20 9.209 23.894 28.742 162 HZ2 LYS 20 HZ2 LYS 20 8.993 25.355 29.468 163 HZ3 LYS 20 HZ3 LYS 20 8.590 25.132 27.866 164 H CYS 21 H CYS 21 14.371 30.058 28.285 165 HA CYS 21 HA CYS 21 16.369 28.670 29.953 166 HB2 CYS 21 HB2 CYS 21 14.864 31.282 30.258 167 HB3 CYS 21 HB3 CYS 21 16.042 30.662 31.411 168 H ILE 22 H ILE 22 15.969 27.583 31.815 169 HA ILE 22 HA ILE 22 13.228 27.567 32.988 170 HB ILE 22 HB ILE 22 14.985 25.130 32.547 171 HG12 ILE 22 HG12 ILE 22 12.383 26.003 31.217 172 HG13 ILE 22 HG13 ILE 22 13.948 25.720 30.448 173 HG21 ILE 22 HG21 ILE 22 13.716 25.095 34.702 174 HG22 ILE 22 HG22 ILE 22 12.209 25.345 33.795 175 HG23 ILE 22 HG23 ILE 22 13.163 23.861 33.594 176 HD11 ILE 22 HD11 ILE 22 12.025 23.653 31.553 177 HD12 ILE 22 HD12 ILE 22 12.638 23.825 29.903 178 HD13 ILE 22 HD13 ILE 22 13.719 23.265 31.190 179 H GLY 23 H GLY 23 13.491 28.595 34.833 180 HA2 GLY 23 HA2 GLY 23 14.101 29.079 36.986 181 HA3 GLY 23 HA3 GLY 23 15.185 27.683 36.982 182 H GLU 24 H GLU 24 17.203 27.919 35.938 183 HA GLU 24 HA GLU 24 18.370 30.662 35.583 184 HB2 GLU 24 HB2 GLU 24 19.519 28.410 37.270 185 HB3 GLU 24 HB3 GLU 24 20.405 29.859 36.842 186 HG2 GLU 24 HG2 GLU 24 17.836 29.856 38.480 187 HG3 GLU 24 HG3 GLU 24 19.458 29.838 39.153 188 H LYS 25 H LYS 25 17.981 27.567 34.204 189 HA LYS 25 HA LYS 25 20.485 27.866 32.570 190 HB2 LYS 25 HB2 LYS 25 19.341 25.308 33.763 191 HB3 LYS 25 HB3 LYS 25 20.664 25.396 32.603 192 HG2 LYS 25 HG2 LYS 25 21.935 26.828 34.245 193 HG3 LYS 25 HG3 LYS 25 20.673 26.494 35.449 194 HD2 LYS 25 HD2 LYS 25 21.105 24.064 35.228 195 HD3 LYS 25 HD3 LYS 25 22.352 24.375 34.020 196 HE2 LYS 25 HE2 LYS 25 22.421 25.178 36.960 197 HE3 LYS 25 HE3 LYS 25 23.339 23.876 36.189 198 HZ1 LYS 25 HZ1 LYS 25 24.896 25.555 36.094 199 HZ2 LYS 25 HZ2 LYS 25 24.111 25.958 34.709 200 HZ3 LYS 25 HZ3 LYS 25 23.782 26.735 36.140 201 H CYS 26 H CYS 26 20.447 27.379 30.473 202 HA CYS 26 HA CYS 26 18.041 27.364 28.949 203 HB2 CYS 26 HB2 CYS 26 20.173 28.140 28.089 204 HB3 CYS 26 HB3 CYS 26 20.897 26.558 28.329 205 H LYS 27 H LYS 27 16.765 25.780 28.101 206 HA LYS 27 HA LYS 27 17.646 22.933 28.047 207 HB2 LYS 27 HB2 LYS 27 15.772 23.945 29.956 208 HB3 LYS 27 HB3 LYS 27 14.814 23.179 28.725 209 HG2 LYS 27 HG2 LYS 27 15.107 21.406 30.121 210 HG3 LYS 27 HG3 LYS 27 16.411 21.139 28.969 211 HD2 LYS 27 HD2 LYS 27 17.333 20.795 31.134 212 HD3 LYS 27 HD3 LYS 27 17.937 22.376 30.589 213 HE2 LYS 27 HE2 LYS 27 16.240 23.521 31.950 214 HE3 LYS 27 HE3 LYS 27 15.517 21.968 32.410 215 HZ1 LYS 27 HZ1 LYS 27 17.516 21.435 33.641 216 HZ2 LYS 27 HZ2 LYS 27 18.299 22.738 33.118 217 HZ3 LYS 27 HZ3 LYS 27 17.008 22.927 34.128 218 H CYS 28 H CYS 28 16.909 21.788 26.270 219 HA CYS 28 HA CYS 28 15.586 23.373 24.170 220 HB2 CYS 28 HB2 CYS 28 16.863 20.672 23.858 221 HB3 CYS 28 HB3 CYS 28 16.421 21.823 22.602 222 H VAL 29 H VAL 29 13.907 22.556 22.822 223 HA VAL 29 HA VAL 29 11.977 20.786 24.228 224 HB VAL 29 HB VAL 29 10.179 21.971 23.158 225 HG11 VAL 29 HG11 VAL 29 10.293 24.042 24.390 226 HG12 VAL 29 HG12 VAL 29 11.066 22.755 25.338 227 HG13 VAL 29 HG13 VAL 29 12.064 23.952 24.484 228 HG21 VAL 29 HG21 VAL 29 12.248 23.852 21.969 229 HG22 VAL 29 HG22 VAL 29 11.233 22.706 21.061 230 HG23 VAL 29 HG23 VAL 29 10.487 24.058 21.924 231 HA PRO 30 HA PRO 30 12.437 17.905 21.072 232 HB2 PRO 30 HB2 PRO 30 10.197 16.357 21.216 233 HB3 PRO 30 HB3 PRO 30 11.410 16.445 22.535 234 HG2 PRO 30 HG2 PRO 30 8.792 18.011 22.268 235 HG3 PRO 30 HG3 PRO 30 9.402 17.092 23.671 236 HD2 PRO 30 HD2 PRO 30 9.759 19.752 23.498 237 HD3 PRO 30 HD3 PRO 30 11.033 18.716 24.218 238 H TYR 31 H TYR 31 12.121 17.258 19.027 239 HA TYR 31 HA TYR 31 9.701 17.954 17.476 240 HB2 TYR 31 HB2 TYR 31 12.528 18.743 16.796 241 HB3 TYR 31 HB3 TYR 31 11.341 18.472 15.535 242 HD1 TYR 31 HD1 TYR 31 12.283 20.670 18.390 243 HD2 TYR 31 HD2 TYR 31 9.483 19.968 15.196 244 HE1 TYR 31 HE1 TYR 31 11.305 22.937 18.726 245 HE2 TYR 31 HE2 TYR 31 8.518 22.237 15.545 246 HH TYR 31 HH TYR 31 8.756 24.246 16.632 Start of MODEL 9 1 H1 ALA 1 H1 ALA 1 18.405 37.730 38.278 2 H2 ALA 1 H2 ALA 1 19.952 37.636 38.825 3 H3 ALA 1 H3 ALA 1 19.114 36.260 38.466 4 HA ALA 1 HA ALA 1 19.778 38.350 36.509 5 HB1 ALA 1 HB1 ALA 1 21.159 35.659 36.919 6 HB2 ALA 1 HB2 ALA 1 21.492 36.819 35.615 7 HB3 ALA 1 HB3 ALA 1 21.851 37.256 37.295 8 H PHE 2 H PHE 2 19.199 37.880 34.357 9 HA PHE 2 HA PHE 2 16.969 35.937 34.038 10 HB2 PHE 2 HB2 PHE 2 18.020 38.110 32.208 11 HB3 PHE 2 HB3 PHE 2 16.605 37.101 31.908 12 HD1 PHE 2 HD1 PHE 2 14.732 37.105 33.718 13 HD2 PHE 2 HD2 PHE 2 17.743 40.177 33.356 14 HE1 PHE 2 HE1 PHE 2 13.318 38.649 35.026 15 HE2 PHE 2 HE2 PHE 2 16.305 41.737 34.636 16 HZ PHE 2 HZ PHE 2 14.079 40.981 35.470 17 H CYS 3 H CYS 3 16.913 34.379 32.312 18 HA CYS 3 HA CYS 3 19.349 33.045 31.643 19 HB2 CYS 3 HB2 CYS 3 17.886 31.616 30.313 20 HB3 CYS 3 HB3 CYS 3 17.201 31.942 31.899 21 H ASN 4 H ASN 4 20.324 32.681 29.638 22 HA ASN 4 HA ASN 4 20.449 34.987 27.791 23 HB2 ASN 4 HB2 ASN 4 22.127 32.454 27.882 24 HB3 ASN 4 HB3 ASN 4 22.469 33.912 26.955 25 HD21 ASN 4 HD21 ASN 4 23.701 35.717 29.793 26 HD22 ASN 4 HD22 ASN 4 22.986 35.912 28.184 27 H LEU 5 H LEU 5 18.136 34.418 27.176 28 HA LEU 5 HA LEU 5 17.396 32.013 26.000 29 HB2 LEU 5 HB2 LEU 5 16.297 34.651 26.518 30 HB3 LEU 5 HB3 LEU 5 15.819 34.184 24.906 31 HG LEU 5 HG LEU 5 15.521 32.374 27.325 32 HD11 LEU 5 HD11 LEU 5 13.135 33.051 27.371 33 HD12 LEU 5 HD12 LEU 5 14.219 34.402 27.726 34 HD13 LEU 5 HD13 LEU 5 13.475 34.270 26.120 35 HD21 LEU 5 HD21 LEU 5 13.802 31.239 25.916 36 HD22 LEU 5 HD22 LEU 5 14.225 32.327 24.576 37 HD23 LEU 5 HD23 LEU 5 15.415 31.163 25.193 38 H ARG 6 H ARG 6 18.600 34.909 24.224 39 HA ARG 6 HA ARG 6 18.138 33.661 21.616 40 HB2 ARG 6 HB2 ARG 6 19.527 36.191 22.542 41 HB3 ARG 6 HB3 ARG 6 19.734 35.611 20.880 42 HG2 ARG 6 HG2 ARG 6 17.338 35.571 20.498 43 HG3 ARG 6 HG3 ARG 6 17.001 36.059 22.153 44 HD2 ARG 6 HD2 ARG 6 18.624 37.702 20.185 45 HD3 ARG 6 HD3 ARG 6 16.871 37.878 20.371 46 HE ARG 6 HE ARG 6 17.670 38.274 22.931 47 HH11 ARG 6 HH11 ARG 6 18.653 39.760 19.910 48 HH12 ARG 6 HH12 ARG 6 19.237 41.207 20.688 49 HH21 ARG 6 HH21 ARG 6 18.265 40.194 23.861 50 HH22 ARG 6 HH22 ARG 6 18.851 41.511 22.881 51 H ARG 7 H ARG 7 21.022 33.852 23.679 52 HA ARG 7 HA ARG 7 22.791 32.401 21.904 53 HB2 ARG 7 HB2 ARG 7 23.454 33.658 23.972 54 HB3 ARG 7 HB3 ARG 7 22.635 32.442 24.954 55 HG2 ARG 7 HG2 ARG 7 24.209 30.697 23.928 56 HG3 ARG 7 HG3 ARG 7 25.106 32.050 23.218 57 HD2 ARG 7 HD2 ARG 7 24.550 31.594 26.182 58 HD3 ARG 7 HD3 ARG 7 26.076 31.249 25.360 59 HE ARG 7 HE ARG 7 25.337 34.006 24.944 60 HH11 ARG 7 HH11 ARG 7 26.739 31.999 27.531 61 HH12 ARG 7 HH12 ARG 7 27.530 33.440 28.186 62 HH21 ARG 7 HH21 ARG 7 26.367 35.621 25.907 63 HH22 ARG 7 HH22 ARG 7 27.337 35.321 27.353 64 H CYS 8 H CYS 8 20.564 31.306 24.452 65 HA CYS 8 HA CYS 8 21.156 28.561 24.380 66 HB2 CYS 8 HB2 CYS 8 19.973 29.711 26.178 67 HB3 CYS 8 HB3 CYS 8 18.619 30.054 25.108 68 H GLU 9 H GLU 9 18.419 30.236 22.664 69 HA GLU 9 HA GLU 9 17.509 27.826 21.420 70 HB2 GLU 9 HB2 GLU 9 17.059 30.740 20.660 71 HB3 GLU 9 HB3 GLU 9 16.221 29.353 19.923 72 HG2 GLU 9 HG2 GLU 9 15.492 28.646 22.236 73 HG3 GLU 9 HG3 GLU 9 16.124 30.169 22.854 74 H LEU 10 H LEU 10 20.056 30.086 20.345 75 HA LEU 10 HA LEU 10 20.320 28.965 17.680 76 HB2 LEU 10 HB2 LEU 10 20.989 31.189 17.917 77 HB3 LEU 10 HB3 LEU 10 21.683 30.924 19.522 78 HG LEU 10 HG LEU 10 23.530 29.706 18.559 79 HD11 LEU 10 HD11 LEU 10 22.474 30.720 15.872 80 HD12 LEU 10 HD12 LEU 10 24.047 29.933 16.126 81 HD13 LEU 10 HD13 LEU 10 22.556 29.011 16.354 82 HD21 LEU 10 HD21 LEU 10 23.740 32.066 19.121 83 HD22 LEU 10 HD22 LEU 10 24.712 31.698 17.685 84 HD23 LEU 10 HD23 LEU 10 23.145 32.523 17.506 85 H SER 11 H SER 11 21.900 28.513 20.867 86 HA SER 11 HA SER 11 23.808 26.553 20.091 87 HB2 SER 11 HB2 SER 11 23.811 27.820 22.218 88 HB3 SER 11 HB3 SER 11 22.377 26.927 22.748 89 HG SER 11 HG SER 11 25.014 26.036 22.313 90 H CYS 12 H CYS 12 20.369 26.183 21.025 91 HA CYS 12 HA CYS 12 20.362 23.296 20.659 92 HB2 CYS 12 HB2 CYS 12 18.043 25.257 20.702 93 HB3 CYS 12 HB3 CYS 12 17.945 23.506 20.876 94 H ARG 13 H ARG 13 19.797 26.065 18.464 95 HA ARG 13 HA ARG 13 18.722 24.569 16.245 96 HB2 ARG 13 HB2 ARG 13 18.747 27.106 16.550 97 HB3 ARG 13 HB3 ARG 13 20.443 27.071 16.051 98 HG2 ARG 13 HG2 ARG 13 19.710 25.928 13.903 99 HG3 ARG 13 HG3 ARG 13 18.035 26.182 14.405 100 HD2 ARG 13 HD2 ARG 13 20.159 28.293 13.876 101 HD3 ARG 13 HD3 ARG 13 18.773 27.914 12.843 102 HE ARG 13 HE ARG 13 17.394 28.578 14.962 103 HH11 ARG 13 HH11 ARG 13 20.225 30.339 13.781 104 HH12 ARG 13 HH12 ARG 13 19.829 31.731 14.784 105 HH21 ARG 13 HH21 ARG 13 16.930 30.467 16.049 106 HH22 ARG 13 HH22 ARG 13 18.062 31.796 15.982 107 H SER 14 H SER 14 22.070 25.215 17.253 108 HA SER 14 HA SER 14 23.464 24.000 15.126 109 HB2 SER 14 HB2 SER 14 24.319 25.218 17.236 110 HB3 SER 14 HB3 SER 14 24.249 23.642 18.036 111 HG SER 14 HG SER 14 25.739 22.856 16.467 112 H LEU 15 H LEU 15 21.438 22.442 17.530 113 HA LEU 15 HA LEU 15 22.242 19.714 16.623 114 HB2 LEU 15 HB2 LEU 15 20.558 20.540 19.005 115 HB3 LEU 15 HB3 LEU 15 21.178 18.928 18.648 116 HG LEU 15 HG LEU 15 22.860 21.352 19.427 117 HD11 LEU 15 HD11 LEU 15 21.471 20.460 21.256 118 HD12 LEU 15 HD12 LEU 15 22.125 18.829 20.963 119 HD13 LEU 15 HD13 LEU 15 23.188 20.139 21.526 120 HD21 LEU 15 HD21 LEU 15 24.704 19.724 19.652 121 HD22 LEU 15 HD22 LEU 15 23.666 18.444 18.990 122 HD23 LEU 15 HD23 LEU 15 24.152 19.825 17.979 123 H GLY 16 H GLY 16 19.855 22.033 15.964 124 HA2 GLY 16 HA2 GLY 16 18.012 21.866 14.582 125 HA3 GLY 16 HA3 GLY 16 18.119 20.110 14.611 126 H LEU 17 H LEU 17 17.909 21.752 17.736 127 HA LEU 17 HA LEU 17 14.990 21.201 17.855 128 HB2 LEU 17 HB2 LEU 17 15.283 20.466 20.240 129 HB3 LEU 17 HB3 LEU 17 15.613 19.318 18.973 130 HG LEU 17 HG LEU 17 17.905 20.824 20.270 131 HD11 LEU 17 HD11 LEU 17 18.050 19.059 21.979 132 HD12 LEU 17 HD12 LEU 17 16.482 19.875 22.110 133 HD13 LEU 17 HD13 LEU 17 16.578 18.288 21.351 134 HD21 LEU 17 HD21 LEU 17 18.369 19.298 18.341 135 HD22 LEU 17 HD22 LEU 17 19.080 18.674 19.836 136 HD23 LEU 17 HD23 LEU 17 17.585 17.965 19.201 137 H LEU 18 H LEU 18 13.922 22.104 19.758 138 HA LEU 18 HA LEU 18 14.319 25.003 19.746 139 HB2 LEU 18 HB2 LEU 18 12.179 23.095 20.756 140 HB3 LEU 18 HB3 LEU 18 12.154 24.808 21.157 141 HG LEU 18 HG LEU 18 11.997 25.423 18.792 142 HD11 LEU 18 HD11 LEU 18 11.875 22.424 18.250 143 HD12 LEU 18 HD12 LEU 18 11.371 23.679 17.106 144 HD13 LEU 18 HD13 LEU 18 13.060 23.592 17.598 145 HD21 LEU 18 HD21 LEU 18 9.942 23.335 19.628 146 HD22 LEU 18 HD22 LEU 18 9.965 25.026 20.170 147 HD23 LEU 18 HD23 LEU 18 9.690 24.648 18.463 148 H GLY 19 H GLY 19 14.107 26.261 21.726 149 HA2 GLY 19 HA2 GLY 19 15.652 25.132 24.034 150 HA3 GLY 19 HA3 GLY 19 15.626 26.813 23.574 151 H LYS 20 H LYS 20 15.102 25.670 26.170 152 HA LYS 20 HA LYS 20 12.485 26.863 26.839 153 HB2 LYS 20 HB2 LYS 20 12.145 24.486 26.826 154 HB3 LYS 20 HB3 LYS 20 13.734 24.179 27.548 155 HG2 LYS 20 HG2 LYS 20 12.061 23.742 29.188 156 HG3 LYS 20 HG3 LYS 20 12.972 25.162 29.678 157 HD2 LYS 20 HD2 LYS 20 11.053 26.545 28.576 158 HD3 LYS 20 HD3 LYS 20 10.159 25.000 28.539 159 HE2 LYS 20 HE2 LYS 20 10.921 24.803 31.042 160 HE3 LYS 20 HE3 LYS 20 11.309 26.521 30.903 161 HZ1 LYS 20 HZ1 LYS 20 9.104 26.215 31.809 162 HZ2 LYS 20 HZ2 LYS 20 8.913 26.861 30.286 163 HZ3 LYS 20 HZ3 LYS 20 8.627 25.276 30.570 164 H CYS 21 H CYS 21 13.012 28.603 28.011 165 HA CYS 21 HA CYS 21 15.391 28.641 29.807 166 HB2 CYS 21 HB2 CYS 21 15.193 30.629 28.613 167 HB3 CYS 21 HB3 CYS 21 13.440 30.708 28.790 168 H ILE 22 H ILE 22 15.293 28.494 31.956 169 HA ILE 22 HA ILE 22 12.638 28.685 33.333 170 HB ILE 22 HB ILE 22 14.853 26.758 34.108 171 HG12 ILE 22 HG12 ILE 22 12.080 26.284 32.927 172 HG13 ILE 22 HG13 ILE 22 13.622 25.979 32.116 173 HG21 ILE 22 HG21 ILE 22 13.304 26.032 35.876 174 HG22 ILE 22 HG22 ILE 22 13.578 27.750 36.059 175 HG23 ILE 22 HG23 ILE 22 12.071 27.184 35.314 176 HD11 ILE 22 HD11 ILE 22 12.487 24.441 34.479 177 HD12 ILE 22 HD12 ILE 22 12.740 23.883 32.823 178 HD13 ILE 22 HD13 ILE 22 14.145 24.241 33.849 179 H GLY 23 H GLY 23 13.060 30.901 33.508 180 HA2 GLY 23 HA2 GLY 23 13.425 32.723 34.839 181 HA3 GLY 23 HA3 GLY 23 14.122 31.652 36.047 182 H GLU 24 H GLU 24 16.291 31.007 35.761 183 HA GLU 24 HA GLU 24 18.009 33.259 34.785 184 HB2 GLU 24 HB2 GLU 24 19.406 33.009 36.650 185 HB3 GLU 24 HB3 GLU 24 17.745 32.998 37.234 186 HG2 GLU 24 HG2 GLU 24 17.912 30.444 37.316 187 HG3 GLU 24 HG3 GLU 24 19.634 30.637 36.953 188 H LYS 25 H LYS 25 17.489 29.891 34.279 189 HA LYS 25 HA LYS 25 20.047 29.687 32.727 190 HB2 LYS 25 HB2 LYS 25 18.674 27.383 34.162 191 HB3 LYS 25 HB3 LYS 25 20.167 27.311 33.232 192 HG2 LYS 25 HG2 LYS 25 19.788 28.685 35.908 193 HG3 LYS 25 HG3 LYS 25 20.618 27.169 35.594 194 HD2 LYS 25 HD2 LYS 25 22.308 28.375 34.211 195 HD3 LYS 25 HD3 LYS 25 21.526 29.912 34.620 196 HE2 LYS 25 HE2 LYS 25 21.871 29.360 37.062 197 HE3 LYS 25 HE3 LYS 25 22.773 27.928 36.573 198 HZ1 LYS 25 HZ1 LYS 25 24.276 29.700 37.048 199 HZ2 LYS 25 HZ2 LYS 25 24.353 29.448 35.430 200 HZ3 LYS 25 HZ3 LYS 25 23.529 30.751 36.038 201 H CYS 26 H CYS 26 19.892 27.961 30.981 202 HA CYS 26 HA CYS 26 17.197 27.382 29.990 203 HB2 CYS 26 HB2 CYS 26 17.615 29.656 29.191 204 HB3 CYS 26 HB3 CYS 26 19.113 29.152 28.427 205 H LYS 27 H LYS 27 17.038 25.655 28.748 206 HA LYS 27 HA LYS 27 19.390 24.292 27.520 207 HB2 LYS 27 HB2 LYS 27 17.475 23.035 29.532 208 HB3 LYS 27 HB3 LYS 27 18.577 22.103 28.532 209 HG2 LYS 27 HG2 LYS 27 19.426 24.148 30.627 210 HG3 LYS 27 HG3 LYS 27 19.393 22.400 30.836 211 HD2 LYS 27 HD2 LYS 27 21.091 22.084 29.108 212 HD3 LYS 27 HD3 LYS 27 21.110 23.825 28.754 213 HE2 LYS 27 HE2 LYS 27 21.859 24.329 31.032 214 HE3 LYS 27 HE3 LYS 27 21.800 22.612 31.457 215 HZ1 LYS 27 HZ1 LYS 27 24.067 23.398 30.834 216 HZ2 LYS 27 HZ2 LYS 27 23.549 22.175 29.861 217 HZ3 LYS 27 HZ3 LYS 27 23.539 23.708 29.312 218 H CYS 28 H CYS 28 18.583 22.255 26.239 219 HA CYS 28 HA CYS 28 16.486 23.290 24.450 220 HB2 CYS 28 HB2 CYS 28 18.069 20.765 24.060 221 HB3 CYS 28 HB3 CYS 28 17.252 21.761 22.861 222 H VAL 29 H VAL 29 14.962 21.594 23.397 223 HA VAL 29 HA VAL 29 13.870 19.677 25.399 224 HB VAL 29 HB VAL 29 11.570 20.289 24.623 225 HG11 VAL 29 HG11 VAL 29 12.432 20.932 26.818 226 HG12 VAL 29 HG12 VAL 29 13.134 22.405 26.116 227 HG13 VAL 29 HG13 VAL 29 11.367 22.186 26.158 228 HG21 VAL 29 HG21 VAL 29 12.188 21.584 22.587 229 HG22 VAL 29 HG22 VAL 29 11.119 22.467 23.697 230 HG23 VAL 29 HG23 VAL 29 12.845 22.859 23.642 231 HA PRO 30 HA PRO 30 14.121 16.739 22.301 232 HB2 PRO 30 HB2 PRO 30 12.357 14.785 23.063 233 HB3 PRO 30 HB3 PRO 30 13.815 15.222 24.005 234 HG2 PRO 30 HG2 PRO 30 10.973 16.214 24.427 235 HG3 PRO 30 HG3 PRO 30 12.091 15.508 25.640 236 HD2 PRO 30 HD2 PRO 30 11.850 18.183 25.365 237 HD3 PRO 30 HD3 PRO 30 13.454 17.441 25.652 238 H TYR 31 H TYR 31 13.535 16.237 20.315 239 HA TYR 31 HA TYR 31 10.746 16.073 19.368 240 HB2 TYR 31 HB2 TYR 31 12.886 17.960 18.347 241 HB3 TYR 31 HB3 TYR 31 11.716 17.272 17.241 242 HD1 TYR 31 HD1 TYR 31 12.120 19.559 20.113 243 HD2 TYR 31 HD2 TYR 31 9.355 17.765 17.333 244 HE1 TYR 31 HE1 TYR 31 10.341 21.120 20.873 245 HE2 TYR 31 HE2 TYR 31 7.575 19.318 18.084 246 HH TYR 31 HH TYR 31 6.972 20.699 19.832 Start of MODEL 10 1 H1 ALA 1 H1 ALA 1 14.863 32.735 37.122 2 H2 ALA 1 H2 ALA 1 14.320 34.294 37.093 3 H3 ALA 1 H3 ALA 1 14.898 33.662 38.490 4 HA ALA 1 HA ALA 1 16.443 35.180 37.470 5 HB1 ALA 1 HB1 ALA 1 18.437 33.586 37.452 6 HB2 ALA 1 HB2 ALA 1 17.443 33.573 38.918 7 HB3 ALA 1 HB3 ALA 1 17.275 32.273 37.723 8 H PHE 2 H PHE 2 17.830 35.737 35.763 9 HA PHE 2 HA PHE 2 16.470 35.339 33.252 10 HB2 PHE 2 HB2 PHE 2 18.934 36.960 33.964 11 HB3 PHE 2 HB3 PHE 2 18.085 37.030 32.424 12 HD1 PHE 2 HD1 PHE 2 18.177 38.335 35.791 13 HD2 PHE 2 HD2 PHE 2 15.588 37.629 32.414 14 HE1 PHE 2 HE1 PHE 2 16.525 39.943 36.712 15 HE2 PHE 2 HE2 PHE 2 13.941 39.222 33.342 16 HZ PHE 2 HZ PHE 2 14.404 40.393 35.494 17 H CYS 3 H CYS 3 17.027 34.325 31.407 18 HA CYS 3 HA CYS 3 19.716 33.023 31.119 19 HB2 CYS 3 HB2 CYS 3 17.038 32.468 29.800 20 HB3 CYS 3 HB3 CYS 3 18.559 31.788 29.297 21 H ASN 4 H ASN 4 20.722 33.295 29.008 22 HA ASN 4 HA ASN 4 19.977 35.718 27.481 23 HB2 ASN 4 HB2 ASN 4 22.228 33.727 27.002 24 HB3 ASN 4 HB3 ASN 4 21.971 35.275 26.188 25 HD21 ASN 4 HD21 ASN 4 23.658 35.195 29.876 26 HD22 ASN 4 HD22 ASN 4 22.925 33.735 29.188 27 H LEU 5 H LEU 5 17.777 34.591 27.171 28 HA LEU 5 HA LEU 5 17.407 32.050 26.196 29 HB2 LEU 5 HB2 LEU 5 15.650 33.472 27.147 30 HB3 LEU 5 HB3 LEU 5 15.665 34.485 25.701 31 HG LEU 5 HG LEU 5 14.859 32.573 24.335 32 HD11 LEU 5 HD11 LEU 5 14.722 31.073 26.988 33 HD12 LEU 5 HD12 LEU 5 13.998 30.538 25.455 34 HD13 LEU 5 HD13 LEU 5 15.752 30.651 25.592 35 HD21 LEU 5 HD21 LEU 5 12.595 32.474 25.266 36 HD22 LEU 5 HD22 LEU 5 13.188 33.078 26.829 37 HD23 LEU 5 HD23 LEU 5 13.249 34.113 25.381 38 H ARG 6 H ARG 6 17.829 34.932 24.032 39 HA ARG 6 HA ARG 6 17.488 33.395 21.618 40 HB2 ARG 6 HB2 ARG 6 19.140 35.922 22.009 41 HB3 ARG 6 HB3 ARG 6 18.585 35.231 20.471 42 HG2 ARG 6 HG2 ARG 6 16.198 35.455 21.366 43 HG3 ARG 6 HG3 ARG 6 16.873 36.371 22.705 44 HD2 ARG 6 HD2 ARG 6 16.393 38.128 21.335 45 HD3 ARG 6 HD3 ARG 6 18.016 37.767 20.728 46 HE ARG 6 HE ARG 6 15.613 36.472 19.503 47 HH11 ARG 6 HH11 ARG 6 18.205 38.833 18.984 48 HH12 ARG 6 HH12 ARG 6 17.805 38.891 17.266 49 HH21 ARG 6 HH21 ARG 6 15.240 36.748 17.299 50 HH22 ARG 6 HH22 ARG 6 16.323 37.828 16.426 51 H ARG 7 H ARG 7 20.474 33.963 23.531 52 HA ARG 7 HA ARG 7 22.206 32.508 21.688 53 HB2 ARG 7 HB2 ARG 7 22.656 32.807 24.684 54 HB3 ARG 7 HB3 ARG 7 23.834 32.441 23.424 55 HG2 ARG 7 HG2 ARG 7 23.087 34.781 22.439 56 HG3 ARG 7 HG3 ARG 7 22.497 35.072 24.059 57 HD2 ARG 7 HD2 ARG 7 25.353 34.442 23.217 58 HD3 ARG 7 HD3 ARG 7 24.734 35.996 23.780 59 HE ARG 7 HE ARG 7 24.652 33.630 25.618 60 HH11 ARG 7 HH11 ARG 7 26.319 36.731 24.979 61 HH12 ARG 7 HH12 ARG 7 26.975 36.681 26.591 62 HH21 ARG 7 HH21 ARG 7 25.650 33.696 27.467 63 HH22 ARG 7 HH22 ARG 7 26.748 35.018 27.871 64 H CYS 8 H CYS 8 20.211 31.523 24.450 65 HA CYS 8 HA CYS 8 20.960 28.748 24.455 66 HB2 CYS 8 HB2 CYS 8 19.816 29.829 26.312 67 HB3 CYS 8 HB3 CYS 8 18.414 30.164 25.299 68 H GLU 9 H GLU 9 18.249 30.435 22.737 69 HA GLU 9 HA GLU 9 17.328 28.097 21.356 70 HB2 GLU 9 HB2 GLU 9 17.019 31.070 20.825 71 HB3 GLU 9 HB3 GLU 9 16.284 29.831 19.797 72 HG2 GLU 9 HG2 GLU 9 15.082 28.872 21.704 73 HG3 GLU 9 HG3 GLU 9 15.796 30.050 22.803 74 H LEU 10 H LEU 10 19.756 30.576 20.321 75 HA LEU 10 HA LEU 10 20.325 29.344 17.784 76 HB2 LEU 10 HB2 LEU 10 22.051 31.005 19.666 77 HB3 LEU 10 HB3 LEU 10 22.566 30.533 18.050 78 HG LEU 10 HG LEU 10 20.059 32.141 18.585 79 HD11 LEU 10 HD11 LEU 10 21.395 34.112 17.861 80 HD12 LEU 10 HD12 LEU 10 22.023 33.404 19.355 81 HD13 LEU 10 HD13 LEU 10 22.852 33.098 17.812 82 HD21 LEU 10 HD21 LEU 10 20.071 31.025 16.380 83 HD22 LEU 10 HD22 LEU 10 20.267 32.769 16.197 84 HD23 LEU 10 HD23 LEU 10 21.682 31.702 16.042 85 H SER 11 H SER 11 21.696 28.829 20.990 86 HA SER 11 HA SER 11 23.658 26.885 20.275 87 HB2 SER 11 HB2 SER 11 23.691 28.056 22.402 88 HB3 SER 11 HB3 SER 11 22.162 27.306 22.886 89 HG SER 11 HG SER 11 24.610 25.954 22.340 90 H CYS 12 H CYS 12 20.207 26.380 21.242 91 HA CYS 12 HA CYS 12 20.370 23.505 20.797 92 HB2 CYS 12 HB2 CYS 12 17.958 25.336 20.904 93 HB3 CYS 12 HB3 CYS 12 17.914 23.572 20.930 94 H ARG 13 H ARG 13 19.631 26.291 18.673 95 HA ARG 13 HA ARG 13 18.734 24.742 16.404 96 HB2 ARG 13 HB2 ARG 13 18.378 27.182 16.733 97 HB3 ARG 13 HB3 ARG 13 20.080 27.486 16.420 98 HG2 ARG 13 HG2 ARG 13 18.308 26.050 14.409 99 HG3 ARG 13 HG3 ARG 13 18.298 27.802 14.535 100 HD2 ARG 13 HD2 ARG 13 20.795 26.173 13.908 101 HD3 ARG 13 HD3 ARG 13 19.759 26.910 12.717 102 HE ARG 13 HE ARG 13 21.578 28.304 14.609 103 HH11 ARG 13 HH11 ARG 13 19.313 28.741 11.950 104 HH12 ARG 13 HH12 ARG 13 19.886 30.370 11.657 105 HH21 ARG 13 HH21 ARG 13 22.301 30.224 14.133 106 HH22 ARG 13 HH22 ARG 13 21.658 31.164 12.801 107 H SER 14 H SER 14 22.008 25.835 17.382 108 HA SER 14 HA SER 14 23.510 24.726 15.279 109 HB2 SER 14 HB2 SER 14 24.147 24.970 18.247 110 HB3 SER 14 HB3 SER 14 25.333 24.502 17.021 111 HG SER 14 HG SER 14 25.217 26.423 16.087 112 H LEU 15 H LEU 15 21.934 23.020 17.953 113 HA LEU 15 HA LEU 15 23.162 20.433 17.160 114 HB2 LEU 15 HB2 LEU 15 21.284 21.188 19.427 115 HB3 LEU 15 HB3 LEU 15 21.985 19.590 19.172 116 HG LEU 15 HG LEU 15 23.544 22.139 19.801 117 HD11 LEU 15 HD11 LEU 15 22.183 21.294 21.682 118 HD12 LEU 15 HD12 LEU 15 22.936 19.692 21.505 119 HD13 LEU 15 HD13 LEU 15 23.916 21.099 21.982 120 HD21 LEU 15 HD21 LEU 15 24.493 19.256 19.530 121 HD22 LEU 15 HD22 LEU 15 24.947 20.621 18.484 122 HD23 LEU 15 HD23 LEU 15 25.459 20.605 20.170 123 H GLY 16 H GLY 16 20.119 22.148 16.756 124 HA2 GLY 16 HA2 GLY 16 18.770 21.584 14.820 125 HA3 GLY 16 HA3 GLY 16 19.082 19.874 15.093 126 H LEU 17 H LEU 17 18.061 22.191 17.624 127 HA LEU 17 HA LEU 17 15.285 21.273 17.600 128 HB2 LEU 17 HB2 LEU 17 15.361 20.459 19.917 129 HB3 LEU 17 HB3 LEU 17 16.134 19.403 18.758 130 HG LEU 17 HG LEU 17 17.651 21.231 20.664 131 HD11 LEU 17 HD11 LEU 17 16.894 18.281 20.912 132 HD12 LEU 17 HD12 LEU 17 17.961 19.161 22.027 133 HD13 LEU 17 HD13 LEU 17 16.253 19.603 21.902 134 HD21 LEU 17 HD21 LEU 17 18.522 18.814 19.016 135 HD22 LEU 17 HD22 LEU 17 19.126 20.482 18.895 136 HD23 LEU 17 HD23 LEU 17 19.485 19.534 20.326 137 H LEU 18 H LEU 18 14.047 22.194 19.496 138 HA LEU 18 HA LEU 18 14.522 25.076 19.586 139 HB2 LEU 18 HB2 LEU 18 12.262 23.268 20.396 140 HB3 LEU 18 HB3 LEU 18 12.362 24.912 21.017 141 HG LEU 18 HG LEU 18 12.479 25.780 18.669 142 HD11 LEU 18 HD11 LEU 18 11.587 24.277 16.862 143 HD12 LEU 18 HD12 LEU 18 13.214 23.855 17.385 144 HD13 LEU 18 HD13 LEU 18 11.824 22.893 17.939 145 HD21 LEU 18 HD21 LEU 18 10.059 24.142 19.476 146 HD22 LEU 18 HD22 LEU 18 10.410 25.822 19.930 147 HD23 LEU 18 HD23 LEU 18 10.058 25.423 18.243 148 H GLY 19 H GLY 19 14.627 26.336 21.480 149 HA2 GLY 19 HA2 GLY 19 15.801 25.012 23.898 150 HA3 GLY 19 HA3 GLY 19 16.325 26.568 23.282 151 H LYS 20 H LYS 20 15.369 25.881 25.932 152 HA LYS 20 HA LYS 20 13.516 28.137 26.283 153 HB2 LYS 20 HB2 LYS 20 11.944 27.053 27.624 154 HB3 LYS 20 HB3 LYS 20 12.038 26.229 26.071 155 HG2 LYS 20 HG2 LYS 20 13.497 24.484 27.122 156 HG3 LYS 20 HG3 LYS 20 13.320 25.313 28.688 157 HD2 LYS 20 HD2 LYS 20 10.857 25.008 28.568 158 HD3 LYS 20 HD3 LYS 20 11.054 24.183 26.994 159 HE2 LYS 20 HE2 LYS 20 12.668 22.621 28.096 160 HE3 LYS 20 HE3 LYS 20 12.291 23.380 29.646 161 HZ1 LYS 20 HZ1 LYS 20 9.982 22.584 29.401 162 HZ2 LYS 20 HZ2 LYS 20 10.320 21.897 27.955 163 HZ3 LYS 20 HZ3 LYS 20 11.060 21.314 29.263 164 H CYS 21 H CYS 21 13.405 28.877 28.537 165 HA CYS 21 HA CYS 21 15.933 28.330 30.059 166 HB2 CYS 21 HB2 CYS 21 15.538 30.668 29.363 167 HB3 CYS 21 HB3 CYS 21 13.997 30.648 30.205 168 H ILE 22 H ILE 22 15.740 26.973 31.757 169 HA ILE 22 HA ILE 22 13.064 26.536 33.030 170 HB ILE 22 HB ILE 22 15.546 24.793 33.097 171 HG12 ILE 22 HG12 ILE 22 12.883 24.473 31.626 172 HG13 ILE 22 HG13 ILE 22 14.452 24.804 30.880 173 HG21 ILE 22 HG21 ILE 22 12.738 24.268 34.196 174 HG22 ILE 22 HG22 ILE 22 14.127 23.161 34.277 175 HG23 ILE 22 HG23 ILE 22 14.155 24.650 35.193 176 HD11 ILE 22 HD11 ILE 22 13.629 22.233 32.267 177 HD12 ILE 22 HD12 ILE 22 14.005 22.484 30.561 178 HD13 ILE 22 HD13 ILE 22 15.297 22.617 31.764 179 H GLY 23 H GLY 23 12.993 28.305 34.288 180 HA2 GLY 23 HA2 GLY 23 13.181 29.670 36.083 181 HA3 GLY 23 HA3 GLY 23 13.993 28.336 36.881 182 H GLU 24 H GLU 24 16.395 28.188 35.781 183 HA GLU 24 HA GLU 24 17.721 30.852 36.094 184 HB2 GLU 24 HB2 GLU 24 18.780 28.301 37.357 185 HB3 GLU 24 HB3 GLU 24 19.222 29.964 37.674 186 HG2 GLU 24 HG2 GLU 24 18.061 29.600 39.548 187 HG3 GLU 24 HG3 GLU 24 16.701 30.123 38.577 188 H LYS 25 H LYS 25 17.539 28.116 34.096 189 HA LYS 25 HA LYS 25 20.199 28.591 32.888 190 HB2 LYS 25 HB2 LYS 25 20.824 26.230 33.044 191 HB3 LYS 25 HB3 LYS 25 20.733 26.980 34.621 192 HG2 LYS 25 HG2 LYS 25 18.372 25.381 33.558 193 HG3 LYS 25 HG3 LYS 25 19.786 24.563 34.210 194 HD2 LYS 25 HD2 LYS 25 19.515 25.626 36.381 195 HD3 LYS 25 HD3 LYS 25 18.166 26.601 35.786 196 HE2 LYS 25 HE2 LYS 25 16.916 24.509 35.250 197 HE3 LYS 25 HE3 LYS 25 18.208 23.570 36.013 198 HZ1 LYS 25 HZ1 LYS 25 17.705 24.716 38.108 199 HZ2 LYS 25 HZ2 LYS 25 16.607 25.675 37.379 200 HZ3 LYS 25 HZ3 LYS 25 16.324 24.054 37.502 201 H CYS 26 H CYS 26 20.547 27.707 30.845 202 HA CYS 26 HA CYS 26 18.221 27.444 29.118 203 HB2 CYS 26 HB2 CYS 26 20.305 28.487 28.371 204 HB3 CYS 26 HB3 CYS 26 21.200 27.016 28.732 205 H LYS 27 H LYS 27 17.377 25.623 28.117 206 HA LYS 27 HA LYS 27 18.789 23.102 28.044 207 HB2 LYS 27 HB2 LYS 27 17.297 23.244 30.280 208 HB3 LYS 27 HB3 LYS 27 15.972 22.968 29.158 209 HG2 LYS 27 HG2 LYS 27 16.589 20.819 29.992 210 HG3 LYS 27 HG3 LYS 27 17.219 20.895 28.350 211 HD2 LYS 27 HD2 LYS 27 19.122 20.147 29.362 212 HD3 LYS 27 HD3 LYS 27 19.378 21.880 29.646 213 HE2 LYS 27 HE2 LYS 27 18.301 21.618 31.907 214 HE3 LYS 27 HE3 LYS 27 18.133 19.887 31.592 215 HZ1 LYS 27 HZ1 LYS 27 20.111 20.223 32.861 216 HZ2 LYS 27 HZ2 LYS 27 20.577 19.784 31.368 217 HZ3 LYS 27 HZ3 LYS 27 20.693 21.374 31.814 218 H CYS 28 H CYS 28 18.078 21.743 26.339 219 HA CYS 28 HA CYS 28 16.270 23.072 24.413 220 HB2 CYS 28 HB2 CYS 28 17.913 20.597 23.954 221 HB3 CYS 28 HB3 CYS 28 17.135 21.639 22.764 222 H VAL 29 H VAL 29 14.679 21.790 23.221 223 HA VAL 29 HA VAL 29 13.401 19.646 24.865 224 HB VAL 29 HB VAL 29 11.207 20.401 24.072 225 HG11 VAL 29 HG11 VAL 29 12.760 22.532 25.602 226 HG12 VAL 29 HG12 VAL 29 11.000 22.275 25.607 227 HG13 VAL 29 HG13 VAL 29 12.073 21.039 26.287 228 HG21 VAL 29 HG21 VAL 29 10.869 22.649 23.185 229 HG22 VAL 29 HG22 VAL 29 12.617 22.945 23.127 230 HG23 VAL 29 HG23 VAL 29 11.877 21.720 22.075 231 HA PRO 30 HA PRO 30 14.108 17.228 21.376 232 HB2 PRO 30 HB2 PRO 30 12.540 15.026 21.758 233 HB3 PRO 30 HB3 PRO 30 13.917 15.451 22.816 234 HG2 PRO 30 HG2 PRO 30 10.977 16.066 23.270 235 HG3 PRO 30 HG3 PRO 30 12.143 15.329 24.416 236 HD2 PRO 30 HD2 PRO 30 11.571 17.991 24.469 237 HD3 PRO 30 HD3 PRO 30 13.225 17.390 24.793 238 H TYR 31 H TYR 31 13.651 17.199 19.335 239 HA TYR 31 HA TYR 31 10.866 17.208 18.265 240 HB2 TYR 31 HB2 TYR 31 13.178 19.004 17.594 241 HB3 TYR 31 HB3 TYR 31 12.107 18.485 16.305 242 HD1 TYR 31 HD1 TYR 31 11.989 20.023 19.738 243 HD2 TYR 31 HD2 TYR 31 10.099 19.593 15.890 244 HE1 TYR 31 HE1 TYR 31 10.220 21.625 20.433 245 HE2 TYR 31 HE2 TYR 31 8.356 21.234 16.564 246 HH TYR 31 HH TYR 31 8.297 22.686 19.849 Start of MODEL 11 1 H1 ALA 1 H1 ALA 1 23.804 34.440 37.122 2 H2 ALA 1 H2 ALA 1 25.220 33.753 36.595 3 H3 ALA 1 H3 ALA 1 23.826 32.867 36.689 4 HA ALA 1 HA ALA 1 24.166 35.193 34.954 5 HB1 ALA 1 HB1 ALA 1 24.316 33.618 33.055 6 HB2 ALA 1 HB2 ALA 1 25.698 33.477 34.153 7 HB3 ALA 1 HB3 ALA 1 24.408 32.260 34.191 8 H PHE 2 H PHE 2 22.255 36.064 34.653 9 HA PHE 2 HA PHE 2 19.714 34.678 34.952 10 HB2 PHE 2 HB2 PHE 2 20.508 37.360 33.763 11 HB3 PHE 2 HB3 PHE 2 18.845 36.809 33.937 12 HD1 PHE 2 HD1 PHE 2 21.684 38.287 35.693 13 HD2 PHE 2 HD2 PHE 2 17.919 36.248 36.213 14 HE1 PHE 2 HE1 PHE 2 21.594 39.041 38.056 15 HE2 PHE 2 HE2 PHE 2 17.842 36.985 38.565 16 HZ PHE 2 HZ PHE 2 19.664 38.408 39.497 17 H CYS 3 H CYS 3 18.125 34.652 33.139 18 HA CYS 3 HA CYS 3 18.972 32.932 31.100 19 HB2 CYS 3 HB2 CYS 3 16.701 33.008 31.945 20 HB3 CYS 3 HB3 CYS 3 16.497 34.657 31.363 21 H ASN 4 H ASN 4 19.599 33.079 29.108 22 HA ASN 4 HA ASN 4 19.186 35.530 27.474 23 HB2 ASN 4 HB2 ASN 4 21.757 33.894 27.601 24 HB3 ASN 4 HB3 ASN 4 21.387 35.105 26.371 25 HD21 ASN 4 HD21 ASN 4 21.911 37.875 28.551 26 HD22 ASN 4 HD22 ASN 4 21.174 37.366 27.033 27 H LEU 5 H LEU 5 17.221 34.286 27.058 28 HA LEU 5 HA LEU 5 16.910 31.828 25.885 29 HB2 LEU 5 HB2 LEU 5 15.069 33.235 26.563 30 HB3 LEU 5 HB3 LEU 5 15.489 34.458 25.365 31 HG LEU 5 HG LEU 5 14.866 32.912 23.525 32 HD11 LEU 5 HD11 LEU 5 15.274 30.726 24.608 33 HD12 LEU 5 HD12 LEU 5 13.961 31.055 25.764 34 HD13 LEU 5 HD13 LEU 5 13.613 30.841 24.035 35 HD21 LEU 5 HD21 LEU 5 12.457 32.965 23.891 36 HD22 LEU 5 HD22 LEU 5 12.704 33.211 25.639 37 HD23 LEU 5 HD23 LEU 5 13.203 34.462 24.478 38 H ARG 6 H ARG 6 17.858 34.800 24.011 39 HA ARG 6 HA ARG 6 17.625 33.550 21.409 40 HB2 ARG 6 HB2 ARG 6 19.340 35.886 22.393 41 HB3 ARG 6 HB3 ARG 6 19.284 35.352 20.718 42 HG2 ARG 6 HG2 ARG 6 16.832 35.725 20.664 43 HG3 ARG 6 HG3 ARG 6 16.899 36.385 22.312 44 HD2 ARG 6 HD2 ARG 6 18.299 38.227 21.601 45 HD3 ARG 6 HD3 ARG 6 18.585 37.471 20.019 46 HE ARG 6 HE ARG 6 15.766 37.914 20.469 47 HH11 ARG 6 HH11 ARG 6 18.653 39.624 19.278 48 HH12 ARG 6 HH12 ARG 6 17.626 40.626 18.261 49 HH21 ARG 6 HH21 ARG 6 14.686 39.173 19.066 50 HH22 ARG 6 HH22 ARG 6 15.548 40.401 18.155 51 H ARG 7 H ARG 7 20.312 33.784 23.656 52 HA ARG 7 HA ARG 7 22.306 32.402 22.077 53 HB2 ARG 7 HB2 ARG 7 22.514 34.027 24.094 54 HB3 ARG 7 HB3 ARG 7 22.206 32.634 25.110 55 HG2 ARG 7 HG2 ARG 7 24.513 33.006 23.155 56 HG3 ARG 7 HG3 ARG 7 24.584 33.224 24.897 57 HD2 ARG 7 HD2 ARG 7 24.282 30.610 23.391 58 HD3 ARG 7 HD3 ARG 7 25.633 31.192 24.358 59 HE ARG 7 HE ARG 7 23.173 30.972 25.923 60 HH11 ARG 7 HH11 ARG 7 26.053 29.130 24.935 61 HH12 ARG 7 HH12 ARG 7 25.659 27.877 26.102 62 HH21 ARG 7 HH21 ARG 7 23.027 29.564 27.488 63 HH22 ARG 7 HH22 ARG 7 24.272 28.333 27.703 64 H CYS 8 H CYS 8 19.863 31.350 24.425 65 HA CYS 8 HA CYS 8 20.704 28.592 24.549 66 HB2 CYS 8 HB2 CYS 8 19.306 29.782 26.247 67 HB3 CYS 8 HB3 CYS 8 17.980 29.827 25.088 68 H GLU 9 H GLU 9 18.106 30.231 22.651 69 HA GLU 9 HA GLU 9 17.231 27.974 21.199 70 HB2 GLU 9 HB2 GLU 9 17.213 30.957 20.684 71 HB3 GLU 9 HB3 GLU 9 16.598 29.855 19.463 72 HG2 GLU 9 HG2 GLU 9 15.569 29.722 22.313 73 HG3 GLU 9 HG3 GLU 9 14.945 30.899 21.164 74 H LEU 10 H LEU 10 19.851 30.315 20.269 75 HA LEU 10 HA LEU 10 20.344 28.867 17.797 76 HB2 LEU 10 HB2 LEU 10 22.160 30.306 17.393 77 HB3 LEU 10 HB3 LEU 10 20.834 31.235 18.046 78 HG LEU 10 HG LEU 10 22.137 30.962 20.338 79 HD11 LEU 10 HD11 LEU 10 24.592 31.040 20.033 80 HD12 LEU 10 HD12 LEU 10 23.974 29.487 19.479 81 HD13 LEU 10 HD13 LEU 10 24.400 30.731 18.296 82 HD21 LEU 10 HD21 LEU 10 23.057 32.823 18.120 83 HD22 LEU 10 HD22 LEU 10 21.688 33.101 19.218 84 HD23 LEU 10 HD23 LEU 10 23.338 33.069 19.854 85 H SER 11 H SER 11 21.637 28.522 21.085 86 HA SER 11 HA SER 11 23.715 26.656 20.432 87 HB2 SER 11 HB2 SER 11 23.527 27.830 22.592 88 HB3 SER 11 HB3 SER 11 22.049 26.927 22.962 89 HG SER 11 HG SER 11 24.709 25.992 22.689 90 H CYS 12 H CYS 12 20.215 26.124 21.179 91 HA CYS 12 HA CYS 12 20.398 23.255 20.755 92 HB2 CYS 12 HB2 CYS 12 18.001 25.107 20.753 93 HB3 CYS 12 HB3 CYS 12 17.949 23.353 20.870 94 H ARG 13 H ARG 13 19.840 25.992 18.575 95 HA ARG 13 HA ARG 13 18.928 24.568 16.269 96 HB2 ARG 13 HB2 ARG 13 19.021 27.104 16.745 97 HB3 ARG 13 HB3 ARG 13 20.717 27.028 16.242 98 HG2 ARG 13 HG2 ARG 13 19.912 26.091 14.027 99 HG3 ARG 13 HG3 ARG 13 18.255 26.395 14.558 100 HD2 ARG 13 HD2 ARG 13 20.478 28.458 14.284 101 HD3 ARG 13 HD3 ARG 13 19.163 28.219 13.126 102 HE ARG 13 HE ARG 13 17.597 28.807 15.057 103 HH11 ARG 13 HH11 ARG 13 20.606 30.502 14.468 104 HH12 ARG 13 HH12 ARG 13 20.195 31.805 15.560 105 HH21 ARG 13 HH21 ARG 13 17.189 30.408 16.538 106 HH22 ARG 13 HH22 ARG 13 18.368 31.660 16.839 107 H SER 14 H SER 14 22.224 24.984 17.578 108 HA SER 14 HA SER 14 23.638 23.745 15.448 109 HB2 SER 14 HB2 SER 14 24.270 23.660 18.427 110 HB3 SER 14 HB3 SER 14 25.384 23.250 17.118 111 HG SER 14 HG SER 14 25.024 25.400 16.304 112 H LEU 15 H LEU 15 21.385 22.230 17.579 113 HA LEU 15 HA LEU 15 22.341 19.516 16.722 114 HB2 LEU 15 HB2 LEU 15 20.556 20.363 19.028 115 HB3 LEU 15 HB3 LEU 15 20.968 18.695 18.619 116 HG LEU 15 HG LEU 15 23.015 20.797 19.445 117 HD11 LEU 15 HD11 LEU 15 21.705 18.595 21.089 118 HD12 LEU 15 HD12 LEU 15 23.031 19.656 21.618 119 HD13 LEU 15 HD13 LEU 15 21.438 20.344 21.276 120 HD21 LEU 15 HD21 LEU 15 23.981 18.925 18.137 121 HD22 LEU 15 HD22 LEU 15 24.477 18.848 19.827 122 HD23 LEU 15 HD23 LEU 15 23.209 17.757 19.231 123 H GLY 16 H GLY 16 19.727 21.809 16.486 124 HA2 GLY 16 HA2 GLY 16 18.289 21.756 14.550 125 HA3 GLY 16 HA3 GLY 16 18.239 19.995 14.621 126 H LEU 17 H LEU 17 17.905 21.464 17.704 127 HA LEU 17 HA LEU 17 14.936 21.208 17.654 128 HB2 LEU 17 HB2 LEU 17 15.136 20.517 20.069 129 HB3 LEU 17 HB3 LEU 17 15.482 19.310 18.848 130 HG LEU 17 HG LEU 17 17.720 20.811 20.241 131 HD11 LEU 17 HD11 LEU 17 16.354 18.263 21.200 132 HD12 LEU 17 HD12 LEU 17 17.765 19.045 21.942 133 HD13 LEU 17 HD13 LEU 17 16.176 19.841 21.970 134 HD21 LEU 17 HD21 LEU 17 18.922 18.656 19.889 135 HD22 LEU 17 HD22 LEU 17 17.494 17.991 19.085 136 HD23 LEU 17 HD23 LEU 17 18.380 19.324 18.338 137 H LEU 18 H LEU 18 13.919 22.316 19.575 138 HA LEU 18 HA LEU 18 14.796 25.145 19.595 139 HB2 LEU 18 HB2 LEU 18 12.280 23.694 20.508 140 HB3 LEU 18 HB3 LEU 18 12.563 25.390 20.819 141 HG LEU 18 HG LEU 18 11.062 25.117 19.007 142 HD11 LEU 18 HD11 LEU 18 12.049 26.583 17.358 143 HD12 LEU 18 HD12 LEU 18 12.577 27.060 18.982 144 HD13 LEU 18 HD13 LEU 18 13.681 26.175 17.914 145 HD21 LEU 18 HD21 LEU 18 11.576 24.174 16.852 146 HD22 LEU 18 HD22 LEU 18 13.238 23.823 17.325 147 HD23 LEU 18 HD23 LEU 18 11.887 22.937 18.074 148 H GLY 19 H GLY 19 14.659 26.351 21.670 149 HA2 GLY 19 HA2 GLY 19 14.993 24.773 24.155 150 HA3 GLY 19 HA3 GLY 19 16.403 25.709 23.661 151 H LYS 20 H LYS 20 15.213 26.025 26.112 152 HA LYS 20 HA LYS 20 14.670 28.884 26.092 153 HB2 LYS 20 HB2 LYS 20 12.608 28.892 27.240 154 HB3 LYS 20 HB3 LYS 20 12.437 28.031 25.720 155 HG2 LYS 20 HG2 LYS 20 12.527 25.864 26.909 156 HG3 LYS 20 HG3 LYS 20 12.754 26.685 28.468 157 HD2 LYS 20 HD2 LYS 20 10.484 27.337 26.597 158 HD3 LYS 20 HD3 LYS 20 10.352 25.993 27.733 159 HE2 LYS 20 HE2 LYS 20 10.762 28.927 28.467 160 HE3 LYS 20 HE3 LYS 20 9.237 28.035 28.554 161 HZ1 LYS 20 HZ1 LYS 20 11.600 27.722 30.288 162 HZ2 LYS 20 HZ2 LYS 20 10.045 27.924 30.721 163 HZ3 LYS 20 HZ3 LYS 20 10.540 26.483 30.146 164 H CYS 21 H CYS 21 14.263 29.642 28.451 165 HA CYS 21 HA CYS 21 16.299 28.377 30.197 166 HB2 CYS 21 HB2 CYS 21 14.757 30.981 30.296 167 HB3 CYS 21 HB3 CYS 21 15.914 30.469 31.524 168 H ILE 22 H ILE 22 15.789 27.373 32.134 169 HA ILE 22 HA ILE 22 13.061 26.486 32.663 170 HB ILE 22 HB ILE 22 15.699 26.274 34.141 171 HG12 ILE 22 HG12 ILE 22 14.091 24.013 32.893 172 HG13 ILE 22 HG13 ILE 22 15.203 24.989 31.940 173 HG21 ILE 22 HG21 ILE 22 13.023 25.024 34.934 174 HG22 ILE 22 HG22 ILE 22 14.598 24.580 35.621 175 HG23 ILE 22 HG23 ILE 22 13.980 26.194 35.877 176 HD11 ILE 22 HD11 ILE 22 17.085 24.420 33.399 177 HD12 ILE 22 HD12 ILE 22 16.019 23.404 34.393 178 HD13 ILE 22 HD13 ILE 22 16.322 22.971 32.710 179 H GLY 23 H GLY 23 15.221 28.804 34.117 180 HA2 GLY 23 HA2 GLY 23 13.132 30.688 34.774 181 HA3 GLY 23 HA3 GLY 23 13.851 29.959 36.221 182 H GLU 24 H GLU 24 16.459 29.604 35.435 183 HA GLU 24 HA GLU 24 17.525 32.233 34.494 184 HB2 GLU 24 HB2 GLU 24 19.237 32.229 36.131 185 HB3 GLU 24 HB3 GLU 24 17.692 32.043 36.959 186 HG2 GLU 24 HG2 GLU 24 18.143 29.571 37.122 187 HG3 GLU 24 HG3 GLU 24 19.727 29.835 36.393 188 H LYS 25 H LYS 25 18.054 28.679 34.572 189 HA LYS 25 HA LYS 25 20.221 29.087 32.568 190 HB2 LYS 25 HB2 LYS 25 21.236 27.092 33.196 191 HB3 LYS 25 HB3 LYS 25 20.968 28.094 34.617 192 HG2 LYS 25 HG2 LYS 25 19.009 26.578 35.192 193 HG3 LYS 25 HG3 LYS 25 19.497 25.542 33.836 194 HD2 LYS 25 HD2 LYS 25 21.806 25.407 34.882 195 HD3 LYS 25 HD3 LYS 25 21.173 26.302 36.279 196 HE2 LYS 25 HE2 LYS 25 19.550 24.469 36.698 197 HE3 LYS 25 HE3 LYS 25 20.200 23.586 35.311 198 HZ1 LYS 25 HZ1 LYS 25 21.686 24.287 37.789 199 HZ2 LYS 25 HZ2 LYS 25 21.263 22.776 37.302 200 HZ3 LYS 25 HZ3 LYS 25 22.394 23.600 36.469 201 H CYS 26 H CYS 26 20.539 27.834 30.822 202 HA CYS 26 HA CYS 26 18.139 27.486 29.242 203 HB2 CYS 26 HB2 CYS 26 20.068 28.613 28.349 204 HB3 CYS 26 HB3 CYS 26 21.120 27.265 28.780 205 H LYS 27 H LYS 27 17.265 25.705 28.305 206 HA LYS 27 HA LYS 27 18.735 23.173 28.116 207 HB2 LYS 27 HB2 LYS 27 17.037 21.805 29.003 208 HB3 LYS 27 HB3 LYS 27 17.602 22.936 30.211 209 HG2 LYS 27 HG2 LYS 27 15.333 22.815 30.588 210 HG3 LYS 27 HG3 LYS 27 15.502 24.339 29.719 211 HD2 LYS 27 HD2 LYS 27 14.575 23.423 27.739 212 HD3 LYS 27 HD3 LYS 27 14.800 21.756 28.270 213 HE2 LYS 27 HE2 LYS 27 13.002 23.721 29.753 214 HE3 LYS 27 HE3 LYS 27 12.397 22.808 28.372 215 HZ1 LYS 27 HZ1 LYS 27 13.618 21.427 30.684 216 HZ2 LYS 27 HZ2 LYS 27 12.010 21.777 30.629 217 HZ3 LYS 27 HZ3 LYS 27 12.698 20.782 29.514 218 H CYS 28 H CYS 28 18.035 21.783 26.424 219 HA CYS 28 HA CYS 28 16.373 23.162 24.382 220 HB2 CYS 28 HB2 CYS 28 17.864 20.578 23.983 221 HB3 CYS 28 HB3 CYS 28 17.143 21.635 22.783 222 H VAL 29 H VAL 29 14.585 22.096 23.424 223 HA VAL 29 HA VAL 29 13.295 20.045 25.165 224 HB VAL 29 HB VAL 29 11.129 20.813 24.304 225 HG11 VAL 29 HG11 VAL 29 12.740 22.882 25.859 226 HG12 VAL 29 HG12 VAL 29 10.971 22.723 25.829 227 HG13 VAL 29 HG13 VAL 29 11.954 21.431 26.531 228 HG21 VAL 29 HG21 VAL 29 10.865 23.062 23.392 229 HG22 VAL 29 HG22 VAL 29 12.621 23.308 23.364 230 HG23 VAL 29 HG23 VAL 29 11.867 22.100 22.303 231 HA PRO 30 HA PRO 30 13.968 17.461 21.780 232 HB2 PRO 30 HB2 PRO 30 12.402 15.282 22.345 233 HB3 PRO 30 HB3 PRO 30 13.837 15.750 23.309 234 HG2 PRO 30 HG2 PRO 30 10.922 16.379 23.881 235 HG3 PRO 30 HG3 PRO 30 12.155 15.731 25.000 236 HD2 PRO 30 HD2 PRO 30 11.507 18.379 24.892 237 HD3 PRO 30 HD3 PRO 30 13.174 17.841 25.229 238 H TYR 31 H TYR 31 13.400 17.234 19.758 239 HA TYR 31 HA TYR 31 10.566 17.004 18.871 240 HB2 TYR 31 HB2 TYR 31 12.725 18.858 17.843 241 HB3 TYR 31 HB3 TYR 31 11.507 18.231 16.756 242 HD1 TYR 31 HD1 TYR 31 11.955 20.284 19.847 243 HD2 TYR 31 HD2 TYR 31 9.270 18.996 16.737 244 HE1 TYR 31 HE1 TYR 31 10.344 22.071 20.494 245 HE2 TYR 31 HE2 TYR 31 7.677 20.794 17.358 246 HH TYR 31 HH TYR 31 8.332 23.059 20.060 Start of MODEL 12 1 H1 ALA 1 H1 ALA 1 18.375 36.848 39.453 2 H2 ALA 1 H2 ALA 1 17.603 35.461 39.016 3 H3 ALA 1 H3 ALA 1 17.032 36.920 38.496 4 HA ALA 1 HA ALA 1 19.027 37.317 37.229 5 HB1 ALA 1 HB1 ALA 1 19.704 34.458 38.057 6 HB2 ALA 1 HB2 ALA 1 20.584 35.420 36.850 7 HB3 ALA 1 HB3 ALA 1 20.573 35.926 38.545 8 H PHE 2 H PHE 2 19.151 36.677 35.016 9 HA PHE 2 HA PHE 2 16.767 35.139 34.053 10 HB2 PHE 2 HB2 PHE 2 18.339 37.370 32.729 11 HB3 PHE 2 HB3 PHE 2 16.991 36.496 32.014 12 HD1 PHE 2 HD1 PHE 2 17.912 39.287 34.083 13 HD2 PHE 2 HD2 PHE 2 14.720 36.530 33.214 14 HE1 PHE 2 HE1 PHE 2 16.290 40.832 35.144 15 HE2 PHE 2 HE2 PHE 2 13.106 38.050 34.287 16 HZ PHE 2 HZ PHE 2 13.883 40.222 35.264 17 H CYS 3 H CYS 3 16.998 33.598 32.483 18 HA CYS 3 HA CYS 3 19.567 32.444 31.783 19 HB2 CYS 3 HB2 CYS 3 18.197 31.007 30.381 20 HB3 CYS 3 HB3 CYS 3 17.417 31.206 31.956 21 H ASN 4 H ASN 4 20.385 32.287 29.544 22 HA ASN 4 HA ASN 4 20.060 34.818 27.998 23 HB2 ASN 4 HB2 ASN 4 22.207 32.661 27.942 24 HB3 ASN 4 HB3 ASN 4 22.148 34.064 26.887 25 HD21 ASN 4 HD21 ASN 4 23.858 36.067 29.172 26 HD22 ASN 4 HD22 ASN 4 23.348 35.785 27.516 27 H LEU 5 H LEU 5 17.807 33.775 27.576 28 HA LEU 5 HA LEU 5 17.449 31.411 26.166 29 HB2 LEU 5 HB2 LEU 5 15.685 32.631 27.341 30 HB3 LEU 5 HB3 LEU 5 15.752 33.924 26.147 31 HG LEU 5 HG LEU 5 14.921 32.375 24.393 32 HD11 LEU 5 HD11 LEU 5 15.735 30.213 25.201 33 HD12 LEU 5 HD12 LEU 5 14.751 30.358 26.679 34 HD13 LEU 5 HD13 LEU 5 13.978 30.171 25.089 35 HD21 LEU 5 HD21 LEU 5 13.234 32.417 26.929 36 HD22 LEU 5 HD22 LEU 5 13.336 33.711 25.713 37 HD23 LEU 5 HD23 LEU 5 12.635 32.147 25.278 38 H ARG 6 H ARG 6 17.853 34.657 24.639 39 HA ARG 6 HA ARG 6 17.399 33.685 21.938 40 HB2 ARG 6 HB2 ARG 6 18.869 36.168 22.915 41 HB3 ARG 6 HB3 ARG 6 18.401 35.864 21.251 42 HG2 ARG 6 HG2 ARG 6 16.501 36.212 23.612 43 HG3 ARG 6 HG3 ARG 6 16.861 37.418 22.386 44 HD2 ARG 6 HD2 ARG 6 15.493 34.740 21.898 45 HD3 ARG 6 HD3 ARG 6 14.681 36.290 21.996 46 HE ARG 6 HE ARG 6 16.160 35.186 19.739 47 HH11 ARG 6 HH11 ARG 6 14.935 38.248 21.061 48 HH12 ARG 6 HH12 ARG 6 15.128 39.044 19.508 49 HH21 ARG 6 HH21 ARG 6 16.311 36.347 17.821 50 HH22 ARG 6 HH22 ARG 6 15.666 37.998 17.791 51 H ARG 7 H ARG 7 20.378 33.956 23.843 52 HA ARG 7 HA ARG 7 22.165 32.993 21.753 53 HB2 ARG 7 HB2 ARG 7 22.880 34.297 23.706 54 HB3 ARG 7 HB3 ARG 7 22.338 33.023 24.799 55 HG2 ARG 7 HG2 ARG 7 24.043 31.480 23.904 56 HG3 ARG 7 HG3 ARG 7 24.606 32.733 22.788 57 HD2 ARG 7 HD2 ARG 7 24.605 32.904 25.841 58 HD3 ARG 7 HD3 ARG 7 26.017 32.566 24.830 59 HE ARG 7 HE ARG 7 25.057 34.957 23.826 60 HH11 ARG 7 HH11 ARG 7 26.326 33.977 27.014 61 HH12 ARG 7 HH12 ARG 7 26.979 35.598 27.229 62 HH21 ARG 7 HH21 ARG 7 25.725 36.995 24.432 63 HH22 ARG 7 HH22 ARG 7 26.709 37.146 25.879 64 H CYS 8 H CYS 8 20.350 31.430 24.356 65 HA CYS 8 HA CYS 8 21.295 28.772 24.078 66 HB2 CYS 8 HB2 CYS 8 20.145 29.661 26.036 67 HB3 CYS 8 HB3 CYS 8 18.701 29.959 25.083 68 H GLU 9 H GLU 9 18.438 30.363 22.488 69 HA GLU 9 HA GLU 9 17.535 28.069 21.078 70 HB2 GLU 9 HB2 GLU 9 17.446 31.029 20.406 71 HB3 GLU 9 HB3 GLU 9 16.868 29.796 19.282 72 HG2 GLU 9 HG2 GLU 9 15.353 28.906 21.089 73 HG3 GLU 9 HG3 GLU 9 15.795 30.300 22.080 74 H LEU 10 H LEU 10 20.311 30.196 20.250 75 HA LEU 10 HA LEU 10 20.762 28.919 17.668 76 HB2 LEU 10 HB2 LEU 10 22.740 30.443 19.403 77 HB3 LEU 10 HB3 LEU 10 22.904 30.087 17.690 78 HG LEU 10 HG LEU 10 20.781 31.897 18.917 79 HD11 LEU 10 HD11 LEU 10 23.054 32.839 19.061 80 HD12 LEU 10 HD12 LEU 10 23.283 32.569 17.317 81 HD13 LEU 10 HD13 LEU 10 22.063 33.723 17.890 82 HD21 LEU 10 HD21 LEU 10 21.478 31.356 15.996 83 HD22 LEU 10 HD22 LEU 10 19.965 30.895 16.820 84 HD23 LEU 10 HD23 LEU 10 20.352 32.601 16.579 85 H SER 11 H SER 11 21.858 28.285 20.957 86 HA SER 11 HA SER 11 23.910 26.347 20.400 87 HB2 SER 11 HB2 SER 11 22.084 26.425 22.836 88 HB3 SER 11 HB3 SER 11 23.695 25.709 22.721 89 HG SER 11 HG SER 11 23.515 27.812 23.745 90 H CYS 12 H CYS 12 20.409 26.061 21.077 91 HA CYS 12 HA CYS 12 20.307 23.186 20.739 92 HB2 CYS 12 HB2 CYS 12 18.105 25.285 20.694 93 HB3 CYS 12 HB3 CYS 12 17.881 23.543 20.896 94 H ARG 13 H ARG 13 19.506 25.973 18.603 95 HA ARG 13 HA ARG 13 18.280 24.465 16.528 96 HB2 ARG 13 HB2 ARG 13 18.071 26.888 16.791 97 HB3 ARG 13 HB3 ARG 13 19.780 27.119 16.378 98 HG2 ARG 13 HG2 ARG 13 19.378 26.273 14.115 99 HG3 ARG 13 HG3 ARG 13 17.708 25.863 14.528 100 HD2 ARG 13 HD2 ARG 13 18.862 28.686 14.573 101 HD3 ARG 13 HD3 ARG 13 18.005 27.986 13.201 102 HE ARG 13 HE ARG 13 16.809 29.041 15.643 103 HH11 ARG 13 HH11 ARG 13 16.151 26.705 13.066 104 HH12 ARG 13 HH12 ARG 13 14.438 26.813 13.409 105 HH21 ARG 13 HH21 ARG 13 14.684 29.272 15.725 106 HH22 ARG 13 HH22 ARG 13 13.655 28.456 14.525 107 H SER 14 H SER 14 21.670 25.246 17.072 108 HA SER 14 HA SER 14 22.761 24.088 14.706 109 HB2 SER 14 HB2 SER 14 24.010 24.310 17.469 110 HB3 SER 14 HB3 SER 14 24.868 24.078 15.936 111 HG SER 14 HG SER 14 23.581 26.348 16.977 112 H LEU 15 H LEU 15 21.494 22.504 17.596 113 HA LEU 15 HA LEU 15 22.541 19.855 16.733 114 HB2 LEU 15 HB2 LEU 15 21.177 20.842 19.249 115 HB3 LEU 15 HB3 LEU 15 21.516 19.141 18.942 116 HG LEU 15 HG LEU 15 23.676 21.290 19.024 117 HD11 LEU 15 HD11 LEU 15 24.174 20.446 21.283 118 HD12 LEU 15 HD12 LEU 15 22.549 21.138 21.201 119 HD13 LEU 15 HD13 LEU 15 22.762 19.371 21.207 120 HD21 LEU 15 HD21 LEU 15 23.797 18.235 19.165 121 HD22 LEU 15 HD22 LEU 15 24.373 19.251 17.821 122 HD23 LEU 15 HD23 LEU 15 25.174 19.332 19.385 123 H GLY 16 H GLY 16 19.832 21.729 16.010 124 HA2 GLY 16 HA2 GLY 16 18.135 21.054 14.547 125 HA3 GLY 16 HA3 GLY 16 18.426 19.364 14.937 126 H LEU 17 H LEU 17 17.873 21.742 17.468 127 HA LEU 17 HA LEU 17 15.019 21.173 17.770 128 HB2 LEU 17 HB2 LEU 17 15.232 20.515 20.105 129 HB3 LEU 17 HB3 LEU 17 15.902 19.312 19.020 130 HG LEU 17 HG LEU 17 17.551 21.282 20.664 131 HD11 LEU 17 HD11 LEU 17 17.909 19.310 22.171 132 HD12 LEU 17 HD12 LEU 17 16.206 19.801 22.117 133 HD13 LEU 17 HD13 LEU 17 16.751 18.392 21.199 134 HD21 LEU 17 HD21 LEU 17 18.294 18.729 19.183 135 HD22 LEU 17 HD22 LEU 17 18.914 20.370 18.893 136 HD23 LEU 17 HD23 LEU 17 19.341 19.530 20.377 137 H LEU 18 H LEU 18 14.264 22.483 19.905 138 HA LEU 18 HA LEU 18 15.614 25.157 19.781 139 HB2 LEU 18 HB2 LEU 18 12.661 24.657 20.193 140 HB3 LEU 18 HB3 LEU 18 13.453 26.223 20.152 141 HG LEU 18 HG LEU 18 13.346 24.289 17.821 142 HD11 LEU 18 HD11 LEU 18 11.138 25.207 18.392 143 HD12 LEU 18 HD12 LEU 18 11.796 26.859 18.316 144 HD13 LEU 18 HD13 LEU 18 11.723 25.849 16.852 145 HD21 LEU 18 HD21 LEU 18 14.287 27.190 17.938 146 HD22 LEU 18 HD22 LEU 18 15.316 25.763 17.656 147 HD23 LEU 18 HD23 LEU 18 14.099 26.208 16.467 148 H GLY 19 H GLY 19 14.734 26.506 21.721 149 HA2 GLY 19 HA2 GLY 19 15.580 25.026 24.178 150 HA3 GLY 19 HA3 GLY 19 16.370 26.515 23.693 151 H LYS 20 H LYS 20 14.873 25.642 26.114 152 HA LYS 20 HA LYS 20 13.085 27.995 26.423 153 HB2 LYS 20 HB2 LYS 20 12.531 25.135 27.304 154 HB3 LYS 20 HB3 LYS 20 11.614 26.547 27.837 155 HG2 LYS 20 HG2 LYS 20 11.116 27.051 25.386 156 HG3 LYS 20 HG3 LYS 20 11.825 25.472 24.991 157 HD2 LYS 20 HD2 LYS 20 10.246 24.391 26.557 158 HD3 LYS 20 HD3 LYS 20 9.480 25.950 26.883 159 HE2 LYS 20 HE2 LYS 20 9.624 24.576 24.159 160 HE3 LYS 20 HE3 LYS 20 8.232 24.525 25.244 161 HZ1 LYS 20 HZ1 LYS 20 7.970 26.217 23.536 162 HZ2 LYS 20 HZ2 LYS 20 8.028 26.931 25.011 163 HZ3 LYS 20 HZ3 LYS 20 9.321 26.990 24.005 164 H CYS 21 H CYS 21 12.835 28.769 28.468 165 HA CYS 21 HA CYS 21 15.389 28.891 29.910 166 HB2 CYS 21 HB2 CYS 21 14.109 30.838 29.026 167 HB3 CYS 21 HB3 CYS 21 12.805 30.455 30.142 168 H ILE 22 H ILE 22 15.734 28.462 32.069 169 HA ILE 22 HA ILE 22 13.487 27.661 33.838 170 HB ILE 22 HB ILE 22 16.061 26.060 33.686 171 HG12 ILE 22 HG12 ILE 22 13.330 25.327 32.547 172 HG13 ILE 22 HG13 ILE 22 14.800 25.641 31.615 173 HG21 ILE 22 HG21 ILE 22 14.788 26.190 35.900 174 HG22 ILE 22 HG22 ILE 22 13.417 25.436 35.081 175 HG23 ILE 22 HG23 ILE 22 14.957 24.565 35.251 176 HD11 ILE 22 HD11 ILE 22 15.891 23.674 32.713 177 HD12 ILE 22 HD12 ILE 22 14.315 23.278 33.451 178 HD13 ILE 22 HD13 ILE 22 14.491 23.285 31.691 179 H GLY 23 H GLY 23 13.739 29.820 34.546 180 HA2 GLY 23 HA2 GLY 23 14.330 31.470 35.961 181 HA3 GLY 23 HA3 GLY 23 15.340 30.306 36.819 182 H GLU 24 H GLU 24 17.378 30.104 36.330 183 HA GLU 24 HA GLU 24 18.775 32.446 35.124 184 HB2 GLU 24 HB2 GLU 24 20.334 32.348 36.809 185 HB3 GLU 24 HB3 GLU 24 18.827 32.031 37.633 186 HG2 GLU 24 HG2 GLU 24 21.001 30.012 36.905 187 HG3 GLU 24 HG3 GLU 24 20.662 30.670 38.491 188 H LYS 25 H LYS 25 18.145 29.453 34.162 189 HA LYS 25 HA LYS 25 20.543 29.252 32.438 190 HB2 LYS 25 HB2 LYS 25 20.652 26.788 32.832 191 HB3 LYS 25 HB3 LYS 25 21.138 27.761 34.213 192 HG2 LYS 25 HG2 LYS 25 19.081 27.299 35.397 193 HG3 LYS 25 HG3 LYS 25 18.355 26.574 33.961 194 HD2 LYS 25 HD2 LYS 25 19.020 24.823 35.528 195 HD3 LYS 25 HD3 LYS 25 19.922 24.723 34.022 196 HE2 LYS 25 HE2 LYS 25 21.510 24.277 35.695 197 HE3 LYS 25 HE3 LYS 25 21.846 25.925 35.174 198 HZ1 LYS 25 HZ1 LYS 25 20.487 25.078 37.684 199 HZ2 LYS 25 HZ2 LYS 25 21.913 25.860 37.516 200 HZ3 LYS 25 HZ3 LYS 25 20.512 26.648 37.197 201 H CYS 26 H CYS 26 20.166 27.744 30.577 202 HA CYS 26 HA CYS 26 17.293 27.325 29.922 203 HB2 CYS 26 HB2 CYS 26 17.718 29.448 28.981 204 HB3 CYS 26 HB3 CYS 26 19.240 28.943 28.273 205 H LYS 27 H LYS 27 16.808 25.687 28.621 206 HA LYS 27 HA LYS 27 18.931 23.686 27.958 207 HB2 LYS 27 HB2 LYS 27 16.896 23.528 30.048 208 HB3 LYS 27 HB3 LYS 27 16.476 22.386 28.786 209 HG2 LYS 27 HG2 LYS 27 17.838 21.180 30.283 210 HG3 LYS 27 HG3 LYS 27 18.861 21.518 28.883 211 HD2 LYS 27 HD2 LYS 27 19.702 23.572 30.220 212 HD3 LYS 27 HD3 LYS 27 18.884 22.860 31.627 213 HE2 LYS 27 HE2 LYS 27 20.203 20.773 31.287 214 HE3 LYS 27 HE3 LYS 27 20.973 21.512 29.875 215 HZ1 LYS 27 HZ1 LYS 27 21.817 23.260 31.412 216 HZ2 LYS 27 HZ2 LYS 27 21.248 22.362 32.692 217 HZ3 LYS 27 HZ3 LYS 27 22.425 21.752 31.707 218 H CYS 28 H CYS 28 18.353 22.116 26.306 219 HA CYS 28 HA CYS 28 16.440 23.231 24.378 220 HB2 CYS 28 HB2 CYS 28 18.089 20.764 23.968 221 HB3 CYS 28 HB3 CYS 28 17.285 21.779 22.779 222 H VAL 29 H VAL 29 14.744 22.035 23.425 223 HA VAL 29 HA VAL 29 13.630 19.825 25.093 224 HB VAL 29 HB VAL 29 11.372 20.650 24.599 225 HG11 VAL 29 HG11 VAL 29 12.556 21.125 26.734 226 HG12 VAL 29 HG12 VAL 29 13.076 22.693 26.083 227 HG13 VAL 29 HG13 VAL 29 11.350 22.344 26.318 228 HG21 VAL 29 HG21 VAL 29 11.802 22.081 22.638 229 HG22 VAL 29 HG22 VAL 29 10.998 22.978 23.920 230 HG23 VAL 29 HG23 VAL 29 12.733 23.218 23.633 231 HA PRO 30 HA PRO 30 13.976 17.621 21.426 232 HB2 PRO 30 HB2 PRO 30 12.435 15.405 21.832 233 HB3 PRO 30 HB3 PRO 30 13.906 15.762 22.788 234 HG2 PRO 30 HG2 PRO 30 11.022 16.376 23.520 235 HG3 PRO 30 HG3 PRO 30 12.263 15.553 24.524 236 HD2 PRO 30 HD2 PRO 30 11.742 18.213 24.782 237 HD3 PRO 30 HD3 PRO 30 13.408 17.585 24.919 238 H TYR 31 H TYR 31 13.172 17.137 19.457 239 HA TYR 31 HA TYR 31 10.347 17.462 18.737 240 HB2 TYR 31 HB2 TYR 31 12.636 19.083 17.582 241 HB3 TYR 31 HB3 TYR 31 11.125 18.815 16.743 242 HD1 TYR 31 HD1 TYR 31 12.791 20.792 19.283 243 HD2 TYR 31 HD2 TYR 31 8.925 19.533 17.871 244 HE1 TYR 31 HE1 TYR 31 11.726 22.697 20.482 245 HE2 TYR 31 HE2 TYR 31 7.866 21.401 19.118 246 HH TYR 31 HH TYR 31 8.193 23.323 20.282 Start of MODEL 13 1 H1 ALA 1 H1 ALA 1 22.264 36.836 38.513 2 H2 ALA 1 H2 ALA 1 21.873 35.305 37.978 3 H3 ALA 1 H3 ALA 1 20.704 36.408 38.119 4 HA ALA 1 HA ALA 1 21.681 37.781 36.428 5 HB1 ALA 1 HB1 ALA 1 23.641 35.473 36.139 6 HB2 ALA 1 HB2 ALA 1 23.502 36.855 35.052 7 HB3 ALA 1 HB3 ALA 1 24.022 37.103 36.723 8 H PHE 2 H PHE 2 20.738 37.643 34.373 9 HA PHE 2 HA PHE 2 18.800 35.484 34.150 10 HB2 PHE 2 HB2 PHE 2 19.380 37.917 32.435 11 HB3 PHE 2 HB3 PHE 2 18.141 36.707 32.024 12 HD1 PHE 2 HD1 PHE 2 16.245 36.239 33.611 13 HD2 PHE 2 HD2 PHE 2 18.892 39.604 34.100 14 HE1 PHE 2 HE1 PHE 2 14.639 37.293 35.168 15 HE2 PHE 2 HE2 PHE 2 17.280 40.627 35.668 16 HZ PHE 2 HZ PHE 2 15.156 39.473 36.240 17 H CYS 3 H CYS 3 18.625 33.854 32.757 18 HA CYS 3 HA CYS 3 20.859 32.986 31.072 19 HB2 CYS 3 HB2 CYS 3 19.553 31.363 32.168 20 HB3 CYS 3 HB3 CYS 3 18.039 32.059 31.620 21 H ASN 4 H ASN 4 21.238 33.643 29.005 22 HA ASN 4 HA ASN 4 19.375 35.416 27.628 23 HB2 ASN 4 HB2 ASN 4 21.801 35.847 27.660 24 HB3 ASN 4 HB3 ASN 4 22.080 34.357 26.755 25 HD21 ASN 4 HD21 ASN 4 21.265 37.617 24.678 26 HD22 ASN 4 HD22 ASN 4 22.024 37.581 26.277 27 H LEU 5 H LEU 5 17.673 34.346 27.153 28 HA LEU 5 HA LEU 5 17.317 31.762 26.098 29 HB2 LEU 5 HB2 LEU 5 15.542 33.105 27.112 30 HB3 LEU 5 HB3 LEU 5 15.636 34.277 25.794 31 HG LEU 5 HG LEU 5 14.792 32.616 24.193 32 HD11 LEU 5 HD11 LEU 5 14.679 30.743 26.587 33 HD12 LEU 5 HD12 LEU 5 13.911 30.430 25.016 34 HD13 LEU 5 HD13 LEU 5 15.668 30.516 25.126 35 HD21 LEU 5 HD21 LEU 5 13.202 33.989 25.551 36 HD22 LEU 5 HD22 LEU 5 12.516 32.423 25.088 37 HD23 LEU 5 HD23 LEU 5 13.114 32.677 26.735 38 H ARG 6 H ARG 6 17.945 34.817 24.291 39 HA ARG 6 HA ARG 6 17.508 33.646 21.665 40 HB2 ARG 6 HB2 ARG 6 18.906 36.123 22.708 41 HB3 ARG 6 HB3 ARG 6 19.145 35.632 21.038 42 HG2 ARG 6 HG2 ARG 6 17.426 37.329 21.261 43 HG3 ARG 6 HG3 ARG 6 16.823 35.875 20.502 44 HD2 ARG 6 HD2 ARG 6 16.382 36.345 23.464 45 HD3 ARG 6 HD3 ARG 6 15.403 37.182 22.262 46 HE ARG 6 HE ARG 6 15.421 34.323 21.754 47 HH11 ARG 6 HH11 ARG 6 13.844 36.668 23.871 48 HH12 ARG 6 HH12 ARG 6 12.320 35.815 23.734 49 HH21 ARG 6 HH21 ARG 6 13.524 33.361 21.681 50 HH22 ARG 6 HH22 ARG 6 12.120 34.047 22.534 51 H ARG 7 H ARG 7 20.466 33.990 23.599 52 HA ARG 7 HA ARG 7 22.215 32.582 21.751 53 HB2 ARG 7 HB2 ARG 7 22.459 33.262 24.706 54 HB3 ARG 7 HB3 ARG 7 23.744 32.493 23.776 55 HG2 ARG 7 HG2 ARG 7 23.843 34.408 22.250 56 HG3 ARG 7 HG3 ARG 7 22.511 35.199 23.089 57 HD2 ARG 7 HD2 ARG 7 23.934 35.302 25.158 58 HD3 ARG 7 HD3 ARG 7 25.285 34.623 24.231 59 HE ARG 7 HE ARG 7 24.218 36.855 22.819 60 HH11 ARG 7 HH11 ARG 7 26.118 36.455 25.808 61 HH12 ARG 7 HH12 ARG 7 26.702 38.098 25.676 62 HH21 ARG 7 HH21 ARG 7 25.266 38.735 22.644 63 HH22 ARG 7 HH22 ARG 7 26.325 39.309 23.910 64 H CYS 8 H CYS 8 20.100 31.482 24.357 65 HA CYS 8 HA CYS 8 21.037 28.741 24.382 66 HB2 CYS 8 HB2 CYS 8 19.821 29.815 26.246 67 HB3 CYS 8 HB3 CYS 8 18.401 29.981 25.226 68 H GLU 9 H GLU 9 18.246 30.359 22.775 69 HA GLU 9 HA GLU 9 17.183 28.187 21.357 70 HB2 GLU 9 HB2 GLU 9 17.339 31.152 20.717 71 HB3 GLU 9 HB3 GLU 9 16.521 30.013 19.650 72 HG2 GLU 9 HG2 GLU 9 14.966 29.356 21.390 73 HG3 GLU 9 HG3 GLU 9 15.768 30.367 22.575 74 H LEU 10 H LEU 10 19.835 30.400 20.229 75 HA LEU 10 HA LEU 10 20.105 28.915 17.759 76 HB2 LEU 10 HB2 LEU 10 21.835 30.373 17.166 77 HB3 LEU 10 HB3 LEU 10 20.606 31.295 17.983 78 HG LEU 10 HG LEU 10 22.182 30.954 20.105 79 HD11 LEU 10 HD11 LEU 10 24.572 31.046 19.489 80 HD12 LEU 10 HD12 LEU 10 23.886 29.521 18.950 81 HD13 LEU 10 HD13 LEU 10 24.161 30.820 17.777 82 HD21 LEU 10 HD21 LEU 10 23.316 33.085 19.528 83 HD22 LEU 10 HD22 LEU 10 22.777 32.908 17.845 84 HD23 LEU 10 HD23 LEU 10 21.592 33.126 19.149 85 H SER 11 H SER 11 21.699 28.569 20.920 86 HA SER 11 HA SER 11 23.733 26.720 20.045 87 HB2 SER 11 HB2 SER 11 23.823 27.916 22.181 88 HB3 SER 11 HB3 SER 11 22.419 27.016 22.773 89 HG SER 11 HG SER 11 24.635 26.252 23.310 90 H CYS 12 H CYS 12 20.363 26.214 21.217 91 HA CYS 12 HA CYS 12 20.424 23.335 20.807 92 HB2 CYS 12 HB2 CYS 12 18.117 25.296 20.990 93 HB3 CYS 12 HB3 CYS 12 17.968 23.551 21.068 94 H ARG 13 H ARG 13 19.448 26.104 18.735 95 HA ARG 13 HA ARG 13 18.382 24.578 16.570 96 HB2 ARG 13 HB2 ARG 13 18.209 27.114 16.934 97 HB3 ARG 13 HB3 ARG 13 19.852 27.231 16.284 98 HG2 ARG 13 HG2 ARG 13 19.092 26.175 14.185 99 HG3 ARG 13 HG3 ARG 13 17.455 25.997 14.842 100 HD2 ARG 13 HD2 ARG 13 18.882 28.661 14.502 101 HD3 ARG 13 HD3 ARG 13 17.852 27.935 13.262 102 HE ARG 13 HE ARG 13 16.338 28.066 15.678 103 HH11 ARG 13 HH11 ARG 13 17.652 30.235 13.241 104 HH12 ARG 13 HH12 ARG 13 16.436 31.450 13.559 105 HH21 ARG 13 HH21 ARG 13 14.758 29.593 15.916 106 HH22 ARG 13 HH22 ARG 13 14.665 30.923 14.765 107 H SER 14 H SER 14 21.713 25.418 17.364 108 HA SER 14 HA SER 14 23.006 24.566 14.996 109 HB2 SER 14 HB2 SER 14 24.037 24.433 17.852 110 HB3 SER 14 HB3 SER 14 25.015 24.358 16.378 111 HG SER 14 HG SER 14 23.381 26.545 17.243 112 H LEU 15 H LEU 15 21.338 22.553 17.251 113 HA LEU 15 HA LEU 15 22.446 20.113 15.932 114 HB2 LEU 15 HB2 LEU 15 21.265 20.494 18.701 115 HB3 LEU 15 HB3 LEU 15 21.694 18.922 18.011 116 HG LEU 15 HG LEU 15 23.667 21.187 18.563 117 HD11 LEU 15 HD11 LEU 15 24.414 19.806 20.441 118 HD12 LEU 15 HD12 LEU 15 22.708 20.244 20.631 119 HD13 LEU 15 HD13 LEU 15 23.156 18.606 20.088 120 HD21 LEU 15 HD21 LEU 15 24.106 18.278 17.755 121 HD22 LEU 15 HD22 LEU 15 24.480 19.711 16.770 122 HD23 LEU 15 HD23 LEU 15 25.373 19.410 18.263 123 H GLY 16 H GLY 16 19.808 22.104 15.820 124 HA2 GLY 16 HA2 GLY 16 18.017 21.761 14.367 125 HA3 GLY 16 HA3 GLY 16 18.111 20.023 14.592 126 H LEU 17 H LEU 17 17.960 21.975 17.540 127 HA LEU 17 HA LEU 17 15.047 21.401 17.785 128 HB2 LEU 17 HB2 LEU 17 15.398 20.711 20.133 129 HB3 LEU 17 HB3 LEU 17 15.909 19.563 18.910 130 HG LEU 17 HG LEU 17 17.820 21.322 20.498 131 HD11 LEU 17 HD11 LEU 17 18.162 19.309 21.891 132 HD12 LEU 17 HD12 LEU 17 16.464 19.810 21.951 133 HD13 LEU 17 HD13 LEU 17 16.940 18.433 20.948 134 HD21 LEU 17 HD21 LEU 17 19.443 19.473 19.936 135 HD22 LEU 17 HD22 LEU 17 18.237 18.803 18.820 136 HD23 LEU 17 HD23 LEU 17 18.939 20.407 18.529 137 H LEU 18 H LEU 18 13.935 22.431 19.536 138 HA LEU 18 HA LEU 18 14.635 25.279 19.778 139 HB2 LEU 18 HB2 LEU 18 12.276 23.780 20.938 140 HB3 LEU 18 HB3 LEU 18 12.492 25.522 20.919 141 HG LEU 18 HG LEU 18 12.179 23.767 18.490 142 HD11 LEU 18 HD11 LEU 18 10.228 25.686 19.844 143 HD12 LEU 18 HD12 LEU 18 9.921 24.767 18.360 144 HD13 LEU 18 HD13 LEU 18 10.130 23.910 19.884 145 HD21 LEU 18 HD21 LEU 18 11.797 25.838 17.229 146 HD22 LEU 18 HD22 LEU 18 12.162 26.792 18.679 147 HD23 LEU 18 HD23 LEU 18 13.426 25.797 17.910 148 H GLY 19 H GLY 19 14.268 26.237 21.949 149 HA2 GLY 19 HA2 GLY 19 15.146 24.700 24.270 150 HA3 GLY 19 HA3 GLY 19 16.388 25.814 23.682 151 H LYS 20 H LYS 20 15.241 25.814 26.213 152 HA LYS 20 HA LYS 20 13.991 28.506 26.421 153 HB2 LYS 20 HB2 LYS 20 12.975 25.882 27.575 154 HB3 LYS 20 HB3 LYS 20 12.532 27.457 28.239 155 HG2 LYS 20 HG2 LYS 20 11.660 28.138 25.982 156 HG3 LYS 20 HG3 LYS 20 11.974 26.485 25.403 157 HD2 LYS 20 HD2 LYS 20 10.516 25.563 27.122 158 HD3 LYS 20 HD3 LYS 20 10.226 27.192 27.790 159 HE2 LYS 20 HE2 LYS 20 9.224 27.898 25.629 160 HE3 LYS 20 HE3 LYS 20 9.505 26.273 24.965 161 HZ1 LYS 20 HZ1 LYS 20 7.246 26.430 25.766 162 HZ2 LYS 20 HZ2 LYS 20 8.077 25.392 26.711 163 HZ3 LYS 20 HZ3 LYS 20 7.747 26.907 27.270 164 H CYS 21 H CYS 21 14.228 29.477 28.432 165 HA CYS 21 HA CYS 21 16.615 28.626 30.016 166 HB2 CYS 21 HB2 CYS 21 15.130 31.226 29.651 167 HB3 CYS 21 HB3 CYS 21 16.274 30.962 30.949 168 H ILE 22 H ILE 22 15.112 26.828 30.740 169 HA ILE 22 HA ILE 22 12.734 27.388 32.270 170 HB ILE 22 HB ILE 22 14.417 24.874 32.017 171 HG12 ILE 22 HG12 ILE 22 11.774 25.689 30.727 172 HG13 ILE 22 HG13 ILE 22 13.350 25.686 29.935 173 HG21 ILE 22 HG21 ILE 22 13.181 24.796 34.146 174 HG22 ILE 22 HG22 ILE 22 11.666 25.207 33.292 175 HG23 ILE 22 HG23 ILE 22 12.499 23.660 32.997 176 HD11 ILE 22 HD11 ILE 22 12.211 23.723 29.227 177 HD12 ILE 22 HD12 ILE 22 13.512 23.210 30.320 178 HD13 ILE 22 HD13 ILE 22 11.821 23.244 30.885 179 H GLY 23 H GLY 23 12.427 27.782 34.374 180 HA2 GLY 23 HA2 GLY 23 12.836 28.403 36.533 181 HA3 GLY 23 HA3 GLY 23 14.267 27.375 36.533 182 H GLU 24 H GLU 24 16.160 28.199 35.659 183 HA GLU 24 HA GLU 24 16.545 31.100 35.115 184 HB2 GLU 24 HB2 GLU 24 17.980 29.533 37.297 185 HB3 GLU 24 HB3 GLU 24 18.450 31.143 36.782 186 HG2 GLU 24 HG2 GLU 24 15.779 30.495 38.065 187 HG3 GLU 24 HG3 GLU 24 17.201 31.058 38.881 188 H LYS 25 H LYS 25 17.225 28.060 33.949 189 HA LYS 25 HA LYS 25 19.951 28.819 32.935 190 HB2 LYS 25 HB2 LYS 25 19.206 26.139 34.179 191 HB3 LYS 25 HB3 LYS 25 20.758 26.554 33.444 192 HG2 LYS 25 HG2 LYS 25 21.153 28.267 35.181 193 HG3 LYS 25 HG3 LYS 25 19.592 27.889 35.928 194 HD2 LYS 25 HD2 LYS 25 20.350 25.576 36.386 195 HD3 LYS 25 HD3 LYS 25 21.945 25.968 35.704 196 HE2 LYS 25 HE2 LYS 25 22.251 27.750 37.395 197 HE3 LYS 25 HE3 LYS 25 20.625 27.454 38.017 198 HZ1 LYS 25 HZ1 LYS 25 22.912 25.553 38.211 199 HZ2 LYS 25 HZ2 LYS 25 22.204 26.371 39.428 200 HZ3 LYS 25 HZ3 LYS 25 21.386 25.191 38.656 201 H CYS 26 H CYS 26 20.631 27.849 30.940 202 HA CYS 26 HA CYS 26 18.479 27.466 29.086 203 HB2 CYS 26 HB2 CYS 26 20.558 28.512 28.420 204 HB3 CYS 26 HB3 CYS 26 21.460 27.055 28.808 205 H LYS 27 H LYS 27 17.468 25.758 28.316 206 HA LYS 27 HA LYS 27 18.628 23.026 28.407 207 HB2 LYS 27 HB2 LYS 27 16.903 23.673 30.347 208 HB3 LYS 27 HB3 LYS 27 15.705 23.610 29.061 209 HG2 LYS 27 HG2 LYS 27 15.667 21.428 29.951 210 HG3 LYS 27 HG3 LYS 27 16.695 21.253 28.526 211 HD2 LYS 27 HD2 LYS 27 18.586 21.933 30.406 212 HD3 LYS 27 HD3 LYS 27 17.371 21.163 31.450 213 HE2 LYS 27 HE2 LYS 27 17.414 19.208 29.778 214 HE3 LYS 27 HE3 LYS 27 18.779 20.009 29.016 215 HZ1 LYS 27 HZ1 LYS 27 19.906 19.915 31.253 216 HZ2 LYS 27 HZ2 LYS 27 18.635 18.909 31.759 217 HZ3 LYS 27 HZ3 LYS 27 19.647 18.476 30.563 218 H CYS 28 H CYS 28 18.359 21.958 26.449 219 HA CYS 28 HA CYS 28 16.591 23.203 24.415 220 HB2 CYS 28 HB2 CYS 28 18.120 20.634 24.086 221 HB3 CYS 28 HB3 CYS 28 17.392 21.657 22.871 222 H VAL 29 H VAL 29 14.682 22.154 23.601 223 HA VAL 29 HA VAL 29 13.332 20.659 25.777 224 HB VAL 29 HB VAL 29 11.254 21.139 24.719 225 HG11 VAL 29 HG11 VAL 29 12.965 23.647 24.515 226 HG12 VAL 29 HG12 VAL 29 11.216 23.544 24.787 227 HG13 VAL 29 HG13 VAL 29 12.330 22.960 26.027 228 HG21 VAL 29 HG21 VAL 29 11.750 20.805 22.385 229 HG22 VAL 29 HG22 VAL 29 11.110 22.433 22.600 230 HG23 VAL 29 HG23 VAL 29 12.865 22.186 22.374 231 HA PRO 30 HA PRO 30 13.467 16.659 24.081 232 HB2 PRO 30 HB2 PRO 30 10.451 16.438 24.246 233 HB3 PRO 30 HB3 PRO 30 11.709 15.293 24.801 234 HG2 PRO 30 HG2 PRO 30 10.524 16.935 26.581 235 HG3 PRO 30 HG3 PRO 30 12.299 16.711 26.643 236 HD2 PRO 30 HD2 PRO 30 10.725 18.979 25.392 237 HD3 PRO 30 HD3 PRO 30 12.166 19.048 26.437 238 H TYR 31 H TYR 31 13.932 16.056 22.149 239 HA TYR 31 HA TYR 31 11.964 15.796 19.961 240 HB2 TYR 31 HB2 TYR 31 14.720 17.086 19.790 241 HB3 TYR 31 HB3 TYR 31 13.987 16.287 18.418 242 HD1 TYR 31 HD1 TYR 31 12.218 17.316 17.122 243 HD2 TYR 31 HD2 TYR 31 13.626 19.134 20.759 244 HE1 TYR 31 HE1 TYR 31 10.962 19.404 16.562 245 HE2 TYR 31 HE2 TYR 31 12.356 21.210 20.204 246 HH TYR 31 HH TYR 31 10.721 21.743 17.171 Start of MODEL 14 1 H1 ALA 1 H1 ALA 1 23.735 31.002 36.910 2 H2 ALA 1 H2 ALA 1 24.874 32.138 36.566 3 H3 ALA 1 H3 ALA 1 25.281 30.550 36.556 4 HA ALA 1 HA ALA 1 25.113 31.384 34.330 5 HB1 ALA 1 HB1 ALA 1 24.553 29.008 34.752 6 HB2 ALA 1 HB2 ALA 1 22.854 29.454 35.033 7 HB3 ALA 1 HB3 ALA 1 23.590 29.681 33.429 8 H PHE 2 H PHE 2 23.846 32.387 32.643 9 HA PHE 2 HA PHE 2 21.819 34.275 33.750 10 HB2 PHE 2 HB2 PHE 2 23.426 34.423 31.191 11 HB3 PHE 2 HB3 PHE 2 22.308 35.637 31.802 12 HD1 PHE 2 HD1 PHE 2 25.703 34.863 31.583 13 HD2 PHE 2 HD2 PHE 2 22.778 36.350 34.382 14 HE1 PHE 2 HE1 PHE 2 27.503 35.950 32.897 15 HE2 PHE 2 HE2 PHE 2 24.576 37.387 35.715 16 HZ PHE 2 HZ PHE 2 26.957 37.199 34.982 17 H CYS 3 H CYS 3 19.760 34.183 33.215 18 HA CYS 3 HA CYS 3 18.732 32.103 31.423 19 HB2 CYS 3 HB2 CYS 3 17.909 32.646 33.733 20 HB3 CYS 3 HB3 CYS 3 17.424 34.228 33.173 21 H ASN 4 H ASN 4 18.982 32.695 29.228 22 HA ASN 4 HA ASN 4 17.649 35.179 28.238 23 HB2 ASN 4 HB2 ASN 4 20.490 34.359 27.549 24 HB3 ASN 4 HB3 ASN 4 19.596 35.711 26.855 25 HD21 ASN 4 HD21 ASN 4 19.974 37.696 29.886 26 HD22 ASN 4 HD22 ASN 4 18.717 37.319 28.713 27 H LEU 5 H LEU 5 16.072 34.327 27.090 28 HA LEU 5 HA LEU 5 15.758 31.893 25.889 29 HB2 LEU 5 HB2 LEU 5 13.972 33.502 26.144 30 HB3 LEU 5 HB3 LEU 5 14.764 34.648 25.072 31 HG LEU 5 HG LEU 5 14.361 33.168 23.130 32 HD11 LEU 5 HD11 LEU 5 14.330 30.975 24.215 33 HD12 LEU 5 HD12 LEU 5 12.884 31.434 25.152 34 HD13 LEU 5 HD13 LEU 5 12.797 31.255 23.385 35 HD21 LEU 5 HD21 LEU 5 11.867 33.736 24.782 36 HD22 LEU 5 HD22 LEU 5 12.709 34.891 23.721 37 HD23 LEU 5 HD23 LEU 5 11.926 33.464 23.025 38 H ARG 6 H ARG 6 16.905 34.771 24.093 39 HA ARG 6 HA ARG 6 17.359 33.415 21.648 40 HB2 ARG 6 HB2 ARG 6 18.456 35.450 20.923 41 HB3 ARG 6 HB3 ARG 6 17.061 35.874 21.903 42 HG2 ARG 6 HG2 ARG 6 18.586 36.371 23.830 43 HG3 ARG 6 HG3 ARG 6 19.967 35.860 22.856 44 HD2 ARG 6 HD2 ARG 6 19.999 38.185 22.726 45 HD3 ARG 6 HD3 ARG 6 19.365 37.636 21.170 46 HE ARG 6 HE ARG 6 17.195 38.224 22.986 47 HH11 ARG 6 HH11 ARG 6 19.570 39.808 20.888 48 HH12 ARG 6 HH12 ARG 6 18.626 41.276 20.842 49 HH21 ARG 6 HH21 ARG 6 16.217 40.289 23.029 50 HH22 ARG 6 HH22 ARG 6 16.913 41.571 22.052 51 H ARG 7 H ARG 7 19.462 33.479 24.444 52 HA ARG 7 HA ARG 7 21.824 32.570 22.866 53 HB2 ARG 7 HB2 ARG 7 21.405 33.079 25.841 54 HB3 ARG 7 HB3 ARG 7 22.840 32.321 25.176 55 HG2 ARG 7 HG2 ARG 7 22.873 34.411 23.543 56 HG3 ARG 7 HG3 ARG 7 21.895 35.168 24.801 57 HD2 ARG 7 HD2 ARG 7 24.619 33.848 25.239 58 HD3 ARG 7 HD3 ARG 7 24.376 35.568 24.901 59 HE ARG 7 HE ARG 7 22.986 34.421 27.284 60 HH11 ARG 7 HH11 ARG 7 25.973 35.942 26.308 61 HH12 ARG 7 HH12 ARG 7 26.049 36.936 27.736 62 HH21 ARG 7 HH21 ARG 7 23.093 35.744 29.050 63 HH22 ARG 7 HH22 ARG 7 24.545 36.712 29.315 64 H CYS 8 H CYS 8 19.154 31.126 24.543 65 HA CYS 8 HA CYS 8 20.450 28.501 24.662 66 HB2 CYS 8 HB2 CYS 8 18.809 29.251 26.336 67 HB3 CYS 8 HB3 CYS 8 17.553 29.286 25.093 68 H GLU 9 H GLU 9 17.826 29.943 22.585 69 HA GLU 9 HA GLU 9 17.451 27.585 21.081 70 HB2 GLU 9 HB2 GLU 9 16.161 28.846 19.576 71 HB3 GLU 9 HB3 GLU 9 15.949 29.511 21.192 72 HG2 GLU 9 HG2 GLU 9 16.031 31.402 20.140 73 HG3 GLU 9 HG3 GLU 9 17.761 31.252 20.432 74 H LEU 10 H LEU 10 19.778 30.169 20.468 75 HA LEU 10 HA LEU 10 20.796 29.089 18.009 76 HB2 LEU 10 HB2 LEU 10 22.580 30.660 18.183 77 HB3 LEU 10 HB3 LEU 10 21.080 31.419 18.670 78 HG LEU 10 HG LEU 10 21.871 31.091 21.096 79 HD11 LEU 10 HD11 LEU 10 23.777 29.535 20.831 80 HD12 LEU 10 HD12 LEU 10 24.535 30.640 19.670 81 HD13 LEU 10 HD13 LEU 10 24.369 31.086 21.378 82 HD21 LEU 10 HD21 LEU 10 23.299 33.111 20.974 83 HD22 LEU 10 HD22 LEU 10 23.515 32.852 19.231 84 HD23 LEU 10 HD23 LEU 10 21.921 33.261 19.879 85 H SER 11 H SER 11 21.236 28.017 21.223 86 HA SER 11 HA SER 11 23.747 26.538 20.707 87 HB2 SER 11 HB2 SER 11 21.931 26.636 23.152 88 HB3 SER 11 HB3 SER 11 23.516 25.852 23.048 89 HG SER 11 HG SER 11 22.844 28.563 23.189 90 H CYS 12 H CYS 12 20.261 25.915 21.186 91 HA CYS 12 HA CYS 12 20.453 23.044 20.802 92 HB2 CYS 12 HB2 CYS 12 18.112 24.964 20.619 93 HB3 CYS 12 HB3 CYS 12 17.993 23.211 20.697 94 H ARG 13 H ARG 13 20.154 25.794 18.567 95 HA ARG 13 HA ARG 13 19.328 24.367 16.230 96 HB2 ARG 13 HB2 ARG 13 19.440 26.888 16.656 97 HB3 ARG 13 HB3 ARG 13 21.156 26.806 16.266 98 HG2 ARG 13 HG2 ARG 13 20.641 25.959 14.009 99 HG3 ARG 13 HG3 ARG 13 18.927 25.814 14.418 100 HD2 ARG 13 HD2 ARG 13 20.532 28.391 14.208 101 HD3 ARG 13 HD3 ARG 13 19.358 27.798 13.030 102 HE ARG 13 HE ARG 13 18.832 29.199 15.514 103 HH11 ARG 13 HH11 ARG 13 17.277 27.111 13.117 104 HH12 ARG 13 HH12 ARG 13 15.693 27.638 13.622 105 HH21 ARG 13 HH21 ARG 13 16.802 29.532 16.251 106 HH22 ARG 13 HH22 ARG 13 15.436 29.076 15.225 107 H SER 14 H SER 14 22.449 24.442 17.786 108 HA SER 14 HA SER 14 23.978 23.299 15.631 109 HB2 SER 14 HB2 SER 14 24.371 23.061 18.616 110 HB3 SER 14 HB3 SER 14 25.618 22.838 17.373 111 HG SER 14 HG SER 14 25.388 25.009 16.809 112 H LEU 15 H LEU 15 21.523 21.952 17.634 113 HA LEU 15 HA LEU 15 22.400 19.144 17.082 114 HB2 LEU 15 HB2 LEU 15 20.725 20.298 19.344 115 HB3 LEU 15 HB3 LEU 15 21.057 18.590 19.100 116 HG LEU 15 HG LEU 15 23.157 20.717 19.708 117 HD11 LEU 15 HD11 LEU 15 23.255 19.654 21.922 118 HD12 LEU 15 HD12 LEU 15 21.632 20.289 21.599 119 HD13 LEU 15 HD13 LEU 15 21.946 18.543 21.463 120 HD21 LEU 15 HD21 LEU 15 24.644 18.769 20.144 121 HD22 LEU 15 HD22 LEU 15 23.379 17.677 19.542 122 HD23 LEU 15 HD23 LEU 15 24.155 18.851 18.451 123 H GLY 16 H GLY 16 19.699 21.418 16.772 124 HA2 GLY 16 HA2 GLY 16 18.331 21.117 14.773 125 HA3 GLY 16 HA3 GLY 16 18.272 19.386 15.059 126 H LEU 17 H LEU 17 17.711 21.990 17.457 127 HA LEU 17 HA LEU 17 14.826 21.716 17.385 128 HB2 LEU 17 HB2 LEU 17 14.592 21.009 19.719 129 HB3 LEU 17 HB3 LEU 17 15.203 19.752 18.664 130 HG LEU 17 HG LEU 17 16.871 21.335 20.657 131 HD11 LEU 17 HD11 LEU 17 16.759 19.261 22.007 132 HD12 LEU 17 HD12 LEU 17 15.140 19.911 21.710 133 HD13 LEU 17 HD13 LEU 17 15.716 18.514 20.780 134 HD21 LEU 17 HD21 LEU 17 18.466 19.380 20.441 135 HD22 LEU 17 HD22 LEU 17 17.551 18.865 19.007 136 HD23 LEU 17 HD23 LEU 17 18.405 20.430 19.039 137 H LEU 18 H LEU 18 13.764 23.209 18.934 138 HA LEU 18 HA LEU 18 15.253 25.741 19.193 139 HB2 LEU 18 HB2 LEU 18 12.374 24.947 19.727 140 HB3 LEU 18 HB3 LEU 18 12.987 26.569 20.035 141 HG LEU 18 HG LEU 18 13.157 25.245 17.316 142 HD11 LEU 18 HD11 LEU 18 11.029 27.143 18.382 143 HD12 LEU 18 HD12 LEU 18 11.170 26.573 16.703 144 HD13 LEU 18 HD13 LEU 18 10.792 25.423 17.996 145 HD21 LEU 18 HD21 LEU 18 14.692 27.145 17.581 146 HD22 LEU 18 HD22 LEU 18 13.356 27.582 16.510 147 HD23 LEU 18 HD23 LEU 18 13.356 28.154 18.191 148 H GLY 19 H GLY 19 14.830 27.032 21.303 149 HA2 GLY 19 HA2 GLY 19 14.984 25.368 23.732 150 HA3 GLY 19 HA3 GLY 19 16.499 26.155 23.297 151 H LYS 20 H LYS 20 15.030 26.405 25.699 152 HA LYS 20 HA LYS 20 14.606 29.329 25.879 153 HB2 LYS 20 HB2 LYS 20 12.617 27.319 26.994 154 HB3 LYS 20 HB3 LYS 20 12.523 29.070 27.099 155 HG2 LYS 20 HG2 LYS 20 12.162 29.203 24.648 156 HG3 LYS 20 HG3 LYS 20 12.271 27.435 24.532 157 HD2 LYS 20 HD2 LYS 20 10.371 27.161 26.020 158 HD3 LYS 20 HD3 LYS 20 10.253 28.924 26.233 159 HE2 LYS 20 HE2 LYS 20 9.905 29.152 23.750 160 HE3 LYS 20 HE3 LYS 20 9.902 27.385 23.619 161 HZ1 LYS 20 HZ1 LYS 20 7.973 29.031 25.156 162 HZ2 LYS 20 HZ2 LYS 20 7.669 28.203 23.757 163 HZ3 LYS 20 HZ3 LYS 20 7.999 27.385 25.167 164 H CYS 21 H CYS 21 14.345 29.926 28.294 165 HA CYS 21 HA CYS 21 16.426 28.525 29.852 166 HB2 CYS 21 HB2 CYS 21 16.413 30.943 29.801 167 HB3 CYS 21 HB3 CYS 21 14.728 30.975 30.317 168 H ILE 22 H ILE 22 16.142 27.496 31.773 169 HA ILE 22 HA ILE 22 13.465 27.277 33.036 170 HB ILE 22 HB ILE 22 15.377 24.963 32.529 171 HG12 ILE 22 HG12 ILE 22 12.467 25.567 31.835 172 HG13 ILE 22 HG13 ILE 22 13.819 25.359 30.729 173 HG21 ILE 22 HG21 ILE 22 14.674 24.923 34.928 174 HG22 ILE 22 HG22 ILE 22 12.977 25.026 34.421 175 HG23 ILE 22 HG23 ILE 22 13.957 23.606 34.026 176 HD11 ILE 22 HD11 ILE 22 12.442 23.413 30.584 177 HD12 ILE 22 HD12 ILE 22 13.920 22.926 31.432 178 HD13 ILE 22 HD13 ILE 22 12.414 23.199 32.339 179 H GLY 23 H GLY 23 13.648 28.344 34.820 180 HA2 GLY 23 HA2 GLY 23 14.361 29.354 36.715 181 HA3 GLY 23 HA3 GLY 23 15.554 28.063 36.885 182 H GLU 24 H GLU 24 17.478 28.308 35.560 183 HA GLU 24 HA GLU 24 18.401 31.052 34.892 184 HB2 GLU 24 HB2 GLU 24 19.823 29.274 36.905 185 HB3 GLU 24 HB3 GLU 24 20.519 30.712 36.164 186 HG2 GLU 24 HG2 GLU 24 18.640 32.090 37.096 187 HG3 GLU 24 HG3 GLU 24 18.104 30.668 38.008 188 H LYS 25 H LYS 25 18.206 27.853 33.987 189 HA LYS 25 HA LYS 25 20.821 27.795 32.508 190 HB2 LYS 25 HB2 LYS 25 19.141 25.570 33.712 191 HB3 LYS 25 HB3 LYS 25 20.530 25.310 32.665 192 HG2 LYS 25 HG2 LYS 25 22.071 26.228 34.259 193 HG3 LYS 25 HG3 LYS 25 20.766 26.898 35.247 194 HD2 LYS 25 HD2 LYS 25 21.625 24.940 36.355 195 HD3 LYS 25 HD3 LYS 25 19.974 24.651 35.816 196 HE2 LYS 25 HE2 LYS 25 21.044 23.528 33.734 197 HE3 LYS 25 HE3 LYS 25 22.561 23.556 34.643 198 HZ1 LYS 25 HZ1 LYS 25 21.410 22.241 36.385 199 HZ2 LYS 25 HZ2 LYS 25 20.021 22.265 35.482 200 HZ3 LYS 25 HZ3 LYS 25 21.352 21.476 34.935 201 H CYS 26 H CYS 26 20.831 27.239 30.365 202 HA CYS 26 HA CYS 26 18.387 27.301 28.805 203 HB2 CYS 26 HB2 CYS 26 20.399 28.057 27.800 204 HB3 CYS 26 HB3 CYS 26 21.259 26.579 28.217 205 H LYS 27 H LYS 27 17.039 25.744 28.225 206 HA LYS 27 HA LYS 27 17.900 22.931 27.999 207 HB2 LYS 27 HB2 LYS 27 15.500 23.997 29.550 208 HB3 LYS 27 HB3 LYS 27 15.481 22.377 28.863 209 HG2 LYS 27 HG2 LYS 27 17.559 23.360 30.876 210 HG3 LYS 27 HG3 LYS 27 16.123 22.407 31.255 211 HD2 LYS 27 HD2 LYS 27 16.909 20.630 29.675 212 HD3 LYS 27 HD3 LYS 27 18.429 21.533 29.472 213 HE2 LYS 27 HE2 LYS 27 18.993 21.296 31.785 214 HE3 LYS 27 HE3 LYS 27 17.389 20.662 32.187 215 HZ1 LYS 27 HZ1 LYS 27 17.859 18.678 30.932 216 HZ2 LYS 27 HZ2 LYS 27 19.296 19.290 30.383 217 HZ3 LYS 27 HZ3 LYS 27 19.112 18.921 31.971 218 H CYS 28 H CYS 28 17.351 22.055 26.127 219 HA CYS 28 HA CYS 28 15.920 23.609 24.178 220 HB2 CYS 28 HB2 CYS 28 16.705 20.710 23.997 221 HB3 CYS 28 HB3 CYS 28 16.280 21.810 22.686 222 H VAL 29 H VAL 29 13.985 22.884 22.995 223 HA VAL 29 HA VAL 29 11.891 22.130 24.942 224 HB VAL 29 HB VAL 29 10.296 23.072 23.470 225 HG11 VAL 29 HG11 VAL 29 12.702 24.923 23.386 226 HG12 VAL 29 HG12 VAL 29 10.987 25.357 23.353 227 HG13 VAL 29 HG13 VAL 29 11.686 24.654 24.819 228 HG21 VAL 29 HG21 VAL 29 10.892 24.044 21.282 229 HG22 VAL 29 HG22 VAL 29 12.511 23.317 21.406 230 HG23 VAL 29 HG23 VAL 29 11.057 22.289 21.314 231 HA PRO 30 HA PRO 30 11.028 18.108 23.509 232 HB2 PRO 30 HB2 PRO 30 8.135 18.829 23.021 233 HB3 PRO 30 HB3 PRO 30 8.825 17.441 23.921 234 HG2 PRO 30 HG2 PRO 30 7.888 19.576 25.276 235 HG3 PRO 30 HG3 PRO 30 9.470 18.869 25.747 236 HD2 PRO 30 HD2 PRO 30 8.950 21.272 23.965 237 HD3 PRO 30 HD3 PRO 30 10.062 21.130 25.360 238 H TYR 31 H TYR 31 11.895 17.442 21.693 239 HA TYR 31 HA TYR 31 10.388 17.603 19.136 240 HB2 TYR 31 HB2 TYR 31 13.313 18.128 19.648 241 HB3 TYR 31 HB3 TYR 31 12.821 17.327 18.162 242 HD1 TYR 31 HD1 TYR 31 12.128 18.532 16.300 243 HD2 TYR 31 HD2 TYR 31 12.118 20.441 20.164 244 HE1 TYR 31 HE1 TYR 31 11.654 20.714 15.226 245 HE2 TYR 31 HE2 TYR 31 11.596 22.609 19.072 246 HH TYR 31 HH TYR 31 11.808 23.034 15.594 Start of MODEL 15 1 H1 ALA 1 H1 ALA 1 21.702 33.844 38.642 2 H2 ALA 1 H2 ALA 1 21.273 35.386 38.981 3 H3 ALA 1 H3 ALA 1 22.846 34.927 39.125 4 HA ALA 1 HA ALA 1 22.517 36.245 37.140 5 HB1 ALA 1 HB1 ALA 1 23.555 34.673 35.548 6 HB2 ALA 1 HB2 ALA 1 24.260 34.466 37.158 7 HB3 ALA 1 HB3 ALA 1 23.062 33.299 36.549 8 H PHE 2 H PHE 2 21.811 35.793 34.691 9 HA PHE 2 HA PHE 2 19.041 34.655 34.618 10 HB2 PHE 2 HB2 PHE 2 20.094 37.032 33.068 11 HB3 PHE 2 HB3 PHE 2 18.458 36.385 33.029 12 HD1 PHE 2 HD1 PHE 2 17.347 36.122 35.488 13 HD2 PHE 2 HD2 PHE 2 20.446 38.930 34.425 14 HE1 PHE 2 HE1 PHE 2 16.738 37.520 37.430 15 HE2 PHE 2 HE2 PHE 2 19.830 40.336 36.381 16 HZ PHE 2 HZ PHE 2 17.951 39.659 37.856 17 H CYS 3 H CYS 3 18.402 33.568 32.780 18 HA CYS 3 HA CYS 3 20.410 32.398 30.995 19 HB2 CYS 3 HB2 CYS 3 18.490 31.166 31.964 20 HB3 CYS 3 HB3 CYS 3 17.383 32.230 31.124 21 H ASN 4 H ASN 4 20.349 32.605 28.683 22 HA ASN 4 HA ASN 4 19.310 35.219 27.674 23 HB2 ASN 4 HB2 ASN 4 21.814 33.703 26.922 24 HB3 ASN 4 HB3 ASN 4 21.275 35.241 26.235 25 HD21 ASN 4 HD21 ASN 4 23.095 35.103 29.855 26 HD22 ASN 4 HD22 ASN 4 22.819 33.668 28.858 27 H LEU 5 H LEU 5 17.306 34.407 26.955 28 HA LEU 5 HA LEU 5 16.906 31.924 25.828 29 HB2 LEU 5 HB2 LEU 5 15.157 33.408 26.731 30 HB3 LEU 5 HB3 LEU 5 15.282 34.431 25.299 31 HG LEU 5 HG LEU 5 14.511 32.533 23.876 32 HD11 LEU 5 HD11 LEU 5 15.255 30.588 25.187 33 HD12 LEU 5 HD12 LEU 5 14.179 31.055 26.529 34 HD13 LEU 5 HD13 LEU 5 13.510 30.528 24.972 35 HD21 LEU 5 HD21 LEU 5 12.707 33.124 26.259 36 HD22 LEU 5 HD22 LEU 5 12.881 34.130 24.805 37 HD23 LEU 5 HD23 LEU 5 12.184 32.499 24.682 38 H ARG 6 H ARG 6 17.792 34.847 23.907 39 HA ARG 6 HA ARG 6 17.386 33.452 21.370 40 HB2 ARG 6 HB2 ARG 6 17.285 35.938 21.685 41 HB3 ARG 6 HB3 ARG 6 19.042 35.957 21.880 42 HG2 ARG 6 HG2 ARG 6 19.326 35.050 19.613 43 HG3 ARG 6 HG3 ARG 6 17.576 34.883 19.418 44 HD2 ARG 6 HD2 ARG 6 19.006 37.539 19.860 45 HD3 ARG 6 HD3 ARG 6 18.622 36.864 18.274 46 HE ARG 6 HE ARG 6 16.198 36.930 19.703 47 HH11 ARG 6 HH11 ARG 6 18.458 39.256 18.217 48 HH12 ARG 6 HH12 ARG 6 17.126 40.358 17.902 49 HH21 ARG 6 HH21 ARG 6 14.631 38.499 19.128 50 HH22 ARG 6 HH22 ARG 6 15.209 39.980 18.400 51 H ARG 7 H ARG 7 20.137 33.826 23.539 52 HA ARG 7 HA ARG 7 22.110 32.547 21.827 53 HB2 ARG 7 HB2 ARG 7 22.615 34.135 23.710 54 HB3 ARG 7 HB3 ARG 7 22.044 32.924 24.843 55 HG2 ARG 7 HG2 ARG 7 24.455 33.025 24.767 56 HG3 ARG 7 HG3 ARG 7 23.875 31.433 24.301 57 HD2 ARG 7 HD2 ARG 7 25.777 32.140 22.916 58 HD3 ARG 7 HD3 ARG 7 24.320 31.921 21.951 59 HE ARG 7 HE ARG 7 24.176 34.251 21.563 60 HH11 ARG 7 HH11 ARG 7 26.700 33.828 24.016 61 HH12 ARG 7 HH12 ARG 7 27.330 35.429 23.684 62 HH21 ARG 7 HH21 ARG 7 25.185 36.131 21.108 63 HH22 ARG 7 HH22 ARG 7 26.266 36.791 22.328 64 H CYS 8 H CYS 8 19.865 31.448 24.318 65 HA CYS 8 HA CYS 8 20.676 28.687 24.391 66 HB2 CYS 8 HB2 CYS 8 19.378 29.794 26.157 67 HB3 CYS 8 HB3 CYS 8 18.046 30.066 25.045 68 H GLU 9 H GLU 9 18.069 30.389 22.544 69 HA GLU 9 HA GLU 9 17.167 28.189 21.060 70 HB2 GLU 9 HB2 GLU 9 17.267 31.165 20.528 71 HB3 GLU 9 HB3 GLU 9 16.658 30.080 19.289 72 HG2 GLU 9 HG2 GLU 9 15.524 30.017 22.112 73 HG3 GLU 9 HG3 GLU 9 14.965 31.171 20.899 74 H LEU 10 H LEU 10 19.941 30.369 20.159 75 HA LEU 10 HA LEU 10 20.439 28.745 17.792 76 HB2 LEU 10 HB2 LEU 10 22.354 30.046 17.347 77 HB3 LEU 10 HB3 LEU 10 21.038 31.077 17.822 78 HG LEU 10 HG LEU 10 22.188 31.051 20.187 79 HD11 LEU 10 HD11 LEU 10 23.988 29.405 19.682 80 HD12 LEU 10 HD12 LEU 10 24.526 30.420 18.332 81 HD13 LEU 10 HD13 LEU 10 24.678 30.991 19.996 82 HD21 LEU 10 HD21 LEU 10 21.908 33.037 18.786 83 HD22 LEU 10 HD22 LEU 10 23.512 33.027 19.522 84 HD23 LEU 10 HD23 LEU 10 23.323 32.573 17.816 85 H SER 11 H SER 11 21.502 28.483 21.133 86 HA SER 11 HA SER 11 23.652 26.622 20.686 87 HB2 SER 11 HB2 SER 11 21.849 26.990 23.114 88 HB3 SER 11 HB3 SER 11 23.320 26.003 23.062 89 HG SER 11 HG SER 11 23.100 28.816 22.664 90 H CYS 12 H CYS 12 20.150 26.171 21.220 91 HA CYS 12 HA CYS 12 20.307 23.267 20.956 92 HB2 CYS 12 HB2 CYS 12 17.967 25.194 20.900 93 HB3 CYS 12 HB3 CYS 12 17.846 23.439 20.998 94 H ARG 13 H ARG 13 19.762 25.972 18.679 95 HA ARG 13 HA ARG 13 18.960 24.457 16.406 96 HB2 ARG 13 HB2 ARG 13 18.999 26.996 16.840 97 HB3 ARG 13 HB3 ARG 13 20.691 26.956 16.330 98 HG2 ARG 13 HG2 ARG 13 19.990 26.128 14.114 99 HG3 ARG 13 HG3 ARG 13 18.305 26.066 14.643 100 HD2 ARG 13 HD2 ARG 13 20.027 28.575 14.494 101 HD3 ARG 13 HD3 ARG 13 18.825 28.096 13.305 102 HE ARG 13 HE ARG 13 17.088 28.304 15.096 103 HH11 ARG 13 HH11 ARG 13 19.950 30.405 15.299 104 HH12 ARG 13 HH12 ARG 13 19.154 31.390 16.520 105 HH21 ARG 13 HH21 ARG 13 16.149 29.828 16.299 106 HH22 ARG 13 HH22 ARG 13 17.032 31.243 16.841 107 H SER 14 H SER 14 22.193 24.930 17.798 108 HA SER 14 HA SER 14 23.728 23.669 15.777 109 HB2 SER 14 HB2 SER 14 24.093 23.440 18.790 110 HB3 SER 14 HB3 SER 14 25.331 23.164 17.560 111 HG SER 14 HG SER 14 25.209 25.325 16.972 112 H LEU 15 H LEU 15 21.594 22.216 18.233 113 HA LEU 15 HA LEU 15 22.395 19.450 17.555 114 HB2 LEU 15 HB2 LEU 15 20.235 20.477 19.441 115 HB3 LEU 15 HB3 LEU 15 20.843 18.826 19.333 116 HG LEU 15 HG LEU 15 22.418 21.242 20.319 117 HD11 LEU 15 HD11 LEU 15 22.245 20.148 22.505 118 HD12 LEU 15 HD12 LEU 15 20.631 20.492 21.853 119 HD13 LEU 15 HD13 LEU 15 21.281 18.839 21.794 120 HD21 LEU 15 HD21 LEU 15 23.934 19.618 19.274 121 HD22 LEU 15 HD22 LEU 15 24.083 19.551 21.037 122 HD23 LEU 15 HD23 LEU 15 23.165 18.293 20.181 123 H GLY 16 H GLY 16 19.852 21.735 16.875 124 HA2 GLY 16 HA2 GLY 16 18.714 21.425 14.678 125 HA3 GLY 16 HA3 GLY 16 18.372 19.762 15.164 126 H LEU 17 H LEU 17 17.929 21.422 17.959 127 HA LEU 17 HA LEU 17 14.970 21.645 17.548 128 HB2 LEU 17 HB2 LEU 17 14.854 20.865 19.923 129 HB3 LEU 17 HB3 LEU 17 15.201 19.662 18.710 130 HG LEU 17 HG LEU 17 17.408 20.880 20.415 131 HD11 LEU 17 HD11 LEU 17 15.611 20.042 21.923 132 HD12 LEU 17 HD12 LEU 17 15.613 18.495 21.073 133 HD13 LEU 17 HD13 LEU 17 17.044 19.001 21.998 134 HD21 LEU 17 HD21 LEU 17 18.154 19.393 18.546 135 HD22 LEU 17 HD22 LEU 17 18.413 18.604 20.102 136 HD23 LEU 17 HD23 LEU 17 17.029 18.148 19.090 137 H LEU 18 H LEU 18 13.875 22.864 19.488 138 HA LEU 18 HA LEU 18 15.153 25.524 19.551 139 HB2 LEU 18 HB2 LEU 18 12.360 24.497 20.091 140 HB3 LEU 18 HB3 LEU 18 12.871 26.096 20.610 141 HG LEU 18 HG LEU 18 13.516 26.651 18.242 142 HD11 LEU 18 HD11 LEU 18 13.702 24.457 17.186 143 HD12 LEU 18 HD12 LEU 18 12.007 24.084 17.595 144 HD13 LEU 18 HD13 LEU 18 12.398 25.363 16.429 145 HD21 LEU 18 HD21 LEU 18 10.631 25.886 18.768 146 HD22 LEU 18 HD22 LEU 18 11.421 27.389 19.290 147 HD23 LEU 18 HD23 LEU 18 11.193 27.067 17.562 148 H GLY 19 H GLY 19 14.971 26.847 21.493 149 HA2 GLY 19 HA2 GLY 19 15.897 25.353 23.931 150 HA3 GLY 19 HA3 GLY 19 16.485 26.924 23.426 151 H LYS 20 H LYS 20 15.280 25.900 25.953 152 HA LYS 20 HA LYS 20 13.274 28.021 26.522 153 HB2 LYS 20 HB2 LYS 20 12.110 25.927 26.432 154 HB3 LYS 20 HB3 LYS 20 13.446 25.063 27.184 155 HG2 LYS 20 HG2 LYS 20 13.022 26.137 29.345 156 HG3 LYS 20 HG3 LYS 20 11.649 27.027 28.640 157 HD2 LYS 20 HD2 LYS 20 10.429 24.993 28.252 158 HD3 LYS 20 HD3 LYS 20 11.872 23.998 28.589 159 HE2 LYS 20 HE2 LYS 20 11.959 24.855 30.884 160 HE3 LYS 20 HE3 LYS 20 10.509 25.832 30.594 161 HZ1 LYS 20 HZ1 LYS 20 9.887 23.778 31.703 162 HZ2 LYS 20 HZ2 LYS 20 9.298 23.687 30.196 163 HZ3 LYS 20 HZ3 LYS 20 10.650 22.853 30.606 164 H CYS 21 H CYS 21 13.447 28.862 28.684 165 HA CYS 21 HA CYS 21 16.141 28.501 29.970 166 HB2 CYS 21 HB2 CYS 21 14.366 30.888 29.528 167 HB3 CYS 21 HB3 CYS 21 15.541 30.860 30.823 168 H ILE 22 H ILE 22 16.183 27.658 31.977 169 HA ILE 22 HA ILE 22 13.883 28.012 33.796 170 HB ILE 22 HB ILE 22 13.706 25.895 32.503 171 HG12 ILE 22 HG12 ILE 22 14.157 25.414 35.476 172 HG13 ILE 22 HG13 ILE 22 12.744 26.232 34.791 173 HG21 ILE 22 HG21 ILE 22 16.118 24.954 34.099 174 HG22 ILE 22 HG22 ILE 22 15.214 24.050 32.873 175 HG23 ILE 22 HG23 ILE 22 16.202 25.436 32.393 176 HD11 ILE 22 HD11 ILE 22 13.574 23.371 34.235 177 HD12 ILE 22 HD12 ILE 22 12.162 23.924 35.156 178 HD13 ILE 22 HD13 ILE 22 12.254 24.232 33.406 179 H GLY 23 H GLY 23 14.312 28.316 35.847 180 HA2 GLY 23 HA2 GLY 23 15.434 28.841 37.787 181 HA3 GLY 23 HA3 GLY 23 16.781 27.826 37.261 182 H GLU 24 H GLU 24 18.158 28.702 35.623 183 HA GLU 24 HA GLU 24 18.269 31.465 34.890 184 HB2 GLU 24 HB2 GLU 24 20.369 32.136 35.920 185 HB3 GLU 24 HB3 GLU 24 19.152 31.797 37.140 186 HG2 GLU 24 HG2 GLU 24 20.210 29.622 37.624 187 HG3 GLU 24 HG3 GLU 24 21.411 29.893 36.356 188 H LYS 25 H LYS 25 18.377 28.635 33.756 189 HA LYS 25 HA LYS 25 20.830 28.868 32.083 190 HB2 LYS 25 HB2 LYS 25 21.292 27.665 34.207 191 HB3 LYS 25 HB3 LYS 25 20.048 26.483 33.811 192 HG2 LYS 25 HG2 LYS 25 21.319 25.624 31.964 193 HG3 LYS 25 HG3 LYS 25 22.479 26.967 32.034 194 HD2 LYS 25 HD2 LYS 25 22.053 25.100 34.389 195 HD3 LYS 25 HD3 LYS 25 23.174 24.710 33.074 196 HE2 LYS 25 HE2 LYS 25 24.508 26.672 33.472 197 HE3 LYS 25 HE3 LYS 25 23.341 27.325 34.627 198 HZ1 LYS 25 HZ1 LYS 25 24.749 24.760 35.066 199 HZ2 LYS 25 HZ2 LYS 25 25.319 26.184 35.616 200 HZ3 LYS 25 HZ3 LYS 25 23.865 25.643 36.164 201 H CYS 26 H CYS 26 20.899 27.592 30.218 202 HA CYS 26 HA CYS 26 18.351 27.375 28.859 203 HB2 CYS 26 HB2 CYS 26 20.341 28.319 27.815 204 HB3 CYS 26 HB3 CYS 26 21.219 26.806 28.056 205 H LYS 27 H LYS 27 17.175 25.650 28.267 206 HA LYS 27 HA LYS 27 18.352 22.898 28.158 207 HB2 LYS 27 HB2 LYS 27 15.635 23.639 29.318 208 HB3 LYS 27 HB3 LYS 27 16.186 21.996 29.016 209 HG2 LYS 27 HG2 LYS 27 17.524 23.922 30.976 210 HG3 LYS 27 HG3 LYS 27 16.300 22.728 31.398 211 HD2 LYS 27 HD2 LYS 27 17.709 20.887 30.750 212 HD3 LYS 27 HD3 LYS 27 18.971 21.999 30.161 213 HE2 LYS 27 HE2 LYS 27 19.354 22.868 32.396 214 HE3 LYS 27 HE3 LYS 27 17.931 22.038 33.018 215 HZ1 LYS 27 HZ1 LYS 27 19.020 19.932 32.644 216 HZ2 LYS 27 HZ2 LYS 27 20.394 20.684 32.057 217 HZ3 LYS 27 HZ3 LYS 27 19.922 20.858 33.613 218 H CYS 28 H CYS 28 17.753 21.737 26.316 219 HA CYS 28 HA CYS 28 16.144 23.238 24.339 220 HB2 CYS 28 HB2 CYS 28 17.517 20.595 23.884 221 HB3 CYS 28 HB3 CYS 28 16.914 21.740 22.692 222 H VAL 29 H VAL 29 14.365 22.421 23.194 223 HA VAL 29 HA VAL 29 12.781 20.281 24.552 224 HB VAL 29 HB VAL 29 10.760 21.558 23.909 225 HG11 VAL 29 HG11 VAL 29 10.871 23.109 25.802 226 HG12 VAL 29 HG12 VAL 29 11.654 21.577 26.213 227 HG13 VAL 29 HG13 VAL 29 12.644 22.998 25.828 228 HG21 VAL 29 HG21 VAL 29 10.877 23.940 23.437 229 HG22 VAL 29 HG22 VAL 29 12.641 23.948 23.562 230 HG23 VAL 29 HG23 VAL 29 11.850 23.113 22.218 231 HA PRO 30 HA PRO 30 13.088 18.467 20.622 232 HB2 PRO 30 HB2 PRO 30 11.478 16.284 20.808 233 HB3 PRO 30 HB3 PRO 30 12.935 16.513 21.825 234 HG2 PRO 30 HG2 PRO 30 10.057 17.112 22.526 235 HG3 PRO 30 HG3 PRO 30 11.259 16.211 23.502 236 HD2 PRO 30 HD2 PRO 30 10.714 18.877 23.900 237 HD3 PRO 30 HD3 PRO 30 12.339 18.189 24.164 238 H TYR 31 H TYR 31 12.319 18.172 18.606 239 HA TYR 31 HA TYR 31 9.553 18.922 17.827 240 HB2 TYR 31 HB2 TYR 31 12.100 20.324 17.033 241 HB3 TYR 31 HB3 TYR 31 10.764 20.217 15.911 242 HD1 TYR 31 HD1 TYR 31 11.556 21.323 19.411 243 HD2 TYR 31 HD2 TYR 31 9.009 21.805 15.973 244 HE1 TYR 31 HE1 TYR 31 10.372 23.184 20.547 245 HE2 TYR 31 HE2 TYR 31 7.888 23.740 17.081 246 HH TYR 31 HH TYR 31 7.759 25.056 18.983 Start of MODEL 16 1 H1 ALA 1 H1 ALA 1 25.803 33.468 37.561 2 H2 ALA 1 H2 ALA 1 24.584 32.368 37.513 3 H3 ALA 1 H3 ALA 1 24.284 33.911 37.998 4 HA ALA 1 HA ALA 1 24.661 34.802 35.878 5 HB1 ALA 1 HB1 ALA 1 26.528 33.280 35.241 6 HB2 ALA 1 HB2 ALA 1 25.357 31.965 35.001 7 HB3 ALA 1 HB3 ALA 1 25.297 33.406 33.967 8 H PHE 2 H PHE 2 22.833 35.175 34.712 9 HA PHE 2 HA PHE 2 20.549 33.282 34.984 10 HB2 PHE 2 HB2 PHE 2 20.591 36.141 33.984 11 HB3 PHE 2 HB3 PHE 2 19.172 35.136 34.259 12 HD1 PHE 2 HD1 PHE 2 20.936 37.778 35.642 13 HD2 PHE 2 HD2 PHE 2 19.245 33.977 36.785 14 HE1 PHE 2 HE1 PHE 2 20.919 38.490 38.029 15 HE2 PHE 2 HE2 PHE 2 19.270 34.680 39.161 16 HZ PHE 2 HZ PHE 2 20.127 36.930 39.791 17 H CYS 3 H CYS 3 19.297 32.724 33.096 18 HA CYS 3 HA CYS 3 20.830 32.009 30.781 19 HB2 CYS 3 HB2 CYS 3 18.945 30.740 31.709 20 HB3 CYS 3 HB3 CYS 3 17.844 32.041 31.303 21 H ASN 4 H ASN 4 20.550 32.617 28.597 22 HA ASN 4 HA ASN 4 19.346 35.289 27.972 23 HB2 ASN 4 HB2 ASN 4 21.968 34.140 26.945 24 HB3 ASN 4 HB3 ASN 4 21.207 35.633 26.388 25 HD21 ASN 4 HD21 ASN 4 22.463 37.578 29.009 26 HD22 ASN 4 HD22 ASN 4 21.149 37.464 27.856 27 H LEU 5 H LEU 5 17.501 34.613 27.039 28 HA LEU 5 HA LEU 5 17.099 32.199 25.767 29 HB2 LEU 5 HB2 LEU 5 15.346 33.669 26.622 30 HB3 LEU 5 HB3 LEU 5 15.626 34.805 25.301 31 HG LEU 5 HG LEU 5 14.830 33.174 23.652 32 HD11 LEU 5 HD11 LEU 5 15.524 31.034 24.572 33 HD12 LEU 5 HD12 LEU 5 14.561 31.297 26.038 34 HD13 LEU 5 HD13 LEU 5 13.767 31.024 24.467 35 HD21 LEU 5 HD21 LEU 5 12.991 33.396 26.073 36 HD22 LEU 5 HD22 LEU 5 13.192 34.602 24.782 37 HD23 LEU 5 HD23 LEU 5 12.486 33.023 24.409 38 H ARG 6 H ARG 6 18.262 35.175 24.122 39 HA ARG 6 HA ARG 6 18.081 34.198 21.428 40 HB2 ARG 6 HB2 ARG 6 18.605 36.535 21.936 41 HB3 ARG 6 HB3 ARG 6 20.135 36.074 22.695 42 HG2 ARG 6 HG2 ARG 6 20.993 35.226 20.534 43 HG3 ARG 6 HG3 ARG 6 19.461 35.612 19.749 44 HD2 ARG 6 HD2 ARG 6 21.371 37.596 21.044 45 HD3 ARG 6 HD3 ARG 6 21.224 37.281 19.302 46 HE ARG 6 HE ARG 6 18.657 37.960 20.138 47 HH11 ARG 6 HH11 ARG 6 21.746 39.621 19.806 48 HH12 ARG 6 HH12 ARG 6 20.956 41.181 19.757 49 HH21 ARG 6 HH21 ARG 6 17.787 40.011 20.218 50 HH22 ARG 6 HH22 ARG 6 18.879 41.392 20.110 51 H ARG 7 H ARG 7 20.636 33.797 23.892 52 HA ARG 7 HA ARG 7 22.414 32.239 22.168 53 HB2 ARG 7 HB2 ARG 7 22.307 32.660 25.183 54 HB3 ARG 7 HB3 ARG 7 23.588 31.820 24.344 55 HG2 ARG 7 HG2 ARG 7 22.824 34.755 23.901 56 HG3 ARG 7 HG3 ARG 7 24.143 34.199 24.890 57 HD2 ARG 7 HD2 ARG 7 23.887 34.085 21.880 58 HD3 ARG 7 HD3 ARG 7 25.117 34.880 22.871 59 HE ARG 7 HE ARG 7 25.113 32.005 23.269 60 HH11 ARG 7 HH11 ARG 7 26.476 34.489 21.117 61 HH12 ARG 7 HH12 ARG 7 27.700 33.370 20.582 62 HH21 ARG 7 HH21 ARG 7 26.729 30.731 22.456 63 HH22 ARG 7 HH22 ARG 7 27.864 31.435 21.288 64 H CYS 8 H CYS 8 19.881 31.462 24.529 65 HA CYS 8 HA CYS 8 20.303 28.639 24.554 66 HB2 CYS 8 HB2 CYS 8 19.014 29.848 26.236 67 HB3 CYS 8 HB3 CYS 8 17.818 30.310 25.031 68 H GLU 9 H GLU 9 17.921 30.561 22.595 69 HA GLU 9 HA GLU 9 16.932 28.398 21.071 70 HB2 GLU 9 HB2 GLU 9 17.234 31.337 20.322 71 HB3 GLU 9 HB3 GLU 9 16.385 30.140 19.340 72 HG2 GLU 9 HG2 GLU 9 14.915 29.684 21.389 73 HG3 GLU 9 HG3 GLU 9 15.597 31.136 22.093 74 H LEU 10 H LEU 10 19.862 30.414 20.387 75 HA LEU 10 HA LEU 10 20.303 28.996 17.885 76 HB2 LEU 10 HB2 LEU 10 22.121 30.356 17.468 77 HB3 LEU 10 HB3 LEU 10 20.921 31.356 18.248 78 HG LEU 10 HG LEU 10 22.337 30.881 20.432 79 HD11 LEU 10 HD11 LEU 10 23.977 29.267 19.455 80 HD12 LEU 10 HD12 LEU 10 24.436 30.478 18.247 81 HD13 LEU 10 HD13 LEU 10 24.773 30.746 19.967 82 HD21 LEU 10 HD21 LEU 10 23.725 32.871 19.919 83 HD22 LEU 10 HD22 LEU 10 23.310 32.712 18.205 84 HD23 LEU 10 HD23 LEU 10 22.048 33.093 19.391 85 H SER 11 H SER 11 21.423 28.494 21.200 86 HA SER 11 HA SER 11 23.523 26.614 20.534 87 HB2 SER 11 HB2 SER 11 21.910 26.887 23.096 88 HB3 SER 11 HB3 SER 11 23.391 25.926 22.883 89 HG SER 11 HG SER 11 23.039 28.725 22.739 90 H CYS 12 H CYS 12 20.030 26.155 21.421 91 HA CYS 12 HA CYS 12 20.169 23.276 21.055 92 HB2 CYS 12 HB2 CYS 12 17.756 25.114 20.953 93 HB3 CYS 12 HB3 CYS 12 17.726 23.359 21.135 94 H ARG 13 H ARG 13 19.350 26.001 18.874 95 HA ARG 13 HA ARG 13 18.558 24.474 16.587 96 HB2 ARG 13 HB2 ARG 13 18.185 26.868 16.820 97 HB3 ARG 13 HB3 ARG 13 19.919 27.191 16.780 98 HG2 ARG 13 HG2 ARG 13 20.079 26.709 14.482 99 HG3 ARG 13 HG3 ARG 13 18.559 25.803 14.469 100 HD2 ARG 13 HD2 ARG 13 18.313 27.993 13.347 101 HD3 ARG 13 HD3 ARG 13 17.243 27.800 14.724 102 HE ARG 13 HE ARG 13 18.289 29.546 15.842 103 HH11 ARG 13 HH11 ARG 13 20.270 28.891 12.990 104 HH12 ARG 13 HH12 ARG 13 21.115 30.415 13.203 105 HH21 ARG 13 HH21 ARG 13 19.323 31.372 15.931 106 HH22 ARG 13 HH22 ARG 13 20.595 31.793 14.779 107 H SER 14 H SER 14 21.805 25.394 17.715 108 HA SER 14 HA SER 14 23.233 24.388 15.467 109 HB2 SER 14 HB2 SER 14 24.160 24.602 18.355 110 HB3 SER 14 HB3 SER 14 25.193 24.409 16.928 111 HG SER 14 HG SER 14 23.518 26.612 17.612 112 H LEU 15 H LEU 15 21.772 22.649 18.151 113 HA LEU 15 HA LEU 15 22.993 20.074 17.290 114 HB2 LEU 15 HB2 LEU 15 21.311 20.837 19.702 115 HB3 LEU 15 HB3 LEU 15 21.898 19.209 19.367 116 HG LEU 15 HG LEU 15 23.642 21.642 19.957 117 HD11 LEU 15 HD11 LEU 15 22.994 19.142 21.582 118 HD12 LEU 15 HD12 LEU 15 24.127 20.426 22.052 119 HD13 LEU 15 HD13 LEU 15 22.398 20.781 21.907 120 HD21 LEU 15 HD21 LEU 15 25.488 19.979 20.127 121 HD22 LEU 15 HD22 LEU 15 24.394 18.719 19.491 122 HD23 LEU 15 HD23 LEU 15 24.870 20.109 18.486 123 H GLY 16 H GLY 16 20.222 21.845 16.508 124 HA2 GLY 16 HA2 GLY 16 18.710 21.145 14.854 125 HA3 GLY 16 HA3 GLY 16 19.038 19.460 15.221 126 H LEU 17 H LEU 17 18.138 21.638 17.863 127 HA LEU 17 HA LEU 17 15.306 20.794 17.787 128 HB2 LEU 17 HB2 LEU 17 15.359 20.141 20.151 129 HB3 LEU 17 HB3 LEU 17 16.136 19.010 19.061 130 HG LEU 17 HG LEU 17 17.643 20.955 20.857 131 HD11 LEU 17 HD11 LEU 17 17.932 18.969 22.351 132 HD12 LEU 17 HD12 LEU 17 16.230 19.427 22.193 133 HD13 LEU 17 HD13 LEU 17 16.852 18.034 21.296 134 HD21 LEU 17 HD21 LEU 17 19.472 19.230 20.633 135 HD22 LEU 17 HD22 LEU 17 18.511 18.433 19.370 136 HD23 LEU 17 HD23 LEU 17 19.121 20.088 19.141 137 H LEU 18 H LEU 18 13.978 21.874 19.507 138 HA LEU 18 HA LEU 18 14.624 24.765 19.565 139 HB2 LEU 18 HB2 LEU 18 12.141 23.150 20.244 140 HB3 LEU 18 HB3 LEU 18 12.248 24.888 20.522 141 HG LEU 18 HG LEU 18 12.697 23.648 17.794 142 HD11 LEU 18 HD11 LEU 18 10.385 24.337 17.259 143 HD12 LEU 18 HD12 LEU 18 10.415 23.128 18.549 144 HD13 LEU 18 HD13 LEU 18 10.143 24.840 18.949 145 HD21 LEU 18 HD21 LEU 18 12.167 25.918 16.984 146 HD22 LEU 18 HD22 LEU 18 12.034 26.489 18.657 147 HD23 LEU 18 HD23 LEU 18 13.593 25.925 18.011 148 H GLY 19 H GLY 19 14.197 26.018 21.536 149 HA2 GLY 19 HA2 GLY 19 14.420 24.615 24.111 150 HA3 GLY 19 HA3 GLY 19 15.873 25.492 23.653 151 H LYS 20 H LYS 20 14.705 25.939 25.960 152 HA LYS 20 HA LYS 20 13.696 28.734 25.939 153 HB2 LYS 20 HB2 LYS 20 12.346 26.361 27.313 154 HB3 LYS 20 HB3 LYS 20 11.961 28.037 27.667 155 HG2 LYS 20 HG2 LYS 20 11.529 26.685 24.964 156 HG3 LYS 20 HG3 LYS 20 10.298 26.968 26.195 157 HD2 LYS 20 HD2 LYS 20 10.622 29.395 26.028 158 HD3 LYS 20 HD3 LYS 20 11.874 29.168 24.787 159 HE2 LYS 20 HE2 LYS 20 10.185 28.016 23.352 160 HE3 LYS 20 HE3 LYS 20 8.962 28.324 24.581 161 HZ1 LYS 20 HZ1 LYS 20 8.758 30.070 23.063 162 HZ2 LYS 20 HZ2 LYS 20 9.627 30.764 24.288 163 HZ3 LYS 20 HZ3 LYS 20 10.370 30.277 22.886 164 H CYS 21 H CYS 21 13.920 29.767 28.066 165 HA CYS 21 HA CYS 21 16.277 28.790 29.513 166 HB2 CYS 21 HB2 CYS 21 14.518 31.234 29.756 167 HB3 CYS 21 HB3 CYS 21 15.825 30.874 30.871 168 H ILE 22 H ILE 22 16.435 28.166 31.643 169 HA ILE 22 HA ILE 22 13.986 27.620 33.211 170 HB ILE 22 HB ILE 22 14.746 25.655 31.933 171 HG12 ILE 22 HG12 ILE 22 15.100 25.093 34.889 172 HG13 ILE 22 HG13 ILE 22 13.548 25.556 34.173 173 HG21 ILE 22 HG21 ILE 22 16.843 24.445 32.757 174 HG22 ILE 22 HG22 ILE 22 17.083 25.873 31.769 175 HG23 ILE 22 HG23 ILE 22 17.307 25.971 33.527 176 HD11 ILE 22 HD11 ILE 22 13.633 23.155 34.264 177 HD12 ILE 22 HD12 ILE 22 13.775 23.643 32.559 178 HD13 ILE 22 HD13 ILE 22 15.212 23.111 33.457 179 H GLY 23 H GLY 23 15.618 29.845 33.380 180 HA2 GLY 23 HA2 GLY 23 15.859 31.199 35.285 181 HA3 GLY 23 HA3 GLY 23 16.383 29.809 36.243 182 H GLU 24 H GLU 24 18.430 29.035 36.012 183 HA GLU 24 HA GLU 24 20.448 31.085 35.458 184 HB2 GLU 24 HB2 GLU 24 22.008 29.623 36.498 185 HB3 GLU 24 HB3 GLU 24 20.597 29.806 37.503 186 HG2 GLU 24 HG2 GLU 24 20.984 27.377 35.691 187 HG3 GLU 24 HG3 GLU 24 21.751 27.488 37.265 188 H LYS 25 H LYS 25 19.168 28.622 33.540 189 HA LYS 25 HA LYS 25 21.326 28.725 31.535 190 HB2 LYS 25 HB2 LYS 25 21.754 26.325 31.596 191 HB3 LYS 25 HB3 LYS 25 22.110 27.053 33.158 192 HG2 LYS 25 HG2 LYS 25 19.768 26.259 33.918 193 HG3 LYS 25 HG3 LYS 25 19.711 25.333 32.410 194 HD2 LYS 25 HD2 LYS 25 21.807 24.157 33.082 195 HD3 LYS 25 HD3 LYS 25 21.833 25.100 34.588 196 HE2 LYS 25 HE2 LYS 25 19.532 24.158 35.105 197 HE3 LYS 25 HE3 LYS 25 19.715 23.086 33.711 198 HZ1 LYS 25 HZ1 LYS 25 20.413 21.967 35.723 199 HZ2 LYS 25 HZ2 LYS 25 21.718 22.179 34.790 200 HZ3 LYS 25 HZ3 LYS 25 21.472 23.163 36.105 201 H CYS 26 H CYS 26 20.852 27.416 29.653 202 HA CYS 26 HA CYS 26 18.105 27.578 28.696 203 HB2 CYS 26 HB2 CYS 26 20.136 28.077 27.359 204 HB3 CYS 26 HB3 CYS 26 20.666 26.414 27.549 205 H LYS 27 H LYS 27 16.791 25.821 27.975 206 HA LYS 27 HA LYS 27 17.597 23.020 28.538 207 HB2 LYS 27 HB2 LYS 27 16.137 23.739 30.331 208 HB3 LYS 27 HB3 LYS 27 14.951 24.386 29.205 209 HG2 LYS 27 HG2 LYS 27 15.730 21.467 29.065 210 HG3 LYS 27 HG3 LYS 27 14.644 22.012 30.345 211 HD2 LYS 27 HD2 LYS 27 12.950 22.709 28.813 212 HD3 LYS 27 HD3 LYS 27 14.042 22.651 27.441 213 HE2 LYS 27 HE2 LYS 27 13.198 20.655 27.011 214 HE3 LYS 27 HE3 LYS 27 14.324 20.106 28.243 215 HZ1 LYS 27 HZ1 LYS 27 12.110 19.244 28.714 216 HZ2 LYS 27 HZ2 LYS 27 12.449 20.377 29.868 217 HZ3 LYS 27 HZ3 LYS 27 11.448 20.745 28.651 218 H CYS 28 H CYS 28 17.451 21.801 26.701 219 HA CYS 28 HA CYS 28 15.875 22.897 24.408 220 HB2 CYS 28 HB2 CYS 28 17.798 20.592 24.242 221 HB3 CYS 28 HB3 CYS 28 17.082 21.529 22.945 222 H VAL 29 H VAL 29 14.306 21.609 23.324 223 HA VAL 29 HA VAL 29 13.177 19.405 24.989 224 HB VAL 29 HB VAL 29 11.080 19.776 23.659 225 HG11 VAL 29 HG11 VAL 29 11.278 20.377 26.001 226 HG12 VAL 29 HG12 VAL 29 12.040 21.935 25.577 227 HG13 VAL 29 HG13 VAL 29 10.355 21.607 25.141 228 HG21 VAL 29 HG21 VAL 29 10.674 21.948 22.698 229 HG22 VAL 29 HG22 VAL 29 12.279 22.540 23.166 230 HG23 VAL 29 HG23 VAL 29 12.125 21.293 21.917 231 HA PRO 30 HA PRO 30 14.271 16.606 21.696 232 HB2 PRO 30 HB2 PRO 30 12.225 14.785 22.956 233 HB3 PRO 30 HB3 PRO 30 13.921 14.432 22.511 234 HG2 PRO 30 HG2 PRO 30 13.250 14.864 25.092 235 HG3 PRO 30 HG3 PRO 30 14.736 15.623 24.427 236 HD2 PRO 30 HD2 PRO 30 11.986 16.884 24.762 237 HD3 PRO 30 HD3 PRO 30 13.583 17.507 25.248 238 H TYR 31 H TYR 31 13.585 16.035 19.681 239 HA TYR 31 HA TYR 31 10.688 16.177 18.943 240 HB2 TYR 31 HB2 TYR 31 13.032 17.567 17.711 241 HB3 TYR 31 HB3 TYR 31 11.790 16.938 16.650 242 HD1 TYR 31 HD1 TYR 31 12.207 19.067 19.712 243 HD2 TYR 31 HD2 TYR 31 9.778 18.092 16.287 244 HE1 TYR 31 HE1 TYR 31 10.592 20.860 20.342 245 HE2 TYR 31 HE2 TYR 31 8.180 19.915 16.910 246 HH TYR 31 HH TYR 31 8.315 21.400 20.044 Start of MODEL 17 1 H1 ALA 1 H1 ALA 1 24.072 33.438 37.327 2 H2 ALA 1 H2 ALA 1 25.520 33.554 36.550 3 H3 ALA 1 H3 ALA 1 24.460 32.373 36.122 4 HA ALA 1 HA ALA 1 23.972 35.251 35.830 5 HB1 ALA 1 HB1 ALA 1 25.721 34.491 34.265 6 HB2 ALA 1 HB2 ALA 1 24.667 33.169 33.708 7 HB3 ALA 1 HB3 ALA 1 24.219 34.858 33.394 8 H PHE 2 H PHE 2 22.056 35.811 34.738 9 HA PHE 2 HA PHE 2 19.728 34.059 34.952 10 HB2 PHE 2 HB2 PHE 2 20.247 36.734 33.594 11 HB3 PHE 2 HB3 PHE 2 18.668 35.985 33.680 12 HD1 PHE 2 HD1 PHE 2 18.946 34.982 36.677 13 HD2 PHE 2 HD2 PHE 2 19.552 38.756 34.664 14 HE1 PHE 2 HE1 PHE 2 18.281 36.181 38.720 15 HE2 PHE 2 HE2 PHE 2 18.872 39.955 36.725 16 HZ PHE 2 HZ PHE 2 18.214 38.677 38.749 17 H CYS 3 H CYS 3 18.257 33.983 32.883 18 HA CYS 3 HA CYS 3 19.584 32.319 30.914 19 HB2 CYS 3 HB2 CYS 3 16.787 33.455 31.140 20 HB3 CYS 3 HB3 CYS 3 17.290 32.359 29.862 21 H ASN 4 H ASN 4 19.831 32.624 28.750 22 HA ASN 4 HA ASN 4 19.406 35.284 27.472 23 HB2 ASN 4 HB2 ASN 4 21.931 33.574 27.416 24 HB3 ASN 4 HB3 ASN 4 21.599 34.887 26.290 25 HD21 ASN 4 HD21 ASN 4 22.876 35.811 30.019 26 HD22 ASN 4 HD22 ASN 4 22.597 34.132 29.564 27 H LEU 5 H LEU 5 17.442 34.284 26.789 28 HA LEU 5 HA LEU 5 17.242 31.696 25.764 29 HB2 LEU 5 HB2 LEU 5 15.399 33.048 26.683 30 HB3 LEU 5 HB3 LEU 5 15.436 34.079 25.254 31 HG LEU 5 HG LEU 5 14.752 32.155 23.831 32 HD11 LEU 5 HD11 LEU 5 13.934 30.070 24.913 33 HD12 LEU 5 HD12 LEU 5 15.675 30.255 25.099 34 HD13 LEU 5 HD13 LEU 5 14.599 30.622 26.470 35 HD21 LEU 5 HD21 LEU 5 12.456 31.942 24.729 36 HD22 LEU 5 HD22 LEU 5 13.004 32.605 26.285 37 HD23 LEU 5 HD23 LEU 5 13.046 33.607 24.818 38 H ARG 6 H ARG 6 17.997 34.652 23.878 39 HA ARG 6 HA ARG 6 17.756 33.308 21.295 40 HB2 ARG 6 HB2 ARG 6 17.731 35.709 21.303 41 HB3 ARG 6 HB3 ARG 6 19.287 35.804 22.124 42 HG2 ARG 6 HG2 ARG 6 20.425 34.807 20.164 43 HG3 ARG 6 HG3 ARG 6 18.875 34.667 19.319 44 HD2 ARG 6 HD2 ARG 6 20.168 37.273 20.248 45 HD3 ARG 6 HD3 ARG 6 20.310 36.611 18.622 46 HE ARG 6 HE ARG 6 17.789 37.608 19.909 47 HH11 ARG 6 HH11 ARG 6 19.451 36.925 16.826 48 HH12 ARG 6 HH12 ARG 6 18.115 37.612 15.931 49 HH21 ARG 6 HH21 ARG 6 16.219 38.335 18.704 50 HH22 ARG 6 HH22 ARG 6 16.301 38.266 16.943 51 H ARG 7 H ARG 7 20.630 33.881 23.423 52 HA ARG 7 HA ARG 7 22.395 32.358 21.746 53 HB2 ARG 7 HB2 ARG 7 23.055 33.977 23.564 54 HB3 ARG 7 HB3 ARG 7 22.600 32.777 24.763 55 HG2 ARG 7 HG2 ARG 7 25.051 32.906 24.309 56 HG3 ARG 7 HG3 ARG 7 24.380 31.295 24.084 57 HD2 ARG 7 HD2 ARG 7 26.069 31.969 22.352 58 HD3 ARG 7 HD3 ARG 7 24.510 31.462 21.695 59 HE ARG 7 HE ARG 7 24.811 34.376 22.098 60 HH11 ARG 7 HH11 ARG 7 25.360 31.831 19.696 61 HH12 ARG 7 HH12 ARG 7 25.248 33.007 18.404 62 HH21 ARG 7 HH21 ARG 7 24.409 35.613 20.476 63 HH22 ARG 7 HH22 ARG 7 24.529 35.076 18.802 64 H CYS 8 H CYS 8 20.293 31.333 24.392 65 HA CYS 8 HA CYS 8 20.986 28.574 24.458 66 HB2 CYS 8 HB2 CYS 8 19.663 29.829 26.128 67 HB3 CYS 8 HB3 CYS 8 18.345 29.967 24.979 68 H GLU 9 H GLU 9 18.325 30.182 22.548 69 HA GLU 9 HA GLU 9 17.572 27.761 21.190 70 HB2 GLU 9 HB2 GLU 9 17.036 30.700 20.619 71 HB3 GLU 9 HB3 GLU 9 16.469 29.391 19.580 72 HG2 GLU 9 HG2 GLU 9 15.335 28.351 21.583 73 HG3 GLU 9 HG3 GLU 9 15.676 29.843 22.471 74 H LEU 10 H LEU 10 20.006 30.235 20.303 75 HA LEU 10 HA LEU 10 20.528 29.072 17.675 76 HB2 LEU 10 HB2 LEU 10 22.221 30.824 19.502 77 HB3 LEU 10 HB3 LEU 10 22.667 30.390 17.851 78 HG LEU 10 HG LEU 10 20.114 31.863 18.577 79 HD11 LEU 10 HD11 LEU 10 22.733 32.984 17.508 80 HD12 LEU 10 HD12 LEU 10 21.230 33.895 17.767 81 HD13 LEU 10 HD13 LEU 10 22.096 33.213 19.152 82 HD21 LEU 10 HD21 LEU 10 20.065 32.474 16.192 83 HD22 LEU 10 HD22 LEU 10 21.496 31.461 15.893 84 HD23 LEU 10 HD23 LEU 10 19.955 30.731 16.400 85 H SER 11 H SER 11 21.932 28.622 20.901 86 HA SER 11 HA SER 11 23.857 26.627 20.159 87 HB2 SER 11 HB2 SER 11 22.338 26.822 22.785 88 HB3 SER 11 HB3 SER 11 23.815 25.890 22.482 89 HG SER 11 HG SER 11 23.436 28.703 22.437 90 H CYS 12 H CYS 12 20.360 26.257 21.010 91 HA CYS 12 HA CYS 12 20.339 23.409 20.486 92 HB2 CYS 12 HB2 CYS 12 18.038 25.383 20.465 93 HB3 CYS 12 HB3 CYS 12 17.912 23.631 20.550 94 H ARG 13 H ARG 13 19.944 26.249 18.370 95 HA ARG 13 HA ARG 13 18.897 24.942 16.047 96 HB2 ARG 13 HB2 ARG 13 19.180 27.472 16.450 97 HB3 ARG 13 HB3 ARG 13 20.872 27.253 16.019 98 HG2 ARG 13 HG2 ARG 13 20.065 26.299 13.783 99 HG3 ARG 13 HG3 ARG 13 18.434 26.780 14.266 100 HD2 ARG 13 HD2 ARG 13 19.335 28.501 12.851 101 HD3 ARG 13 HD3 ARG 13 19.275 29.158 14.495 102 HE ARG 13 HE ARG 13 21.838 28.029 14.212 103 HH11 ARG 13 HH11 ARG 13 20.209 30.739 12.653 104 HH12 ARG 13 HH12 ARG 13 21.715 31.299 11.960 105 HH21 ARG 13 HH21 ARG 13 23.602 28.880 13.510 106 HH22 ARG 13 HH22 ARG 13 23.625 30.340 12.529 107 H SER 14 H SER 14 22.271 25.332 17.146 108 HA SER 14 HA SER 14 23.547 24.121 14.953 109 HB2 SER 14 HB2 SER 14 25.425 23.761 16.347 110 HB3 SER 14 HB3 SER 14 24.667 25.261 16.896 111 HG SER 14 HG SER 14 23.752 24.051 18.652 112 H LEU 15 H LEU 15 22.019 22.537 17.724 113 HA LEU 15 HA LEU 15 22.677 19.823 16.844 114 HB2 LEU 15 HB2 LEU 15 20.874 20.853 19.060 115 HB3 LEU 15 HB3 LEU 15 21.433 19.189 18.863 116 HG LEU 15 HG LEU 15 23.155 21.624 19.525 117 HD11 LEU 15 HD11 LEU 15 23.395 20.554 21.702 118 HD12 LEU 15 HD12 LEU 15 21.687 20.850 21.350 119 HD13 LEU 15 HD13 LEU 15 22.358 19.209 21.188 120 HD21 LEU 15 HD21 LEU 15 24.498 20.030 18.239 121 HD22 LEU 15 HD22 LEU 15 24.961 19.965 19.942 122 HD23 LEU 15 HD23 LEU 15 23.929 18.684 19.261 123 H GLY 16 H GLY 16 19.997 22.024 16.350 124 HA2 GLY 16 HA2 GLY 16 18.407 21.735 14.617 125 HA3 GLY 16 HA3 GLY 16 18.612 19.990 14.674 126 H LEU 17 H LEU 17 17.892 22.257 17.368 127 HA LEU 17 HA LEU 17 15.064 21.570 17.465 128 HB2 LEU 17 HB2 LEU 17 15.145 20.785 19.832 129 HB3 LEU 17 HB3 LEU 17 15.729 19.654 18.635 130 HG LEU 17 HG LEU 17 17.605 21.292 20.379 131 HD11 LEU 17 HD11 LEU 17 17.683 19.272 21.831 132 HD12 LEU 17 HD12 LEU 17 16.050 19.958 21.783 133 HD13 LEU 17 HD13 LEU 17 16.428 18.511 20.834 134 HD21 LEU 17 HD21 LEU 17 19.118 19.319 20.002 135 HD22 LEU 17 HD22 LEU 17 17.935 18.657 18.857 136 HD23 LEU 17 HD23 LEU 17 18.761 20.187 18.515 137 H LEU 18 H LEU 18 14.121 22.623 19.620 138 HA LEU 18 HA LEU 18 15.248 25.379 19.923 139 HB2 LEU 18 HB2 LEU 18 12.402 24.319 20.099 140 HB3 LEU 18 HB3 LEU 18 12.843 25.931 20.646 141 HG LEU 18 HG LEU 18 13.288 24.961 17.804 142 HD11 LEU 18 HD11 LEU 18 11.073 26.718 18.945 143 HD12 LEU 18 HD12 LEU 18 11.340 26.335 17.229 144 HD13 LEU 18 HD13 LEU 18 10.880 25.051 18.354 145 HD21 LEU 18 HD21 LEU 18 14.769 26.821 18.417 146 HD22 LEU 18 HD22 LEU 18 13.504 27.396 17.332 147 HD23 LEU 18 HD23 LEU 18 13.386 27.735 19.068 148 H GLY 19 H GLY 19 14.338 26.361 22.104 149 HA2 GLY 19 HA2 GLY 19 14.722 24.486 24.363 150 HA3 GLY 19 HA3 GLY 19 15.935 25.741 24.166 151 H LYS 20 H LYS 20 14.820 25.590 26.501 152 HA LYS 20 HA LYS 20 13.202 28.039 26.764 153 HB2 LYS 20 HB2 LYS 20 11.526 27.067 28.203 154 HB3 LYS 20 HB3 LYS 20 11.516 26.257 26.647 155 HG2 LYS 20 HG2 LYS 20 11.549 24.318 27.760 156 HG3 LYS 20 HG3 LYS 20 13.226 24.636 28.158 157 HD2 LYS 20 HD2 LYS 20 12.180 24.095 30.192 158 HD3 LYS 20 HD3 LYS 20 12.330 25.857 30.262 159 HE2 LYS 20 HE2 LYS 20 10.038 26.175 30.111 160 HE3 LYS 20 HE3 LYS 20 9.812 24.770 29.060 161 HZ1 LYS 20 HZ1 LYS 20 10.106 23.329 30.983 162 HZ2 LYS 20 HZ2 LYS 20 10.280 24.616 31.987 163 HZ3 LYS 20 HZ3 LYS 20 8.851 24.336 31.216 164 H CYS 21 H CYS 21 13.444 29.170 28.573 165 HA CYS 21 HA CYS 21 15.739 28.656 30.331 166 HB2 CYS 21 HB2 CYS 21 15.192 30.915 29.605 167 HB3 CYS 21 HB3 CYS 21 13.546 30.747 30.212 168 H ILE 22 H ILE 22 15.627 27.481 32.230 169 HA ILE 22 HA ILE 22 13.022 26.530 33.185 170 HB ILE 22 HB ILE 22 14.107 25.001 34.427 171 HG12 ILE 22 HG12 ILE 22 16.671 26.616 34.390 172 HG13 ILE 22 HG13 ILE 22 15.580 26.373 35.757 173 HG21 ILE 22 HG21 ILE 22 15.556 23.823 32.938 174 HG22 ILE 22 HG22 ILE 22 14.419 24.746 31.946 175 HG23 ILE 22 HG23 ILE 22 16.091 25.329 32.161 176 HD11 ILE 22 HD11 ILE 22 17.457 24.928 36.061 177 HD12 ILE 22 HD12 ILE 22 16.036 23.934 35.683 178 HD13 ILE 22 HD13 ILE 22 17.275 24.231 34.441 179 H GLY 23 H GLY 23 15.282 29.004 33.931 180 HA2 GLY 23 HA2 GLY 23 13.652 30.738 35.258 181 HA3 GLY 23 HA3 GLY 23 14.267 29.731 36.584 182 H GLU 24 H GLU 24 16.840 29.226 35.780 183 HA GLU 24 HA GLU 24 18.217 31.838 35.276 184 HB2 GLU 24 HB2 GLU 24 19.169 29.758 37.266 185 HB3 GLU 24 HB3 GLU 24 19.808 31.372 37.004 186 HG2 GLU 24 HG2 GLU 24 17.958 32.411 38.097 187 HG3 GLU 24 HG3 GLU 24 16.978 30.948 38.062 188 H LYS 25 H LYS 25 18.346 28.282 35.104 189 HA LYS 25 HA LYS 25 20.519 28.335 33.067 190 HB2 LYS 25 HB2 LYS 25 18.947 25.956 34.110 191 HB3 LYS 25 HB3 LYS 25 20.436 25.925 33.181 192 HG2 LYS 25 HG2 LYS 25 21.670 26.915 35.104 193 HG3 LYS 25 HG3 LYS 25 20.161 26.935 36.042 194 HD2 LYS 25 HD2 LYS 25 19.988 24.428 35.643 195 HD3 LYS 25 HD3 LYS 25 21.633 24.485 34.986 196 HE2 LYS 25 HE2 LYS 25 22.473 25.359 37.156 197 HE3 LYS 25 HE3 LYS 25 20.813 25.413 37.768 198 HZ1 LYS 25 HZ1 LYS 25 21.594 23.403 38.582 199 HZ2 LYS 25 HZ2 LYS 25 20.815 22.904 37.246 200 HZ3 LYS 25 HZ3 LYS 25 22.460 23.017 37.255 201 H CYS 26 H CYS 26 20.188 27.283 30.962 202 HA CYS 26 HA CYS 26 17.355 27.073 30.051 203 HB2 CYS 26 HB2 CYS 26 18.174 29.343 29.527 204 HB3 CYS 26 HB3 CYS 26 19.465 28.648 28.552 205 H LYS 27 H LYS 27 16.873 25.471 28.717 206 HA LYS 27 HA LYS 27 19.022 23.719 27.613 207 HB2 LYS 27 HB2 LYS 27 18.073 21.753 28.688 208 HB3 LYS 27 HB3 LYS 27 18.731 22.923 29.806 209 HG2 LYS 27 HG2 LYS 27 16.817 22.212 30.893 210 HG3 LYS 27 HG3 LYS 27 16.292 23.730 30.161 211 HD2 LYS 27 HD2 LYS 27 15.405 22.335 28.222 212 HD3 LYS 27 HD3 LYS 27 15.721 20.893 29.173 213 HE2 LYS 27 HE2 LYS 27 14.049 23.231 30.191 214 HE3 LYS 27 HE3 LYS 27 13.347 21.947 29.198 215 HZ1 LYS 27 HZ1 LYS 27 13.890 20.344 30.886 216 HZ2 LYS 27 HZ2 LYS 27 14.573 21.479 31.887 217 HZ3 LYS 27 HZ3 LYS 27 12.988 21.508 31.510 218 H CYS 28 H CYS 28 18.380 22.122 26.075 219 HA CYS 28 HA CYS 28 16.305 23.195 24.315 220 HB2 CYS 28 HB2 CYS 28 17.916 20.723 23.766 221 HB3 CYS 28 HB3 CYS 28 17.068 21.765 22.642 222 H VAL 29 H VAL 29 14.538 21.944 23.420 223 HA VAL 29 HA VAL 29 13.262 20.225 25.515 224 HB VAL 29 HB VAL 29 11.130 21.137 24.773 225 HG11 VAL 29 HG11 VAL 29 12.369 22.309 26.513 226 HG12 VAL 29 HG12 VAL 29 13.100 23.370 25.293 227 HG13 VAL 29 HG13 VAL 29 11.345 23.392 25.550 228 HG21 VAL 29 HG21 VAL 29 12.646 22.867 22.800 229 HG22 VAL 29 HG22 VAL 29 11.598 21.493 22.385 230 HG23 VAL 29 HG23 VAL 29 10.915 22.922 23.164 231 HA PRO 30 HA PRO 30 12.503 16.798 22.941 232 HB2 PRO 30 HB2 PRO 30 9.512 17.119 23.172 233 HB3 PRO 30 HB3 PRO 30 10.516 15.643 23.376 234 HG2 PRO 30 HG2 PRO 30 9.662 16.983 25.557 235 HG3 PRO 30 HG3 PRO 30 11.378 16.455 25.469 236 HD2 PRO 30 HD2 PRO 30 10.211 19.172 24.830 237 HD3 PRO 30 HD3 PRO 30 11.623 18.786 25.857 238 H TYR 31 H TYR 31 12.879 16.625 20.924 239 HA TYR 31 HA TYR 31 11.009 17.323 18.767 240 HB2 TYR 31 HB2 TYR 31 13.839 18.324 19.084 241 HB3 TYR 31 HB3 TYR 31 13.275 17.884 17.472 242 HD1 TYR 31 HD1 TYR 31 11.460 19.030 16.373 243 HD2 TYR 31 HD2 TYR 31 12.764 20.242 20.289 244 HE1 TYR 31 HE1 TYR 31 9.958 20.982 16.247 245 HE2 TYR 31 HE2 TYR 31 11.236 22.203 20.182 246 HH TYR 31 HH TYR 31 8.892 22.519 17.507 Start of MODEL 18 1 H1 ALA 1 H1 ALA 1 23.392 31.821 37.666 2 H2 ALA 1 H2 ALA 1 24.947 32.329 37.513 3 H3 ALA 1 H3 ALA 1 24.227 31.480 36.291 4 HA ALA 1 HA ALA 1 23.440 34.161 37.207 5 HB1 ALA 1 HB1 ALA 1 24.201 34.899 34.946 6 HB2 ALA 1 HB2 ALA 1 25.523 34.235 35.921 7 HB3 ALA 1 HB3 ALA 1 24.790 33.262 34.628 8 H PHE 2 H PHE 2 21.774 35.169 35.773 9 HA PHE 2 HA PHE 2 19.501 33.420 35.471 10 HB2 PHE 2 HB2 PHE 2 20.011 36.295 34.632 11 HB3 PHE 2 HB3 PHE 2 18.447 35.511 34.504 12 HD1 PHE 2 HD1 PHE 2 17.714 34.205 36.799 13 HD2 PHE 2 HD2 PHE 2 20.250 37.682 36.521 14 HE1 PHE 2 HE1 PHE 2 17.146 34.805 39.135 15 HE2 PHE 2 HE2 PHE 2 19.688 38.266 38.865 16 HZ PHE 2 HZ PHE 2 18.133 36.842 40.171 17 H CYS 3 H CYS 3 18.102 33.426 33.471 18 HA CYS 3 HA CYS 3 19.375 31.939 31.419 19 HB2 CYS 3 HB2 CYS 3 16.665 33.259 31.715 20 HB3 CYS 3 HB3 CYS 3 17.103 32.441 30.225 21 H ASN 4 H ASN 4 19.714 32.297 29.265 22 HA ASN 4 HA ASN 4 19.353 34.992 28.068 23 HB2 ASN 4 HB2 ASN 4 21.939 33.395 27.959 24 HB3 ASN 4 HB3 ASN 4 21.527 34.695 26.835 25 HD21 ASN 4 HD21 ASN 4 22.865 35.621 30.531 26 HD22 ASN 4 HD22 ASN 4 22.770 33.967 29.950 27 H LEU 5 H LEU 5 17.389 33.836 27.442 28 HA LEU 5 HA LEU 5 17.217 31.373 26.169 29 HB2 LEU 5 HB2 LEU 5 15.324 32.620 27.085 30 HB3 LEU 5 HB3 LEU 5 15.523 33.881 25.868 31 HG LEU 5 HG LEU 5 14.888 32.277 24.078 32 HD11 LEU 5 HD11 LEU 5 14.400 30.360 26.399 33 HD12 LEU 5 HD12 LEU 5 13.864 30.107 24.724 34 HD13 LEU 5 HD13 LEU 5 15.590 30.141 25.087 35 HD21 LEU 5 HD21 LEU 5 12.911 32.415 26.392 36 HD22 LEU 5 HD22 LEU 5 13.181 33.678 25.172 37 HD23 LEU 5 HD23 LEU 5 12.516 32.112 24.684 38 H ARG 6 H ARG 6 17.901 34.529 24.598 39 HA ARG 6 HA ARG 6 17.564 33.593 21.913 40 HB2 ARG 6 HB2 ARG 6 17.661 35.998 22.818 41 HB3 ARG 6 HB3 ARG 6 19.406 35.835 22.874 42 HG2 ARG 6 HG2 ARG 6 18.561 37.046 20.881 43 HG3 ARG 6 HG3 ARG 6 19.541 35.648 20.466 44 HD2 ARG 6 HD2 ARG 6 17.403 36.080 19.095 45 HD3 ARG 6 HD3 ARG 6 17.744 34.436 19.643 46 HE ARG 6 HE ARG 6 15.983 35.956 21.448 47 HH11 ARG 6 HH11 ARG 6 15.882 33.987 18.557 48 HH12 ARG 6 HH12 ARG 6 14.504 33.062 19.114 49 HH21 ARG 6 HH21 ARG 6 14.180 34.944 22.021 50 HH22 ARG 6 HH22 ARG 6 13.511 33.629 21.053 51 H ARG 7 H ARG 7 20.407 33.567 24.003 52 HA ARG 7 HA ARG 7 22.224 32.474 21.968 53 HB2 ARG 7 HB2 ARG 7 22.530 32.370 24.992 54 HB3 ARG 7 HB3 ARG 7 23.794 32.202 23.773 55 HG2 ARG 7 HG2 ARG 7 23.403 34.611 23.102 56 HG3 ARG 7 HG3 ARG 7 22.213 34.734 24.414 57 HD2 ARG 7 HD2 ARG 7 24.122 33.834 25.936 58 HD3 ARG 7 HD3 ARG 7 25.205 34.306 24.617 59 HE ARG 7 HE ARG 7 23.698 36.594 25.071 60 HH11 ARG 7 HH11 ARG 7 25.728 34.623 27.149 61 HH12 ARG 7 HH12 ARG 7 25.951 35.923 28.301 62 HH21 ARG 7 HH21 ARG 7 24.009 38.155 26.518 63 HH22 ARG 7 HH22 ARG 7 24.953 37.888 27.977 64 H CYS 8 H CYS 8 20.106 31.117 24.437 65 HA CYS 8 HA CYS 8 20.965 28.373 24.295 66 HB2 CYS 8 HB2 CYS 8 19.704 29.360 26.167 67 HB3 CYS 8 HB3 CYS 8 18.344 29.675 25.103 68 H GLU 9 H GLU 9 18.268 30.135 22.705 69 HA GLU 9 HA GLU 9 17.231 28.066 21.090 70 HB2 GLU 9 HB2 GLU 9 17.353 31.090 20.910 71 HB3 GLU 9 HB3 GLU 9 16.663 30.179 19.584 72 HG2 GLU 9 HG2 GLU 9 15.669 29.702 22.407 73 HG3 GLU 9 HG3 GLU 9 15.114 31.087 21.467 74 H LEU 10 H LEU 10 19.836 30.419 20.226 75 HA LEU 10 HA LEU 10 20.211 29.293 17.584 76 HB2 LEU 10 HB2 LEU 10 22.025 31.018 19.319 77 HB3 LEU 10 HB3 LEU 10 22.306 30.681 17.610 78 HG LEU 10 HG LEU 10 19.795 32.040 18.656 79 HD11 LEU 10 HD11 LEU 10 21.778 33.410 19.173 80 HD12 LEU 10 HD12 LEU 10 22.301 33.308 17.474 81 HD13 LEU 10 HD13 LEU 10 20.798 34.156 17.907 82 HD21 LEU 10 HD21 LEU 10 19.518 31.037 16.417 83 HD22 LEU 10 HD22 LEU 10 19.539 32.796 16.316 84 HD23 LEU 10 HD23 LEU 10 20.986 31.876 15.858 85 H SER 11 H SER 11 21.869 28.774 20.668 86 HA SER 11 HA SER 11 23.938 27.026 19.741 87 HB2 SER 11 HB2 SER 11 22.486 26.966 22.422 88 HB3 SER 11 HB3 SER 11 24.007 26.133 22.043 89 HG SER 11 HG SER 11 23.474 28.912 22.182 90 H CYS 12 H CYS 12 20.619 26.230 20.910 91 HA CYS 12 HA CYS 12 20.962 23.417 20.250 92 HB2 CYS 12 HB2 CYS 12 18.756 25.093 21.420 93 HB3 CYS 12 HB3 CYS 12 18.422 23.464 20.847 94 H ARG 13 H ARG 13 19.822 26.185 18.376 95 HA ARG 13 HA ARG 13 18.519 24.641 16.319 96 HB2 ARG 13 HB2 ARG 13 18.384 27.109 16.425 97 HB3 ARG 13 HB3 ARG 13 20.109 27.229 16.025 98 HG2 ARG 13 HG2 ARG 13 19.719 26.165 13.836 99 HG3 ARG 13 HG3 ARG 13 18.034 25.852 14.271 100 HD2 ARG 13 HD2 ARG 13 18.149 27.691 12.761 101 HD3 ARG 13 HD3 ARG 13 17.590 28.283 14.337 102 HE ARG 13 HE ARG 13 20.347 28.701 14.393 103 HH11 ARG 13 HH11 ARG 13 17.887 29.713 12.071 104 HH12 ARG 13 HH12 ARG 13 18.856 31.084 11.595 105 HH21 ARG 13 HH21 ARG 13 21.347 30.486 13.875 106 HH22 ARG 13 HH22 ARG 13 20.520 31.740 12.930 107 H SER 14 H SER 14 21.968 25.417 16.807 108 HA SER 14 HA SER 14 22.920 24.006 14.525 109 HB2 SER 14 HB2 SER 14 25.057 24.234 15.393 110 HB3 SER 14 HB3 SER 14 24.199 25.613 16.089 111 HG SER 14 HG SER 14 23.982 24.384 18.043 112 H LEU 15 H LEU 15 21.532 22.726 17.371 113 HA LEU 15 HA LEU 15 22.593 19.975 16.901 114 HB2 LEU 15 HB2 LEU 15 21.385 21.333 19.334 115 HB3 LEU 15 HB3 LEU 15 21.721 19.610 19.265 116 HG LEU 15 HG LEU 15 23.888 21.720 18.883 117 HD11 LEU 15 HD11 LEU 15 23.050 20.268 21.421 118 HD12 LEU 15 HD12 LEU 15 24.492 21.292 21.228 119 HD13 LEU 15 HD13 LEU 15 22.881 22.010 21.099 120 HD21 LEU 15 HD21 LEU 15 24.451 19.467 18.047 121 HD22 LEU 15 HD22 LEU 15 25.368 19.823 19.510 122 HD23 LEU 15 HD23 LEU 15 23.958 18.753 19.599 123 H GLY 16 H GLY 16 20.013 21.761 15.890 124 HA2 GLY 16 HA2 GLY 16 18.093 21.087 14.858 125 HA3 GLY 16 HA3 GLY 16 18.513 19.408 15.182 126 H LEU 17 H LEU 17 18.016 21.815 17.765 127 HA LEU 17 HA LEU 17 15.222 21.001 18.158 128 HB2 LEU 17 HB2 LEU 17 15.454 20.544 20.498 129 HB3 LEU 17 HB3 LEU 17 16.312 19.355 19.534 130 HG LEU 17 HG LEU 17 17.551 21.607 21.158 131 HD11 LEU 17 HD11 LEU 17 16.415 19.977 22.589 132 HD12 LEU 17 HD12 LEU 17 17.235 18.641 21.762 133 HD13 LEU 17 HD13 LEU 17 18.168 19.790 22.741 134 HD21 LEU 17 HD21 LEU 17 18.834 19.170 19.852 135 HD22 LEU 17 HD22 LEU 17 19.112 20.869 19.421 136 HD23 LEU 17 HD23 LEU 17 19.648 20.271 20.988 137 H LEU 18 H LEU 18 14.131 22.335 19.886 138 HA LEU 18 HA LEU 18 15.002 25.170 19.625 139 HB2 LEU 18 HB2 LEU 18 12.404 23.967 20.624 140 HB3 LEU 18 HB3 LEU 18 12.793 25.684 20.711 141 HG LEU 18 HG LEU 18 12.624 24.073 18.154 142 HD11 LEU 18 HD11 LEU 18 10.720 26.153 19.330 143 HD12 LEU 18 HD12 LEU 18 10.523 25.320 17.773 144 HD13 LEU 18 HD13 LEU 18 10.423 24.402 19.283 145 HD21 LEU 18 HD21 LEU 18 12.997 27.051 18.600 146 HD22 LEU 18 HD22 LEU 18 14.125 25.937 17.808 147 HD23 LEU 18 HD23 LEU 18 12.585 26.310 17.038 148 H GLY 19 H GLY 19 15.026 26.527 21.336 149 HA2 GLY 19 HA2 GLY 19 16.258 25.351 23.809 150 HA3 GLY 19 HA3 GLY 19 16.645 26.928 23.154 151 H LYS 20 H LYS 20 15.605 26.018 25.824 152 HA LYS 20 HA LYS 20 13.454 28.027 26.152 153 HB2 LYS 20 HB2 LYS 20 13.249 25.157 27.160 154 HB3 LYS 20 HB3 LYS 20 12.165 26.463 27.604 155 HG2 LYS 20 HG2 LYS 20 12.480 25.348 24.784 156 HG3 LYS 20 HG3 LYS 20 11.214 24.928 25.934 157 HD2 LYS 20 HD2 LYS 20 10.354 27.195 25.956 158 HD3 LYS 20 HD3 LYS 20 11.629 27.733 24.857 159 HE2 LYS 20 HE2 LYS 20 10.794 26.009 23.187 160 HE3 LYS 20 HE3 LYS 20 9.434 25.695 24.284 161 HZ1 LYS 20 HZ1 LYS 20 8.890 28.094 24.073 162 HZ2 LYS 20 HZ2 LYS 20 10.098 28.261 22.955 163 HZ3 LYS 20 HZ3 LYS 20 8.822 27.313 22.610 164 H CYS 21 H CYS 21 13.321 28.908 28.176 165 HA CYS 21 HA CYS 21 15.651 28.544 29.992 166 HB2 CYS 21 HB2 CYS 21 15.032 30.826 29.413 167 HB3 CYS 21 HB3 CYS 21 13.359 30.527 29.883 168 H ILE 22 H ILE 22 15.531 27.576 31.951 169 HA ILE 22 HA ILE 22 12.887 27.153 33.251 170 HB ILE 22 HB ILE 22 15.064 25.040 33.074 171 HG12 ILE 22 HG12 ILE 22 12.178 25.169 32.072 172 HG13 ILE 22 HG13 ILE 22 13.639 25.076 31.092 173 HG21 ILE 22 HG21 ILE 22 13.635 23.705 34.584 174 HG22 ILE 22 HG22 ILE 22 14.093 25.190 35.384 175 HG23 ILE 22 HG23 ILE 22 12.462 25.034 34.687 176 HD11 ILE 22 HD11 ILE 22 12.639 22.923 31.040 177 HD12 ILE 22 HD12 ILE 22 14.066 22.775 32.093 178 HD13 ILE 22 HD13 ILE 22 12.433 22.875 32.794 179 H GLY 23 H GLY 23 12.981 28.644 34.711 180 HA2 GLY 23 HA2 GLY 23 13.482 29.842 36.566 181 HA3 GLY 23 HA3 GLY 23 14.649 28.592 36.990 182 H GLU 24 H GLU 24 16.701 28.690 35.846 183 HA GLU 24 HA GLU 24 17.731 31.456 35.301 184 HB2 GLU 24 HB2 GLU 24 19.037 29.360 37.076 185 HB3 GLU 24 HB3 GLU 24 19.711 30.931 36.639 186 HG2 GLU 24 HG2 GLU 24 17.903 32.079 37.862 187 HG3 GLU 24 HG3 GLU 24 17.211 30.515 38.321 188 H LYS 25 H LYS 25 17.580 28.235 34.133 189 HA LYS 25 HA LYS 25 20.134 28.588 32.603 190 HB2 LYS 25 HB2 LYS 25 19.168 26.075 33.975 191 HB3 LYS 25 HB3 LYS 25 20.606 26.192 32.962 192 HG2 LYS 25 HG2 LYS 25 21.753 27.564 34.550 193 HG3 LYS 25 HG3 LYS 25 20.287 27.889 35.477 194 HD2 LYS 25 HD2 LYS 25 21.544 26.378 36.740 195 HD3 LYS 25 HD3 LYS 25 20.144 25.504 36.121 196 HE2 LYS 25 HE2 LYS 25 21.565 24.442 34.368 197 HE3 LYS 25 HE3 LYS 25 22.957 25.384 34.959 198 HZ1 LYS 25 HZ1 LYS 25 21.511 23.280 36.504 199 HZ2 LYS 25 HZ2 LYS 25 23.059 23.215 35.994 200 HZ3 LYS 25 HZ3 LYS 25 22.620 24.271 37.137 201 H CYS 26 H CYS 26 20.386 27.601 30.674 202 HA CYS 26 HA CYS 26 18.088 27.242 28.956 203 HB2 CYS 26 HB2 CYS 26 20.184 28.166 28.152 204 HB3 CYS 26 HB3 CYS 26 21.062 26.734 28.659 205 H LYS 27 H LYS 27 16.835 25.487 28.873 206 HA LYS 27 HA LYS 27 17.987 22.742 28.837 207 HB2 LYS 27 HB2 LYS 27 15.665 23.838 30.465 208 HB3 LYS 27 HB3 LYS 27 15.681 22.157 29.964 209 HG2 LYS 27 HG2 LYS 27 17.844 23.459 31.664 210 HG3 LYS 27 HG3 LYS 27 16.514 22.453 32.257 211 HD2 LYS 27 HD2 LYS 27 17.346 20.582 30.758 212 HD3 LYS 27 HD3 LYS 27 18.766 21.585 30.408 213 HE2 LYS 27 HE2 LYS 27 19.333 21.654 32.790 214 HE3 LYS 27 HE3 LYS 27 17.894 20.694 33.187 215 HZ1 LYS 27 HZ1 LYS 27 19.869 19.287 33.062 216 HZ2 LYS 27 HZ2 LYS 27 18.841 18.894 31.831 217 HZ3 LYS 27 HZ3 LYS 27 20.187 19.803 31.528 218 H CYS 28 H CYS 28 17.947 22.589 26.676 219 HA CYS 28 HA CYS 28 15.845 23.536 24.963 220 HB2 CYS 28 HB2 CYS 28 18.035 21.517 24.432 221 HB3 CYS 28 HB3 CYS 28 17.024 22.293 23.222 222 H VAL 29 H VAL 29 14.383 22.323 23.673 223 HA VAL 29 HA VAL 29 13.091 20.193 25.284 224 HB VAL 29 HB VAL 29 11.079 20.733 23.869 225 HG11 VAL 29 HG11 VAL 29 10.569 22.736 25.224 226 HG12 VAL 29 HG12 VAL 29 11.356 21.475 26.179 227 HG13 VAL 29 HG13 VAL 29 12.293 22.879 25.655 228 HG21 VAL 29 HG21 VAL 29 10.943 22.897 22.763 229 HG22 VAL 29 HG22 VAL 29 12.621 23.294 23.160 230 HG23 VAL 29 HG23 VAL 29 12.266 21.984 22.018 231 HA PRO 30 HA PRO 30 14.407 17.187 22.513 232 HB2 PRO 30 HB2 PRO 30 12.724 15.065 22.967 233 HB3 PRO 30 HB3 PRO 30 13.930 15.666 24.146 234 HG2 PRO 30 HG2 PRO 30 10.970 16.290 24.026 235 HG3 PRO 30 HG3 PRO 30 11.963 15.835 25.454 236 HD2 PRO 30 HD2 PRO 30 11.334 18.430 24.854 237 HD3 PRO 30 HD3 PRO 30 12.890 17.986 25.609 238 H TYR 31 H TYR 31 14.310 16.467 20.510 239 HA TYR 31 HA TYR 31 11.813 16.750 18.865 240 HB2 TYR 31 HB2 TYR 31 14.643 17.639 18.383 241 HB3 TYR 31 HB3 TYR 31 13.745 17.016 17.020 242 HD1 TYR 31 HD1 TYR 31 12.495 18.437 15.720 243 HD2 TYR 31 HD2 TYR 31 13.240 19.456 19.836 244 HE1 TYR 31 HE1 TYR 31 11.248 20.567 15.414 245 HE2 TYR 31 HE2 TYR 31 11.943 21.577 19.544 246 HH TYR 31 HH TYR 31 10.818 22.677 16.417 Start of MODEL 19 1 H1 ALA 1 H1 ALA 1 20.182 37.223 38.081 2 H2 ALA 1 H2 ALA 1 21.406 36.543 38.957 3 H3 ALA 1 H3 ALA 1 20.279 35.583 38.190 4 HA ALA 1 HA ALA 1 22.145 37.385 36.815 5 HB1 ALA 1 HB1 ALA 1 23.430 35.577 37.828 6 HB2 ALA 1 HB2 ALA 1 22.316 34.375 37.162 7 HB3 ALA 1 HB3 ALA 1 23.335 35.331 36.083 8 H PHE 2 H PHE 2 21.699 37.711 34.680 9 HA PHE 2 HA PHE 2 19.026 37.065 33.851 10 HB2 PHE 2 HB2 PHE 2 21.277 38.362 32.289 11 HB3 PHE 2 HB3 PHE 2 19.566 38.380 31.859 12 HD1 PHE 2 HD1 PHE 2 22.089 40.307 33.353 13 HD2 PHE 2 HD2 PHE 2 17.958 39.190 33.904 14 HE1 PHE 2 HE1 PHE 2 21.708 42.347 34.707 15 HE2 PHE 2 HE2 PHE 2 17.595 41.206 35.276 16 HZ PHE 2 HZ PHE 2 19.462 42.819 35.662 17 H CYS 3 H CYS 3 18.232 35.440 32.640 18 HA CYS 3 HA CYS 3 20.005 33.360 31.534 19 HB2 CYS 3 HB2 CYS 3 17.856 33.021 32.837 20 HB3 CYS 3 HB3 CYS 3 16.986 33.601 31.425 21 H ASN 4 H ASN 4 20.901 33.647 29.490 22 HA ASN 4 HA ASN 4 19.669 35.517 27.595 23 HB2 ASN 4 HB2 ASN 4 22.151 35.365 28.046 24 HB3 ASN 4 HB3 ASN 4 22.175 33.835 27.181 25 HD21 ASN 4 HD21 ASN 4 22.328 37.276 25.133 26 HD22 ASN 4 HD22 ASN 4 22.511 37.179 26.892 27 H LEU 5 H LEU 5 17.728 34.496 27.223 28 HA LEU 5 HA LEU 5 17.412 31.870 26.140 29 HB2 LEU 5 HB2 LEU 5 15.558 33.102 27.153 30 HB3 LEU 5 HB3 LEU 5 15.650 34.324 25.883 31 HG LEU 5 HG LEU 5 15.020 32.607 24.182 32 HD11 LEU 5 HD11 LEU 5 14.632 30.796 26.601 33 HD12 LEU 5 HD12 LEU 5 14.061 30.452 24.956 34 HD13 LEU 5 HD13 LEU 5 15.790 30.533 25.274 35 HD21 LEU 5 HD21 LEU 5 13.113 32.810 26.524 36 HD22 LEU 5 HD22 LEU 5 13.319 34.017 25.236 37 HD23 LEU 5 HD23 LEU 5 12.685 32.408 24.852 38 H ARG 6 H ARG 6 18.032 35.027 24.503 39 HA ARG 6 HA ARG 6 17.597 34.035 21.864 40 HB2 ARG 6 HB2 ARG 6 18.885 35.955 21.060 41 HB3 ARG 6 HB3 ARG 6 17.647 36.374 22.230 42 HG2 ARG 6 HG2 ARG 6 19.372 36.576 24.002 43 HG3 ARG 6 HG3 ARG 6 20.629 36.206 22.809 44 HD2 ARG 6 HD2 ARG 6 18.694 38.501 22.449 45 HD3 ARG 6 HD3 ARG 6 20.179 38.673 23.401 46 HE ARG 6 HE ARG 6 20.951 37.533 20.946 47 HH11 ARG 6 HH11 ARG 6 19.566 40.624 21.904 48 HH12 ARG 6 HH12 ARG 6 20.495 41.483 20.685 49 HH21 ARG 6 HH21 ARG 6 21.992 38.598 19.494 50 HH22 ARG 6 HH22 ARG 6 21.871 40.348 19.303 51 H ARG 7 H ARG 7 20.708 33.893 23.736 52 HA ARG 7 HA ARG 7 21.955 32.348 21.575 53 HB2 ARG 7 HB2 ARG 7 22.755 32.816 24.465 54 HB3 ARG 7 HB3 ARG 7 23.655 31.796 23.337 55 HG2 ARG 7 HG2 ARG 7 23.745 33.768 21.739 56 HG3 ARG 7 HG3 ARG 7 23.160 34.784 23.059 57 HD2 ARG 7 HD2 ARG 7 25.684 33.075 23.058 58 HD3 ARG 7 HD3 ARG 7 25.631 34.813 22.823 59 HE ARG 7 HE ARG 7 25.195 33.328 25.362 60 HH11 ARG 7 HH11 ARG 7 25.284 36.498 23.847 61 HH12 ARG 7 HH12 ARG 7 25.592 37.305 25.357 62 HH21 ARG 7 HH21 ARG 7 25.535 34.356 27.206 63 HH22 ARG 7 HH22 ARG 7 25.627 36.117 27.259 64 H CYS 8 H CYS 8 20.022 31.488 24.398 65 HA CYS 8 HA CYS 8 20.641 28.692 24.427 66 HB2 CYS 8 HB2 CYS 8 19.428 29.943 26.209 67 HB3 CYS 8 HB3 CYS 8 18.048 30.100 25.128 68 H GLU 9 H GLU 9 18.010 30.476 22.725 69 HA GLU 9 HA GLU 9 16.932 28.266 21.323 70 HB2 GLU 9 HB2 GLU 9 16.984 31.244 20.696 71 HB3 GLU 9 HB3 GLU 9 16.105 30.061 19.725 72 HG2 GLU 9 HG2 GLU 9 14.845 29.355 21.781 73 HG3 GLU 9 HG3 GLU 9 15.621 30.660 22.671 74 H LEU 10 H LEU 10 19.562 30.516 20.226 75 HA LEU 10 HA LEU 10 19.778 29.074 17.716 76 HB2 LEU 10 HB2 LEU 10 21.392 30.556 17.028 77 HB3 LEU 10 HB3 LEU 10 20.319 31.494 18.051 78 HG LEU 10 HG LEU 10 22.178 30.952 19.903 79 HD11 LEU 10 HD11 LEU 10 24.448 31.016 18.965 80 HD12 LEU 10 HD12 LEU 10 23.631 29.541 18.437 81 HD13 LEU 10 HD13 LEU 10 23.786 30.915 17.324 82 HD21 LEU 10 HD21 LEU 10 22.522 33.019 17.706 83 HD22 LEU 10 HD22 LEU 10 21.513 33.204 19.156 84 HD23 LEU 10 HD23 LEU 10 23.279 33.082 19.312 85 H SER 11 H SER 11 21.382 28.720 20.825 86 HA SER 11 HA SER 11 23.501 26.966 20.056 87 HB2 SER 11 HB2 SER 11 23.452 28.107 22.208 88 HB3 SER 11 HB3 SER 11 21.955 27.271 22.657 89 HG SER 11 HG SER 11 23.145 25.788 23.434 90 H CYS 12 H CYS 12 20.125 26.286 21.132 91 HA CYS 12 HA CYS 12 20.361 23.424 20.767 92 HB2 CYS 12 HB2 CYS 12 17.919 25.227 20.860 93 HB3 CYS 12 HB3 CYS 12 17.917 23.472 21.048 94 H ARG 13 H ARG 13 19.263 26.107 18.645 95 HA ARG 13 HA ARG 13 18.400 24.443 16.473 96 HB2 ARG 13 HB2 ARG 13 17.746 26.788 16.753 97 HB3 ARG 13 HB3 ARG 13 19.410 27.309 16.431 98 HG2 ARG 13 HG2 ARG 13 19.302 26.564 14.143 99 HG3 ARG 13 HG3 ARG 13 17.810 25.660 14.431 100 HD2 ARG 13 HD2 ARG 13 17.384 27.740 13.191 101 HD3 ARG 13 HD3 ARG 13 16.547 27.702 14.736 102 HE ARG 13 HE ARG 13 17.807 29.488 15.503 103 HH11 ARG 13 HH11 ARG 13 19.310 28.472 12.474 104 HH12 ARG 13 HH12 ARG 13 20.288 29.933 12.424 105 HH21 ARG 13 HH21 ARG 13 18.955 31.242 15.301 106 HH22 ARG 13 HH22 ARG 13 19.918 31.558 13.856 107 H SER 14 H SER 14 21.663 25.408 17.390 108 HA SER 14 HA SER 14 23.007 24.685 14.999 109 HB2 SER 14 HB2 SER 14 24.087 25.720 17.005 110 HB3 SER 14 HB3 SER 14 23.935 24.178 17.851 111 HG SER 14 HG SER 14 25.946 24.431 16.954 112 H LEU 15 H LEU 15 21.906 22.662 17.718 113 HA LEU 15 HA LEU 15 22.761 20.112 16.615 114 HB2 LEU 15 HB2 LEU 15 20.635 20.663 18.704 115 HB3 LEU 15 HB3 LEU 15 21.566 19.184 18.496 116 HG LEU 15 HG LEU 15 22.659 21.876 19.456 117 HD11 LEU 15 HD11 LEU 15 21.089 20.812 21.029 118 HD12 LEU 15 HD12 LEU 15 22.050 19.316 20.970 119 HD13 LEU 15 HD13 LEU 15 22.746 20.814 21.633 120 HD21 LEU 15 HD21 LEU 15 24.425 20.583 18.344 121 HD22 LEU 15 HD22 LEU 15 24.658 20.538 20.097 122 HD23 LEU 15 HD23 LEU 15 23.967 19.131 19.259 123 H GLY 16 H GLY 16 19.795 22.018 16.575 124 HA2 GLY 16 HA2 GLY 16 18.384 21.809 14.535 125 HA3 GLY 16 HA3 GLY 16 18.442 20.061 14.740 126 H LEU 17 H LEU 17 18.132 21.551 17.799 127 HA LEU 17 HA LEU 17 15.183 21.107 17.793 128 HB2 LEU 17 HB2 LEU 17 15.499 20.478 20.210 129 HB3 LEU 17 HB3 LEU 17 15.871 19.279 18.991 130 HG LEU 17 HG LEU 17 18.073 20.915 20.291 131 HD11 LEU 17 HD11 LEU 17 18.260 19.169 22.005 132 HD12 LEU 17 HD12 LEU 17 16.633 19.873 22.081 133 HD13 LEU 17 HD13 LEU 17 16.871 18.300 21.321 134 HD21 LEU 17 HD21 LEU 17 17.959 18.048 19.218 135 HD22 LEU 17 HD22 LEU 17 18.691 19.403 18.360 136 HD23 LEU 17 HD23 LEU 17 19.387 18.847 19.890 137 H LEU 18 H LEU 18 14.116 22.151 19.807 138 HA LEU 18 HA LEU 18 14.762 25.021 19.608 139 HB2 LEU 18 HB2 LEU 18 12.351 23.437 20.513 140 HB3 LEU 18 HB3 LEU 18 12.557 25.112 21.004 141 HG LEU 18 HG LEU 18 12.701 25.818 18.632 142 HD11 LEU 18 HD11 LEU 18 11.948 22.929 18.015 143 HD12 LEU 18 HD12 LEU 18 11.827 24.281 16.871 144 HD13 LEU 18 HD13 LEU 18 13.408 23.792 17.470 145 HD21 LEU 18 HD21 LEU 18 10.594 25.897 19.898 146 HD22 LEU 18 HD22 LEU 18 10.293 25.542 18.190 147 HD23 LEU 18 HD23 LEU 18 10.222 24.235 19.395 148 H GLY 19 H GLY 19 14.864 26.405 21.435 149 HA2 GLY 19 HA2 GLY 19 15.941 25.153 23.944 150 HA3 GLY 19 HA3 GLY 19 16.541 26.651 23.251 151 H LYS 20 H LYS 20 15.444 25.998 25.914 152 HA LYS 20 HA LYS 20 13.556 28.284 26.225 153 HB2 LYS 20 HB2 LYS 20 13.129 25.506 27.422 154 HB3 LYS 20 HB3 LYS 20 12.192 26.935 27.834 155 HG2 LYS 20 HG2 LYS 20 12.234 25.602 25.097 156 HG3 LYS 20 HG3 LYS 20 10.999 25.388 26.333 157 HD2 LYS 20 HD2 LYS 20 10.380 27.772 26.201 158 HD3 LYS 20 HD3 LYS 20 11.661 28.053 25.004 159 HE2 LYS 20 HE2 LYS 20 10.547 26.196 23.606 160 HE3 LYS 20 HE3 LYS 20 9.176 26.314 24.702 161 HZ1 LYS 20 HZ1 LYS 20 10.297 28.531 23.080 162 HZ2 LYS 20 HZ2 LYS 20 8.929 27.719 22.721 163 HZ3 LYS 20 HZ3 LYS 20 8.980 28.669 24.075 164 H CYS 21 H CYS 21 13.654 29.302 28.272 165 HA CYS 21 HA CYS 21 15.986 28.533 29.971 166 HB2 CYS 21 HB2 CYS 21 15.689 30.945 29.352 167 HB3 CYS 21 HB3 CYS 21 14.161 30.936 30.248 168 H ILE 22 H ILE 22 15.637 27.199 31.655 169 HA ILE 22 HA ILE 22 12.872 26.963 32.804 170 HB ILE 22 HB ILE 22 15.076 24.901 32.546 171 HG12 ILE 22 HG12 ILE 22 12.243 25.093 31.422 172 HG13 ILE 22 HG13 ILE 22 13.743 25.264 30.513 173 HG21 ILE 22 HG21 ILE 22 12.412 24.686 34.027 174 HG22 ILE 22 HG22 ILE 22 13.563 23.357 33.757 175 HG23 ILE 22 HG23 ILE 22 14.021 24.695 34.783 176 HD11 ILE 22 HD11 ILE 22 14.312 22.870 31.148 177 HD12 ILE 22 HD12 ILE 22 12.650 22.731 31.764 178 HD13 ILE 22 HD13 ILE 22 12.925 23.086 30.056 179 H GLY 23 H GLY 23 12.868 28.456 34.315 180 HA2 GLY 23 HA2 GLY 23 13.178 29.495 36.300 181 HA3 GLY 23 HA3 GLY 23 14.154 28.128 36.827 182 H GLU 24 H GLU 24 16.350 28.097 36.073 183 HA GLU 24 HA GLU 24 17.608 30.829 36.307 184 HB2 GLU 24 HB2 GLU 24 18.473 28.178 37.515 185 HB3 GLU 24 HB3 GLU 24 19.282 29.717 37.744 186 HG2 GLU 24 HG2 GLU 24 16.452 29.040 38.698 187 HG3 GLU 24 HG3 GLU 24 17.902 29.008 39.683 188 H LYS 25 H LYS 25 17.610 27.973 34.351 189 HA LYS 25 HA LYS 25 20.069 28.804 32.905 190 HB2 LYS 25 HB2 LYS 25 19.698 26.026 34.096 191 HB3 LYS 25 HB3 LYS 25 20.974 26.477 32.981 192 HG2 LYS 25 HG2 LYS 25 20.636 27.607 35.789 193 HG3 LYS 25 HG3 LYS 25 21.711 26.299 35.324 194 HD2 LYS 25 HD2 LYS 25 23.029 27.771 33.879 195 HD3 LYS 25 HD3 LYS 25 21.894 29.101 34.146 196 HE2 LYS 25 HE2 LYS 25 23.782 29.509 35.527 197 HE3 LYS 25 HE3 LYS 25 22.432 29.092 36.579 198 HZ1 LYS 25 HZ1 LYS 25 24.518 27.171 35.714 199 HZ2 LYS 25 HZ2 LYS 25 24.558 27.978 37.145 200 HZ3 LYS 25 HZ3 LYS 25 23.353 26.894 36.858 201 H CYS 26 H CYS 26 20.348 28.006 30.858 202 HA CYS 26 HA CYS 26 18.018 27.463 29.260 203 HB2 CYS 26 HB2 CYS 26 19.870 28.753 28.409 204 HB3 CYS 26 HB3 CYS 26 21.004 27.450 28.789 205 H LYS 27 H LYS 27 17.127 25.631 28.504 206 HA LYS 27 HA LYS 27 18.669 23.072 28.330 207 HB2 LYS 27 HB2 LYS 27 15.970 23.579 29.568 208 HB3 LYS 27 HB3 LYS 27 16.096 22.198 28.501 209 HG2 LYS 27 HG2 LYS 27 16.416 21.327 30.605 210 HG3 LYS 27 HG3 LYS 27 18.015 21.320 29.865 211 HD2 LYS 27 HD2 LYS 27 18.725 23.190 31.233 212 HD3 LYS 27 HD3 LYS 27 17.058 23.490 31.770 213 HE2 LYS 27 HE2 LYS 27 16.994 21.284 32.878 214 HE3 LYS 27 HE3 LYS 27 18.650 20.945 32.327 215 HZ1 LYS 27 HZ1 LYS 27 19.427 22.763 33.688 216 HZ2 LYS 27 HZ2 LYS 27 17.935 23.202 34.125 217 HZ3 LYS 27 HZ3 LYS 27 18.551 21.742 34.638 218 H CYS 28 H CYS 28 18.135 21.763 26.535 219 HA CYS 28 HA CYS 28 16.534 23.094 24.396 220 HB2 CYS 28 HB2 CYS 28 18.367 20.728 24.015 221 HB3 CYS 28 HB3 CYS 28 17.569 21.716 22.790 222 H VAL 29 H VAL 29 14.725 22.118 23.569 223 HA VAL 29 HA VAL 29 13.617 19.845 25.150 224 HB VAL 29 HB VAL 29 11.423 20.566 24.218 225 HG11 VAL 29 HG11 VAL 29 12.909 22.660 25.855 226 HG12 VAL 29 HG12 VAL 29 11.153 22.448 25.760 227 HG13 VAL 29 HG13 VAL 29 12.153 21.186 26.488 228 HG21 VAL 29 HG21 VAL 29 12.261 21.888 22.259 229 HG22 VAL 29 HG22 VAL 29 11.126 22.770 23.286 230 HG23 VAL 29 HG23 VAL 29 12.851 23.127 23.386 231 HA PRO 30 HA PRO 30 14.311 17.190 21.859 232 HB2 PRO 30 HB2 PRO 30 12.461 15.174 22.151 233 HB3 PRO 30 HB3 PRO 30 13.833 15.455 23.263 234 HG2 PRO 30 HG2 PRO 30 10.958 16.405 23.564 235 HG3 PRO 30 HG3 PRO 30 11.989 15.578 24.776 236 HD2 PRO 30 HD2 PRO 30 11.707 18.265 24.784 237 HD3 PRO 30 HD3 PRO 30 13.294 17.521 25.142 238 H TYR 31 H TYR 31 14.099 17.460 19.813 239 HA TYR 31 HA TYR 31 11.529 17.214 18.349 240 HB2 TYR 31 HB2 TYR 31 13.585 19.422 18.115 241 HB3 TYR 31 HB3 TYR 31 12.702 18.896 16.704 242 HD1 TYR 31 HD1 TYR 31 12.176 20.224 20.175 243 HD2 TYR 31 HD2 TYR 31 10.573 19.716 16.217 244 HE1 TYR 31 HE1 TYR 31 10.225 21.634 20.793 245 HE2 TYR 31 HE2 TYR 31 8.633 21.154 16.812 246 HH TYR 31 HH TYR 31 7.453 21.959 18.565 Start of MODEL 20 1 H1 ALA 1 H1 ALA 1 14.738 35.873 36.945 2 H2 ALA 1 H2 ALA 1 15.042 37.488 36.965 3 H3 ALA 1 H3 ALA 1 15.125 36.617 38.362 4 HA ALA 1 HA ALA 1 17.314 37.126 37.585 5 HB1 ALA 1 HB1 ALA 1 16.614 34.176 37.259 6 HB2 ALA 1 HB2 ALA 1 18.219 34.839 37.590 7 HB3 ALA 1 HB3 ALA 1 16.928 35.005 38.798 8 H PHE 2 H PHE 2 18.932 36.934 35.952 9 HA PHE 2 HA PHE 2 18.002 37.346 33.240 10 HB2 PHE 2 HB2 PHE 2 20.734 37.057 34.512 11 HB3 PHE 2 HB3 PHE 2 20.517 37.219 32.776 12 HD1 PHE 2 HD1 PHE 2 19.595 39.243 31.750 13 HD2 PHE 2 HD2 PHE 2 20.338 39.006 35.992 14 HE1 PHE 2 HE1 PHE 2 19.395 41.699 31.921 15 HE2 PHE 2 HE2 PHE 2 20.170 41.475 36.158 16 HZ PHE 2 HZ PHE 2 19.699 42.836 34.119 17 H CYS 3 H CYS 3 18.168 35.980 31.442 18 HA CYS 3 HA CYS 3 19.395 33.289 31.673 19 HB2 CYS 3 HB2 CYS 3 17.015 33.203 32.486 20 HB3 CYS 3 HB3 CYS 3 16.488 33.633 30.865 21 H ASN 4 H ASN 4 20.414 32.770 29.803 22 HA ASN 4 HA ASN 4 20.464 34.744 27.677 23 HB2 ASN 4 HB2 ASN 4 21.975 32.111 27.885 24 HB3 ASN 4 HB3 ASN 4 22.355 33.471 26.840 25 HD21 ASN 4 HD21 ASN 4 24.224 35.203 29.255 26 HD22 ASN 4 HD22 ASN 4 23.345 35.359 27.731 27 H LEU 5 H LEU 5 17.916 33.764 27.568 28 HA LEU 5 HA LEU 5 17.395 31.371 26.297 29 HB2 LEU 5 HB2 LEU 5 15.753 32.712 27.490 30 HB3 LEU 5 HB3 LEU 5 15.782 33.941 26.229 31 HG LEU 5 HG LEU 5 14.787 32.374 24.614 32 HD11 LEU 5 HD11 LEU 5 14.772 30.400 26.943 33 HD12 LEU 5 HD12 LEU 5 13.872 30.199 25.423 34 HD13 LEU 5 HD13 LEU 5 15.631 30.211 25.390 35 HD21 LEU 5 HD21 LEU 5 12.576 32.194 25.673 36 HD22 LEU 5 HD22 LEU 5 13.298 32.456 27.277 37 HD23 LEU 5 HD23 LEU 5 13.326 33.749 26.055 38 H ARG 6 H ARG 6 17.650 34.523 24.457 39 HA ARG 6 HA ARG 6 17.357 33.124 21.924 40 HB2 ARG 6 HB2 ARG 6 18.513 35.873 22.537 41 HB3 ARG 6 HB3 ARG 6 18.239 35.240 20.916 42 HG2 ARG 6 HG2 ARG 6 16.093 35.822 23.000 43 HG3 ARG 6 HG3 ARG 6 16.439 36.710 21.516 44 HD2 ARG 6 HD2 ARG 6 15.895 34.527 20.263 45 HD3 ARG 6 HD3 ARG 6 15.218 33.941 21.796 46 HE ARG 6 HE ARG 6 14.157 36.533 21.141 47 HH11 ARG 6 HH11 ARG 6 13.797 33.209 19.987 48 HH12 ARG 6 HH12 ARG 6 12.372 33.663 19.056 49 HH21 ARG 6 HH21 ARG 6 12.147 36.856 20.218 50 HH22 ARG 6 HH22 ARG 6 11.355 35.512 19.433 51 H ARG 7 H ARG 7 20.292 33.748 23.842 52 HA ARG 7 HA ARG 7 22.132 32.832 21.751 53 HB2 ARG 7 HB2 ARG 7 22.534 32.619 24.758 54 HB3 ARG 7 HB3 ARG 7 23.772 32.607 23.524 55 HG2 ARG 7 HG2 ARG 7 22.056 35.016 24.269 56 HG3 ARG 7 HG3 ARG 7 23.703 34.694 24.813 57 HD2 ARG 7 HD2 ARG 7 24.434 34.721 22.407 58 HD3 ARG 7 HD3 ARG 7 22.817 35.283 21.966 59 HE ARG 7 HE ARG 7 23.263 37.215 23.591 60 HH11 ARG 7 HH11 ARG 7 26.046 35.785 21.889 61 HH12 ARG 7 HH12 ARG 7 26.922 37.300 21.996 62 HH21 ARG 7 HH21 ARG 7 24.404 38.997 23.629 63 HH22 ARG 7 HH22 ARG 7 26.056 39.062 23.039 64 H CYS 8 H CYS 8 20.320 31.262 24.323 65 HA CYS 8 HA CYS 8 21.337 28.599 24.052 66 HB2 CYS 8 HB2 CYS 8 20.236 29.386 26.047 67 HB3 CYS 8 HB3 CYS 8 18.786 29.795 25.152 68 H GLU 9 H GLU 9 18.381 30.168 22.617 69 HA GLU 9 HA GLU 9 17.447 27.971 21.130 70 HB2 GLU 9 HB2 GLU 9 17.449 30.941 20.493 71 HB3 GLU 9 HB3 GLU 9 16.635 29.740 19.484 72 HG2 GLU 9 HG2 GLU 9 15.151 29.095 21.268 73 HG3 GLU 9 HG3 GLU 9 15.998 30.108 22.432 74 H LEU 10 H LEU 10 20.068 30.242 20.165 75 HA LEU 10 HA LEU 10 20.514 29.019 17.579 76 HB2 LEU 10 HB2 LEU 10 22.416 30.594 19.365 77 HB3 LEU 10 HB3 LEU 10 22.687 30.230 17.664 78 HG LEU 10 HG LEU 10 20.375 31.903 18.728 79 HD11 LEU 10 HD11 LEU 10 22.976 32.725 17.375 80 HD12 LEU 10 HD12 LEU 10 21.629 33.811 17.776 81 HD13 LEU 10 HD13 LEU 10 22.538 33.020 19.072 82 HD21 LEU 10 HD21 LEU 10 21.386 31.421 15.903 83 HD22 LEU 10 HD22 LEU 10 19.825 30.858 16.566 84 HD23 LEU 10 HD23 LEU 10 20.125 32.579 16.346 85 H SER 11 H SER 11 21.834 28.379 20.777 86 HA SER 11 HA SER 11 23.817 26.434 19.967 87 HB2 SER 11 HB2 SER 11 23.797 27.709 22.136 88 HB3 SER 11 HB3 SER 11 22.438 26.703 22.666 89 HG SER 11 HG SER 11 25.068 25.872 21.963 90 H CYS 12 H CYS 12 20.391 26.179 20.957 91 HA CYS 12 HA CYS 12 20.225 23.308 20.702 92 HB2 CYS 12 HB2 CYS 12 18.061 25.427 20.506 93 HB3 CYS 12 HB3 CYS 12 17.813 23.702 20.756 94 H ARG 13 H ARG 13 19.633 26.017 18.407 95 HA ARG 13 HA ARG 13 18.633 24.397 16.278 96 HB2 ARG 13 HB2 ARG 13 18.459 26.880 16.433 97 HB3 ARG 13 HB3 ARG 13 20.188 27.008 16.091 98 HG2 ARG 13 HG2 ARG 13 19.794 25.922 13.858 99 HG3 ARG 13 HG3 ARG 13 18.078 25.784 14.249 100 HD2 ARG 13 HD2 ARG 13 18.410 27.693 12.794 101 HD3 ARG 13 HD3 ARG 13 17.940 28.285 14.399 102 HE ARG 13 HE ARG 13 20.764 28.198 14.359 103 HH11 ARG 13 HH11 ARG 13 18.319 30.201 12.674 104 HH12 ARG 13 HH12 ARG 13 19.516 31.476 12.543 105 HH21 ARG 13 HH21 ARG 13 22.038 29.848 14.098 106 HH22 ARG 13 HH22 ARG 13 21.457 31.306 13.266 107 H SER 14 H SER 14 21.946 25.162 17.212 108 HA SER 14 HA SER 14 23.299 23.727 15.138 109 HB2 SER 14 HB2 SER 14 24.570 25.233 16.426 110 HB3 SER 14 HB3 SER 14 23.976 24.587 17.944 111 HG SER 14 HG SER 14 25.900 23.541 16.179 112 H LEU 15 H LEU 15 21.803 22.542 18.169 113 HA LEU 15 HA LEU 15 22.740 19.788 17.795 114 HB2 LEU 15 HB2 LEU 15 20.702 21.060 19.654 115 HB3 LEU 15 HB3 LEU 15 21.083 19.348 19.656 116 HG LEU 15 HG LEU 15 23.235 21.444 20.101 117 HD11 LEU 15 HD11 LEU 15 21.553 19.991 22.179 118 HD12 LEU 15 HD12 LEU 15 22.957 21.036 22.500 119 HD13 LEU 15 HD13 LEU 15 21.489 21.730 21.812 120 HD21 LEU 15 HD21 LEU 15 24.044 19.199 19.505 121 HD22 LEU 15 HD22 LEU 15 24.362 19.516 21.218 122 HD23 LEU 15 HD23 LEU 15 23.014 18.470 20.752 123 H GLY 16 H GLY 16 19.992 21.627 16.685 124 HA2 GLY 16 HA2 GLY 16 18.728 20.786 14.763 125 HA3 GLY 16 HA3 GLY 16 18.763 19.175 15.469 126 H LEU 17 H LEU 17 18.072 21.834 17.652 127 HA LEU 17 HA LEU 17 15.147 21.490 17.550 128 HB2 LEU 17 HB2 LEU 17 15.152 20.972 20.022 129 HB3 LEU 17 HB3 LEU 17 15.500 19.662 18.924 130 HG LEU 17 HG LEU 17 17.707 21.126 20.425 131 HD11 LEU 17 HD11 LEU 17 17.527 19.313 22.120 132 HD12 LEU 17 HD12 LEU 17 16.037 20.259 22.051 133 HD13 LEU 17 HD13 LEU 17 16.101 18.668 21.286 134 HD21 LEU 17 HD21 LEU 17 17.476 18.291 19.296 135 HD22 LEU 17 HD22 LEU 17 18.534 19.569 18.680 136 HD23 LEU 17 HD23 LEU 17 18.830 18.890 20.269 137 H LEU 18 H LEU 18 14.243 22.820 19.655 138 HA LEU 18 HA LEU 18 15.715 25.426 19.799 139 HB2 LEU 18 HB2 LEU 18 12.717 24.923 19.779 140 HB3 LEU 18 HB3 LEU 18 13.425 26.410 20.342 141 HG LEU 18 HG LEU 18 12.612 26.766 18.172 142 HD11 LEU 18 HD11 LEU 18 14.550 27.656 17.035 143 HD12 LEU 18 HD12 LEU 18 14.734 27.897 18.781 144 HD13 LEU 18 HD13 LEU 18 15.640 26.604 17.953 145 HD21 LEU 18 HD21 LEU 18 13.260 25.678 16.163 146 HD22 LEU 18 HD22 LEU 18 14.467 24.683 16.988 147 HD23 LEU 18 HD23 LEU 18 12.732 24.420 17.295 148 H GLY 19 H GLY 19 14.772 26.632 21.969 149 HA2 GLY 19 HA2 GLY 19 14.818 24.710 24.215 150 HA3 GLY 19 HA3 GLY 19 16.192 25.809 24.081 151 H LYS 20 H LYS 20 14.733 25.638 26.293 152 HA LYS 20 HA LYS 20 13.251 28.200 26.576 153 HB2 LYS 20 HB2 LYS 20 12.202 25.459 27.418 154 HB3 LYS 20 HB3 LYS 20 11.496 26.993 27.904 155 HG2 LYS 20 HG2 LYS 20 11.656 26.003 25.028 156 HG3 LYS 20 HG3 LYS 20 10.250 25.884 26.084 157 HD2 LYS 20 HD2 LYS 20 10.095 28.326 26.259 158 HD3 LYS 20 HD3 LYS 20 11.553 28.517 25.276 159 HE2 LYS 20 HE2 LYS 20 10.392 27.298 23.400 160 HE3 LYS 20 HE3 LYS 20 8.915 27.301 24.384 161 HZ1 LYS 20 HZ1 LYS 20 8.957 29.185 22.867 162 HZ2 LYS 20 HZ2 LYS 20 9.040 29.737 24.416 163 HZ3 LYS 20 HZ3 LYS 20 10.396 29.703 23.484 164 H CYS 21 H CYS 21 13.210 29.062 28.622 165 HA CYS 21 HA CYS 21 15.594 28.436 30.195 166 HB2 CYS 21 HB2 CYS 21 14.877 30.761 29.570 167 HB3 CYS 21 HB3 CYS 21 13.501 30.569 30.664 168 H ILE 22 H ILE 22 15.736 27.526 32.197 169 HA ILE 22 HA ILE 22 13.391 26.341 33.507 170 HB ILE 22 HB ILE 22 16.319 26.471 34.287 171 HG12 ILE 22 HG12 ILE 22 14.698 24.125 33.193 172 HG13 ILE 22 HG13 ILE 22 15.757 25.132 32.208 173 HG21 ILE 22 HG21 ILE 22 14.874 26.224 36.302 174 HG22 ILE 22 HG22 ILE 22 14.054 24.847 35.537 175 HG23 ILE 22 HG23 ILE 22 15.769 24.751 35.981 176 HD11 ILE 22 HD11 ILE 22 17.706 24.483 33.617 177 HD12 ILE 22 HD12 ILE 22 16.655 23.335 34.486 178 HD13 ILE 22 HD13 ILE 22 16.944 23.133 32.755 179 H GLY 23 H GLY 23 15.710 28.899 34.244 180 HA2 GLY 23 HA2 GLY 23 13.769 30.693 35.353 181 HA3 GLY 23 HA3 GLY 23 14.671 29.910 36.664 182 H GLU 24 H GLU 24 17.173 29.668 35.548 183 HA GLU 24 HA GLU 24 17.953 32.285 34.362 184 HB2 GLU 24 HB2 GLU 24 19.798 32.660 35.805 185 HB3 GLU 24 HB3 GLU 24 18.333 32.517 36.767 186 HG2 GLU 24 HG2 GLU 24 18.988 30.196 37.389 187 HG3 GLU 24 HG3 GLU 24 20.483 30.380 36.457 188 H LYS 25 H LYS 25 18.477 28.849 34.552 189 HA LYS 25 HA LYS 25 20.442 29.062 32.302 190 HB2 LYS 25 HB2 LYS 25 19.739 26.596 33.934 191 HB3 LYS 25 HB3 LYS 25 20.991 26.748 32.693 192 HG2 LYS 25 HG2 LYS 25 20.990 28.021 35.451 193 HG3 LYS 25 HG3 LYS 25 22.046 26.747 34.835 194 HD2 LYS 25 HD2 LYS 25 22.914 28.412 33.115 195 HD3 LYS 25 HD3 LYS 25 21.985 29.668 33.968 196 HE2 LYS 25 HE2 LYS 25 23.211 28.891 36.103 197 HE3 LYS 25 HE3 LYS 25 24.290 28.005 35.017 198 HZ1 LYS 25 HZ1 LYS 25 25.180 30.190 35.500 199 HZ2 LYS 25 HZ2 LYS 25 24.740 30.175 33.905 200 HZ3 LYS 25 HZ3 LYS 25 23.806 30.927 35.042 201 H CYS 26 H CYS 26 20.057 28.049 30.380 202 HA CYS 26 HA CYS 26 17.233 27.199 29.838 203 HB2 CYS 26 HB2 CYS 26 17.748 29.314 28.846 204 HB3 CYS 26 HB3 CYS 26 19.250 28.705 28.164 205 H LYS 27 H LYS 27 16.773 25.462 28.581 206 HA LYS 27 HA LYS 27 18.966 23.688 27.622 207 HB2 LYS 27 HB2 LYS 27 16.724 22.865 29.519 208 HB3 LYS 27 HB3 LYS 27 17.695 21.720 28.604 209 HG2 LYS 27 HG2 LYS 27 18.794 23.645 30.704 210 HG3 LYS 27 HG3 LYS 27 18.429 21.937 30.939 211 HD2 LYS 27 HD2 LYS 27 20.089 21.362 29.143 212 HD3 LYS 27 HD3 LYS 27 20.552 23.076 29.074 213 HE2 LYS 27 HE2 LYS 27 21.193 22.996 31.475 214 HE3 LYS 27 HE3 LYS 27 20.682 21.307 31.546 215 HZ1 LYS 27 HZ1 LYS 27 22.907 22.351 29.892 216 HZ2 LYS 27 HZ2 LYS 27 23.026 21.350 31.224 217 HZ3 LYS 27 HZ3 LYS 27 22.352 20.811 29.838 218 H CYS 28 H CYS 28 18.387 22.211 26.023 219 HA CYS 28 HA CYS 28 16.376 23.315 24.251 220 HB2 CYS 28 HB2 CYS 28 18.143 20.930 23.762 221 HB3 CYS 28 HB3 CYS 28 17.334 21.964 22.579 222 H VAL 29 H VAL 29 14.482 22.421 23.498 223 HA VAL 29 HA VAL 29 13.380 20.119 25.035 224 HB VAL 29 HB VAL 29 11.166 20.906 24.451 225 HG11 VAL 29 HG11 VAL 29 12.814 23.141 25.683 226 HG12 VAL 29 HG12 VAL 29 11.083 22.813 25.927 227 HG13 VAL 29 HG13 VAL 29 12.297 21.653 26.506 228 HG21 VAL 29 HG21 VAL 29 11.478 22.054 22.344 229 HG22 VAL 29 HG22 VAL 29 10.778 23.167 23.522 230 HG23 VAL 29 HG23 VAL 29 12.503 23.289 23.119 231 HA PRO 30 HA PRO 30 13.884 17.731 21.492 232 HB2 PRO 30 HB2 PRO 30 12.040 15.696 21.735 233 HB3 PRO 30 HB3 PRO 30 13.497 15.874 22.750 234 HG2 PRO 30 HG2 PRO 30 10.669 16.739 23.381 235 HG3 PRO 30 HG3 PRO 30 11.820 15.862 24.434 236 HD2 PRO 30 HD2 PRO 30 11.435 18.557 24.623 237 HD3 PRO 30 HD3 PRO 30 13.054 17.834 24.884 238 H TYR 31 H TYR 31 13.298 17.300 19.418 239 HA TYR 31 HA TYR 31 10.623 18.065 18.362 240 HB2 TYR 31 HB2 TYR 31 13.326 19.083 17.419 241 HB3 TYR 31 HB3 TYR 31 11.973 18.920 16.325 242 HD1 TYR 31 HD1 TYR 31 10.298 20.612 16.162 243 HD2 TYR 31 HD2 TYR 31 12.978 20.551 19.518 244 HE1 TYR 31 HE1 TYR 31 9.417 22.818 16.903 245 HE2 TYR 31 HE2 TYR 31 12.084 22.750 20.283 246 HH TYR 31 HH TYR 31 9.355 24.348 18.636
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