NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
637590 | 6d9o | 30467 | 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 34.972 28.189 12.782 2 H2 ALA 1 H2 ALA 1 34.698 29.395 13.871 3 H3 ALA 1 H3 ALA 1 33.434 28.669 13.136 4 HA ALA 1 HA ALA 1 35.344 27.281 14.893 5 HB1 ALA 1 HB1 ALA 1 34.102 28.922 16.225 6 HB2 ALA 1 HB2 ALA 1 32.559 28.304 15.585 7 HB3 ALA 1 HB3 ALA 1 33.575 27.275 16.619 8 H PHE 2 H PHE 2 34.826 25.104 15.369 9 HA PHE 2 HA PHE 2 33.580 23.764 13.078 10 HB2 PHE 2 HB2 PHE 2 35.201 22.630 15.374 11 HB3 PHE 2 HB3 PHE 2 34.817 21.824 13.861 12 HD1 PHE 2 HD1 PHE 2 37.007 24.329 15.481 13 HD2 PHE 2 HD2 PHE 2 36.033 22.329 11.794 14 HE1 PHE 2 HE1 PHE 2 39.123 25.132 14.471 15 HE2 PHE 2 HE2 PHE 2 38.127 23.171 10.782 16 HZ PHE 2 HZ PHE 2 39.683 24.570 12.123 17 H CYS 3 H CYS 3 31.694 24.908 15.070 18 HA CYS 3 HA CYS 3 30.218 22.471 15.866 19 HB2 CYS 3 HB2 CYS 3 31.821 22.828 17.669 20 HB3 CYS 3 HB3 CYS 3 31.299 24.506 17.855 21 H ASN 4 H ASN 4 28.135 22.736 15.360 22 HA ASN 4 HA ASN 4 26.994 25.382 14.877 23 HB2 ASN 4 HB2 ASN 4 25.657 22.635 14.844 24 HB3 ASN 4 HB3 ASN 4 24.924 24.138 14.347 25 HD21 ASN 4 HD21 ASN 4 27.139 24.297 11.369 26 HD22 ASN 4 HD22 ASN 4 27.129 25.265 12.822 27 H LEU 5 H LEU 5 27.182 26.410 16.893 28 HA LEU 5 HA LEU 5 26.054 25.388 19.305 29 HB2 LEU 5 HB2 LEU 5 27.859 27.059 19.210 30 HB3 LEU 5 HB3 LEU 5 26.765 28.240 18.510 31 HG LEU 5 HG LEU 5 25.446 28.351 20.562 32 HD11 LEU 5 HD11 LEU 5 26.252 27.189 22.628 33 HD12 LEU 5 HD12 LEU 5 25.592 26.068 21.437 34 HD13 LEU 5 HD13 LEU 5 27.356 26.225 21.626 35 HD21 LEU 5 HD21 LEU 5 27.491 29.730 20.345 36 HD22 LEU 5 HD22 LEU 5 27.156 29.313 22.034 37 HD23 LEU 5 HD23 LEU 5 28.439 28.460 21.143 38 H ARG 6 H ARG 6 24.669 27.906 17.067 39 HA ARG 6 HA ARG 6 22.307 28.353 18.584 40 HB2 ARG 6 HB2 ARG 6 23.016 29.820 16.761 41 HB3 ARG 6 HB3 ARG 6 22.768 28.545 15.577 42 HG2 ARG 6 HG2 ARG 6 20.977 30.267 15.588 43 HG3 ARG 6 HG3 ARG 6 20.384 28.633 15.808 44 HD2 ARG 6 HD2 ARG 6 19.220 30.311 17.219 45 HD3 ARG 6 HD3 ARG 6 19.955 29.018 18.170 46 HE ARG 6 HE ARG 6 21.901 31.009 18.097 47 HH11 ARG 6 HH11 ARG 6 18.551 31.003 19.347 48 HH12 ARG 6 HH12 ARG 6 19.016 32.184 20.558 49 HH21 ARG 6 HH21 ARG 6 22.258 32.454 19.559 50 HH22 ARG 6 HH22 ARG 6 21.002 32.969 20.710 51 H ARG 7 H ARG 7 22.847 25.962 15.999 52 HA ARG 7 HA ARG 7 20.196 24.871 15.997 53 HB2 ARG 7 HB2 ARG 7 22.544 24.507 14.536 54 HB3 ARG 7 HB3 ARG 7 22.402 22.972 15.370 55 HG2 ARG 7 HG2 ARG 7 20.339 24.313 13.567 56 HG3 ARG 7 HG3 ARG 7 21.361 22.945 13.143 57 HD2 ARG 7 HD2 ARG 7 19.110 22.938 15.193 58 HD3 ARG 7 HD3 ARG 7 19.074 22.235 13.573 59 HE ARG 7 HE ARG 7 21.277 21.081 14.963 60 HH11 ARG 7 HH11 ARG 7 17.759 20.871 15.037 61 HH12 ARG 7 HH12 ARG 7 17.825 19.496 16.105 62 HH21 ARG 7 HH21 ARG 7 21.271 19.275 16.024 63 HH22 ARG 7 HH22 ARG 7 19.766 18.409 16.366 64 H CYS 8 H CYS 8 22.960 24.177 18.048 65 HA CYS 8 HA CYS 8 21.802 21.914 19.449 66 HB2 CYS 8 HB2 CYS 8 24.198 22.266 19.268 67 HB3 CYS 8 HB3 CYS 8 24.070 23.843 20.008 68 H GLU 9 H GLU 9 22.043 25.533 20.268 69 HA GLU 9 HA GLU 9 21.033 25.288 22.867 70 HB2 GLU 9 HB2 GLU 9 22.384 27.081 22.280 71 HB3 GLU 9 HB3 GLU 9 21.732 27.225 20.677 72 HG2 GLU 9 HG2 GLU 9 21.211 29.087 21.586 73 HG3 GLU 9 HG3 GLU 9 19.709 28.191 21.462 74 H LEU 10 H LEU 10 19.452 26.049 19.748 75 HA LEU 10 HA LEU 10 16.820 26.289 20.937 76 HB2 LEU 10 HB2 LEU 10 15.941 26.385 18.718 77 HB3 LEU 10 HB3 LEU 10 17.398 27.346 18.848 78 HG LEU 10 HG LEU 10 18.553 25.172 17.823 79 HD11 LEU 10 HD11 LEU 10 15.726 24.957 16.721 80 HD12 LEU 10 HD12 LEU 10 17.145 24.061 16.152 81 HD13 LEU 10 HD13 LEU 10 16.501 23.746 17.762 82 HD21 LEU 10 HD21 LEU 10 18.220 26.140 15.576 83 HD22 LEU 10 HD22 LEU 10 16.844 27.087 16.180 84 HD23 LEU 10 HD23 LEU 10 18.484 27.410 16.778 85 H SER 11 H SER 11 18.639 23.438 19.920 86 HA SER 11 HA SER 11 16.336 21.630 20.049 87 HB2 SER 11 HB2 SER 11 19.309 20.992 20.264 88 HB3 SER 11 HB3 SER 11 17.983 19.841 20.044 89 HG SER 11 HG SER 11 18.953 21.792 18.230 90 H CYS 12 H CYS 12 18.981 22.549 22.292 91 HA CYS 12 HA CYS 12 18.109 20.975 24.510 92 HB2 CYS 12 HB2 CYS 12 19.630 23.612 24.523 93 HB3 CYS 12 HB3 CYS 12 19.548 22.427 25.841 94 H ARG 13 H ARG 13 17.212 24.266 23.430 95 HA ARG 13 HA ARG 13 15.605 24.991 25.610 96 HB2 ARG 13 HB2 ARG 13 16.358 26.364 23.544 97 HB3 ARG 13 HB3 ARG 13 14.980 25.678 22.705 98 HG2 ARG 13 HG2 ARG 13 14.455 27.901 23.545 99 HG3 ARG 13 HG3 ARG 13 13.445 26.710 24.355 100 HD2 ARG 13 HD2 ARG 13 14.284 28.440 25.910 101 HD3 ARG 13 HD3 ARG 13 14.837 26.827 26.369 102 HE ARG 13 HE ARG 13 16.753 28.165 24.656 103 HH11 ARG 13 HH11 ARG 13 15.708 28.141 28.022 104 HH12 ARG 13 HH12 ARG 13 17.227 28.803 28.580 105 HH21 ARG 13 HH21 ARG 13 18.684 28.910 25.449 106 HH22 ARG 13 HH22 ARG 13 18.798 29.293 27.152 107 H SER 14 H SER 14 14.834 22.656 23.067 108 HA SER 14 HA SER 14 11.975 22.491 23.668 109 HB2 SER 14 HB2 SER 14 12.836 21.478 21.627 110 HB3 SER 14 HB3 SER 14 13.857 20.367 22.559 111 HG SER 14 HG SER 14 11.529 19.782 21.804 112 H LEU 15 H LEU 15 14.838 20.716 24.840 113 HA LEU 15 HA LEU 15 13.480 19.225 26.918 114 HB2 LEU 15 HB2 LEU 15 16.436 19.877 26.642 115 HB3 LEU 15 HB3 LEU 15 15.730 18.546 27.546 116 HG LEU 15 HG LEU 15 15.662 18.850 24.504 117 HD11 LEU 15 HD11 LEU 15 17.324 17.016 26.263 118 HD12 LEU 15 HD12 LEU 15 17.291 17.042 24.486 119 HD13 LEU 15 HD13 LEU 15 17.922 18.438 25.375 120 HD21 LEU 15 HD21 LEU 15 13.734 17.535 25.322 121 HD22 LEU 15 HD22 LEU 15 14.911 16.501 24.504 122 HD23 LEU 15 HD23 LEU 15 14.834 16.512 26.281 123 H GLY 16 H GLY 16 14.270 22.484 26.751 124 HA2 GLY 16 HA2 GLY 16 13.851 24.171 28.244 125 HA3 GLY 16 HA3 GLY 16 13.650 23.014 29.563 126 H LEU 17 H LEU 17 16.597 22.701 27.721 127 HA LEU 17 HA LEU 17 18.136 24.079 29.887 128 HB2 LEU 17 HB2 LEU 17 19.665 22.174 28.298 129 HB3 LEU 17 HB3 LEU 17 19.601 22.439 30.026 130 HG LEU 17 HG LEU 17 17.804 20.712 28.400 131 HD11 LEU 17 HD11 LEU 17 18.859 18.851 29.598 132 HD12 LEU 17 HD12 LEU 17 20.079 19.817 28.782 133 HD13 LEU 17 HD13 LEU 17 19.861 19.988 30.529 134 HD21 LEU 17 HD21 LEU 17 17.893 21.018 31.466 135 HD22 LEU 17 HD22 LEU 17 16.527 21.500 30.461 136 HD23 LEU 17 HD23 LEU 17 16.943 19.801 30.594 137 H LEU 18 H LEU 18 20.378 24.602 29.055 138 HA LEU 18 HA LEU 18 20.208 26.356 26.647 139 HB2 LEU 18 HB2 LEU 18 22.341 26.076 28.817 140 HB3 LEU 18 HB3 LEU 18 22.348 27.220 27.490 141 HG LEU 18 HG LEU 18 20.255 28.266 28.437 142 HD11 LEU 18 HD11 LEU 18 20.894 26.479 30.830 143 HD12 LEU 18 HD12 LEU 18 19.948 27.976 30.932 144 HD13 LEU 18 HD13 LEU 18 19.331 26.651 29.983 145 HD21 LEU 18 HD21 LEU 18 22.562 29.150 28.763 146 HD22 LEU 18 HD22 LEU 18 21.509 29.495 30.134 147 HD23 LEU 18 HD23 LEU 18 22.703 28.173 30.249 148 H GLY 19 H GLY 19 21.973 26.208 25.058 149 HA2 GLY 19 HA2 GLY 19 23.341 23.515 24.947 150 HA3 GLY 19 HA3 GLY 19 22.984 24.509 23.550 151 H LYS 20 H LYS 20 25.560 23.431 25.051 152 HA LYS 20 HA LYS 20 27.159 25.870 24.445 153 HB2 LYS 20 HB2 LYS 20 27.514 24.103 26.898 154 HB3 LYS 20 HB3 LYS 20 28.688 25.297 26.346 155 HG2 LYS 20 HG2 LYS 20 25.886 25.949 27.278 156 HG3 LYS 20 HG3 LYS 20 27.359 26.056 28.244 157 HD2 LYS 20 HD2 LYS 20 28.297 27.733 26.626 158 HD3 LYS 20 HD3 LYS 20 26.801 27.618 25.699 159 HE2 LYS 20 HE2 LYS 20 26.413 29.481 27.010 160 HE3 LYS 20 HE3 LYS 20 25.576 28.162 27.848 161 HZ1 LYS 20 HZ1 LYS 20 26.788 29.503 29.428 162 HZ2 LYS 20 HZ2 LYS 20 27.499 28.063 29.379 163 HZ3 LYS 20 HZ3 LYS 20 28.183 29.370 28.636 164 H CYS 21 H CYS 21 28.831 25.573 23.206 165 HA CYS 21 HA CYS 21 29.444 22.939 22.086 166 HB2 CYS 21 HB2 CYS 21 30.423 25.736 21.588 167 HB3 CYS 21 HB3 CYS 21 31.295 24.359 20.933 168 H ILE 22 H ILE 22 31.355 21.887 22.158 169 HA ILE 22 HA ILE 22 33.438 22.565 24.130 170 HB ILE 22 HB ILE 22 31.891 21.403 25.446 171 HG12 ILE 22 HG12 ILE 22 33.858 19.200 24.833 172 HG13 ILE 22 HG13 ILE 22 34.420 20.756 25.442 173 HG21 ILE 22 HG21 ILE 22 31.729 19.163 23.396 174 HG22 ILE 22 HG22 ILE 22 31.041 19.113 25.026 175 HG23 ILE 22 HG23 ILE 22 30.442 20.288 23.862 176 HD11 ILE 22 HD11 ILE 22 34.100 19.223 27.310 177 HD12 ILE 22 HD12 ILE 22 32.937 20.555 27.418 178 HD13 ILE 22 HD13 ILE 22 32.407 18.957 26.855 179 H GLY 23 H GLY 23 34.558 23.065 22.216 180 HA2 GLY 23 HA2 GLY 23 36.471 22.578 21.011 181 HA3 GLY 23 HA3 GLY 23 36.248 20.864 21.348 182 H GLU 24 H GLU 24 34.380 19.871 20.174 183 HA GLU 24 HA GLU 24 34.151 20.801 17.330 184 HB2 GLU 24 HB2 GLU 24 34.858 18.783 16.428 185 HB3 GLU 24 HB3 GLU 24 36.119 19.401 17.475 186 HG2 GLU 24 HG2 GLU 24 34.154 17.216 18.283 187 HG3 GLU 24 HG3 GLU 24 35.715 16.962 17.524 188 H ALA 25 H ALA 25 32.360 19.998 19.910 189 HA ALA 25 HA ALA 25 30.012 19.207 18.339 190 HB1 ALA 25 HB1 ALA 25 31.144 17.052 18.848 191 HB2 ALA 25 HB2 ALA 25 31.170 17.479 20.572 192 HB3 ALA 25 HB3 ALA 25 29.625 17.197 19.743 193 H CYS 26 H CYS 26 28.037 19.127 19.883 194 HA CYS 26 HA CYS 26 28.375 21.094 22.114 195 HB2 CYS 26 HB2 CYS 26 27.503 22.148 20.059 196 HB3 CYS 26 HB3 CYS 26 26.146 21.043 20.068 197 H LYS 27 H LYS 27 27.083 20.988 23.868 198 HA LYS 27 HA LYS 27 25.305 18.620 24.215 199 HB2 LYS 27 HB2 LYS 27 27.533 17.951 24.890 200 HB3 LYS 27 HB3 LYS 27 27.670 19.324 25.993 201 HG2 LYS 27 HG2 LYS 27 26.156 18.411 27.539 202 HG3 LYS 27 HG3 LYS 27 25.353 17.416 26.324 203 HD2 LYS 27 HD2 LYS 27 26.615 16.015 27.825 204 HD3 LYS 27 HD3 LYS 27 27.242 15.907 26.178 205 HE2 LYS 27 HE2 LYS 27 29.134 17.339 26.726 206 HE3 LYS 27 HE3 LYS 27 28.465 17.691 28.329 207 HZ1 LYS 27 HZ1 LYS 27 29.259 14.973 27.439 208 HZ2 LYS 27 HZ2 LYS 27 30.189 15.952 28.377 209 HZ3 LYS 27 HZ3 LYS 27 28.747 15.416 28.944 210 H CYS 28 H CYS 28 23.677 18.849 25.682 211 HA CYS 28 HA CYS 28 22.874 21.586 26.264 212 HB2 CYS 28 HB2 CYS 28 21.488 18.983 26.947 213 HB3 CYS 28 HB3 CYS 28 20.804 20.629 26.987 214 H VAL 29 H VAL 29 22.536 22.577 28.250 215 HA VAL 29 HA VAL 29 23.351 21.186 30.736 216 HB VAL 29 HB VAL 29 24.745 22.979 31.485 217 HG11 VAL 29 HG11 VAL 29 25.763 21.996 28.799 218 HG12 VAL 29 HG12 VAL 29 26.735 22.590 30.156 219 HG13 VAL 29 HG13 VAL 29 25.820 21.089 30.325 220 HG21 VAL 29 HG21 VAL 29 25.663 24.703 29.939 221 HG22 VAL 29 HG22 VAL 29 24.451 24.229 28.731 222 HG23 VAL 29 HG23 VAL 29 23.951 24.939 30.284 223 HA PRO 30 HA PRO 30 19.725 23.429 31.991 224 HB2 PRO 30 HB2 PRO 30 19.456 22.619 34.553 225 HB3 PRO 30 HB3 PRO 30 19.436 21.446 33.205 226 HG2 PRO 30 HG2 PRO 30 21.780 22.176 34.980 227 HG3 PRO 30 HG3 PRO 30 21.173 20.535 34.576 228 HD2 PRO 30 HD2 PRO 30 23.251 21.750 33.229 229 HD3 PRO 30 HD3 PRO 30 22.119 20.617 32.439 230 H TYR 31 H TYR 31 22.703 24.428 33.050 231 HA TYR 31 HA TYR 31 22.217 25.908 35.403 232 HB2 TYR 31 HB2 TYR 31 24.509 26.121 33.441 233 HB3 TYR 31 HB3 TYR 31 24.556 26.534 35.148 234 HD1 TYR 31 HD1 TYR 31 23.434 24.212 36.532 235 HD2 TYR 31 HD2 TYR 31 25.971 24.391 33.051 236 HE1 TYR 31 HE1 TYR 31 24.316 21.941 37.051 237 HE2 TYR 31 HE2 TYR 31 26.843 22.123 33.557 238 HH TYR 31 HH TYR 31 26.811 20.362 34.993 Start of MODEL 2 1 H1 ALA 1 H1 ALA 1 35.157 21.578 18.450 2 H2 ALA 1 H2 ALA 1 36.378 22.684 18.325 3 H3 ALA 1 H3 ALA 1 36.685 21.087 18.076 4 HA ALA 1 HA ALA 1 36.626 22.284 16.012 5 HB1 ALA 1 HB1 ALA 1 34.236 20.409 16.340 6 HB2 ALA 1 HB2 ALA 1 35.063 20.795 14.829 7 HB3 ALA 1 HB3 ALA 1 35.915 19.893 16.093 8 H PHE 2 H PHE 2 35.062 23.172 14.314 9 HA PHE 2 HA PHE 2 33.620 25.447 15.368 10 HB2 PHE 2 HB2 PHE 2 33.747 24.456 12.512 11 HB3 PHE 2 HB3 PHE 2 33.315 26.071 13.056 12 HD1 PHE 2 HD1 PHE 2 35.760 24.418 11.415 13 HD2 PHE 2 HD2 PHE 2 35.347 27.012 14.836 14 HE1 PHE 2 HE1 PHE 2 38.139 25.121 11.170 15 HE2 PHE 2 HE2 PHE 2 37.706 27.737 14.567 16 HZ PHE 2 HZ PHE 2 39.085 26.806 12.718 17 H CYS 3 H CYS 3 32.166 23.776 16.613 18 HA CYS 3 HA CYS 3 29.963 22.565 15.227 19 HB2 CYS 3 HB2 CYS 3 29.071 22.186 17.450 20 HB3 CYS 3 HB3 CYS 3 30.795 21.822 17.394 21 H ASN 4 H ASN 4 27.767 23.069 15.290 22 HA ASN 4 HA ASN 4 27.196 25.893 14.681 23 HB2 ASN 4 HB2 ASN 4 25.504 23.387 14.321 24 HB3 ASN 4 HB3 ASN 4 25.217 24.961 13.594 25 HD21 ASN 4 HD21 ASN 4 27.885 24.489 11.167 26 HD22 ASN 4 HD22 ASN 4 27.241 25.788 12.153 27 H LEU 5 H LEU 5 27.136 26.873 16.721 28 HA LEU 5 HA LEU 5 25.908 25.694 18.985 29 HB2 LEU 5 HB2 LEU 5 27.815 27.259 19.017 30 HB3 LEU 5 HB3 LEU 5 26.760 28.566 18.479 31 HG LEU 5 HG LEU 5 25.471 28.415 20.599 32 HD11 LEU 5 HD11 LEU 5 27.541 26.299 21.356 33 HD12 LEU 5 HD12 LEU 5 26.415 27.069 22.486 34 HD13 LEU 5 HD13 LEU 5 25.784 26.048 21.196 35 HD21 LEU 5 HD21 LEU 5 27.428 29.921 20.397 36 HD22 LEU 5 HD22 LEU 5 27.242 29.327 22.048 37 HD23 LEU 5 HD23 LEU 5 28.488 28.629 20.996 38 H ARG 6 H ARG 6 24.624 28.251 16.812 39 HA ARG 6 HA ARG 6 22.244 28.877 18.278 40 HB2 ARG 6 HB2 ARG 6 23.216 30.233 16.493 41 HB3 ARG 6 HB3 ARG 6 22.973 28.957 15.315 42 HG2 ARG 6 HG2 ARG 6 20.499 29.270 15.495 43 HG3 ARG 6 HG3 ARG 6 20.781 30.553 16.687 44 HD2 ARG 6 HD2 ARG 6 20.453 31.631 14.559 45 HD3 ARG 6 HD3 ARG 6 22.165 31.773 14.973 46 HE ARG 6 HE ARG 6 21.651 29.438 13.331 47 HH11 ARG 6 HH11 ARG 6 22.197 32.931 12.944 48 HH12 ARG 6 HH12 ARG 6 22.528 32.730 11.240 49 HH21 ARG 6 HH21 ARG 6 22.280 29.293 11.353 50 HH22 ARG 6 HH22 ARG 6 22.704 30.704 10.375 51 H ARG 7 H ARG 7 22.787 26.350 15.835 52 HA ARG 7 HA ARG 7 20.167 25.143 15.899 53 HB2 ARG 7 HB2 ARG 7 21.781 24.845 14.086 54 HB3 ARG 7 HB3 ARG 7 22.946 24.111 15.186 55 HG2 ARG 7 HG2 ARG 7 21.377 22.203 15.536 56 HG3 ARG 7 HG3 ARG 7 20.282 22.907 14.334 57 HD2 ARG 7 HD2 ARG 7 23.195 22.151 13.839 58 HD3 ARG 7 HD3 ARG 7 21.831 21.076 13.507 59 HE ARG 7 HE ARG 7 21.021 23.092 12.010 60 HH11 ARG 7 HH11 ARG 7 24.355 21.881 12.142 61 HH12 ARG 7 HH12 ARG 7 24.660 22.470 10.517 62 HH21 ARG 7 HH21 ARG 7 21.447 23.647 10.064 63 HH22 ARG 7 HH22 ARG 7 22.953 23.226 9.260 64 H CYS 8 H CYS 8 23.058 24.605 17.884 65 HA CYS 8 HA CYS 8 22.018 22.265 19.257 66 HB2 CYS 8 HB2 CYS 8 24.376 22.526 19.009 67 HB3 CYS 8 HB3 CYS 8 24.354 24.136 19.718 68 H GLU 9 H GLU 9 22.234 25.747 20.113 69 HA GLU 9 HA GLU 9 21.173 25.704 22.713 70 HB2 GLU 9 HB2 GLU 9 21.062 27.651 20.399 71 HB3 GLU 9 HB3 GLU 9 20.176 28.029 21.858 72 HG2 GLU 9 HG2 GLU 9 23.129 27.296 21.960 73 HG3 GLU 9 HG3 GLU 9 22.578 28.932 21.598 74 H LEU 10 H LEU 10 19.266 25.832 19.648 75 HA LEU 10 HA LEU 10 16.774 25.561 21.130 76 HB2 LEU 10 HB2 LEU 10 15.674 25.524 18.979 77 HB3 LEU 10 HB3 LEU 10 16.782 26.863 19.196 78 HG LEU 10 HG LEU 10 18.463 25.430 17.808 79 HD11 LEU 10 HD11 LEU 10 17.167 23.321 17.754 80 HD12 LEU 10 HD12 LEU 10 15.825 24.168 16.959 81 HD13 LEU 10 HD13 LEU 10 17.381 23.980 16.134 82 HD21 LEU 10 HD21 LEU 10 17.432 27.527 17.040 83 HD22 LEU 10 HD22 LEU 10 17.547 26.354 15.725 84 HD23 LEU 10 HD23 LEU 10 15.985 26.632 16.524 85 H SER 11 H SER 11 19.052 23.174 20.089 86 HA SER 11 HA SER 11 17.156 20.932 20.128 87 HB2 SER 11 HB2 SER 11 19.272 20.652 18.948 88 HB3 SER 11 HB3 SER 11 20.178 20.999 20.428 89 HG SER 11 HG SER 11 18.729 18.692 19.738 90 H CYS 12 H CYS 12 19.348 22.479 22.542 91 HA CYS 12 HA CYS 12 18.439 20.719 24.693 92 HB2 CYS 12 HB2 CYS 12 20.013 23.309 24.703 93 HB3 CYS 12 HB3 CYS 12 19.724 22.307 26.129 94 H ARG 13 H ARG 13 17.594 24.136 23.725 95 HA ARG 13 HA ARG 13 15.863 24.557 25.931 96 HB2 ARG 13 HB2 ARG 13 16.282 25.877 23.228 97 HB3 ARG 13 HB3 ARG 13 15.074 26.434 24.382 98 HG2 ARG 13 HG2 ARG 13 16.831 26.722 26.110 99 HG3 ARG 13 HG3 ARG 13 18.020 26.088 24.974 100 HD2 ARG 13 HD2 ARG 13 17.212 27.999 23.386 101 HD3 ARG 13 HD3 ARG 13 16.514 28.715 24.849 102 HE ARG 13 HE ARG 13 19.394 27.938 24.439 103 HH11 ARG 13 HH11 ARG 13 17.176 30.121 26.203 104 HH12 ARG 13 HH12 ARG 13 18.565 31.087 26.703 105 HH21 ARG 13 HH21 ARG 13 20.919 29.140 25.326 106 HH22 ARG 13 HH22 ARG 13 20.497 30.563 26.330 107 H SER 14 H SER 14 15.255 22.825 22.936 108 HA SER 14 HA SER 14 12.413 22.662 23.201 109 HB2 SER 14 HB2 SER 14 13.669 21.905 21.216 110 HB3 SER 14 HB3 SER 14 14.361 20.572 22.163 111 HG SER 14 HG SER 14 11.748 20.938 21.180 112 H LEU 15 H LEU 15 14.959 21.159 25.120 113 HA LEU 15 HA LEU 15 13.043 19.493 26.671 114 HB2 LEU 15 HB2 LEU 15 16.013 19.897 27.138 115 HB3 LEU 15 HB3 LEU 15 14.987 18.636 27.791 116 HG LEU 15 HG LEU 15 15.831 18.935 24.870 117 HD11 LEU 15 HD11 LEU 15 17.171 16.928 25.308 118 HD12 LEU 15 HD12 LEU 15 17.656 18.254 26.375 119 HD13 LEU 15 HD13 LEU 15 16.652 16.929 27.009 120 HD21 LEU 15 HD21 LEU 15 14.867 16.681 24.577 121 HD22 LEU 15 HD22 LEU 15 14.250 16.720 26.245 122 HD23 LEU 15 HD23 LEU 15 13.618 17.849 25.022 123 H GLY 16 H GLY 16 14.649 22.580 26.789 124 HA2 GLY 16 HA2 GLY 16 13.684 24.347 28.116 125 HA3 GLY 16 HA3 GLY 16 13.395 23.218 29.437 126 H LEU 17 H LEU 17 16.540 22.759 28.122 127 HA LEU 17 HA LEU 17 17.791 24.634 30.074 128 HB2 LEU 17 HB2 LEU 17 19.623 22.944 30.230 129 HB3 LEU 17 HB3 LEU 17 18.148 22.601 31.115 130 HG LEU 17 HG LEU 17 18.725 21.313 28.419 131 HD11 LEU 17 HD11 LEU 17 19.445 20.284 31.197 132 HD12 LEU 17 HD12 LEU 17 19.695 19.436 29.655 133 HD13 LEU 17 HD13 LEU 17 20.611 20.914 30.025 134 HD21 LEU 17 HD21 LEU 17 17.054 20.422 30.829 135 HD22 LEU 17 HD22 LEU 17 16.400 20.941 29.271 136 HD23 LEU 17 HD23 LEU 17 17.339 19.457 29.368 137 H LEU 18 H LEU 18 20.127 25.128 29.511 138 HA LEU 18 HA LEU 18 20.044 26.234 26.808 139 HB2 LEU 18 HB2 LEU 18 22.083 26.515 29.053 140 HB3 LEU 18 HB3 LEU 18 22.067 27.392 27.534 141 HG LEU 18 HG LEU 18 19.703 28.235 28.228 142 HD11 LEU 18 HD11 LEU 18 19.232 26.899 30.228 143 HD12 LEU 18 HD12 LEU 18 20.794 27.357 30.947 144 HD13 LEU 18 HD13 LEU 18 19.508 28.558 30.724 145 HD21 LEU 18 HD21 LEU 18 20.736 30.098 29.437 146 HD22 LEU 18 HD22 LEU 18 22.181 29.112 29.750 147 HD23 LEU 18 HD23 LEU 18 21.772 29.594 28.092 148 H GLY 19 H GLY 19 21.767 26.052 25.237 149 HA2 GLY 19 HA2 GLY 19 23.017 23.333 25.231 150 HA3 GLY 19 HA3 GLY 19 22.579 24.245 23.807 151 H LYS 20 H LYS 20 25.058 22.938 24.653 152 HA LYS 20 HA LYS 20 27.008 25.008 23.892 153 HB2 LYS 20 HB2 LYS 20 27.299 23.137 26.294 154 HB3 LYS 20 HB3 LYS 20 28.640 24.018 25.566 155 HG2 LYS 20 HG2 LYS 20 26.229 25.324 26.890 156 HG3 LYS 20 HG3 LYS 20 27.814 25.078 27.630 157 HD2 LYS 20 HD2 LYS 20 28.846 26.460 25.829 158 HD3 LYS 20 HD3 LYS 20 27.226 26.762 25.168 159 HE2 LYS 20 HE2 LYS 20 26.596 27.753 27.412 160 HE3 LYS 20 HE3 LYS 20 28.291 27.572 27.905 161 HZ1 LYS 20 HZ1 LYS 20 27.858 29.814 27.028 162 HZ2 LYS 20 HZ2 LYS 20 28.888 29.015 26.001 163 HZ3 LYS 20 HZ3 LYS 20 27.320 29.197 25.617 164 H CYS 21 H CYS 21 28.886 24.061 22.801 165 HA CYS 21 HA CYS 21 28.682 21.186 22.181 166 HB2 CYS 21 HB2 CYS 21 28.526 21.607 19.823 167 HB3 CYS 21 HB3 CYS 21 27.148 22.303 20.635 168 H ILE 22 H ILE 22 30.544 20.289 21.312 169 HA ILE 22 HA ILE 22 32.708 22.159 20.499 170 HB ILE 22 HB ILE 22 33.039 21.602 22.918 171 HG12 ILE 22 HG12 ILE 22 35.163 20.908 20.864 172 HG13 ILE 22 HG13 ILE 22 34.818 22.473 21.586 173 HG21 ILE 22 HG21 ILE 22 32.353 19.137 22.682 174 HG22 ILE 22 HG22 ILE 22 33.967 18.861 22.001 175 HG23 ILE 22 HG23 ILE 22 33.782 19.474 23.652 176 HD11 ILE 22 HD11 ILE 22 35.494 21.495 23.821 177 HD12 ILE 22 HD12 ILE 22 36.039 20.048 22.949 178 HD13 ILE 22 HD13 ILE 22 36.800 21.616 22.622 179 H GLY 23 H GLY 23 31.843 18.669 20.591 180 HA2 GLY 23 HA2 GLY 23 33.811 18.062 18.522 181 HA3 GLY 23 HA3 GLY 23 32.791 16.933 19.404 182 H GLU 24 H GLU 24 31.960 19.670 17.231 183 HA GLU 24 HA GLU 24 30.307 19.863 15.631 184 HB2 GLU 24 HB2 GLU 24 31.315 17.177 14.639 185 HB3 GLU 24 HB3 GLU 24 30.383 18.374 13.737 186 HG2 GLU 24 HG2 GLU 24 32.271 20.003 14.041 187 HG3 GLU 24 HG3 GLU 24 33.212 18.715 14.796 188 H ALA 25 H ALA 25 29.441 18.801 18.116 189 HA ALA 25 HA ALA 25 26.835 17.640 17.500 190 HB1 ALA 25 HB1 ALA 25 29.010 16.164 19.062 191 HB2 ALA 25 HB2 ALA 25 27.292 15.718 19.103 192 HB3 ALA 25 HB3 ALA 25 28.191 15.611 17.585 193 H CYS 26 H CYS 26 25.499 17.557 19.524 194 HA CYS 26 HA CYS 26 26.117 20.025 21.084 195 HB2 CYS 26 HB2 CYS 26 24.287 20.076 19.461 196 HB3 CYS 26 HB3 CYS 26 23.520 18.711 20.258 197 H LYS 27 H LYS 27 26.058 20.144 23.261 198 HA LYS 27 HA LYS 27 24.576 18.082 24.849 199 HB2 LYS 27 HB2 LYS 27 27.401 19.037 25.348 200 HB3 LYS 27 HB3 LYS 27 26.375 18.332 26.613 201 HG2 LYS 27 HG2 LYS 27 25.958 16.370 24.988 202 HG3 LYS 27 HG3 LYS 27 27.314 17.013 24.037 203 HD2 LYS 27 HD2 LYS 27 28.774 16.803 26.016 204 HD3 LYS 27 HD3 LYS 27 27.391 16.209 26.969 205 HE2 LYS 27 HE2 LYS 27 27.116 14.294 25.435 206 HE3 LYS 27 HE3 LYS 27 28.459 14.886 24.427 207 HZ1 LYS 27 HZ1 LYS 27 28.756 14.072 27.261 208 HZ2 LYS 27 HZ2 LYS 27 29.100 13.101 25.959 209 HZ3 LYS 27 HZ3 LYS 27 29.949 14.506 26.252 210 H CYS 28 H CYS 28 24.179 18.856 27.163 211 HA CYS 28 HA CYS 28 23.199 21.681 26.953 212 HB2 CYS 28 HB2 CYS 28 21.684 19.390 28.180 213 HB3 CYS 28 HB3 CYS 28 21.120 21.033 27.830 214 H VAL 29 H VAL 29 22.732 22.858 28.819 215 HA VAL 29 HA VAL 29 24.102 22.050 31.317 216 HB VAL 29 HB VAL 29 25.339 24.168 31.365 217 HG11 VAL 29 HG11 VAL 29 26.428 22.068 30.617 218 HG12 VAL 29 HG12 VAL 29 26.084 22.513 28.931 219 HG13 VAL 29 HG13 VAL 29 27.148 23.521 29.923 220 HG21 VAL 29 HG21 VAL 29 25.747 25.402 29.249 221 HG22 VAL 29 HG22 VAL 29 24.475 24.467 28.456 222 HG23 VAL 29 HG23 VAL 29 24.084 25.557 29.803 223 HA PRO 30 HA PRO 30 20.792 24.480 33.099 224 HB2 PRO 30 HB2 PRO 30 21.233 24.054 35.680 225 HB3 PRO 30 HB3 PRO 30 20.971 22.685 34.547 226 HG2 PRO 30 HG2 PRO 30 23.622 23.781 35.544 227 HG3 PRO 30 HG3 PRO 30 23.063 22.074 35.594 228 HD2 PRO 30 HD2 PRO 30 24.599 23.105 33.529 229 HD3 PRO 30 HD3 PRO 30 23.384 21.809 33.309 230 H TYR 31 H TYR 31 22.662 26.111 32.112 231 HA TYR 31 HA TYR 31 23.684 28.096 34.036 232 HB2 TYR 31 HB2 TYR 31 23.713 28.020 31.008 233 HB3 TYR 31 HB3 TYR 31 24.521 29.231 31.982 234 HD1 TYR 31 HD1 TYR 31 26.154 28.234 30.105 235 HD2 TYR 31 HD2 TYR 31 25.172 26.347 33.860 236 HE1 TYR 31 HE1 TYR 31 28.253 26.881 29.991 237 HE2 TYR 31 HE2 TYR 31 27.244 24.996 33.713 238 HH TYR 31 HH TYR 31 29.352 25.041 30.841 Start of MODEL 3 1 H1 ALA 1 H1 ALA 1 35.002 28.598 16.998 2 H2 ALA 1 H2 ALA 1 36.155 27.878 16.075 3 H3 ALA 1 H3 ALA 1 36.447 28.149 17.663 4 HA ALA 1 HA ALA 1 35.992 25.870 17.394 5 HB1 ALA 1 HB1 ALA 1 35.158 26.935 19.466 6 HB2 ALA 1 HB2 ALA 1 33.605 27.265 18.672 7 HB3 ALA 1 HB3 ALA 1 34.130 25.591 18.952 8 H PHE 2 H PHE 2 34.861 24.183 16.466 9 HA PHE 2 HA PHE 2 33.360 24.961 14.044 10 HB2 PHE 2 HB2 PHE 2 34.517 22.255 14.783 11 HB3 PHE 2 HB3 PHE 2 34.009 22.789 13.189 12 HD1 PHE 2 HD1 PHE 2 36.833 22.039 15.003 13 HD2 PHE 2 HD2 PHE 2 35.270 25.186 12.500 14 HE1 PHE 2 HE1 PHE 2 39.145 22.694 14.365 15 HE2 PHE 2 HE2 PHE 2 37.579 25.846 11.890 16 HZ PHE 2 HZ PHE 2 39.521 24.587 12.805 17 H CYS 3 H CYS 3 32.319 24.419 16.921 18 HA CYS 3 HA CYS 3 30.160 22.486 16.575 19 HB2 CYS 3 HB2 CYS 3 29.375 23.475 18.734 20 HB3 CYS 3 HB3 CYS 3 31.038 22.910 18.764 21 H ASN 4 H ASN 4 27.942 23.009 16.441 22 HA ASN 4 HA ASN 4 27.254 25.565 15.024 23 HB2 ASN 4 HB2 ASN 4 25.779 22.915 14.813 24 HB3 ASN 4 HB3 ASN 4 25.496 24.382 13.888 25 HD21 ASN 4 HD21 ASN 4 28.503 23.825 11.869 26 HD22 ASN 4 HD22 ASN 4 27.653 25.181 12.617 27 H LEU 5 H LEU 5 27.133 26.635 16.977 28 HA LEU 5 HA LEU 5 25.978 25.648 19.350 29 HB2 LEU 5 HB2 LEU 5 27.729 27.387 19.172 30 HB3 LEU 5 HB3 LEU 5 26.567 28.485 18.446 31 HG LEU 5 HG LEU 5 25.224 28.477 20.563 32 HD11 LEU 5 HD11 LEU 5 27.585 26.837 21.635 33 HD12 LEU 5 HD12 LEU 5 26.324 27.603 22.622 34 HD13 LEU 5 HD13 LEU 5 25.884 26.307 21.522 35 HD21 LEU 5 HD21 LEU 5 26.934 30.207 20.115 36 HD22 LEU 5 HD22 LEU 5 26.816 29.845 21.836 37 HD23 LEU 5 HD23 LEU 5 28.177 29.202 20.890 38 H ARG 6 H ARG 6 24.510 27.885 16.915 39 HA ARG 6 HA ARG 6 22.082 28.266 18.440 40 HB2 ARG 6 HB2 ARG 6 22.829 28.720 15.537 41 HB3 ARG 6 HB3 ARG 6 21.192 29.021 16.136 42 HG2 ARG 6 HG2 ARG 6 21.957 30.624 17.767 43 HG3 ARG 6 HG3 ARG 6 23.651 30.250 17.461 44 HD2 ARG 6 HD2 ARG 6 21.813 31.352 15.301 45 HD3 ARG 6 HD3 ARG 6 22.684 32.399 16.420 46 HE ARG 6 HE ARG 6 23.845 30.795 14.232 47 HH11 ARG 6 HH11 ARG 6 24.658 32.562 17.197 48 HH12 ARG 6 HH12 ARG 6 26.324 32.678 16.729 49 HH21 ARG 6 HH21 ARG 6 25.942 31.207 13.667 50 HH22 ARG 6 HH22 ARG 6 26.877 32.316 14.657 51 H ARG 7 H ARG 7 22.832 25.902 15.875 52 HA ARG 7 HA ARG 7 20.266 24.593 15.857 53 HB2 ARG 7 HB2 ARG 7 22.009 24.306 14.097 54 HB3 ARG 7 HB3 ARG 7 23.027 23.467 15.247 55 HG2 ARG 7 HG2 ARG 7 21.941 21.899 13.727 56 HG3 ARG 7 HG3 ARG 7 21.487 21.601 15.392 57 HD2 ARG 7 HD2 ARG 7 19.579 21.250 14.000 58 HD3 ARG 7 HD3 ARG 7 19.279 22.683 14.985 59 HE ARG 7 HE ARG 7 20.354 23.639 12.563 60 HH11 ARG 7 HH11 ARG 7 17.504 21.554 13.086 61 HH12 ARG 7 HH12 ARG 7 16.719 22.321 11.741 62 HH21 ARG 7 HH21 ARG 7 19.119 24.560 10.995 63 HH22 ARG 7 HH22 ARG 7 17.426 24.152 10.902 64 H CYS 8 H CYS 8 23.079 24.168 17.963 65 HA CYS 8 HA CYS 8 21.995 21.938 19.474 66 HB2 CYS 8 HB2 CYS 8 24.388 22.507 19.327 67 HB3 CYS 8 HB3 CYS 8 24.088 24.036 20.132 68 H GLU 9 H GLU 9 22.183 25.483 20.223 69 HA GLU 9 HA GLU 9 20.783 25.447 22.652 70 HB2 GLU 9 HB2 GLU 9 21.180 27.525 20.486 71 HB3 GLU 9 HB3 GLU 9 20.177 27.901 21.873 72 HG2 GLU 9 HG2 GLU 9 22.998 26.855 22.274 73 HG3 GLU 9 HG3 GLU 9 22.686 28.553 21.908 74 H LEU 10 H LEU 10 19.350 25.788 19.350 75 HA LEU 10 HA LEU 10 16.674 26.090 20.404 76 HB2 LEU 10 HB2 LEU 10 15.915 25.992 18.144 77 HB3 LEU 10 HB3 LEU 10 17.344 26.995 18.266 78 HG LEU 10 HG LEU 10 18.596 24.823 17.434 79 HD11 LEU 10 HD11 LEU 10 15.778 24.350 16.387 80 HD12 LEU 10 HD12 LEU 10 17.235 23.532 15.801 81 HD13 LEU 10 HD13 LEU 10 16.685 23.254 17.447 82 HD21 LEU 10 HD21 LEU 10 18.448 26.944 16.186 83 HD22 LEU 10 HD22 LEU 10 18.235 25.569 15.091 84 HD23 LEU 10 HD23 LEU 10 16.825 26.509 15.620 85 H SER 11 H SER 11 18.614 23.232 19.821 86 HA SER 11 HA SER 11 16.320 21.399 20.049 87 HB2 SER 11 HB2 SER 11 18.263 20.699 18.765 88 HB3 SER 11 HB3 SER 11 19.314 20.915 20.177 89 HG SER 11 HG SER 11 17.114 19.099 19.957 90 H CYS 12 H CYS 12 18.992 22.509 22.237 91 HA CYS 12 HA CYS 12 18.039 21.052 24.493 92 HB2 CYS 12 HB2 CYS 12 19.609 23.646 24.576 93 HB3 CYS 12 HB3 CYS 12 19.488 22.412 25.838 94 H ARG 13 H ARG 13 17.040 24.254 23.254 95 HA ARG 13 HA ARG 13 15.361 25.046 25.405 96 HB2 ARG 13 HB2 ARG 13 16.221 26.334 23.413 97 HB3 ARG 13 HB3 ARG 13 15.056 25.486 22.401 98 HG2 ARG 13 HG2 ARG 13 13.215 26.619 23.525 99 HG3 ARG 13 HG3 ARG 13 14.302 27.231 24.785 100 HD2 ARG 13 HD2 ARG 13 13.779 28.993 23.127 101 HD3 ARG 13 HD3 ARG 13 15.507 28.609 23.156 102 HE ARG 13 HE ARG 13 14.009 27.064 21.174 103 HH11 ARG 13 HH11 ARG 13 15.817 30.140 21.452 104 HH12 ARG 13 HH12 ARG 13 16.004 30.129 19.694 105 HH21 ARG 13 HH21 ARG 13 14.127 27.424 19.076 106 HH22 ARG 13 HH22 ARG 13 15.138 28.742 18.449 107 H SER 14 H SER 14 14.901 22.390 23.191 108 HA SER 14 HA SER 14 12.004 22.153 23.556 109 HB2 SER 14 HB2 SER 14 13.307 21.078 21.678 110 HB3 SER 14 HB3 SER 14 14.026 19.981 22.874 111 HG SER 14 HG SER 14 11.343 20.257 22.061 112 H LEU 15 H LEU 15 14.877 20.974 25.266 113 HA LEU 15 HA LEU 15 13.357 19.457 27.288 114 HB2 LEU 15 HB2 LEU 15 16.266 20.315 27.264 115 HB3 LEU 15 HB3 LEU 15 15.545 19.053 28.257 116 HG LEU 15 HG LEU 15 15.920 18.979 25.223 117 HD11 LEU 15 HD11 LEU 15 18.026 18.820 26.481 118 HD12 LEU 15 HD12 LEU 15 17.357 17.486 27.447 119 HD13 LEU 15 HD13 LEU 15 17.619 17.283 25.704 120 HD21 LEU 15 HD21 LEU 15 14.934 16.809 27.119 121 HD22 LEU 15 HD22 LEU 15 13.948 17.640 25.894 122 HD23 LEU 15 HD23 LEU 15 15.288 16.600 25.392 123 H GLY 16 H GLY 16 14.970 22.563 26.934 124 HA2 GLY 16 HA2 GLY 16 14.033 24.536 28.092 125 HA3 GLY 16 HA3 GLY 16 13.916 23.561 29.556 126 H LEU 17 H LEU 17 16.819 22.878 27.836 127 HA LEU 17 HA LEU 17 18.359 24.340 29.951 128 HB2 LEU 17 HB2 LEU 17 19.819 22.254 28.495 129 HB3 LEU 17 HB3 LEU 17 19.771 22.651 30.202 130 HG LEU 17 HG LEU 17 17.828 20.968 28.667 131 HD11 LEU 17 HD11 LEU 17 18.769 19.091 29.966 132 HD12 LEU 17 HD12 LEU 17 20.009 19.894 29.009 133 HD13 LEU 17 HD13 LEU 17 19.908 20.200 30.754 134 HD21 LEU 17 HD21 LEU 17 17.990 21.435 31.707 135 HD22 LEU 17 HD22 LEU 17 16.669 22.003 30.676 136 HD23 LEU 17 HD23 LEU 17 16.909 20.278 30.910 137 H LEU 18 H LEU 18 20.757 24.565 29.203 138 HA LEU 18 HA LEU 18 20.782 26.323 26.802 139 HB2 LEU 18 HB2 LEU 18 22.833 25.853 29.033 140 HB3 LEU 18 HB3 LEU 18 23.044 26.933 27.671 141 HG LEU 18 HG LEU 18 21.210 28.373 28.483 142 HD11 LEU 18 HD11 LEU 18 21.141 26.521 30.890 143 HD12 LEU 18 HD12 LEU 18 20.484 28.170 30.864 144 HD13 LEU 18 HD13 LEU 18 19.779 26.957 29.818 145 HD21 LEU 18 HD21 LEU 18 23.555 28.801 29.086 146 HD22 LEU 18 HD22 LEU 18 22.479 29.250 30.421 147 HD23 LEU 18 HD23 LEU 18 23.395 27.738 30.505 148 H GLY 19 H GLY 19 22.001 25.835 25.032 149 HA2 GLY 19 HA2 GLY 19 23.414 23.198 24.885 150 HA3 GLY 19 HA3 GLY 19 23.012 24.260 23.535 151 H LYS 20 H LYS 20 25.552 23.257 25.561 152 HA LYS 20 HA LYS 20 27.184 25.680 24.897 153 HB2 LYS 20 HB2 LYS 20 27.422 23.723 27.201 154 HB3 LYS 20 HB3 LYS 20 28.596 24.990 26.789 155 HG2 LYS 20 HG2 LYS 20 26.656 26.672 26.927 156 HG3 LYS 20 HG3 LYS 20 25.693 25.368 27.669 157 HD2 LYS 20 HD2 LYS 20 27.473 25.053 29.344 158 HD3 LYS 20 HD3 LYS 20 28.407 26.364 28.582 159 HE2 LYS 20 HE2 LYS 20 26.375 27.887 29.039 160 HE3 LYS 20 HE3 LYS 20 25.743 26.579 30.050 161 HZ1 LYS 20 HZ1 LYS 20 27.985 26.724 31.217 162 HZ2 LYS 20 HZ2 LYS 20 28.199 28.171 30.469 163 HZ3 LYS 20 HZ3 LYS 20 26.913 27.942 31.500 164 H CYS 21 H CYS 21 29.050 25.584 24.008 165 HA CYS 21 HA CYS 21 29.559 23.308 22.255 166 HB2 CYS 21 HB2 CYS 21 29.595 25.553 21.406 167 HB3 CYS 21 HB3 CYS 21 30.810 26.046 22.583 168 H ILE 22 H ILE 22 31.275 21.999 22.136 169 HA ILE 22 HA ILE 22 33.660 22.414 23.809 170 HB ILE 22 HB ILE 22 32.392 20.954 25.142 171 HG12 ILE 22 HG12 ILE 22 34.505 19.253 23.785 172 HG13 ILE 22 HG13 ILE 22 34.886 20.656 24.785 173 HG21 ILE 22 HG21 ILE 22 30.841 19.957 23.472 174 HG22 ILE 22 HG22 ILE 22 32.167 18.939 22.871 175 HG23 ILE 22 HG23 ILE 22 31.572 18.754 24.527 176 HD11 ILE 22 HD11 ILE 22 33.674 19.617 26.701 177 HD12 ILE 22 HD12 ILE 22 33.435 18.153 25.718 178 HD13 ILE 22 HD13 ILE 22 35.075 18.681 26.142 179 H GLY 23 H GLY 23 34.474 23.275 21.978 180 HA2 GLY 23 HA2 GLY 23 35.863 23.384 20.199 181 HA3 GLY 23 HA3 GLY 23 36.096 21.645 20.344 182 H GLU 24 H GLU 24 34.140 20.393 19.539 183 HA GLU 24 HA GLU 24 33.182 21.350 16.884 184 HB2 GLU 24 HB2 GLU 24 34.108 19.628 15.680 185 HB3 GLU 24 HB3 GLU 24 35.401 20.429 16.547 186 HG2 GLU 24 HG2 GLU 24 34.107 17.772 17.310 187 HG3 GLU 24 HG3 GLU 24 35.581 18.007 16.388 188 H ALA 25 H ALA 25 32.126 20.355 19.624 189 HA ALA 25 HA ALA 25 29.693 19.080 18.584 190 HB1 ALA 25 HB1 ALA 25 29.749 17.346 20.319 191 HB2 ALA 25 HB2 ALA 25 31.161 17.197 19.261 192 HB3 ALA 25 HB3 ALA 25 31.330 17.921 20.878 193 H CYS 26 H CYS 26 28.027 19.053 20.465 194 HA CYS 26 HA CYS 26 28.424 21.156 22.496 195 HB2 CYS 26 HB2 CYS 26 27.765 22.371 20.505 196 HB3 CYS 26 HB3 CYS 26 26.387 21.310 20.255 197 H LYS 27 H LYS 27 27.208 20.938 24.286 198 HA LYS 27 HA LYS 27 25.386 18.543 24.494 199 HB2 LYS 27 HB2 LYS 27 27.232 19.631 26.651 200 HB3 LYS 27 HB3 LYS 27 26.229 18.193 26.746 201 HG2 LYS 27 HG2 LYS 27 28.702 18.584 25.020 202 HG3 LYS 27 HG3 LYS 27 28.544 17.593 26.467 203 HD2 LYS 27 HD2 LYS 27 26.917 16.114 25.256 204 HD3 LYS 27 HD3 LYS 27 27.199 17.077 23.785 205 HE2 LYS 27 HE2 LYS 27 29.688 16.608 24.085 206 HE3 LYS 27 HE3 LYS 27 29.261 15.470 25.365 207 HZ1 LYS 27 HZ1 LYS 27 28.363 15.293 22.534 208 HZ2 LYS 27 HZ2 LYS 27 29.552 14.389 23.224 209 HZ3 LYS 27 HZ3 LYS 27 27.984 14.208 23.705 210 H CYS 28 H CYS 28 23.631 18.642 25.916 211 HA CYS 28 HA CYS 28 22.607 21.383 26.414 212 HB2 CYS 28 HB2 CYS 28 21.204 18.706 26.660 213 HB3 CYS 28 HB3 CYS 28 20.472 20.294 26.861 214 H VAL 29 H VAL 29 22.734 22.294 28.377 215 HA VAL 29 HA VAL 29 22.845 20.667 30.852 216 HB VAL 29 HB VAL 29 24.794 21.958 31.651 217 HG11 VAL 29 HG11 VAL 29 26.499 20.636 30.573 218 HG12 VAL 29 HG12 VAL 29 25.044 19.650 30.781 219 HG13 VAL 29 HG13 VAL 29 25.451 20.314 29.182 220 HG21 VAL 29 HG21 VAL 29 24.776 23.882 30.094 221 HG22 VAL 29 HG22 VAL 29 26.327 23.034 30.053 222 HG23 VAL 29 HG23 VAL 29 25.158 22.803 28.739 223 HA PRO 30 HA PRO 30 20.578 24.256 32.307 224 HB2 PRO 30 HB2 PRO 30 20.186 23.618 34.873 225 HB3 PRO 30 HB3 PRO 30 19.580 22.578 33.550 226 HG2 PRO 30 HG2 PRO 30 22.150 22.244 35.142 227 HG3 PRO 30 HG3 PRO 30 20.869 21.017 34.858 228 HD2 PRO 30 HD2 PRO 30 23.126 21.217 33.299 229 HD3 PRO 30 HD3 PRO 30 21.549 20.680 32.653 230 H TYR 31 H TYR 31 23.442 24.554 32.172 231 HA TYR 31 HA TYR 31 24.374 25.888 34.645 232 HB2 TYR 31 HB2 TYR 31 25.925 25.154 32.153 233 HB3 TYR 31 HB3 TYR 31 26.610 25.677 33.681 234 HD1 TYR 31 HD1 TYR 31 27.587 23.311 32.345 235 HD2 TYR 31 HD2 TYR 31 24.347 23.707 35.158 236 HE1 TYR 31 HE1 TYR 31 27.876 20.932 33.015 237 HE2 TYR 31 HE2 TYR 31 24.627 21.338 35.821 238 HH TYR 31 HH TYR 31 27.134 19.224 34.368 Start of MODEL 4 1 H1 ALA 1 H1 ALA 1 35.325 24.086 17.428 2 H2 ALA 1 H2 ALA 1 36.957 24.053 17.230 3 H3 ALA 1 H3 ALA 1 35.997 23.014 16.366 4 HA ALA 1 HA ALA 1 36.047 25.922 16.160 5 HB1 ALA 1 HB1 ALA 1 38.027 24.912 15.112 6 HB2 ALA 1 HB2 ALA 1 36.982 23.856 14.136 7 HB3 ALA 1 HB3 ALA 1 36.947 25.617 13.896 8 H PHE 2 H PHE 2 34.717 23.068 14.591 9 HA PHE 2 HA PHE 2 32.561 24.810 13.488 10 HB2 PHE 2 HB2 PHE 2 33.609 22.230 12.338 11 HB3 PHE 2 HB3 PHE 2 32.444 23.331 11.598 12 HD1 PHE 2 HD1 PHE 2 33.289 25.928 11.546 13 HD2 PHE 2 HD2 PHE 2 35.844 22.451 11.595 14 HE1 PHE 2 HE1 PHE 2 35.172 27.299 10.704 15 HE2 PHE 2 HE2 PHE 2 37.723 23.828 10.745 16 HZ PHE 2 HZ PHE 2 37.401 26.261 10.322 17 H CYS 3 H CYS 3 31.949 24.164 15.975 18 HA CYS 3 HA CYS 3 29.719 22.216 15.883 19 HB2 CYS 3 HB2 CYS 3 29.337 23.023 18.208 20 HB3 CYS 3 HB3 CYS 3 30.966 22.412 17.967 21 H ASN 4 H ASN 4 27.564 22.829 15.597 22 HA ASN 4 HA ASN 4 27.096 25.669 14.782 23 HB2 ASN 4 HB2 ASN 4 25.506 23.154 14.208 24 HB3 ASN 4 HB3 ASN 4 24.978 24.784 13.827 25 HD21 ASN 4 HD21 ASN 4 27.748 23.072 11.420 26 HD22 ASN 4 HD22 ASN 4 27.151 22.244 12.863 27 H LEU 5 H LEU 5 27.093 26.642 16.713 28 HA LEU 5 HA LEU 5 25.942 25.562 19.051 29 HB2 LEU 5 HB2 LEU 5 27.824 27.084 19.013 30 HB3 LEU 5 HB3 LEU 5 26.828 28.368 18.337 31 HG LEU 5 HG LEU 5 25.526 28.518 20.424 32 HD11 LEU 5 HD11 LEU 5 27.422 26.364 21.472 33 HD12 LEU 5 HD12 LEU 5 26.294 27.320 22.457 34 HD13 LEU 5 HD13 LEU 5 25.663 26.195 21.256 35 HD21 LEU 5 HD21 LEU 5 28.546 28.534 20.860 36 HD22 LEU 5 HD22 LEU 5 27.611 29.833 20.094 37 HD23 LEU 5 HD23 LEU 5 27.346 29.448 21.794 38 H ARG 6 H ARG 6 24.441 28.005 16.830 39 HA ARG 6 HA ARG 6 22.188 28.450 18.608 40 HB2 ARG 6 HB2 ARG 6 22.987 30.029 16.814 41 HB3 ARG 6 HB3 ARG 6 22.290 28.928 15.617 42 HG2 ARG 6 HG2 ARG 6 20.042 29.255 16.590 43 HG3 ARG 6 HG3 ARG 6 20.732 30.262 17.869 44 HD2 ARG 6 HD2 ARG 6 19.705 31.672 16.184 45 HD3 ARG 6 HD3 ARG 6 21.457 31.931 16.184 46 HE ARG 6 HE ARG 6 21.127 30.000 14.243 47 HH11 ARG 6 HH11 ARG 6 19.591 33.192 14.544 48 HH12 ARG 6 HH12 ARG 6 19.286 33.218 12.833 49 HH21 ARG 6 HH21 ARG 6 20.730 30.182 12.218 50 HH22 ARG 6 HH22 ARG 6 20.216 31.696 11.478 51 H ARG 7 H ARG 7 22.727 26.214 15.884 52 HA ARG 7 HA ARG 7 20.144 24.907 15.912 53 HB2 ARG 7 HB2 ARG 7 22.939 24.119 15.026 54 HB3 ARG 7 HB3 ARG 7 21.604 22.965 14.961 55 HG2 ARG 7 HG2 ARG 7 20.411 24.166 13.359 56 HG3 ARG 7 HG3 ARG 7 21.233 25.684 13.704 57 HD2 ARG 7 HD2 ARG 7 21.811 24.640 11.503 58 HD3 ARG 7 HD3 ARG 7 23.176 25.075 12.531 59 HE ARG 7 HE ARG 7 22.599 22.339 13.039 60 HH11 ARG 7 HH11 ARG 7 23.800 24.240 10.308 61 HH12 ARG 7 HH12 ARG 7 24.909 22.979 9.834 62 HH21 ARG 7 HH21 ARG 7 23.708 20.676 12.076 63 HH22 ARG 7 HH22 ARG 7 24.753 21.006 10.715 64 H CYS 8 H CYS 8 23.071 24.309 17.860 65 HA CYS 8 HA CYS 8 21.933 22.069 19.309 66 HB2 CYS 8 HB2 CYS 8 24.316 22.384 19.233 67 HB3 CYS 8 HB3 CYS 8 24.184 24.003 19.920 68 H GLU 9 H GLU 9 22.230 25.574 20.125 69 HA GLU 9 HA GLU 9 20.990 25.506 22.651 70 HB2 GLU 9 HB2 GLU 9 21.304 27.599 20.495 71 HB3 GLU 9 HB3 GLU 9 20.375 27.974 21.926 72 HG2 GLU 9 HG2 GLU 9 23.096 26.759 22.387 73 HG3 GLU 9 HG3 GLU 9 23.034 28.397 21.732 74 H LEU 10 H LEU 10 19.354 25.967 19.449 75 HA LEU 10 HA LEU 10 16.744 26.177 20.698 76 HB2 LEU 10 HB2 LEU 10 15.831 26.223 18.522 77 HB3 LEU 10 HB3 LEU 10 17.321 27.131 18.518 78 HG LEU 10 HG LEU 10 18.367 24.909 17.562 79 HD11 LEU 10 HD11 LEU 10 16.830 23.698 16.060 80 HD12 LEU 10 HD12 LEU 10 16.326 23.472 17.723 81 HD13 LEU 10 HD13 LEU 10 15.449 24.622 16.693 82 HD21 LEU 10 HD21 LEU 10 18.247 27.044 16.352 83 HD22 LEU 10 HD22 LEU 10 17.883 25.691 15.275 84 HD23 LEU 10 HD23 LEU 10 16.562 26.705 15.894 85 H SER 11 H SER 11 18.695 23.433 19.801 86 HA SER 11 HA SER 11 16.574 21.438 20.005 87 HB2 SER 11 HB2 SER 11 18.733 21.301 18.646 88 HB3 SER 11 HB3 SER 11 19.572 20.978 20.172 89 HG SER 11 HG SER 11 18.156 19.376 18.591 90 H CYS 12 H CYS 12 19.084 22.748 22.202 91 HA CYS 12 HA CYS 12 18.369 21.088 24.472 92 HB2 CYS 12 HB2 CYS 12 19.798 23.767 24.324 93 HB3 CYS 12 HB3 CYS 12 19.657 22.769 25.770 94 H ARG 13 H ARG 13 17.310 24.394 23.372 95 HA ARG 13 HA ARG 13 15.574 24.892 25.511 96 HB2 ARG 13 HB2 ARG 13 16.187 26.174 23.124 97 HB3 ARG 13 HB3 ARG 13 14.559 25.624 22.795 98 HG2 ARG 13 HG2 ARG 13 14.351 27.805 23.772 99 HG3 ARG 13 HG3 ARG 13 13.858 26.671 25.032 100 HD2 ARG 13 HD2 ARG 13 15.296 28.353 26.003 101 HD3 ARG 13 HD3 ARG 13 16.180 26.827 26.026 102 HE ARG 13 HE ARG 13 16.531 28.912 23.904 103 HH11 ARG 13 HH11 ARG 13 18.240 26.383 25.767 104 HH12 ARG 13 HH12 ARG 13 19.748 27.053 25.136 105 HH21 ARG 13 HH21 ARG 13 18.559 29.644 23.476 106 HH22 ARG 13 HH22 ARG 13 19.923 28.705 24.100 107 H SER 14 H SER 14 14.946 22.744 22.739 108 HA SER 14 HA SER 14 12.172 22.313 23.347 109 HB2 SER 14 HB2 SER 14 13.309 21.621 21.240 110 HB3 SER 14 HB3 SER 14 14.090 20.294 22.124 111 HG SER 14 HG SER 14 12.002 19.913 20.963 112 H LEU 15 H LEU 15 15.116 20.729 24.649 113 HA LEU 15 HA LEU 15 13.679 18.983 26.478 114 HB2 LEU 15 HB2 LEU 15 16.524 20.016 26.742 115 HB3 LEU 15 HB3 LEU 15 15.822 18.595 27.503 116 HG LEU 15 HG LEU 15 16.379 18.951 24.528 117 HD11 LEU 15 HD11 LEU 15 18.091 17.227 24.901 118 HD12 LEU 15 HD12 LEU 15 18.393 18.650 25.916 119 HD13 LEU 15 HD13 LEU 15 17.693 17.182 26.629 120 HD21 LEU 15 HD21 LEU 15 15.294 16.532 26.046 121 HD22 LEU 15 HD22 LEU 15 14.423 17.481 24.820 122 HD23 LEU 15 HD23 LEU 15 15.834 16.527 24.354 123 H GLY 16 H GLY 16 14.840 22.311 26.661 124 HA2 GLY 16 HA2 GLY 16 13.588 23.877 28.065 125 HA3 GLY 16 HA3 GLY 16 13.522 22.663 29.337 126 H LEU 17 H LEU 17 16.610 22.974 27.697 127 HA LEU 17 HA LEU 17 17.707 24.656 29.904 128 HB2 LEU 17 HB2 LEU 17 19.629 22.943 29.865 129 HB3 LEU 17 HB3 LEU 17 18.222 22.702 30.868 130 HG LEU 17 HG LEU 17 18.407 21.328 28.174 131 HD11 LEU 17 HD11 LEU 17 19.518 19.453 29.263 132 HD12 LEU 17 HD12 LEU 17 20.511 20.907 29.477 133 HD13 LEU 17 HD13 LEU 17 19.533 20.312 30.820 134 HD21 LEU 17 HD21 LEU 17 17.147 20.532 30.857 135 HD22 LEU 17 HD22 LEU 17 16.245 21.069 29.439 136 HD23 LEU 17 HD23 LEU 17 17.132 19.548 29.385 137 H LEU 18 H LEU 18 20.071 25.103 29.567 138 HA LEU 18 HA LEU 18 20.378 26.539 27.017 139 HB2 LEU 18 HB2 LEU 18 21.830 26.483 29.659 140 HB3 LEU 18 HB3 LEU 18 22.612 27.150 28.229 141 HG LEU 18 HG LEU 18 20.809 28.771 27.907 142 HD11 LEU 18 HD11 LEU 18 18.858 27.701 28.901 143 HD12 LEU 18 HD12 LEU 18 19.646 27.664 30.499 144 HD13 LEU 18 HD13 LEU 18 19.179 29.207 29.756 145 HD21 LEU 18 HD21 LEU 18 21.346 30.204 29.804 146 HD22 LEU 18 HD22 LEU 18 21.896 28.810 30.750 147 HD23 LEU 18 HD23 LEU 18 22.795 29.320 29.298 148 H GLY 19 H GLY 19 22.189 26.319 25.576 149 HA2 GLY 19 HA2 GLY 19 23.476 23.605 25.554 150 HA3 GLY 19 HA3 GLY 19 23.122 24.570 24.134 151 H LYS 20 H LYS 20 25.655 23.379 25.206 152 HA LYS 20 HA LYS 20 27.461 25.725 24.913 153 HB2 LYS 20 HB2 LYS 20 27.475 23.489 26.989 154 HB3 LYS 20 HB3 LYS 20 28.941 24.365 26.583 155 HG2 LYS 20 HG2 LYS 20 26.413 25.651 27.708 156 HG3 LYS 20 HG3 LYS 20 27.884 25.238 28.603 157 HD2 LYS 20 HD2 LYS 20 29.139 26.698 26.879 158 HD3 LYS 20 HD3 LYS 20 27.548 27.329 26.420 159 HE2 LYS 20 HE2 LYS 20 27.204 28.345 28.523 160 HE3 LYS 20 HE3 LYS 20 28.329 27.242 29.334 161 HZ1 LYS 20 HZ1 LYS 20 29.162 29.424 27.499 162 HZ2 LYS 20 HZ2 LYS 20 29.355 29.386 29.144 163 HZ3 LYS 20 HZ3 LYS 20 30.165 28.335 28.218 164 H CYS 21 H CYS 21 28.998 25.491 23.443 165 HA CYS 21 HA CYS 21 29.210 23.073 21.847 166 HB2 CYS 21 HB2 CYS 21 29.434 25.154 20.757 167 HB3 CYS 21 HB3 CYS 21 30.665 25.723 21.887 168 H ILE 22 H ILE 22 30.683 21.486 21.798 169 HA ILE 22 HA ILE 22 32.776 21.266 23.903 170 HB ILE 22 HB ILE 22 31.774 19.134 22.011 171 HG12 ILE 22 HG12 ILE 22 30.878 19.646 24.890 172 HG13 ILE 22 HG13 ILE 22 29.901 19.944 23.456 173 HG21 ILE 22 HG21 ILE 22 33.318 18.938 24.645 174 HG22 ILE 22 HG22 ILE 22 32.799 17.567 23.642 175 HG23 ILE 22 HG23 ILE 22 33.998 18.663 23.033 176 HD11 ILE 22 HD11 ILE 22 30.785 17.268 24.528 177 HD12 ILE 22 HD12 ILE 22 29.150 17.867 24.234 178 HD13 ILE 22 HD13 ILE 22 30.186 17.480 22.861 179 H GLY 23 H GLY 23 32.385 21.785 20.493 180 HA2 GLY 23 HA2 GLY 23 34.666 22.952 19.783 181 HA3 GLY 23 HA3 GLY 23 35.203 21.259 19.770 182 H GLU 24 H GLU 24 33.470 19.782 18.658 183 HA GLU 24 HA GLU 24 32.228 21.024 16.242 184 HB2 GLU 24 HB2 GLU 24 33.745 18.424 16.654 185 HB3 GLU 24 HB3 GLU 24 32.515 18.578 15.401 186 HG2 GLU 24 HG2 GLU 24 34.598 19.037 14.397 187 HG3 GLU 24 HG3 GLU 24 33.648 20.525 14.450 188 H ALA 25 H ALA 25 31.881 18.745 18.942 189 HA ALA 25 HA ALA 25 28.982 18.378 18.391 190 HB1 ALA 25 HB1 ALA 25 30.350 16.421 19.038 191 HB2 ALA 25 HB2 ALA 25 30.802 17.238 20.551 192 HB3 ALA 25 HB3 ALA 25 29.112 16.778 20.251 193 H CYS 26 H CYS 26 27.676 18.494 20.589 194 HA CYS 26 HA CYS 26 28.346 20.891 22.204 195 HB2 CYS 26 HB2 CYS 26 27.098 21.545 20.129 196 HB3 CYS 26 HB3 CYS 26 25.774 20.517 20.659 197 H LYS 27 H LYS 27 26.900 21.106 24.111 198 HA LYS 27 HA LYS 27 25.483 18.624 25.005 199 HB2 LYS 27 HB2 LYS 27 27.804 18.519 25.788 200 HB3 LYS 27 HB3 LYS 27 27.614 20.066 26.623 201 HG2 LYS 27 HG2 LYS 27 26.029 19.127 28.171 202 HG3 LYS 27 HG3 LYS 27 25.788 17.684 27.156 203 HD2 LYS 27 HD2 LYS 27 28.110 17.025 27.523 204 HD3 LYS 27 HD3 LYS 27 28.355 18.412 28.612 205 HE2 LYS 27 HE2 LYS 27 26.588 17.534 30.124 206 HE3 LYS 27 HE3 LYS 27 26.300 16.186 29.013 207 HZ1 LYS 27 HZ1 LYS 27 28.816 16.679 30.522 208 HZ2 LYS 27 HZ2 LYS 27 27.735 15.503 30.815 209 HZ3 LYS 27 HZ3 LYS 27 28.604 15.465 29.417 210 H CYS 28 H CYS 28 23.735 19.006 26.393 211 HA CYS 28 HA CYS 28 22.960 21.834 26.752 212 HB2 CYS 28 HB2 CYS 28 21.368 19.360 27.401 213 HB3 CYS 28 HB3 CYS 28 20.790 21.028 27.284 214 H VAL 29 H VAL 29 22.652 22.774 28.809 215 HA VAL 29 HA VAL 29 23.851 21.317 31.122 216 HB VAL 29 HB VAL 29 25.129 23.340 31.690 217 HG11 VAL 29 HG11 VAL 29 26.906 23.028 30.063 218 HG12 VAL 29 HG12 VAL 29 26.172 21.465 30.450 219 HG13 VAL 29 HG13 VAL 29 25.788 22.273 28.912 220 HG21 VAL 29 HG21 VAL 29 25.541 25.101 30.078 221 HG22 VAL 29 HG22 VAL 29 24.419 24.370 28.912 222 HG23 VAL 29 HG23 VAL 29 23.815 25.049 30.437 223 HA PRO 30 HA PRO 30 20.445 22.833 33.390 224 HB2 PRO 30 HB2 PRO 30 21.181 22.365 35.952 225 HB3 PRO 30 HB3 PRO 30 21.014 21.052 34.741 226 HG2 PRO 30 HG2 PRO 30 23.554 22.505 35.562 227 HG3 PRO 30 HG3 PRO 30 23.268 20.734 35.550 228 HD2 PRO 30 HD2 PRO 30 24.444 21.997 33.451 229 HD3 PRO 30 HD3 PRO 30 23.288 20.657 33.193 230 H TYR 31 H TYR 31 22.488 24.847 32.726 231 HA TYR 31 HA TYR 31 22.875 26.838 34.787 232 HB2 TYR 31 HB2 TYR 31 23.075 26.886 31.760 233 HB3 TYR 31 HB3 TYR 31 23.380 28.295 32.734 234 HD1 TYR 31 HD1 TYR 31 25.524 28.358 31.481 235 HD2 TYR 31 HD2 TYR 31 24.646 25.238 34.337 236 HE1 TYR 31 HE1 TYR 31 27.943 27.785 31.617 237 HE2 TYR 31 HE2 TYR 31 27.042 24.658 34.431 238 HH TYR 31 HH TYR 31 29.540 26.410 32.574 Start of MODEL 5 1 H1 ALA 1 H1 ALA 1 35.946 27.703 16.475 2 H2 ALA 1 H2 ALA 1 35.992 27.971 18.096 3 H3 ALA 1 H3 ALA 1 34.852 28.702 17.170 4 HA ALA 1 HA ALA 1 35.064 25.822 17.719 5 HB1 ALA 1 HB1 ALA 1 32.865 26.089 18.812 6 HB2 ALA 1 HB2 ALA 1 34.110 27.062 19.606 7 HB3 ALA 1 HB3 ALA 1 32.931 27.844 18.530 8 H PHE 2 H PHE 2 34.657 24.679 15.906 9 HA PHE 2 HA PHE 2 32.982 25.815 13.785 10 HB2 PHE 2 HB2 PHE 2 34.364 23.113 13.978 11 HB3 PHE 2 HB3 PHE 2 33.548 23.719 12.552 12 HD1 PHE 2 HD1 PHE 2 34.374 25.909 11.471 13 HD2 PHE 2 HD2 PHE 2 36.680 23.626 14.310 14 HE1 PHE 2 HE1 PHE 2 36.450 26.992 10.667 15 HE2 PHE 2 HE2 PHE 2 38.752 24.724 13.495 16 HZ PHE 2 HZ PHE 2 38.649 26.405 11.671 17 H CYS 3 H CYS 3 31.973 24.570 16.505 18 HA CYS 3 HA CYS 3 29.963 22.669 15.716 19 HB2 CYS 3 HB2 CYS 3 29.133 22.879 17.943 20 HB3 CYS 3 HB3 CYS 3 30.886 22.896 18.041 21 H ASN 4 H ASN 4 27.715 22.891 15.694 22 HA ASN 4 HA ASN 4 26.647 25.438 14.656 23 HB2 ASN 4 HB2 ASN 4 25.443 22.649 14.923 24 HB3 ASN 4 HB3 ASN 4 24.603 24.043 14.264 25 HD21 ASN 4 HD21 ASN 4 25.793 23.332 11.057 26 HD22 ASN 4 HD22 ASN 4 24.539 24.048 12.062 27 H LEU 5 H LEU 5 27.299 26.233 17.000 28 HA LEU 5 HA LEU 5 25.966 25.518 19.330 29 HB2 LEU 5 HB2 LEU 5 27.914 26.987 19.201 30 HB3 LEU 5 HB3 LEU 5 26.987 28.251 18.445 31 HG LEU 5 HG LEU 5 27.617 28.526 20.870 32 HD11 LEU 5 HD11 LEU 5 25.659 29.697 21.505 33 HD12 LEU 5 HD12 LEU 5 25.859 29.893 19.765 34 HD13 LEU 5 HD13 LEU 5 24.628 28.779 20.409 35 HD21 LEU 5 HD21 LEU 5 26.229 27.547 22.609 36 HD22 LEU 5 HD22 LEU 5 25.344 26.578 21.424 37 HD23 LEU 5 HD23 LEU 5 27.073 26.277 21.712 38 H ARG 6 H ARG 6 24.898 28.143 17.121 39 HA ARG 6 HA ARG 6 22.440 28.607 18.586 40 HB2 ARG 6 HB2 ARG 6 23.147 29.450 15.753 41 HB3 ARG 6 HB3 ARG 6 21.827 30.088 16.739 42 HG2 ARG 6 HG2 ARG 6 23.586 30.835 18.437 43 HG3 ARG 6 HG3 ARG 6 24.801 30.463 17.212 44 HD2 ARG 6 HD2 ARG 6 22.644 32.582 17.163 45 HD3 ARG 6 HD3 ARG 6 24.396 32.776 16.993 46 HE ARG 6 HE ARG 6 22.982 31.226 14.898 47 HH11 ARG 6 HH11 ARG 6 23.981 34.558 15.653 48 HH12 ARG 6 HH12 ARG 6 23.788 34.969 13.953 49 HH21 ARG 6 HH21 ARG 6 22.928 31.902 12.850 50 HH22 ARG 6 HH22 ARG 6 23.205 33.619 12.527 51 H ARG 7 H ARG 7 23.118 25.987 16.613 52 HA ARG 7 HA ARG 7 20.205 25.492 16.077 53 HB2 ARG 7 HB2 ARG 7 22.351 24.974 14.481 54 HB3 ARG 7 HB3 ARG 7 22.322 23.485 15.395 55 HG2 ARG 7 HG2 ARG 7 20.132 24.684 13.655 56 HG3 ARG 7 HG3 ARG 7 21.086 23.248 13.308 57 HD2 ARG 7 HD2 ARG 7 18.985 23.520 15.501 58 HD3 ARG 7 HD3 ARG 7 18.780 22.706 13.948 59 HE ARG 7 HE ARG 7 20.993 21.464 15.152 60 HH11 ARG 7 HH11 ARG 7 17.567 21.796 15.842 61 HH12 ARG 7 HH12 ARG 7 17.482 20.285 16.712 62 HH21 ARG 7 HH21 ARG 7 20.790 19.448 16.085 63 HH22 ARG 7 HH22 ARG 7 19.294 18.988 16.852 64 H CYS 8 H CYS 8 23.020 24.267 17.858 65 HA CYS 8 HA CYS 8 21.785 22.124 19.273 66 HB2 CYS 8 HB2 CYS 8 24.201 22.471 19.090 67 HB3 CYS 8 HB3 CYS 8 24.081 23.978 19.991 68 H GLU 9 H GLU 9 22.065 25.604 20.125 69 HA GLU 9 HA GLU 9 20.761 25.688 22.609 70 HB2 GLU 9 HB2 GLU 9 20.769 27.545 20.205 71 HB3 GLU 9 HB3 GLU 9 19.923 27.981 21.680 72 HG2 GLU 9 HG2 GLU 9 22.834 27.164 21.857 73 HG3 GLU 9 HG3 GLU 9 22.395 28.769 21.262 74 H LEU 10 H LEU 10 19.195 25.478 19.379 75 HA LEU 10 HA LEU 10 16.498 25.843 20.375 76 HB2 LEU 10 HB2 LEU 10 17.337 24.438 17.810 77 HB3 LEU 10 HB3 LEU 10 15.786 25.198 18.166 78 HG LEU 10 HG LEU 10 18.433 26.617 17.876 79 HD11 LEU 10 HD11 LEU 10 17.510 27.476 15.765 80 HD12 LEU 10 HD12 LEU 10 17.589 25.705 15.751 81 HD13 LEU 10 HD13 LEU 10 16.033 26.518 16.016 82 HD21 LEU 10 HD21 LEU 10 16.977 27.895 19.384 83 HD22 LEU 10 HD22 LEU 10 16.974 28.694 17.813 84 HD23 LEU 10 HD23 LEU 10 15.597 27.687 18.280 85 H SER 11 H SER 11 18.518 23.057 19.603 86 HA SER 11 HA SER 11 16.507 21.047 20.195 87 HB2 SER 11 HB2 SER 11 18.533 20.605 18.849 88 HB3 SER 11 HB3 SER 11 19.535 20.783 20.296 89 HG SER 11 HG SER 11 18.982 18.886 20.923 90 H CYS 12 H CYS 12 19.027 22.612 22.236 91 HA CYS 12 HA CYS 12 18.276 21.178 24.624 92 HB2 CYS 12 HB2 CYS 12 19.660 23.860 24.356 93 HB3 CYS 12 HB3 CYS 12 19.587 22.857 25.807 94 H ARG 13 H ARG 13 17.054 24.309 23.220 95 HA ARG 13 HA ARG 13 15.321 24.978 25.375 96 HB2 ARG 13 HB2 ARG 13 15.507 25.522 22.404 97 HB3 ARG 13 HB3 ARG 13 14.079 26.022 23.289 98 HG2 ARG 13 HG2 ARG 13 15.268 27.521 24.664 99 HG3 ARG 13 HG3 ARG 13 16.815 26.740 24.336 100 HD2 ARG 13 HD2 ARG 13 16.585 28.955 23.252 101 HD3 ARG 13 HD3 ARG 13 16.934 27.648 22.119 102 HE ARG 13 HE ARG 13 14.293 27.668 21.859 103 HH11 ARG 13 HH11 ARG 13 16.301 30.598 22.068 104 HH12 ARG 13 HH12 ARG 13 15.154 31.473 21.082 105 HH21 ARG 13 HH21 ARG 13 13.051 28.881 20.519 106 HH22 ARG 13 HH22 ARG 13 13.277 30.626 20.478 107 H SER 14 H SER 14 14.892 22.693 22.667 108 HA SER 14 HA SER 14 12.182 21.973 23.344 109 HB2 SER 14 HB2 SER 14 14.254 20.222 21.977 110 HB3 SER 14 HB3 SER 14 12.493 20.068 21.906 111 HG SER 14 HG SER 14 12.445 22.148 20.884 112 H LEU 15 H LEU 15 15.141 21.234 24.983 113 HA LEU 15 HA LEU 15 13.811 19.138 26.653 114 HB2 LEU 15 HB2 LEU 15 16.713 20.048 26.589 115 HB3 LEU 15 HB3 LEU 15 16.070 18.729 27.543 116 HG LEU 15 HG LEU 15 16.198 18.816 24.503 117 HD11 LEU 15 HD11 LEU 15 18.401 18.610 25.575 118 HD12 LEU 15 HD12 LEU 15 17.821 17.237 26.546 119 HD13 LEU 15 HD13 LEU 15 17.937 17.102 24.780 120 HD21 LEU 15 HD21 LEU 15 15.619 16.400 24.638 121 HD22 LEU 15 HD22 LEU 15 15.370 16.555 26.391 122 HD23 LEU 15 HD23 LEU 15 14.308 17.409 25.245 123 H GLY 16 H GLY 16 14.299 22.469 26.615 124 HA2 GLY 16 HA2 GLY 16 13.597 24.020 28.202 125 HA3 GLY 16 HA3 GLY 16 13.683 22.811 29.474 126 H LEU 17 H LEU 17 16.659 22.810 27.715 127 HA LEU 17 HA LEU 17 17.894 24.508 29.862 128 HB2 LEU 17 HB2 LEU 17 19.815 22.715 28.750 129 HB3 LEU 17 HB3 LEU 17 19.301 22.966 30.403 130 HG LEU 17 HG LEU 17 18.140 20.992 28.431 131 HD11 LEU 17 HD11 LEU 17 20.449 20.533 29.264 132 HD12 LEU 17 HD12 LEU 17 19.848 20.593 30.927 133 HD13 LEU 17 HD13 LEU 17 19.273 19.339 29.809 134 HD21 LEU 17 HD21 LEU 17 17.616 21.316 31.452 135 HD22 LEU 17 HD22 LEU 17 16.402 21.544 30.190 136 HD23 LEU 17 HD23 LEU 17 17.070 19.942 30.465 137 H LEU 18 H LEU 18 20.334 24.939 29.140 138 HA LEU 18 HA LEU 18 20.297 26.507 26.600 139 HB2 LEU 18 HB2 LEU 18 21.898 26.550 29.157 140 HB3 LEU 18 HB3 LEU 18 22.656 27.105 27.678 141 HG LEU 18 HG LEU 18 20.998 28.819 27.323 142 HD11 LEU 18 HD11 LEU 18 19.630 27.807 29.859 143 HD12 LEU 18 HD12 LEU 18 19.279 29.353 29.041 144 HD13 LEU 18 HD13 LEU 18 18.951 27.840 28.217 145 HD21 LEU 18 HD21 LEU 18 22.931 29.263 28.818 146 HD22 LEU 18 HD22 LEU 18 21.520 30.227 29.262 147 HD23 LEU 18 HD23 LEU 18 21.950 28.787 30.221 148 H GLY 19 H GLY 19 21.887 26.223 25.017 149 HA2 GLY 19 HA2 GLY 19 23.204 23.549 24.882 150 HA3 GLY 19 HA3 GLY 19 22.983 24.672 23.542 151 H LYS 20 H LYS 20 25.394 23.265 24.658 152 HA LYS 20 HA LYS 20 27.242 25.551 24.935 153 HB2 LYS 20 HB2 LYS 20 26.156 24.453 27.166 154 HB3 LYS 20 HB3 LYS 20 27.403 23.254 26.894 155 HG2 LYS 20 HG2 LYS 20 28.308 24.823 28.365 156 HG3 LYS 20 HG3 LYS 20 29.054 25.173 26.785 157 HD2 LYS 20 HD2 LYS 20 26.879 26.856 26.675 158 HD3 LYS 20 HD3 LYS 20 27.100 26.782 28.425 159 HE2 LYS 20 HE2 LYS 20 29.538 27.394 28.060 160 HE3 LYS 20 HE3 LYS 20 29.172 27.524 26.333 161 HZ1 LYS 20 HZ1 LYS 20 29.045 29.712 27.276 162 HZ2 LYS 20 HZ2 LYS 20 27.511 29.302 26.965 163 HZ3 LYS 20 HZ3 LYS 20 28.071 29.267 28.497 164 H CYS 21 H CYS 21 28.946 25.260 23.630 165 HA CYS 21 HA CYS 21 29.343 22.637 22.371 166 HB2 CYS 21 HB2 CYS 21 30.530 25.364 21.854 167 HB3 CYS 21 HB3 CYS 21 31.064 23.899 21.034 168 H ILE 22 H ILE 22 31.013 21.335 22.387 169 HA ILE 22 HA ILE 22 33.226 21.624 24.337 170 HB ILE 22 HB ILE 22 32.537 19.458 22.312 171 HG12 ILE 22 HG12 ILE 22 32.212 19.545 25.352 172 HG13 ILE 22 HG13 ILE 22 30.901 19.657 24.179 173 HG21 ILE 22 HG21 ILE 22 34.667 19.459 24.499 174 HG22 ILE 22 HG22 ILE 22 34.258 18.089 23.442 175 HG23 ILE 22 HG23 ILE 22 34.967 19.529 22.750 176 HD11 ILE 22 HD11 ILE 22 32.621 17.222 24.726 177 HD12 ILE 22 HD12 ILE 22 30.894 17.440 25.026 178 HD13 ILE 22 HD13 ILE 22 31.489 17.356 23.356 179 H GLY 23 H GLY 23 32.590 21.755 20.847 180 HA2 GLY 23 HA2 GLY 23 34.146 23.914 20.238 181 HA3 GLY 23 HA3 GLY 23 35.291 22.567 20.064 182 H GLU 24 H GLU 24 33.883 20.612 18.995 183 HA GLU 24 HA GLU 24 32.567 21.566 16.473 184 HB2 GLU 24 HB2 GLU 24 34.018 18.934 17.006 185 HB3 GLU 24 HB3 GLU 24 33.180 19.400 15.528 186 HG2 GLU 24 HG2 GLU 24 35.407 19.781 15.016 187 HG3 GLU 24 HG3 GLU 24 34.761 21.386 15.344 188 H ALA 25 H ALA 25 32.489 19.140 19.103 189 HA ALA 25 HA ALA 25 29.677 18.423 18.577 190 HB1 ALA 25 HB1 ALA 25 29.998 16.964 20.543 191 HB2 ALA 25 HB2 ALA 25 31.279 16.732 19.352 192 HB3 ALA 25 HB3 ALA 25 31.606 17.670 20.823 193 H CYS 26 H CYS 26 28.060 18.588 20.311 194 HA CYS 26 HA CYS 26 28.366 20.803 22.249 195 HB2 CYS 26 HB2 CYS 26 27.454 21.734 20.111 196 HB3 CYS 26 HB3 CYS 26 26.090 20.630 20.241 197 H LYS 27 H LYS 27 26.952 20.721 24.041 198 HA LYS 27 HA LYS 27 25.028 18.524 24.328 199 HB2 LYS 27 HB2 LYS 27 27.626 17.850 24.924 200 HB3 LYS 27 HB3 LYS 27 27.152 18.551 26.456 201 HG2 LYS 27 HG2 LYS 27 26.762 16.236 26.635 202 HG3 LYS 27 HG3 LYS 27 25.157 16.939 26.438 203 HD2 LYS 27 HD2 LYS 27 25.206 16.293 24.008 204 HD3 LYS 27 HD3 LYS 27 26.840 15.639 24.238 205 HE2 LYS 27 HE2 LYS 27 25.883 14.078 25.996 206 HE3 LYS 27 HE3 LYS 27 24.277 14.666 25.554 207 HZ1 LYS 27 HZ1 LYS 27 24.741 12.652 24.362 208 HZ2 LYS 27 HZ2 LYS 27 24.763 13.868 23.249 209 HZ3 LYS 27 HZ3 LYS 27 26.164 13.218 23.772 210 H CYS 28 H CYS 28 23.450 19.015 25.861 211 HA CYS 28 HA CYS 28 23.305 21.828 26.487 212 HB2 CYS 28 HB2 CYS 28 21.458 19.592 27.388 213 HB3 CYS 28 HB3 CYS 28 21.056 21.306 27.220 214 H VAL 29 H VAL 29 22.642 22.783 28.532 215 HA VAL 29 HA VAL 29 23.914 21.551 30.919 216 HB VAL 29 HB VAL 29 25.035 23.690 31.436 217 HG11 VAL 29 HG11 VAL 29 25.920 22.513 28.790 218 HG12 VAL 29 HG12 VAL 29 26.923 23.384 29.970 219 HG13 VAL 29 HG13 VAL 29 26.240 21.804 30.386 220 HG21 VAL 29 HG21 VAL 29 23.773 25.297 30.106 221 HG22 VAL 29 HG22 VAL 29 25.470 25.323 29.631 222 HG23 VAL 29 HG23 VAL 29 24.282 24.506 28.601 223 HA PRO 30 HA PRO 30 20.394 23.038 33.082 224 HB2 PRO 30 HB2 PRO 30 21.164 22.763 35.660 225 HB3 PRO 30 HB3 PRO 30 21.058 21.357 34.554 226 HG2 PRO 30 HG2 PRO 30 23.528 23.013 35.228 227 HG3 PRO 30 HG3 PRO 30 23.316 21.238 35.372 228 HD2 PRO 30 HD2 PRO 30 24.425 22.322 33.161 229 HD3 PRO 30 HD3 PRO 30 23.294 20.940 33.026 230 H TYR 31 H TYR 31 22.730 25.081 32.546 231 HA TYR 31 HA TYR 31 23.015 26.882 34.711 232 HB2 TYR 31 HB2 TYR 31 23.277 27.448 31.741 233 HB3 TYR 31 HB3 TYR 31 23.890 28.469 33.026 234 HD1 TYR 31 HD1 TYR 31 24.729 25.294 34.273 235 HD2 TYR 31 HD2 TYR 31 25.724 28.047 31.104 236 HE1 TYR 31 HE1 TYR 31 26.936 24.190 34.002 237 HE2 TYR 31 HE2 TYR 31 27.946 26.945 30.857 238 HH TYR 31 HH TYR 31 28.783 23.977 32.621 Start of MODEL 6 1 H1 ALA 1 H1 ALA 1 37.555 23.300 13.573 2 H2 ALA 1 H2 ALA 1 36.714 23.909 14.840 3 H3 ALA 1 H3 ALA 1 37.098 24.889 13.570 4 HA ALA 1 HA ALA 1 35.712 23.600 12.099 5 HB1 ALA 1 HB1 ALA 1 34.196 21.912 13.038 6 HB2 ALA 1 HB2 ALA 1 35.879 21.443 13.351 7 HB3 ALA 1 HB3 ALA 1 34.893 22.140 14.654 8 H PHE 2 H PHE 2 33.687 24.471 11.648 9 HA PHE 2 HA PHE 2 32.716 26.609 13.392 10 HB2 PHE 2 HB2 PHE 2 31.955 25.586 10.647 11 HB3 PHE 2 HB3 PHE 2 31.006 26.786 11.501 12 HD1 PHE 2 HD1 PHE 2 34.374 26.180 10.002 13 HD2 PHE 2 HD2 PHE 2 31.670 29.053 11.743 14 HE1 PHE 2 HE1 PHE 2 35.829 28.023 9.231 15 HE2 PHE 2 HE2 PHE 2 33.096 30.898 10.918 16 HZ PHE 2 HZ PHE 2 35.179 30.397 9.672 17 H CYS 3 H CYS 3 32.354 25.066 15.160 18 HA CYS 3 HA CYS 3 30.254 23.177 15.227 19 HB2 CYS 3 HB2 CYS 3 31.983 23.592 17.021 20 HB3 CYS 3 HB3 CYS 3 31.028 24.982 17.548 21 H ASN 4 H ASN 4 28.083 23.298 15.169 22 HA ASN 4 HA ASN 4 26.793 25.923 14.807 23 HB2 ASN 4 HB2 ASN 4 25.561 23.136 14.734 24 HB3 ASN 4 HB3 ASN 4 24.812 24.637 14.229 25 HD21 ASN 4 HD21 ASN 4 27.349 22.811 11.659 26 HD22 ASN 4 HD22 ASN 4 27.376 22.307 13.347 27 H LEU 5 H LEU 5 27.100 26.842 16.919 28 HA LEU 5 HA LEU 5 26.085 25.502 19.275 29 HB2 LEU 5 HB2 LEU 5 27.971 27.039 19.380 30 HB3 LEU 5 HB3 LEU 5 26.975 28.364 18.789 31 HG LEU 5 HG LEU 5 25.584 28.275 20.841 32 HD11 LEU 5 HD11 LEU 5 26.417 26.977 22.789 33 HD12 LEU 5 HD12 LEU 5 25.824 25.920 21.508 34 HD13 LEU 5 HD13 LEU 5 27.579 26.144 21.732 35 HD21 LEU 5 HD21 LEU 5 27.575 29.730 20.685 36 HD22 LEU 5 HD22 LEU 5 27.274 29.184 22.347 37 HD23 LEU 5 HD23 LEU 5 28.574 28.445 21.385 38 H ARG 6 H ARG 6 24.729 28.120 17.188 39 HA ARG 6 HA ARG 6 22.430 28.561 18.823 40 HB2 ARG 6 HB2 ARG 6 23.443 29.720 16.508 41 HB3 ARG 6 HB3 ARG 6 22.067 28.867 15.856 42 HG2 ARG 6 HG2 ARG 6 21.405 31.124 16.434 43 HG3 ARG 6 HG3 ARG 6 20.568 29.996 17.496 44 HD2 ARG 6 HD2 ARG 6 21.432 32.029 18.667 45 HD3 ARG 6 HD3 ARG 6 22.047 30.526 19.344 46 HE ARG 6 HE ARG 6 23.679 31.876 17.274 47 HH11 ARG 6 HH11 ARG 6 23.539 30.949 20.721 48 HH12 ARG 6 HH12 ARG 6 25.167 31.573 20.946 49 HH21 ARG 6 HH21 ARG 6 25.773 32.545 17.777 50 HH22 ARG 6 HH22 ARG 6 26.325 32.362 19.437 51 H ARG 7 H ARG 7 22.824 26.428 16.071 52 HA ARG 7 HA ARG 7 20.322 25.102 15.946 53 HB2 ARG 7 HB2 ARG 7 22.395 24.897 14.450 54 HB3 ARG 7 HB3 ARG 7 23.091 23.860 15.675 55 HG2 ARG 7 HG2 ARG 7 22.355 22.382 14.105 56 HG3 ARG 7 HG3 ARG 7 21.042 22.298 15.282 57 HD2 ARG 7 HD2 ARG 7 20.938 24.171 12.875 58 HD3 ARG 7 HD3 ARG 7 20.563 22.461 12.698 59 HE ARG 7 HE ARG 7 18.907 23.042 14.726 60 HH11 ARG 7 HH11 ARG 7 19.329 25.004 11.825 61 HH12 ARG 7 HH12 ARG 7 17.619 25.173 11.607 62 HH21 ARG 7 HH21 ARG 7 16.876 23.491 14.547 63 HH22 ARG 7 HH22 ARG 7 16.245 24.503 13.244 64 H CYS 8 H CYS 8 23.119 24.314 18.007 65 HA CYS 8 HA CYS 8 21.931 22.129 19.423 66 HB2 CYS 8 HB2 CYS 8 24.329 22.445 19.227 67 HB3 CYS 8 HB3 CYS 8 24.236 23.991 20.056 68 H GLU 9 H GLU 9 22.333 25.610 20.413 69 HA GLU 9 HA GLU 9 21.029 25.440 22.909 70 HB2 GLU 9 HB2 GLU 9 21.248 27.681 20.864 71 HB3 GLU 9 HB3 GLU 9 20.434 27.888 22.408 72 HG2 GLU 9 HG2 GLU 9 22.477 27.342 23.635 73 HG3 GLU 9 HG3 GLU 9 23.362 27.135 22.123 74 H LEU 10 H LEU 10 19.485 25.776 19.641 75 HA LEU 10 HA LEU 10 16.811 26.002 20.690 76 HB2 LEU 10 HB2 LEU 10 17.193 27.027 18.639 77 HB3 LEU 10 HB3 LEU 10 18.237 25.731 18.057 78 HG LEU 10 HG LEU 10 16.331 24.287 17.799 79 HD11 LEU 10 HD11 LEU 10 14.605 26.781 18.186 80 HD12 LEU 10 HD12 LEU 10 14.036 25.152 17.755 81 HD13 LEU 10 HD13 LEU 10 14.698 25.468 19.369 82 HD21 LEU 10 HD21 LEU 10 15.479 25.359 15.743 83 HD22 LEU 10 HD22 LEU 10 16.100 26.928 16.298 84 HD23 LEU 10 HD23 LEU 10 17.230 25.617 15.920 85 H SER 11 H SER 11 18.870 23.232 19.631 86 HA SER 11 HA SER 11 16.741 21.271 19.782 87 HB2 SER 11 HB2 SER 11 18.919 20.915 18.612 88 HB3 SER 11 HB3 SER 11 19.722 20.832 20.190 89 HG SER 11 HG SER 11 18.381 18.928 18.858 90 H CYS 12 H CYS 12 19.134 22.425 22.172 91 HA CYS 12 HA CYS 12 18.263 20.791 24.368 92 HB2 CYS 12 HB2 CYS 12 19.750 23.445 24.304 93 HB3 CYS 12 HB3 CYS 12 19.604 22.394 25.711 94 H ARG 13 H ARG 13 17.104 23.898 23.114 95 HA ARG 13 HA ARG 13 15.412 24.637 25.263 96 HB2 ARG 13 HB2 ARG 13 16.106 25.801 23.047 97 HB3 ARG 13 HB3 ARG 13 14.689 25.044 22.346 98 HG2 ARG 13 HG2 ARG 13 13.191 26.254 23.740 99 HG3 ARG 13 HG3 ARG 13 14.482 26.738 24.862 100 HD2 ARG 13 HD2 ARG 13 14.336 27.582 21.944 101 HD3 ARG 13 HD3 ARG 13 13.776 28.578 23.300 102 HE ARG 13 HE ARG 13 16.235 28.172 24.165 103 HH11 ARG 13 HH11 ARG 13 15.597 28.778 20.723 104 HH12 ARG 13 HH12 ARG 13 17.304 29.069 20.454 105 HH21 ARG 13 HH21 ARG 13 18.171 28.646 23.754 106 HH22 ARG 13 HH22 ARG 13 18.673 29.346 22.202 107 H SER 14 H SER 14 15.009 22.018 22.946 108 HA SER 14 HA SER 14 12.189 21.521 23.532 109 HB2 SER 14 HB2 SER 14 13.468 20.635 21.542 110 HB3 SER 14 HB3 SER 14 14.260 19.493 22.638 111 HG SER 14 HG SER 14 12.298 18.516 23.036 112 H LEU 15 H LEU 15 15.169 20.883 25.255 113 HA LEU 15 HA LEU 15 13.830 19.143 27.263 114 HB2 LEU 15 HB2 LEU 15 16.712 20.094 27.181 115 HB3 LEU 15 HB3 LEU 15 16.047 18.789 28.147 116 HG LEU 15 HG LEU 15 16.358 18.782 25.106 117 HD11 LEU 15 HD11 LEU 15 18.148 17.185 25.504 118 HD12 LEU 15 HD12 LEU 15 18.492 18.699 26.353 119 HD13 LEU 15 HD13 LEU 15 17.898 17.291 27.258 120 HD21 LEU 15 HD21 LEU 15 15.538 16.538 27.001 121 HD22 LEU 15 HD22 LEU 15 14.463 17.351 25.842 122 HD23 LEU 15 HD23 LEU 15 15.823 16.390 25.252 123 H GLY 16 H GLY 16 14.268 22.437 26.668 124 HA2 GLY 16 HA2 GLY 16 13.644 24.254 27.955 125 HA3 GLY 16 HA3 GLY 16 13.526 23.224 29.382 126 H LEU 17 H LEU 17 16.571 23.183 27.589 127 HA LEU 17 HA LEU 17 17.836 25.054 29.546 128 HB2 LEU 17 HB2 LEU 17 19.755 23.109 28.920 129 HB3 LEU 17 HB3 LEU 17 19.058 23.509 30.472 130 HG LEU 17 HG LEU 17 17.892 21.430 28.615 131 HD11 LEU 17 HD11 LEU 17 19.101 19.751 29.905 132 HD12 LEU 17 HD12 LEU 17 20.244 20.892 29.197 133 HD13 LEU 17 HD13 LEU 17 19.844 21.013 30.916 134 HD21 LEU 17 HD21 LEU 17 16.369 22.091 30.489 135 HD22 LEU 17 HD22 LEU 17 16.981 20.467 30.736 136 HD23 LEU 17 HD23 LEU 17 17.676 21.820 31.655 137 H LEU 18 H LEU 18 20.150 25.469 28.882 138 HA LEU 18 HA LEU 18 20.307 26.448 26.092 139 HB2 LEU 18 HB2 LEU 18 22.085 26.685 28.552 140 HB3 LEU 18 HB3 LEU 18 22.622 27.244 26.977 141 HG LEU 18 HG LEU 18 20.104 28.270 28.328 142 HD11 LEU 18 HD11 LEU 18 21.436 30.258 28.874 143 HD12 LEU 18 HD12 LEU 18 22.122 28.821 29.643 144 HD13 LEU 18 HD13 LEU 18 22.891 29.499 28.190 145 HD21 LEU 18 HD21 LEU 18 20.353 30.138 26.705 146 HD22 LEU 18 HD22 LEU 18 21.735 29.311 25.960 147 HD23 LEU 18 HD23 LEU 18 20.104 28.603 25.879 148 H GLY 19 H GLY 19 22.417 26.125 25.005 149 HA2 GLY 19 HA2 GLY 19 23.548 23.375 25.282 150 HA3 GLY 19 HA3 GLY 19 23.253 24.099 23.707 151 H LYS 20 H LYS 20 25.772 23.186 24.850 152 HA LYS 20 HA LYS 20 27.489 25.549 24.336 153 HB2 LYS 20 HB2 LYS 20 28.733 25.372 26.367 154 HB3 LYS 20 HB3 LYS 20 27.050 25.724 26.681 155 HG2 LYS 20 HG2 LYS 20 27.187 24.113 28.233 156 HG3 LYS 20 HG3 LYS 20 26.951 22.996 26.900 157 HD2 LYS 20 HD2 LYS 20 28.808 22.099 27.962 158 HD3 LYS 20 HD3 LYS 20 29.554 23.098 26.683 159 HE2 LYS 20 HE2 LYS 20 29.893 24.935 28.290 160 HE3 LYS 20 HE3 LYS 20 28.974 24.076 29.528 161 HZ1 LYS 20 HZ1 LYS 20 31.603 23.200 28.467 162 HZ2 LYS 20 HZ2 LYS 20 31.318 23.918 29.896 163 HZ3 LYS 20 HZ3 LYS 20 30.707 22.418 29.642 164 H CYS 21 H CYS 21 29.321 25.091 23.244 165 HA CYS 21 HA CYS 21 29.601 22.251 22.426 166 HB2 CYS 21 HB2 CYS 21 29.041 23.856 20.688 167 HB3 CYS 21 HB3 CYS 21 30.520 24.758 21.014 168 H ILE 22 H ILE 22 31.284 21.040 22.865 169 HA ILE 22 HA ILE 22 33.758 22.244 24.007 170 HB ILE 22 HB ILE 22 32.538 20.768 25.471 171 HG12 ILE 22 HG12 ILE 22 34.901 21.089 25.770 172 HG13 ILE 22 HG13 ILE 22 34.349 19.526 26.335 173 HG21 ILE 22 HG21 ILE 22 31.533 19.146 23.947 174 HG22 ILE 22 HG22 ILE 22 33.122 18.432 23.619 175 HG23 ILE 22 HG23 ILE 22 32.441 18.367 25.247 176 HD11 ILE 22 HD11 ILE 22 35.346 18.458 24.292 177 HD12 ILE 22 HD12 ILE 22 36.014 20.053 23.848 178 HD13 ILE 22 HD13 ILE 22 36.514 19.267 25.346 179 H GLY 23 H GLY 23 34.606 22.915 22.125 180 HA2 GLY 23 HA2 GLY 23 36.161 22.785 20.422 181 HA3 GLY 23 HA3 GLY 23 36.181 21.028 20.579 182 H GLU 24 H GLU 24 34.140 19.942 19.784 183 HA GLU 24 HA GLU 24 32.818 21.214 17.472 184 HB2 GLU 24 HB2 GLU 24 33.542 19.654 15.822 185 HB3 GLU 24 HB3 GLU 24 34.941 20.453 16.513 186 HG2 GLU 24 HG2 GLU 24 35.663 18.500 17.650 187 HG3 GLU 24 HG3 GLU 24 34.084 17.723 17.529 188 H ALA 25 H ALA 25 32.167 19.651 20.133 189 HA ALA 25 HA ALA 25 29.734 18.413 18.972 190 HB1 ALA 25 HB1 ALA 25 31.458 17.111 21.123 191 HB2 ALA 25 HB2 ALA 25 29.873 16.533 20.560 192 HB3 ALA 25 HB3 ALA 25 31.258 16.532 19.451 193 H CYS 26 H CYS 26 27.841 18.666 20.331 194 HA CYS 26 HA CYS 26 28.269 20.723 22.448 195 HB2 CYS 26 HB2 CYS 26 27.625 21.619 20.260 196 HB3 CYS 26 HB3 CYS 26 26.135 20.680 20.319 197 H LYS 27 H LYS 27 27.312 20.699 24.263 198 HA LYS 27 HA LYS 27 25.481 18.425 24.948 199 HB2 LYS 27 HB2 LYS 27 27.482 19.829 26.743 200 HB3 LYS 27 HB3 LYS 27 26.424 18.470 27.154 201 HG2 LYS 27 HG2 LYS 27 27.559 17.257 25.136 202 HG3 LYS 27 HG3 LYS 27 28.807 18.508 25.266 203 HD2 LYS 27 HD2 LYS 27 29.141 17.843 27.665 204 HD3 LYS 27 HD3 LYS 27 27.918 16.570 27.432 205 HE2 LYS 27 HE2 LYS 27 29.306 15.564 25.632 206 HE3 LYS 27 HE3 LYS 27 30.529 16.823 25.863 207 HZ1 LYS 27 HZ1 LYS 27 31.137 14.821 27.071 208 HZ2 LYS 27 HZ2 LYS 27 30.821 15.993 28.164 209 HZ3 LYS 27 HZ3 LYS 27 29.708 14.835 27.912 210 H CYS 28 H CYS 28 23.706 18.813 26.268 211 HA CYS 28 HA CYS 28 22.782 21.605 26.429 212 HB2 CYS 28 HB2 CYS 28 21.379 19.051 27.257 213 HB3 CYS 28 HB3 CYS 28 20.669 20.664 27.120 214 H VAL 29 H VAL 29 22.328 22.729 28.357 215 HA VAL 29 HA VAL 29 23.382 21.568 30.876 216 HB VAL 29 HB VAL 29 24.698 23.641 31.269 217 HG11 VAL 29 HG11 VAL 29 26.663 22.858 30.122 218 HG12 VAL 29 HG12 VAL 29 25.716 21.467 30.651 219 HG13 VAL 29 HG13 VAL 29 25.686 21.959 28.943 220 HG21 VAL 29 HG21 VAL 29 25.473 24.987 29.396 221 HG22 VAL 29 HG22 VAL 29 24.469 24.067 28.259 222 HG23 VAL 29 HG23 VAL 29 23.724 25.100 29.497 223 HA PRO 30 HA PRO 30 19.965 23.639 32.672 224 HB2 PRO 30 HB2 PRO 30 20.483 23.339 35.318 225 HB3 PRO 30 HB3 PRO 30 20.219 21.941 34.229 226 HG2 PRO 30 HG2 PRO 30 22.868 23.141 35.122 227 HG3 PRO 30 HG3 PRO 30 22.355 21.422 35.208 228 HD2 PRO 30 HD2 PRO 30 23.835 22.381 33.133 229 HD3 PRO 30 HD3 PRO 30 22.573 21.145 32.880 230 H TYR 31 H TYR 31 22.649 25.292 32.341 231 HA TYR 31 HA TYR 31 22.995 27.091 34.472 232 HB2 TYR 31 HB2 TYR 31 23.645 27.607 31.567 233 HB3 TYR 31 HB3 TYR 31 24.356 28.402 32.959 234 HD1 TYR 31 HD1 TYR 31 24.430 25.203 34.242 235 HD2 TYR 31 HD2 TYR 31 26.094 27.486 30.977 236 HE1 TYR 31 HE1 TYR 31 26.292 23.572 34.046 237 HE2 TYR 31 HE2 TYR 31 27.978 25.863 30.818 238 HH TYR 31 HH TYR 31 28.105 22.886 32.772 Start of MODEL 7 1 H1 ALA 1 H1 ALA 1 37.309 25.690 15.834 2 H2 ALA 1 H2 ALA 1 37.647 25.921 17.441 3 H3 ALA 1 H3 ALA 1 36.580 26.904 16.691 4 HA ALA 1 HA ALA 1 36.266 24.059 17.324 5 HB1 ALA 1 HB1 ALA 1 35.868 25.527 19.230 6 HB2 ALA 1 HB2 ALA 1 34.741 26.509 18.274 7 HB3 ALA 1 HB3 ALA 1 34.342 24.826 18.669 8 H PHE 2 H PHE 2 35.439 22.997 15.546 9 HA PHE 2 HA PHE 2 33.628 24.310 13.672 10 HB2 PHE 2 HB2 PHE 2 34.366 21.381 13.843 11 HB3 PHE 2 HB3 PHE 2 33.588 22.192 12.495 12 HD1 PHE 2 HD1 PHE 2 34.859 24.184 11.377 13 HD2 PHE 2 HD2 PHE 2 36.737 21.171 13.828 14 HE1 PHE 2 HE1 PHE 2 37.056 24.699 10.333 15 HE2 PHE 2 HE2 PHE 2 38.922 21.683 12.777 16 HZ PHE 2 HZ PHE 2 39.089 23.452 11.034 17 H CYS 3 H CYS 3 32.612 24.323 16.333 18 HA CYS 3 HA CYS 3 30.391 22.501 16.729 19 HB2 CYS 3 HB2 CYS 3 31.457 25.064 17.919 20 HB3 CYS 3 HB3 CYS 3 29.837 24.540 18.341 21 H ASN 4 H ASN 4 28.177 23.304 17.024 22 HA ASN 4 HA ASN 4 27.288 25.475 15.191 23 HB2 ASN 4 HB2 ASN 4 26.100 22.675 15.265 24 HB3 ASN 4 HB3 ASN 4 25.367 24.076 14.489 25 HD21 ASN 4 HD21 ASN 4 28.586 22.344 12.682 26 HD22 ASN 4 HD22 ASN 4 27.976 21.713 14.212 27 H LEU 5 H LEU 5 27.460 26.611 17.170 28 HA LEU 5 HA LEU 5 26.227 25.793 19.583 29 HB2 LEU 5 HB2 LEU 5 28.127 27.348 19.399 30 HB3 LEU 5 HB3 LEU 5 27.099 28.541 18.612 31 HG LEU 5 HG LEU 5 25.758 28.796 20.684 32 HD11 LEU 5 HD11 LEU 5 26.644 27.807 22.811 33 HD12 LEU 5 HD12 LEU 5 26.004 26.583 21.715 34 HD13 LEU 5 HD13 LEU 5 27.764 26.816 21.857 35 HD21 LEU 5 HD21 LEU 5 28.771 29.048 21.107 36 HD22 LEU 5 HD22 LEU 5 27.726 30.228 20.290 37 HD23 LEU 5 HD23 LEU 5 27.512 29.913 22.014 38 H ARG 6 H ARG 6 24.934 27.893 16.979 39 HA ARG 6 HA ARG 6 22.525 28.621 18.449 40 HB2 ARG 6 HB2 ARG 6 23.508 29.965 16.598 41 HB3 ARG 6 HB3 ARG 6 23.059 28.702 15.440 42 HG2 ARG 6 HG2 ARG 6 20.701 29.082 15.806 43 HG3 ARG 6 HG3 ARG 6 21.025 30.039 17.257 44 HD2 ARG 6 HD2 ARG 6 20.444 31.581 15.529 45 HD3 ARG 6 HD3 ARG 6 22.144 31.769 15.875 46 HE ARG 6 HE ARG 6 22.690 30.577 13.799 47 HH11 ARG 6 HH11 ARG 6 19.275 31.541 13.901 48 HH12 ARG 6 HH12 ARG 6 19.315 31.845 12.156 49 HH21 ARG 6 HH21 ARG 6 22.511 30.862 11.699 50 HH22 ARG 6 HH22 ARG 6 20.965 31.373 10.978 51 H ARG 7 H ARG 7 23.282 25.982 16.139 52 HA ARG 7 HA ARG 7 20.619 24.832 16.173 53 HB2 ARG 7 HB2 ARG 7 22.425 24.192 14.529 54 HB3 ARG 7 HB3 ARG 7 23.329 23.457 15.846 55 HG2 ARG 7 HG2 ARG 7 22.258 21.673 14.723 56 HG3 ARG 7 HG3 ARG 7 21.407 21.865 16.238 57 HD2 ARG 7 HD2 ARG 7 19.718 21.523 14.600 58 HD3 ARG 7 HD3 ARG 7 19.646 23.235 14.983 59 HE ARG 7 HE ARG 7 20.226 23.730 12.789 60 HH11 ARG 7 HH11 ARG 7 20.917 20.304 13.263 61 HH12 ARG 7 HH12 ARG 7 21.470 20.134 11.601 62 HH21 ARG 7 HH21 ARG 7 21.157 23.434 10.811 63 HH22 ARG 7 HH22 ARG 7 21.530 21.827 10.250 64 H CYS 8 H CYS 8 23.446 24.379 18.250 65 HA CYS 8 HA CYS 8 22.398 22.298 19.891 66 HB2 CYS 8 HB2 CYS 8 24.778 22.833 19.683 67 HB3 CYS 8 HB3 CYS 8 24.513 24.413 20.407 68 H GLU 9 H GLU 9 22.362 25.883 20.374 69 HA GLU 9 HA GLU 9 20.983 25.948 22.836 70 HB2 GLU 9 HB2 GLU 9 21.097 27.786 20.432 71 HB3 GLU 9 HB3 GLU 9 20.072 28.191 21.796 72 HG2 GLU 9 HG2 GLU 9 23.019 27.541 22.201 73 HG3 GLU 9 HG3 GLU 9 22.477 29.146 21.712 74 H LEU 10 H LEU 10 19.505 25.803 19.541 75 HA LEU 10 HA LEU 10 16.782 25.774 20.568 76 HB2 LEU 10 HB2 LEU 10 17.793 24.603 17.947 77 HB3 LEU 10 HB3 LEU 10 16.131 25.060 18.324 78 HG LEU 10 HG LEU 10 18.475 26.947 18.174 79 HD11 LEU 10 HD11 LEU 10 17.548 27.710 16.034 80 HD12 LEU 10 HD12 LEU 10 17.933 25.987 15.970 81 HD13 LEU 10 HD13 LEU 10 16.245 26.506 16.158 82 HD21 LEU 10 HD21 LEU 10 16.782 28.757 18.111 83 HD22 LEU 10 HD22 LEU 10 15.492 27.552 18.324 84 HD23 LEU 10 HD23 LEU 10 16.681 27.845 19.617 85 H SER 11 H SER 11 19.042 23.267 19.639 86 HA SER 11 HA SER 11 17.275 21.033 20.005 87 HB2 SER 11 HB2 SER 11 19.355 21.001 18.632 88 HB3 SER 11 HB3 SER 11 20.314 21.018 20.129 89 HG SER 11 HG SER 11 18.362 19.083 19.355 90 H CYS 12 H CYS 12 19.362 22.692 22.356 91 HA CYS 12 HA CYS 12 18.694 20.808 24.505 92 HB2 CYS 12 HB2 CYS 12 19.982 23.553 24.506 93 HB3 CYS 12 HB3 CYS 12 19.842 22.501 25.912 94 H ARG 13 H ARG 13 17.437 24.024 23.380 95 HA ARG 13 HA ARG 13 15.676 24.436 25.600 96 HB2 ARG 13 HB2 ARG 13 15.986 25.502 22.784 97 HB3 ARG 13 HB3 ARG 13 14.631 25.998 23.791 98 HG2 ARG 13 HG2 ARG 13 16.123 26.881 25.493 99 HG3 ARG 13 HG3 ARG 13 17.522 26.152 24.701 100 HD2 ARG 13 HD2 ARG 13 16.759 27.588 22.610 101 HD3 ARG 13 HD3 ARG 13 15.870 28.516 23.835 102 HE ARG 13 HE ARG 13 18.793 27.904 24.058 103 HH11 ARG 13 HH11 ARG 13 16.432 30.449 23.692 104 HH12 ARG 13 HH12 ARG 13 17.476 31.658 24.403 105 HH21 ARG 13 HH21 ARG 13 20.084 29.450 24.810 106 HH22 ARG 13 HH22 ARG 13 19.499 31.100 25.068 107 H SER 14 H SER 14 15.242 22.701 22.557 108 HA SER 14 HA SER 14 12.540 21.916 22.721 109 HB2 SER 14 HB2 SER 14 14.008 21.398 20.839 110 HB3 SER 14 HB3 SER 14 15.037 20.400 21.872 111 HG SER 14 HG SER 14 12.457 19.847 20.865 112 H LEU 15 H LEU 15 15.208 20.968 24.789 113 HA LEU 15 HA LEU 15 13.602 18.914 26.191 114 HB2 LEU 15 HB2 LEU 15 16.548 19.534 26.491 115 HB3 LEU 15 HB3 LEU 15 15.691 18.114 27.066 116 HG LEU 15 HG LEU 15 16.297 18.897 24.197 117 HD11 LEU 15 HD11 LEU 15 18.229 18.068 25.467 118 HD12 LEU 15 HD12 LEU 15 17.313 16.617 25.931 119 HD13 LEU 15 HD13 LEU 15 17.744 16.897 24.229 120 HD21 LEU 15 HD21 LEU 15 14.151 17.657 24.232 121 HD22 LEU 15 HD22 LEU 15 15.429 16.638 23.574 122 HD23 LEU 15 HD23 LEU 15 14.883 16.396 25.250 123 H GLY 16 H GLY 16 14.486 22.198 26.552 124 HA2 GLY 16 HA2 GLY 16 13.495 23.542 28.233 125 HA3 GLY 16 HA3 GLY 16 13.589 22.226 29.392 126 H LEU 17 H LEU 17 16.573 22.837 27.607 127 HA LEU 17 HA LEU 17 17.635 24.666 29.711 128 HB2 LEU 17 HB2 LEU 17 19.536 23.114 29.975 129 HB3 LEU 17 HB3 LEU 17 18.031 22.550 30.662 130 HG LEU 17 HG LEU 17 19.098 21.567 27.987 131 HD11 LEU 17 HD11 LEU 17 20.713 21.167 29.815 132 HD12 LEU 17 HD12 LEU 17 19.424 20.442 30.790 133 HD13 LEU 17 HD13 LEU 17 19.958 19.648 29.291 134 HD21 LEU 17 HD21 LEU 17 16.996 20.527 29.925 135 HD22 LEU 17 HD22 LEU 17 16.820 20.883 28.199 136 HD23 LEU 17 HD23 LEU 17 17.759 19.488 28.699 137 H LEU 18 H LEU 18 19.972 25.344 29.208 138 HA LEU 18 HA LEU 18 19.959 26.361 26.436 139 HB2 LEU 18 HB2 LEU 18 21.284 27.076 29.041 140 HB3 LEU 18 HB3 LEU 18 22.150 27.460 27.558 141 HG LEU 18 HG LEU 18 20.289 28.745 26.697 142 HD11 LEU 18 HD11 LEU 18 18.338 27.668 27.714 143 HD12 LEU 18 HD12 LEU 18 18.880 28.197 29.325 144 HD13 LEU 18 HD13 LEU 18 18.369 29.387 28.110 145 HD21 LEU 18 HD21 LEU 18 21.984 29.872 28.041 146 HD22 LEU 18 HD22 LEU 18 20.402 30.624 28.271 147 HD23 LEU 18 HD23 LEU 18 21.036 29.531 29.522 148 H GLY 19 H GLY 19 21.782 26.345 25.072 149 HA2 GLY 19 HA2 GLY 19 23.308 23.763 25.183 150 HA3 GLY 19 HA3 GLY 19 22.867 24.622 23.721 151 H LYS 20 H LYS 20 25.434 23.618 24.876 152 HA LYS 20 HA LYS 20 27.173 26.026 24.511 153 HB2 LYS 20 HB2 LYS 20 27.630 23.708 26.437 154 HB3 LYS 20 HB3 LYS 20 28.687 25.096 26.218 155 HG2 LYS 20 HG2 LYS 20 25.867 25.184 27.354 156 HG3 LYS 20 HG3 LYS 20 27.357 25.192 28.291 157 HD2 LYS 20 HD2 LYS 20 28.013 27.358 27.325 158 HD3 LYS 20 HD3 LYS 20 26.565 27.365 26.298 159 HE2 LYS 20 HE2 LYS 20 25.173 27.114 28.409 160 HE3 LYS 20 HE3 LYS 20 26.648 27.362 29.345 161 HZ1 LYS 20 HZ1 LYS 20 25.350 29.362 29.058 162 HZ2 LYS 20 HZ2 LYS 20 26.828 29.568 28.304 163 HZ3 LYS 20 HZ3 LYS 20 25.429 29.270 27.438 164 H CYS 21 H CYS 21 29.279 25.577 23.705 165 HA CYS 21 HA CYS 21 29.384 23.329 21.782 166 HB2 CYS 21 HB2 CYS 21 29.963 25.445 20.876 167 HB3 CYS 21 HB3 CYS 21 31.014 25.825 22.236 168 H ILE 22 H ILE 22 30.695 21.645 21.879 169 HA ILE 22 HA ILE 22 32.934 21.549 23.829 170 HB ILE 22 HB ILE 22 31.195 20.373 24.872 171 HG12 ILE 22 HG12 ILE 22 32.944 18.125 23.855 172 HG13 ILE 22 HG13 ILE 22 33.644 19.468 24.759 173 HG21 ILE 22 HG21 ILE 22 29.716 19.748 23.059 174 HG22 ILE 22 HG22 ILE 22 30.916 18.599 22.419 175 HG23 ILE 22 HG23 ILE 22 30.141 18.312 23.980 176 HD11 ILE 22 HD11 ILE 22 33.113 17.647 26.289 177 HD12 ILE 22 HD12 ILE 22 32.116 19.061 26.651 178 HD13 ILE 22 HD13 ILE 22 31.414 17.670 25.788 179 H GLY 23 H GLY 23 33.917 22.470 21.953 180 HA2 GLY 23 HA2 GLY 23 35.650 22.303 20.494 181 HA3 GLY 23 HA3 GLY 23 35.565 20.549 20.613 182 H GLU 24 H GLU 24 33.339 19.767 19.504 183 HA GLU 24 HA GLU 24 32.849 21.154 16.912 184 HB2 GLU 24 HB2 GLU 24 33.570 18.191 17.139 185 HB3 GLU 24 HB3 GLU 24 33.098 19.034 15.658 186 HG2 GLU 24 HG2 GLU 24 35.125 20.413 15.758 187 HG3 GLU 24 HG3 GLU 24 35.604 19.639 17.269 188 H ALA 25 H ALA 25 31.482 19.858 19.613 189 HA ALA 25 HA ALA 25 28.947 19.050 18.273 190 HB1 ALA 25 HB1 ALA 25 30.478 17.527 20.431 191 HB2 ALA 25 HB2 ALA 25 28.874 17.096 19.811 192 HB3 ALA 25 HB3 ALA 25 30.277 17.042 18.737 193 H CYS 26 H CYS 26 27.266 18.612 20.105 194 HA CYS 26 HA CYS 26 26.983 21.136 21.620 195 HB2 CYS 26 HB2 CYS 26 25.318 20.489 19.958 196 HB3 CYS 26 HB3 CYS 26 25.052 18.955 20.776 197 H LYS 27 H LYS 27 26.486 21.298 23.746 198 HA LYS 27 HA LYS 27 26.204 18.924 25.555 199 HB2 LYS 27 HB2 LYS 27 28.521 19.580 25.582 200 HB3 LYS 27 HB3 LYS 27 28.095 21.260 25.935 201 HG2 LYS 27 HG2 LYS 27 27.212 20.649 28.128 202 HG3 LYS 27 HG3 LYS 27 27.352 18.916 27.751 203 HD2 LYS 27 HD2 LYS 27 29.784 19.216 27.429 204 HD3 LYS 27 HD3 LYS 27 29.658 20.899 27.959 205 HE2 LYS 27 HE2 LYS 27 29.111 18.386 29.599 206 HE3 LYS 27 HE3 LYS 27 30.525 19.427 29.739 207 HZ1 LYS 27 HZ1 LYS 27 27.741 20.109 30.463 208 HZ2 LYS 27 HZ2 LYS 27 29.012 19.926 31.480 209 HZ3 LYS 27 HZ3 LYS 27 28.997 21.220 30.504 210 H CYS 28 H CYS 28 24.312 19.249 26.803 211 HA CYS 28 HA CYS 28 23.203 22.009 26.863 212 HB2 CYS 28 HB2 CYS 28 21.820 19.461 27.687 213 HB3 CYS 28 HB3 CYS 28 21.127 21.049 27.414 214 H VAL 29 H VAL 29 22.711 23.135 28.727 215 HA VAL 29 HA VAL 29 23.210 21.895 31.376 216 HB VAL 29 HB VAL 29 24.483 23.824 32.153 217 HG11 VAL 29 HG11 VAL 29 25.849 22.506 29.782 218 HG12 VAL 29 HG12 VAL 29 26.621 23.245 31.199 219 HG13 VAL 29 HG13 VAL 29 25.645 21.779 31.398 220 HG21 VAL 29 HG21 VAL 29 24.589 24.687 29.232 221 HG22 VAL 29 HG22 VAL 29 23.837 25.581 30.569 222 HG23 VAL 29 HG23 VAL 29 25.586 25.359 30.543 223 HA PRO 30 HA PRO 30 19.424 23.892 32.287 224 HB2 PRO 30 HB2 PRO 30 19.334 23.809 35.009 225 HB3 PRO 30 HB3 PRO 30 19.336 22.344 34.006 226 HG2 PRO 30 HG2 PRO 30 21.707 23.678 35.342 227 HG3 PRO 30 HG3 PRO 30 21.211 21.949 35.455 228 HD2 PRO 30 HD2 PRO 30 23.099 22.748 33.687 229 HD3 PRO 30 HD3 PRO 30 21.879 21.521 33.223 230 H TYR 31 H TYR 31 22.164 25.622 32.736 231 HA TYR 31 HA TYR 31 21.182 27.812 34.414 232 HB2 TYR 31 HB2 TYR 31 23.851 27.567 33.000 233 HB3 TYR 31 HB3 TYR 31 23.452 28.562 34.393 234 HD1 TYR 31 HD1 TYR 31 25.102 25.649 33.432 235 HD2 TYR 31 HD2 TYR 31 22.388 27.066 36.460 236 HE1 TYR 31 HE1 TYR 31 25.682 23.693 34.874 237 HE2 TYR 31 HE2 TYR 31 22.992 25.127 37.909 238 HH TYR 31 HH TYR 31 24.337 23.276 38.156 Start of MODEL 8 1 H1 ALA 1 H1 ALA 1 34.940 29.892 16.891 2 H2 ALA 1 H2 ALA 1 35.891 29.677 15.545 3 H3 ALA 1 H3 ALA 1 36.521 29.463 17.043 4 HA ALA 1 HA ALA 1 36.133 27.380 15.919 5 HB1 ALA 1 HB1 ALA 1 36.086 27.429 18.382 6 HB2 ALA 1 HB2 ALA 1 34.358 27.840 18.350 7 HB3 ALA 1 HB3 ALA 1 34.909 26.265 17.740 8 H PHE 2 H PHE 2 34.861 26.182 14.564 9 HA PHE 2 HA PHE 2 32.585 27.604 13.390 10 HB2 PHE 2 HB2 PHE 2 34.036 25.102 12.472 11 HB3 PHE 2 HB3 PHE 2 32.908 26.072 11.530 12 HD1 PHE 2 HD1 PHE 2 33.505 28.453 10.894 13 HD2 PHE 2 HD2 PHE 2 36.374 25.674 12.522 14 HE1 PHE 2 HE1 PHE 2 35.363 29.837 9.993 15 HE2 PHE 2 HE2 PHE 2 38.226 27.068 11.616 16 HZ PHE 2 HZ PHE 2 37.721 29.148 10.357 17 H CYS 3 H CYS 3 31.743 26.711 15.833 18 HA CYS 3 HA CYS 3 30.434 24.069 15.552 19 HB2 CYS 3 HB2 CYS 3 31.670 24.602 17.594 20 HB3 CYS 3 HB3 CYS 3 30.594 25.968 17.917 21 H ASN 4 H ASN 4 28.238 23.712 15.525 22 HA ASN 4 HA ASN 4 26.577 25.890 14.550 23 HB2 ASN 4 HB2 ASN 4 25.739 23.019 15.001 24 HB3 ASN 4 HB3 ASN 4 24.904 24.267 14.093 25 HD21 ASN 4 HD21 ASN 4 26.756 22.196 11.669 26 HD22 ASN 4 HD22 ASN 4 25.492 21.866 12.848 27 H LEU 5 H LEU 5 27.236 26.729 17.011 28 HA LEU 5 HA LEU 5 25.982 25.725 19.282 29 HB2 LEU 5 HB2 LEU 5 27.812 27.353 19.275 30 HB3 LEU 5 HB3 LEU 5 26.743 28.586 18.602 31 HG LEU 5 HG LEU 5 25.393 28.580 20.683 32 HD11 LEU 5 HD11 LEU 5 27.493 26.622 21.719 33 HD12 LEU 5 HD12 LEU 5 26.261 27.446 22.703 34 HD13 LEU 5 HD13 LEU 5 25.759 26.273 21.485 35 HD21 LEU 5 HD21 LEU 5 27.082 29.638 22.120 36 HD22 LEU 5 HD22 LEU 5 28.386 28.922 21.148 37 HD23 LEU 5 HD23 LEU 5 27.292 30.130 20.433 38 H ARG 6 H ARG 6 24.563 28.049 16.963 39 HA ARG 6 HA ARG 6 22.105 28.531 18.395 40 HB2 ARG 6 HB2 ARG 6 22.883 28.667 15.452 41 HB3 ARG 6 HB3 ARG 6 21.300 29.145 16.049 42 HG2 ARG 6 HG2 ARG 6 22.213 30.864 17.467 43 HG3 ARG 6 HG3 ARG 6 23.881 30.390 17.091 44 HD2 ARG 6 HD2 ARG 6 21.892 31.280 14.966 45 HD3 ARG 6 HD3 ARG 6 22.935 32.413 15.844 46 HE ARG 6 HE ARG 6 24.715 30.541 14.915 47 HH11 ARG 6 HH11 ARG 6 22.417 32.707 13.300 48 HH12 ARG 6 HH12 ARG 6 23.461 32.806 11.882 49 HH21 ARG 6 HH21 ARG 6 25.948 30.883 13.028 50 HH22 ARG 6 HH22 ARG 6 25.263 31.922 11.773 51 H ARG 7 H ARG 7 22.988 25.898 16.188 52 HA ARG 7 HA ARG 7 20.312 24.671 16.076 53 HB2 ARG 7 HB2 ARG 7 23.087 23.585 15.422 54 HB3 ARG 7 HB3 ARG 7 21.624 22.704 15.154 55 HG2 ARG 7 HG2 ARG 7 22.446 25.290 13.768 56 HG3 ARG 7 HG3 ARG 7 22.456 23.673 13.079 57 HD2 ARG 7 HD2 ARG 7 20.014 25.314 13.841 58 HD3 ARG 7 HD3 ARG 7 20.570 24.912 12.213 59 HE ARG 7 HE ARG 7 20.140 22.447 13.563 60 HH11 ARG 7 HH11 ARG 7 18.106 24.981 12.115 61 HH12 ARG 7 HH12 ARG 7 16.682 23.978 12.425 62 HH21 ARG 7 HH21 ARG 7 18.333 21.315 13.674 63 HH22 ARG 7 HH22 ARG 7 16.796 22.038 13.166 64 H CYS 8 H CYS 8 23.201 24.354 18.058 65 HA CYS 8 HA CYS 8 22.317 22.084 19.614 66 HB2 CYS 8 HB2 CYS 8 24.656 22.687 19.416 67 HB3 CYS 8 HB3 CYS 8 24.357 24.273 20.111 68 H GLU 9 H GLU 9 22.319 25.632 20.349 69 HA GLU 9 HA GLU 9 20.915 25.612 22.771 70 HB2 GLU 9 HB2 GLU 9 21.128 27.566 20.473 71 HB3 GLU 9 HB3 GLU 9 20.012 27.914 21.781 72 HG2 GLU 9 HG2 GLU 9 22.905 27.251 22.410 73 HG3 GLU 9 HG3 GLU 9 22.432 28.865 21.873 74 H LEU 10 H LEU 10 19.364 25.874 19.484 75 HA LEU 10 HA LEU 10 16.737 25.847 20.666 76 HB2 LEU 10 HB2 LEU 10 15.850 25.742 18.470 77 HB3 LEU 10 HB3 LEU 10 17.230 26.808 18.484 78 HG LEU 10 HG LEU 10 18.537 24.704 17.576 79 HD11 LEU 10 HD11 LEU 10 15.717 24.095 16.580 80 HD12 LEU 10 HD12 LEU 10 17.214 23.272 16.100 81 HD13 LEU 10 HD13 LEU 10 16.597 23.093 17.740 82 HD21 LEU 10 HD21 LEU 10 17.968 25.387 15.256 83 HD22 LEU 10 HD22 LEU 10 16.569 26.290 15.876 84 HD23 LEU 10 HD23 LEU 10 18.214 26.775 16.319 85 H SER 11 H SER 11 18.893 23.213 19.824 86 HA SER 11 HA SER 11 16.842 21.132 19.937 87 HB2 SER 11 HB2 SER 11 19.874 20.899 20.139 88 HB3 SER 11 HB3 SER 11 18.725 19.562 19.965 89 HG SER 11 HG SER 11 19.442 21.577 18.125 90 H CYS 12 H CYS 12 19.260 22.435 22.278 91 HA CYS 12 HA CYS 12 18.475 20.660 24.423 92 HB2 CYS 12 HB2 CYS 12 19.853 23.367 24.478 93 HB3 CYS 12 HB3 CYS 12 19.782 22.221 25.815 94 H ARG 13 H ARG 13 17.536 24.081 23.594 95 HA ARG 13 HA ARG 13 15.882 24.458 25.857 96 HB2 ARG 13 HB2 ARG 13 16.227 25.825 23.165 97 HB3 ARG 13 HB3 ARG 13 15.033 26.361 24.338 98 HG2 ARG 13 HG2 ARG 13 16.795 26.647 26.040 99 HG3 ARG 13 HG3 ARG 13 17.997 26.076 24.858 100 HD2 ARG 13 HD2 ARG 13 17.174 27.922 23.300 101 HD3 ARG 13 HD3 ARG 13 16.248 28.568 24.658 102 HE ARG 13 HE ARG 13 19.206 28.142 24.562 103 HH11 ARG 13 HH11 ARG 13 16.605 29.778 26.218 104 HH12 ARG 13 HH12 ARG 13 17.587 31.128 26.725 105 HH21 ARG 13 HH21 ARG 13 20.483 29.793 25.317 106 HH22 ARG 13 HH22 ARG 13 19.795 31.006 26.405 107 H SER 14 H SER 14 15.185 22.720 22.948 108 HA SER 14 HA SER 14 12.330 22.676 23.067 109 HB2 SER 14 HB2 SER 14 12.393 20.686 21.829 110 HB3 SER 14 HB3 SER 14 13.774 21.625 21.252 111 HG SER 14 HG SER 14 15.146 20.256 22.363 112 H LEU 15 H LEU 15 14.711 21.180 25.162 113 HA LEU 15 HA LEU 15 12.645 19.710 26.726 114 HB2 LEU 15 HB2 LEU 15 15.668 19.701 27.004 115 HB3 LEU 15 HB3 LEU 15 14.531 18.573 27.731 116 HG LEU 15 HG LEU 15 15.241 18.834 24.778 117 HD11 LEU 15 HD11 LEU 15 16.984 17.798 26.170 118 HD12 LEU 15 HD12 LEU 15 15.805 16.616 26.790 119 HD13 LEU 15 HD13 LEU 15 16.250 16.625 25.070 120 HD21 LEU 15 HD21 LEU 15 13.900 16.758 24.462 121 HD22 LEU 15 HD22 LEU 15 13.354 16.851 26.151 122 HD23 LEU 15 HD23 LEU 15 12.885 18.105 24.979 123 H GLY 16 H GLY 16 14.220 22.729 26.755 124 HA2 GLY 16 HA2 GLY 16 13.797 24.446 28.276 125 HA3 GLY 16 HA3 GLY 16 13.388 23.301 29.534 126 H LEU 17 H LEU 17 16.462 22.757 27.884 127 HA LEU 17 HA LEU 17 17.924 24.339 29.936 128 HB2 LEU 17 HB2 LEU 17 19.644 22.582 29.909 129 HB3 LEU 17 HB3 LEU 17 18.170 22.208 30.777 130 HG LEU 17 HG LEU 17 18.566 21.194 27.945 131 HD11 LEU 17 HD11 LEU 17 19.629 19.203 28.835 132 HD12 LEU 17 HD12 LEU 17 20.584 20.622 29.328 133 HD13 LEU 17 HD13 LEU 17 19.512 19.838 30.494 134 HD21 LEU 17 HD21 LEU 17 17.224 19.270 28.812 135 HD22 LEU 17 HD22 LEU 17 17.117 20.062 30.395 136 HD23 LEU 17 HD23 LEU 17 16.325 20.783 28.993 137 H LEU 18 H LEU 18 19.953 25.132 29.376 138 HA LEU 18 HA LEU 18 20.104 26.296 26.742 139 HB2 LEU 18 HB2 LEU 18 21.639 26.366 29.330 140 HB3 LEU 18 HB3 LEU 18 22.552 26.766 27.878 141 HG LEU 18 HG LEU 18 21.008 28.537 27.298 142 HD11 LEU 18 HD11 LEU 18 19.595 27.929 29.931 143 HD12 LEU 18 HD12 LEU 18 19.308 29.350 28.907 144 HD13 LEU 18 HD13 LEU 18 18.893 27.740 28.309 145 HD21 LEU 18 HD21 LEU 18 21.689 30.080 29.033 146 HD22 LEU 18 HD22 LEU 18 21.935 28.751 30.188 147 HD23 LEU 18 HD23 LEU 18 22.989 28.916 28.761 148 H GLY 19 H GLY 19 21.745 26.151 25.204 149 HA2 GLY 19 HA2 GLY 19 23.313 23.597 25.076 150 HA3 GLY 19 HA3 GLY 19 22.879 24.600 23.705 151 H LYS 20 H LYS 20 25.461 23.566 24.842 152 HA LYS 20 HA LYS 20 27.143 25.983 24.419 153 HB2 LYS 20 HB2 LYS 20 27.598 23.821 26.531 154 HB3 LYS 20 HB3 LYS 20 28.694 25.154 26.180 155 HG2 LYS 20 HG2 LYS 20 25.877 25.482 27.276 156 HG3 LYS 20 HG3 LYS 20 27.344 25.439 28.249 157 HD2 LYS 20 HD2 LYS 20 28.185 27.463 27.312 158 HD3 LYS 20 HD3 LYS 20 26.935 27.505 26.043 159 HE2 LYS 20 HE2 LYS 20 25.198 27.967 27.545 160 HE3 LYS 20 HE3 LYS 20 26.128 27.389 28.943 161 HZ1 LYS 20 HZ1 LYS 20 26.837 29.866 27.464 162 HZ2 LYS 20 HZ2 LYS 20 25.968 29.832 28.851 163 HZ3 LYS 20 HZ3 LYS 20 27.518 29.292 28.835 164 H CYS 21 H CYS 21 29.472 25.237 23.855 165 HA CYS 21 HA CYS 21 29.338 22.658 22.339 166 HB2 CYS 21 HB2 CYS 21 29.132 24.779 20.972 167 HB3 CYS 21 HB3 CYS 21 30.826 25.106 21.405 168 H ILE 22 H ILE 22 31.089 21.362 22.196 169 HA ILE 22 HA ILE 22 33.726 22.295 23.144 170 HB ILE 22 HB ILE 22 32.790 21.295 25.100 171 HG12 ILE 22 HG12 ILE 22 34.826 19.384 23.876 172 HG13 ILE 22 HG13 ILE 22 35.195 20.995 24.503 173 HG21 ILE 22 HG21 ILE 22 31.091 19.761 24.016 174 HG22 ILE 22 HG22 ILE 22 32.414 18.631 23.674 175 HG23 ILE 22 HG23 ILE 22 31.997 19.045 25.341 176 HD11 ILE 22 HD11 ILE 22 34.129 18.644 26.115 177 HD12 ILE 22 HD12 ILE 22 35.744 19.369 26.198 178 HD13 ILE 22 HD13 ILE 22 34.331 20.296 26.749 179 H GLY 23 H GLY 23 34.715 22.287 21.203 180 HA2 GLY 23 HA2 GLY 23 35.808 21.380 19.370 181 HA3 GLY 23 HA3 GLY 23 35.608 19.788 20.113 182 H GLU 24 H GLU 24 33.232 22.114 18.868 183 HA GLU 24 HA GLU 24 31.489 22.024 17.482 184 HB2 GLU 24 HB2 GLU 24 33.010 19.900 15.926 185 HB3 GLU 24 HB3 GLU 24 31.551 20.747 15.420 186 HG2 GLU 24 HG2 GLU 24 32.758 22.951 15.673 187 HG3 GLU 24 HG3 GLU 24 34.235 22.032 16.010 188 H ALA 25 H ALA 25 31.944 19.596 19.632 189 HA ALA 25 HA ALA 25 29.430 18.172 19.016 190 HB1 ALA 25 HB1 ALA 25 29.939 16.901 21.017 191 HB2 ALA 25 HB2 ALA 25 31.373 16.949 19.970 192 HB3 ALA 25 HB3 ALA 25 31.282 17.968 21.421 193 H CYS 26 H CYS 26 27.512 18.640 19.952 194 HA CYS 26 HA CYS 26 27.143 21.074 21.541 195 HB2 CYS 26 HB2 CYS 26 25.560 20.480 19.789 196 HB3 CYS 26 HB3 CYS 26 25.288 18.906 20.538 197 H LYS 27 H LYS 27 26.767 21.219 23.642 198 HA LYS 27 HA LYS 27 26.293 18.828 25.379 199 HB2 LYS 27 HB2 LYS 27 28.625 19.293 25.646 200 HB3 LYS 27 HB3 LYS 27 28.368 21.027 25.619 201 HG2 LYS 27 HG2 LYS 27 28.983 20.377 27.816 202 HG3 LYS 27 HG3 LYS 27 27.331 20.972 27.842 203 HD2 LYS 27 HD2 LYS 27 26.478 18.650 28.022 204 HD3 LYS 27 HD3 LYS 27 28.141 18.031 27.898 205 HE2 LYS 27 HE2 LYS 27 28.770 19.345 29.921 206 HE3 LYS 27 HE3 LYS 27 27.109 19.932 30.062 207 HZ1 LYS 27 HZ1 LYS 27 27.634 18.031 31.521 208 HZ2 LYS 27 HZ2 LYS 27 26.371 17.715 30.526 209 HZ3 LYS 27 HZ3 LYS 27 27.886 17.073 30.222 210 H CYS 28 H CYS 28 24.225 19.154 26.041 211 HA CYS 28 HA CYS 28 23.198 21.841 26.516 212 HB2 CYS 28 HB2 CYS 28 21.950 19.236 27.395 213 HB3 CYS 28 HB3 CYS 28 21.177 20.812 27.224 214 H VAL 29 H VAL 29 22.629 22.752 28.599 215 HA VAL 29 HA VAL 29 24.028 21.569 30.945 216 HB VAL 29 HB VAL 29 25.020 23.750 31.504 217 HG11 VAL 29 HG11 VAL 29 26.897 23.632 30.005 218 HG12 VAL 29 HG12 VAL 29 26.331 21.994 30.332 219 HG13 VAL 29 HG13 VAL 29 25.948 22.771 28.777 220 HG21 VAL 29 HG21 VAL 29 25.294 25.470 29.746 221 HG22 VAL 29 HG22 VAL 29 24.154 24.600 28.702 222 HG23 VAL 29 HG23 VAL 29 23.614 25.304 30.241 223 HA PRO 30 HA PRO 30 20.417 22.867 33.132 224 HB2 PRO 30 HB2 PRO 30 21.218 22.600 35.703 225 HB3 PRO 30 HB3 PRO 30 21.089 21.200 34.595 226 HG2 PRO 30 HG2 PRO 30 23.572 22.801 35.309 227 HG3 PRO 30 HG3 PRO 30 23.360 21.017 35.362 228 HD2 PRO 30 HD2 PRO 30 24.471 22.275 33.218 229 HD3 PRO 30 HD3 PRO 30 23.413 20.852 33.014 230 H TYR 31 H TYR 31 22.771 24.927 32.634 231 HA TYR 31 HA TYR 31 22.874 26.825 34.761 232 HB2 TYR 31 HB2 TYR 31 23.414 27.243 31.805 233 HB3 TYR 31 HB3 TYR 31 23.919 28.305 33.107 234 HD1 TYR 31 HD1 TYR 31 25.849 27.594 31.220 235 HD2 TYR 31 HD2 TYR 31 24.671 25.390 34.729 236 HE1 TYR 31 HE1 TYR 31 28.094 26.501 31.293 237 HE2 TYR 31 HE2 TYR 31 26.908 24.311 34.796 238 HH TYR 31 HH TYR 31 28.851 23.913 33.575 Start of MODEL 9 1 H1 ALA 1 H1 ALA 1 35.670 27.242 14.832 2 H2 ALA 1 H2 ALA 1 34.077 27.402 14.419 3 H3 ALA 1 H3 ALA 1 35.168 26.535 13.456 4 HA ALA 1 HA ALA 1 35.491 24.924 15.142 5 HB1 ALA 1 HB1 ALA 1 34.055 24.862 17.130 6 HB2 ALA 1 HB2 ALA 1 35.048 26.327 17.110 7 HB3 ALA 1 HB3 ALA 1 33.336 26.418 16.662 8 H PHE 2 H PHE 2 34.458 23.009 14.820 9 HA PHE 2 HA PHE 2 32.273 23.027 12.913 10 HB2 PHE 2 HB2 PHE 2 33.639 20.630 14.191 11 HB3 PHE 2 HB3 PHE 2 32.703 20.639 12.703 12 HD1 PHE 2 HD1 PHE 2 33.582 22.287 10.793 13 HD2 PHE 2 HD2 PHE 2 35.995 20.786 14.036 14 HE1 PHE 2 HE1 PHE 2 35.644 22.791 9.504 15 HE2 PHE 2 HE2 PHE 2 38.048 21.305 12.746 16 HZ PHE 2 HZ PHE 2 37.881 22.295 10.480 17 H CYS 3 H CYS 3 32.063 23.411 16.006 18 HA CYS 3 HA CYS 3 29.591 21.859 16.573 19 HB2 CYS 3 HB2 CYS 3 29.675 22.906 18.770 20 HB3 CYS 3 HB3 CYS 3 31.212 22.128 18.409 21 H ASN 4 H ASN 4 27.549 22.939 16.757 22 HA ASN 4 HA ASN 4 27.427 25.667 15.456 23 HB2 ASN 4 HB2 ASN 4 25.550 23.289 15.177 24 HB3 ASN 4 HB3 ASN 4 25.314 24.862 14.442 25 HD21 ASN 4 HD21 ASN 4 27.668 22.199 12.585 26 HD22 ASN 4 HD22 ASN 4 26.509 21.808 13.866 27 H LEU 5 H LEU 5 27.302 26.967 17.247 28 HA LEU 5 HA LEU 5 26.140 26.177 19.679 29 HB2 LEU 5 HB2 LEU 5 27.933 27.862 19.424 30 HB3 LEU 5 HB3 LEU 5 26.769 28.983 18.706 31 HG LEU 5 HG LEU 5 25.485 29.000 20.852 32 HD11 LEU 5 HD11 LEU 5 26.648 28.117 22.880 33 HD12 LEU 5 HD12 LEU 5 26.060 26.846 21.806 34 HD13 LEU 5 HD13 LEU 5 27.799 27.274 21.824 35 HD21 LEU 5 HD21 LEU 5 28.449 29.661 21.129 36 HD22 LEU 5 HD22 LEU 5 27.199 30.707 20.405 37 HD23 LEU 5 HD23 LEU 5 27.124 30.312 22.121 38 H ARG 6 H ARG 6 24.669 28.422 17.237 39 HA ARG 6 HA ARG 6 22.264 28.909 18.796 40 HB2 ARG 6 HB2 ARG 6 22.754 29.032 15.791 41 HB3 ARG 6 HB3 ARG 6 21.262 29.523 16.588 42 HG2 ARG 6 HG2 ARG 6 22.408 31.277 17.814 43 HG3 ARG 6 HG3 ARG 6 23.972 30.810 17.122 44 HD2 ARG 6 HD2 ARG 6 21.582 31.603 15.404 45 HD3 ARG 6 HD3 ARG 6 22.709 32.793 16.013 46 HE ARG 6 HE ARG 6 23.179 30.815 13.888 47 HH11 ARG 6 HH11 ARG 6 24.751 33.273 15.906 48 HH12 ARG 6 HH12 ARG 6 26.246 33.069 15.008 49 HH21 ARG 6 HH21 ARG 6 24.966 30.942 12.689 50 HH22 ARG 6 HH22 ARG 6 26.237 32.105 13.104 51 H ARG 7 H ARG 7 23.073 26.470 16.346 52 HA ARG 7 HA ARG 7 20.537 25.122 16.337 53 HB2 ARG 7 HB2 ARG 7 22.596 24.991 14.724 54 HB3 ARG 7 HB3 ARG 7 23.182 23.733 15.821 55 HG2 ARG 7 HG2 ARG 7 20.970 22.534 15.482 56 HG3 ARG 7 HG3 ARG 7 20.529 23.771 14.292 57 HD2 ARG 7 HD2 ARG 7 22.896 21.874 14.162 58 HD3 ARG 7 HD3 ARG 7 21.417 21.747 13.205 59 HE ARG 7 HE ARG 7 22.242 24.201 12.448 60 HH11 ARG 7 HH11 ARG 7 24.219 21.272 12.699 61 HH12 ARG 7 HH12 ARG 7 25.083 21.694 11.234 62 HH21 ARG 7 HH21 ARG 7 23.719 24.732 10.777 63 HH22 ARG 7 HH22 ARG 7 24.791 23.447 10.243 64 H CYS 8 H CYS 8 23.409 24.699 18.362 65 HA CYS 8 HA CYS 8 22.475 22.447 19.884 66 HB2 CYS 8 HB2 CYS 8 24.814 23.057 19.665 67 HB3 CYS 8 HB3 CYS 8 24.526 24.612 20.415 68 H GLU 9 H GLU 9 22.305 26.021 20.523 69 HA GLU 9 HA GLU 9 20.916 25.876 22.986 70 HB2 GLU 9 HB2 GLU 9 20.951 27.949 20.761 71 HB3 GLU 9 HB3 GLU 9 20.021 28.154 22.235 72 HG2 GLU 9 HG2 GLU 9 22.033 27.973 23.616 73 HG3 GLU 9 HG3 GLU 9 23.022 27.696 22.179 74 H LEU 10 H LEU 10 19.480 26.006 19.663 75 HA LEU 10 HA LEU 10 16.788 25.718 20.758 76 HB2 LEU 10 HB2 LEU 10 15.999 25.753 18.512 77 HB3 LEU 10 HB3 LEU 10 17.196 27.006 18.776 78 HG LEU 10 HG LEU 10 18.833 25.208 17.694 79 HD11 LEU 10 HD11 LEU 10 17.744 23.953 15.869 80 HD12 LEU 10 HD12 LEU 10 17.154 23.389 17.430 81 HD13 LEU 10 HD13 LEU 10 16.151 24.472 16.448 82 HD21 LEU 10 HD21 LEU 10 16.855 26.871 16.094 83 HD22 LEU 10 HD22 LEU 10 18.393 27.437 16.785 84 HD23 LEU 10 HD23 LEU 10 18.397 26.236 15.485 85 H SER 11 H SER 11 19.192 23.383 19.637 86 HA SER 11 HA SER 11 17.499 21.063 19.629 87 HB2 SER 11 HB2 SER 11 19.754 21.035 18.718 88 HB3 SER 11 HB3 SER 11 20.441 21.430 20.299 89 HG SER 11 HG SER 11 19.196 19.045 19.427 90 H CYS 12 H CYS 12 19.424 22.575 22.264 91 HA CYS 12 HA CYS 12 18.482 20.775 24.312 92 HB2 CYS 12 HB2 CYS 12 19.855 23.477 24.452 93 HB3 CYS 12 HB3 CYS 12 19.659 22.369 25.810 94 H ARG 13 H ARG 13 17.236 23.885 23.087 95 HA ARG 13 HA ARG 13 15.409 24.517 25.167 96 HB2 ARG 13 HB2 ARG 13 16.054 25.892 23.145 97 HB3 ARG 13 HB3 ARG 13 15.036 24.841 22.160 98 HG2 ARG 13 HG2 ARG 13 13.040 25.610 23.272 99 HG3 ARG 13 HG3 ARG 13 13.978 26.387 24.560 100 HD2 ARG 13 HD2 ARG 13 13.124 28.042 22.950 101 HD3 ARG 13 HD3 ARG 13 14.897 28.016 23.004 102 HE ARG 13 HE ARG 13 13.988 26.258 20.930 103 HH11 ARG 13 HH11 ARG 13 14.264 29.722 21.501 104 HH12 ARG 13 HH12 ARG 13 14.406 30.065 19.796 105 HH21 ARG 13 HH21 ARG 13 13.956 26.720 18.919 106 HH22 ARG 13 HH22 ARG 13 14.078 28.344 18.273 107 H SER 14 H SER 14 15.243 21.992 22.702 108 HA SER 14 HA SER 14 12.457 21.376 23.054 109 HB2 SER 14 HB2 SER 14 12.880 19.306 21.957 110 HB3 SER 14 HB3 SER 14 13.880 20.537 21.175 111 HG SER 14 HG SER 14 15.683 19.718 22.169 112 H LEU 15 H LEU 15 15.246 20.593 25.008 113 HA LEU 15 HA LEU 15 13.788 18.720 26.778 114 HB2 LEU 15 HB2 LEU 15 16.616 19.819 26.993 115 HB3 LEU 15 HB3 LEU 15 15.944 18.441 27.855 116 HG LEU 15 HG LEU 15 16.495 18.565 24.855 117 HD11 LEU 15 HD11 LEU 15 18.530 18.522 26.248 118 HD12 LEU 15 HD12 LEU 15 17.930 17.075 27.088 119 HD13 LEU 15 HD13 LEU 15 18.314 17.012 25.358 120 HD21 LEU 15 HD21 LEU 15 16.093 16.094 24.955 121 HD22 LEU 15 HD22 LEU 15 15.545 16.269 26.628 122 HD23 LEU 15 HD23 LEU 15 14.629 17.030 25.307 123 H GLY 16 H GLY 16 14.472 22.103 26.560 124 HA2 GLY 16 HA2 GLY 16 13.498 23.748 27.931 125 HA3 GLY 16 HA3 GLY 16 13.374 22.614 29.271 126 H LEU 17 H LEU 17 16.484 22.895 27.582 127 HA LEU 17 HA LEU 17 17.545 24.773 29.619 128 HB2 LEU 17 HB2 LEU 17 19.577 23.180 29.696 129 HB3 LEU 17 HB3 LEU 17 18.210 22.937 30.753 130 HG LEU 17 HG LEU 17 18.368 21.386 28.158 131 HD11 LEU 17 HD11 LEU 17 20.580 21.218 29.367 132 HD12 LEU 17 HD12 LEU 17 19.720 20.576 30.760 133 HD13 LEU 17 HD13 LEU 17 19.687 19.686 29.212 134 HD21 LEU 17 HD21 LEU 17 17.296 19.614 29.550 135 HD22 LEU 17 HD22 LEU 17 17.357 20.681 30.965 136 HD23 LEU 17 HD23 LEU 17 16.323 21.089 29.597 137 H LEU 18 H LEU 18 19.802 25.456 29.135 138 HA LEU 18 HA LEU 18 20.030 26.446 26.402 139 HB2 LEU 18 HB2 LEU 18 21.523 26.777 29.016 140 HB3 LEU 18 HB3 LEU 18 22.355 27.206 27.525 141 HG LEU 18 HG LEU 18 19.722 28.429 28.430 142 HD11 LEU 18 HD11 LEU 18 21.600 29.147 29.825 143 HD12 LEU 18 HD12 LEU 18 22.577 29.493 28.382 144 HD13 LEU 18 HD13 LEU 18 21.138 30.463 28.747 145 HD21 LEU 18 HD21 LEU 18 20.276 30.094 26.621 146 HD22 LEU 18 HD22 LEU 18 21.551 29.004 26.061 147 HD23 LEU 18 HD23 LEU 18 19.839 28.505 25.999 148 H GLY 19 H GLY 19 22.157 26.347 25.278 149 HA2 GLY 19 HA2 GLY 19 23.535 23.720 25.486 150 HA3 GLY 19 HA3 GLY 19 22.929 24.270 23.928 151 H LYS 20 H LYS 20 25.709 23.740 25.029 152 HA LYS 20 HA LYS 20 26.991 26.160 23.959 153 HB2 LYS 20 HB2 LYS 20 28.180 26.685 25.805 154 HB3 LYS 20 HB3 LYS 20 26.677 26.200 26.517 155 HG2 LYS 20 HG2 LYS 20 28.022 25.003 27.904 156 HG3 LYS 20 HG3 LYS 20 27.975 23.790 26.605 157 HD2 LYS 20 HD2 LYS 20 29.964 25.118 25.605 158 HD3 LYS 20 HD3 LYS 20 30.055 25.950 27.155 159 HE2 LYS 20 HE2 LYS 20 30.367 23.733 28.275 160 HE3 LYS 20 HE3 LYS 20 30.308 22.963 26.671 161 HZ1 LYS 20 HZ1 LYS 20 32.227 24.296 26.030 162 HZ2 LYS 20 HZ2 LYS 20 32.304 25.001 27.512 163 HZ3 LYS 20 HZ3 LYS 20 32.632 23.407 27.350 164 H CYS 21 H CYS 21 29.208 25.811 23.276 165 HA CYS 21 HA CYS 21 29.415 23.344 21.741 166 HB2 CYS 21 HB2 CYS 21 30.012 25.497 20.789 167 HB3 CYS 21 HB3 CYS 21 31.179 25.786 22.074 168 H ILE 22 H ILE 22 30.822 21.667 21.923 169 HA ILE 22 HA ILE 22 33.094 21.817 23.810 170 HB ILE 22 HB ILE 22 31.504 20.660 25.076 171 HG12 ILE 22 HG12 ILE 22 33.230 18.420 23.977 172 HG13 ILE 22 HG13 ILE 22 33.945 19.808 24.802 173 HG21 ILE 22 HG21 ILE 22 30.370 18.570 24.421 174 HG22 ILE 22 HG22 ILE 22 29.882 19.916 23.397 175 HG23 ILE 22 HG23 ILE 22 31.026 18.705 22.786 176 HD11 ILE 22 HD11 ILE 22 33.616 17.976 26.375 177 HD12 ILE 22 HD12 ILE 22 32.592 19.358 26.812 178 HD13 ILE 22 HD13 ILE 22 31.881 17.937 26.021 179 H GLY 23 H GLY 23 34.307 22.359 22.067 180 HA2 GLY 23 HA2 GLY 23 35.965 21.970 20.555 181 HA3 GLY 23 HA3 GLY 23 35.727 20.247 20.804 182 H GLU 24 H GLU 24 33.720 19.384 19.718 183 HA GLU 24 HA GLU 24 33.290 20.527 16.997 184 HB2 GLU 24 HB2 GLU 24 33.826 18.532 15.846 185 HB3 GLU 24 HB3 GLU 24 35.178 18.925 16.901 186 HG2 GLU 24 HG2 GLU 24 34.237 17.209 18.553 187 HG3 GLU 24 HG3 GLU 24 33.074 16.750 17.312 188 H ALA 25 H ALA 25 31.746 19.587 19.721 189 HA ALA 25 HA ALA 25 29.222 18.966 18.277 190 HB1 ALA 25 HB1 ALA 25 28.807 17.054 19.755 191 HB2 ALA 25 HB2 ALA 25 30.326 16.818 18.881 192 HB3 ALA 25 HB3 ALA 25 30.356 17.326 20.584 193 H CYS 26 H CYS 26 27.398 18.811 19.934 194 HA CYS 26 HA CYS 26 27.304 21.240 21.583 195 HB2 CYS 26 HB2 CYS 26 25.570 20.744 19.942 196 HB3 CYS 26 HB3 CYS 26 25.270 19.183 20.684 197 H LYS 27 H LYS 27 26.687 21.369 23.693 198 HA LYS 27 HA LYS 27 26.186 18.969 25.396 199 HB2 LYS 27 HB2 LYS 27 28.499 19.416 25.735 200 HB3 LYS 27 HB3 LYS 27 28.211 21.148 25.945 201 HG2 LYS 27 HG2 LYS 27 27.058 20.813 28.022 202 HG3 LYS 27 HG3 LYS 27 26.952 19.052 27.777 203 HD2 LYS 27 HD2 LYS 27 29.277 18.756 28.077 204 HD3 LYS 27 HD3 LYS 27 29.609 20.497 27.929 205 HE2 LYS 27 HE2 LYS 27 28.225 20.895 29.987 206 HE3 LYS 27 HE3 LYS 27 28.125 19.140 30.229 207 HZ1 LYS 27 HZ1 LYS 27 29.945 20.431 31.435 208 HZ2 LYS 27 HZ2 LYS 27 30.464 19.074 30.648 209 HZ3 LYS 27 HZ3 LYS 27 30.702 20.576 30.007 210 H CYS 28 H CYS 28 24.106 19.304 26.092 211 HA CYS 28 HA CYS 28 23.080 21.991 26.507 212 HB2 CYS 28 HB2 CYS 28 21.842 19.464 27.591 213 HB3 CYS 28 HB3 CYS 28 21.097 21.035 27.312 214 H VAL 29 H VAL 29 22.552 23.053 28.484 215 HA VAL 29 HA VAL 29 24.096 22.182 30.868 216 HB VAL 29 HB VAL 29 25.016 24.526 31.034 217 HG11 VAL 29 HG11 VAL 29 26.946 24.043 29.709 218 HG12 VAL 29 HG12 VAL 29 26.352 22.524 30.382 219 HG13 VAL 29 HG13 VAL 29 26.041 22.920 28.673 220 HG21 VAL 29 HG21 VAL 29 23.623 25.666 29.346 221 HG22 VAL 29 HG22 VAL 29 25.346 25.801 28.963 222 HG23 VAL 29 HG23 VAL 29 24.340 24.662 28.063 223 HA PRO 30 HA PRO 30 20.579 23.472 33.021 224 HB2 PRO 30 HB2 PRO 30 21.412 23.459 35.569 225 HB3 PRO 30 HB3 PRO 30 21.554 22.001 34.541 226 HG2 PRO 30 HG2 PRO 30 23.715 24.090 35.057 227 HG3 PRO 30 HG3 PRO 30 23.824 22.326 35.357 228 HD2 PRO 30 HD2 PRO 30 24.680 23.383 33.020 229 HD3 PRO 30 HD3 PRO 30 23.788 21.834 33.045 230 H TYR 31 H TYR 31 22.409 25.710 32.116 231 HA TYR 31 HA TYR 31 22.485 27.816 34.078 232 HB2 TYR 31 HB2 TYR 31 22.901 27.891 31.077 233 HB3 TYR 31 HB3 TYR 31 23.383 29.149 32.203 234 HD1 TYR 31 HD1 TYR 31 24.386 26.522 34.150 235 HD2 TYR 31 HD2 TYR 31 25.248 28.232 30.277 236 HE1 TYR 31 HE1 TYR 31 26.667 25.528 34.204 237 HE2 TYR 31 HE2 TYR 31 27.516 27.234 30.346 238 HH TYR 31 HH TYR 31 28.949 25.853 31.461 Start of MODEL 10 1 H1 ALA 1 H1 ALA 1 37.189 25.759 13.969 2 H2 ALA 1 H2 ALA 1 37.693 26.171 15.466 3 H3 ALA 1 H3 ALA 1 36.456 27.004 14.771 4 HA ALA 1 HA ALA 1 36.463 24.241 15.738 5 HB1 ALA 1 HB1 ALA 1 34.676 26.600 16.474 6 HB2 ALA 1 HB2 ALA 1 34.623 24.980 17.193 7 HB3 ALA 1 HB3 ALA 1 36.049 25.996 17.435 8 H PHE 2 H PHE 2 34.094 23.387 15.710 9 HA PHE 2 HA PHE 2 32.926 23.655 12.993 10 HB2 PHE 2 HB2 PHE 2 33.699 21.022 14.265 11 HB3 PHE 2 HB3 PHE 2 33.148 21.314 12.626 12 HD1 PHE 2 HD1 PHE 2 34.695 22.255 10.916 13 HD2 PHE 2 HD2 PHE 2 36.004 21.444 14.955 14 HE1 PHE 2 HE1 PHE 2 37.062 22.478 10.197 15 HE2 PHE 2 HE2 PHE 2 38.371 21.705 14.241 16 HZ PHE 2 HZ PHE 2 38.893 22.221 11.862 17 H CYS 3 H CYS 3 31.700 24.716 15.279 18 HA CYS 3 HA CYS 3 29.318 22.978 15.521 19 HB2 CYS 3 HB2 CYS 3 30.758 22.298 17.342 20 HB3 CYS 3 HB3 CYS 3 30.906 23.964 17.905 21 H ASN 4 H ASN 4 27.606 24.116 15.080 22 HA ASN 4 HA ASN 4 27.398 27.025 15.404 23 HB2 ASN 4 HB2 ASN 4 26.475 25.898 13.433 24 HB3 ASN 4 HB3 ASN 4 25.470 24.866 14.425 25 HD21 ASN 4 HD21 ASN 4 23.595 27.893 13.104 26 HD22 ASN 4 HD22 ASN 4 24.709 26.769 12.303 27 H LEU 5 H LEU 5 26.969 27.814 17.308 28 HA LEU 5 HA LEU 5 26.078 26.301 19.571 29 HB2 LEU 5 HB2 LEU 5 27.536 28.296 19.693 30 HB3 LEU 5 HB3 LEU 5 26.209 29.310 19.120 31 HG LEU 5 HG LEU 5 24.914 28.791 21.178 32 HD11 LEU 5 HD11 LEU 5 25.781 26.577 21.778 33 HD12 LEU 5 HD12 LEU 5 27.420 27.248 21.986 34 HD13 LEU 5 HD13 LEU 5 26.111 27.709 23.090 35 HD21 LEU 5 HD21 LEU 5 26.420 30.753 21.098 36 HD22 LEU 5 HD22 LEU 5 26.309 30.078 22.730 37 HD23 LEU 5 HD23 LEU 5 27.747 29.759 21.737 38 H ARG 6 H ARG 6 24.303 28.441 17.328 39 HA ARG 6 HA ARG 6 21.801 28.453 18.824 40 HB2 ARG 6 HB2 ARG 6 22.758 29.407 16.134 41 HB3 ARG 6 HB3 ARG 6 21.053 29.010 16.261 42 HG2 ARG 6 HG2 ARG 6 21.314 31.345 16.714 43 HG3 ARG 6 HG3 ARG 6 20.769 30.512 18.164 44 HD2 ARG 6 HD2 ARG 6 22.342 32.060 18.918 45 HD3 ARG 6 HD3 ARG 6 23.213 30.524 18.957 46 HE ARG 6 HE ARG 6 23.716 31.709 16.424 47 HH11 ARG 6 HH11 ARG 6 24.491 32.558 19.783 48 HH12 ARG 6 HH12 ARG 6 25.700 33.711 19.214 49 HH21 ARG 6 HH21 ARG 6 25.222 33.175 15.910 50 HH22 ARG 6 HH22 ARG 6 26.006 34.109 17.186 51 H ARG 7 H ARG 7 22.950 26.500 16.075 52 HA ARG 7 HA ARG 7 20.606 24.904 15.733 53 HB2 ARG 7 HB2 ARG 7 22.567 25.131 14.169 54 HB3 ARG 7 HB3 ARG 7 23.488 24.073 15.240 55 HG2 ARG 7 HG2 ARG 7 21.857 22.247 14.852 56 HG3 ARG 7 HG3 ARG 7 20.901 23.310 13.811 57 HD2 ARG 7 HD2 ARG 7 23.788 22.467 13.298 58 HD3 ARG 7 HD3 ARG 7 22.370 21.669 12.605 59 HE ARG 7 HE ARG 7 22.036 24.312 11.858 60 HH11 ARG 7 HH11 ARG 7 24.444 21.840 11.139 61 HH12 ARG 7 HH12 ARG 7 25.191 22.832 9.905 62 HH21 ARG 7 HH21 ARG 7 22.689 25.217 10.017 63 HH22 ARG 7 HH22 ARG 7 24.027 24.563 9.096 64 H CYS 8 H CYS 8 23.120 24.671 18.140 65 HA CYS 8 HA CYS 8 22.082 22.136 19.248 66 HB2 CYS 8 HB2 CYS 8 24.482 22.608 19.254 67 HB3 CYS 8 HB3 CYS 8 24.210 24.060 20.219 68 H GLU 9 H GLU 9 22.269 25.591 20.367 69 HA GLU 9 HA GLU 9 20.861 25.267 22.772 70 HB2 GLU 9 HB2 GLU 9 21.260 27.612 20.890 71 HB3 GLU 9 HB3 GLU 9 20.198 27.744 22.284 72 HG2 GLU 9 HG2 GLU 9 22.107 26.969 23.749 73 HG3 GLU 9 HG3 GLU 9 23.180 27.217 22.357 74 H LEU 10 H LEU 10 19.418 25.778 19.500 75 HA LEU 10 HA LEU 10 16.745 26.047 20.535 76 HB2 LEU 10 HB2 LEU 10 15.993 25.913 18.320 77 HB3 LEU 10 HB3 LEU 10 17.524 26.750 18.281 78 HG LEU 10 HG LEU 10 18.451 24.296 17.682 79 HD11 LEU 10 HD11 LEU 10 16.856 23.123 16.183 80 HD12 LEU 10 HD12 LEU 10 16.221 23.144 17.828 81 HD13 LEU 10 HD13 LEU 10 15.579 24.267 16.619 82 HD21 LEU 10 HD21 LEU 10 16.989 26.106 15.720 83 HD22 LEU 10 HD22 LEU 10 18.668 26.287 16.250 84 HD23 LEU 10 HD23 LEU 10 18.194 24.877 15.287 85 H SER 11 H SER 11 18.721 23.204 19.813 86 HA SER 11 HA SER 11 16.562 21.274 20.092 87 HB2 SER 11 HB2 SER 11 18.703 20.895 18.812 88 HB3 SER 11 HB3 SER 11 19.564 20.830 20.358 89 HG SER 11 HG SER 11 17.457 19.169 19.439 90 H CYS 12 H CYS 12 19.072 22.600 22.283 91 HA CYS 12 HA CYS 12 18.263 21.025 24.553 92 HB2 CYS 12 HB2 CYS 12 19.722 23.690 24.576 93 HB3 CYS 12 HB3 CYS 12 19.676 22.462 25.846 94 H ARG 13 H ARG 13 17.203 24.251 23.391 95 HA ARG 13 HA ARG 13 15.544 24.893 25.633 96 HB2 ARG 13 HB2 ARG 13 16.355 26.440 23.906 97 HB3 ARG 13 HB3 ARG 13 15.381 25.615 22.692 98 HG2 ARG 13 HG2 ARG 13 13.309 26.351 23.907 99 HG3 ARG 13 HG3 ARG 13 14.329 27.145 25.125 100 HD2 ARG 13 HD2 ARG 13 13.525 28.774 23.465 101 HD3 ARG 13 HD3 ARG 13 15.287 28.611 23.381 102 HE ARG 13 HE ARG 13 13.892 26.807 21.564 103 HH11 ARG 13 HH11 ARG 13 15.363 30.035 21.709 104 HH12 ARG 13 HH12 ARG 13 15.407 30.086 19.946 105 HH21 ARG 13 HH21 ARG 13 13.879 27.135 19.367 106 HH22 ARG 13 HH22 ARG 13 14.702 28.568 18.750 107 H SER 14 H SER 14 14.966 22.699 22.867 108 HA SER 14 HA SER 14 12.180 22.217 23.532 109 HB2 SER 14 HB2 SER 14 14.128 20.424 22.049 110 HB3 SER 14 HB3 SER 14 12.359 20.296 22.062 111 HG SER 14 HG SER 14 12.207 22.268 21.040 112 H LEU 15 H LEU 15 15.110 21.226 25.064 113 HA LEU 15 HA LEU 15 13.745 19.161 26.727 114 HB2 LEU 15 HB2 LEU 15 16.677 19.956 26.695 115 HB3 LEU 15 HB3 LEU 15 15.970 18.560 27.479 116 HG LEU 15 HG LEU 15 16.172 19.004 24.477 117 HD11 LEU 15 HD11 LEU 15 17.820 17.194 24.556 118 HD12 LEU 15 HD12 LEU 15 18.332 18.557 25.566 119 HD13 LEU 15 HD13 LEU 15 17.657 17.095 26.324 120 HD21 LEU 15 HD21 LEU 15 15.210 16.559 26.028 121 HD22 LEU 15 HD22 LEU 15 14.196 17.617 25.016 122 HD23 LEU 15 HD23 LEU 15 15.466 16.644 24.274 123 H GLY 16 H GLY 16 14.121 22.447 26.746 124 HA2 GLY 16 HA2 GLY 16 13.424 23.944 28.366 125 HA3 GLY 16 HA3 GLY 16 13.627 22.729 29.624 126 H LEU 17 H LEU 17 16.517 22.892 27.806 127 HA LEU 17 HA LEU 17 17.784 24.528 29.984 128 HB2 LEU 17 HB2 LEU 17 19.587 22.687 28.629 129 HB3 LEU 17 HB3 LEU 17 19.326 22.988 30.334 130 HG LEU 17 HG LEU 17 17.798 21.068 28.579 131 HD11 LEU 17 HD11 LEU 17 19.033 19.326 29.799 132 HD12 LEU 17 HD12 LEU 17 20.161 20.436 29.009 133 HD13 LEU 17 HD13 LEU 17 19.882 20.564 30.750 134 HD21 LEU 17 HD21 LEU 17 16.962 20.104 30.743 135 HD22 LEU 17 HD22 LEU 17 17.776 21.415 31.637 136 HD23 LEU 17 HD23 LEU 17 16.409 21.769 30.580 137 H LEU 18 H LEU 18 20.222 24.931 29.228 138 HA LEU 18 HA LEU 18 20.228 26.437 26.649 139 HB2 LEU 18 HB2 LEU 18 22.089 26.423 29.065 140 HB3 LEU 18 HB3 LEU 18 22.499 27.237 27.554 141 HG LEU 18 HG LEU 18 20.094 27.903 29.253 142 HD11 LEU 18 HD11 LEU 18 22.743 29.353 28.905 143 HD12 LEU 18 HD12 LEU 18 21.356 29.930 29.864 144 HD13 LEU 18 HD13 LEU 18 22.226 28.471 30.358 145 HD21 LEU 18 HD21 LEU 18 21.277 29.274 26.811 146 HD22 LEU 18 HD22 LEU 18 19.668 28.524 26.933 147 HD23 LEU 18 HD23 LEU 18 20.028 29.980 27.855 148 H GLY 19 H GLY 19 22.557 26.262 25.679 149 HA2 GLY 19 HA2 GLY 19 23.667 23.507 25.791 150 HA3 GLY 19 HA3 GLY 19 23.206 24.134 24.208 151 H LYS 20 H LYS 20 25.829 23.327 25.217 152 HA LYS 20 HA LYS 20 27.311 25.761 24.363 153 HB2 LYS 20 HB2 LYS 20 28.919 25.741 26.039 154 HB3 LYS 20 HB3 LYS 20 27.353 25.729 26.822 155 HG2 LYS 20 HG2 LYS 20 28.300 24.141 28.138 156 HG3 LYS 20 HG3 LYS 20 27.811 23.058 26.844 157 HD2 LYS 20 HD2 LYS 20 30.058 22.486 27.234 158 HD3 LYS 20 HD3 LYS 20 30.152 23.549 25.814 159 HE2 LYS 20 HE2 LYS 20 30.812 25.445 27.224 160 HE3 LYS 20 HE3 LYS 20 30.562 24.488 28.691 161 HZ1 LYS 20 HZ1 LYS 20 32.406 23.049 27.991 162 HZ2 LYS 20 HZ2 LYS 20 32.641 23.963 26.630 163 HZ3 LYS 20 HZ3 LYS 20 32.920 24.601 28.081 164 H CYS 21 H CYS 21 28.807 25.472 22.912 165 HA CYS 21 HA CYS 21 29.159 22.837 21.659 166 HB2 CYS 21 HB2 CYS 21 30.152 25.640 21.080 167 HB3 CYS 21 HB3 CYS 21 30.787 24.248 20.238 168 H ILE 22 H ILE 22 31.092 21.748 21.497 169 HA ILE 22 HA ILE 22 33.463 22.692 22.988 170 HB ILE 22 HB ILE 22 32.194 21.377 24.542 171 HG12 ILE 22 HG12 ILE 22 34.670 19.784 23.803 172 HG13 ILE 22 HG13 ILE 22 34.740 21.427 24.451 173 HG21 ILE 22 HG21 ILE 22 31.765 19.016 24.356 174 HG22 ILE 22 HG22 ILE 22 31.019 19.825 22.986 175 HG23 ILE 22 HG23 ILE 22 32.536 18.925 22.769 176 HD11 ILE 22 HD11 ILE 22 33.532 19.011 25.855 177 HD12 ILE 22 HD12 ILE 22 35.000 19.904 26.297 178 HD13 ILE 22 HD13 ILE 22 33.420 20.687 26.448 179 H GLY 23 H GLY 23 33.799 23.288 20.756 180 HA2 GLY 23 HA2 GLY 23 35.381 23.145 19.088 181 HA3 GLY 23 HA3 GLY 23 35.761 21.496 19.595 182 H GLU 24 H GLU 24 33.988 19.898 19.101 183 HA GLU 24 HA GLU 24 32.760 20.270 16.395 184 HB2 GLU 24 HB2 GLU 24 33.726 18.170 15.637 185 HB3 GLU 24 HB3 GLU 24 34.886 19.460 15.873 186 HG2 GLU 24 HG2 GLU 24 34.415 17.508 18.146 187 HG3 GLU 24 HG3 GLU 24 35.296 17.005 16.713 188 H ALA 25 H ALA 25 31.841 19.844 19.280 189 HA ALA 25 HA ALA 25 29.507 18.223 18.624 190 HB1 ALA 25 HB1 ALA 25 31.334 17.524 20.977 191 HB2 ALA 25 HB2 ALA 25 29.748 16.797 20.639 192 HB3 ALA 25 HB3 ALA 25 31.096 16.535 19.520 193 H CYS 26 H CYS 26 27.997 18.341 20.749 194 HA CYS 26 HA CYS 26 28.437 20.766 22.344 195 HB2 CYS 26 HB2 CYS 26 27.386 21.620 20.280 196 HB3 CYS 26 HB3 CYS 26 26.052 20.494 20.484 197 H LYS 27 H LYS 27 27.381 20.774 24.264 198 HA LYS 27 HA LYS 27 25.564 18.459 24.897 199 HB2 LYS 27 HB2 LYS 27 27.702 18.099 25.905 200 HB3 LYS 27 HB3 LYS 27 27.716 19.706 26.634 201 HG2 LYS 27 HG2 LYS 27 26.120 19.155 28.250 202 HG3 LYS 27 HG3 LYS 27 25.442 17.819 27.296 203 HD2 LYS 27 HD2 LYS 27 27.316 16.410 27.707 204 HD3 LYS 27 HD3 LYS 27 28.248 17.717 28.458 205 HE2 LYS 27 HE2 LYS 27 26.923 17.748 30.411 206 HE3 LYS 27 HE3 LYS 27 25.568 16.927 29.621 207 HZ1 LYS 27 HZ1 LYS 27 26.773 14.921 29.561 208 HZ2 LYS 27 HZ2 LYS 27 28.155 15.579 30.192 209 HZ3 LYS 27 HZ3 LYS 27 26.781 15.439 31.101 210 H CYS 28 H CYS 28 23.665 18.850 25.845 211 HA CYS 28 HA CYS 28 22.783 21.608 26.284 212 HB2 CYS 28 HB2 CYS 28 21.388 18.967 26.799 213 HB3 CYS 28 HB3 CYS 28 20.659 20.574 26.887 214 H VAL 29 H VAL 29 22.503 22.634 28.206 215 HA VAL 29 HA VAL 29 23.480 21.320 30.685 216 HB VAL 29 HB VAL 29 24.945 23.246 31.108 217 HG11 VAL 29 HG11 VAL 29 25.802 21.099 30.169 218 HG12 VAL 29 HG12 VAL 29 25.693 21.801 28.541 219 HG13 VAL 29 HG13 VAL 29 26.787 22.506 29.742 220 HG21 VAL 29 HG21 VAL 29 24.013 24.959 29.604 221 HG22 VAL 29 HG22 VAL 29 25.714 24.676 29.240 222 HG23 VAL 29 HG23 VAL 29 24.472 23.989 28.187 223 HA PRO 30 HA PRO 30 20.153 23.649 32.429 224 HB2 PRO 30 HB2 PRO 30 20.441 23.105 35.036 225 HB3 PRO 30 HB3 PRO 30 20.205 21.795 33.842 226 HG2 PRO 30 HG2 PRO 30 22.835 22.801 35.006 227 HG3 PRO 30 HG3 PRO 30 22.233 21.111 34.958 228 HD2 PRO 30 HD2 PRO 30 23.898 22.116 33.034 229 HD3 PRO 30 HD3 PRO 30 22.616 20.925 32.663 230 H TYR 31 H TYR 31 22.848 25.078 32.138 231 HA TYR 31 HA TYR 31 23.415 26.682 34.430 232 HB2 TYR 31 HB2 TYR 31 24.146 27.234 31.545 233 HB3 TYR 31 HB3 TYR 31 24.904 27.943 32.954 234 HD1 TYR 31 HD1 TYR 31 24.699 24.723 34.174 235 HD2 TYR 31 HD2 TYR 31 26.583 26.921 30.963 236 HE1 TYR 31 HE1 TYR 31 26.436 22.953 33.971 237 HE2 TYR 31 HE2 TYR 31 28.341 25.168 30.808 238 HH TYR 31 HH TYR 31 28.041 22.066 32.338 Start of MODEL 11 1 H1 ALA 1 H1 ALA 1 36.968 23.454 16.333 2 H2 ALA 1 H2 ALA 1 35.920 24.433 17.161 3 H3 ALA 1 H3 ALA 1 37.437 24.941 16.825 4 HA ALA 1 HA ALA 1 36.000 26.046 15.398 5 HB1 ALA 1 HB1 ALA 1 37.428 23.841 13.859 6 HB2 ALA 1 HB2 ALA 1 36.883 25.403 13.209 7 HB3 ALA 1 HB3 ALA 1 38.169 25.359 14.428 8 H PHE 2 H PHE 2 34.226 26.214 14.250 9 HA PHE 2 HA PHE 2 32.168 25.882 13.488 10 HB2 PHE 2 HB2 PHE 2 33.309 23.401 12.208 11 HB3 PHE 2 HB3 PHE 2 31.966 24.377 11.635 12 HD1 PHE 2 HD1 PHE 2 32.480 26.914 11.090 13 HD2 PHE 2 HD2 PHE 2 35.476 23.837 11.413 14 HE1 PHE 2 HE1 PHE 2 34.076 28.326 9.825 15 HE2 PHE 2 HE2 PHE 2 37.068 25.240 10.128 16 HZ PHE 2 HZ PHE 2 36.389 27.497 9.363 17 H CYS 3 H CYS 3 31.946 25.114 16.097 18 HA CYS 3 HA CYS 3 30.294 22.655 16.118 19 HB2 CYS 3 HB2 CYS 3 29.943 23.018 18.407 20 HB3 CYS 3 HB3 CYS 3 31.651 23.211 18.100 21 H ASN 4 H ASN 4 28.092 22.639 15.862 22 HA ASN 4 HA ASN 4 26.855 25.090 14.785 23 HB2 ASN 4 HB2 ASN 4 25.589 22.340 14.986 24 HB3 ASN 4 HB3 ASN 4 25.094 23.689 13.977 25 HD21 ASN 4 HD21 ASN 4 27.693 23.065 11.561 26 HD22 ASN 4 HD22 ASN 4 26.583 24.326 12.152 27 H LEU 5 H LEU 5 27.134 26.104 16.895 28 HA LEU 5 HA LEU 5 25.809 25.221 19.220 29 HB2 LEU 5 HB2 LEU 5 27.741 26.746 19.187 30 HB3 LEU 5 HB3 LEU 5 26.752 28.006 18.458 31 HG LEU 5 HG LEU 5 25.380 28.198 20.458 32 HD11 LEU 5 HD11 LEU 5 25.382 25.865 21.295 33 HD12 LEU 5 HD12 LEU 5 27.113 26.002 21.676 34 HD13 LEU 5 HD13 LEU 5 25.920 26.982 22.538 35 HD21 LEU 5 HD21 LEU 5 28.334 28.134 21.175 36 HD22 LEU 5 HD22 LEU 5 27.519 29.441 20.292 37 HD23 LEU 5 HD23 LEU 5 27.062 29.095 21.964 38 H ARG 6 H ARG 6 24.628 27.581 16.740 39 HA ARG 6 HA ARG 6 22.265 28.330 18.235 40 HB2 ARG 6 HB2 ARG 6 23.069 29.702 16.426 41 HB3 ARG 6 HB3 ARG 6 22.877 28.400 15.250 42 HG2 ARG 6 HG2 ARG 6 20.478 28.499 15.370 43 HG3 ARG 6 HG3 ARG 6 20.529 29.497 16.831 44 HD2 ARG 6 HD2 ARG 6 19.908 30.846 14.911 45 HD3 ARG 6 HD3 ARG 6 21.453 31.375 15.589 46 HE ARG 6 HE ARG 6 22.004 29.562 13.446 47 HH11 ARG 6 HH11 ARG 6 20.557 32.773 13.822 48 HH12 ARG 6 HH12 ARG 6 21.133 33.288 12.272 49 HH21 ARG 6 HH21 ARG 6 22.966 30.474 11.618 50 HH22 ARG 6 HH22 ARG 6 22.419 32.030 11.049 51 H ARG 7 H ARG 7 22.803 25.719 15.850 52 HA ARG 7 HA ARG 7 20.125 24.672 15.917 53 HB2 ARG 7 HB2 ARG 7 22.139 24.275 14.262 54 HB3 ARG 7 HB3 ARG 7 22.656 23.057 15.406 55 HG2 ARG 7 HG2 ARG 7 21.410 22.055 13.588 56 HG3 ARG 7 HG3 ARG 7 20.521 21.830 15.088 57 HD2 ARG 7 HD2 ARG 7 19.119 22.436 13.057 58 HD3 ARG 7 HD3 ARG 7 18.874 23.446 14.484 59 HE ARG 7 HE ARG 7 20.854 24.498 12.581 60 HH11 ARG 7 HH11 ARG 7 17.392 24.296 12.853 61 HH12 ARG 7 HH12 ARG 7 17.152 25.972 12.446 62 HH21 ARG 7 HH21 ARG 7 20.526 26.687 12.155 63 HH22 ARG 7 HH22 ARG 7 18.882 27.282 12.049 64 H CYS 8 H CYS 8 22.947 24.088 17.916 65 HA CYS 8 HA CYS 8 21.896 21.891 19.472 66 HB2 CYS 8 HB2 CYS 8 24.280 22.407 19.155 67 HB3 CYS 8 HB3 CYS 8 24.077 23.934 19.979 68 H GLU 9 H GLU 9 22.223 25.418 20.167 69 HA GLU 9 HA GLU 9 21.010 25.539 22.697 70 HB2 GLU 9 HB2 GLU 9 21.253 27.484 20.385 71 HB3 GLU 9 HB3 GLU 9 20.436 27.952 21.857 72 HG2 GLU 9 HG2 GLU 9 23.195 26.756 22.130 73 HG3 GLU 9 HG3 GLU 9 23.053 28.367 21.434 74 H LEU 10 H LEU 10 19.364 25.976 19.492 75 HA LEU 10 HA LEU 10 16.777 26.193 20.776 76 HB2 LEU 10 HB2 LEU 10 15.844 26.297 18.587 77 HB3 LEU 10 HB3 LEU 10 17.305 27.254 18.666 78 HG LEU 10 HG LEU 10 18.426 25.080 17.610 79 HD11 LEU 10 HD11 LEU 10 15.538 24.840 16.665 80 HD12 LEU 10 HD12 LEU 10 16.926 23.976 15.980 81 HD13 LEU 10 HD13 LEU 10 16.411 23.640 17.632 82 HD21 LEU 10 HD21 LEU 10 18.310 27.319 16.559 83 HD22 LEU 10 HD22 LEU 10 18.039 26.032 15.379 84 HD23 LEU 10 HD23 LEU 10 16.662 26.969 15.997 85 H SER 11 H SER 11 18.675 23.418 19.864 86 HA SER 11 HA SER 11 16.411 21.532 20.079 87 HB2 SER 11 HB2 SER 11 19.394 20.957 20.041 88 HB3 SER 11 HB3 SER 11 18.073 19.785 19.892 89 HG SER 11 HG SER 11 18.937 21.786 18.096 90 H CYS 12 H CYS 12 18.919 22.862 22.257 91 HA CYS 12 HA CYS 12 18.174 21.187 24.506 92 HB2 CYS 12 HB2 CYS 12 19.670 23.835 24.395 93 HB3 CYS 12 HB3 CYS 12 19.573 22.751 25.787 94 H ARG 13 H ARG 13 17.187 24.467 23.408 95 HA ARG 13 HA ARG 13 15.519 25.152 25.578 96 HB2 ARG 13 HB2 ARG 13 16.330 26.535 23.603 97 HB3 ARG 13 HB3 ARG 13 15.019 25.827 22.649 98 HG2 ARG 13 HG2 ARG 13 13.354 26.782 24.195 99 HG3 ARG 13 HG3 ARG 13 14.640 27.375 25.261 100 HD2 ARG 13 HD2 ARG 13 14.310 28.213 22.362 101 HD3 ARG 13 HD3 ARG 13 13.628 29.115 23.711 102 HE ARG 13 HE ARG 13 16.473 28.902 22.904 103 HH11 ARG 13 HH11 ARG 13 14.264 30.178 25.351 104 HH12 ARG 13 HH12 ARG 13 15.459 31.305 25.940 105 HH21 ARG 13 HH21 ARG 13 17.941 30.317 23.762 106 HH22 ARG 13 HH22 ARG 13 17.407 31.462 24.982 107 H SER 14 H SER 14 14.832 22.947 22.922 108 HA SER 14 HA SER 14 12.046 22.483 23.439 109 HB2 SER 14 HB2 SER 14 13.261 21.809 21.408 110 HB3 SER 14 HB3 SER 14 14.143 20.589 22.345 111 HG SER 14 HG SER 14 12.531 19.341 22.150 112 H LEU 15 H LEU 15 14.942 21.194 25.017 113 HA LEU 15 HA LEU 15 13.450 19.317 26.721 114 HB2 LEU 15 HB2 LEU 15 16.352 20.189 26.884 115 HB3 LEU 15 HB3 LEU 15 15.619 18.771 27.626 116 HG LEU 15 HG LEU 15 15.952 19.186 24.622 117 HD11 LEU 15 HD11 LEU 15 17.727 17.488 24.825 118 HD12 LEU 15 HD12 LEU 15 18.107 18.959 25.737 119 HD13 LEU 15 HD13 LEU 15 17.541 17.511 26.591 120 HD21 LEU 15 HD21 LEU 15 15.105 16.735 26.232 121 HD22 LEU 15 HD22 LEU 15 14.069 17.680 25.138 122 HD23 LEU 15 HD23 LEU 15 15.434 16.766 24.489 123 H GLY 16 H GLY 16 14.598 22.611 26.889 124 HA2 GLY 16 HA2 GLY 16 13.802 24.217 28.462 125 HA3 GLY 16 HA3 GLY 16 13.501 22.941 29.639 126 H LEU 17 H LEU 17 16.591 23.031 27.931 127 HA LEU 17 HA LEU 17 17.995 24.462 30.126 128 HB2 LEU 17 HB2 LEU 17 19.758 22.629 29.865 129 HB3 LEU 17 HB3 LEU 17 18.414 22.396 30.955 130 HG LEU 17 HG LEU 17 18.285 21.218 28.169 131 HD11 LEU 17 HD11 LEU 17 20.500 20.626 29.208 132 HD12 LEU 17 HD12 LEU 17 19.634 19.943 30.584 133 HD13 LEU 17 HD13 LEU 17 19.427 19.234 28.965 134 HD21 LEU 17 HD21 LEU 17 17.288 20.285 30.923 135 HD22 LEU 17 HD22 LEU 17 16.267 20.957 29.649 136 HD23 LEU 17 HD23 LEU 17 17.068 19.403 29.404 137 H LEU 18 H LEU 18 20.383 24.854 29.424 138 HA LEU 18 HA LEU 18 20.147 26.296 26.846 139 HB2 LEU 18 HB2 LEU 18 22.226 26.348 29.059 140 HB3 LEU 18 HB3 LEU 18 22.334 27.323 27.600 141 HG LEU 18 HG LEU 18 20.021 27.467 29.547 142 HD11 LEU 18 HD11 LEU 18 22.445 29.303 29.280 143 HD12 LEU 18 HD12 LEU 18 21.058 29.554 30.364 144 HD13 LEU 18 HD13 LEU 18 22.135 28.174 30.616 145 HD21 LEU 18 HD21 LEU 18 19.530 29.631 28.473 146 HD22 LEU 18 HD22 LEU 18 20.836 29.361 27.304 147 HD23 LEU 18 HD23 LEU 18 19.410 28.307 27.321 148 H GLY 19 H GLY 19 22.028 26.416 25.441 149 HA2 GLY 19 HA2 GLY 19 23.198 23.700 24.900 150 HA3 GLY 19 HA3 GLY 19 23.030 24.976 23.718 151 H LYS 20 H LYS 20 25.356 23.304 24.809 152 HA LYS 20 HA LYS 20 27.363 25.406 25.351 153 HB2 LYS 20 HB2 LYS 20 26.270 24.067 27.300 154 HB3 LYS 20 HB3 LYS 20 27.043 22.648 26.646 155 HG2 LYS 20 HG2 LYS 20 28.351 23.535 28.429 156 HG3 LYS 20 HG3 LYS 20 29.272 23.773 26.928 157 HD2 LYS 20 HD2 LYS 20 28.947 26.104 26.945 158 HD3 LYS 20 HD3 LYS 20 27.418 25.994 27.850 159 HE2 LYS 20 HE2 LYS 20 28.590 25.226 29.820 160 HE3 LYS 20 HE3 LYS 20 30.147 25.313 28.966 161 HZ1 LYS 20 HZ1 LYS 20 29.811 27.714 28.734 162 HZ2 LYS 20 HZ2 LYS 20 28.383 27.629 29.548 163 HZ3 LYS 20 HZ3 LYS 20 29.801 27.300 30.327 164 H CYS 21 H CYS 21 28.945 25.307 23.812 165 HA CYS 21 HA CYS 21 29.512 22.829 22.367 166 HB2 CYS 21 HB2 CYS 21 30.852 25.536 22.300 167 HB3 CYS 21 HB3 CYS 21 31.458 24.127 21.435 168 H ILE 22 H ILE 22 31.363 21.675 22.319 169 HA ILE 22 HA ILE 22 33.367 21.893 24.486 170 HB ILE 22 HB ILE 22 31.863 20.305 25.340 171 HG12 ILE 22 HG12 ILE 22 34.219 18.749 24.189 172 HG13 ILE 22 HG13 ILE 22 34.345 19.927 25.496 173 HG21 ILE 22 HG21 ILE 22 32.056 18.612 22.814 174 HG22 ILE 22 HG22 ILE 22 31.129 18.260 24.281 175 HG23 ILE 22 HG23 ILE 22 30.661 19.612 23.269 176 HD11 ILE 22 HD11 ILE 22 34.260 17.745 26.472 177 HD12 ILE 22 HD12 ILE 22 32.717 18.544 26.832 178 HD13 ILE 22 HD13 ILE 22 32.812 17.307 25.555 179 H GLY 23 H GLY 23 34.488 22.977 22.870 180 HA2 GLY 23 HA2 GLY 23 36.395 23.041 21.551 181 HA3 GLY 23 HA3 GLY 23 36.318 21.290 21.345 182 H GLU 24 H GLU 24 34.741 20.454 19.937 183 HA GLU 24 HA GLU 24 34.195 22.156 17.510 184 HB2 GLU 24 HB2 GLU 24 35.126 19.261 17.499 185 HB3 GLU 24 HB3 GLU 24 34.799 20.280 16.109 186 HG2 GLU 24 HG2 GLU 24 37.072 20.436 16.159 187 HG3 GLU 24 HG3 GLU 24 36.637 21.868 17.080 188 H ALA 25 H ALA 25 32.674 20.338 19.850 189 HA ALA 25 HA ALA 25 30.331 19.650 18.126 190 HB1 ALA 25 HB1 ALA 25 30.185 17.536 19.416 191 HB2 ALA 25 HB2 ALA 25 31.729 17.660 18.573 192 HB3 ALA 25 HB3 ALA 25 31.641 17.974 20.322 193 H CYS 26 H CYS 26 28.354 19.115 19.753 194 HA CYS 26 HA CYS 26 28.429 20.990 22.069 195 HB2 CYS 26 HB2 CYS 26 27.818 22.243 20.034 196 HB3 CYS 26 HB3 CYS 26 26.412 21.206 19.817 197 H LYS 27 H LYS 27 26.954 20.830 23.638 198 HA LYS 27 HA LYS 27 24.956 18.629 23.737 199 HB2 LYS 27 HB2 LYS 27 27.181 19.097 25.774 200 HB3 LYS 27 HB3 LYS 27 25.814 18.032 26.029 201 HG2 LYS 27 HG2 LYS 27 27.965 17.641 23.913 202 HG3 LYS 27 HG3 LYS 27 27.859 16.825 25.471 203 HD2 LYS 27 HD2 LYS 27 25.585 15.903 24.736 204 HD3 LYS 27 HD3 LYS 27 25.976 16.500 23.112 205 HE2 LYS 27 HE2 LYS 27 28.184 15.223 23.308 206 HE3 LYS 27 HE3 LYS 27 27.564 14.519 24.803 207 HZ1 LYS 27 HZ1 LYS 27 27.141 13.026 22.983 208 HZ2 LYS 27 HZ2 LYS 27 25.704 13.596 23.463 209 HZ3 LYS 27 HZ3 LYS 27 26.407 14.155 22.077 210 H CYS 28 H CYS 28 23.700 18.892 25.956 211 HA CYS 28 HA CYS 28 23.094 21.786 26.282 212 HB2 CYS 28 HB2 CYS 28 21.472 19.418 27.230 213 HB3 CYS 28 HB3 CYS 28 20.980 21.115 27.154 214 H VAL 29 H VAL 29 22.655 22.683 28.390 215 HA VAL 29 HA VAL 29 23.640 21.230 30.762 216 HB VAL 29 HB VAL 29 24.929 23.132 31.563 217 HG11 VAL 29 HG11 VAL 29 26.043 21.232 30.459 218 HG12 VAL 29 HG12 VAL 29 26.001 22.107 28.917 219 HG13 VAL 29 HG13 VAL 29 26.940 22.745 30.282 220 HG21 VAL 29 HG21 VAL 29 24.522 24.313 28.787 221 HG22 VAL 29 HG22 VAL 29 24.080 25.033 30.345 222 HG23 VAL 29 HG23 VAL 29 25.779 24.845 29.924 223 HA PRO 30 HA PRO 30 19.997 23.149 32.361 224 HB2 PRO 30 HB2 PRO 30 20.046 22.364 34.938 225 HB3 PRO 30 HB3 PRO 30 20.026 21.164 33.602 226 HG2 PRO 30 HG2 PRO 30 22.449 22.240 35.096 227 HG3 PRO 30 HG3 PRO 30 21.977 20.524 34.888 228 HD2 PRO 30 HD2 PRO 30 23.751 21.741 33.212 229 HD3 PRO 30 HD3 PRO 30 22.561 20.558 32.593 230 H TYR 31 H TYR 31 22.828 24.621 32.912 231 HA TYR 31 HA TYR 31 22.772 25.935 35.352 232 HB2 TYR 31 HB2 TYR 31 24.009 27.007 32.812 233 HB3 TYR 31 HB3 TYR 31 24.509 27.363 34.456 234 HD1 TYR 31 HD1 TYR 31 26.233 26.385 32.166 235 HD2 TYR 31 HD2 TYR 31 24.273 24.253 35.357 236 HE1 TYR 31 HE1 TYR 31 27.912 24.562 31.979 237 HE2 TYR 31 HE2 TYR 31 25.915 22.403 35.120 238 HH TYR 31 HH TYR 31 28.502 22.486 32.638 Start of MODEL 12 1 H1 ALA 1 H1 ALA 1 36.761 24.411 14.364 2 H2 ALA 1 H2 ALA 1 36.856 22.893 15.012 3 H3 ALA 1 H3 ALA 1 37.618 24.153 15.745 4 HA ALA 1 HA ALA 1 35.622 23.424 16.865 5 HB1 ALA 1 HB1 ALA 1 34.727 25.648 17.302 6 HB2 ALA 1 HB2 ALA 1 36.499 25.705 17.206 7 HB3 ALA 1 HB3 ALA 1 35.516 26.287 15.845 8 H PHE 2 H PHE 2 34.822 21.857 15.115 9 HA PHE 2 HA PHE 2 32.786 22.876 13.317 10 HB2 PHE 2 HB2 PHE 2 33.615 20.028 14.008 11 HB3 PHE 2 HB3 PHE 2 32.521 20.468 12.693 12 HD1 PHE 2 HD1 PHE 2 35.975 19.951 13.563 13 HD2 PHE 2 HD2 PHE 2 33.367 22.033 10.837 14 HE1 PHE 2 HE1 PHE 2 37.858 20.249 11.976 15 HE2 PHE 2 HE2 PHE 2 35.247 22.297 9.248 16 HZ PHE 2 HZ PHE 2 37.504 21.408 9.810 17 H CYS 3 H CYS 3 32.317 23.068 16.321 18 HA CYS 3 HA CYS 3 29.863 21.555 16.787 19 HB2 CYS 3 HB2 CYS 3 29.751 22.718 18.871 20 HB3 CYS 3 HB3 CYS 3 31.409 22.222 18.607 21 H ASN 4 H ASN 4 27.764 22.308 16.721 22 HA ASN 4 HA ASN 4 27.279 24.813 15.138 23 HB2 ASN 4 HB2 ASN 4 25.568 22.306 15.255 24 HB3 ASN 4 HB3 ASN 4 25.381 23.694 14.176 25 HD21 ASN 4 HD21 ASN 4 28.317 22.661 12.205 26 HD22 ASN 4 HD22 ASN 4 27.626 24.143 12.874 27 H LEU 5 H LEU 5 27.432 25.976 17.187 28 HA LEU 5 HA LEU 5 25.974 25.274 19.486 29 HB2 LEU 5 HB2 LEU 5 27.946 26.717 19.495 30 HB3 LEU 5 HB3 LEU 5 27.078 27.960 18.600 31 HG LEU 5 HG LEU 5 25.534 28.290 20.525 32 HD11 LEU 5 HD11 LEU 5 27.344 26.282 21.924 33 HD12 LEU 5 HD12 LEU 5 26.142 27.314 22.729 34 HD13 LEU 5 HD13 LEU 5 25.606 26.078 21.591 35 HD21 LEU 5 HD21 LEU 5 27.583 29.651 20.308 36 HD22 LEU 5 HD22 LEU 5 27.163 29.372 22.006 37 HD23 LEU 5 HD23 LEU 5 28.486 28.450 21.256 38 H ARG 6 H ARG 6 24.923 27.586 16.877 39 HA ARG 6 HA ARG 6 22.545 28.385 18.316 40 HB2 ARG 6 HB2 ARG 6 23.693 29.741 16.624 41 HB3 ARG 6 HB3 ARG 6 23.344 28.522 15.391 42 HG2 ARG 6 HG2 ARG 6 20.929 28.993 15.576 43 HG3 ARG 6 HG3 ARG 6 21.234 30.132 16.900 44 HD2 ARG 6 HD2 ARG 6 20.907 31.277 14.731 45 HD3 ARG 6 HD3 ARG 6 22.477 31.608 15.465 46 HE ARG 6 HE ARG 6 22.171 29.482 13.360 47 HH11 ARG 6 HH11 ARG 6 24.021 32.283 14.460 48 HH12 ARG 6 HH12 ARG 6 24.895 32.339 12.943 49 HH21 ARG 6 HH21 ARG 6 23.401 29.492 11.682 50 HH22 ARG 6 HH22 ARG 6 24.800 30.566 11.570 51 H ARG 7 H ARG 7 23.170 25.914 15.814 52 HA ARG 7 HA ARG 7 20.448 24.885 15.651 53 HB2 ARG 7 HB2 ARG 7 23.158 23.573 15.140 54 HB3 ARG 7 HB3 ARG 7 21.624 22.805 14.817 55 HG2 ARG 7 HG2 ARG 7 22.731 25.265 13.429 56 HG3 ARG 7 HG3 ARG 7 22.562 23.644 12.757 57 HD2 ARG 7 HD2 ARG 7 20.331 25.562 13.509 58 HD3 ARG 7 HD3 ARG 7 20.837 25.108 11.881 59 HE ARG 7 HE ARG 7 20.127 22.679 12.990 60 HH11 ARG 7 HH11 ARG 7 18.467 25.689 12.271 61 HH12 ARG 7 HH12 ARG 7 16.885 24.939 12.448 62 HH21 ARG 7 HH21 ARG 7 18.033 21.796 13.121 63 HH22 ARG 7 HH22 ARG 7 16.735 22.751 12.466 64 H CYS 8 H CYS 8 23.092 24.223 17.881 65 HA CYS 8 HA CYS 8 21.804 21.991 19.213 66 HB2 CYS 8 HB2 CYS 8 24.217 22.306 19.112 67 HB3 CYS 8 HB3 CYS 8 24.078 23.867 19.906 68 H GLU 9 H GLU 9 22.259 25.458 20.115 69 HA GLU 9 HA GLU 9 20.914 25.536 22.547 70 HB2 GLU 9 HB2 GLU 9 21.356 27.506 20.299 71 HB3 GLU 9 HB3 GLU 9 20.356 27.992 21.665 72 HG2 GLU 9 HG2 GLU 9 23.087 26.813 22.216 73 HG3 GLU 9 HG3 GLU 9 22.949 28.468 21.631 74 H LEU 10 H LEU 10 19.405 25.982 19.301 75 HA LEU 10 HA LEU 10 16.770 26.410 20.382 76 HB2 LEU 10 HB2 LEU 10 15.984 26.330 18.129 77 HB3 LEU 10 HB3 LEU 10 17.485 27.213 18.199 78 HG LEU 10 HG LEU 10 18.557 24.917 17.445 79 HD11 LEU 10 HD11 LEU 10 17.104 23.663 15.873 80 HD12 LEU 10 HD12 LEU 10 16.479 23.525 17.510 81 HD13 LEU 10 HD13 LEU 10 15.706 24.642 16.371 82 HD21 LEU 10 HD21 LEU 10 18.592 26.972 16.114 83 HD22 LEU 10 HD22 LEU 10 18.248 25.581 15.085 84 HD23 LEU 10 HD23 LEU 10 16.931 26.671 15.563 85 H SER 11 H SER 11 18.566 23.492 19.896 86 HA SER 11 HA SER 11 16.186 21.748 20.068 87 HB2 SER 11 HB2 SER 11 18.191 21.199 18.622 88 HB3 SER 11 HB3 SER 11 19.110 20.935 20.121 89 HG SER 11 HG SER 11 16.828 19.597 19.117 90 H CYS 12 H CYS 12 18.959 22.759 22.160 91 HA CYS 12 HA CYS 12 18.201 21.172 24.422 92 HB2 CYS 12 HB2 CYS 12 19.591 23.872 24.391 93 HB3 CYS 12 HB3 CYS 12 19.577 22.718 25.713 94 H ARG 13 H ARG 13 17.032 24.336 23.280 95 HA ARG 13 HA ARG 13 15.292 24.995 25.426 96 HB2 ARG 13 HB2 ARG 13 15.983 26.367 23.354 97 HB3 ARG 13 HB3 ARG 13 14.737 25.486 22.466 98 HG2 ARG 13 HG2 ARG 13 13.030 26.366 24.078 99 HG3 ARG 13 HG3 ARG 13 14.293 27.263 24.916 100 HD2 ARG 13 HD2 ARG 13 13.564 27.654 21.973 101 HD3 ARG 13 HD3 ARG 13 12.868 28.581 23.304 102 HE ARG 13 HE ARG 13 15.811 28.626 23.160 103 HH11 ARG 13 HH11 ARG 13 12.885 30.421 22.209 104 HH12 ARG 13 HH12 ARG 13 13.824 31.875 22.017 105 HH21 ARG 13 HH21 ARG 13 16.827 30.522 22.889 106 HH22 ARG 13 HH22 ARG 13 15.944 31.936 22.336 107 H SER 14 H SER 14 14.920 22.433 23.055 108 HA SER 14 HA SER 14 12.103 21.897 23.480 109 HB2 SER 14 HB2 SER 14 13.634 21.094 21.561 110 HB3 SER 14 HB3 SER 14 14.222 19.871 22.703 111 HG SER 14 HG SER 14 11.777 20.192 21.465 112 H LEU 15 H LEU 15 14.922 21.273 25.402 113 HA LEU 15 HA LEU 15 13.536 19.238 27.088 114 HB2 LEU 15 HB2 LEU 15 16.454 20.064 27.050 115 HB3 LEU 15 HB3 LEU 15 15.751 18.703 27.920 116 HG LEU 15 HG LEU 15 15.974 18.969 24.894 117 HD11 LEU 15 HD11 LEU 15 18.129 18.597 26.035 118 HD12 LEU 15 HD12 LEU 15 17.449 17.175 26.864 119 HD13 LEU 15 HD13 LEU 15 17.633 17.180 25.097 120 HD21 LEU 15 HD21 LEU 15 13.998 17.618 25.477 121 HD22 LEU 15 HD22 LEU 15 15.288 16.565 24.890 122 HD23 LEU 15 HD23 LEU 15 14.966 16.662 26.629 123 H GLY 16 H GLY 16 14.514 22.571 27.082 124 HA2 GLY 16 HA2 GLY 16 13.933 24.190 28.686 125 HA3 GLY 16 HA3 GLY 16 13.606 22.940 29.881 126 H LEU 17 H LEU 17 16.637 22.970 28.054 127 HA LEU 17 HA LEU 17 18.143 24.300 30.239 128 HB2 LEU 17 HB2 LEU 17 19.909 22.443 29.754 129 HB3 LEU 17 HB3 LEU 17 18.725 22.287 31.026 130 HG LEU 17 HG LEU 17 18.143 21.040 28.336 131 HD11 LEU 17 HD11 LEU 17 19.825 19.778 30.541 132 HD12 LEU 17 HD12 LEU 17 19.312 19.027 29.008 133 HD13 LEU 17 HD13 LEU 17 20.452 20.380 29.003 134 HD21 LEU 17 HD21 LEU 17 17.035 19.330 29.782 135 HD22 LEU 17 HD22 LEU 17 17.576 20.182 31.234 136 HD23 LEU 17 HD23 LEU 17 16.392 20.929 30.167 137 H LEU 18 H LEU 18 20.430 24.790 29.463 138 HA LEU 18 HA LEU 18 20.140 26.146 26.842 139 HB2 LEU 18 HB2 LEU 18 22.188 26.393 29.098 140 HB3 LEU 18 HB3 LEU 18 22.230 27.300 27.597 141 HG LEU 18 HG LEU 18 21.374 28.767 29.143 142 HD11 LEU 18 HD11 LEU 18 19.201 29.386 28.357 143 HD12 LEU 18 HD12 LEU 18 20.139 28.744 26.994 144 HD13 LEU 18 HD13 LEU 18 18.878 27.756 27.772 145 HD21 LEU 18 HD21 LEU 18 19.590 28.487 30.686 146 HD22 LEU 18 HD22 LEU 18 19.180 26.889 30.060 147 HD23 LEU 18 HD23 LEU 18 20.719 27.146 30.927 148 H GLY 19 H GLY 19 22.031 26.219 25.386 149 HA2 GLY 19 HA2 GLY 19 23.435 23.559 25.202 150 HA3 GLY 19 HA3 GLY 19 23.062 24.608 23.846 151 H LYS 20 H LYS 20 25.648 23.473 25.295 152 HA LYS 20 HA LYS 20 27.242 25.932 24.690 153 HB2 LYS 20 HB2 LYS 20 27.650 23.886 26.879 154 HB3 LYS 20 HB3 LYS 20 28.868 25.056 26.342 155 HG2 LYS 20 HG2 LYS 20 27.250 26.932 26.821 156 HG3 LYS 20 HG3 LYS 20 26.131 25.725 27.527 157 HD2 LYS 20 HD2 LYS 20 27.887 24.966 29.030 158 HD3 LYS 20 HD3 LYS 20 29.013 26.153 28.316 159 HE2 LYS 20 HE2 LYS 20 27.444 27.993 29.011 160 HE3 LYS 20 HE3 LYS 20 26.447 26.792 29.862 161 HZ1 LYS 20 HZ1 LYS 20 28.006 27.938 31.326 162 HZ2 LYS 20 HZ2 LYS 20 28.374 26.339 31.296 163 HZ3 LYS 20 HZ3 LYS 20 29.290 27.372 30.441 164 H CYS 21 H CYS 21 29.120 25.692 23.663 165 HA CYS 21 HA CYS 21 29.497 23.262 22.006 166 HB2 CYS 21 HB2 CYS 21 29.681 25.375 20.895 167 HB3 CYS 21 HB3 CYS 21 30.834 25.969 22.083 168 H ILE 22 H ILE 22 30.914 21.709 22.390 169 HA ILE 22 HA ILE 22 32.770 21.765 24.698 170 HB ILE 22 HB ILE 22 32.177 19.580 22.667 171 HG12 ILE 22 HG12 ILE 22 30.095 20.017 23.804 172 HG13 ILE 22 HG13 ILE 22 30.765 18.505 24.372 173 HG21 ILE 22 HG21 ILE 22 33.579 19.458 25.373 174 HG22 ILE 22 HG22 ILE 22 33.116 18.056 24.385 175 HG23 ILE 22 HG23 ILE 22 34.308 19.201 23.777 176 HD11 ILE 22 HD11 ILE 22 31.529 19.627 26.466 177 HD12 ILE 22 HD12 ILE 22 30.838 21.161 25.886 178 HD13 ILE 22 HD13 ILE 22 29.787 19.775 26.220 179 H GLY 23 H GLY 23 32.765 21.798 21.212 180 HA2 GLY 23 HA2 GLY 23 34.848 23.411 20.631 181 HA3 GLY 23 HA3 GLY 23 35.671 21.852 20.819 182 H GLU 24 H GLU 24 34.350 19.996 19.718 183 HA GLU 24 HA GLU 24 33.665 20.822 16.917 184 HB2 GLU 24 HB2 GLU 24 34.598 18.064 17.721 185 HB3 GLU 24 HB3 GLU 24 34.577 18.807 16.123 186 HG2 GLU 24 HG2 GLU 24 36.496 19.268 18.411 187 HG3 GLU 24 HG3 GLU 24 36.849 18.699 16.786 188 H ALA 25 H ALA 25 32.333 19.651 19.728 189 HA ALA 25 HA ALA 25 29.782 19.044 18.348 190 HB1 ALA 25 HB1 ALA 25 30.985 17.447 20.658 191 HB2 ALA 25 HB2 ALA 25 29.370 17.216 19.955 192 HB3 ALA 25 HB3 ALA 25 30.812 16.882 18.979 193 H CYS 26 H CYS 26 27.989 19.076 20.115 194 HA CYS 26 HA CYS 26 28.455 21.211 22.143 195 HB2 CYS 26 HB2 CYS 26 27.422 22.138 20.108 196 HB3 CYS 26 HB3 CYS 26 26.144 20.936 20.197 197 H LYS 27 H LYS 27 26.920 21.168 23.935 198 HA LYS 27 HA LYS 27 25.291 18.728 24.260 199 HB2 LYS 27 HB2 LYS 27 27.678 18.279 25.052 200 HB3 LYS 27 HB3 LYS 27 27.332 19.362 26.405 201 HG2 LYS 27 HG2 LYS 27 25.594 17.910 27.232 202 HG3 LYS 27 HG3 LYS 27 25.500 17.025 25.693 203 HD2 LYS 27 HD2 LYS 27 27.783 16.167 26.023 204 HD3 LYS 27 HD3 LYS 27 27.867 16.995 27.593 205 HE2 LYS 27 HE2 LYS 27 25.972 15.670 28.422 206 HE3 LYS 27 HE3 LYS 27 25.786 14.879 26.845 207 HZ1 LYS 27 HZ1 LYS 27 28.305 14.688 28.378 208 HZ2 LYS 27 HZ2 LYS 27 27.060 13.645 28.624 209 HZ3 LYS 27 HZ3 LYS 27 27.811 13.745 27.145 210 H CYS 28 H CYS 28 23.649 18.925 25.823 211 HA CYS 28 HA CYS 28 22.956 21.708 26.424 212 HB2 CYS 28 HB2 CYS 28 21.294 19.228 26.866 213 HB3 CYS 28 HB3 CYS 28 20.749 20.906 26.899 214 H VAL 29 H VAL 29 22.743 22.605 28.448 215 HA VAL 29 HA VAL 29 23.251 20.967 30.854 216 HB VAL 29 HB VAL 29 24.938 22.376 31.720 217 HG11 VAL 29 HG11 VAL 29 25.773 21.708 28.868 218 HG12 VAL 29 HG12 VAL 29 26.810 21.875 30.292 219 HG13 VAL 29 HG13 VAL 29 25.665 20.539 30.200 220 HG21 VAL 29 HG21 VAL 29 26.042 24.168 30.403 221 HG22 VAL 29 HG22 VAL 29 24.763 24.043 29.174 222 HG23 VAL 29 HG23 VAL 29 24.386 24.578 30.827 223 HA PRO 30 HA PRO 30 19.947 23.524 32.378 224 HB2 PRO 30 HB2 PRO 30 21.031 23.016 35.142 225 HB3 PRO 30 HB3 PRO 30 19.391 22.708 34.512 226 HG2 PRO 30 HG2 PRO 30 21.102 20.668 34.881 227 HG3 PRO 30 HG3 PRO 30 20.131 20.728 33.373 228 HD2 PRO 30 HD2 PRO 30 23.003 21.650 33.785 229 HD3 PRO 30 HD3 PRO 30 22.311 20.581 32.539 230 H TYR 31 H TYR 31 23.077 24.621 32.882 231 HA TYR 31 HA TYR 31 22.700 26.461 35.047 232 HB2 TYR 31 HB2 TYR 31 25.065 26.232 33.178 233 HB3 TYR 31 HB3 TYR 31 25.053 26.844 34.825 234 HD1 TYR 31 HD1 TYR 31 23.875 24.971 36.542 235 HD2 TYR 31 HD2 TYR 31 26.085 24.155 32.941 236 HE1 TYR 31 HE1 TYR 31 24.433 22.695 37.400 237 HE2 TYR 31 HE2 TYR 31 26.615 21.865 33.780 238 HH TYR 31 HH TYR 31 26.425 20.394 35.502 Start of MODEL 13 1 H1 ALA 1 H1 ALA 1 36.909 23.504 14.946 2 H2 ALA 1 H2 ALA 1 37.863 23.796 16.234 3 H3 ALA 1 H3 ALA 1 37.467 25.053 15.240 4 HA ALA 1 HA ALA 1 35.623 23.480 16.876 5 HB1 ALA 1 HB1 ALA 1 36.668 26.301 17.360 6 HB2 ALA 1 HB2 ALA 1 35.395 25.492 18.305 7 HB3 ALA 1 HB3 ALA 1 37.045 24.849 18.315 8 H PHE 2 H PHE 2 34.444 23.196 14.834 9 HA PHE 2 HA PHE 2 32.933 25.616 13.955 10 HB2 PHE 2 HB2 PHE 2 33.499 23.103 12.381 11 HB3 PHE 2 HB3 PHE 2 32.768 24.583 11.791 12 HD1 PHE 2 HD1 PHE 2 35.858 22.791 12.325 13 HD2 PHE 2 HD2 PHE 2 34.214 26.745 11.837 14 HE1 PHE 2 HE1 PHE 2 38.105 23.648 11.697 15 HE2 PHE 2 HE2 PHE 2 36.461 27.603 11.206 16 HZ PHE 2 HZ PHE 2 38.403 26.046 11.099 17 H CYS 3 H CYS 3 32.124 24.197 16.284 18 HA CYS 3 HA CYS 3 29.963 22.414 15.883 19 HB2 CYS 3 HB2 CYS 3 29.375 23.102 18.224 20 HB3 CYS 3 HB3 CYS 3 31.048 22.617 17.998 21 H ASN 4 H ASN 4 27.762 22.660 15.922 22 HA ASN 4 HA ASN 4 26.681 25.141 14.725 23 HB2 ASN 4 HB2 ASN 4 25.359 22.444 15.180 24 HB3 ASN 4 HB3 ASN 4 24.777 23.750 14.142 25 HD21 ASN 4 HD21 ASN 4 27.548 23.108 11.759 26 HD22 ASN 4 HD22 ASN 4 26.747 24.495 12.485 27 H LEU 5 H LEU 5 27.073 26.312 16.755 28 HA LEU 5 HA LEU 5 25.839 25.538 19.195 29 HB2 LEU 5 HB2 LEU 5 27.845 26.915 19.029 30 HB3 LEU 5 HB3 LEU 5 26.923 28.215 18.277 31 HG LEU 5 HG LEU 5 25.660 28.584 20.358 32 HD11 LEU 5 HD11 LEU 5 25.616 26.322 21.336 33 HD12 LEU 5 HD12 LEU 5 27.388 26.344 21.517 34 HD13 LEU 5 HD13 LEU 5 26.369 27.448 22.460 35 HD21 LEU 5 HD21 LEU 5 27.533 29.426 21.708 36 HD22 LEU 5 HD22 LEU 5 28.673 28.407 20.810 37 HD23 LEU 5 HD23 LEU 5 27.823 29.736 19.991 38 H ARG 6 H ARG 6 24.541 27.593 16.582 39 HA ARG 6 HA ARG 6 22.241 28.546 18.140 40 HB2 ARG 6 HB2 ARG 6 23.163 28.696 15.284 41 HB3 ARG 6 HB3 ARG 6 21.433 28.742 15.522 42 HG2 ARG 6 HG2 ARG 6 22.529 30.987 15.401 43 HG3 ARG 6 HG3 ARG 6 21.491 30.712 16.795 44 HD2 ARG 6 HD2 ARG 6 23.473 31.966 17.420 45 HD3 ARG 6 HD3 ARG 6 23.407 30.418 18.263 46 HE ARG 6 HE ARG 6 24.994 29.980 15.976 47 HH11 ARG 6 HH11 ARG 6 25.195 31.892 18.906 48 HH12 ARG 6 HH12 ARG 6 26.934 31.924 18.906 49 HH21 ARG 6 HH21 ARG 6 27.150 29.947 16.037 50 HH22 ARG 6 HH22 ARG 6 28.045 30.865 17.248 51 H ARG 7 H ARG 7 22.704 25.857 15.868 52 HA ARG 7 HA ARG 7 20.081 24.701 16.106 53 HB2 ARG 7 HB2 ARG 7 21.853 24.111 14.403 54 HB3 ARG 7 HB3 ARG 7 22.764 23.312 15.687 55 HG2 ARG 7 HG2 ARG 7 20.679 21.813 16.042 56 HG3 ARG 7 HG3 ARG 7 20.045 22.543 14.562 57 HD2 ARG 7 HD2 ARG 7 21.083 20.523 13.882 58 HD3 ARG 7 HD3 ARG 7 22.219 21.807 13.427 59 HE ARG 7 HE ARG 7 22.727 20.669 16.086 60 HH11 ARG 7 HH11 ARG 7 23.307 19.904 12.698 61 HH12 ARG 7 HH12 ARG 7 24.650 18.847 13.145 62 HH21 ARG 7 HH21 ARG 7 24.487 19.447 16.474 63 HH22 ARG 7 HH22 ARG 7 25.272 18.605 15.142 64 H CYS 8 H CYS 8 23.052 24.226 18.017 65 HA CYS 8 HA CYS 8 22.004 22.219 19.761 66 HB2 CYS 8 HB2 CYS 8 24.382 22.700 19.347 67 HB3 CYS 8 HB3 CYS 8 24.217 24.251 20.168 68 H GLU 9 H GLU 9 22.275 25.804 20.253 69 HA GLU 9 HA GLU 9 21.018 25.933 22.770 70 HB2 GLU 9 HB2 GLU 9 21.306 27.852 20.446 71 HB3 GLU 9 HB3 GLU 9 20.363 28.325 21.844 72 HG2 GLU 9 HG2 GLU 9 23.194 27.284 22.223 73 HG3 GLU 9 HG3 GLU 9 22.890 28.952 21.725 74 H LEU 10 H LEU 10 19.391 25.984 19.532 75 HA LEU 10 HA LEU 10 16.775 26.268 20.835 76 HB2 LEU 10 HB2 LEU 10 15.820 26.367 18.717 77 HB3 LEU 10 HB3 LEU 10 17.338 27.226 18.618 78 HG LEU 10 HG LEU 10 18.222 24.898 17.661 79 HD11 LEU 10 HD11 LEU 10 16.077 23.624 17.921 80 HD12 LEU 10 HD12 LEU 10 15.266 24.826 16.903 81 HD13 LEU 10 HD13 LEU 10 16.541 23.789 16.233 82 HD21 LEU 10 HD21 LEU 10 17.675 25.689 15.383 83 HD22 LEU 10 HD22 LEU 10 16.522 26.849 16.091 84 HD23 LEU 10 HD23 LEU 10 18.264 26.982 16.423 85 H SER 11 H SER 11 18.713 23.522 19.701 86 HA SER 11 HA SER 11 16.596 21.571 19.906 87 HB2 SER 11 HB2 SER 11 18.732 21.305 18.610 88 HB3 SER 11 HB3 SER 11 19.593 21.122 20.154 89 HG SER 11 HG SER 11 17.621 19.507 18.932 90 H CYS 12 H CYS 12 19.186 22.595 22.195 91 HA CYS 12 HA CYS 12 18.320 20.944 24.373 92 HB2 CYS 12 HB2 CYS 12 19.806 23.589 24.448 93 HB3 CYS 12 HB3 CYS 12 19.651 22.438 25.780 94 H ARG 13 H ARG 13 17.226 24.178 23.260 95 HA ARG 13 HA ARG 13 15.582 24.686 25.550 96 HB2 ARG 13 HB2 ARG 13 16.256 26.310 23.727 97 HB3 ARG 13 HB3 ARG 13 14.978 25.622 22.717 98 HG2 ARG 13 HG2 ARG 13 13.267 26.242 24.346 99 HG3 ARG 13 HG3 ARG 13 14.485 26.691 25.542 100 HD2 ARG 13 HD2 ARG 13 13.962 28.111 22.910 101 HD3 ARG 13 HD3 ARG 13 13.486 28.661 24.529 102 HE ARG 13 HE ARG 13 16.293 28.228 24.552 103 HH11 ARG 13 HH11 ARG 13 14.017 30.526 23.194 104 HH12 ARG 13 HH12 ARG 13 15.263 31.695 22.846 105 HH21 ARG 13 HH21 ARG 13 17.841 29.703 24.019 106 HH22 ARG 13 HH22 ARG 13 17.356 31.257 23.339 107 H SER 14 H SER 14 15.011 22.610 22.732 108 HA SER 14 HA SER 14 12.229 22.053 23.411 109 HB2 SER 14 HB2 SER 14 13.354 21.644 21.165 110 HB3 SER 14 HB3 SER 14 14.109 20.215 21.906 111 HG SER 14 HG SER 14 12.312 19.325 21.253 112 H LEU 15 H LEU 15 15.229 21.096 24.800 113 HA LEU 15 HA LEU 15 14.019 18.981 26.502 114 HB2 LEU 15 HB2 LEU 15 16.884 19.925 26.564 115 HB3 LEU 15 HB3 LEU 15 16.209 18.425 27.156 116 HG LEU 15 HG LEU 15 16.576 19.166 24.231 117 HD11 LEU 15 HD11 LEU 15 18.392 17.641 24.256 118 HD12 LEU 15 HD12 LEU 15 18.626 18.708 25.643 119 HD13 LEU 15 HD13 LEU 15 18.000 17.071 25.903 120 HD21 LEU 15 HD21 LEU 15 14.681 17.630 24.416 121 HD22 LEU 15 HD22 LEU 15 16.118 16.733 23.853 122 HD23 LEU 15 HD23 LEU 15 15.589 16.590 25.536 123 H GLY 16 H GLY 16 14.185 22.297 26.562 124 HA2 GLY 16 HA2 GLY 16 13.619 23.790 28.208 125 HA3 GLY 16 HA3 GLY 16 13.751 22.531 29.431 126 H LEU 17 H LEU 17 16.713 22.786 27.622 127 HA LEU 17 HA LEU 17 17.873 24.517 29.769 128 HB2 LEU 17 HB2 LEU 17 19.834 22.638 28.866 129 HB3 LEU 17 HB3 LEU 17 19.270 22.986 30.488 130 HG LEU 17 HG LEU 17 17.985 21.007 28.606 131 HD11 LEU 17 HD11 LEU 17 19.920 20.513 30.912 132 HD12 LEU 17 HD12 LEU 17 19.137 19.273 29.906 133 HD13 LEU 17 HD13 LEU 17 20.313 20.378 29.193 134 HD21 LEU 17 HD21 LEU 17 16.466 21.677 30.524 135 HD22 LEU 17 HD22 LEU 17 17.043 20.032 30.748 136 HD23 LEU 17 HD23 LEU 17 17.780 21.365 31.658 137 H LEU 18 H LEU 18 20.223 25.052 29.244 138 HA LEU 18 HA LEU 18 20.364 26.520 26.664 139 HB2 LEU 18 HB2 LEU 18 22.174 26.331 29.103 140 HB3 LEU 18 HB3 LEU 18 22.727 27.030 27.603 141 HG LEU 18 HG LEU 18 22.165 28.757 29.069 142 HD11 LEU 18 HD11 LEU 18 19.971 28.683 26.972 143 HD12 LEU 18 HD12 LEU 18 20.657 30.111 27.771 144 HD13 LEU 18 HD13 LEU 18 21.666 29.142 26.690 145 HD21 LEU 18 HD21 LEU 18 19.297 27.766 29.205 146 HD22 LEU 18 HD22 LEU 18 20.513 27.614 30.499 147 HD23 LEU 18 HD23 LEU 18 19.977 29.214 29.974 148 H GLY 19 H GLY 19 22.151 26.225 25.232 149 HA2 GLY 19 HA2 GLY 19 23.378 23.465 25.218 150 HA3 GLY 19 HA3 GLY 19 23.010 24.383 23.761 151 H LYS 20 H LYS 20 25.585 23.328 25.281 152 HA LYS 20 HA LYS 20 27.228 25.757 24.715 153 HB2 LYS 20 HB2 LYS 20 28.495 25.585 26.647 154 HB3 LYS 20 HB3 LYS 20 26.821 25.493 27.149 155 HG2 LYS 20 HG2 LYS 20 27.543 23.760 28.420 156 HG3 LYS 20 HG3 LYS 20 27.336 22.819 26.950 157 HD2 LYS 20 HD2 LYS 20 29.497 22.236 27.665 158 HD3 LYS 20 HD3 LYS 20 29.825 23.495 26.466 159 HE2 LYS 20 HE2 LYS 20 29.949 25.198 28.299 160 HE3 LYS 20 HE3 LYS 20 29.637 23.897 29.490 161 HZ1 LYS 20 HZ1 LYS 20 31.995 24.468 29.285 162 HZ2 LYS 20 HZ2 LYS 20 31.731 22.876 28.795 163 HZ3 LYS 20 HZ3 LYS 20 31.982 24.025 27.700 164 H CYS 21 H CYS 21 28.955 25.537 23.535 165 HA CYS 21 HA CYS 21 29.235 23.071 22.004 166 HB2 CYS 21 HB2 CYS 21 29.350 25.137 20.864 167 HB3 CYS 21 HB3 CYS 21 30.553 25.796 21.971 168 H ILE 22 H ILE 22 30.902 21.615 21.940 169 HA ILE 22 HA ILE 22 32.934 21.627 24.133 170 HB ILE 22 HB ILE 22 32.217 19.493 22.104 171 HG12 ILE 22 HG12 ILE 22 30.304 19.747 23.549 172 HG13 ILE 22 HG13 ILE 22 31.151 18.275 23.967 173 HG21 ILE 22 HG21 ILE 22 33.495 17.981 23.613 174 HG22 ILE 22 HG22 ILE 22 34.503 19.213 22.839 175 HG23 ILE 22 HG23 ILE 22 34.026 19.398 24.537 176 HD11 ILE 22 HD11 ILE 22 31.273 20.891 25.535 177 HD12 ILE 22 HD12 ILE 22 30.382 19.434 25.976 178 HD13 ILE 22 HD13 ILE 22 32.154 19.402 25.959 179 H GLY 23 H GLY 23 32.679 21.399 20.599 180 HA2 GLY 23 HA2 GLY 23 34.607 23.338 19.998 181 HA3 GLY 23 HA3 GLY 23 35.448 21.774 19.916 182 H GLU 24 H GLU 24 33.782 20.059 18.920 183 HA GLU 24 HA GLU 24 32.458 21.149 16.447 184 HB2 GLU 24 HB2 GLU 24 33.630 18.383 16.872 185 HB3 GLU 24 HB3 GLU 24 32.892 19.001 15.398 186 HG2 GLU 24 HG2 GLU 24 35.518 19.944 16.648 187 HG3 GLU 24 HG3 GLU 24 35.337 18.937 15.217 188 H ALA 25 H ALA 25 32.373 18.725 19.067 189 HA ALA 25 HA ALA 25 29.543 18.093 18.752 190 HB1 ALA 25 HB1 ALA 25 29.945 16.873 20.885 191 HB2 ALA 25 HB2 ALA 25 31.139 16.466 19.645 192 HB3 ALA 25 HB3 ALA 25 31.575 17.564 20.969 193 H CYS 26 H CYS 26 28.005 18.463 20.606 194 HA CYS 26 HA CYS 26 28.468 20.825 22.291 195 HB2 CYS 26 HB2 CYS 26 27.695 21.707 20.084 196 HB3 CYS 26 HB3 CYS 26 26.191 20.816 20.280 197 H LYS 27 H LYS 27 27.082 20.986 24.087 198 HA LYS 27 HA LYS 27 25.318 18.618 24.646 199 HB2 LYS 27 HB2 LYS 27 27.690 19.561 26.240 200 HB3 LYS 27 HB3 LYS 27 26.365 18.609 26.926 201 HG2 LYS 27 HG2 LYS 27 26.712 16.867 25.134 202 HG3 LYS 27 HG3 LYS 27 28.164 17.758 24.610 203 HD2 LYS 27 HD2 LYS 27 29.122 17.549 26.853 204 HD3 LYS 27 HD3 LYS 27 27.659 16.745 27.427 205 HE2 LYS 27 HE2 LYS 27 29.390 15.622 25.178 206 HE3 LYS 27 HE3 LYS 27 29.709 15.288 26.882 207 HZ1 LYS 27 HZ1 LYS 27 27.454 14.374 27.056 208 HZ2 LYS 27 HZ2 LYS 27 27.238 14.529 25.425 209 HZ3 LYS 27 HZ3 LYS 27 28.409 13.537 26.005 210 H CYS 28 H CYS 28 23.663 18.902 26.056 211 HA CYS 28 HA CYS 28 22.837 21.667 26.547 212 HB2 CYS 28 HB2 CYS 28 21.378 19.086 27.162 213 HB3 CYS 28 HB3 CYS 28 20.695 20.718 27.081 214 H VAL 29 H VAL 29 22.434 22.642 28.562 215 HA VAL 29 HA VAL 29 23.414 21.231 30.989 216 HB VAL 29 HB VAL 29 24.849 23.228 31.512 217 HG11 VAL 29 HG11 VAL 29 25.754 21.045 30.726 218 HG12 VAL 29 HG12 VAL 29 25.740 21.676 29.062 219 HG13 VAL 29 HG13 VAL 29 26.753 22.443 30.304 220 HG21 VAL 29 HG21 VAL 29 23.948 24.845 29.884 221 HG22 VAL 29 HG22 VAL 29 25.675 24.585 29.644 222 HG23 VAL 29 HG23 VAL 29 24.526 23.835 28.535 223 HA PRO 30 HA PRO 30 20.361 23.680 33.105 224 HB2 PRO 30 HB2 PRO 30 20.738 22.960 35.621 225 HB3 PRO 30 HB3 PRO 30 20.308 21.778 34.347 226 HG2 PRO 30 HG2 PRO 30 23.073 22.386 35.429 227 HG3 PRO 30 HG3 PRO 30 22.288 20.782 35.268 228 HD2 PRO 30 HD2 PRO 30 23.976 21.847 33.345 229 HD3 PRO 30 HD3 PRO 30 22.621 20.747 32.954 230 H TYR 31 H TYR 31 22.278 25.265 32.246 231 HA TYR 31 HA TYR 31 23.299 27.126 34.288 232 HB2 TYR 31 HB2 TYR 31 22.924 27.428 31.288 233 HB3 TYR 31 HB3 TYR 31 23.682 28.616 32.327 234 HD1 TYR 31 HD1 TYR 31 24.896 25.641 33.720 235 HD2 TYR 31 HD2 TYR 31 25.235 28.091 30.176 236 HE1 TYR 31 HE1 TYR 31 27.089 24.641 33.240 237 HE2 TYR 31 HE2 TYR 31 27.487 27.112 29.740 238 HH TYR 31 HH TYR 31 28.935 24.673 31.920 Start of MODEL 14 1 H1 ALA 1 H1 ALA 1 35.837 21.001 13.142 2 H2 ALA 1 H2 ALA 1 34.610 21.376 12.093 3 H3 ALA 1 H3 ALA 1 34.751 19.861 12.724 4 HA ALA 1 HA ALA 1 34.295 20.653 14.924 5 HB1 ALA 1 HB1 ALA 1 33.515 22.986 15.218 6 HB2 ALA 1 HB2 ALA 1 35.227 22.845 14.763 7 HB3 ALA 1 HB3 ALA 1 34.015 23.336 13.547 8 H PHE 2 H PHE 2 32.788 19.017 14.480 9 HA PHE 2 HA PHE 2 30.355 19.491 13.007 10 HB2 PHE 2 HB2 PHE 2 31.019 17.367 15.059 11 HB3 PHE 2 HB3 PHE 2 29.623 17.342 13.993 12 HD1 PHE 2 HD1 PHE 2 33.050 16.352 14.343 13 HD2 PHE 2 HD2 PHE 2 30.016 17.320 11.443 14 HE1 PHE 2 HE1 PHE 2 34.266 15.033 12.608 15 HE2 PHE 2 HE2 PHE 2 31.247 16.025 9.726 16 HZ PHE 2 HZ PHE 2 33.373 14.877 10.307 17 H CYS 3 H CYS 3 30.661 21.651 14.975 18 HA CYS 3 HA CYS 3 27.989 21.431 16.192 19 HB2 CYS 3 HB2 CYS 3 29.670 20.644 17.877 20 HB3 CYS 3 HB3 CYS 3 30.354 22.265 17.893 21 H ASN 4 H ASN 4 26.858 23.209 16.224 22 HA ASN 4 HA ASN 4 28.067 25.897 15.829 23 HB2 ASN 4 HB2 ASN 4 25.831 24.496 14.348 24 HB3 ASN 4 HB3 ASN 4 25.741 26.223 14.563 25 HD21 ASN 4 HD21 ASN 4 29.141 25.693 12.479 26 HD22 ASN 4 HD22 ASN 4 29.074 25.255 14.183 27 H LEU 5 H LEU 5 27.483 27.307 17.320 28 HA LEU 5 HA LEU 5 26.286 26.348 19.664 29 HB2 LEU 5 HB2 LEU 5 28.059 28.032 19.528 30 HB3 LEU 5 HB3 LEU 5 26.932 29.196 18.829 31 HG LEU 5 HG LEU 5 25.627 29.233 20.927 32 HD11 LEU 5 HD11 LEU 5 26.578 28.150 22.973 33 HD12 LEU 5 HD12 LEU 5 25.962 26.982 21.805 34 HD13 LEU 5 HD13 LEU 5 27.719 27.264 21.938 35 HD21 LEU 5 HD21 LEU 5 28.626 29.581 21.338 36 HD22 LEU 5 HD22 LEU 5 27.522 30.785 20.629 37 HD23 LEU 5 HD23 LEU 5 27.348 30.317 22.327 38 H ARG 6 H ARG 6 24.766 28.678 17.315 39 HA ARG 6 HA ARG 6 22.389 29.027 18.974 40 HB2 ARG 6 HB2 ARG 6 22.753 29.496 15.983 41 HB3 ARG 6 HB3 ARG 6 21.450 30.121 17.007 42 HG2 ARG 6 HG2 ARG 6 23.199 31.333 18.354 43 HG3 ARG 6 HG3 ARG 6 24.409 30.855 17.158 44 HD2 ARG 6 HD2 ARG 6 21.939 32.560 16.652 45 HD3 ARG 6 HD3 ARG 6 23.598 33.147 16.753 46 HE ARG 6 HE ARG 6 22.323 31.725 14.506 47 HH11 ARG 6 HH11 ARG 6 25.521 32.804 15.690 48 HH12 ARG 6 HH12 ARG 6 26.074 32.870 14.019 49 HH21 ARG 6 HH21 ARG 6 23.194 32.041 12.550 50 HH22 ARG 6 HH22 ARG 6 24.910 32.429 12.403 51 H ARG 7 H ARG 7 23.248 26.918 16.300 52 HA ARG 7 HA ARG 7 20.836 25.415 15.998 53 HB2 ARG 7 HB2 ARG 7 23.782 24.915 15.471 54 HB3 ARG 7 HB3 ARG 7 22.672 23.585 15.361 55 HG2 ARG 7 HG2 ARG 7 21.285 25.167 13.760 56 HG3 ARG 7 HG3 ARG 7 22.788 26.090 13.671 57 HD2 ARG 7 HD2 ARG 7 22.730 24.533 11.817 58 HD3 ARG 7 HD3 ARG 7 23.979 23.997 12.954 59 HE ARG 7 HE ARG 7 21.370 22.771 13.438 60 HH11 ARG 7 HH11 ARG 7 24.364 22.282 11.578 61 HH12 ARG 7 HH12 ARG 7 23.905 20.619 11.241 62 HH21 ARG 7 HH21 ARG 7 21.079 20.610 13.137 63 HH22 ARG 7 HH22 ARG 7 22.184 19.702 12.146 64 H CYS 8 H CYS 8 23.487 25.031 18.331 65 HA CYS 8 HA CYS 8 22.409 22.621 19.530 66 HB2 CYS 8 HB2 CYS 8 24.797 23.212 19.500 67 HB3 CYS 8 HB3 CYS 8 24.478 24.635 20.478 68 H GLU 9 H GLU 9 22.322 26.116 20.508 69 HA GLU 9 HA GLU 9 20.877 25.770 22.910 70 HB2 GLU 9 HB2 GLU 9 21.102 28.065 20.931 71 HB3 GLU 9 HB3 GLU 9 20.059 28.174 22.348 72 HG2 GLU 9 HG2 GLU 9 22.072 27.513 23.764 73 HG3 GLU 9 HG3 GLU 9 23.073 27.795 22.335 74 H LEU 10 H LEU 10 19.494 26.056 19.601 75 HA LEU 10 HA LEU 10 16.770 25.902 20.655 76 HB2 LEU 10 HB2 LEU 10 16.034 26.017 18.402 77 HB3 LEU 10 HB3 LEU 10 17.318 27.170 18.673 78 HG LEU 10 HG LEU 10 18.860 25.302 17.610 79 HD11 LEU 10 HD11 LEU 10 17.180 23.502 17.382 80 HD12 LEU 10 HD12 LEU 10 16.115 24.592 16.467 81 HD13 LEU 10 HD13 LEU 10 17.664 24.068 15.792 82 HD21 LEU 10 HD21 LEU 10 16.915 26.946 15.945 83 HD22 LEU 10 HD22 LEU 10 18.442 27.528 16.643 84 HD23 LEU 10 HD23 LEU 10 18.470 26.287 15.394 85 H SER 11 H SER 11 19.113 23.473 20.080 86 HA SER 11 HA SER 11 17.156 21.280 19.755 87 HB2 SER 11 HB2 SER 11 19.379 21.242 18.649 88 HB3 SER 11 HB3 SER 11 20.159 21.193 20.247 89 HG SER 11 HG SER 11 19.738 19.154 20.364 90 H CYS 12 H CYS 12 19.212 22.660 22.304 91 HA CYS 12 HA CYS 12 18.483 20.791 24.384 92 HB2 CYS 12 HB2 CYS 12 19.663 23.592 24.474 93 HB3 CYS 12 HB3 CYS 12 19.521 22.516 25.865 94 H ARG 13 H ARG 13 17.003 23.701 23.138 95 HA ARG 13 HA ARG 13 15.180 24.413 25.163 96 HB2 ARG 13 HB2 ARG 13 15.679 25.475 22.893 97 HB3 ARG 13 HB3 ARG 13 14.635 24.255 22.163 98 HG2 ARG 13 HG2 ARG 13 12.734 25.072 23.530 99 HG3 ARG 13 HG3 ARG 13 13.777 26.287 24.284 100 HD2 ARG 13 HD2 ARG 13 13.134 26.041 21.322 101 HD3 ARG 13 HD3 ARG 13 12.388 27.195 22.431 102 HE ARG 13 HE ARG 13 15.108 27.729 22.670 103 HH11 ARG 13 HH11 ARG 13 12.887 27.682 19.937 104 HH12 ARG 13 HH12 ARG 13 13.816 28.916 19.098 105 HH21 ARG 13 HH21 ARG 13 16.205 29.279 21.496 106 HH22 ARG 13 HH22 ARG 13 15.718 29.636 19.866 107 H SER 14 H SER 14 15.101 21.592 23.024 108 HA SER 14 HA SER 14 12.366 20.824 23.661 109 HB2 SER 14 HB2 SER 14 14.667 19.091 22.719 110 HB3 SER 14 HB3 SER 14 12.932 18.715 22.625 111 HG SER 14 HG SER 14 13.846 19.523 20.714 112 H LEU 15 H LEU 15 15.321 20.529 25.411 113 HA LEU 15 HA LEU 15 14.176 18.645 27.415 114 HB2 LEU 15 HB2 LEU 15 16.939 19.908 27.236 115 HB3 LEU 15 HB3 LEU 15 16.439 18.637 28.336 116 HG LEU 15 HG LEU 15 16.687 18.397 25.298 117 HD11 LEU 15 HD11 LEU 15 18.362 17.181 27.522 118 HD12 LEU 15 HD12 LEU 15 18.589 16.961 25.774 119 HD13 LEU 15 HD13 LEU 15 18.841 18.553 26.501 120 HD21 LEU 15 HD21 LEU 15 16.007 16.275 27.379 121 HD22 LEU 15 HD22 LEU 15 14.920 16.882 26.109 122 HD23 LEU 15 HD23 LEU 15 16.365 15.969 25.667 123 H GLY 16 H GLY 16 14.687 21.996 26.765 124 HA2 GLY 16 HA2 GLY 16 13.541 23.738 27.887 125 HA3 GLY 16 HA3 GLY 16 13.578 22.832 29.396 126 H LEU 17 H LEU 17 16.612 22.684 27.910 127 HA LEU 17 HA LEU 17 17.698 24.782 29.767 128 HB2 LEU 17 HB2 LEU 17 19.759 22.980 29.120 129 HB3 LEU 17 HB3 LEU 17 19.032 23.326 30.668 130 HG LEU 17 HG LEU 17 18.064 21.183 28.777 131 HD11 LEU 17 HD11 LEU 17 19.268 19.595 30.178 132 HD12 LEU 17 HD12 LEU 17 20.406 20.798 29.571 133 HD13 LEU 17 HD13 LEU 17 19.838 20.899 31.241 134 HD21 LEU 17 HD21 LEU 17 16.999 20.199 30.803 135 HD22 LEU 17 HD22 LEU 17 17.589 21.556 31.792 136 HD23 LEU 17 HD23 LEU 17 16.364 21.822 30.550 137 H LEU 18 H LEU 18 20.017 25.364 29.052 138 HA LEU 18 HA LEU 18 19.926 26.287 26.212 139 HB2 LEU 18 HB2 LEU 18 21.749 27.013 28.530 140 HB3 LEU 18 HB3 LEU 18 22.009 27.575 26.876 141 HG LEU 18 HG LEU 18 19.537 28.146 28.535 142 HD11 LEU 18 HD11 LEU 18 21.862 29.929 27.695 143 HD12 LEU 18 HD12 LEU 18 20.448 30.406 28.665 144 HD13 LEU 18 HD13 LEU 18 21.605 29.240 29.316 145 HD21 LEU 18 HD21 LEU 18 20.354 29.112 25.766 146 HD22 LEU 18 HD22 LEU 18 18.888 28.196 26.197 147 HD23 LEU 18 HD23 LEU 18 19.077 29.858 26.746 148 H GLY 19 H GLY 19 22.044 26.253 25.112 149 HA2 GLY 19 HA2 GLY 19 23.373 23.574 25.352 150 HA3 GLY 19 HA3 GLY 19 22.875 24.234 23.800 151 H LYS 20 H LYS 20 25.514 23.443 24.878 152 HA LYS 20 HA LYS 20 27.013 25.806 23.908 153 HB2 LYS 20 HB2 LYS 20 28.723 25.631 25.542 154 HB3 LYS 20 HB3 LYS 20 27.178 25.885 26.336 155 HG2 LYS 20 HG2 LYS 20 28.102 24.313 27.734 156 HG3 LYS 20 HG3 LYS 20 27.235 23.246 26.637 157 HD2 LYS 20 HD2 LYS 20 29.405 22.283 26.847 158 HD3 LYS 20 HD3 LYS 20 29.395 23.107 25.285 159 HE2 LYS 20 HE2 LYS 20 31.485 23.617 26.203 160 HE3 LYS 20 HE3 LYS 20 30.523 25.082 26.358 161 HZ1 LYS 20 HZ1 LYS 20 31.055 23.131 28.542 162 HZ2 LYS 20 HZ2 LYS 20 31.733 24.615 28.385 163 HZ3 LYS 20 HZ3 LYS 20 30.145 24.490 28.714 164 H CYS 21 H CYS 21 29.022 25.315 22.908 165 HA CYS 21 HA CYS 21 29.032 22.577 21.705 166 HB2 CYS 21 HB2 CYS 21 30.097 25.231 20.757 167 HB3 CYS 21 HB3 CYS 21 30.690 23.716 20.095 168 H ILE 22 H ILE 22 30.761 21.316 21.690 169 HA ILE 22 HA ILE 22 33.331 22.211 22.909 170 HB ILE 22 HB ILE 22 32.224 19.416 23.312 171 HG12 ILE 22 HG12 ILE 22 32.217 21.803 25.215 172 HG13 ILE 22 HG13 ILE 22 30.802 20.955 24.569 173 HG21 ILE 22 HG21 ILE 22 34.563 20.881 24.640 174 HG22 ILE 22 HG22 ILE 22 34.125 19.168 24.833 175 HG23 ILE 22 HG23 ILE 22 34.755 19.743 23.301 176 HD11 ILE 22 HD11 ILE 22 32.803 19.890 26.568 177 HD12 ILE 22 HD12 ILE 22 31.079 20.225 26.799 178 HD13 ILE 22 HD13 ILE 22 31.584 18.882 25.743 179 H GLY 23 H GLY 23 33.117 22.746 20.594 180 HA2 GLY 23 HA2 GLY 23 33.909 22.711 18.450 181 HA3 GLY 23 HA3 GLY 23 34.981 21.420 18.983 182 H GLU 24 H GLU 24 33.734 19.267 19.231 183 HA GLU 24 HA GLU 24 32.489 18.642 16.594 184 HB2 GLU 24 HB2 GLU 24 33.811 16.696 18.500 185 HB3 GLU 24 HB3 GLU 24 33.457 16.484 16.791 186 HG2 GLU 24 HG2 GLU 24 35.611 18.223 18.055 187 HG3 GLU 24 HG3 GLU 24 35.828 16.821 17.024 188 H ALA 25 H ALA 25 31.509 19.030 19.780 189 HA ALA 25 HA ALA 25 29.080 17.369 19.377 190 HB1 ALA 25 HB1 ALA 25 29.273 16.526 21.676 191 HB2 ALA 25 HB2 ALA 25 30.671 16.043 20.696 192 HB3 ALA 25 HB3 ALA 25 30.826 17.374 21.866 193 H CYS 26 H CYS 26 27.214 18.117 20.247 194 HA CYS 26 HA CYS 26 27.131 20.813 21.545 195 HB2 CYS 26 HB2 CYS 26 25.713 20.717 19.620 196 HB3 CYS 26 HB3 CYS 26 25.148 19.102 20.030 197 H LYS 27 H LYS 27 26.520 20.976 23.662 198 HA LYS 27 HA LYS 27 25.243 18.649 25.045 199 HB2 LYS 27 HB2 LYS 27 27.716 20.087 26.074 200 HB3 LYS 27 HB3 LYS 27 26.747 18.879 26.927 201 HG2 LYS 27 HG2 LYS 27 27.245 17.311 24.911 202 HG3 LYS 27 HG3 LYS 27 28.531 18.472 24.501 203 HD2 LYS 27 HD2 LYS 27 29.455 18.157 26.818 204 HD3 LYS 27 HD3 LYS 27 28.140 17.000 27.124 205 HE2 LYS 27 HE2 LYS 27 28.963 15.600 25.215 206 HE3 LYS 27 HE3 LYS 27 30.335 16.709 25.022 207 HZ1 LYS 27 HZ1 LYS 27 29.739 15.157 27.479 208 HZ2 LYS 27 HZ2 LYS 27 30.910 14.791 26.361 209 HZ3 LYS 27 HZ3 LYS 27 31.034 16.154 27.262 210 H CYS 28 H CYS 28 23.833 19.169 26.688 211 HA CYS 28 HA CYS 28 23.081 22.015 26.782 212 HB2 CYS 28 HB2 CYS 28 21.505 19.630 27.728 213 HB3 CYS 28 HB3 CYS 28 20.915 21.268 27.433 214 H VAL 29 H VAL 29 22.468 23.137 28.676 215 HA VAL 29 HA VAL 29 23.751 22.192 31.189 216 HB VAL 29 HB VAL 29 24.816 24.364 31.490 217 HG11 VAL 29 HG11 VAL 29 26.064 22.451 30.536 218 HG12 VAL 29 HG12 VAL 29 25.687 23.037 28.897 219 HG13 VAL 29 HG13 VAL 29 26.677 24.019 29.994 220 HG21 VAL 29 HG21 VAL 29 24.031 24.958 28.606 221 HG22 VAL 29 HG22 VAL 29 23.451 25.824 30.048 222 HG23 VAL 29 HG23 VAL 29 25.157 25.900 29.598 223 HA PRO 30 HA PRO 30 20.085 23.570 33.108 224 HB2 PRO 30 HB2 PRO 30 20.737 23.384 35.738 225 HB3 PRO 30 HB3 PRO 30 20.782 21.964 34.646 226 HG2 PRO 30 HG2 PRO 30 23.096 23.772 35.448 227 HG3 PRO 30 HG3 PRO 30 23.007 21.983 35.581 228 HD2 PRO 30 HD2 PRO 30 24.154 23.188 33.435 229 HD3 PRO 30 HD3 PRO 30 23.167 21.706 33.250 230 H TYR 31 H TYR 31 22.299 25.809 32.729 231 HA TYR 31 HA TYR 31 21.705 27.695 34.904 232 HB2 TYR 31 HB2 TYR 31 23.463 28.106 32.477 233 HB3 TYR 31 HB3 TYR 31 23.451 29.056 33.957 234 HD1 TYR 31 HD1 TYR 31 23.698 27.471 36.209 235 HD2 TYR 31 HD2 TYR 31 25.227 26.582 32.269 236 HE1 TYR 31 HE1 TYR 31 25.304 25.859 37.200 237 HE2 TYR 31 HE2 TYR 31 26.847 24.963 33.274 238 HH TYR 31 HH TYR 31 27.190 24.536 36.785 Start of MODEL 15 1 H1 ALA 1 H1 ALA 1 36.875 26.139 16.980 2 H2 ALA 1 H2 ALA 1 36.891 26.646 18.522 3 H3 ALA 1 H3 ALA 1 36.053 27.522 17.401 4 HA ALA 1 HA ALA 1 35.473 24.776 18.267 5 HB1 ALA 1 HB1 ALA 1 34.008 27.351 18.987 6 HB2 ALA 1 HB2 ALA 1 33.501 25.700 19.422 7 HB3 ALA 1 HB3 ALA 1 35.008 26.367 20.077 8 H PHE 2 H PHE 2 35.218 23.969 16.192 9 HA PHE 2 HA PHE 2 33.617 25.185 14.130 10 HB2 PHE 2 HB2 PHE 2 34.374 22.262 14.338 11 HB3 PHE 2 HB3 PHE 2 34.054 23.185 12.880 12 HD1 PHE 2 HD1 PHE 2 36.548 21.441 14.101 13 HD2 PHE 2 HD2 PHE 2 35.793 25.585 13.195 14 HE1 PHE 2 HE1 PHE 2 38.980 21.829 13.858 15 HE2 PHE 2 HE2 PHE 2 38.233 25.979 12.993 16 HZ PHE 2 HZ PHE 2 39.836 24.104 13.320 17 H CYS 3 H CYS 3 32.075 24.876 16.611 18 HA CYS 3 HA CYS 3 30.223 22.648 16.248 19 HB2 CYS 3 HB2 CYS 3 29.412 23.291 18.442 20 HB3 CYS 3 HB3 CYS 3 31.161 23.131 18.461 21 H ASN 4 H ASN 4 27.944 22.857 16.251 22 HA ASN 4 HA ASN 4 26.948 25.209 14.733 23 HB2 ASN 4 HB2 ASN 4 25.631 22.531 15.150 24 HB3 ASN 4 HB3 ASN 4 25.133 23.807 14.034 25 HD21 ASN 4 HD21 ASN 4 27.857 21.137 12.808 26 HD22 ASN 4 HD22 ASN 4 26.771 20.906 14.183 27 H LEU 5 H LEU 5 27.165 26.437 16.868 28 HA LEU 5 HA LEU 5 25.920 25.693 19.226 29 HB2 LEU 5 HB2 LEU 5 27.653 27.393 19.060 30 HB3 LEU 5 HB3 LEU 5 26.551 28.477 18.209 31 HG LEU 5 HG LEU 5 25.129 28.647 20.237 32 HD11 LEU 5 HD11 LEU 5 27.280 26.966 21.594 33 HD12 LEU 5 HD12 LEU 5 25.959 27.821 22.413 34 HD13 LEU 5 HD13 LEU 5 25.586 26.479 21.333 35 HD21 LEU 5 HD21 LEU 5 26.952 30.256 19.843 36 HD22 LEU 5 HD22 LEU 5 26.672 29.983 21.571 37 HD23 LEU 5 HD23 LEU 5 28.064 29.220 20.769 38 H ARG 6 H ARG 6 24.325 27.828 16.738 39 HA ARG 6 HA ARG 6 21.958 28.101 18.423 40 HB2 ARG 6 HB2 ARG 6 22.532 29.825 16.842 41 HB3 ARG 6 HB3 ARG 6 22.463 28.710 15.494 42 HG2 ARG 6 HG2 ARG 6 20.559 30.320 15.696 43 HG3 ARG 6 HG3 ARG 6 20.119 28.638 15.488 44 HD2 ARG 6 HD2 ARG 6 18.721 30.043 17.066 45 HD3 ARG 6 HD3 ARG 6 19.206 28.441 17.606 46 HE ARG 6 HE ARG 6 21.163 30.199 18.623 47 HH11 ARG 6 HH11 ARG 6 17.689 29.781 19.057 48 HH12 ARG 6 HH12 ARG 6 17.782 30.149 20.756 49 HH21 ARG 6 HH21 ARG 6 21.203 30.715 20.696 50 HH22 ARG 6 HH22 ARG 6 19.702 30.895 21.605 51 H ARG 7 H ARG 7 22.843 25.887 15.819 52 HA ARG 7 HA ARG 7 20.337 24.484 15.583 53 HB2 ARG 7 HB2 ARG 7 22.498 24.395 14.115 54 HB3 ARG 7 HB3 ARG 7 23.080 23.205 15.277 55 HG2 ARG 7 HG2 ARG 7 20.964 21.866 14.811 56 HG3 ARG 7 HG3 ARG 7 20.598 23.019 13.518 57 HD2 ARG 7 HD2 ARG 7 23.052 21.207 13.731 58 HD3 ARG 7 HD3 ARG 7 21.665 20.979 12.661 59 HE ARG 7 HE ARG 7 22.785 23.532 12.095 60 HH11 ARG 7 HH11 ARG 7 23.477 20.135 11.528 61 HH12 ARG 7 HH12 ARG 7 24.409 20.502 10.095 62 HH21 ARG 7 HH21 ARG 7 24.117 23.908 10.397 63 HH22 ARG 7 HH22 ARG 7 25.048 22.598 9.709 64 H CYS 8 H CYS 8 23.020 24.157 17.837 65 HA CYS 8 HA CYS 8 21.986 21.914 19.341 66 HB2 CYS 8 HB2 CYS 8 24.345 22.460 19.166 67 HB3 CYS 8 HB3 CYS 8 24.071 24.041 19.856 68 H GLU 9 H GLU 9 22.170 25.458 20.187 69 HA GLU 9 HA GLU 9 20.720 25.329 22.595 70 HB2 GLU 9 HB2 GLU 9 21.075 27.513 20.524 71 HB3 GLU 9 HB3 GLU 9 20.149 27.789 21.982 72 HG2 GLU 9 HG2 GLU 9 22.872 26.635 22.426 73 HG3 GLU 9 HG3 GLU 9 22.828 28.249 21.732 74 H LEU 10 H LEU 10 19.321 25.807 19.270 75 HA LEU 10 HA LEU 10 16.662 26.112 20.285 76 HB2 LEU 10 HB2 LEU 10 15.905 26.038 18.051 77 HB3 LEU 10 HB3 LEU 10 17.420 26.899 18.099 78 HG LEU 10 HG LEU 10 18.471 24.611 17.332 79 HD11 LEU 10 HD11 LEU 10 16.501 23.140 17.489 80 HD12 LEU 10 HD12 LEU 10 15.570 24.248 16.456 81 HD13 LEU 10 HD13 LEU 10 16.947 23.349 15.803 82 HD21 LEU 10 HD21 LEU 10 16.723 26.290 15.481 83 HD22 LEU 10 HD22 LEU 10 18.386 26.673 15.971 84 HD23 LEU 10 HD23 LEU 10 18.070 25.251 14.974 85 H SER 11 H SER 11 18.553 23.248 19.968 86 HA SER 11 HA SER 11 16.232 21.408 20.220 87 HB2 SER 11 HB2 SER 11 18.144 20.618 18.927 88 HB3 SER 11 HB3 SER 11 19.232 20.887 20.300 89 HG SER 11 HG SER 11 18.684 19.005 20.992 90 H CYS 12 H CYS 12 18.996 22.618 22.227 91 HA CYS 12 HA CYS 12 18.252 21.239 24.588 92 HB2 CYS 12 HB2 CYS 12 19.673 23.913 24.355 93 HB3 CYS 12 HB3 CYS 12 19.719 22.802 25.731 94 H ARG 13 H ARG 13 17.112 24.399 23.370 95 HA ARG 13 HA ARG 13 15.384 25.022 25.539 96 HB2 ARG 13 HB2 ARG 13 16.171 26.449 23.558 97 HB3 ARG 13 HB3 ARG 13 14.927 25.686 22.604 98 HG2 ARG 13 HG2 ARG 13 14.316 27.936 23.492 99 HG3 ARG 13 HG3 ARG 13 13.172 26.681 23.961 100 HD2 ARG 13 HD2 ARG 13 13.759 28.347 25.775 101 HD3 ARG 13 HD3 ARG 13 13.962 26.650 26.212 102 HE ARG 13 HE ARG 13 16.382 27.984 25.173 103 HH11 ARG 13 HH11 ARG 13 14.666 27.509 28.227 104 HH12 ARG 13 HH12 ARG 13 16.195 27.300 29.067 105 HH21 ARG 13 HH21 ARG 13 18.203 27.650 26.434 106 HH22 ARG 13 HH22 ARG 13 17.992 27.582 28.192 107 H SER 14 H SER 14 14.930 22.569 23.089 108 HA SER 14 HA SER 14 12.045 22.219 23.492 109 HB2 SER 14 HB2 SER 14 13.216 21.361 21.483 110 HB3 SER 14 HB3 SER 14 14.118 20.229 22.508 111 HG SER 14 HG SER 14 12.547 18.945 22.332 112 H LEU 15 H LEU 15 15.022 21.006 25.012 113 HA LEU 15 HA LEU 15 13.618 19.287 26.931 114 HB2 LEU 15 HB2 LEU 15 16.514 20.198 26.947 115 HB3 LEU 15 HB3 LEU 15 15.819 18.811 27.778 116 HG LEU 15 HG LEU 15 16.133 19.109 24.756 117 HD11 LEU 15 HD11 LEU 15 18.263 18.805 25.954 118 HD12 LEU 15 HD12 LEU 15 17.613 17.354 26.751 119 HD13 LEU 15 HD13 LEU 15 17.845 17.383 24.991 120 HD21 LEU 15 HD21 LEU 15 15.529 16.704 24.677 121 HD22 LEU 15 HD22 LEU 15 15.165 16.736 26.414 122 HD23 LEU 15 HD23 LEU 15 14.186 17.686 25.271 123 H GLY 16 H GLY 16 14.893 22.574 26.906 124 HA2 GLY 16 HA2 GLY 16 13.959 24.282 28.352 125 HA3 GLY 16 HA3 GLY 16 13.736 23.086 29.627 126 H LEU 17 H LEU 17 16.791 23.126 27.850 127 HA LEU 17 HA LEU 17 18.131 24.579 30.057 128 HB2 LEU 17 HB2 LEU 17 19.967 22.715 29.630 129 HB3 LEU 17 HB3 LEU 17 18.786 22.618 30.903 130 HG LEU 17 HG LEU 17 18.289 21.280 28.224 131 HD11 LEU 17 HD11 LEU 17 19.802 20.084 30.594 132 HD12 LEU 17 HD12 LEU 17 19.358 19.259 29.080 133 HD13 LEU 17 HD13 LEU 17 20.525 20.582 29.060 134 HD21 LEU 17 HD21 LEU 17 17.485 20.572 31.109 135 HD22 LEU 17 HD22 LEU 17 16.400 21.244 29.891 136 HD23 LEU 17 HD23 LEU 17 17.067 19.630 29.666 137 H LEU 18 H LEU 18 20.415 25.117 29.597 138 HA LEU 18 HA LEU 18 20.650 26.522 27.049 139 HB2 LEU 18 HB2 LEU 18 22.410 26.122 29.491 140 HB3 LEU 18 HB3 LEU 18 23.028 26.944 28.069 141 HG LEU 18 HG LEU 18 20.439 27.852 29.368 142 HD11 LEU 18 HD11 LEU 18 23.274 28.728 30.079 143 HD12 LEU 18 HD12 LEU 18 21.786 29.564 30.579 144 HD13 LEU 18 HD13 LEU 18 22.098 27.920 31.143 145 HD21 LEU 18 HD21 LEU 18 21.008 28.694 27.101 146 HD22 LEU 18 HD22 LEU 18 21.001 29.982 28.311 147 HD23 LEU 18 HD23 LEU 18 22.546 29.321 27.724 148 H GLY 19 H GLY 19 22.291 26.245 25.499 149 HA2 GLY 19 HA2 GLY 19 23.570 23.523 25.336 150 HA3 GLY 19 HA3 GLY 19 23.092 24.473 23.931 151 H LYS 20 H LYS 20 25.782 23.448 25.232 152 HA LYS 20 HA LYS 20 27.338 25.872 24.508 153 HB2 LYS 20 HB2 LYS 20 28.671 25.910 26.471 154 HB3 LYS 20 HB3 LYS 20 26.979 26.033 26.909 155 HG2 LYS 20 HG2 LYS 20 27.586 24.520 28.488 156 HG3 LYS 20 HG3 LYS 20 27.204 23.372 27.211 157 HD2 LYS 20 HD2 LYS 20 29.254 22.613 27.938 158 HD3 LYS 20 HD3 LYS 20 29.758 23.638 26.581 159 HE2 LYS 20 HE2 LYS 20 30.406 25.436 28.073 160 HE3 LYS 20 HE3 LYS 20 29.588 24.670 29.445 161 HZ1 LYS 20 HZ1 LYS 20 31.984 24.306 29.568 162 HZ2 LYS 20 HZ2 LYS 20 31.203 22.869 29.343 163 HZ3 LYS 20 HZ3 LYS 20 32.000 23.584 28.107 164 H CYS 21 H CYS 21 29.457 25.559 23.828 165 HA CYS 21 HA CYS 21 29.652 23.027 22.368 166 HB2 CYS 21 HB2 CYS 21 31.282 25.567 22.206 167 HB3 CYS 21 HB3 CYS 21 31.533 24.130 21.209 168 H ILE 22 H ILE 22 31.207 21.537 22.410 169 HA ILE 22 HA ILE 22 33.098 21.442 24.719 170 HB ILE 22 HB ILE 22 32.312 19.270 22.758 171 HG12 ILE 22 HG12 ILE 22 30.295 19.817 23.968 172 HG13 ILE 22 HG13 ILE 22 30.930 18.288 24.537 173 HG21 ILE 22 HG21 ILE 22 34.468 18.867 23.808 174 HG22 ILE 22 HG22 ILE 22 33.794 19.149 25.419 175 HG23 ILE 22 HG23 ILE 22 33.276 17.745 24.462 176 HD11 ILE 22 HD11 ILE 22 31.192 20.952 26.009 177 HD12 ILE 22 HD12 ILE 22 30.065 19.644 26.390 178 HD13 ILE 22 HD13 ILE 22 31.803 19.383 26.589 179 H GLY 23 H GLY 23 32.950 21.502 21.214 180 HA2 GLY 23 HA2 GLY 23 35.145 23.107 20.762 181 HA3 GLY 23 HA3 GLY 23 35.812 21.461 20.701 182 H GLU 24 H GLU 24 34.169 19.923 19.507 183 HA GLU 24 HA GLU 24 33.329 21.149 16.878 184 HB2 GLU 24 HB2 GLU 24 34.041 18.268 17.575 185 HB3 GLU 24 HB3 GLU 24 33.431 18.827 16.011 186 HG2 GLU 24 HG2 GLU 24 35.408 20.278 15.744 187 HG3 GLU 24 HG3 GLU 24 36.046 19.715 17.292 188 H ALA 25 H ALA 25 32.394 18.894 19.486 189 HA ALA 25 HA ALA 25 29.585 18.809 18.616 190 HB1 ALA 25 HB1 ALA 25 29.329 17.363 20.616 191 HB2 ALA 25 HB2 ALA 25 30.628 16.801 19.560 192 HB3 ALA 25 HB3 ALA 25 31.021 17.674 21.059 193 H CYS 26 H CYS 26 27.864 19.406 20.062 194 HA CYS 26 HA CYS 26 28.460 21.333 22.237 195 HB2 CYS 26 HB2 CYS 26 27.852 22.695 20.357 196 HB3 CYS 26 HB3 CYS 26 26.469 21.676 19.972 197 H LYS 27 H LYS 27 27.162 21.158 24.018 198 HA LYS 27 HA LYS 27 25.277 18.820 24.141 199 HB2 LYS 27 HB2 LYS 27 27.531 19.492 26.053 200 HB3 LYS 27 HB3 LYS 27 26.196 18.369 26.389 201 HG2 LYS 27 HG2 LYS 27 26.856 17.100 24.263 202 HG3 LYS 27 HG3 LYS 27 28.323 18.075 24.228 203 HD2 LYS 27 HD2 LYS 27 28.897 17.299 26.509 204 HD3 LYS 27 HD3 LYS 27 27.367 16.375 26.550 205 HE2 LYS 27 HE2 LYS 27 28.141 14.958 24.688 206 HE3 LYS 27 HE3 LYS 27 29.646 15.876 24.575 207 HZ1 LYS 27 HZ1 LYS 27 30.251 15.147 26.759 208 HZ2 LYS 27 HZ2 LYS 27 28.806 14.390 26.996 209 HZ3 LYS 27 HZ3 LYS 27 29.888 13.818 25.876 210 H CYS 28 H CYS 28 23.562 18.996 25.528 211 HA CYS 28 HA CYS 28 22.848 21.710 26.373 212 HB2 CYS 28 HB2 CYS 28 21.274 19.157 26.744 213 HB3 CYS 28 HB3 CYS 28 20.681 20.814 26.850 214 H VAL 29 H VAL 29 22.747 22.468 28.486 215 HA VAL 29 HA VAL 29 23.564 20.649 30.696 216 HB VAL 29 HB VAL 29 25.157 22.316 31.525 217 HG11 VAL 29 HG11 VAL 29 25.911 20.394 30.162 218 HG12 VAL 29 HG12 VAL 29 25.852 21.401 28.700 219 HG13 VAL 29 HG13 VAL 29 26.970 21.797 30.021 220 HG21 VAL 29 HG21 VAL 29 26.039 24.079 30.080 221 HG22 VAL 29 HG22 VAL 29 24.845 23.714 28.814 222 HG23 VAL 29 HG23 VAL 29 24.344 24.372 30.384 223 HA PRO 30 HA PRO 30 20.425 22.944 32.813 224 HB2 PRO 30 HB2 PRO 30 20.538 21.916 35.270 225 HB3 PRO 30 HB3 PRO 30 20.243 20.897 33.826 226 HG2 PRO 30 HG2 PRO 30 22.898 21.365 35.210 227 HG3 PRO 30 HG3 PRO 30 22.130 19.772 34.857 228 HD2 PRO 30 HD2 PRO 30 23.967 20.933 33.173 229 HD3 PRO 30 HD3 PRO 30 22.582 19.987 32.561 230 H TYR 31 H TYR 31 22.571 24.540 32.414 231 HA TYR 31 HA TYR 31 23.478 25.902 34.874 232 HB2 TYR 31 HB2 TYR 31 23.828 26.627 31.953 233 HB3 TYR 31 HB3 TYR 31 24.516 27.524 33.296 234 HD1 TYR 31 HD1 TYR 31 26.483 27.188 31.708 235 HD2 TYR 31 HD2 TYR 31 24.823 24.007 34.095 236 HE1 TYR 31 HE1 TYR 31 28.576 25.881 31.431 237 HE2 TYR 31 HE2 TYR 31 26.894 22.687 33.767 238 HH TYR 31 HH TYR 31 28.820 22.499 32.423 Start of MODEL 16 1 H1 ALA 1 H1 ALA 1 36.909 26.977 14.815 2 H2 ALA 1 H2 ALA 1 35.336 27.519 14.759 3 H3 ALA 1 H3 ALA 1 35.979 26.679 13.500 4 HA ALA 1 HA ALA 1 36.228 24.716 14.800 5 HB1 ALA 1 HB1 ALA 1 35.263 24.589 17.055 6 HB2 ALA 1 HB2 ALA 1 36.538 25.818 17.005 7 HB3 ALA 1 HB3 ALA 1 34.832 26.309 16.997 8 H PHE 2 H PHE 2 34.735 23.229 14.191 9 HA PHE 2 HA PHE 2 32.355 24.226 12.866 10 HB2 PHE 2 HB2 PHE 2 33.709 21.528 13.046 11 HB3 PHE 2 HB3 PHE 2 32.201 21.753 12.180 12 HD1 PHE 2 HD1 PHE 2 32.023 23.041 10.145 13 HD2 PHE 2 HD2 PHE 2 35.812 22.619 12.154 14 HE1 PHE 2 HE1 PHE 2 33.191 23.901 8.130 15 HE2 PHE 2 HE2 PHE 2 36.979 23.469 10.134 16 HZ PHE 2 HZ PHE 2 35.665 24.120 8.129 17 H CYS 3 H CYS 3 32.109 24.485 15.726 18 HA CYS 3 HA CYS 3 30.058 22.630 16.689 19 HB2 CYS 3 HB2 CYS 3 31.542 23.868 18.241 20 HB3 CYS 3 HB3 CYS 3 30.910 25.395 17.620 21 H ASN 4 H ASN 4 27.844 22.893 16.530 22 HA ASN 4 HA ASN 4 26.823 25.237 14.966 23 HB2 ASN 4 HB2 ASN 4 25.458 22.520 15.133 24 HB3 ASN 4 HB3 ASN 4 25.050 23.903 14.160 25 HD21 ASN 4 HD21 ASN 4 27.995 23.352 11.991 26 HD22 ASN 4 HD22 ASN 4 27.194 24.696 12.821 27 H LEU 5 H LEU 5 26.952 26.423 16.948 28 HA LEU 5 HA LEU 5 25.710 25.500 19.322 29 HB2 LEU 5 HB2 LEU 5 27.611 27.038 19.259 30 HB3 LEU 5 HB3 LEU 5 26.609 28.291 18.553 31 HG LEU 5 HG LEU 5 25.231 28.393 20.602 32 HD11 LEU 5 HD11 LEU 5 27.165 26.294 21.675 33 HD12 LEU 5 HD12 LEU 5 26.029 27.247 22.659 34 HD13 LEU 5 HD13 LEU 5 25.405 26.115 21.466 35 HD21 LEU 5 HD21 LEU 5 26.927 29.390 22.058 36 HD22 LEU 5 HD22 LEU 5 28.221 28.557 21.165 37 HD23 LEU 5 HD23 LEU 5 27.243 29.814 20.373 38 H ARG 6 H ARG 6 24.410 27.852 16.891 39 HA ARG 6 HA ARG 6 21.951 28.343 18.291 40 HB2 ARG 6 HB2 ARG 6 22.641 28.390 15.328 41 HB3 ARG 6 HB3 ARG 6 21.032 28.787 15.947 42 HG2 ARG 6 HG2 ARG 6 22.049 30.570 17.377 43 HG3 ARG 6 HG3 ARG 6 23.598 30.292 16.577 44 HD2 ARG 6 HD2 ARG 6 20.995 31.122 15.230 45 HD3 ARG 6 HD3 ARG 6 22.340 32.203 15.615 46 HE ARG 6 HE ARG 6 23.466 30.202 14.011 47 HH11 ARG 6 HH11 ARG 6 20.922 32.651 13.489 48 HH12 ARG 6 HH12 ARG 6 21.390 32.754 11.794 49 HH21 ARG 6 HH21 ARG 6 23.640 30.294 11.741 50 HH22 ARG 6 HH22 ARG 6 22.737 31.562 10.920 51 H ARG 7 H ARG 7 22.645 25.777 15.856 52 HA ARG 7 HA ARG 7 20.051 24.542 16.024 53 HB2 ARG 7 HB2 ARG 7 21.740 24.104 14.212 54 HB3 ARG 7 HB3 ARG 7 22.754 23.284 15.369 55 HG2 ARG 7 HG2 ARG 7 21.447 21.755 13.887 56 HG3 ARG 7 HG3 ARG 7 21.259 21.467 15.606 57 HD2 ARG 7 HD2 ARG 7 19.149 21.141 14.550 58 HD3 ARG 7 HD3 ARG 7 19.038 22.563 15.577 59 HE ARG 7 HE ARG 7 19.645 23.287 12.815 60 HH11 ARG 7 HH11 ARG 7 16.884 22.193 14.838 61 HH12 ARG 7 HH12 ARG 7 15.777 23.006 13.743 62 HH21 ARG 7 HH21 ARG 7 17.968 24.253 11.552 63 HH22 ARG 7 HH22 ARG 7 16.322 24.065 12.136 64 H CYS 8 H CYS 8 22.952 24.146 18.002 65 HA CYS 8 HA CYS 8 21.992 21.960 19.615 66 HB2 CYS 8 HB2 CYS 8 24.363 22.625 19.349 67 HB3 CYS 8 HB3 CYS 8 24.036 24.124 20.194 68 H GLU 9 H GLU 9 22.169 25.527 20.331 69 HA GLU 9 HA GLU 9 20.821 25.544 22.786 70 HB2 GLU 9 HB2 GLU 9 20.997 27.566 20.518 71 HB3 GLU 9 HB3 GLU 9 20.013 27.862 21.946 72 HG2 GLU 9 HG2 GLU 9 22.001 27.557 23.400 73 HG3 GLU 9 HG3 GLU 9 23.007 27.363 21.964 74 H LEU 10 H LEU 10 19.293 25.916 19.505 75 HA LEU 10 HA LEU 10 16.701 26.080 20.715 76 HB2 LEU 10 HB2 LEU 10 15.871 26.489 18.662 77 HB3 LEU 10 HB3 LEU 10 17.535 26.960 18.459 78 HG LEU 10 HG LEU 10 17.737 24.425 17.528 79 HD11 LEU 10 HD11 LEU 10 14.851 25.274 16.938 80 HD12 LEU 10 HD12 LEU 10 15.684 23.905 16.199 81 HD13 LEU 10 HD13 LEU 10 15.330 23.883 17.927 82 HD21 LEU 10 HD21 LEU 10 16.591 26.763 15.948 83 HD22 LEU 10 HD22 LEU 10 18.312 26.470 16.275 84 HD23 LEU 10 HD23 LEU 10 17.401 25.338 15.262 85 H SER 11 H SER 11 18.583 23.275 19.758 86 HA SER 11 HA SER 11 16.404 21.344 20.027 87 HB2 SER 11 HB2 SER 11 19.404 20.869 20.250 88 HB3 SER 11 HB3 SER 11 18.141 19.648 20.032 89 HG SER 11 HG SER 11 19.091 21.609 18.236 90 H CYS 12 H CYS 12 18.932 22.626 22.234 91 HA CYS 12 HA CYS 12 18.161 20.965 24.475 92 HB2 CYS 12 HB2 CYS 12 19.696 23.590 24.390 93 HB3 CYS 12 HB3 CYS 12 19.644 22.471 25.743 94 H ARG 13 H ARG 13 17.256 24.245 23.407 95 HA ARG 13 HA ARG 13 15.648 25.022 25.622 96 HB2 ARG 13 HB2 ARG 13 16.636 26.429 23.817 97 HB3 ARG 13 HB3 ARG 13 15.466 25.754 22.680 98 HG2 ARG 13 HG2 ARG 13 13.629 26.839 23.978 99 HG3 ARG 13 HG3 ARG 13 14.821 27.429 25.155 100 HD2 ARG 13 HD2 ARG 13 14.305 29.217 23.566 101 HD3 ARG 13 HD3 ARG 13 15.982 28.695 23.340 102 HE ARG 13 HE ARG 13 14.311 27.172 21.600 103 HH11 ARG 13 HH11 ARG 13 15.592 30.455 21.686 104 HH12 ARG 13 HH12 ARG 13 15.198 30.696 20.005 105 HH21 ARG 13 HH21 ARG 13 13.834 27.543 19.639 106 HH22 ARG 13 HH22 ARG 13 13.947 29.149 18.930 107 H SER 14 H SER 14 14.854 22.959 22.817 108 HA SER 14 HA SER 14 12.057 22.678 23.285 109 HB2 SER 14 HB2 SER 14 13.993 20.502 22.406 110 HB3 SER 14 HB3 SER 14 12.252 20.533 22.146 111 HG SER 14 HG SER 14 12.500 22.335 20.825 112 H LEU 15 H LEU 15 14.820 21.299 25.017 113 HA LEU 15 HA LEU 15 13.154 19.543 26.719 114 HB2 LEU 15 HB2 LEU 15 16.143 20.060 26.867 115 HB3 LEU 15 HB3 LEU 15 15.250 18.721 27.568 116 HG LEU 15 HG LEU 15 15.716 19.182 24.588 117 HD11 LEU 15 HD11 LEU 15 17.220 17.256 24.758 118 HD12 LEU 15 HD12 LEU 15 17.760 18.566 25.817 119 HD13 LEU 15 HD13 LEU 15 16.924 17.154 26.507 120 HD21 LEU 15 HD21 LEU 15 14.832 16.914 24.296 121 HD22 LEU 15 HD22 LEU 15 14.483 16.799 26.038 122 HD23 LEU 15 HD23 LEU 15 13.604 17.959 25.020 123 H GLY 16 H GLY 16 14.485 22.745 26.809 124 HA2 GLY 16 HA2 GLY 16 13.813 24.358 28.398 125 HA3 GLY 16 HA3 GLY 16 13.612 23.113 29.626 126 H LEU 17 H LEU 17 16.597 23.082 27.770 127 HA LEU 17 HA LEU 17 18.109 24.574 29.861 128 HB2 LEU 17 HB2 LEU 17 19.877 22.757 29.363 129 HB3 LEU 17 HB3 LEU 17 18.699 22.566 30.642 130 HG LEU 17 HG LEU 17 18.384 21.269 27.902 131 HD11 LEU 17 HD11 LEU 17 20.538 20.640 29.056 132 HD12 LEU 17 HD12 LEU 17 19.598 20.075 30.439 133 HD13 LEU 17 HD13 LEU 17 19.414 19.287 28.852 134 HD21 LEU 17 HD21 LEU 17 16.324 21.137 29.311 135 HD22 LEU 17 HD22 LEU 17 17.094 19.561 29.230 136 HD23 LEU 17 HD23 LEU 17 17.285 20.567 30.680 137 H LEU 18 H LEU 18 20.270 25.241 29.157 138 HA LEU 18 HA LEU 18 20.313 26.297 26.435 139 HB2 LEU 18 HB2 LEU 18 22.003 26.539 28.942 140 HB3 LEU 18 HB3 LEU 18 22.736 26.948 27.411 141 HG LEU 18 HG LEU 18 21.924 28.920 28.539 142 HD11 LEU 18 HD11 LEU 18 20.784 29.965 26.692 143 HD12 LEU 18 HD12 LEU 18 21.986 28.828 26.053 144 HD13 LEU 18 HD13 LEU 18 20.256 28.398 26.064 145 HD21 LEU 18 HD21 LEU 18 19.103 27.876 28.158 146 HD22 LEU 18 HD22 LEU 18 19.962 27.965 29.709 147 HD23 LEU 18 HD23 LEU 18 19.577 29.451 28.817 148 H GLY 19 H GLY 19 22.255 26.078 25.121 149 HA2 GLY 19 HA2 GLY 19 23.546 23.380 25.216 150 HA3 GLY 19 HA3 GLY 19 23.184 24.228 23.707 151 H LYS 20 H LYS 20 25.792 23.359 25.003 152 HA LYS 20 HA LYS 20 27.222 25.845 24.295 153 HB2 LYS 20 HB2 LYS 20 28.650 25.931 26.151 154 HB3 LYS 20 HB3 LYS 20 26.987 26.057 26.690 155 HG2 LYS 20 HG2 LYS 20 27.821 24.681 28.326 156 HG3 LYS 20 HG3 LYS 20 27.267 23.453 27.178 157 HD2 LYS 20 HD2 LYS 20 29.478 22.806 27.833 158 HD3 LYS 20 HD3 LYS 20 29.614 23.495 26.211 159 HE2 LYS 20 HE2 LYS 20 30.252 25.715 27.338 160 HE3 LYS 20 HE3 LYS 20 30.405 24.793 28.835 161 HZ1 LYS 20 HZ1 LYS 20 32.518 24.990 27.633 162 HZ2 LYS 20 HZ2 LYS 20 32.084 23.409 27.723 163 HZ3 LYS 20 HZ3 LYS 20 31.895 24.226 26.318 164 H CYS 21 H CYS 21 29.258 25.660 23.457 165 HA CYS 21 HA CYS 21 29.705 23.198 22.052 166 HB2 CYS 21 HB2 CYS 21 31.460 25.651 22.260 167 HB3 CYS 21 HB3 CYS 21 31.697 24.335 21.122 168 H ILE 22 H ILE 22 31.455 21.795 22.078 169 HA ILE 22 HA ILE 22 33.523 21.973 24.164 170 HB ILE 22 HB ILE 22 31.923 20.652 25.253 171 HG12 ILE 22 HG12 ILE 22 34.011 18.710 24.179 172 HG13 ILE 22 HG13 ILE 22 34.382 20.034 25.289 173 HG21 ILE 22 HG21 ILE 22 31.825 18.686 22.930 174 HG22 ILE 22 HG22 ILE 22 30.949 18.578 24.463 175 HG23 ILE 22 HG23 ILE 22 30.549 19.860 23.326 176 HD11 ILE 22 HD11 ILE 22 32.512 17.703 25.857 177 HD12 ILE 22 HD12 ILE 22 34.113 17.998 26.557 178 HD13 ILE 22 HD13 ILE 22 32.771 19.095 26.938 179 H GLY 23 H GLY 23 34.938 22.571 22.663 180 HA2 GLY 23 HA2 GLY 23 36.793 22.234 21.341 181 HA3 GLY 23 HA3 GLY 23 36.376 20.537 21.162 182 H GLU 24 H GLU 24 34.385 20.164 19.804 183 HA GLU 24 HA GLU 24 33.795 22.125 17.678 184 HB2 GLU 24 HB2 GLU 24 34.226 20.736 15.862 185 HB3 GLU 24 HB3 GLU 24 35.691 20.913 16.804 186 HG2 GLU 24 HG2 GLU 24 33.846 18.492 17.068 187 HG3 GLU 24 HG3 GLU 24 35.116 18.646 15.859 188 H ALA 25 H ALA 25 32.635 19.858 19.852 189 HA ALA 25 HA ALA 25 30.096 19.403 18.331 190 HB1 ALA 25 HB1 ALA 25 31.285 17.951 20.738 191 HB2 ALA 25 HB2 ALA 25 29.731 17.575 19.955 192 HB3 ALA 25 HB3 ALA 25 31.245 17.359 19.066 193 H CYS 26 H CYS 26 28.224 19.206 20.178 194 HA CYS 26 HA CYS 26 28.546 21.293 22.257 195 HB2 CYS 26 HB2 CYS 26 27.708 22.402 20.235 196 HB3 CYS 26 HB3 CYS 26 26.356 21.285 20.155 197 H LYS 27 H LYS 27 27.270 21.074 24.054 198 HA LYS 27 HA LYS 27 25.464 18.674 24.261 199 HB2 LYS 27 HB2 LYS 27 27.504 19.654 26.303 200 HB3 LYS 27 HB3 LYS 27 26.282 18.428 26.618 201 HG2 LYS 27 HG2 LYS 27 28.555 18.150 24.629 202 HG3 LYS 27 HG3 LYS 27 28.486 17.482 26.261 203 HD2 LYS 27 HD2 LYS 27 26.334 16.232 25.497 204 HD3 LYS 27 HD3 LYS 27 26.804 16.712 23.852 205 HE2 LYS 27 HE2 LYS 27 27.883 14.662 24.010 206 HE3 LYS 27 HE3 LYS 27 29.156 15.778 24.533 207 HZ1 LYS 27 HZ1 LYS 27 29.154 14.128 26.162 208 HZ2 LYS 27 HZ2 LYS 27 28.205 15.232 26.897 209 HZ3 LYS 27 HZ3 LYS 27 27.515 13.948 26.161 210 H CYS 28 H CYS 28 23.717 18.845 25.652 211 HA CYS 28 HA CYS 28 22.835 21.575 26.293 212 HB2 CYS 28 HB2 CYS 28 21.432 18.962 26.892 213 HB3 CYS 28 HB3 CYS 28 20.752 20.587 26.914 214 H VAL 29 H VAL 29 22.608 22.480 28.348 215 HA VAL 29 HA VAL 29 23.472 20.883 30.701 216 HB VAL 29 HB VAL 29 24.938 22.706 31.448 217 HG11 VAL 29 HG11 VAL 29 25.853 21.488 28.816 218 HG12 VAL 29 HG12 VAL 29 26.876 22.099 30.132 219 HG13 VAL 29 HG13 VAL 29 25.866 20.670 30.401 220 HG21 VAL 29 HG21 VAL 29 24.731 23.768 28.591 221 HG22 VAL 29 HG22 VAL 29 24.148 24.595 30.053 222 HG23 VAL 29 HG23 VAL 29 25.874 24.316 29.827 223 HA PRO 30 HA PRO 30 20.083 22.985 32.576 224 HB2 PRO 30 HB2 PRO 30 20.530 22.559 35.224 225 HB3 PRO 30 HB3 PRO 30 20.158 21.227 34.087 226 HG2 PRO 30 HG2 PRO 30 22.881 22.152 35.058 227 HG3 PRO 30 HG3 PRO 30 22.226 20.483 35.045 228 HD2 PRO 30 HD2 PRO 30 23.832 21.415 33.061 229 HD3 PRO 30 HD3 PRO 30 22.484 20.302 32.705 230 H TYR 31 H TYR 31 23.042 24.339 32.554 231 HA TYR 31 HA TYR 31 22.909 26.374 34.605 232 HB2 TYR 31 HB2 TYR 31 24.719 26.094 32.208 233 HB3 TYR 31 HB3 TYR 31 24.961 27.212 33.547 234 HD1 TYR 31 HD1 TYR 31 24.587 25.737 35.978 235 HD2 TYR 31 HD2 TYR 31 26.343 24.400 32.273 236 HE1 TYR 31 HE1 TYR 31 25.784 23.931 37.195 237 HE2 TYR 31 HE2 TYR 31 27.531 22.577 33.497 238 HH TYR 31 HH TYR 31 28.031 21.682 35.557 Start of MODEL 17 1 H1 ALA 1 H1 ALA 1 37.320 24.148 15.406 2 H2 ALA 1 H2 ALA 1 36.532 24.298 13.955 3 H3 ALA 1 H3 ALA 1 36.589 22.851 14.709 4 HA ALA 1 HA ALA 1 35.202 23.408 16.381 5 HB1 ALA 1 HB1 ALA 1 34.321 25.699 16.726 6 HB2 ALA 1 HB2 ALA 1 36.067 25.594 16.949 7 HB3 ALA 1 HB3 ALA 1 35.407 26.289 15.448 8 H PHE 2 H PHE 2 34.278 21.921 14.699 9 HA PHE 2 HA PHE 2 32.392 23.052 12.800 10 HB2 PHE 2 HB2 PHE 2 32.915 20.185 13.669 11 HB3 PHE 2 HB3 PHE 2 31.865 20.641 12.341 12 HD1 PHE 2 HD1 PHE 2 35.233 19.770 13.199 13 HD2 PHE 2 HD2 PHE 2 32.853 22.013 10.385 14 HE1 PHE 2 HE1 PHE 2 37.116 19.741 11.576 15 HE2 PHE 2 HE2 PHE 2 34.738 21.971 8.766 16 HZ PHE 2 HZ PHE 2 36.873 20.849 9.365 17 H CYS 3 H CYS 3 31.898 23.397 15.840 18 HA CYS 3 HA CYS 3 29.413 21.945 16.213 19 HB2 CYS 3 HB2 CYS 3 29.309 22.785 18.379 20 HB3 CYS 3 HB3 CYS 3 30.986 22.401 18.046 21 H ASN 4 H ASN 4 27.412 22.501 15.714 22 HA ASN 4 HA ASN 4 26.757 25.212 14.695 23 HB2 ASN 4 HB2 ASN 4 25.269 22.570 14.608 24 HB3 ASN 4 HB3 ASN 4 24.539 24.107 14.162 25 HD21 ASN 4 HD21 ASN 4 26.741 22.264 11.393 26 HD22 ASN 4 HD22 ASN 4 26.386 21.498 12.940 27 H LEU 5 H LEU 5 27.328 25.888 16.984 28 HA LEU 5 HA LEU 5 25.842 25.177 19.246 29 HB2 LEU 5 HB2 LEU 5 27.946 26.393 19.293 30 HB3 LEU 5 HB3 LEU 5 27.186 27.790 18.511 31 HG LEU 5 HG LEU 5 25.830 28.228 20.503 32 HD11 LEU 5 HD11 LEU 5 27.189 25.793 21.713 33 HD12 LEU 5 HD12 LEU 5 26.241 26.986 22.622 34 HD13 LEU 5 HD13 LEU 5 25.448 25.981 21.405 35 HD21 LEU 5 HD21 LEU 5 27.671 28.792 22.055 36 HD22 LEU 5 HD22 LEU 5 28.764 27.738 21.146 37 HD23 LEU 5 HD23 LEU 5 28.086 29.189 20.376 38 H ARG 6 H ARG 6 24.956 27.523 16.719 39 HA ARG 6 HA ARG 6 22.676 28.652 18.077 40 HB2 ARG 6 HB2 ARG 6 23.940 29.645 16.159 41 HB3 ARG 6 HB3 ARG 6 23.297 28.391 15.101 42 HG2 ARG 6 HG2 ARG 6 20.979 29.266 15.543 43 HG3 ARG 6 HG3 ARG 6 21.682 30.492 16.616 44 HD2 ARG 6 HD2 ARG 6 21.232 31.499 14.452 45 HD3 ARG 6 HD3 ARG 6 22.977 31.412 14.704 46 HE ARG 6 HE ARG 6 22.028 29.062 13.300 47 HH11 ARG 6 HH11 ARG 6 22.517 32.482 12.554 48 HH12 ARG 6 HH12 ARG 6 23.238 32.074 11.009 49 HH21 ARG 6 HH21 ARG 6 22.479 28.816 11.088 50 HH22 ARG 6 HH22 ARG 6 23.219 30.174 10.253 51 H ARG 7 H ARG 7 22.988 25.752 16.064 52 HA ARG 7 HA ARG 7 20.118 25.117 16.177 53 HB2 ARG 7 HB2 ARG 7 21.625 24.394 14.285 54 HB3 ARG 7 HB3 ARG 7 22.417 23.280 15.408 55 HG2 ARG 7 HG2 ARG 7 20.328 22.071 15.797 56 HG3 ARG 7 HG3 ARG 7 19.402 23.315 14.950 57 HD2 ARG 7 HD2 ARG 7 19.566 21.408 13.560 58 HD3 ARG 7 HD3 ARG 7 20.502 22.719 12.823 59 HE ARG 7 HE ARG 7 22.328 21.192 14.349 60 HH11 ARG 7 HH11 ARG 7 20.134 20.506 11.680 61 HH12 ARG 7 HH12 ARG 7 21.099 19.168 11.115 62 HH21 ARG 7 HH21 ARG 7 23.603 19.588 13.460 63 HH22 ARG 7 HH22 ARG 7 23.070 18.760 12.019 64 H CYS 8 H CYS 8 23.033 24.252 17.946 65 HA CYS 8 HA CYS 8 21.944 22.127 19.545 66 HB2 CYS 8 HB2 CYS 8 24.355 22.575 19.315 67 HB3 CYS 8 HB3 CYS 8 24.146 24.129 20.129 68 H GLU 9 H GLU 9 22.196 25.696 20.156 69 HA GLU 9 HA GLU 9 20.875 25.881 22.574 70 HB2 GLU 9 HB2 GLU 9 21.342 27.573 20.158 71 HB3 GLU 9 HB3 GLU 9 19.932 28.056 21.090 72 HG2 GLU 9 HG2 GLU 9 22.647 27.530 22.383 73 HG3 GLU 9 HG3 GLU 9 22.158 29.098 21.749 74 H LEU 10 H LEU 10 19.193 25.816 19.360 75 HA LEU 10 HA LEU 10 16.624 25.917 20.752 76 HB2 LEU 10 HB2 LEU 10 15.581 25.816 18.572 77 HB3 LEU 10 HB3 LEU 10 16.808 27.061 18.718 78 HG LEU 10 HG LEU 10 18.368 25.364 17.504 79 HD11 LEU 10 HD11 LEU 10 16.885 23.380 17.512 80 HD12 LEU 10 HD12 LEU 10 15.634 24.311 16.665 81 HD13 LEU 10 HD13 LEU 10 17.169 23.930 15.863 82 HD21 LEU 10 HD21 LEU 10 16.096 26.771 16.083 83 HD22 LEU 10 HD22 LEU 10 17.664 27.472 16.535 84 HD23 LEU 10 HD23 LEU 10 17.589 26.198 15.308 85 H SER 11 H SER 11 18.652 23.297 19.615 86 HA SER 11 HA SER 11 16.731 21.176 19.982 87 HB2 SER 11 HB2 SER 11 18.858 20.946 18.721 88 HB3 SER 11 HB3 SER 11 19.762 21.115 20.237 89 HG SER 11 HG SER 11 19.538 18.964 19.769 90 H CYS 12 H CYS 12 19.202 22.602 22.228 91 HA CYS 12 HA CYS 12 18.362 21.071 24.513 92 HB2 CYS 12 HB2 CYS 12 19.786 23.752 24.369 93 HB3 CYS 12 HB3 CYS 12 19.677 22.715 25.789 94 H ARG 13 H ARG 13 17.287 24.252 23.253 95 HA ARG 13 HA ARG 13 15.513 24.904 25.380 96 HB2 ARG 13 HB2 ARG 13 16.330 26.223 23.222 97 HB3 ARG 13 HB3 ARG 13 14.909 25.542 22.480 98 HG2 ARG 13 HG2 ARG 13 14.602 27.835 23.284 99 HG3 ARG 13 HG3 ARG 13 13.474 26.731 24.052 100 HD2 ARG 13 HD2 ARG 13 14.712 28.618 25.448 101 HD3 ARG 13 HD3 ARG 13 14.347 27.044 26.132 102 HE ARG 13 HE ARG 13 16.543 26.819 26.579 103 HH11 ARG 13 HH11 ARG 13 16.624 29.313 24.140 104 HH12 ARG 13 HH12 ARG 13 18.349 29.037 23.876 105 HH21 ARG 13 HH21 ARG 13 18.626 26.432 26.007 106 HH22 ARG 13 HH22 ARG 13 19.465 27.622 25.014 107 H SER 14 H SER 14 15.094 22.564 22.761 108 HA SER 14 HA SER 14 12.306 22.105 23.268 109 HB2 SER 14 HB2 SER 14 12.406 20.267 21.888 110 HB3 SER 14 HB3 SER 14 13.684 21.305 21.238 111 HG SER 14 HG SER 14 15.213 20.019 22.292 112 H LEU 15 H LEU 15 15.156 21.046 24.997 113 HA LEU 15 HA LEU 15 13.640 19.205 26.767 114 HB2 LEU 15 HB2 LEU 15 16.515 20.168 26.939 115 HB3 LEU 15 HB3 LEU 15 15.798 18.834 27.830 116 HG LEU 15 HG LEU 15 16.258 18.903 24.809 117 HD11 LEU 15 HD11 LEU 15 17.726 17.417 27.017 118 HD12 LEU 15 HD12 LEU 15 18.027 17.287 25.273 119 HD13 LEU 15 HD13 LEU 15 18.346 18.817 26.110 120 HD21 LEU 15 HD21 LEU 15 15.356 16.638 26.638 121 HD22 LEU 15 HD22 LEU 15 14.361 17.443 25.410 122 HD23 LEU 15 HD23 LEU 15 15.765 16.484 24.920 123 H GLY 16 H GLY 16 14.657 22.511 26.593 124 HA2 GLY 16 HA2 GLY 16 13.824 24.266 27.923 125 HA3 GLY 16 HA3 GLY 16 13.502 23.158 29.253 126 H LEU 17 H LEU 17 16.665 23.026 27.653 127 HA LEU 17 HA LEU 17 17.899 24.541 29.908 128 HB2 LEU 17 HB2 LEU 17 19.790 22.653 29.185 129 HB3 LEU 17 HB3 LEU 17 18.926 22.802 30.695 130 HG LEU 17 HG LEU 17 17.970 21.119 28.377 131 HD11 LEU 17 HD11 LEU 17 19.565 20.245 30.814 132 HD12 LEU 17 HD12 LEU 17 18.967 19.203 29.507 133 HD13 LEU 17 HD13 LEU 17 20.218 20.412 29.179 134 HD21 LEU 17 HD21 LEU 17 17.320 20.963 31.370 135 HD22 LEU 17 HD22 LEU 17 16.184 21.487 30.118 136 HD23 LEU 17 HD23 LEU 17 16.750 19.826 30.138 137 H LEU 18 H LEU 18 20.214 25.048 29.477 138 HA LEU 18 HA LEU 18 20.555 26.511 26.962 139 HB2 LEU 18 HB2 LEU 18 22.208 26.140 29.475 140 HB3 LEU 18 HB3 LEU 18 22.838 27.014 28.075 141 HG LEU 18 HG LEU 18 20.208 27.798 29.350 142 HD11 LEU 18 HD11 LEU 18 21.455 29.523 30.612 143 HD12 LEU 18 HD12 LEU 18 21.923 27.892 31.115 144 HD13 LEU 18 HD13 LEU 18 22.990 28.832 30.042 145 HD21 LEU 18 HD21 LEU 18 20.661 28.717 27.110 146 HD22 LEU 18 HD22 LEU 18 20.698 29.981 28.345 147 HD23 LEU 18 HD23 LEU 18 22.221 29.346 27.688 148 H GLY 19 H GLY 19 22.126 26.225 25.454 149 HA2 GLY 19 HA2 GLY 19 23.471 23.542 25.285 150 HA3 GLY 19 HA3 GLY 19 23.218 24.643 23.940 151 H LYS 20 H LYS 20 25.686 23.342 25.276 152 HA LYS 20 HA LYS 20 27.448 25.728 25.047 153 HB2 LYS 20 HB2 LYS 20 27.445 23.621 27.250 154 HB3 LYS 20 HB3 LYS 20 28.872 24.576 26.877 155 HG2 LYS 20 HG2 LYS 20 26.211 25.744 27.797 156 HG3 LYS 20 HG3 LYS 20 27.647 25.479 28.794 157 HD2 LYS 20 HD2 LYS 20 28.943 26.960 27.216 158 HD3 LYS 20 HD3 LYS 20 27.409 27.344 26.409 159 HE2 LYS 20 HE2 LYS 20 26.533 28.373 28.403 160 HE3 LYS 20 HE3 LYS 20 27.904 27.812 29.375 161 HZ1 LYS 20 HZ1 LYS 20 28.294 29.613 27.055 162 HZ2 LYS 20 HZ2 LYS 20 28.012 30.203 28.569 163 HZ3 LYS 20 HZ3 LYS 20 29.348 29.309 28.276 164 H CYS 21 H CYS 21 28.947 25.522 23.610 165 HA CYS 21 HA CYS 21 29.383 22.989 22.199 166 HB2 CYS 21 HB2 CYS 21 29.166 24.933 20.870 167 HB3 CYS 21 HB3 CYS 21 30.356 25.826 21.821 168 H ILE 22 H ILE 22 30.964 21.563 22.481 169 HA ILE 22 HA ILE 22 33.128 22.006 24.445 170 HB ILE 22 HB ILE 22 32.438 19.645 22.667 171 HG12 ILE 22 HG12 ILE 22 32.087 20.094 25.661 172 HG13 ILE 22 HG13 ILE 22 30.794 20.074 24.459 173 HG21 ILE 22 HG21 ILE 22 34.504 19.777 24.912 174 HG22 ILE 22 HG22 ILE 22 34.125 18.366 23.902 175 HG23 ILE 22 HG23 ILE 22 34.909 19.745 23.185 176 HD11 ILE 22 HD11 ILE 22 30.810 17.973 25.631 177 HD12 ILE 22 HD12 ILE 22 31.308 17.689 23.950 178 HD13 ILE 22 HD13 ILE 22 32.507 17.693 25.270 179 H GLY 23 H GLY 23 32.733 21.694 20.941 180 HA2 GLY 23 HA2 GLY 23 34.464 23.696 20.174 181 HA3 GLY 23 HA3 GLY 23 35.494 22.254 20.205 182 H GLU 24 H GLU 24 33.976 20.256 19.289 183 HA GLU 24 HA GLU 24 33.339 21.076 16.476 184 HB2 GLU 24 HB2 GLU 24 33.987 18.281 17.425 185 HB3 GLU 24 HB3 GLU 24 33.987 18.912 15.780 186 HG2 GLU 24 HG2 GLU 24 36.003 19.327 17.989 187 HG3 GLU 24 HG3 GLU 24 36.264 18.638 16.391 188 H ALA 25 H ALA 25 31.985 19.632 19.324 189 HA ALA 25 HA ALA 25 29.302 19.716 18.062 190 HB1 ALA 25 HB1 ALA 25 30.366 17.425 19.763 191 HB2 ALA 25 HB2 ALA 25 28.716 17.571 19.119 192 HB3 ALA 25 HB3 ALA 25 30.081 17.363 18.013 193 H CYS 26 H CYS 26 27.660 19.296 20.051 194 HA CYS 26 HA CYS 26 28.432 21.047 22.328 195 HB2 CYS 26 HB2 CYS 26 27.738 22.495 20.547 196 HB3 CYS 26 HB3 CYS 26 26.322 21.516 20.210 197 H LYS 27 H LYS 27 27.260 20.891 24.158 198 HA LYS 27 HA LYS 27 25.367 18.573 24.439 199 HB2 LYS 27 HB2 LYS 27 27.425 19.650 26.410 200 HB3 LYS 27 HB3 LYS 27 26.279 18.371 26.762 201 HG2 LYS 27 HG2 LYS 27 28.432 18.135 24.614 202 HG3 LYS 27 HG3 LYS 27 28.635 17.669 26.304 203 HD2 LYS 27 HD2 LYS 27 26.779 16.044 26.109 204 HD3 LYS 27 HD3 LYS 27 26.635 16.423 24.378 205 HE2 LYS 27 HE2 LYS 27 28.925 15.666 23.966 206 HE3 LYS 27 HE3 LYS 27 29.229 15.513 25.706 207 HZ1 LYS 27 HZ1 LYS 27 27.546 13.765 25.779 208 HZ2 LYS 27 HZ2 LYS 27 27.339 13.829 24.154 209 HZ3 LYS 27 HZ3 LYS 27 28.785 13.341 24.802 210 H CYS 28 H CYS 28 23.804 18.789 26.161 211 HA CYS 28 HA CYS 28 22.960 21.616 26.603 212 HB2 CYS 28 HB2 CYS 28 21.371 19.093 27.096 213 HB3 CYS 28 HB3 CYS 28 20.787 20.765 27.119 214 H VAL 29 H VAL 29 22.573 22.474 28.672 215 HA VAL 29 HA VAL 29 23.458 20.858 31.011 216 HB VAL 29 HB VAL 29 24.768 22.766 31.835 217 HG11 VAL 29 HG11 VAL 29 25.777 21.691 29.177 218 HG12 VAL 29 HG12 VAL 29 26.749 22.314 30.521 219 HG13 VAL 29 HG13 VAL 29 25.827 20.818 30.725 220 HG21 VAL 29 HG21 VAL 29 23.874 24.634 30.515 221 HG22 VAL 29 HG22 VAL 29 25.609 24.465 30.244 222 HG23 VAL 29 HG23 VAL 29 24.474 23.891 29.013 223 HA PRO 30 HA PRO 30 19.816 22.486 32.791 224 HB2 PRO 30 HB2 PRO 30 20.020 21.613 35.347 225 HB3 PRO 30 HB3 PRO 30 19.963 20.496 33.948 226 HG2 PRO 30 HG2 PRO 30 22.414 21.520 35.417 227 HG3 PRO 30 HG3 PRO 30 21.975 19.813 35.054 228 HD2 PRO 30 HD2 PRO 30 23.659 21.256 33.461 229 HD3 PRO 30 HD3 PRO 30 22.504 20.073 32.784 230 H TYR 31 H TYR 31 22.391 24.263 33.170 231 HA TYR 31 HA TYR 31 22.332 25.630 35.625 232 HB2 TYR 31 HB2 TYR 31 23.251 26.789 32.983 233 HB3 TYR 31 HB3 TYR 31 23.807 27.231 34.585 234 HD1 TYR 31 HD1 TYR 31 24.021 23.990 35.312 235 HD2 TYR 31 HD2 TYR 31 25.637 26.726 32.393 236 HE1 TYR 31 HE1 TYR 31 25.971 22.485 34.969 237 HE2 TYR 31 HE2 TYR 31 27.612 25.230 32.092 238 HH TYR 31 HH TYR 31 28.724 23.373 32.896 Start of MODEL 18 1 H1 ALA 1 H1 ALA 1 34.981 20.180 13.672 2 H2 ALA 1 H2 ALA 1 36.432 20.128 14.436 3 H3 ALA 1 H3 ALA 1 36.032 21.460 13.536 4 HA ALA 1 HA ALA 1 34.574 20.564 15.914 5 HB1 ALA 1 HB1 ALA 1 36.633 22.800 15.727 6 HB2 ALA 1 HB2 ALA 1 35.698 22.352 17.164 7 HB3 ALA 1 HB3 ALA 1 36.887 21.222 16.507 8 H PHE 2 H PHE 2 33.166 21.076 13.627 9 HA PHE 2 HA PHE 2 32.610 23.920 13.258 10 HB2 PHE 2 HB2 PHE 2 31.379 21.527 11.861 11 HB3 PHE 2 HB3 PHE 2 31.385 23.193 11.309 12 HD1 PHE 2 HD1 PHE 2 33.610 24.275 10.627 13 HD2 PHE 2 HD2 PHE 2 33.190 20.059 11.383 14 HE1 PHE 2 HE1 PHE 2 35.764 23.849 9.464 15 HE2 PHE 2 HE2 PHE 2 35.321 19.619 10.173 16 HZ PHE 2 HZ PHE 2 36.609 21.521 9.218 17 H CYS 3 H CYS 3 31.776 23.134 15.844 18 HA CYS 3 HA CYS 3 29.124 22.145 15.975 19 HB2 CYS 3 HB2 CYS 3 30.588 22.015 17.858 20 HB3 CYS 3 HB3 CYS 3 30.770 23.773 17.918 21 H ASN 4 H ASN 4 27.317 22.962 15.306 22 HA ASN 4 HA ASN 4 26.918 25.782 14.672 23 HB2 ASN 4 HB2 ASN 4 25.317 23.212 14.397 24 HB3 ASN 4 HB3 ASN 4 24.557 24.775 14.169 25 HD21 ASN 4 HD21 ASN 4 25.765 25.329 10.976 26 HD22 ASN 4 HD22 ASN 4 24.936 25.991 12.369 27 H LEU 5 H LEU 5 27.151 26.831 16.676 28 HA LEU 5 HA LEU 5 26.029 26.018 19.061 29 HB2 LEU 5 HB2 LEU 5 27.845 27.634 18.842 30 HB3 LEU 5 HB3 LEU 5 26.734 28.838 18.183 31 HG LEU 5 HG LEU 5 25.533 28.973 20.321 32 HD11 LEU 5 HD11 LEU 5 27.524 26.882 21.305 33 HD12 LEU 5 HD12 LEU 5 26.456 27.836 22.347 34 HD13 LEU 5 HD13 LEU 5 25.756 26.690 21.206 35 HD21 LEU 5 HD21 LEU 5 27.322 29.957 21.669 36 HD22 LEU 5 HD22 LEU 5 28.552 29.117 20.699 37 HD23 LEU 5 HD23 LEU 5 27.538 30.377 19.961 38 H ARG 6 H ARG 6 24.415 28.268 16.732 39 HA ARG 6 HA ARG 6 22.138 28.685 18.462 40 HB2 ARG 6 HB2 ARG 6 22.815 30.156 16.533 41 HB3 ARG 6 HB3 ARG 6 22.262 28.917 15.421 42 HG2 ARG 6 HG2 ARG 6 20.677 30.809 15.754 43 HG3 ARG 6 HG3 ARG 6 19.977 29.222 16.035 44 HD2 ARG 6 HD2 ARG 6 19.304 31.081 17.635 45 HD3 ARG 6 HD3 ARG 6 19.806 29.552 18.357 46 HE ARG 6 HE ARG 6 22.141 31.082 18.278 47 HH11 ARG 6 HH11 ARG 6 19.057 31.754 19.791 48 HH12 ARG 6 HH12 ARG 6 19.819 32.221 21.296 49 HH21 ARG 6 HH21 ARG 6 23.005 31.750 20.052 50 HH22 ARG 6 HH22 ARG 6 22.061 32.159 21.477 51 H ARG 7 H ARG 7 22.771 26.231 15.972 52 HA ARG 7 HA ARG 7 20.194 24.889 16.226 53 HB2 ARG 7 HB2 ARG 7 22.886 23.770 15.355 54 HB3 ARG 7 HB3 ARG 7 21.351 22.962 15.179 55 HG2 ARG 7 HG2 ARG 7 22.215 25.519 13.767 56 HG3 ARG 7 HG3 ARG 7 22.000 23.928 13.052 57 HD2 ARG 7 HD2 ARG 7 19.820 25.749 14.155 58 HD3 ARG 7 HD3 ARG 7 20.143 25.371 12.460 59 HE ARG 7 HE ARG 7 19.703 22.910 13.832 60 HH11 ARG 7 HH11 ARG 7 17.677 25.656 12.816 61 HH12 ARG 7 HH12 ARG 7 16.284 24.581 12.773 62 HH21 ARG 7 HH21 ARG 7 17.998 21.770 13.632 63 HH22 ARG 7 HH22 ARG 7 16.490 22.427 13.023 64 H CYS 8 H CYS 8 23.254 24.537 17.995 65 HA CYS 8 HA CYS 8 22.418 22.368 19.686 66 HB2 CYS 8 HB2 CYS 8 24.734 22.899 19.385 67 HB3 CYS 8 HB3 CYS 8 24.499 24.553 19.929 68 H GLU 9 H GLU 9 22.387 25.940 20.268 69 HA GLU 9 HA GLU 9 21.131 25.918 22.790 70 HB2 GLU 9 HB2 GLU 9 21.276 27.896 20.508 71 HB3 GLU 9 HB3 GLU 9 20.233 28.252 21.868 72 HG2 GLU 9 HG2 GLU 9 23.122 27.484 22.368 73 HG3 GLU 9 HG3 GLU 9 22.687 29.122 21.863 74 H LEU 10 H LEU 10 19.474 25.994 19.557 75 HA LEU 10 HA LEU 10 16.865 25.955 20.875 76 HB2 LEU 10 HB2 LEU 10 15.872 25.855 18.746 77 HB3 LEU 10 HB3 LEU 10 17.202 26.976 18.697 78 HG LEU 10 HG LEU 10 18.526 24.912 17.697 79 HD11 LEU 10 HD11 LEU 10 15.662 24.282 16.845 80 HD12 LEU 10 HD12 LEU 10 17.137 23.517 16.225 81 HD13 LEU 10 HD13 LEU 10 16.648 23.249 17.893 82 HD21 LEU 10 HD21 LEU 10 17.879 25.685 15.440 83 HD22 LEU 10 HD22 LEU 10 16.477 26.527 16.126 84 HD23 LEU 10 HD23 LEU 10 18.125 27.042 16.543 85 H SER 11 H SER 11 19.060 23.383 19.718 86 HA SER 11 HA SER 11 17.140 21.258 20.028 87 HB2 SER 11 HB2 SER 11 20.175 21.153 20.195 88 HB3 SER 11 HB3 SER 11 19.087 19.757 20.069 89 HG SER 11 HG SER 11 19.621 21.794 18.199 90 H CYS 12 H CYS 12 19.508 22.671 22.366 91 HA CYS 12 HA CYS 12 18.659 20.959 24.539 92 HB2 CYS 12 HB2 CYS 12 20.038 23.658 24.567 93 HB3 CYS 12 HB3 CYS 12 19.871 22.584 25.955 94 H ARG 13 H ARG 13 17.509 24.189 23.388 95 HA ARG 13 HA ARG 13 15.678 24.683 25.520 96 HB2 ARG 13 HB2 ARG 13 16.398 26.311 23.756 97 HB3 ARG 13 HB3 ARG 13 15.450 25.408 22.579 98 HG2 ARG 13 HG2 ARG 13 13.378 25.933 23.953 99 HG3 ARG 13 HG3 ARG 13 14.400 26.898 25.035 100 HD2 ARG 13 HD2 ARG 13 13.313 28.354 23.427 101 HD3 ARG 13 HD3 ARG 13 15.052 28.319 23.082 102 HE ARG 13 HE ARG 13 13.906 26.286 21.502 103 HH11 ARG 13 HH11 ARG 13 13.595 29.815 21.583 104 HH12 ARG 13 HH12 ARG 13 12.979 29.812 19.930 105 HH21 ARG 13 HH21 ARG 13 13.216 26.444 19.492 106 HH22 ARG 13 HH22 ARG 13 12.783 28.013 18.799 107 H SER 14 H SER 14 15.347 22.567 22.652 108 HA SER 14 HA SER 14 12.544 22.064 23.004 109 HB2 SER 14 HB2 SER 14 12.758 20.246 21.575 110 HB3 SER 14 HB3 SER 14 13.955 21.407 20.995 111 HG SER 14 HG SER 14 15.566 20.140 22.046 112 H LEU 15 H LEU 15 15.355 20.622 24.627 113 HA LEU 15 HA LEU 15 13.762 18.776 26.248 114 HB2 LEU 15 HB2 LEU 15 16.595 19.769 26.709 115 HB3 LEU 15 HB3 LEU 15 15.830 18.354 27.423 116 HG LEU 15 HG LEU 15 16.584 18.721 24.489 117 HD11 LEU 15 HD11 LEU 15 18.493 18.374 26.015 118 HD12 LEU 15 HD12 LEU 15 17.720 16.904 26.650 119 HD13 LEU 15 HD13 LEU 15 18.238 16.981 24.953 120 HD21 LEU 15 HD21 LEU 15 16.013 16.313 24.251 121 HD22 LEU 15 HD22 LEU 15 15.348 16.315 25.898 122 HD23 LEU 15 HD23 LEU 15 14.591 17.295 24.618 123 H GLY 16 H GLY 16 15.166 22.014 26.647 124 HA2 GLY 16 HA2 GLY 16 13.614 23.586 27.847 125 HA3 GLY 16 HA3 GLY 16 13.608 22.443 29.186 126 H LEU 17 H LEU 17 16.729 22.563 27.855 127 HA LEU 17 HA LEU 17 17.705 24.468 29.954 128 HB2 LEU 17 HB2 LEU 17 19.665 22.918 30.078 129 HB3 LEU 17 HB3 LEU 17 18.193 22.431 30.888 130 HG LEU 17 HG LEU 17 18.930 21.314 28.160 131 HD11 LEU 17 HD11 LEU 17 20.053 19.464 29.353 132 HD12 LEU 17 HD12 LEU 17 20.848 21.003 29.731 133 HD13 LEU 17 HD13 LEU 17 19.756 20.262 30.909 134 HD21 LEU 17 HD21 LEU 17 17.394 20.097 30.516 135 HD22 LEU 17 HD22 LEU 17 16.637 20.713 29.037 136 HD23 LEU 17 HD23 LEU 17 17.711 19.319 28.964 137 H LEU 18 H LEU 18 20.175 24.982 29.477 138 HA LEU 18 HA LEU 18 20.097 26.368 26.863 139 HB2 LEU 18 HB2 LEU 18 22.054 26.479 29.198 140 HB3 LEU 18 HB3 LEU 18 22.255 27.354 27.702 141 HG LEU 18 HG LEU 18 21.454 28.884 29.231 142 HD11 LEU 18 HD11 LEU 18 19.004 28.145 27.605 143 HD12 LEU 18 HD12 LEU 18 19.444 29.738 28.219 144 HD13 LEU 18 HD13 LEU 18 20.434 28.986 26.955 145 HD21 LEU 18 HD21 LEU 18 20.469 27.276 30.884 146 HD22 LEU 18 HD22 LEU 18 19.500 28.726 30.600 147 HD23 LEU 18 HD23 LEU 18 19.010 27.201 29.861 148 H GLY 19 H GLY 19 21.941 26.382 25.436 149 HA2 GLY 19 HA2 GLY 19 23.345 23.725 25.282 150 HA3 GLY 19 HA3 GLY 19 22.806 24.629 23.875 151 H LYS 20 H LYS 20 25.476 23.632 24.923 152 HA LYS 20 HA LYS 20 26.972 25.938 23.887 153 HB2 LYS 20 HB2 LYS 20 28.657 25.926 25.602 154 HB3 LYS 20 HB3 LYS 20 27.078 26.346 26.240 155 HG2 LYS 20 HG2 LYS 20 27.858 24.992 27.925 156 HG3 LYS 20 HG3 LYS 20 26.972 23.811 26.962 157 HD2 LYS 20 HD2 LYS 20 29.057 22.774 27.419 158 HD3 LYS 20 HD3 LYS 20 29.197 23.384 25.758 159 HE2 LYS 20 HE2 LYS 20 30.323 25.463 26.713 160 HE3 LYS 20 HE3 LYS 20 30.356 24.641 28.276 161 HZ1 LYS 20 HZ1 LYS 20 31.717 22.901 27.257 162 HZ2 LYS 20 HZ2 LYS 20 31.629 23.659 25.773 163 HZ3 LYS 20 HZ3 LYS 20 32.414 24.341 27.047 164 H CYS 21 H CYS 21 29.015 25.422 23.012 165 HA CYS 21 HA CYS 21 29.016 22.767 21.745 166 HB2 CYS 21 HB2 CYS 21 30.716 25.258 21.456 167 HB3 CYS 21 HB3 CYS 21 31.032 23.774 20.562 168 H ILE 22 H ILE 22 30.644 21.219 21.813 169 HA ILE 22 HA ILE 22 32.766 21.515 23.875 170 HB ILE 22 HB ILE 22 30.834 20.311 24.789 171 HG12 ILE 22 HG12 ILE 22 33.079 18.307 24.691 172 HG13 ILE 22 HG13 ILE 22 33.362 19.911 25.390 173 HG21 ILE 22 HG21 ILE 22 30.395 17.950 24.122 174 HG22 ILE 22 HG22 ILE 22 29.985 19.110 22.861 175 HG23 ILE 22 HG23 ILE 22 31.480 18.157 22.741 176 HD11 ILE 22 HD11 ILE 22 32.737 18.328 27.129 177 HD12 ILE 22 HD12 ILE 22 31.489 19.579 26.956 178 HD13 ILE 22 HD13 ILE 22 31.219 17.951 26.293 179 H GLY 23 H GLY 23 32.911 21.987 21.182 180 HA2 GLY 23 HA2 GLY 23 35.065 21.652 19.956 181 HA3 GLY 23 HA3 GLY 23 34.797 19.913 20.130 182 H GLU 24 H GLU 24 33.214 18.923 18.955 183 HA GLU 24 HA GLU 24 32.271 20.238 16.448 184 HB2 GLU 24 HB2 GLU 24 33.942 18.379 16.357 185 HB3 GLU 24 HB3 GLU 24 32.863 17.375 17.317 186 HG2 GLU 24 HG2 GLU 24 32.685 16.641 15.127 187 HG3 GLU 24 HG3 GLU 24 31.176 17.438 15.540 188 H ALA 25 H ALA 25 31.340 18.348 19.276 189 HA ALA 25 HA ALA 25 28.505 18.134 18.474 190 HB1 ALA 25 HB1 ALA 25 28.389 16.608 20.400 191 HB2 ALA 25 HB2 ALA 25 29.706 16.153 19.310 192 HB3 ALA 25 HB3 ALA 25 30.065 17.000 20.836 193 H CYS 26 H CYS 26 26.894 18.498 20.076 194 HA CYS 26 HA CYS 26 27.127 21.037 21.589 195 HB2 CYS 26 HB2 CYS 26 25.286 20.636 19.993 196 HB3 CYS 26 HB3 CYS 26 24.832 19.182 20.868 197 H LYS 27 H LYS 27 26.553 21.172 23.796 198 HA LYS 27 HA LYS 27 25.944 18.729 25.354 199 HB2 LYS 27 HB2 LYS 27 28.434 19.174 25.504 200 HB3 LYS 27 HB3 LYS 27 28.080 20.770 26.146 201 HG2 LYS 27 HG2 LYS 27 28.694 19.297 27.954 202 HG3 LYS 27 HG3 LYS 27 26.981 19.701 28.136 203 HD2 LYS 27 HD2 LYS 27 26.325 17.541 27.247 204 HD3 LYS 27 HD3 LYS 27 27.998 17.147 26.811 205 HE2 LYS 27 HE2 LYS 27 28.593 17.189 29.228 206 HE3 LYS 27 HE3 LYS 27 26.905 17.504 29.638 207 HZ1 LYS 27 HZ1 LYS 27 26.297 15.394 28.704 208 HZ2 LYS 27 HZ2 LYS 27 27.819 15.117 28.124 209 HZ3 LYS 27 HZ3 LYS 27 27.562 15.100 29.732 210 H CYS 28 H CYS 28 24.163 19.128 26.579 211 HA CYS 28 HA CYS 28 23.221 21.921 26.760 212 HB2 CYS 28 HB2 CYS 28 21.809 19.384 27.608 213 HB3 CYS 28 HB3 CYS 28 21.120 21.000 27.436 214 H VAL 29 H VAL 29 22.742 23.032 28.713 215 HA VAL 29 HA VAL 29 23.820 21.805 31.181 216 HB VAL 29 HB VAL 29 25.072 23.734 31.802 217 HG11 VAL 29 HG11 VAL 29 26.914 23.573 30.251 218 HG12 VAL 29 HG12 VAL 29 26.191 21.972 30.459 219 HG13 VAL 29 HG13 VAL 29 25.865 22.910 28.983 220 HG21 VAL 29 HG21 VAL 29 25.520 25.562 30.156 221 HG22 VAL 29 HG22 VAL 29 24.203 24.938 29.144 222 HG23 VAL 29 HG23 VAL 29 23.876 25.549 30.790 223 HA PRO 30 HA PRO 30 20.182 23.450 33.023 224 HB2 PRO 30 HB2 PRO 30 21.408 22.998 35.689 225 HB3 PRO 30 HB3 PRO 30 20.003 22.163 34.941 226 HG2 PRO 30 HG2 PRO 30 22.418 20.925 35.279 227 HG3 PRO 30 HG3 PRO 30 21.472 20.695 33.761 228 HD2 PRO 30 HD2 PRO 30 23.687 22.743 34.239 229 HD3 PRO 30 HD3 PRO 30 23.600 21.457 33.025 230 H TYR 31 H TYR 31 22.402 25.566 32.778 231 HA TYR 31 HA TYR 31 22.749 26.952 35.227 232 HB2 TYR 31 HB2 TYR 31 23.149 27.988 32.415 233 HB3 TYR 31 HB3 TYR 31 23.768 28.725 33.887 234 HD1 TYR 31 HD1 TYR 31 25.583 28.372 31.781 235 HD2 TYR 31 HD2 TYR 31 24.433 25.482 34.778 236 HE1 TYR 31 HE1 TYR 31 27.740 27.174 31.466 237 HE2 TYR 31 HE2 TYR 31 26.573 24.284 34.432 238 HH TYR 31 HH TYR 31 28.430 24.065 33.071 Start of MODEL 19 1 H1 ALA 1 H1 ALA 1 37.034 26.370 16.092 2 H2 ALA 1 H2 ALA 1 37.364 26.542 17.697 3 H3 ALA 1 H3 ALA 1 36.328 27.591 16.955 4 HA ALA 1 HA ALA 1 35.917 24.737 17.518 5 HB1 ALA 1 HB1 ALA 1 33.989 25.568 18.862 6 HB2 ALA 1 HB2 ALA 1 35.551 26.152 19.461 7 HB3 ALA 1 HB3 ALA 1 34.496 27.233 18.526 8 H PHE 2 H PHE 2 35.407 23.943 15.468 9 HA PHE 2 HA PHE 2 33.620 25.346 13.691 10 HB2 PHE 2 HB2 PHE 2 34.446 22.415 13.666 11 HB3 PHE 2 HB3 PHE 2 33.679 23.267 12.338 12 HD1 PHE 2 HD1 PHE 2 36.825 22.324 13.743 13 HD2 PHE 2 HD2 PHE 2 34.883 25.318 11.320 14 HE1 PHE 2 HE1 PHE 2 39.022 22.991 12.800 15 HE2 PHE 2 HE2 PHE 2 37.079 25.980 10.382 16 HZ PHE 2 HZ PHE 2 39.159 24.826 11.131 17 H CYS 3 H CYS 3 32.674 24.248 16.461 18 HA CYS 3 HA CYS 3 30.292 22.731 15.971 19 HB2 CYS 3 HB2 CYS 3 31.335 22.756 18.138 20 HB3 CYS 3 HB3 CYS 3 31.200 24.501 18.256 21 H ASN 4 H ASN 4 28.222 23.253 15.709 22 HA ASN 4 HA ASN 4 27.498 26.027 14.932 23 HB2 ASN 4 HB2 ASN 4 25.998 23.408 14.543 24 HB3 ASN 4 HB3 ASN 4 25.588 24.971 13.843 25 HD21 ASN 4 HD21 ASN 4 28.502 22.727 12.089 26 HD22 ASN 4 HD22 ASN 4 27.855 22.218 13.636 27 H LEU 5 H LEU 5 27.038 27.192 16.709 28 HA LEU 5 HA LEU 5 26.102 25.977 19.125 29 HB2 LEU 5 HB2 LEU 5 27.760 27.757 18.997 30 HB3 LEU 5 HB3 LEU 5 26.573 28.891 18.386 31 HG LEU 5 HG LEU 5 27.289 29.044 20.820 32 HD11 LEU 5 HD11 LEU 5 24.285 28.853 20.416 33 HD12 LEU 5 HD12 LEU 5 25.161 29.767 21.650 34 HD13 LEU 5 HD13 LEU 5 25.308 30.231 19.949 35 HD21 LEU 5 HD21 LEU 5 27.122 26.600 21.319 36 HD22 LEU 5 HD22 LEU 5 26.304 27.638 22.474 37 HD23 LEU 5 HD23 LEU 5 25.349 26.747 21.281 38 H ARG 6 H ARG 6 24.416 28.401 16.997 39 HA ARG 6 HA ARG 6 22.014 28.372 18.632 40 HB2 ARG 6 HB2 ARG 6 22.777 29.485 15.949 41 HB3 ARG 6 HB3 ARG 6 21.057 29.199 16.234 42 HG2 ARG 6 HG2 ARG 6 21.086 30.505 18.287 43 HG3 ARG 6 HG3 ARG 6 22.826 30.799 18.129 44 HD2 ARG 6 HD2 ARG 6 20.749 31.673 16.070 45 HD3 ARG 6 HD3 ARG 6 21.316 32.693 17.403 46 HE ARG 6 HE ARG 6 23.563 31.655 15.921 47 HH11 ARG 6 HH11 ARG 6 21.130 34.171 15.602 48 HH12 ARG 6 HH12 ARG 6 22.268 35.246 14.798 49 HH21 ARG 6 HH21 ARG 6 24.808 32.904 14.850 50 HH22 ARG 6 HH22 ARG 6 24.356 34.528 14.369 51 H ARG 7 H ARG 7 23.030 26.440 15.888 52 HA ARG 7 HA ARG 7 20.712 24.867 15.416 53 HB2 ARG 7 HB2 ARG 7 22.850 25.087 14.101 54 HB3 ARG 7 HB3 ARG 7 23.640 24.048 15.291 55 HG2 ARG 7 HG2 ARG 7 22.110 22.192 14.689 56 HG3 ARG 7 HG3 ARG 7 21.297 23.242 13.519 57 HD2 ARG 7 HD2 ARG 7 24.233 22.404 13.436 58 HD3 ARG 7 HD3 ARG 7 22.947 21.745 12.428 59 HE ARG 7 HE ARG 7 22.842 24.502 11.979 60 HH11 ARG 7 HH11 ARG 7 25.042 21.894 11.092 61 HH12 ARG 7 HH12 ARG 7 25.691 22.844 9.767 62 HH21 ARG 7 HH21 ARG 7 23.998 25.716 10.678 63 HH22 ARG 7 HH22 ARG 7 25.118 24.999 9.534 64 H CYS 8 H CYS 8 23.086 24.651 18.010 65 HA CYS 8 HA CYS 8 21.934 22.179 19.136 66 HB2 CYS 8 HB2 CYS 8 24.350 22.543 19.103 67 HB3 CYS 8 HB3 CYS 8 24.168 24.027 20.024 68 H GLU 9 H GLU 9 22.169 25.689 20.126 69 HA GLU 9 HA GLU 9 20.789 25.459 22.574 70 HB2 GLU 9 HB2 GLU 9 20.993 27.737 20.573 71 HB3 GLU 9 HB3 GLU 9 20.028 27.848 22.040 72 HG2 GLU 9 HG2 GLU 9 22.071 27.315 23.395 73 HG3 GLU 9 HG3 GLU 9 23.028 27.502 21.924 74 H LEU 10 H LEU 10 19.332 25.775 19.293 75 HA LEU 10 HA LEU 10 16.640 26.033 20.256 76 HB2 LEU 10 HB2 LEU 10 15.952 25.759 18.020 77 HB3 LEU 10 HB3 LEU 10 17.477 26.594 17.962 78 HG LEU 10 HG LEU 10 18.431 24.117 17.599 79 HD11 LEU 10 HD11 LEU 10 16.106 23.045 17.782 80 HD12 LEU 10 HD12 LEU 10 15.668 23.929 16.315 81 HD13 LEU 10 HD13 LEU 10 16.957 22.719 16.287 82 HD21 LEU 10 HD21 LEU 10 17.020 25.689 15.406 83 HD22 LEU 10 HD22 LEU 10 18.663 25.993 16.001 84 HD23 LEU 10 HD23 LEU 10 18.288 24.472 15.167 85 H SER 11 H SER 11 18.704 23.214 19.968 86 HA SER 11 HA SER 11 16.522 21.250 20.089 87 HB2 SER 11 HB2 SER 11 18.651 20.791 18.889 88 HB3 SER 11 HB3 SER 11 19.526 20.880 20.432 89 HG SER 11 HG SER 11 18.994 18.898 20.727 90 H CYS 12 H CYS 12 19.043 22.499 22.339 91 HA CYS 12 HA CYS 12 18.133 21.011 24.615 92 HB2 CYS 12 HB2 CYS 12 19.645 23.636 24.530 93 HB3 CYS 12 HB3 CYS 12 19.511 22.557 25.913 94 H ARG 13 H ARG 13 17.099 24.187 23.304 95 HA ARG 13 HA ARG 13 15.317 24.975 25.349 96 HB2 ARG 13 HB2 ARG 13 15.929 26.304 23.325 97 HB3 ARG 13 HB3 ARG 13 14.967 25.222 22.334 98 HG2 ARG 13 HG2 ARG 13 13.757 27.278 22.733 99 HG3 ARG 13 HG3 ARG 13 12.901 25.937 23.471 100 HD2 ARG 13 HD2 ARG 13 12.841 27.895 24.919 101 HD3 ARG 13 HD3 ARG 13 13.754 26.607 25.705 102 HE ARG 13 HE ARG 13 15.847 27.756 25.002 103 HH11 ARG 13 HH11 ARG 13 12.995 29.852 25.435 104 HH12 ARG 13 HH12 ARG 13 14.022 31.259 25.502 105 HH21 ARG 13 HH21 ARG 13 16.891 29.583 24.666 106 HH22 ARG 13 HH22 ARG 13 16.184 31.117 25.131 107 H SER 14 H SER 14 14.924 22.281 23.062 108 HA SER 14 HA SER 14 12.091 21.933 23.586 109 HB2 SER 14 HB2 SER 14 12.194 19.883 22.500 110 HB3 SER 14 HB3 SER 14 13.359 20.898 21.639 111 HG SER 14 HG SER 14 15.026 19.831 22.689 112 H LEU 15 H LEU 15 14.989 21.009 25.344 113 HA LEU 15 HA LEU 15 13.560 19.242 27.227 114 HB2 LEU 15 HB2 LEU 15 16.441 20.201 27.286 115 HB3 LEU 15 HB3 LEU 15 15.746 18.842 28.159 116 HG LEU 15 HG LEU 15 16.150 19.017 25.137 117 HD11 LEU 15 HD11 LEU 15 17.853 17.303 25.514 118 HD12 LEU 15 HD12 LEU 15 18.231 18.768 26.427 119 HD13 LEU 15 HD13 LEU 15 17.554 17.353 27.265 120 HD21 LEU 15 HD21 LEU 15 15.547 16.605 25.143 121 HD22 LEU 15 HD22 LEU 15 15.101 16.724 26.858 122 HD23 LEU 15 HD23 LEU 15 14.185 17.623 25.626 123 H GLY 16 H GLY 16 14.636 22.572 27.057 124 HA2 GLY 16 HA2 GLY 16 13.734 24.295 28.440 125 HA3 GLY 16 HA3 GLY 16 13.493 23.146 29.756 126 H LEU 17 H LEU 17 16.577 23.183 28.045 127 HA LEU 17 HA LEU 17 17.932 24.866 30.078 128 HB2 LEU 17 HB2 LEU 17 19.753 23.045 29.966 129 HB3 LEU 17 HB3 LEU 17 18.469 22.956 31.148 130 HG LEU 17 HG LEU 17 18.226 21.417 28.541 131 HD11 LEU 17 HD11 LEU 17 20.476 20.954 29.523 132 HD12 LEU 17 HD12 LEU 17 19.698 20.464 31.034 133 HD13 LEU 17 HD13 LEU 17 19.401 19.547 29.539 134 HD21 LEU 17 HD21 LEU 17 17.345 20.823 31.423 135 HD22 LEU 17 HD22 LEU 17 16.269 21.348 30.125 136 HD23 LEU 17 HD23 LEU 17 17.059 19.775 30.024 137 H LEU 18 H LEU 18 20.154 25.459 29.392 138 HA LEU 18 HA LEU 18 20.152 26.283 26.583 139 HB2 LEU 18 HB2 LEU 18 22.072 26.689 28.900 140 HB3 LEU 18 HB3 LEU 18 22.404 27.315 27.290 141 HG LEU 18 HG LEU 18 19.875 28.010 28.821 142 HD11 LEU 18 HD11 LEU 18 20.979 30.145 29.375 143 HD12 LEU 18 HD12 LEU 18 21.857 28.782 30.079 144 HD13 LEU 18 HD13 LEU 18 22.484 29.580 28.616 145 HD21 LEU 18 HD21 LEU 18 19.669 28.414 26.416 146 HD22 LEU 18 HD22 LEU 18 19.828 29.950 27.261 147 HD23 LEU 18 HD23 LEU 18 21.227 29.277 26.399 148 H GLY 19 H GLY 19 22.147 26.097 25.283 149 HA2 GLY 19 HA2 GLY 19 23.372 23.352 25.379 150 HA3 GLY 19 HA3 GLY 19 22.911 24.135 23.874 151 H LYS 20 H LYS 20 25.571 23.181 25.067 152 HA LYS 20 HA LYS 20 27.175 25.627 24.456 153 HB2 LYS 20 HB2 LYS 20 27.641 23.749 26.813 154 HB3 LYS 20 HB3 LYS 20 28.714 25.066 26.329 155 HG2 LYS 20 HG2 LYS 20 25.860 25.399 27.309 156 HG3 LYS 20 HG3 LYS 20 27.309 25.600 28.290 157 HD2 LYS 20 HD2 LYS 20 28.016 27.529 27.033 158 HD3 LYS 20 HD3 LYS 20 26.770 27.271 25.801 159 HE2 LYS 20 HE2 LYS 20 25.018 27.518 27.594 160 HE3 LYS 20 HE3 LYS 20 26.306 27.946 28.727 161 HZ1 LYS 20 HZ1 LYS 20 26.874 29.790 27.226 162 HZ2 LYS 20 HZ2 LYS 20 25.499 29.477 26.311 163 HZ3 LYS 20 HZ3 LYS 20 25.381 29.929 27.879 164 H CYS 21 H CYS 21 28.798 25.355 23.164 165 HA CYS 21 HA CYS 21 29.271 22.847 21.837 166 HB2 CYS 21 HB2 CYS 21 30.596 25.569 21.773 167 HB3 CYS 21 HB3 CYS 21 31.180 24.222 20.799 168 H ILE 22 H ILE 22 30.763 21.371 22.032 169 HA ILE 22 HA ILE 22 32.773 21.278 24.192 170 HB ILE 22 HB ILE 22 32.275 19.454 21.806 171 HG12 ILE 22 HG12 ILE 22 30.246 19.465 23.151 172 HG13 ILE 22 HG13 ILE 22 31.072 17.928 23.236 173 HG21 ILE 22 HG21 ILE 22 34.496 19.093 22.628 174 HG22 ILE 22 HG22 ILE 22 33.921 19.014 24.308 175 HG23 ILE 22 HG23 ILE 22 33.486 17.740 23.149 176 HD11 ILE 22 HD11 ILE 22 31.176 20.066 25.402 177 HD12 ILE 22 HD12 ILE 22 30.171 18.607 25.420 178 HD13 ILE 22 HD13 ILE 22 31.935 18.453 25.475 179 H GLY 23 H GLY 23 32.602 21.599 20.679 180 HA2 GLY 23 HA2 GLY 23 34.592 23.483 20.228 181 HA3 GLY 23 HA3 GLY 23 35.407 21.911 20.153 182 H GLU 24 H GLU 24 33.685 20.259 18.989 183 HA GLU 24 HA GLU 24 32.626 21.496 16.485 184 HB2 GLU 24 HB2 GLU 24 33.670 18.674 16.727 185 HB3 GLU 24 HB3 GLU 24 33.152 19.532 15.284 186 HG2 GLU 24 HG2 GLU 24 35.485 19.588 15.111 187 HG3 GLU 24 HG3 GLU 24 35.068 21.201 15.722 188 H ALA 25 H ALA 25 32.258 18.976 18.939 189 HA ALA 25 HA ALA 25 29.418 18.486 18.339 190 HB1 ALA 25 HB1 ALA 25 29.652 16.866 20.186 191 HB2 ALA 25 HB2 ALA 25 30.951 16.661 19.009 192 HB3 ALA 25 HB3 ALA 25 31.275 17.480 20.553 193 H CYS 26 H CYS 26 27.941 18.468 20.418 194 HA CYS 26 HA CYS 26 28.345 20.740 22.251 195 HB2 CYS 26 HB2 CYS 26 27.417 21.719 20.164 196 HB3 CYS 26 HB3 CYS 26 26.039 20.622 20.270 197 H LYS 27 H LYS 27 26.990 20.705 24.090 198 HA LYS 27 HA LYS 27 24.966 18.560 24.437 199 HB2 LYS 27 HB2 LYS 27 27.462 18.763 26.167 200 HB3 LYS 27 HB3 LYS 27 25.960 18.000 26.689 201 HG2 LYS 27 HG2 LYS 27 26.112 16.643 24.452 202 HG3 LYS 27 HG3 LYS 27 27.815 17.122 24.463 203 HD2 LYS 27 HD2 LYS 27 28.130 16.022 26.633 204 HD3 LYS 27 HD3 LYS 27 26.383 15.712 26.756 205 HE2 LYS 27 HE2 LYS 27 26.439 14.271 24.779 206 HE3 LYS 27 HE3 LYS 27 28.156 14.610 24.530 207 HZ1 LYS 27 HZ1 LYS 27 28.657 13.500 26.582 208 HZ2 LYS 27 HZ2 LYS 27 27.053 13.223 26.918 209 HZ3 LYS 27 HZ3 LYS 27 27.780 12.483 25.643 210 H CYS 28 H CYS 28 23.684 18.833 26.428 211 HA CYS 28 HA CYS 28 23.067 21.710 26.660 212 HB2 CYS 28 HB2 CYS 28 21.417 19.358 27.568 213 HB3 CYS 28 HB3 CYS 28 20.899 21.037 27.389 214 H VAL 29 H VAL 29 22.562 22.782 28.668 215 HA VAL 29 HA VAL 29 23.905 21.619 31.052 216 HB VAL 29 HB VAL 29 25.117 23.639 31.482 217 HG11 VAL 29 HG11 VAL 29 26.861 23.422 29.823 218 HG12 VAL 29 HG12 VAL 29 26.196 21.824 30.181 219 HG13 VAL 29 HG13 VAL 29 25.747 22.652 28.674 220 HG21 VAL 29 HG21 VAL 29 25.423 25.381 29.748 221 HG22 VAL 29 HG22 VAL 29 24.128 24.639 28.778 222 HG23 VAL 29 HG23 VAL 29 23.781 25.364 30.364 223 HA PRO 30 HA PRO 30 20.384 23.230 33.187 224 HB2 PRO 30 HB2 PRO 30 21.053 22.701 35.752 225 HB3 PRO 30 HB3 PRO 30 20.815 21.406 34.537 226 HG2 PRO 30 HG2 PRO 30 23.429 22.656 35.455 227 HG3 PRO 30 HG3 PRO 30 23.017 20.911 35.340 228 HD2 PRO 30 HD2 PRO 30 24.347 22.244 33.353 229 HD3 PRO 30 HD3 PRO 30 23.201 20.916 33.008 230 H TYR 31 H TYR 31 22.833 25.052 32.762 231 HA TYR 31 HA TYR 31 23.437 26.754 34.921 232 HB2 TYR 31 HB2 TYR 31 23.429 27.370 31.941 233 HB3 TYR 31 HB3 TYR 31 24.140 28.396 33.170 234 HD1 TYR 31 HD1 TYR 31 25.871 28.081 31.215 235 HD2 TYR 31 HD2 TYR 31 25.026 25.160 34.282 236 HE1 TYR 31 HE1 TYR 31 28.132 27.069 30.889 237 HE2 TYR 31 HE2 TYR 31 27.262 24.154 33.936 238 HH TYR 31 HH TYR 31 29.213 24.205 32.743 Start of MODEL 20 1 H1 ALA 1 H1 ALA 1 35.924 24.165 17.509 2 H2 ALA 1 H2 ALA 1 36.881 25.424 17.067 3 H3 ALA 1 H3 ALA 1 37.477 23.877 17.086 4 HA ALA 1 HA ALA 1 36.958 24.727 14.832 5 HB1 ALA 1 HB1 ALA 1 35.391 22.294 15.797 6 HB2 ALA 1 HB2 ALA 1 35.883 22.612 14.129 7 HB3 ALA 1 HB3 ALA 1 37.114 22.301 15.363 8 H PHE 2 H PHE 2 34.976 24.626 13.304 9 HA PHE 2 HA PHE 2 32.959 26.502 14.129 10 HB2 PHE 2 HB2 PHE 2 33.032 24.774 11.640 11 HB3 PHE 2 HB3 PHE 2 32.132 26.271 11.858 12 HD1 PHE 2 HD1 PHE 2 34.089 28.182 12.956 13 HD2 PHE 2 HD2 PHE 2 34.607 25.117 9.965 14 HE1 PHE 2 HE1 PHE 2 36.004 29.425 12.007 15 HE2 PHE 2 HE2 PHE 2 36.543 26.358 9.029 16 HZ PHE 2 HZ PHE 2 37.245 28.519 10.050 17 H CYS 3 H CYS 3 32.473 24.880 16.048 18 HA CYS 3 HA CYS 3 30.616 22.755 15.696 19 HB2 CYS 3 HB2 CYS 3 30.078 23.194 18.098 20 HB3 CYS 3 HB3 CYS 3 31.791 23.009 17.748 21 H ASN 4 H ASN 4 28.436 22.673 15.469 22 HA ASN 4 HA ASN 4 27.087 25.143 14.576 23 HB2 ASN 4 HB2 ASN 4 25.993 22.316 14.607 24 HB3 ASN 4 HB3 ASN 4 25.322 23.715 13.790 25 HD21 ASN 4 HD21 ASN 4 28.091 21.665 11.804 26 HD22 ASN 4 HD22 ASN 4 27.361 21.045 13.269 27 H LEU 5 H LEU 5 27.434 26.003 16.761 28 HA LEU 5 HA LEU 5 26.170 24.935 19.051 29 HB2 LEU 5 HB2 LEU 5 28.123 26.384 19.035 30 HB3 LEU 5 HB3 LEU 5 27.202 27.726 18.394 31 HG LEU 5 HG LEU 5 27.840 27.719 20.849 32 HD11 LEU 5 HD11 LEU 5 25.869 28.878 21.568 33 HD12 LEU 5 HD12 LEU 5 26.233 29.301 19.893 34 HD13 LEU 5 HD13 LEU 5 24.903 28.188 20.258 35 HD21 LEU 5 HD21 LEU 5 27.154 25.389 21.366 36 HD22 LEU 5 HD22 LEU 5 26.416 26.584 22.448 37 HD23 LEU 5 HD23 LEU 5 25.454 25.855 21.175 38 H ARG 6 H ARG 6 24.946 27.474 16.793 39 HA ARG 6 HA ARG 6 22.600 28.001 18.461 40 HB2 ARG 6 HB2 ARG 6 23.166 28.732 15.556 41 HB3 ARG 6 HB3 ARG 6 21.822 29.336 16.539 42 HG2 ARG 6 HG2 ARG 6 23.468 30.241 18.201 43 HG3 ARG 6 HG3 ARG 6 24.794 29.746 17.143 44 HD2 ARG 6 HD2 ARG 6 22.610 31.726 16.428 45 HD3 ARG 6 HD3 ARG 6 24.243 32.152 16.946 46 HE ARG 6 HE ARG 6 23.411 31.039 14.322 47 HH11 ARG 6 HH11 ARG 6 26.312 31.703 16.241 48 HH12 ARG 6 HH12 ARG 6 27.199 32.166 14.821 49 HH21 ARG 6 HH21 ARG 6 24.562 31.460 12.678 50 HH22 ARG 6 HH22 ARG 6 26.231 31.991 12.766 51 H ARG 7 H ARG 7 23.293 25.732 15.845 52 HA ARG 7 HA ARG 7 20.626 24.654 15.560 53 HB2 ARG 7 HB2 ARG 7 22.618 24.356 14.024 54 HB3 ARG 7 HB3 ARG 7 23.352 23.317 15.223 55 HG2 ARG 7 HG2 ARG 7 22.406 21.970 13.478 56 HG3 ARG 7 HG3 ARG 7 21.552 21.668 14.982 57 HD2 ARG 7 HD2 ARG 7 20.002 21.760 13.105 58 HD3 ARG 7 HD3 ARG 7 19.676 23.096 14.222 59 HE ARG 7 HE ARG 7 21.529 23.880 12.120 60 HH11 ARG 7 HH11 ARG 7 18.063 23.286 12.525 61 HH12 ARG 7 HH12 ARG 7 17.714 24.445 11.232 62 HH21 ARG 7 HH21 ARG 7 20.895 25.343 10.600 63 HH22 ARG 7 HH22 ARG 7 19.174 25.482 10.210 64 H CYS 8 H CYS 8 23.112 24.182 17.988 65 HA CYS 8 HA CYS 8 21.830 21.859 19.250 66 HB2 CYS 8 HB2 CYS 8 24.229 22.067 19.161 67 HB3 CYS 8 HB3 CYS 8 24.177 23.649 19.911 68 H GLU 9 H GLU 9 22.269 25.359 20.116 69 HA GLU 9 HA GLU 9 20.951 25.338 22.598 70 HB2 GLU 9 HB2 GLU 9 21.173 27.477 20.443 71 HB3 GLU 9 HB3 GLU 9 20.468 27.773 22.036 72 HG2 GLU 9 HG2 GLU 9 22.612 26.989 23.090 73 HG3 GLU 9 HG3 GLU 9 23.323 26.912 21.493 74 H LEU 10 H LEU 10 19.391 25.817 19.372 75 HA LEU 10 HA LEU 10 16.773 26.179 20.446 76 HB2 LEU 10 HB2 LEU 10 15.962 25.924 18.205 77 HB3 LEU 10 HB3 LEU 10 17.425 26.868 18.215 78 HG LEU 10 HG LEU 10 18.588 24.583 17.565 79 HD11 LEU 10 HD11 LEU 10 17.167 23.180 16.103 80 HD12 LEU 10 HD12 LEU 10 16.566 23.113 17.750 81 HD13 LEU 10 HD13 LEU 10 15.735 24.128 16.557 82 HD21 LEU 10 HD21 LEU 10 16.844 26.146 15.616 83 HD22 LEU 10 HD22 LEU 10 18.494 26.571 16.111 84 HD23 LEU 10 HD23 LEU 10 18.210 25.101 15.171 85 H SER 11 H SER 11 18.607 23.243 20.072 86 HA SER 11 HA SER 11 16.289 21.439 20.318 87 HB2 SER 11 HB2 SER 11 18.372 20.712 19.172 88 HB3 SER 11 HB3 SER 11 19.265 20.883 20.692 89 HG SER 11 HG SER 11 17.073 19.189 20.123 90 H CYS 12 H CYS 12 18.963 22.602 22.448 91 HA CYS 12 HA CYS 12 18.150 21.245 24.775 92 HB2 CYS 12 HB2 CYS 12 19.552 23.934 24.610 93 HB3 CYS 12 HB3 CYS 12 19.608 22.788 25.951 94 H ARG 13 H ARG 13 17.208 24.544 23.665 95 HA ARG 13 HA ARG 13 15.556 25.191 25.902 96 HB2 ARG 13 HB2 ARG 13 16.438 26.637 23.929 97 HB3 ARG 13 HB3 ARG 13 15.001 26.109 23.054 98 HG2 ARG 13 HG2 ARG 13 13.569 27.026 24.900 99 HG3 ARG 13 HG3 ARG 13 15.025 27.534 25.767 100 HD2 ARG 13 HD2 ARG 13 14.086 28.533 23.054 101 HD3 ARG 13 HD3 ARG 13 13.979 29.419 24.574 102 HE ARG 13 HE ARG 13 16.400 28.922 22.928 103 HH11 ARG 13 HH11 ARG 13 15.264 30.360 25.979 104 HH12 ARG 13 HH12 ARG 13 16.794 31.173 26.184 105 HH21 ARG 13 HH21 ARG 13 18.199 29.997 23.304 106 HH22 ARG 13 HH22 ARG 13 18.406 30.934 24.790 107 H SER 14 H SER 14 14.893 23.043 23.206 108 HA SER 14 HA SER 14 12.003 22.929 23.642 109 HB2 SER 14 HB2 SER 14 13.542 22.293 21.531 110 HB3 SER 14 HB3 SER 14 13.489 20.696 22.299 111 HG SER 14 HG SER 14 11.775 20.882 20.919 112 H LEU 15 H LEU 15 14.810 21.363 25.033 113 HA LEU 15 HA LEU 15 13.230 19.336 26.508 114 HB2 LEU 15 HB2 LEU 15 16.172 20.054 26.772 115 HB3 LEU 15 HB3 LEU 15 15.369 18.601 27.350 116 HG LEU 15 HG LEU 15 15.843 19.353 24.437 117 HD11 LEU 15 HD11 LEU 15 17.880 18.691 25.658 118 HD12 LEU 15 HD12 LEU 15 17.089 17.183 26.168 119 HD13 LEU 15 HD13 LEU 15 17.417 17.485 24.450 120 HD21 LEU 15 HD21 LEU 15 13.768 18.020 24.661 121 HD22 LEU 15 HD22 LEU 15 15.062 17.095 23.903 122 HD23 LEU 15 HD23 LEU 15 14.654 16.800 25.612 123 H GLY 16 H GLY 16 14.304 22.590 26.982 124 HA2 GLY 16 HA2 GLY 16 13.547 24.001 28.727 125 HA3 GLY 16 HA3 GLY 16 13.348 22.620 29.800 126 H LEU 17 H LEU 17 16.389 22.978 27.996 127 HA LEU 17 HA LEU 17 17.788 24.268 30.276 128 HB2 LEU 17 HB2 LEU 17 19.568 22.491 29.999 129 HB3 LEU 17 HB3 LEU 17 18.156 22.115 30.952 130 HG LEU 17 HG LEU 17 18.210 21.235 28.057 131 HD11 LEU 17 HD11 LEU 17 20.411 20.634 29.078 132 HD12 LEU 17 HD12 LEU 17 19.561 19.766 30.363 133 HD13 LEU 17 HD13 LEU 17 19.415 19.224 28.674 134 HD21 LEU 17 HD21 LEU 17 16.174 20.731 29.441 135 HD22 LEU 17 HD22 LEU 17 17.038 19.249 29.035 136 HD23 LEU 17 HD23 LEU 17 17.183 19.950 30.656 137 H LEU 18 H LEU 18 20.265 24.482 29.559 138 HA LEU 18 HA LEU 18 20.167 26.163 27.125 139 HB2 LEU 18 HB2 LEU 18 22.237 25.932 29.334 140 HB3 LEU 18 HB3 LEU 18 22.336 26.988 27.947 141 HG LEU 18 HG LEU 18 21.790 28.244 29.811 142 HD11 LEU 18 HD11 LEU 18 19.857 29.472 29.089 143 HD12 LEU 18 HD12 LEU 18 20.756 28.914 27.672 144 HD13 LEU 18 HD13 LEU 18 19.261 28.086 28.162 145 HD21 LEU 18 HD21 LEU 18 19.883 28.025 31.227 146 HD22 LEU 18 HD22 LEU 18 19.169 26.763 30.228 147 HD23 LEU 18 HD23 LEU 18 20.658 26.444 31.157 148 H GLY 19 H GLY 19 22.045 26.158 25.700 149 HA2 GLY 19 HA2 GLY 19 23.413 23.489 25.391 150 HA3 GLY 19 HA3 GLY 19 23.066 24.589 24.071 151 H LYS 20 H LYS 20 25.646 23.385 25.026 152 HA LYS 20 HA LYS 20 27.226 25.866 24.742 153 HB2 LYS 20 HB2 LYS 20 28.667 25.558 26.562 154 HB3 LYS 20 HB3 LYS 20 27.028 25.502 27.168 155 HG2 LYS 20 HG2 LYS 20 27.797 23.710 28.333 156 HG3 LYS 20 HG3 LYS 20 27.384 22.843 26.860 157 HD2 LYS 20 HD2 LYS 20 29.538 22.084 27.312 158 HD3 LYS 20 HD3 LYS 20 29.859 23.377 26.137 159 HE2 LYS 20 HE2 LYS 20 30.401 24.932 27.999 160 HE3 LYS 20 HE3 LYS 20 29.968 23.678 29.168 161 HZ1 LYS 20 HZ1 LYS 20 31.786 22.309 28.165 162 HZ2 LYS 20 HZ2 LYS 20 32.298 23.627 27.329 163 HZ3 LYS 20 HZ3 LYS 20 32.304 23.620 28.968 164 H CYS 21 H CYS 21 28.893 25.734 23.414 165 HA CYS 21 HA CYS 21 29.373 23.245 21.962 166 HB2 CYS 21 HB2 CYS 21 29.438 25.187 20.670 167 HB3 CYS 21 HB3 CYS 21 30.479 26.046 21.806 168 H ILE 22 H ILE 22 30.958 21.829 22.143 169 HA ILE 22 HA ILE 22 32.705 21.776 24.519 170 HB ILE 22 HB ILE 22 32.408 19.782 22.247 171 HG12 ILE 22 HG12 ILE 22 30.201 20.036 23.212 172 HG13 ILE 22 HG13 ILE 22 30.879 18.478 23.625 173 HG21 ILE 22 HG21 ILE 22 33.559 19.492 25.055 174 HG22 ILE 22 HG22 ILE 22 33.247 18.142 23.944 175 HG23 ILE 22 HG23 ILE 22 34.433 19.375 23.518 176 HD11 ILE 22 HD11 ILE 22 29.652 19.588 25.503 177 HD12 ILE 22 HD12 ILE 22 31.328 19.188 25.894 178 HD13 ILE 22 HD13 ILE 22 30.859 20.871 25.515 179 H GLY 23 H GLY 23 32.967 22.060 21.021 180 HA2 GLY 23 HA2 GLY 23 35.179 23.602 20.649 181 HA3 GLY 23 HA3 GLY 23 35.890 21.990 20.878 182 H GLU 24 H GLU 24 34.429 20.260 19.705 183 HA GLU 24 HA GLU 24 33.836 21.073 16.878 184 HB2 GLU 24 HB2 GLU 24 34.353 18.277 17.992 185 HB3 GLU 24 HB3 GLU 24 34.087 18.729 16.328 186 HG2 GLU 24 HG2 GLU 24 36.360 18.428 16.380 187 HG3 GLU 24 HG3 GLU 24 36.209 20.174 16.488 188 H ALA 25 H ALA 25 32.693 19.136 19.648 189 HA ALA 25 HA ALA 25 30.000 18.794 18.524 190 HB1 ALA 25 HB1 ALA 25 29.733 17.326 20.504 191 HB2 ALA 25 HB2 ALA 25 31.205 16.938 19.603 192 HB3 ALA 25 HB3 ALA 25 31.309 17.865 21.113 193 H CYS 26 H CYS 26 28.186 18.933 20.302 194 HA CYS 26 HA CYS 26 28.472 21.139 22.218 195 HB2 CYS 26 HB2 CYS 26 27.657 22.290 20.253 196 HB3 CYS 26 HB3 CYS 26 26.364 21.127 20.047 197 H LYS 27 H LYS 27 27.138 20.974 24.003 198 HA LYS 27 HA LYS 27 25.259 18.656 24.199 199 HB2 LYS 27 HB2 LYS 27 27.378 19.388 26.258 200 HB3 LYS 27 HB3 LYS 27 26.120 18.183 26.485 201 HG2 LYS 27 HG2 LYS 27 28.335 17.985 24.403 202 HG3 LYS 27 HG3 LYS 27 28.352 17.236 25.996 203 HD2 LYS 27 HD2 LYS 27 26.319 15.911 25.369 204 HD3 LYS 27 HD3 LYS 27 26.400 16.614 23.733 205 HE2 LYS 27 HE2 LYS 27 28.761 15.772 23.548 206 HE3 LYS 27 HE3 LYS 27 28.600 15.014 25.133 207 HZ1 LYS 27 HZ1 LYS 27 27.011 14.336 22.722 208 HZ2 LYS 27 HZ2 LYS 27 28.230 13.440 23.381 209 HZ3 LYS 27 HZ3 LYS 27 26.802 13.639 24.201 210 H CYS 28 H CYS 28 23.679 18.858 25.837 211 HA CYS 28 HA CYS 28 23.034 21.658 26.516 212 HB2 CYS 28 HB2 CYS 28 21.287 19.230 26.913 213 HB3 CYS 28 HB3 CYS 28 20.819 20.926 26.976 214 H VAL 29 H VAL 29 22.679 22.423 28.577 215 HA VAL 29 HA VAL 29 22.985 20.733 30.967 216 HB VAL 29 HB VAL 29 24.574 22.333 32.018 217 HG11 VAL 29 HG11 VAL 29 25.338 20.150 31.181 218 HG12 VAL 29 HG12 VAL 29 25.763 20.901 29.625 219 HG13 VAL 29 HG13 VAL 29 26.600 21.386 31.108 220 HG21 VAL 29 HG21 VAL 29 24.363 24.275 30.508 221 HG22 VAL 29 HG22 VAL 29 26.044 23.735 30.653 222 HG23 VAL 29 HG23 VAL 29 25.112 23.337 29.197 223 HA PRO 30 HA PRO 30 19.739 23.469 32.136 224 HB2 PRO 30 HB2 PRO 30 19.540 23.106 34.828 225 HB3 PRO 30 HB3 PRO 30 19.191 21.813 33.638 226 HG2 PRO 30 HG2 PRO 30 21.752 22.298 35.187 227 HG3 PRO 30 HG3 PRO 30 20.842 20.762 35.018 228 HD2 PRO 30 HD2 PRO 30 22.986 21.341 33.444 229 HD3 PRO 30 HD3 PRO 30 21.563 20.472 32.793 230 H TYR 31 H TYR 31 22.766 24.469 32.797 231 HA TYR 31 HA TYR 31 22.325 26.449 34.871 232 HB2 TYR 31 HB2 TYR 31 24.832 25.928 33.274 233 HB3 TYR 31 HB3 TYR 31 24.703 26.737 34.833 234 HD1 TYR 31 HD1 TYR 31 25.908 23.866 33.485 235 HD2 TYR 31 HD2 TYR 31 23.098 25.078 36.530 236 HE1 TYR 31 HE1 TYR 31 26.157 21.651 34.597 237 HE2 TYR 31 HE2 TYR 31 23.348 22.845 37.631 238 HH TYR 31 HH TYR 31 25.019 20.183 36.143
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