NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
24179 | 2k10 | 15665 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H1 GLY 1 12.944 -11.270 12.024 2 HA2 GLY 1 HA2 GLY 1 14.730 -10.560 10.430 3 HA3 GLY 1 HA3 GLY 1 13.451 -11.499 9.593 4 H ILE 2 H ILE 2 15.062 -9.588 8.162 5 HA ILE 2 HA ILE 2 13.364 -7.175 7.890 6 HB ILE 2 HB ILE 2 15.765 -8.103 6.228 7 HG12 ILE 2 HG12 ILE 2 15.495 -5.900 8.376 8 HG13 ILE 2 HG13 ILE 2 16.286 -7.477 8.611 9 HG21 ILE 2 HG21 ILE 2 15.630 -5.847 5.156 10 HG22 ILE 2 HG22 ILE 2 14.112 -6.718 4.906 11 HG23 ILE 2 HG23 ILE 2 14.204 -5.444 6.154 12 HD11 ILE 2 HD11 ILE 2 17.950 -6.884 6.775 13 HD12 ILE 2 HD12 ILE 2 17.261 -5.230 6.743 14 HD13 ILE 2 HD13 ILE 2 18.033 -5.841 8.223 15 H LEU 3 H LEU 3 14.359 -10.026 5.755 16 HA LEU 3 HA LEU 3 12.466 -9.612 3.842 17 HB2 LEU 3 HB2 LEU 3 12.468 -11.890 3.206 18 HB3 LEU 3 HB3 LEU 3 14.126 -11.478 3.693 19 HG LEU 3 HG LEU 3 12.101 -13.053 5.432 20 HD11 LEU 3 HD11 LEU 3 13.412 -15.080 4.791 21 HD12 LEU 3 HD12 LEU 3 14.433 -14.091 3.708 22 HD13 LEU 3 HD13 LEU 3 12.694 -14.310 3.357 23 HD21 LEU 3 HD21 LEU 3 13.861 -12.020 6.886 24 HD22 LEU 3 HD22 LEU 3 15.137 -12.607 5.781 25 HD23 LEU 3 HD23 LEU 3 14.158 -13.755 6.736 26 H SER 4 H SER 4 11.766 -10.974 7.154 27 HA SER 4 HA SER 4 9.150 -11.891 6.450 28 HB2 SER 4 HB2 SER 4 8.654 -11.773 8.884 29 HB3 SER 4 HB3 SER 4 10.232 -12.568 8.572 30 HG SER 4 HG SER 4 10.384 -10.877 10.253 31 H SER 5 H SER 5 10.412 -8.759 7.894 32 HA SER 5 HA SER 5 7.896 -7.489 8.032 33 HB2 SER 5 HB2 SER 5 10.615 -6.166 7.436 34 HB3 SER 5 HB3 SER 5 9.152 -5.353 8.074 35 HG SER 5 HG SER 5 10.633 -6.064 9.815 36 H PHE 6 H PHE 6 10.297 -7.664 5.267 37 HA PHE 6 HA PHE 6 8.778 -5.784 3.687 38 HB2 PHE 6 HB2 PHE 6 11.082 -7.656 3.003 39 HB3 PHE 6 HB3 PHE 6 10.062 -7.019 1.706 40 HD1 PHE 6 HD1 PHE 6 11.663 -5.670 4.884 41 HD2 PHE 6 HD2 PHE 6 10.830 -5.013 0.708 42 HE1 PHE 6 HE1 PHE 6 12.806 -3.485 4.993 43 HE2 PHE 6 HE2 PHE 6 11.985 -2.840 0.824 44 HZ PHE 6 HZ PHE 6 12.971 -2.060 2.966 45 H LYS 7 H LYS 7 9.121 -9.458 3.270 46 HA LYS 7 HA LYS 7 7.106 -9.485 1.341 47 HB2 LYS 7 HB2 LYS 7 6.880 -11.861 1.579 48 HB3 LYS 7 HB3 LYS 7 8.578 -11.428 1.866 49 HG2 LYS 7 HG2 LYS 7 8.224 -12.966 3.607 50 HG3 LYS 7 HG3 LYS 7 7.848 -11.445 4.444 51 HD2 LYS 7 HD2 LYS 7 5.346 -11.920 3.975 52 HD3 LYS 7 HD3 LYS 7 5.841 -13.452 3.224 53 HE2 LYS 7 HE2 LYS 7 6.859 -14.179 5.410 54 HE3 LYS 7 HE3 LYS 7 6.374 -12.628 6.150 55 HZ1 LYS 7 HZ1 LYS 7 4.765 -14.417 6.670 56 HZ2 LYS 7 HZ2 LYS 7 4.473 -14.691 4.978 57 HZ3 LYS 7 HZ3 LYS 7 4.004 -13.179 5.714 58 H GLY 8 H GLY 8 6.721 -9.314 4.961 59 HA2 GLY 8 HA2 GLY 8 3.929 -9.919 4.934 60 HA3 GLY 8 HA3 GLY 8 4.762 -8.942 6.167 61 H VAL 9 H VAL 9 5.747 -6.744 4.699 62 HA VAL 9 HA VAL 9 3.128 -5.364 4.277 63 HB VAL 9 HB VAL 9 5.936 -4.257 4.838 64 HG11 VAL 9 HG11 VAL 9 4.756 -2.078 5.172 65 HG12 VAL 9 HG12 VAL 9 4.581 -2.641 3.492 66 HG13 VAL 9 HG13 VAL 9 3.218 -2.815 4.637 67 HG21 VAL 9 HG21 VAL 9 3.461 -4.499 6.655 68 HG22 VAL 9 HG22 VAL 9 4.943 -5.486 6.791 69 HG23 VAL 9 HG23 VAL 9 5.016 -3.731 7.085 70 H ALA 10 H ALA 10 6.479 -5.326 2.776 71 HA ALA 10 HA ALA 10 5.780 -3.713 0.670 72 HB1 ALA 10 HB1 ALA 10 8.142 -4.352 1.184 73 HB2 ALA 10 HB2 ALA 10 7.835 -6.002 0.559 74 HB3 ALA 10 HB3 ALA 10 7.768 -4.598 -0.546 75 H LYS 11 H LYS 11 5.157 -7.308 0.880 76 HA LYS 11 HA LYS 11 5.123 -7.877 -1.777 77 HB2 LYS 11 HB2 LYS 11 3.492 -9.674 -1.435 78 HB3 LYS 11 HB3 LYS 11 4.678 -9.615 -0.111 79 HG2 LYS 11 HG2 LYS 11 2.940 -8.391 1.314 80 HG3 LYS 11 HG3 LYS 11 1.768 -8.551 -0.018 81 HD2 LYS 11 HD2 LYS 11 1.825 -11.002 0.085 82 HD3 LYS 11 HD3 LYS 11 3.107 -10.982 1.319 83 HE2 LYS 11 HE2 LYS 11 1.574 -9.787 2.913 84 HE3 LYS 11 HE3 LYS 11 0.276 -9.822 1.686 85 HZ1 LYS 11 HZ1 LYS 11 0.349 -12.300 1.729 86 HZ2 LYS 11 HZ2 LYS 11 0.026 -11.651 3.311 87 HZ3 LYS 11 HZ3 LYS 11 1.613 -12.253 2.934 88 H GLY 12 H GLY 12 2.387 -6.108 -0.100 89 HA2 GLY 12 HA2 GLY 12 0.979 -6.019 -2.771 90 HA3 GLY 12 HA3 GLY 12 0.249 -5.779 -1.174 91 H VAL 13 H VAL 13 3.414 -4.301 -2.134 92 HA VAL 13 HA VAL 13 2.325 -1.752 -1.347 93 HB VAL 13 HB VAL 13 4.712 -2.454 -1.001 94 HG11 VAL 13 HG11 VAL 13 5.109 -1.710 -3.976 95 HG12 VAL 13 HG12 VAL 13 6.390 -2.126 -2.806 96 HG13 VAL 13 HG13 VAL 13 5.233 -3.369 -3.334 97 HG21 VAL 13 HG21 VAL 13 3.951 -0.051 -0.780 98 HG22 VAL 13 HG22 VAL 13 5.665 -0.211 -1.250 99 HG23 VAL 13 HG23 VAL 13 4.451 0.203 -2.479 100 H ALA 14 H ALA 14 2.924 -3.346 -4.571 101 HA ALA 14 HA ALA 14 2.999 -1.179 -6.203 102 HB1 ALA 14 HB1 ALA 14 2.985 -3.493 -7.111 103 HB2 ALA 14 HB2 ALA 14 1.257 -3.681 -6.694 104 HB3 ALA 14 HB3 ALA 14 1.753 -2.506 -7.949 105 H LYS 15 H LYS 15 -0.123 -2.587 -4.891 106 HA LYS 15 HA LYS 15 -1.590 -0.283 -6.054 107 HB2 LYS 15 HB2 LYS 15 -2.625 -2.586 -4.306 108 HB3 LYS 15 HB3 LYS 15 -3.596 -1.339 -5.132 109 HG2 LYS 15 HG2 LYS 15 -2.745 -2.183 -7.372 110 HG3 LYS 15 HG3 LYS 15 -1.758 -3.389 -6.528 111 HD2 LYS 15 HD2 LYS 15 -3.728 -4.525 -7.345 112 HD3 LYS 15 HD3 LYS 15 -3.800 -4.465 -5.568 113 HE2 LYS 15 HE2 LYS 15 -6.015 -4.084 -6.554 114 HE3 LYS 15 HE3 LYS 15 -5.511 -2.617 -5.696 115 HZ1 LYS 15 HZ1 LYS 15 -6.571 -2.194 -7.919 116 HZ2 LYS 15 HZ2 LYS 15 -5.265 -3.032 -8.701 117 HZ3 LYS 15 HZ3 LYS 15 -4.982 -1.536 -7.837 118 H ASP 16 H ASP 16 -0.753 -1.651 -2.746 119 HA ASP 16 HA ASP 16 -2.478 0.185 -1.466 120 HB2 ASP 16 HB2 ASP 16 -1.560 -2.017 -0.521 121 HB3 ASP 16 HB3 ASP 16 -0.054 -1.138 -0.131 122 H LEU 17 H LEU 17 0.947 0.610 -2.522 123 HA LEU 17 HA LEU 17 1.667 2.666 -0.808 124 HB2 LEU 17 HB2 LEU 17 2.863 1.729 -3.159 125 HB3 LEU 17 HB3 LEU 17 2.332 3.300 -3.719 126 HG LEU 17 HG LEU 17 4.136 2.737 -1.283 127 HD11 LEU 17 HD11 LEU 17 5.932 3.767 -2.670 128 HD12 LEU 17 HD12 LEU 17 4.785 4.013 -4.018 129 HD13 LEU 17 HD13 LEU 17 5.247 2.361 -3.521 130 HD21 LEU 17 HD21 LEU 17 4.484 5.258 -1.256 131 HD22 LEU 17 HD22 LEU 17 2.823 4.795 -0.829 132 HD23 LEU 17 HD23 LEU 17 3.180 5.418 -2.470 133 H ALA 18 H ALA 18 -0.142 2.858 -3.969 134 HA ALA 18 HA ALA 18 -0.652 5.651 -3.818 135 HB1 ALA 18 HB1 ALA 18 -2.436 5.245 -5.478 136 HB2 ALA 18 HB2 ALA 18 -1.017 4.254 -5.897 137 HB3 ALA 18 HB3 ALA 18 -2.438 3.491 -5.120 138 H GLY 19 H GLY 19 -2.491 2.746 -2.519 139 HA2 GLY 19 HA2 GLY 19 -4.706 4.048 -1.500 140 HA3 GLY 19 HA3 GLY 19 -3.899 2.707 -0.651 141 H LYS 20 H LYS 20 -1.311 4.054 -0.024 142 HA LYS 20 HA LYS 20 -2.319 5.446 2.342 143 HB2 LYS 20 HB2 LYS 20 0.567 5.008 1.370 144 HB3 LYS 20 HB3 LYS 20 0.135 6.040 2.750 145 HG2 LYS 20 HG2 LYS 20 0.787 3.941 3.652 146 HG3 LYS 20 HG3 LYS 20 -0.969 4.101 3.898 147 HD2 LYS 20 HD2 LYS 20 -1.364 2.557 1.948 148 HD3 LYS 20 HD3 LYS 20 0.395 2.512 1.630 149 HE2 LYS 20 HE2 LYS 20 -0.048 0.477 2.788 150 HE3 LYS 20 HE3 LYS 20 0.676 1.522 4.019 151 HZ1 LYS 20 HZ1 LYS 20 -1.603 2.003 4.905 152 HZ2 LYS 20 HZ2 LYS 20 -1.294 0.301 4.867 153 HZ3 LYS 20 HZ3 LYS 20 -2.305 1.013 3.650 154 H LEU 21 H LEU 21 -0.152 6.486 -0.446 155 HA LEU 21 HA LEU 21 -0.086 9.168 0.549 156 HB2 LEU 21 HB2 LEU 21 0.306 8.225 -2.352 157 HB3 LEU 21 HB3 LEU 21 0.736 9.837 -1.727 158 HG LEU 21 HG LEU 21 2.046 7.175 -0.885 159 HD11 LEU 21 HD11 LEU 21 4.042 8.040 -2.089 160 HD12 LEU 21 HD12 LEU 21 3.156 9.526 -2.532 161 HD13 LEU 21 HD13 LEU 21 2.651 7.947 -3.199 162 HD21 LEU 21 HD21 LEU 21 2.645 10.045 0.047 163 HD22 LEU 21 HD22 LEU 21 3.730 8.650 0.309 164 HD23 LEU 21 HD23 LEU 21 2.132 8.669 1.073 165 H LEU 22 H LEU 22 -2.223 7.543 -1.874 166 HA LEU 22 HA LEU 22 -3.828 10.083 -2.046 167 HB2 LEU 22 HB2 LEU 22 -3.977 7.562 -3.759 168 HB3 LEU 22 HB3 LEU 22 -4.714 9.142 -4.105 169 HG LEU 22 HG LEU 22 -1.706 8.454 -4.142 170 HD11 LEU 22 HD11 LEU 22 -3.042 7.617 -6.107 171 HD12 LEU 22 HD12 LEU 22 -1.884 8.886 -6.577 172 HD13 LEU 22 HD13 LEU 22 -3.619 9.277 -6.414 173 HD21 LEU 22 HD21 LEU 22 -1.919 10.792 -3.330 174 HD22 LEU 22 HD22 LEU 22 -3.095 11.167 -4.627 175 HD23 LEU 22 HD23 LEU 22 -1.389 10.810 -5.024 176 H GLU 23 H GLU 23 -3.978 8.640 0.467 177 HA GLU 23 HA GLU 23 -6.194 6.826 0.411 178 HB2 GLU 23 HB2 GLU 23 -4.701 7.141 2.417 179 HB3 GLU 23 HB3 GLU 23 -5.382 8.771 2.660 180 HG2 GLU 23 HG2 GLU 23 -7.678 7.724 2.974 181 HG3 GLU 23 HG3 GLU 23 -6.954 6.111 2.759 182 H THR 24 H THR 24 -5.940 10.441 0.810 183 HA THR 24 HA THR 24 -8.553 11.072 1.249 184 HB THR 24 HB THR 24 -6.751 12.750 1.082 185 HG1 THR 24 HG1 THR 24 -8.204 14.341 0.083 186 HG21 THR 24 HG21 THR 24 -5.672 11.933 -1.107 187 HG22 THR 24 HG22 THR 24 -6.035 13.679 -1.116 188 HG23 THR 24 HG23 THR 24 -7.100 12.549 -1.987 189 H LEU 25 H LEU 25 -7.330 9.844 -1.924 190 HA LEU 25 HA LEU 25 -10.159 10.061 -2.880 191 HB2 LEU 25 HB2 LEU 25 -9.513 10.855 -5.048 192 HB3 LEU 25 HB3 LEU 25 -8.908 11.906 -3.754 193 HG LEU 25 HG LEU 25 -6.633 10.545 -4.073 194 HD11 LEU 25 HD11 LEU 25 -7.879 10.231 -6.891 195 HD12 LEU 25 HD12 LEU 25 -7.643 8.863 -5.789 196 HD13 LEU 25 HD13 LEU 25 -6.232 9.756 -6.398 197 HD21 LEU 25 HD21 LEU 25 -7.576 12.645 -6.107 198 HD22 LEU 25 HD22 LEU 25 -5.875 12.190 -5.790 199 HD23 LEU 25 HD23 LEU 25 -6.838 12.970 -4.512 200 H LYS 26 H LYS 26 -7.051 8.084 -3.417 201 HA LYS 26 HA LYS 26 -8.490 6.257 -5.053 202 HB2 LYS 26 HB2 LYS 26 -6.064 5.782 -3.239 203 HB3 LYS 26 HB3 LYS 26 -6.787 4.487 -4.211 204 HG2 LYS 26 HG2 LYS 26 -5.751 7.105 -5.462 205 HG3 LYS 26 HG3 LYS 26 -4.767 5.636 -5.220 206 HD2 LYS 26 HD2 LYS 26 -6.385 4.313 -6.637 207 HD3 LYS 26 HD3 LYS 26 -7.268 5.820 -7.006 208 HE2 LYS 26 HE2 LYS 26 -5.189 6.804 -8.001 209 HE3 LYS 26 HE3 LYS 26 -4.296 5.302 -7.635 210 HZ1 LYS 26 HZ1 LYS 26 -6.704 5.507 -9.471 211 HZ2 LYS 26 HZ2 LYS 26 -5.831 4.040 -9.099 212 HZ3 LYS 26 HZ3 LYS 26 -5.046 5.326 -9.967 213 H CYS 27 H CYS 27 -7.717 5.965 -1.444 214 HA CYS 27 HA CYS 27 -9.206 3.628 -1.164 215 HB2 CYS 27 HB2 CYS 27 -8.743 5.882 0.870 216 HB3 CYS 27 HB3 CYS 27 -9.599 4.378 1.294 217 H LYS 28 H LYS 28 -10.462 7.041 -1.195 218 HA LYS 28 HA LYS 28 -13.138 6.224 -0.435 219 HB2 LYS 28 HB2 LYS 28 -12.071 8.668 -1.954 220 HB3 LYS 28 HB3 LYS 28 -13.812 8.357 -1.801 221 HG2 LYS 28 HG2 LYS 28 -13.021 9.921 -0.043 222 HG3 LYS 28 HG3 LYS 28 -13.762 8.444 0.627 223 HD2 LYS 28 HD2 LYS 28 -11.499 7.504 1.140 224 HD3 LYS 28 HD3 LYS 28 -10.728 8.940 0.403 225 HE2 LYS 28 HE2 LYS 28 -11.770 10.401 2.140 226 HE3 LYS 28 HE3 LYS 28 -12.623 8.995 2.836 227 HZ1 LYS 28 HZ1 LYS 28 -9.611 9.326 2.696 228 HZ2 LYS 28 HZ2 LYS 28 -10.447 7.959 3.383 229 HZ3 LYS 28 HZ3 LYS 28 -10.593 9.530 4.115 230 H ILE 29 H ILE 29 -11.428 6.539 -3.649 231 HA ILE 29 HA ILE 29 -13.838 5.826 -5.090 232 HB ILE 29 HB ILE 29 -10.916 5.920 -5.966 233 HG12 ILE 29 HG12 ILE 29 -13.251 7.747 -6.781 234 HG13 ILE 29 HG13 ILE 29 -12.259 8.094 -5.355 235 HG21 ILE 29 HG21 ILE 29 -12.098 4.207 -7.345 236 HG22 ILE 29 HG22 ILE 29 -13.425 5.358 -7.661 237 HG23 ILE 29 HG23 ILE 29 -11.791 5.653 -8.318 238 HD11 ILE 29 HD11 ILE 29 -11.390 9.390 -7.235 239 HD12 ILE 29 HD12 ILE 29 -10.180 8.162 -6.773 240 HD13 ILE 29 HD13 ILE 29 -11.183 7.934 -8.237 241 H THR 30 H THR 30 -10.712 3.868 -4.763 242 HA THR 30 HA THR 30 -12.100 1.592 -5.720 243 HB THR 30 HB THR 30 -9.604 1.835 -5.875 244 HG1 THR 30 HG1 THR 30 -10.606 -0.317 -6.048 245 HG21 THR 30 HG21 THR 30 -9.584 0.998 -2.899 246 HG22 THR 30 HG22 THR 30 -9.064 2.593 -3.511 247 HG23 THR 30 HG23 THR 30 -8.173 1.126 -3.975 248 H GLY 31 H GLY 31 -11.691 2.793 -2.327 249 HA2 GLY 31 HA2 GLY 31 -12.806 1.911 -0.411 250 HA3 GLY 31 HA3 GLY 31 -13.463 0.600 -1.406 251 H CYS 32 H CYS 32 -10.352 1.885 0.019 252 HA CYS 32 HA CYS 32 -8.966 -0.609 -0.708 253 HB2 CYS 32 HB2 CYS 32 -6.953 0.410 0.192 254 HB3 CYS 32 HB3 CYS 32 -7.795 1.620 -0.812 Start of MODEL 2 1 H1 GLY 1 H1 GLY 1 12.354 -10.898 12.268 2 HA2 GLY 1 HA2 GLY 1 14.239 -10.392 10.714 3 HA3 GLY 1 HA3 GLY 1 12.947 -11.312 9.878 4 H ILE 2 H ILE 2 14.759 -9.527 8.461 5 HA ILE 2 HA ILE 2 13.188 -7.067 7.970 6 HB ILE 2 HB ILE 2 15.665 -8.167 6.539 7 HG12 ILE 2 HG12 ILE 2 15.323 -5.850 8.557 8 HG13 ILE 2 HG13 ILE 2 16.019 -7.446 8.929 9 HG21 ILE 2 HG21 ILE 2 14.190 -6.773 5.023 10 HG22 ILE 2 HG22 ILE 2 14.244 -5.450 6.223 11 HG23 ILE 2 HG23 ILE 2 15.725 -5.965 5.363 12 HD11 ILE 2 HD11 ILE 2 17.243 -5.335 7.048 13 HD12 ILE 2 HD12 ILE 2 17.864 -5.901 8.613 14 HD13 ILE 2 HD13 ILE 2 17.854 -7.011 7.214 15 H LEU 3 H LEU 3 14.171 -10.067 6.041 16 HA LEU 3 HA LEU 3 12.437 -9.470 3.935 17 HB2 LEU 3 HB2 LEU 3 12.589 -11.774 3.194 18 HB3 LEU 3 HB3 LEU 3 14.149 -11.205 3.813 19 HG LEU 3 HG LEU 3 13.358 -12.415 6.093 20 HD11 LEU 3 HD11 LEU 3 11.006 -13.037 5.255 21 HD12 LEU 3 HD12 LEU 3 11.977 -14.454 5.693 22 HD13 LEU 3 HD13 LEU 3 11.762 -14.013 3.977 23 HD21 LEU 3 HD21 LEU 3 14.322 -13.975 3.620 24 HD22 LEU 3 HD22 LEU 3 14.458 -14.534 5.314 25 HD23 LEU 3 HD23 LEU 3 15.357 -13.092 4.781 26 H SER 4 H SER 4 11.635 -10.926 7.171 27 HA SER 4 HA SER 4 9.031 -11.776 6.370 28 HB2 SER 4 HB2 SER 4 8.434 -11.723 8.764 29 HB3 SER 4 HB3 SER 4 10.029 -12.508 8.520 30 HG SER 4 HG SER 4 10.079 -10.853 10.244 31 H SER 5 H SER 5 10.230 -8.684 7.934 32 HA SER 5 HA SER 5 7.730 -7.405 7.989 33 HB2 SER 5 HB2 SER 5 10.466 -6.093 7.445 34 HB3 SER 5 HB3 SER 5 8.989 -5.265 8.032 35 HG SER 5 HG SER 5 10.419 -5.961 9.821 36 H PHE 6 H PHE 6 10.171 -7.604 5.267 37 HA PHE 6 HA PHE 6 8.686 -5.723 3.651 38 HB2 PHE 6 HB2 PHE 6 10.985 -7.618 3.006 39 HB3 PHE 6 HB3 PHE 6 10.004 -6.938 1.699 40 HD1 PHE 6 HD1 PHE 6 11.684 -5.732 4.895 41 HD2 PHE 6 HD2 PHE 6 10.702 -4.861 0.792 42 HE1 PHE 6 HE1 PHE 6 12.872 -3.577 5.064 43 HE2 PHE 6 HE2 PHE 6 11.906 -2.717 0.966 44 HZ PHE 6 HZ PHE 6 12.997 -2.064 3.100 45 H LYS 7 H LYS 7 9.020 -9.407 3.236 46 HA LYS 7 HA LYS 7 7.035 -9.351 1.269 47 HB2 LYS 7 HB2 LYS 7 6.867 -11.704 1.300 48 HB3 LYS 7 HB3 LYS 7 8.539 -11.303 1.727 49 HG2 LYS 7 HG2 LYS 7 7.967 -13.094 3.158 50 HG3 LYS 7 HG3 LYS 7 7.837 -11.665 4.216 51 HD2 LYS 7 HD2 LYS 7 5.375 -11.803 4.165 52 HD3 LYS 7 HD3 LYS 7 5.397 -12.903 2.767 53 HE2 LYS 7 HE2 LYS 7 4.805 -14.052 4.878 54 HE3 LYS 7 HE3 LYS 7 6.276 -14.736 4.147 55 HZ1 LYS 7 HZ1 LYS 7 7.664 -13.660 5.779 56 HZ2 LYS 7 HZ2 LYS 7 6.378 -14.405 6.644 57 HZ3 LYS 7 HZ3 LYS 7 6.336 -12.683 6.388 58 H GLY 8 H GLY 8 6.615 -9.272 4.857 59 HA2 GLY 8 HA2 GLY 8 3.832 -9.893 4.836 60 HA3 GLY 8 HA3 GLY 8 4.649 -8.877 6.046 61 H VAL 9 H VAL 9 5.577 -6.671 4.604 62 HA VAL 9 HA VAL 9 2.927 -5.394 4.050 63 HB VAL 9 HB VAL 9 5.651 -4.162 4.737 64 HG11 VAL 9 HG11 VAL 9 4.350 -2.040 5.005 65 HG12 VAL 9 HG12 VAL 9 4.279 -2.618 3.322 66 HG13 VAL 9 HG13 VAL 9 2.877 -2.854 4.406 67 HG21 VAL 9 HG21 VAL 9 3.109 -4.524 6.440 68 HG22 VAL 9 HG22 VAL 9 4.636 -5.427 6.652 69 HG23 VAL 9 HG23 VAL 9 4.597 -3.669 6.938 70 H ALA 10 H ALA 10 6.346 -5.249 2.712 71 HA ALA 10 HA ALA 10 5.726 -3.658 0.572 72 HB1 ALA 10 HB1 ALA 10 7.772 -5.962 0.531 73 HB2 ALA 10 HB2 ALA 10 7.755 -4.555 -0.572 74 HB3 ALA 10 HB3 ALA 10 8.070 -4.316 1.170 75 H LYS 11 H LYS 11 5.070 -7.243 0.767 76 HA LYS 11 HA LYS 11 5.043 -7.807 -1.900 77 HB2 LYS 11 HB2 LYS 11 3.365 -9.557 -1.568 78 HB3 LYS 11 HB3 LYS 11 4.545 -9.541 -0.238 79 HG2 LYS 11 HG2 LYS 11 2.845 -8.294 1.198 80 HG3 LYS 11 HG3 LYS 11 1.675 -8.379 -0.145 81 HD2 LYS 11 HD2 LYS 11 1.678 -10.850 -0.095 82 HD3 LYS 11 HD3 LYS 11 2.911 -10.867 1.189 83 HE2 LYS 11 HE2 LYS 11 1.334 -9.653 2.729 84 HE3 LYS 11 HE3 LYS 11 0.090 -9.653 1.449 85 HZ1 LYS 11 HZ1 LYS 11 1.324 -12.120 2.731 86 HZ2 LYS 11 HZ2 LYS 11 0.110 -12.132 1.475 87 HZ3 LYS 11 HZ3 LYS 11 -0.265 -11.488 3.047 88 H GLY 12 H GLY 12 2.387 -5.937 -0.215 89 HA2 GLY 12 HA2 GLY 12 0.971 -5.778 -2.877 90 HA3 GLY 12 HA3 GLY 12 0.269 -5.499 -1.275 91 H VAL 13 H VAL 13 3.498 -4.174 -2.284 92 HA VAL 13 HA VAL 13 2.602 -1.600 -1.429 93 HB VAL 13 HB VAL 13 4.972 -2.303 -1.278 94 HG11 VAL 13 HG11 VAL 13 5.181 -1.754 -4.313 95 HG12 VAL 13 HG12 VAL 13 6.517 -2.146 -3.204 96 HG13 VAL 13 HG13 VAL 13 5.293 -3.377 -3.580 97 HG21 VAL 13 HG21 VAL 13 5.954 -0.101 -1.765 98 HG22 VAL 13 HG22 VAL 13 4.642 0.274 -2.909 99 HG23 VAL 13 HG23 VAL 13 4.294 0.140 -1.159 100 H ALA 14 H ALA 14 2.986 -3.066 -4.771 101 HA ALA 14 HA ALA 14 3.019 -0.744 -6.204 102 HB1 ALA 14 HB1 ALA 14 1.883 -1.950 -8.092 103 HB2 ALA 14 HB2 ALA 14 3.150 -2.947 -7.318 104 HB3 ALA 14 HB3 ALA 14 1.427 -3.268 -6.972 105 H LYS 15 H LYS 15 -0.107 -2.412 -5.221 106 HA LYS 15 HA LYS 15 -1.626 -0.109 -6.225 107 HB2 LYS 15 HB2 LYS 15 -2.588 -2.373 -6.342 108 HB3 LYS 15 HB3 LYS 15 -2.495 -2.551 -4.569 109 HG2 LYS 15 HG2 LYS 15 -4.105 -0.669 -4.254 110 HG3 LYS 15 HG3 LYS 15 -4.176 -0.409 -6.020 111 HD2 LYS 15 HD2 LYS 15 -5.152 -2.688 -6.338 112 HD3 LYS 15 HD3 LYS 15 -4.993 -3.024 -4.591 113 HE2 LYS 15 HE2 LYS 15 -6.577 -1.170 -4.063 114 HE3 LYS 15 HE3 LYS 15 -6.742 -0.792 -5.803 115 HZ1 LYS 15 HZ1 LYS 15 -8.612 -2.169 -4.977 116 HZ2 LYS 15 HZ2 LYS 15 -7.513 -3.423 -4.490 117 HZ3 LYS 15 HZ3 LYS 15 -7.698 -3.033 -6.182 118 H ASP 16 H ASP 16 -0.819 -1.511 -2.925 119 HA ASP 16 HA ASP 16 -2.553 0.340 -1.659 120 HB2 ASP 16 HB2 ASP 16 -1.719 -1.885 -0.711 121 HB3 ASP 16 HB3 ASP 16 -0.187 -1.061 -0.303 122 H LEU 17 H LEU 17 0.804 0.849 -2.805 123 HA LEU 17 HA LEU 17 1.617 2.706 -0.888 124 HB2 LEU 17 HB2 LEU 17 2.882 1.873 -3.108 125 HB3 LEU 17 HB3 LEU 17 2.225 3.347 -3.822 126 HG LEU 17 HG LEU 17 4.103 3.047 -1.386 127 HD11 LEU 17 HD11 LEU 17 5.165 2.751 -3.654 128 HD12 LEU 17 HD12 LEU 17 5.758 4.217 -2.833 129 HD13 LEU 17 HD13 LEU 17 4.551 4.357 -4.142 130 HD21 LEU 17 HD21 LEU 17 2.686 4.960 -0.842 131 HD22 LEU 17 HD22 LEU 17 2.808 5.602 -2.514 132 HD23 LEU 17 HD23 LEU 17 4.231 5.604 -1.427 133 H ALA 18 H ALA 18 -0.236 3.269 -4.003 134 HA ALA 18 HA ALA 18 -0.765 6.025 -3.515 135 HB1 ALA 18 HB1 ALA 18 -1.219 5.023 -5.728 136 HB2 ALA 18 HB2 ALA 18 -2.436 3.921 -5.025 137 HB3 ALA 18 HB3 ALA 18 -2.744 5.687 -5.070 138 H GLY 19 H GLY 19 -2.536 2.986 -2.457 139 HA2 GLY 19 HA2 GLY 19 -4.722 4.137 -1.234 140 HA3 GLY 19 HA3 GLY 19 -3.852 2.749 -0.533 141 H LYS 20 H LYS 20 -1.262 4.274 0.013 142 HA LYS 20 HA LYS 20 -2.222 5.520 2.512 143 HB2 LYS 20 HB2 LYS 20 0.649 5.149 1.474 144 HB3 LYS 20 HB3 LYS 20 0.195 6.034 2.945 145 HG2 LYS 20 HG2 LYS 20 0.899 3.867 3.632 146 HG3 LYS 20 HG3 LYS 20 -0.861 3.959 3.897 147 HD2 LYS 20 HD2 LYS 20 -1.259 2.572 1.871 148 HD3 LYS 20 HD3 LYS 20 0.472 2.678 1.428 149 HE2 LYS 20 HE2 LYS 20 0.152 0.491 2.355 150 HE3 LYS 20 HE3 LYS 20 1.049 1.417 3.570 151 HZ1 LYS 20 HZ1 LYS 20 -1.039 1.737 4.857 152 HZ2 LYS 20 HZ2 LYS 20 -0.771 0.056 4.554 153 HZ3 LYS 20 HZ3 LYS 20 -1.954 0.914 3.616 154 H LEU 21 H LEU 21 -0.111 6.623 -0.323 155 HA LEU 21 HA LEU 21 -0.052 9.281 0.781 156 HB2 LEU 21 HB2 LEU 21 0.456 8.421 -2.127 157 HB3 LEU 21 HB3 LEU 21 0.831 10.023 -1.445 158 HG LEU 21 HG LEU 21 2.140 7.363 -0.601 159 HD11 LEU 21 HD11 LEU 21 2.813 8.173 -2.895 160 HD12 LEU 21 HD12 LEU 21 4.168 8.263 -1.741 161 HD13 LEU 21 HD13 LEU 21 3.280 9.746 -2.189 162 HD21 LEU 21 HD21 LEU 21 3.778 8.842 0.654 163 HD22 LEU 21 HD22 LEU 21 2.158 8.839 1.371 164 HD23 LEU 21 HD23 LEU 21 2.689 10.229 0.373 165 H LEU 22 H LEU 22 -1.989 7.789 -1.906 166 HA LEU 22 HA LEU 22 -3.687 10.273 -1.946 167 HB2 LEU 22 HB2 LEU 22 -3.657 7.853 -3.817 168 HB3 LEU 22 HB3 LEU 22 -4.509 9.395 -4.080 169 HG LEU 22 HG LEU 22 -1.453 8.939 -4.071 170 HD11 LEU 22 HD11 LEU 22 -3.376 9.711 -6.352 171 HD12 LEU 22 HD12 LEU 22 -2.651 8.095 -6.113 172 HD13 LEU 22 HD13 LEU 22 -1.608 9.490 -6.492 173 HD21 LEU 22 HD21 LEU 22 -1.310 11.357 -4.837 174 HD22 LEU 22 HD22 LEU 22 -1.859 11.206 -3.156 175 HD23 LEU 22 HD23 LEU 22 -3.045 11.554 -4.453 176 H GLU 23 H GLU 23 -3.932 8.879 0.483 177 HA GLU 23 HA GLU 23 -5.939 6.849 0.285 178 HB2 GLU 23 HB2 GLU 23 -4.551 7.307 2.378 179 HB3 GLU 23 HB3 GLU 23 -5.504 8.789 2.637 180 HG2 GLU 23 HG2 GLU 23 -7.606 7.333 2.729 181 HG3 GLU 23 HG3 GLU 23 -6.580 5.888 2.559 182 H THR 24 H THR 24 -6.036 10.451 0.804 183 HA THR 24 HA THR 24 -8.683 10.883 1.149 184 HB THR 24 HB THR 24 -7.016 12.699 1.029 185 HG1 THR 24 HG1 THR 24 -8.548 14.176 -0.024 186 HG21 THR 24 HG21 THR 24 -5.807 11.959 -1.122 187 HG22 THR 24 HG22 THR 24 -6.288 13.676 -1.130 188 HG23 THR 24 HG23 THR 24 -7.242 12.487 -2.047 189 H LEU 25 H LEU 25 -7.279 9.862 -2.029 190 HA LEU 25 HA LEU 25 -10.101 9.784 -3.034 191 HB2 LEU 25 HB2 LEU 25 -9.513 10.706 -5.161 192 HB3 LEU 25 HB3 LEU 25 -9.025 11.781 -3.837 193 HG LEU 25 HG LEU 25 -6.614 10.667 -4.173 194 HD11 LEU 25 HD11 LEU 25 -6.123 10.010 -6.523 195 HD12 LEU 25 HD12 LEU 25 -7.818 10.298 -7.002 196 HD13 LEU 25 HD13 LEU 25 -7.410 8.935 -5.945 197 HD21 LEU 25 HD21 LEU 25 -7.770 12.708 -6.155 198 HD22 LEU 25 HD22 LEU 25 -6.030 12.436 -5.841 199 HD23 LEU 25 HD23 LEU 25 -7.076 13.073 -4.550 200 H LYS 26 H LYS 26 -6.766 8.228 -3.570 201 HA LYS 26 HA LYS 26 -7.901 6.353 -5.354 202 HB2 LYS 26 HB2 LYS 26 -5.411 6.644 -4.993 203 HB3 LYS 26 HB3 LYS 26 -5.568 5.851 -3.412 204 HG2 LYS 26 HG2 LYS 26 -4.819 4.137 -4.858 205 HG3 LYS 26 HG3 LYS 26 -6.543 3.786 -4.659 206 HD2 LYS 26 HD2 LYS 26 -7.036 4.679 -6.920 207 HD3 LYS 26 HD3 LYS 26 -5.415 5.414 -7.034 208 HE2 LYS 26 HE2 LYS 26 -5.441 3.451 -8.443 209 HE3 LYS 26 HE3 LYS 26 -4.348 3.152 -7.071 210 HZ1 LYS 26 HZ1 LYS 26 -6.134 1.794 -5.993 211 HZ2 LYS 26 HZ2 LYS 26 -5.751 1.197 -7.573 212 HZ3 LYS 26 HZ3 LYS 26 -7.189 2.139 -7.356 213 H CYS 27 H CYS 27 -7.309 6.155 -1.719 214 HA CYS 27 HA CYS 27 -8.284 3.537 -1.543 215 HB2 CYS 27 HB2 CYS 27 -7.048 4.613 0.348 216 HB3 CYS 27 HB3 CYS 27 -8.484 5.638 0.679 217 H LYS 28 H LYS 28 -10.067 6.715 -1.350 218 HA LYS 28 HA LYS 28 -12.578 5.490 -0.619 219 HB2 LYS 28 HB2 LYS 28 -11.894 8.148 -2.005 220 HB3 LYS 28 HB3 LYS 28 -13.572 7.589 -1.857 221 HG2 LYS 28 HG2 LYS 28 -13.018 9.143 -0.032 222 HG3 LYS 28 HG3 LYS 28 -13.488 7.535 0.577 223 HD2 LYS 28 HD2 LYS 28 -11.093 6.967 1.015 224 HD3 LYS 28 HD3 LYS 28 -10.586 8.536 0.321 225 HE2 LYS 28 HE2 LYS 28 -11.799 9.753 2.124 226 HE3 LYS 28 HE3 LYS 28 -12.412 8.212 2.785 227 HZ1 LYS 28 HZ1 LYS 28 -10.111 7.509 3.285 228 HZ2 LYS 28 HZ2 LYS 28 -10.463 9.030 4.049 229 HZ3 LYS 28 HZ3 LYS 28 -9.487 8.999 2.611 230 H ILE 29 H ILE 29 -11.047 6.279 -3.839 231 HA ILE 29 HA ILE 29 -13.393 5.549 -5.305 232 HB ILE 29 HB ILE 29 -10.462 5.721 -6.149 233 HG12 ILE 29 HG12 ILE 29 -12.838 7.499 -6.972 234 HG13 ILE 29 HG13 ILE 29 -11.914 7.832 -5.499 235 HG21 ILE 29 HG21 ILE 29 -12.916 5.133 -7.914 236 HG22 ILE 29 HG22 ILE 29 -11.288 5.529 -8.534 237 HG23 ILE 29 HG23 ILE 29 -11.540 4.032 -7.624 238 HD11 ILE 29 HD11 ILE 29 -9.788 8.028 -6.843 239 HD12 ILE 29 HD12 ILE 29 -10.735 7.821 -8.346 240 HD13 ILE 29 HD13 ILE 29 -11.027 9.228 -7.296 241 H THR 30 H THR 30 -10.288 3.598 -4.919 242 HA THR 30 HA THR 30 -11.622 1.299 -5.993 243 HB THR 30 HB THR 30 -9.100 1.678 -5.967 244 HG1 THR 30 HG1 THR 30 -9.998 -0.465 -6.429 245 HG21 THR 30 HG21 THR 30 -7.776 1.011 -4.024 246 HG22 THR 30 HG22 THR 30 -9.221 0.466 -3.135 247 HG23 THR 30 HG23 THR 30 -8.952 2.204 -3.430 248 H GLY 31 H GLY 31 -11.533 2.643 -2.673 249 HA2 GLY 31 HA2 GLY 31 -12.712 1.843 -0.801 250 HA3 GLY 31 HA3 GLY 31 -13.279 0.464 -1.765 251 H CYS 32 H CYS 32 -9.996 1.824 -0.789 252 HA CYS 32 HA CYS 32 -8.895 -0.824 -0.674 253 HB2 CYS 32 HB2 CYS 32 -6.849 0.075 0.066 254 HB3 CYS 32 HB3 CYS 32 -7.494 1.348 -0.989 Start of MODEL 3 1 H1 GLY 1 H1 GLY 1 12.641 -9.399 12.231 2 HA2 GLY 1 HA2 GLY 1 14.362 -10.420 10.732 3 HA3 GLY 1 HA3 GLY 1 13.020 -11.350 10.000 4 H ILE 2 H ILE 2 14.721 -9.591 8.428 5 HA ILE 2 HA ILE 2 13.107 -7.139 8.013 6 HB ILE 2 HB ILE 2 15.525 -8.199 6.463 7 HG12 ILE 2 HG12 ILE 2 15.266 -5.932 8.554 8 HG13 ILE 2 HG13 ILE 2 15.999 -7.526 8.848 9 HG21 ILE 2 HG21 ILE 2 14.081 -5.480 6.277 10 HG22 ILE 2 HG22 ILE 2 15.516 -5.975 5.332 11 HG23 ILE 2 HG23 ILE 2 13.965 -6.781 5.058 12 HD11 ILE 2 HD11 ILE 2 17.804 -5.953 8.482 13 HD12 ILE 2 HD12 ILE 2 17.737 -7.026 7.055 14 HD13 ILE 2 HD13 ILE 2 17.100 -5.353 6.965 15 H LEU 3 H LEU 3 14.018 -10.160 6.079 16 HA LEU 3 HA LEU 3 12.159 -9.643 4.029 17 HB2 LEU 3 HB2 LEU 3 13.075 -12.313 5.229 18 HB3 LEU 3 HB3 LEU 3 12.005 -12.247 3.814 19 HG LEU 3 HG LEU 3 14.761 -10.880 3.812 20 HD11 LEU 3 HD11 LEU 3 14.030 -13.713 2.836 21 HD12 LEU 3 HD12 LEU 3 15.092 -13.319 4.220 22 HD13 LEU 3 HD13 LEU 3 15.597 -12.894 2.565 23 HD21 LEU 3 HD21 LEU 3 13.193 -10.063 2.007 24 HD22 LEU 3 HD22 LEU 3 12.874 -11.750 1.522 25 HD23 LEU 3 HD23 LEU 3 14.496 -11.040 1.309 26 H SER 4 H SER 4 11.621 -11.284 7.266 27 HA SER 4 HA SER 4 8.994 -12.079 6.729 28 HB2 SER 4 HB2 SER 4 8.536 -11.915 9.161 29 HB3 SER 4 HB3 SER 4 10.144 -12.654 8.870 30 HG SER 4 HG SER 4 10.218 -10.897 10.491 31 H SER 5 H SER 5 10.225 -8.860 7.990 32 HA SER 5 HA SER 5 7.628 -7.698 8.165 33 HB2 SER 5 HB2 SER 5 10.302 -6.266 7.624 34 HB3 SER 5 HB3 SER 5 8.811 -5.504 8.236 35 HG SER 5 HG SER 5 9.083 -6.945 10.134 36 H PHE 6 H PHE 6 10.047 -7.773 5.409 37 HA PHE 6 HA PHE 6 8.500 -5.886 3.867 38 HB2 PHE 6 HB2 PHE 6 10.828 -7.714 3.141 39 HB3 PHE 6 HB3 PHE 6 9.805 -7.047 1.861 40 HD1 PHE 6 HD1 PHE 6 11.372 -5.751 5.084 41 HD2 PHE 6 HD2 PHE 6 10.573 -5.021 0.914 42 HE1 PHE 6 HE1 PHE 6 12.516 -3.574 5.242 43 HE2 PHE 6 HE2 PHE 6 11.739 -2.857 1.076 44 HZ PHE 6 HZ PHE 6 12.710 -2.118 3.240 45 H LYS 7 H LYS 7 8.849 -9.561 3.474 46 HA LYS 7 HA LYS 7 6.805 -9.609 1.546 47 HB2 LYS 7 HB2 LYS 7 6.621 -11.978 1.795 48 HB3 LYS 7 HB3 LYS 7 8.317 -11.530 2.064 49 HG2 LYS 7 HG2 LYS 7 7.992 -13.082 3.794 50 HG3 LYS 7 HG3 LYS 7 7.648 -11.570 4.647 51 HD2 LYS 7 HD2 LYS 7 5.107 -12.061 4.170 52 HD3 LYS 7 HD3 LYS 7 5.645 -13.581 3.431 53 HE2 LYS 7 HE2 LYS 7 4.972 -14.194 5.628 54 HE3 LYS 7 HE3 LYS 7 6.749 -14.145 5.721 55 HZ1 LYS 7 HZ1 LYS 7 4.791 -12.020 6.680 56 HZ2 LYS 7 HZ2 LYS 7 6.508 -11.823 6.742 57 HZ3 LYS 7 HZ3 LYS 7 5.751 -13.072 7.672 58 H GLY 8 H GLY 8 6.566 -9.477 5.181 59 HA2 GLY 8 HA2 GLY 8 3.800 -10.060 5.346 60 HA3 GLY 8 HA3 GLY 8 4.693 -9.020 6.476 61 H VAL 9 H VAL 9 5.542 -6.889 4.849 62 HA VAL 9 HA VAL 9 2.878 -5.551 4.560 63 HB VAL 9 HB VAL 9 5.690 -4.412 5.043 64 HG11 VAL 9 HG11 VAL 9 4.503 -2.247 5.422 65 HG12 VAL 9 HG12 VAL 9 4.297 -2.801 3.742 66 HG13 VAL 9 HG13 VAL 9 2.958 -2.990 4.914 67 HG21 VAL 9 HG21 VAL 9 4.757 -5.661 7.010 68 HG22 VAL 9 HG22 VAL 9 4.833 -3.907 7.314 69 HG23 VAL 9 HG23 VAL 9 3.268 -4.677 6.926 70 H ALA 10 H ALA 10 6.177 -5.454 2.940 71 HA ALA 10 HA ALA 10 5.140 -3.845 0.861 72 HB1 ALA 10 HB1 ALA 10 7.343 -4.195 -0.259 73 HB2 ALA 10 HB2 ALA 10 7.570 -3.901 1.488 74 HB3 ALA 10 HB3 ALA 10 7.693 -5.563 0.838 75 H LYS 11 H LYS 11 4.660 -7.359 1.157 76 HA LYS 11 HA LYS 11 5.188 -8.122 -1.428 77 HB2 LYS 11 HB2 LYS 11 3.539 -9.887 -1.328 78 HB3 LYS 11 HB3 LYS 11 4.400 -9.765 0.221 79 HG2 LYS 11 HG2 LYS 11 2.388 -8.604 1.232 80 HG3 LYS 11 HG3 LYS 11 1.598 -8.591 -0.358 81 HD2 LYS 11 HD2 LYS 11 0.568 -10.368 0.867 82 HD3 LYS 11 HD3 LYS 11 1.524 -11.051 -0.466 83 HE2 LYS 11 HE2 LYS 11 1.789 -12.469 1.467 84 HE3 LYS 11 HE3 LYS 11 3.349 -11.659 1.228 85 HZ1 LYS 11 HZ1 LYS 11 1.199 -10.843 3.235 86 HZ2 LYS 11 HZ2 LYS 11 2.758 -10.086 3.056 87 HZ3 LYS 11 HZ3 LYS 11 2.642 -11.730 3.602 88 H GLY 12 H GLY 12 2.292 -6.186 -0.359 89 HA2 GLY 12 HA2 GLY 12 1.443 -6.086 -3.266 90 HA3 GLY 12 HA3 GLY 12 0.378 -5.932 -1.853 91 H VAL 13 H VAL 13 3.687 -4.454 -2.298 92 HA VAL 13 HA VAL 13 2.658 -1.953 -1.404 93 HB VAL 13 HB VAL 13 5.075 -2.683 -1.208 94 HG11 VAL 13 HG11 VAL 13 5.469 -3.428 -3.600 95 HG12 VAL 13 HG12 VAL 13 5.324 -1.726 -4.133 96 HG13 VAL 13 HG13 VAL 13 6.656 -2.216 -3.055 97 HG21 VAL 13 HG21 VAL 13 6.001 -0.406 -1.360 98 HG22 VAL 13 HG22 VAL 13 4.669 0.087 -2.434 99 HG23 VAL 13 HG23 VAL 13 4.334 -0.333 -0.728 100 H ALA 14 H ALA 14 3.133 -3.361 -4.733 101 HA ALA 14 HA ALA 14 3.195 -1.081 -6.216 102 HB1 ALA 14 HB1 ALA 14 3.248 -3.309 -7.279 103 HB2 ALA 14 HB2 ALA 14 1.528 -3.586 -6.887 104 HB3 ALA 14 HB3 ALA 14 1.984 -2.306 -8.051 105 H LYS 15 H LYS 15 0.009 -2.648 -5.195 106 HA LYS 15 HA LYS 15 -1.408 -0.290 -6.203 107 HB2 LYS 15 HB2 LYS 15 -2.392 -2.641 -6.196 108 HB3 LYS 15 HB3 LYS 15 -2.506 -2.543 -4.421 109 HG2 LYS 15 HG2 LYS 15 -3.932 -0.398 -4.739 110 HG3 LYS 15 HG3 LYS 15 -3.899 -0.730 -6.492 111 HD2 LYS 15 HD2 LYS 15 -4.957 -3.028 -5.981 112 HD3 LYS 15 HD3 LYS 15 -5.090 -2.516 -4.275 113 HE2 LYS 15 HE2 LYS 15 -6.470 -0.501 -5.066 114 HE3 LYS 15 HE3 LYS 15 -6.421 -1.178 -6.716 115 HZ1 LYS 15 HZ1 LYS 15 -7.529 -3.245 -5.827 116 HZ2 LYS 15 HZ2 LYS 15 -8.497 -1.815 -5.630 117 HZ3 LYS 15 HZ3 LYS 15 -7.654 -2.480 -4.262 118 H ASP 16 H ASP 16 -0.645 -1.756 -2.934 119 HA ASP 16 HA ASP 16 -2.258 -0.000 -1.500 120 HB2 ASP 16 HB2 ASP 16 -1.218 -2.083 -0.552 121 HB3 ASP 16 HB3 ASP 16 0.378 -1.278 -0.570 122 H LEU 17 H LEU 17 1.151 0.553 -2.617 123 HA LEU 17 HA LEU 17 1.752 2.660 -0.916 124 HB2 LEU 17 HB2 LEU 17 3.091 1.668 -3.153 125 HB3 LEU 17 HB3 LEU 17 2.556 3.205 -3.810 126 HG LEU 17 HG LEU 17 4.244 2.755 -1.264 127 HD11 LEU 17 HD11 LEU 17 6.093 3.772 -2.587 128 HD12 LEU 17 HD12 LEU 17 5.014 3.952 -4.001 129 HD13 LEU 17 HD13 LEU 17 5.468 2.325 -3.418 130 HD21 LEU 17 HD21 LEU 17 4.554 5.283 -1.301 131 HD22 LEU 17 HD22 LEU 17 2.886 4.799 -0.935 132 HD23 LEU 17 HD23 LEU 17 3.303 5.385 -2.575 133 H ALA 18 H ALA 18 0.048 2.741 -4.143 134 HA ALA 18 HA ALA 18 -0.450 5.521 -4.147 135 HB1 ALA 18 HB1 ALA 18 -2.269 5.054 -5.756 136 HB2 ALA 18 HB2 ALA 18 -0.869 4.020 -6.136 137 HB3 ALA 18 HB3 ALA 18 -2.291 3.325 -5.301 138 H GLY 19 H GLY 19 -2.386 2.749 -2.685 139 HA2 GLY 19 HA2 GLY 19 -4.552 4.246 -1.766 140 HA3 GLY 19 HA3 GLY 19 -3.866 2.865 -0.875 141 H LYS 20 H LYS 20 -1.304 3.783 -0.085 142 HA LYS 20 HA LYS 20 -2.092 5.304 2.208 143 HB2 LYS 20 HB2 LYS 20 0.654 4.556 1.066 144 HB3 LYS 20 HB3 LYS 20 0.537 5.794 2.330 145 HG2 LYS 20 HG2 LYS 20 1.011 3.621 3.319 146 HG3 LYS 20 HG3 LYS 20 -0.537 4.284 3.901 147 HD2 LYS 20 HD2 LYS 20 -1.787 2.776 2.334 148 HD3 LYS 20 HD3 LYS 20 -0.247 2.103 1.734 149 HE2 LYS 20 HE2 LYS 20 -1.132 1.989 4.697 150 HE3 LYS 20 HE3 LYS 20 -1.521 0.717 3.527 151 HZ1 LYS 20 HZ1 LYS 20 0.439 0.068 4.764 152 HZ2 LYS 20 HZ2 LYS 20 1.280 1.522 4.385 153 HZ3 LYS 20 HZ3 LYS 20 0.911 0.375 3.121 154 H LEU 21 H LEU 21 0.035 6.412 -0.575 155 HA LEU 21 HA LEU 21 0.078 9.072 0.486 156 HB2 LEU 21 HB2 LEU 21 0.468 8.166 -2.426 157 HB3 LEU 21 HB3 LEU 21 0.845 9.798 -1.817 158 HG LEU 21 HG LEU 21 2.243 7.204 -0.904 159 HD11 LEU 21 HD11 LEU 21 2.784 7.863 -3.272 160 HD12 LEU 21 HD12 LEU 21 4.194 8.049 -2.197 161 HD13 LEU 21 HD13 LEU 21 3.263 9.488 -2.703 162 HD21 LEU 21 HD21 LEU 21 2.335 8.817 0.962 163 HD22 LEU 21 HD22 LEU 21 2.795 10.139 -0.155 164 HD23 LEU 21 HD23 LEU 21 3.916 8.785 0.165 165 H LEU 22 H LEU 22 -2.140 7.477 -1.881 166 HA LEU 22 HA LEU 22 -3.677 10.063 -2.044 167 HB2 LEU 22 HB2 LEU 22 -3.895 7.580 -3.802 168 HB3 LEU 22 HB3 LEU 22 -4.575 9.188 -4.122 169 HG LEU 22 HG LEU 22 -1.582 8.422 -4.134 170 HD11 LEU 22 HD11 LEU 22 -2.873 7.576 -6.104 171 HD12 LEU 22 HD12 LEU 22 -1.724 8.853 -6.580 172 HD13 LEU 22 HD13 LEU 22 -3.465 9.229 -6.434 173 HD21 LEU 22 HD21 LEU 22 -2.920 11.151 -4.674 174 HD22 LEU 22 HD22 LEU 22 -1.210 10.763 -5.028 175 HD23 LEU 22 HD23 LEU 22 -1.780 10.772 -3.346 176 H GLU 23 H GLU 23 -3.867 8.657 0.444 177 HA GLU 23 HA GLU 23 -6.065 6.827 0.383 178 HB2 GLU 23 HB2 GLU 23 -4.604 7.126 2.395 179 HB3 GLU 23 HB3 GLU 23 -5.256 8.770 2.632 180 HG2 GLU 23 HG2 GLU 23 -7.573 7.789 2.948 181 HG3 GLU 23 HG3 GLU 23 -6.897 6.154 2.731 182 H THR 24 H THR 24 -5.870 10.440 0.756 183 HA THR 24 HA THR 24 -8.518 10.981 1.196 184 HB THR 24 HB THR 24 -6.730 12.711 1.077 185 HG1 THR 24 HG1 THR 24 -9.023 13.345 -0.514 186 HG21 THR 24 HG21 THR 24 -7.074 12.559 -1.989 187 HG22 THR 24 HG22 THR 24 -5.623 12.011 -1.107 188 HG23 THR 24 HG23 THR 24 -6.085 13.737 -1.089 189 H LEU 25 H LEU 25 -7.251 9.744 -1.949 190 HA LEU 25 HA LEU 25 -10.071 9.932 -2.924 191 HB2 LEU 25 HB2 LEU 25 -9.435 10.774 -5.082 192 HB3 LEU 25 HB3 LEU 25 -8.864 11.827 -3.772 193 HG LEU 25 HG LEU 25 -6.554 10.527 -4.088 194 HD11 LEU 25 HD11 LEU 25 -7.518 8.853 -5.854 195 HD12 LEU 25 HD12 LEU 25 -6.112 9.783 -6.419 196 HD13 LEU 25 HD13 LEU 25 -7.759 10.239 -6.931 197 HD21 LEU 25 HD21 LEU 25 -6.810 12.953 -4.488 198 HD22 LEU 25 HD22 LEU 25 -7.526 12.635 -6.093 199 HD23 LEU 25 HD23 LEU 25 -5.816 12.217 -5.768 200 H LYS 26 H LYS 26 -6.906 8.049 -3.504 201 HA LYS 26 HA LYS 26 -8.310 6.207 -5.163 202 HB2 LYS 26 HB2 LYS 26 -5.848 5.806 -3.381 203 HB3 LYS 26 HB3 LYS 26 -6.542 4.478 -4.330 204 HG2 LYS 26 HG2 LYS 26 -5.594 7.119 -5.608 205 HG3 LYS 26 HG3 LYS 26 -4.570 5.676 -5.376 206 HD2 LYS 26 HD2 LYS 26 -6.196 4.307 -6.754 207 HD3 LYS 26 HD3 LYS 26 -7.100 5.801 -7.130 208 HE2 LYS 26 HE2 LYS 26 -5.036 6.792 -8.160 209 HE3 LYS 26 HE3 LYS 26 -4.131 5.297 -7.789 210 HZ1 LYS 26 HZ1 LYS 26 -4.908 5.289 -10.111 211 HZ2 LYS 26 HZ2 LYS 26 -6.562 5.471 -9.599 212 HZ3 LYS 26 HZ3 LYS 26 -5.678 4.012 -9.221 213 H CYS 27 H CYS 27 -7.476 5.905 -1.581 214 HA CYS 27 HA CYS 27 -8.827 3.488 -1.254 215 HB2 CYS 27 HB2 CYS 27 -8.537 5.775 0.778 216 HB3 CYS 27 HB3 CYS 27 -9.134 4.143 1.185 217 H LYS 28 H LYS 28 -10.276 6.820 -1.400 218 HA LYS 28 HA LYS 28 -12.883 5.845 -0.511 219 HB2 LYS 28 HB2 LYS 28 -12.054 8.395 -2.013 220 HB3 LYS 28 HB3 LYS 28 -13.748 7.966 -1.689 221 HG2 LYS 28 HG2 LYS 28 -12.948 9.530 0.024 222 HG3 LYS 28 HG3 LYS 28 -13.396 7.960 0.743 223 HD2 LYS 28 HD2 LYS 28 -10.995 7.333 0.968 224 HD3 LYS 28 HD3 LYS 28 -10.524 8.787 0.038 225 HE2 LYS 28 HE2 LYS 28 -10.087 9.114 2.431 226 HE3 LYS 28 HE3 LYS 28 -11.333 10.259 1.874 227 HZ1 LYS 28 HZ1 LYS 28 -11.833 9.206 4.083 228 HZ2 LYS 28 HZ2 LYS 28 -11.918 7.645 3.317 229 HZ3 LYS 28 HZ3 LYS 28 -13.076 8.900 2.931 230 H ILE 29 H ILE 29 -11.301 6.465 -3.755 231 HA ILE 29 HA ILE 29 -13.689 5.781 -5.192 232 HB ILE 29 HB ILE 29 -10.768 5.873 -6.084 233 HG12 ILE 29 HG12 ILE 29 -13.111 7.723 -6.846 234 HG13 ILE 29 HG13 ILE 29 -12.105 8.037 -5.422 235 HG21 ILE 29 HG21 ILE 29 -11.949 4.201 -7.510 236 HG22 ILE 29 HG22 ILE 29 -13.281 5.358 -7.791 237 HG23 ILE 29 HG23 ILE 29 -11.648 5.673 -8.444 238 HD11 ILE 29 HD11 ILE 29 -11.065 7.953 -8.322 239 HD12 ILE 29 HD12 ILE 29 -11.254 9.379 -7.276 240 HD13 ILE 29 HD13 ILE 29 -10.040 8.136 -6.867 241 H THR 30 H THR 30 -10.590 3.773 -4.877 242 HA THR 30 HA THR 30 -11.952 1.505 -5.896 243 HB THR 30 HB THR 30 -9.465 1.670 -5.868 244 HG1 THR 30 HG1 THR 30 -10.560 -0.704 -4.693 245 HG21 THR 30 HG21 THR 30 -8.195 0.918 -3.857 246 HG22 THR 30 HG22 THR 30 -9.683 0.897 -2.880 247 HG23 THR 30 HG23 THR 30 -9.041 2.442 -3.503 248 H GLY 31 H GLY 31 -11.747 2.787 -2.503 249 HA2 GLY 31 HA2 GLY 31 -13.026 2.035 -0.655 250 HA3 GLY 31 HA3 GLY 31 -13.804 0.842 -1.712 251 H CYS 32 H CYS 32 -10.507 1.661 -0.312 252 HA CYS 32 HA CYS 32 -9.460 -0.944 -0.854 253 HB2 CYS 32 HB2 CYS 32 -7.584 -0.362 0.642 254 HB3 CYS 32 HB3 CYS 32 -7.988 1.048 -0.381 Start of MODEL 4 1 H1 GLY 1 H1 GLY 1 12.995 -10.762 11.988 2 HA2 GLY 1 HA2 GLY 1 14.850 -10.160 10.423 3 HA3 GLY 1 HA3 GLY 1 13.619 -11.184 9.612 4 H ILE 2 H ILE 2 15.246 -9.440 8.060 5 HA ILE 2 HA ILE 2 13.683 -6.990 7.579 6 HB ILE 2 HB ILE 2 15.931 -8.248 5.916 7 HG12 ILE 2 HG12 ILE 2 15.922 -5.833 7.847 8 HG13 ILE 2 HG13 ILE 2 16.622 -7.431 8.199 9 HG21 ILE 2 HG21 ILE 2 14.319 -6.860 4.529 10 HG22 ILE 2 HG22 ILE 2 14.579 -5.490 5.644 11 HG23 ILE 2 HG23 ILE 2 15.916 -6.109 4.631 12 HD11 ILE 2 HD11 ILE 2 18.451 -5.968 7.573 13 HD12 ILE 2 HD12 ILE 2 18.221 -7.128 6.235 14 HD13 ILE 2 HD13 ILE 2 17.641 -5.439 6.083 15 H LEU 3 H LEU 3 14.329 -10.155 5.775 16 HA LEU 3 HA LEU 3 12.380 -9.583 3.836 17 HB2 LEU 3 HB2 LEU 3 12.390 -11.899 3.166 18 HB3 LEU 3 HB3 LEU 3 14.028 -11.367 3.588 19 HG LEU 3 HG LEU 3 13.473 -12.493 5.971 20 HD11 LEU 3 HD11 LEU 3 11.570 -14.075 4.108 21 HD12 LEU 3 HD12 LEU 3 11.006 -13.038 5.435 22 HD13 LEU 3 HD13 LEU 3 11.969 -14.482 5.799 23 HD21 LEU 3 HD21 LEU 3 14.380 -14.674 5.129 24 HD22 LEU 3 HD22 LEU 3 15.265 -13.285 4.451 25 HD23 LEU 3 HD23 LEU 3 14.066 -14.153 3.447 26 H SER 4 H SER 4 11.954 -10.925 7.202 27 HA SER 4 HA SER 4 9.248 -11.713 6.775 28 HB2 SER 4 HB2 SER 4 8.982 -11.609 9.231 29 HB3 SER 4 HB3 SER 4 10.491 -12.438 8.755 30 HG SER 4 HG SER 4 10.372 -9.744 9.733 31 H SER 5 H SER 5 10.767 -8.499 7.591 32 HA SER 5 HA SER 5 8.204 -7.240 8.079 33 HB2 SER 5 HB2 SER 5 10.912 -5.965 7.325 34 HB3 SER 5 HB3 SER 5 9.446 -5.089 7.836 35 HG SER 5 HG SER 5 10.827 -6.978 9.503 36 H PHE 6 H PHE 6 10.404 -7.556 5.168 37 HA PHE 6 HA PHE 6 8.786 -5.713 3.625 38 HB2 PHE 6 HB2 PHE 6 11.027 -7.636 2.840 39 HB3 PHE 6 HB3 PHE 6 9.957 -6.936 1.615 40 HD1 PHE 6 HD2 PHE 6 11.786 -5.674 4.721 41 HD2 PHE 6 HD1 PHE 6 10.777 -4.964 0.593 42 HE1 PHE 6 HE2 PHE 6 13.020 -3.547 4.783 43 HE2 PHE 6 HE1 PHE 6 12.036 -2.848 0.659 44 HZ PHE 6 HZ PHE 6 13.163 -2.125 2.752 45 H LYS 7 H LYS 7 9.124 -9.398 3.438 46 HA LYS 7 HA LYS 7 7.014 -9.651 1.639 47 HB2 LYS 7 HB2 LYS 7 6.779 -11.965 2.221 48 HB3 LYS 7 HB3 LYS 7 8.497 -11.540 2.351 49 HG2 LYS 7 HG2 LYS 7 8.297 -12.724 4.378 50 HG3 LYS 7 HG3 LYS 7 7.856 -11.103 4.918 51 HD2 LYS 7 HD2 LYS 7 6.110 -12.275 5.890 52 HD3 LYS 7 HD3 LYS 7 5.330 -11.954 4.328 53 HE2 LYS 7 HE2 LYS 7 6.779 -14.536 5.197 54 HE3 LYS 7 HE3 LYS 7 5.022 -14.298 5.052 55 HZ1 LYS 7 HZ1 LYS 7 5.308 -13.956 2.604 56 HZ2 LYS 7 HZ2 LYS 7 5.837 -15.521 3.136 57 HZ3 LYS 7 HZ3 LYS 7 7.022 -14.326 2.768 58 H GLY 8 H GLY 8 6.791 -8.982 5.219 59 HA2 GLY 8 HA2 GLY 8 3.994 -9.609 5.366 60 HA3 GLY 8 HA3 GLY 8 4.880 -8.530 6.468 61 H VAL 9 H VAL 9 5.843 -6.523 4.659 62 HA VAL 9 HA VAL 9 3.223 -5.133 4.261 63 HB VAL 9 HB VAL 9 6.071 -4.036 4.569 64 HG11 VAL 9 HG11 VAL 9 4.940 -1.812 4.754 65 HG12 VAL 9 HG12 VAL 9 4.669 -2.529 3.146 66 HG13 VAL 9 HG13 VAL 9 3.366 -2.567 4.371 67 HG21 VAL 9 HG21 VAL 9 5.273 -3.280 6.802 68 HG22 VAL 9 HG22 VAL 9 3.689 -4.059 6.523 69 HG23 VAL 9 HG23 VAL 9 5.165 -5.054 6.680 70 H ALA 10 H ALA 10 6.491 -5.297 2.576 71 HA ALA 10 HA ALA 10 5.781 -3.923 0.335 72 HB1 ALA 10 HB1 ALA 10 7.546 -5.165 -0.908 73 HB2 ALA 10 HB2 ALA 10 8.096 -4.767 0.745 74 HB3 ALA 10 HB3 ALA 10 7.566 -6.431 0.355 75 H LYS 11 H LYS 11 5.058 -7.441 0.959 76 HA LYS 11 HA LYS 11 4.555 -8.418 -1.435 77 HB2 LYS 11 HB2 LYS 11 2.615 -9.740 -0.603 78 HB3 LYS 11 HB3 LYS 11 4.002 -9.765 0.502 79 HG2 LYS 11 HG2 LYS 11 2.904 -8.021 1.948 80 HG3 LYS 11 HG3 LYS 11 1.494 -7.984 0.880 81 HD2 LYS 11 HD2 LYS 11 2.420 -10.429 2.499 82 HD3 LYS 11 HD3 LYS 11 1.086 -9.328 2.913 83 HE2 LYS 11 HE2 LYS 11 1.196 -11.277 0.525 84 HE3 LYS 11 HE3 LYS 11 0.173 -11.367 1.969 85 HZ1 LYS 11 HZ1 LYS 11 -0.047 -9.343 -0.285 86 HZ2 LYS 11 HZ2 LYS 11 -0.901 -9.198 1.240 87 HZ3 LYS 11 HZ3 LYS 11 -1.180 -10.547 0.177 88 H GLY 12 H GLY 12 2.207 -5.939 -0.074 89 HA2 GLY 12 HA2 GLY 12 0.808 -6.077 -2.762 90 HA3 GLY 12 HA3 GLY 12 -0.045 -5.995 -1.202 91 H VAL 13 H VAL 13 3.040 -4.332 -2.139 92 HA VAL 13 HA VAL 13 1.887 -1.849 -1.190 93 HB VAL 13 HB VAL 13 4.269 -2.533 -0.842 94 HG11 VAL 13 HG11 VAL 13 4.859 -3.281 -3.223 95 HG12 VAL 13 HG12 VAL 13 4.677 -1.592 -3.764 96 HG13 VAL 13 HG13 VAL 13 5.963 -2.031 -2.609 97 HG21 VAL 13 HG21 VAL 13 3.465 -0.183 -0.441 98 HG22 VAL 13 HG22 VAL 13 5.168 -0.239 -0.966 99 HG23 VAL 13 HG23 VAL 13 3.897 0.212 -2.129 100 H ALA 14 H ALA 14 2.421 -3.332 -4.467 101 HA ALA 14 HA ALA 14 2.494 -1.134 -6.050 102 HB1 ALA 14 HB1 ALA 14 0.699 -3.596 -6.534 103 HB2 ALA 14 HB2 ALA 14 1.154 -2.398 -7.783 104 HB3 ALA 14 HB3 ALA 14 2.409 -3.411 -7.012 105 H LYS 15 H LYS 15 -0.671 -2.493 -4.759 106 HA LYS 15 HA LYS 15 -2.085 -0.109 -5.809 107 HB2 LYS 15 HB2 LYS 15 -3.039 -2.486 -4.109 108 HB3 LYS 15 HB3 LYS 15 -4.046 -1.068 -4.480 109 HG2 LYS 15 HG2 LYS 15 -4.584 -2.880 -5.990 110 HG3 LYS 15 HG3 LYS 15 -3.927 -1.502 -6.910 111 HD2 LYS 15 HD2 LYS 15 -1.733 -2.635 -7.123 112 HD3 LYS 15 HD3 LYS 15 -2.298 -4.006 -6.123 113 HE2 LYS 15 HE2 LYS 15 -3.456 -3.174 -8.868 114 HE3 LYS 15 HE3 LYS 15 -2.276 -4.480 -8.586 115 HZ1 LYS 15 HZ1 LYS 15 -5.165 -4.434 -7.645 116 HZ2 LYS 15 HZ2 LYS 15 -3.982 -5.615 -7.127 117 HZ3 LYS 15 HZ3 LYS 15 -4.439 -5.480 -8.795 118 H ASP 16 H ASP 16 -1.258 -1.570 -2.547 119 HA ASP 16 HA ASP 16 -2.730 0.325 -1.130 120 HB2 ASP 16 HB2 ASP 16 -1.828 -1.838 -0.179 121 HB3 ASP 16 HB3 ASP 16 -0.193 -1.119 -0.174 122 H LEU 17 H LEU 17 0.593 0.735 -2.474 123 HA LEU 17 HA LEU 17 1.442 2.735 -0.740 124 HB2 LEU 17 HB2 LEU 17 2.511 1.784 -3.177 125 HB3 LEU 17 HB3 LEU 17 2.069 3.419 -3.632 126 HG LEU 17 HG LEU 17 3.868 2.639 -1.248 127 HD11 LEU 17 HD11 LEU 17 4.941 2.196 -3.479 128 HD12 LEU 17 HD12 LEU 17 5.730 3.551 -2.633 129 HD13 LEU 17 HD13 LEU 17 4.597 3.878 -3.977 130 HD21 LEU 17 HD21 LEU 17 2.713 4.781 -0.763 131 HD22 LEU 17 HD22 LEU 17 3.129 5.408 -2.386 132 HD23 LEU 17 HD23 LEU 17 4.409 5.116 -1.171 133 H ALA 18 H ALA 18 -0.465 3.064 -3.836 134 HA ALA 18 HA ALA 18 -0.946 5.869 -3.521 135 HB1 ALA 18 HB1 ALA 18 -2.855 5.501 -5.120 136 HB2 ALA 18 HB2 ALA 18 -1.344 4.730 -5.687 137 HB3 ALA 18 HB3 ALA 18 -2.632 3.728 -4.961 138 H GLY 19 H GLY 19 -2.784 2.897 -2.364 139 HA2 GLY 19 HA2 GLY 19 -4.974 4.184 -1.245 140 HA3 GLY 19 HA3 GLY 19 -4.192 2.767 -0.497 141 H LYS 20 H LYS 20 -1.555 4.117 0.067 142 HA LYS 20 HA LYS 20 -2.438 5.502 2.525 143 HB2 LYS 20 HB2 LYS 20 0.289 4.574 1.495 144 HB3 LYS 20 HB3 LYS 20 0.185 5.850 2.724 145 HG2 LYS 20 HG2 LYS 20 0.501 3.680 3.780 146 HG3 LYS 20 HG3 LYS 20 -1.037 4.426 4.281 147 HD2 LYS 20 HD2 LYS 20 -2.281 2.956 2.660 148 HD3 LYS 20 HD3 LYS 20 -0.742 2.197 2.174 149 HE2 LYS 20 HE2 LYS 20 -1.838 2.191 5.071 150 HE3 LYS 20 HE3 LYS 20 -2.183 0.905 3.902 151 HZ1 LYS 20 HZ1 LYS 20 0.568 1.630 4.966 152 HZ2 LYS 20 HZ2 LYS 20 0.262 0.471 3.696 153 HZ3 LYS 20 HZ3 LYS 20 -0.353 0.212 5.298 154 H LEU 21 H LEU 21 -0.101 6.450 -0.165 155 HA LEU 21 HA LEU 21 -0.009 9.106 0.858 156 HB2 LEU 21 HB2 LEU 21 0.486 8.204 -2.039 157 HB3 LEU 21 HB3 LEU 21 0.902 9.807 -1.381 158 HG LEU 21 HG LEU 21 2.149 7.132 -0.502 159 HD11 LEU 21 HD11 LEU 21 4.196 7.969 -1.629 160 HD12 LEU 21 HD12 LEU 21 3.361 9.483 -2.080 161 HD13 LEU 21 HD13 LEU 21 2.849 7.930 -2.796 162 HD21 LEU 21 HD21 LEU 21 2.182 8.616 1.467 163 HD22 LEU 21 HD22 LEU 21 2.736 9.994 0.465 164 HD23 LEU 21 HD23 LEU 21 3.805 8.593 0.758 165 H LEU 22 H LEU 22 -2.066 7.656 -1.760 166 HA LEU 22 HA LEU 22 -3.571 10.263 -1.877 167 HB2 LEU 22 HB2 LEU 22 -3.742 7.832 -3.724 168 HB3 LEU 22 HB3 LEU 22 -4.414 9.455 -4.007 169 HG LEU 22 HG LEU 22 -1.428 8.659 -3.950 170 HD11 LEU 22 HD11 LEU 22 -3.214 9.633 -6.263 171 HD12 LEU 22 HD12 LEU 22 -2.687 7.946 -6.006 172 HD13 LEU 22 HD13 LEU 22 -1.482 9.207 -6.371 173 HD21 LEU 22 HD21 LEU 22 -2.700 11.436 -4.373 174 HD22 LEU 22 HD22 LEU 22 -0.991 11.034 -4.713 175 HD23 LEU 22 HD23 LEU 22 -1.594 10.964 -3.046 176 H GLU 23 H GLU 23 -3.913 8.870 0.577 177 HA GLU 23 HA GLU 23 -6.064 7.008 0.386 178 HB2 GLU 23 HB2 GLU 23 -4.714 7.340 2.484 179 HB3 GLU 23 HB3 GLU 23 -5.470 8.939 2.709 180 HG2 GLU 23 HG2 GLU 23 -7.746 7.800 2.825 181 HG3 GLU 23 HG3 GLU 23 -6.934 6.217 2.661 182 H THR 24 H THR 24 -5.973 10.613 0.887 183 HA THR 24 HA THR 24 -8.621 11.114 1.207 184 HB THR 24 HB THR 24 -6.883 12.903 1.169 185 HG1 THR 24 HG1 THR 24 -9.149 13.534 0.832 186 HG21 THR 24 HG21 THR 24 -6.107 13.902 -0.957 187 HG22 THR 24 HG22 THR 24 -7.040 12.721 -1.908 188 HG23 THR 24 HG23 THR 24 -5.635 12.179 -0.946 189 H LEU 25 H LEU 25 -7.223 10.023 -1.933 190 HA LEU 25 HA LEU 25 -10.018 10.142 -2.995 191 HB2 LEU 25 HB2 LEU 25 -9.329 11.046 -5.109 192 HB3 LEU 25 HB3 LEU 25 -8.815 12.083 -3.764 193 HG LEU 25 HG LEU 25 -6.463 10.833 -4.042 194 HD11 LEU 25 HD11 LEU 25 -5.941 10.164 -6.382 195 HD12 LEU 25 HD12 LEU 25 -7.590 10.589 -6.915 196 HD13 LEU 25 HD13 LEU 25 -7.330 9.182 -5.871 197 HD21 LEU 25 HD21 LEU 25 -5.725 12.585 -5.661 198 HD22 LEU 25 HD22 LEU 25 -6.767 13.268 -4.391 199 HD23 LEU 25 HD23 LEU 25 -7.436 12.968 -6.019 200 H LYS 26 H LYS 26 -6.763 8.408 -3.513 201 HA LYS 26 HA LYS 26 -8.002 6.592 -5.287 202 HB2 LYS 26 HB2 LYS 26 -5.538 6.655 -5.079 203 HB3 LYS 26 HB3 LYS 26 -5.627 6.107 -3.387 204 HG2 LYS 26 HG2 LYS 26 -4.996 4.232 -4.761 205 HG3 LYS 26 HG3 LYS 26 -6.610 3.905 -4.115 206 HD2 LYS 26 HD2 LYS 26 -7.655 4.433 -6.297 207 HD3 LYS 26 HD3 LYS 26 -6.108 5.059 -6.940 208 HE2 LYS 26 HE2 LYS 26 -5.094 2.780 -6.774 209 HE3 LYS 26 HE3 LYS 26 -6.611 2.140 -6.093 210 HZ1 LYS 26 HZ1 LYS 26 -6.447 1.677 -8.504 211 HZ2 LYS 26 HZ2 LYS 26 -6.282 3.373 -8.854 212 HZ3 LYS 26 HZ3 LYS 26 -7.777 2.756 -8.201 213 H CYS 27 H CYS 27 -7.355 6.313 -1.668 214 HA CYS 27 HA CYS 27 -8.456 3.766 -1.475 215 HB2 CYS 27 HB2 CYS 27 -7.208 4.825 0.425 216 HB3 CYS 27 HB3 CYS 27 -8.614 5.903 0.716 217 H LYS 28 H LYS 28 -10.143 6.987 -1.464 218 HA LYS 28 HA LYS 28 -12.690 5.846 -0.661 219 HB2 LYS 28 HB2 LYS 28 -11.988 8.453 -2.141 220 HB3 LYS 28 HB3 LYS 28 -13.664 7.926 -1.870 221 HG2 LYS 28 HG2 LYS 28 -13.005 9.529 -0.133 222 HG3 LYS 28 HG3 LYS 28 -13.394 7.934 0.566 223 HD2 LYS 28 HD2 LYS 28 -10.982 7.435 0.888 224 HD3 LYS 28 HD3 LYS 28 -10.544 8.903 -0.036 225 HE2 LYS 28 HE2 LYS 28 -10.221 9.251 2.378 226 HE3 LYS 28 HE3 LYS 28 -11.462 10.359 1.742 227 HZ1 LYS 28 HZ1 LYS 28 -12.069 7.753 3.191 228 HZ2 LYS 28 HZ2 LYS 28 -13.228 8.980 2.729 229 HZ3 LYS 28 HZ3 LYS 28 -12.050 9.321 3.941 230 H ILE 29 H ILE 29 -11.100 6.543 -3.879 231 HA ILE 29 HA ILE 29 -13.446 5.794 -5.350 232 HB ILE 29 HB ILE 29 -10.516 5.969 -6.193 233 HG12 ILE 29 HG12 ILE 29 -12.902 7.748 -6.992 234 HG13 ILE 29 HG13 ILE 29 -11.931 8.088 -5.550 235 HG21 ILE 29 HG21 ILE 29 -11.354 5.749 -8.575 236 HG22 ILE 29 HG22 ILE 29 -11.620 4.266 -7.648 237 HG23 ILE 29 HG23 ILE 29 -12.983 5.381 -7.945 238 HD11 ILE 29 HD11 ILE 29 -10.837 8.048 -8.429 239 HD12 ILE 29 HD12 ILE 29 -11.094 9.464 -7.383 240 HD13 ILE 29 HD13 ILE 29 -9.847 8.262 -6.954 241 H THR 30 H THR 30 -10.314 3.864 -4.967 242 HA THR 30 HA THR 30 -11.631 1.551 -5.998 243 HB THR 30 HB THR 30 -9.144 1.873 -5.990 244 HG1 THR 30 HG1 THR 30 -8.879 -0.465 -5.662 245 HG21 THR 30 HG21 THR 30 -7.824 1.159 -3.992 246 HG22 THR 30 HG22 THR 30 -9.314 0.853 -3.066 247 HG23 THR 30 HG23 THR 30 -8.867 2.522 -3.518 248 H GLY 31 H GLY 31 -11.570 2.929 -2.679 249 HA2 GLY 31 HA2 GLY 31 -12.860 2.179 -0.851 250 HA3 GLY 31 HA3 GLY 31 -13.412 0.800 -1.822 251 H CYS 32 H CYS 32 -10.153 2.109 -0.725 252 HA CYS 32 HA CYS 32 -9.103 -0.556 -0.537 253 HB2 CYS 32 HB2 CYS 32 -7.072 0.322 0.273 254 HB3 CYS 32 HB3 CYS 32 -7.656 1.592 -0.820 Start of MODEL 5 1 H1 GLY 1 H1 GLY 1 12.476 -9.584 12.038 2 HA2 GLY 1 HA2 GLY 1 14.527 -10.253 10.765 3 HA3 GLY 1 HA3 GLY 1 13.465 -11.378 9.866 4 H ILE 2 H ILE 2 14.848 -9.675 8.261 5 HA ILE 2 HA ILE 2 13.301 -7.188 7.878 6 HB ILE 2 HB ILE 2 15.569 -8.396 6.214 7 HG12 ILE 2 HG12 ILE 2 15.527 -6.064 8.251 8 HG13 ILE 2 HG13 ILE 2 16.213 -7.678 8.548 9 HG21 ILE 2 HG21 ILE 2 15.616 -6.190 5.033 10 HG22 ILE 2 HG22 ILE 2 14.029 -6.938 4.835 11 HG23 ILE 2 HG23 ILE 2 14.240 -5.618 6.019 12 HD11 ILE 2 HD11 ILE 2 17.863 -7.288 6.641 13 HD12 ILE 2 HD12 ILE 2 17.295 -5.590 6.563 14 HD13 ILE 2 HD13 ILE 2 18.060 -6.201 8.045 15 H LEU 3 H LEU 3 13.785 -10.387 6.082 16 HA LEU 3 HA LEU 3 12.030 -9.560 3.981 17 HB2 LEU 3 HB2 LEU 3 12.798 -12.377 4.913 18 HB3 LEU 3 HB3 LEU 3 11.569 -12.083 3.661 19 HG LEU 3 HG LEU 3 13.195 -10.848 2.241 20 HD11 LEU 3 HD11 LEU 3 15.669 -11.015 2.751 21 HD12 LEU 3 HD12 LEU 3 15.276 -11.647 4.374 22 HD13 LEU 3 HD13 LEU 3 14.812 -9.978 3.909 23 HD21 LEU 3 HD21 LEU 3 14.122 -13.670 3.055 24 HD22 LEU 3 HD22 LEU 3 14.501 -12.850 1.512 25 HD23 LEU 3 HD23 LEU 3 12.817 -13.289 1.893 26 H SER 4 H SER 4 11.376 -11.515 7.033 27 HA SER 4 HA SER 4 8.691 -11.937 6.608 28 HB2 SER 4 HB2 SER 4 8.289 -11.911 9.020 29 HB3 SER 4 HB3 SER 4 9.847 -12.719 8.702 30 HG SER 4 HG SER 4 10.843 -10.650 9.341 31 H SER 5 H SER 5 10.247 -8.834 7.738 32 HA SER 5 HA SER 5 7.705 -7.528 8.150 33 HB2 SER 5 HB2 SER 5 10.484 -6.280 7.659 34 HB3 SER 5 HB3 SER 5 9.009 -5.399 8.132 35 HG SER 5 HG SER 5 10.230 -7.439 9.744 36 H PHE 6 H PHE 6 10.129 -7.550 5.380 37 HA PHE 6 HA PHE 6 8.566 -5.678 3.859 38 HB2 PHE 6 HB2 PHE 6 10.874 -7.514 3.097 39 HB3 PHE 6 HB3 PHE 6 9.833 -6.861 1.824 40 HD1 PHE 6 HD2 PHE 6 11.598 -5.627 4.958 41 HD2 PHE 6 HD1 PHE 6 10.400 -4.747 0.914 42 HE1 PHE 6 HE2 PHE 6 12.762 -3.455 5.081 43 HE2 PHE 6 HE1 PHE 6 11.575 -2.584 1.042 44 HZ PHE 6 HZ PHE 6 12.756 -1.923 3.125 45 H LYS 7 H LYS 7 8.916 -9.341 3.276 46 HA LYS 7 HA LYS 7 6.835 -9.291 1.428 47 HB2 LYS 7 HB2 LYS 7 6.599 -11.665 1.573 48 HB3 LYS 7 HB3 LYS 7 8.309 -11.262 1.832 49 HG2 LYS 7 HG2 LYS 7 7.969 -12.895 3.490 50 HG3 LYS 7 HG3 LYS 7 7.681 -11.415 4.422 51 HD2 LYS 7 HD2 LYS 7 5.127 -11.805 3.974 52 HD3 LYS 7 HD3 LYS 7 5.585 -13.323 3.178 53 HE2 LYS 7 HE2 LYS 7 6.638 -14.112 5.334 54 HE3 LYS 7 HE3 LYS 7 6.157 -12.580 6.117 55 HZ1 LYS 7 HZ1 LYS 7 4.247 -14.613 4.910 56 HZ2 LYS 7 HZ2 LYS 7 3.785 -13.118 5.682 57 HZ3 LYS 7 HZ3 LYS 7 4.551 -14.378 6.605 58 H GLY 8 H GLY 8 6.584 -9.393 5.081 59 HA2 GLY 8 HA2 GLY 8 3.830 -9.949 5.202 60 HA3 GLY 8 HA3 GLY 8 4.700 -8.936 6.376 61 H VAL 9 H VAL 9 5.532 -6.728 4.878 62 HA VAL 9 HA VAL 9 2.867 -5.414 4.585 63 HB VAL 9 HB VAL 9 5.687 -4.254 4.964 64 HG11 VAL 9 HG11 VAL 9 2.950 -2.842 4.862 65 HG12 VAL 9 HG12 VAL 9 4.503 -2.079 5.312 66 HG13 VAL 9 HG13 VAL 9 4.259 -2.679 3.654 67 HG21 VAL 9 HG21 VAL 9 4.801 -5.451 6.989 68 HG22 VAL 9 HG22 VAL 9 4.882 -3.690 7.243 69 HG23 VAL 9 HG23 VAL 9 3.310 -4.471 6.910 70 H ALA 10 H ALA 10 6.120 -5.321 2.882 71 HA ALA 10 HA ALA 10 5.133 -3.773 0.801 72 HB1 ALA 10 HB1 ALA 10 7.577 -4.069 1.266 73 HB2 ALA 10 HB2 ALA 10 7.487 -5.754 0.669 74 HB3 ALA 10 HB3 ALA 10 7.208 -4.388 -0.452 75 H LYS 11 H LYS 11 4.606 -7.325 1.152 76 HA LYS 11 HA LYS 11 4.782 -8.088 -1.454 77 HB2 LYS 11 HB2 LYS 11 3.047 -9.794 -1.149 78 HB3 LYS 11 HB3 LYS 11 4.163 -9.725 0.225 79 HG2 LYS 11 HG2 LYS 11 2.387 -8.436 1.551 80 HG3 LYS 11 HG3 LYS 11 1.338 -8.473 0.113 81 HD2 LYS 11 HD2 LYS 11 0.524 -10.172 1.589 82 HD3 LYS 11 HD3 LYS 11 1.271 -10.982 0.190 83 HE2 LYS 11 HE2 LYS 11 3.328 -11.454 1.617 84 HE3 LYS 11 HE3 LYS 11 2.530 -10.619 2.985 85 HZ1 LYS 11 HZ1 LYS 11 1.502 -13.107 1.588 86 HZ2 LYS 11 HZ2 LYS 11 0.736 -12.306 2.936 87 HZ3 LYS 11 HZ3 LYS 11 2.293 -13.056 3.136 88 H GLY 12 H GLY 12 2.029 -6.076 -0.147 89 HA2 GLY 12 HA2 GLY 12 0.913 -6.037 -2.964 90 HA3 GLY 12 HA3 GLY 12 -0.014 -5.816 -1.467 91 H VAL 13 H VAL 13 3.260 -4.407 -2.231 92 HA VAL 13 HA VAL 13 2.289 -1.850 -1.371 93 HB VAL 13 HB VAL 13 4.685 -2.616 -1.177 94 HG11 VAL 13 HG11 VAL 13 5.051 -3.485 -3.535 95 HG12 VAL 13 HG12 VAL 13 4.927 -1.810 -4.146 96 HG13 VAL 13 HG13 VAL 13 6.261 -2.270 -3.057 97 HG21 VAL 13 HG21 VAL 13 5.663 -0.377 -1.431 98 HG22 VAL 13 HG22 VAL 13 4.358 0.092 -2.545 99 HG23 VAL 13 HG23 VAL 13 3.994 -0.214 -0.821 100 H ALA 14 H ALA 14 2.694 -3.364 -4.661 101 HA ALA 14 HA ALA 14 2.756 -1.150 -6.232 102 HB1 ALA 14 HB1 ALA 14 0.956 -3.606 -6.733 103 HB2 ALA 14 HB2 ALA 14 1.427 -2.401 -7.969 104 HB3 ALA 14 HB3 ALA 14 2.672 -3.432 -7.204 105 H LYS 15 H LYS 15 -0.359 -2.549 -4.881 106 HA LYS 15 HA LYS 15 -1.828 -0.201 -5.919 107 HB2 LYS 15 HB2 LYS 15 -2.791 -2.466 -4.073 108 HB3 LYS 15 HB3 LYS 15 -3.800 -1.201 -4.821 109 HG2 LYS 15 HG2 LYS 15 -3.148 -2.065 -7.112 110 HG3 LYS 15 HG3 LYS 15 -2.181 -3.345 -6.330 111 HD2 LYS 15 HD2 LYS 15 -4.281 -4.210 -5.193 112 HD3 LYS 15 HD3 LYS 15 -5.216 -2.917 -5.986 113 HE2 LYS 15 HE2 LYS 15 -5.577 -4.970 -7.218 114 HE3 LYS 15 HE3 LYS 15 -4.611 -3.883 -8.246 115 HZ1 LYS 15 HZ1 LYS 15 -3.848 -6.260 -8.267 116 HZ2 LYS 15 HZ2 LYS 15 -3.478 -6.160 -6.573 117 HZ3 LYS 15 HZ3 LYS 15 -2.594 -5.203 -7.740 118 H ASP 16 H ASP 16 -0.832 -1.593 -2.676 119 HA ASP 16 HA ASP 16 -2.473 0.239 -1.294 120 HB2 ASP 16 HB2 ASP 16 -1.529 -1.994 -0.437 121 HB3 ASP 16 HB3 ASP 16 -0.006 -1.129 -0.089 122 H LEU 17 H LEU 17 0.910 0.623 -2.472 123 HA LEU 17 HA LEU 17 1.727 2.650 -0.772 124 HB2 LEU 17 HB2 LEU 17 2.808 1.704 -3.188 125 HB3 LEU 17 HB3 LEU 17 2.320 3.310 -3.688 126 HG LEU 17 HG LEU 17 4.173 2.619 -1.325 127 HD11 LEU 17 HD11 LEU 17 5.206 2.229 -3.596 128 HD12 LEU 17 HD12 LEU 17 5.973 3.595 -2.749 129 HD13 LEU 17 HD13 LEU 17 4.800 3.904 -4.062 130 HD21 LEU 17 HD21 LEU 17 2.960 4.732 -0.812 131 HD22 LEU 17 HD22 LEU 17 3.314 5.358 -2.451 132 HD23 LEU 17 HD23 LEU 17 4.632 5.120 -1.266 133 H ALA 18 H ALA 18 -0.184 2.931 -3.871 134 HA ALA 18 HA ALA 18 -0.640 5.739 -3.603 135 HB1 ALA 18 HB1 ALA 18 -2.445 5.431 -5.250 136 HB2 ALA 18 HB2 ALA 18 -1.030 4.469 -5.750 137 HB3 ALA 18 HB3 ALA 18 -2.442 3.658 -5.005 138 H GLY 19 H GLY 19 -2.477 2.791 -2.410 139 HA2 GLY 19 HA2 GLY 19 -4.704 4.037 -1.356 140 HA3 GLY 19 HA3 GLY 19 -3.873 2.691 -0.533 141 H LYS 20 H LYS 20 -1.290 4.170 0.021 142 HA LYS 20 HA LYS 20 -2.310 5.604 2.392 143 HB2 LYS 20 HB2 LYS 20 0.563 5.007 1.469 144 HB3 LYS 20 HB3 LYS 20 0.162 6.114 2.801 145 HG2 LYS 20 HG2 LYS 20 0.700 4.020 3.797 146 HG3 LYS 20 HG3 LYS 20 -1.048 4.279 4.010 147 HD2 LYS 20 HD2 LYS 20 -1.471 2.693 2.067 148 HD3 LYS 20 HD3 LYS 20 0.295 2.508 1.869 149 HE2 LYS 20 HE2 LYS 20 -0.310 0.581 3.118 150 HE3 LYS 20 HE3 LYS 20 0.303 1.670 4.370 151 HZ1 LYS 20 HZ1 LYS 20 -2.061 2.283 4.923 152 HZ2 LYS 20 HZ2 LYS 20 -1.791 0.576 5.054 153 HZ3 LYS 20 HZ3 LYS 20 -2.626 1.205 3.671 154 H LEU 21 H LEU 21 -0.084 6.485 -0.418 155 HA LEU 21 HA LEU 21 0.050 9.186 0.515 156 HB2 LEU 21 HB2 LEU 21 0.460 8.198 -2.368 157 HB3 LEU 21 HB3 LEU 21 0.933 9.796 -1.736 158 HG LEU 21 HG LEU 21 2.135 7.083 -0.895 159 HD11 LEU 21 HD11 LEU 21 4.193 7.920 -2.020 160 HD12 LEU 21 HD12 LEU 21 3.365 9.443 -2.445 161 HD13 LEU 21 HD13 LEU 21 2.832 7.900 -3.172 162 HD21 LEU 21 HD21 LEU 21 2.209 8.514 1.103 163 HD22 LEU 21 HD22 LEU 21 2.787 9.907 0.133 164 HD23 LEU 21 HD23 LEU 21 3.829 8.476 0.386 165 H LEU 22 H LEU 22 -2.039 7.610 -1.996 166 HA LEU 22 HA LEU 22 -3.644 10.151 -2.134 167 HB2 LEU 22 HB2 LEU 22 -3.793 7.641 -3.878 168 HB3 LEU 22 HB3 LEU 22 -4.547 9.226 -4.190 169 HG LEU 22 HG LEU 22 -1.534 8.554 -4.258 170 HD11 LEU 22 HD11 LEU 22 -2.861 7.746 -6.236 171 HD12 LEU 22 HD12 LEU 22 -1.730 9.046 -6.687 172 HD13 LEU 22 HD13 LEU 22 -3.471 9.403 -6.499 173 HD21 LEU 22 HD21 LEU 22 -2.937 11.270 -4.677 174 HD22 LEU 22 HD22 LEU 22 -1.234 10.930 -5.100 175 HD23 LEU 22 HD23 LEU 22 -1.744 10.875 -3.402 176 H GLU 23 H GLU 23 -3.839 8.855 0.374 177 HA GLU 23 HA GLU 23 -5.973 6.945 0.338 178 HB2 GLU 23 HB2 GLU 23 -4.509 7.324 2.355 179 HB3 GLU 23 HB3 GLU 23 -5.251 8.928 2.583 180 HG2 GLU 23 HG2 GLU 23 -7.517 7.793 2.862 181 HG3 GLU 23 HG3 GLU 23 -6.712 6.208 2.691 182 H THR 24 H THR 24 -5.847 10.558 0.754 183 HA THR 24 HA THR 24 -8.483 11.069 1.201 184 HB THR 24 HB THR 24 -6.739 12.826 1.086 185 HG1 THR 24 HG1 THR 24 -8.244 14.391 0.126 186 HG21 THR 24 HG21 THR 24 -5.630 12.102 -1.122 187 HG22 THR 24 HG22 THR 24 -6.057 13.833 -1.088 188 HG23 THR 24 HG23 THR 24 -7.080 12.686 -1.987 189 H LEU 25 H LEU 25 -7.234 9.911 -1.982 190 HA LEU 25 HA LEU 25 -10.065 10.104 -2.937 191 HB2 LEU 25 HB2 LEU 25 -9.433 10.948 -5.086 192 HB3 LEU 25 HB3 LEU 25 -8.820 11.983 -3.783 193 HG LEU 25 HG LEU 25 -6.542 10.613 -4.147 194 HD11 LEU 25 HD11 LEU 25 -7.603 9.002 -5.917 195 HD12 LEU 25 HD12 LEU 25 -6.169 9.887 -6.490 196 HD13 LEU 25 HD13 LEU 25 -7.805 10.412 -6.970 197 HD21 LEU 25 HD21 LEU 25 -5.788 12.308 -5.814 198 HD22 LEU 25 HD22 LEU 25 -6.731 13.051 -4.499 199 HD23 LEU 25 HD23 LEU 25 -7.490 12.785 -6.094 200 H LYS 26 H LYS 26 -6.905 8.216 -3.563 201 HA LYS 26 HA LYS 26 -8.413 6.375 -5.166 202 HB2 LYS 26 HB2 LYS 26 -5.808 5.923 -3.602 203 HB3 LYS 26 HB3 LYS 26 -6.581 4.680 -4.606 204 HG2 LYS 26 HG2 LYS 26 -5.566 7.386 -5.679 205 HG3 LYS 26 HG3 LYS 26 -4.729 5.822 -5.751 206 HD2 LYS 26 HD2 LYS 26 -6.830 4.927 -7.061 207 HD3 LYS 26 HD3 LYS 26 -7.294 6.643 -7.211 208 HE2 LYS 26 HE2 LYS 26 -6.152 6.111 -9.231 209 HE3 LYS 26 HE3 LYS 26 -4.996 7.082 -8.281 210 HZ1 LYS 26 HZ1 LYS 26 -3.777 4.985 -7.699 211 HZ2 LYS 26 HZ2 LYS 26 -3.979 5.103 -9.399 212 HZ3 LYS 26 HZ3 LYS 26 -5.008 4.040 -8.493 213 H CYS 27 H CYS 27 -7.349 6.188 -1.634 214 HA CYS 27 HA CYS 27 -8.494 3.698 -1.255 215 HB2 CYS 27 HB2 CYS 27 -7.110 4.797 0.520 216 HB3 CYS 27 HB3 CYS 27 -8.482 5.905 0.871 217 H LYS 28 H LYS 28 -10.147 6.930 -1.270 218 HA LYS 28 HA LYS 28 -12.668 5.856 -0.314 219 HB2 LYS 28 HB2 LYS 28 -11.993 8.378 -1.944 220 HB3 LYS 28 HB3 LYS 28 -13.665 7.880 -1.609 221 HG2 LYS 28 HG2 LYS 28 -12.938 9.561 0.030 222 HG3 LYS 28 HG3 LYS 28 -13.344 8.009 0.812 223 HD2 LYS 28 HD2 LYS 28 -10.937 7.475 1.109 224 HD3 LYS 28 HD3 LYS 28 -10.484 8.892 0.119 225 HE2 LYS 28 HE2 LYS 28 -10.122 9.333 2.516 226 HE3 LYS 28 HE3 LYS 28 -11.340 10.444 1.842 227 HZ1 LYS 28 HZ1 LYS 28 -11.931 9.522 4.089 228 HZ2 LYS 28 HZ2 LYS 28 -12.009 7.923 3.403 229 HZ3 LYS 28 HZ3 LYS 28 -13.131 9.171 2.907 230 H ILE 29 H ILE 29 -11.237 6.424 -3.637 231 HA ILE 29 HA ILE 29 -13.636 5.558 -4.952 232 HB ILE 29 HB ILE 29 -10.762 5.754 -5.962 233 HG12 ILE 29 HG12 ILE 29 -13.205 7.471 -6.704 234 HG13 ILE 29 HG13 ILE 29 -12.181 7.878 -5.318 235 HG21 ILE 29 HG21 ILE 29 -13.311 5.067 -7.548 236 HG22 ILE 29 HG22 ILE 29 -11.726 5.438 -8.279 237 HG23 ILE 29 HG23 ILE 29 -11.915 3.985 -7.288 238 HD11 ILE 29 HD11 ILE 29 -10.158 8.028 -6.810 239 HD12 ILE 29 HD12 ILE 29 -11.200 7.739 -8.235 240 HD13 ILE 29 HD13 ILE 29 -11.439 9.193 -7.237 241 H THR 30 H THR 30 -10.436 3.716 -4.687 242 HA THR 30 HA THR 30 -11.744 1.343 -5.563 243 HB THR 30 HB THR 30 -9.268 1.699 -5.718 244 HG1 THR 30 HG1 THR 30 -10.105 -0.750 -4.495 245 HG21 THR 30 HG21 THR 30 -7.820 1.039 -3.798 246 HG22 THR 30 HG22 THR 30 -9.236 0.904 -2.725 247 HG23 THR 30 HG23 THR 30 -8.755 2.495 -3.378 248 H GLY 31 H GLY 31 -11.560 2.813 -2.285 249 HA2 GLY 31 HA2 GLY 31 -12.745 2.068 -0.383 250 HA3 GLY 31 HA3 GLY 31 -13.317 0.666 -1.306 251 H CYS 32 H CYS 32 -10.056 2.056 -0.348 252 HA CYS 32 HA CYS 32 -8.921 -0.576 -0.194 253 HB2 CYS 32 HB2 CYS 32 -6.887 0.362 0.550 254 HB3 CYS 32 HB3 CYS 32 -7.542 1.599 -0.543 Start of MODEL 6 1 H1 GLY 1 H1 GLY 1 12.266 -9.531 12.254 2 HA2 GLY 1 HA2 GLY 1 14.323 -10.224 11.006 3 HA3 GLY 1 HA3 GLY 1 13.257 -11.330 10.088 4 H ILE 2 H ILE 2 14.703 -9.622 8.527 5 HA ILE 2 HA ILE 2 13.161 -7.136 8.094 6 HB ILE 2 HB ILE 2 15.476 -8.353 6.498 7 HG12 ILE 2 HG12 ILE 2 15.394 -6.001 8.508 8 HG13 ILE 2 HG13 ILE 2 16.043 -7.620 8.855 9 HG21 ILE 2 HG21 ILE 2 14.148 -5.579 6.250 10 HG22 ILE 2 HG22 ILE 2 15.554 -6.154 5.309 11 HG23 ILE 2 HG23 ILE 2 13.976 -6.908 5.071 12 HD11 ILE 2 HD11 ILE 2 17.764 -7.299 7.005 13 HD12 ILE 2 HD12 ILE 2 17.228 -5.595 6.864 14 HD13 ILE 2 HD13 ILE 2 17.929 -6.180 8.388 15 H LEU 3 H LEU 3 13.779 -10.298 6.301 16 HA LEU 3 HA LEU 3 12.024 -9.596 4.184 17 HB2 LEU 3 HB2 LEU 3 12.911 -12.317 5.265 18 HB3 LEU 3 HB3 LEU 3 11.646 -12.228 4.030 19 HG LEU 3 HG LEU 3 13.907 -12.672 3.089 20 HD11 LEU 3 HD11 LEU 3 12.086 -11.660 1.674 21 HD12 LEU 3 HD12 LEU 3 13.725 -11.212 1.140 22 HD13 LEU 3 HD13 LEU 3 12.729 -10.030 2.015 23 HD21 LEU 3 HD21 LEU 3 14.599 -9.766 3.864 24 HD22 LEU 3 HD22 LEU 3 15.594 -10.864 2.876 25 HD23 LEU 3 HD23 LEU 3 15.306 -11.242 4.593 26 H SER 4 H SER 4 11.310 -11.397 7.309 27 HA SER 4 HA SER 4 8.659 -11.923 6.768 28 HB2 SER 4 HB2 SER 4 8.127 -11.800 9.154 29 HB3 SER 4 HB3 SER 4 9.716 -12.581 8.948 30 HG SER 4 HG SER 4 10.621 -10.464 9.564 31 H SER 5 H SER 5 10.087 -8.734 7.871 32 HA SER 5 HA SER 5 7.526 -7.456 8.065 33 HB2 SER 5 HB2 SER 5 10.264 -6.155 7.536 34 HB3 SER 5 HB3 SER 5 8.783 -5.337 8.117 35 HG SER 5 HG SER 5 10.205 -6.029 9.912 36 H PHE 6 H PHE 6 10.042 -7.585 5.378 37 HA PHE 6 HA PHE 6 8.534 -5.793 3.724 38 HB2 PHE 6 HB2 PHE 6 10.854 -7.670 3.128 39 HB3 PHE 6 HB3 PHE 6 9.845 -7.125 1.784 40 HD1 PHE 6 HD1 PHE 6 11.528 -5.660 4.856 41 HD2 PHE 6 HD2 PHE 6 10.439 -5.088 0.727 42 HE1 PHE 6 HE1 PHE 6 12.613 -3.440 4.871 43 HE2 PHE 6 HE2 PHE 6 11.515 -2.871 0.753 44 HZ PHE 6 HZ PHE 6 12.594 -2.029 2.826 45 H LYS 7 H LYS 7 8.854 -9.469 3.393 46 HA LYS 7 HA LYS 7 6.839 -9.550 1.458 47 HB2 LYS 7 HB2 LYS 7 6.621 -11.922 1.785 48 HB3 LYS 7 HB3 LYS 7 8.319 -11.469 2.037 49 HG2 LYS 7 HG2 LYS 7 8.000 -12.941 3.839 50 HG3 LYS 7 HG3 LYS 7 7.618 -11.395 4.625 51 HD2 LYS 7 HD2 LYS 7 5.112 -11.914 4.179 52 HD3 LYS 7 HD3 LYS 7 5.627 -13.472 3.497 53 HE2 LYS 7 HE2 LYS 7 6.673 -14.071 5.720 54 HE3 LYS 7 HE3 LYS 7 6.122 -12.507 6.385 55 HZ1 LYS 7 HZ1 LYS 7 4.573 -14.323 6.973 56 HZ2 LYS 7 HZ2 LYS 7 4.312 -14.691 5.294 57 HZ3 LYS 7 HZ3 LYS 7 3.780 -13.163 5.949 58 H GLY 8 H GLY 8 6.475 -9.282 5.079 59 HA2 GLY 8 HA2 GLY 8 3.679 -9.875 5.075 60 HA3 GLY 8 HA3 GLY 8 4.523 -8.883 6.287 61 H VAL 9 H VAL 9 5.533 -6.754 4.625 62 HA VAL 9 HA VAL 9 2.914 -5.336 4.274 63 HB VAL 9 HB VAL 9 5.736 -4.280 4.871 64 HG11 VAL 9 HG11 VAL 9 4.594 -2.086 5.225 65 HG12 VAL 9 HG12 VAL 9 4.426 -2.625 3.536 66 HG13 VAL 9 HG13 VAL 9 3.048 -2.788 4.665 67 HG21 VAL 9 HG21 VAL 9 4.809 -3.771 7.118 68 HG22 VAL 9 HG22 VAL 9 3.243 -4.502 6.665 69 HG23 VAL 9 HG23 VAL 9 4.705 -5.521 6.796 70 H ALA 10 H ALA 10 6.278 -5.282 2.784 71 HA ALA 10 HA ALA 10 5.493 -3.661 0.671 72 HB1 ALA 10 HB1 ALA 10 7.714 -5.795 0.637 73 HB2 ALA 10 HB2 ALA 10 7.576 -4.415 -0.494 74 HB3 ALA 10 HB3 ALA 10 7.885 -4.118 1.241 75 H LYS 11 H LYS 11 4.986 -7.246 0.941 76 HA LYS 11 HA LYS 11 5.075 -7.970 -1.658 77 HB2 LYS 11 HB2 LYS 11 3.313 -9.661 -1.315 78 HB3 LYS 11 HB3 LYS 11 4.441 -9.596 0.056 79 HG2 LYS 11 HG2 LYS 11 2.734 -8.231 1.359 80 HG3 LYS 11 HG3 LYS 11 1.615 -8.331 -0.028 81 HD2 LYS 11 HD2 LYS 11 1.489 -10.782 0.134 82 HD3 LYS 11 HD3 LYS 11 2.662 -10.803 1.473 83 HE2 LYS 11 HE2 LYS 11 1.098 -9.443 2.887 84 HE3 LYS 11 HE3 LYS 11 -0.082 -9.397 1.548 85 HZ1 LYS 11 HZ1 LYS 11 -0.651 -11.140 3.183 86 HZ2 LYS 11 HZ2 LYS 11 0.895 -11.906 2.958 87 HZ3 LYS 11 HZ3 LYS 11 -0.261 -11.861 1.649 88 H GLY 12 H GLY 12 2.318 -5.979 -0.296 89 HA2 GLY 12 HA2 GLY 12 1.148 -5.956 -3.092 90 HA3 GLY 12 HA3 GLY 12 0.245 -5.770 -1.575 91 H VAL 13 H VAL 13 3.464 -4.258 -2.341 92 HA VAL 13 HA VAL 13 2.428 -1.750 -1.450 93 HB VAL 13 HB VAL 13 4.846 -2.427 -1.295 94 HG11 VAL 13 HG11 VAL 13 5.009 -1.618 -4.273 95 HG12 VAL 13 HG12 VAL 13 6.378 -2.036 -3.209 96 HG13 VAL 13 HG13 VAL 13 5.197 -3.288 -3.664 97 HG21 VAL 13 HG21 VAL 13 5.747 -0.151 -1.585 98 HG22 VAL 13 HG22 VAL 13 4.396 0.272 -2.665 99 HG23 VAL 13 HG23 VAL 13 4.089 -0.049 -0.933 100 H ALA 14 H ALA 14 2.747 -3.206 -4.771 101 HA ALA 14 HA ALA 14 2.794 -0.987 -6.310 102 HB1 ALA 14 HB1 ALA 14 1.397 -2.179 -8.032 103 HB2 ALA 14 HB2 ALA 14 2.658 -3.229 -7.322 104 HB3 ALA 14 HB3 ALA 14 0.957 -3.411 -6.811 105 H LYS 15 H LYS 15 -0.427 -2.341 -5.112 106 HA LYS 15 HA LYS 15 -1.719 0.190 -5.921 107 HB2 LYS 15 HB2 LYS 15 -2.793 -2.244 -4.375 108 HB3 LYS 15 HB3 LYS 15 -3.750 -0.797 -4.783 109 HG2 LYS 15 HG2 LYS 15 -3.392 -1.167 -7.201 110 HG3 LYS 15 HG3 LYS 15 -2.395 -2.613 -6.872 111 HD2 LYS 15 HD2 LYS 15 -4.334 -3.723 -5.753 112 HD3 LYS 15 HD3 LYS 15 -5.361 -2.293 -6.038 113 HE2 LYS 15 HE2 LYS 15 -4.091 -4.018 -8.262 114 HE3 LYS 15 HE3 LYS 15 -5.757 -4.190 -7.655 115 HZ1 LYS 15 HZ1 LYS 15 -4.641 -1.771 -9.115 116 HZ2 LYS 15 HZ2 LYS 15 -6.213 -1.834 -8.356 117 HZ3 LYS 15 HZ3 LYS 15 -5.818 -2.895 -9.675 118 H ASP 16 H ASP 16 -0.830 -1.522 -2.798 119 HA ASP 16 HA ASP 16 -2.347 0.209 -1.240 120 HB2 ASP 16 HB2 ASP 16 -1.253 -1.994 -0.502 121 HB3 ASP 16 HB3 ASP 16 0.254 -1.072 -0.237 122 H LEU 17 H LEU 17 0.997 0.732 -2.519 123 HA LEU 17 HA LEU 17 1.746 2.808 -0.859 124 HB2 LEU 17 HB2 LEU 17 2.811 1.893 -3.317 125 HB3 LEU 17 HB3 LEU 17 2.305 3.512 -3.755 126 HG LEU 17 HG LEU 17 4.180 2.769 -1.424 127 HD11 LEU 17 HD11 LEU 17 5.205 2.430 -3.704 128 HD12 LEU 17 HD12 LEU 17 5.968 3.783 -2.833 129 HD13 LEU 17 HD13 LEU 17 4.790 4.112 -4.136 130 HD21 LEU 17 HD21 LEU 17 4.626 5.265 -1.306 131 HD22 LEU 17 HD22 LEU 17 2.952 4.867 -0.869 132 HD23 LEU 17 HD23 LEU 17 3.313 5.530 -2.490 133 H ALA 18 H ALA 18 -0.208 3.022 -3.942 134 HA ALA 18 HA ALA 18 -0.806 5.796 -3.685 135 HB1 ALA 18 HB1 ALA 18 -1.275 4.558 -5.794 136 HB2 ALA 18 HB2 ALA 18 -2.500 3.556 -4.968 137 HB3 ALA 18 HB3 ALA 18 -2.774 5.311 -5.177 138 H GLY 19 H GLY 19 -2.479 2.801 -2.370 139 HA2 GLY 19 HA2 GLY 19 -4.667 4.001 -1.192 140 HA3 GLY 19 HA3 GLY 19 -3.768 2.670 -0.420 141 H LYS 20 H LYS 20 -1.186 4.170 0.040 142 HA LYS 20 HA LYS 20 -2.120 5.541 2.472 143 HB2 LYS 20 HB2 LYS 20 0.742 5.150 1.408 144 HB3 LYS 20 HB3 LYS 20 0.309 6.123 2.829 145 HG2 LYS 20 HG2 LYS 20 1.041 4.034 3.662 146 HG3 LYS 20 HG3 LYS 20 -0.721 4.094 3.920 147 HD2 LYS 20 HD2 LYS 20 -1.063 2.579 1.968 148 HD3 LYS 20 HD3 LYS 20 0.675 2.681 1.556 149 HE2 LYS 20 HE2 LYS 20 0.445 0.572 2.634 150 HE3 LYS 20 HE3 LYS 20 1.184 1.614 3.856 151 HZ1 LYS 20 HZ1 LYS 20 -1.039 1.899 4.930 152 HZ2 LYS 20 HZ2 LYS 20 -0.630 0.224 4.788 153 HZ3 LYS 20 HZ3 LYS 20 -1.777 0.924 3.685 154 H LEU 21 H LEU 21 -0.044 6.547 -0.416 155 HA LEU 21 HA LEU 21 0.019 9.240 0.599 156 HB2 LEU 21 HB2 LEU 21 0.522 8.289 -2.282 157 HB3 LEU 21 HB3 LEU 21 0.924 9.901 -1.637 158 HG LEU 21 HG LEU 21 2.196 7.232 -0.759 159 HD11 LEU 21 HD11 LEU 21 2.897 8.047 -3.038 160 HD12 LEU 21 HD12 LEU 21 4.241 8.106 -1.868 161 HD13 LEU 21 HD13 LEU 21 3.384 9.608 -2.318 162 HD21 LEU 21 HD21 LEU 21 2.202 8.697 1.219 163 HD22 LEU 21 HD22 LEU 21 2.749 10.091 0.234 164 HD23 LEU 21 HD23 LEU 21 3.831 8.698 0.521 165 H LEU 22 H LEU 22 -1.997 7.607 -1.927 166 HA LEU 22 HA LEU 22 -3.637 10.124 -2.126 167 HB2 LEU 22 HB2 LEU 22 -3.695 7.602 -3.846 168 HB3 LEU 22 HB3 LEU 22 -4.466 9.166 -4.205 169 HG LEU 22 HG LEU 22 -1.439 8.547 -4.158 170 HD11 LEU 22 HD11 LEU 22 -2.684 7.668 -6.158 171 HD12 LEU 22 HD12 LEU 22 -1.550 8.970 -6.600 172 HD13 LEU 22 HD13 LEU 22 -3.301 9.311 -6.487 173 HD21 LEU 22 HD21 LEU 22 -1.151 10.909 -5.040 174 HD22 LEU 22 HD22 LEU 22 -1.725 10.882 -3.361 175 HD23 LEU 22 HD23 LEU 22 -2.875 11.226 -4.691 176 H GLU 23 H GLU 23 -3.839 8.847 0.387 177 HA GLU 23 HA GLU 23 -5.940 6.894 0.325 178 HB2 GLU 23 HB2 GLU 23 -4.420 7.309 2.330 179 HB3 GLU 23 HB3 GLU 23 -5.273 8.849 2.610 180 HG2 GLU 23 HG2 GLU 23 -7.429 7.548 2.927 181 HG3 GLU 23 HG3 GLU 23 -6.553 6.029 2.610 182 H THR 24 H THR 24 -5.846 10.524 0.447 183 HA THR 24 HA THR 24 -8.564 10.941 1.100 184 HB THR 24 HB THR 24 -8.302 13.120 -0.221 185 HG1 THR 24 HG1 THR 24 -6.117 13.413 -1.121 186 HG21 THR 24 HG21 THR 24 -6.598 14.115 1.297 187 HG22 THR 24 HG22 THR 24 -6.010 12.499 1.763 188 HG23 THR 24 HG23 THR 24 -7.665 13.008 2.202 189 H LEU 25 H LEU 25 -7.233 9.664 -1.970 190 HA LEU 25 HA LEU 25 -10.009 9.827 -3.054 191 HB2 LEU 25 HB2 LEU 25 -9.285 10.797 -5.149 192 HB3 LEU 25 HB3 LEU 25 -8.866 11.808 -3.752 193 HG LEU 25 HG LEU 25 -6.456 10.611 -3.982 194 HD11 LEU 25 HD11 LEU 25 -5.838 10.129 -6.338 195 HD12 LEU 25 HD12 LEU 25 -7.477 10.542 -6.905 196 HD13 LEU 25 HD13 LEU 25 -7.215 9.076 -5.939 197 HD21 LEU 25 HD21 LEU 25 -5.691 12.486 -5.419 198 HD22 LEU 25 HD22 LEU 25 -6.797 13.037 -4.136 199 HD23 LEU 25 HD23 LEU 25 -7.392 12.878 -5.817 200 H LYS 26 H LYS 26 -6.730 8.160 -3.637 201 HA LYS 26 HA LYS 26 -7.965 6.305 -5.398 202 HB2 LYS 26 HB2 LYS 26 -5.466 6.517 -5.117 203 HB3 LYS 26 HB3 LYS 26 -5.600 5.799 -3.496 204 HG2 LYS 26 HG2 LYS 26 -4.926 3.996 -4.869 205 HG3 LYS 26 HG3 LYS 26 -6.657 3.709 -4.623 206 HD2 LYS 26 HD2 LYS 26 -7.149 4.561 -6.920 207 HD3 LYS 26 HD3 LYS 26 -5.475 5.153 -7.090 208 HE2 LYS 26 HE2 LYS 26 -5.681 3.127 -8.392 209 HE3 LYS 26 HE3 LYS 26 -4.603 2.804 -7.014 210 HZ1 LYS 26 HZ1 LYS 26 -6.193 0.960 -7.425 211 HZ2 LYS 26 HZ2 LYS 26 -7.531 2.043 -7.203 212 HZ3 LYS 26 HZ3 LYS 26 -6.471 1.644 -5.863 213 H CYS 27 H CYS 27 -7.291 6.170 -1.770 214 HA CYS 27 HA CYS 27 -8.363 3.587 -1.508 215 HB2 CYS 27 HB2 CYS 27 -7.011 4.649 0.314 216 HB3 CYS 27 HB3 CYS 27 -8.380 5.753 0.662 217 H LYS 28 H LYS 28 -10.016 6.847 -1.315 218 HA LYS 28 HA LYS 28 -12.532 5.737 -0.459 219 HB2 LYS 28 HB2 LYS 28 -11.821 8.313 -1.975 220 HB3 LYS 28 HB3 LYS 28 -13.511 7.808 -1.787 221 HG2 LYS 28 HG2 LYS 28 -12.905 9.412 -0.025 222 HG3 LYS 28 HG3 LYS 28 -13.397 7.836 0.647 223 HD2 LYS 28 HD2 LYS 28 -10.992 7.237 1.045 224 HD3 LYS 28 HD3 LYS 28 -10.490 8.791 0.312 225 HE2 LYS 28 HE2 LYS 28 -11.618 10.050 2.125 226 HE3 LYS 28 HE3 LYS 28 -12.291 8.543 2.805 227 HZ1 LYS 28 HZ1 LYS 28 -10.304 9.299 4.052 228 HZ2 LYS 28 HZ2 LYS 28 -9.334 9.183 2.615 229 HZ3 LYS 28 HZ3 LYS 28 -10.031 7.747 3.319 230 H ILE 29 H ILE 29 -11.101 6.307 -3.773 231 HA ILE 29 HA ILE 29 -13.539 5.582 -5.088 232 HB ILE 29 HB ILE 29 -10.658 5.628 -6.091 233 HG12 ILE 29 HG12 ILE 29 -13.042 7.439 -6.837 234 HG13 ILE 29 HG13 ILE 29 -11.993 7.810 -5.460 235 HG21 ILE 29 HG21 ILE 29 -11.628 5.348 -8.417 236 HG22 ILE 29 HG22 ILE 29 -11.877 3.907 -7.420 237 HG23 ILE 29 HG23 ILE 29 -13.229 5.042 -7.688 238 HD11 ILE 29 HD11 ILE 29 -11.222 9.096 -7.384 239 HD12 ILE 29 HD12 ILE 29 -9.980 7.881 -6.977 240 HD13 ILE 29 HD13 ILE 29 -11.052 7.637 -8.388 241 H THR 30 H THR 30 -10.476 3.536 -4.768 242 HA THR 30 HA THR 30 -11.967 1.243 -5.646 243 HB THR 30 HB THR 30 -9.472 1.464 -5.838 244 HG1 THR 30 HG1 THR 30 -10.450 -0.949 -4.653 245 HG21 THR 30 HG21 THR 30 -9.439 0.576 -2.875 246 HG22 THR 30 HG22 THR 30 -8.916 2.177 -3.464 247 HG23 THR 30 HG23 THR 30 -8.031 0.709 -3.956 248 H GLY 31 H GLY 31 -11.693 2.765 -2.421 249 HA2 GLY 31 HA2 GLY 31 -12.787 2.095 -0.450 250 HA3 GLY 31 HA3 GLY 31 -13.460 0.702 -1.322 251 H CYS 32 H CYS 32 -10.075 1.947 -0.600 252 HA CYS 32 HA CYS 32 -9.056 -0.708 -0.458 253 HB2 CYS 32 HB2 CYS 32 -6.963 0.144 0.242 254 HB3 CYS 32 HB3 CYS 32 -7.602 1.402 -0.835 Start of MODEL 7 1 H1 GLY 1 H1 GLY 1 12.813 -11.001 12.341 2 HA2 GLY 1 HA2 GLY 1 14.670 -10.133 10.908 3 HA3 GLY 1 HA3 GLY 1 13.668 -11.324 10.018 4 H ILE 2 H ILE 2 15.068 -9.507 8.469 5 HA ILE 2 HA ILE 2 13.418 -7.129 7.986 6 HB ILE 2 HB ILE 2 15.695 -8.348 6.331 7 HG12 ILE 2 HG12 ILE 2 15.609 -5.861 8.168 8 HG13 ILE 2 HG13 ILE 2 16.320 -7.430 8.611 9 HG21 ILE 2 HG21 ILE 2 14.238 -5.657 5.961 10 HG22 ILE 2 HG22 ILE 2 15.632 -6.231 5.000 11 HG23 ILE 2 HG23 ILE 2 14.081 -7.066 4.875 12 HD11 ILE 2 HD11 ILE 2 17.958 -7.204 6.673 13 HD12 ILE 2 HD12 ILE 2 17.362 -5.534 6.420 14 HD13 ILE 2 HD13 ILE 2 18.140 -5.974 7.955 15 H LEU 3 H LEU 3 14.074 -10.288 6.193 16 HA LEU 3 HA LEU 3 12.179 -9.656 4.173 17 HB2 LEU 3 HB2 LEU 3 13.060 -12.405 5.210 18 HB3 LEU 3 HB3 LEU 3 12.034 -12.189 3.772 19 HG LEU 3 HG LEU 3 14.879 -11.023 4.006 20 HD11 LEU 3 HD11 LEU 3 13.921 -13.595 2.596 21 HD12 LEU 3 HD12 LEU 3 14.940 -13.527 4.062 22 HD13 LEU 3 HD13 LEU 3 15.571 -12.914 2.515 23 HD21 LEU 3 HD21 LEU 3 14.683 -10.838 1.483 24 HD22 LEU 3 HD22 LEU 3 13.525 -9.779 2.303 25 HD23 LEU 3 HD23 LEU 3 12.969 -11.324 1.595 26 H SER 4 H SER 4 11.710 -11.620 7.263 27 HA SER 4 HA SER 4 9.113 -12.363 6.765 28 HB2 SER 4 HB2 SER 4 8.635 -12.355 9.170 29 HB3 SER 4 HB3 SER 4 10.286 -12.978 8.905 30 HG SER 4 HG SER 4 11.010 -10.795 9.546 31 H SER 5 H SER 5 10.223 -9.090 7.938 32 HA SER 5 HA SER 5 7.494 -8.102 8.151 33 HB2 SER 5 HB2 SER 5 10.155 -6.553 7.945 34 HB3 SER 5 HB3 SER 5 8.553 -5.843 8.281 35 HG SER 5 HG SER 5 9.828 -7.773 9.985 36 H PHE 6 H PHE 6 10.163 -7.876 5.642 37 HA PHE 6 HA PHE 6 8.734 -5.981 4.107 38 HB2 PHE 6 HB2 PHE 6 11.288 -6.733 3.927 39 HB3 PHE 6 HB3 PHE 6 10.690 -7.917 2.753 40 HD1 PHE 6 HD2 PHE 6 10.721 -4.285 3.728 41 HD2 PHE 6 HD1 PHE 6 10.192 -7.052 0.471 42 HE1 PHE 6 HE2 PHE 6 10.781 -2.403 2.125 43 HE2 PHE 6 HE1 PHE 6 10.265 -5.164 -1.134 44 HZ PHE 6 HZ PHE 6 10.560 -2.837 -0.312 45 H LYS 7 H LYS 7 9.024 -9.612 3.651 46 HA LYS 7 HA LYS 7 7.067 -9.643 1.568 47 HB2 LYS 7 HB2 LYS 7 7.026 -12.042 1.748 48 HB3 LYS 7 HB3 LYS 7 8.690 -11.493 2.031 49 HG2 LYS 7 HG2 LYS 7 8.480 -13.078 3.746 50 HG3 LYS 7 HG3 LYS 7 7.956 -11.629 4.633 51 HD2 LYS 7 HD2 LYS 7 5.526 -12.310 4.198 52 HD3 LYS 7 HD3 LYS 7 6.130 -13.750 3.341 53 HE2 LYS 7 HE2 LYS 7 7.275 -14.498 5.466 54 HE3 LYS 7 HE3 LYS 7 6.645 -13.052 6.303 55 HZ1 LYS 7 HZ1 LYS 7 4.340 -13.818 5.866 56 HZ2 LYS 7 HZ2 LYS 7 5.243 -15.020 6.741 57 HZ3 LYS 7 HZ3 LYS 7 4.947 -15.230 5.041 58 H GLY 8 H GLY 8 6.706 -9.425 5.155 59 HA2 GLY 8 HA2 GLY 8 3.840 -10.138 4.960 60 HA3 GLY 8 HA3 GLY 8 4.736 -9.638 6.404 61 H VAL 9 H VAL 9 5.511 -7.295 4.005 62 HA VAL 9 HA VAL 9 3.094 -5.657 4.646 63 HB VAL 9 HB VAL 9 6.006 -4.868 5.252 64 HG11 VAL 9 HG11 VAL 9 3.426 -3.184 5.406 65 HG12 VAL 9 HG12 VAL 9 5.027 -2.679 6.018 66 HG13 VAL 9 HG13 VAL 9 4.783 -2.918 4.273 67 HG21 VAL 9 HG21 VAL 9 5.195 -4.614 7.602 68 HG22 VAL 9 HG22 VAL 9 3.576 -5.195 7.118 69 HG23 VAL 9 HG23 VAL 9 4.985 -6.291 7.052 70 H ALA 10 H ALA 10 6.362 -5.438 2.910 71 HA ALA 10 HA ALA 10 5.303 -3.593 1.037 72 HB1 ALA 10 HB1 ALA 10 7.626 -5.572 0.656 73 HB2 ALA 10 HB2 ALA 10 7.335 -4.107 -0.329 74 HB3 ALA 10 HB3 ALA 10 7.764 -3.948 1.400 75 H LYS 11 H LYS 11 4.965 -7.185 1.167 76 HA LYS 11 HA LYS 11 4.992 -7.918 -1.354 77 HB2 LYS 11 HB2 LYS 11 3.314 -9.613 -1.052 78 HB3 LYS 11 HB3 LYS 11 4.276 -9.464 0.426 79 HG2 LYS 11 HG2 LYS 11 1.431 -8.353 -0.031 80 HG3 LYS 11 HG3 LYS 11 1.832 -9.842 0.851 81 HD2 LYS 11 HD2 LYS 11 3.116 -8.505 2.558 82 HD3 LYS 11 HD3 LYS 11 2.596 -7.010 1.765 83 HE2 LYS 11 HE2 LYS 11 0.726 -9.086 3.035 84 HE3 LYS 11 HE3 LYS 11 1.223 -7.535 3.754 85 HZ1 LYS 11 HZ1 LYS 11 0.159 -6.356 1.809 86 HZ2 LYS 11 HZ2 LYS 11 -0.955 -7.244 2.806 87 HZ3 LYS 11 HZ3 LYS 11 -0.496 -7.888 1.277 88 H GLY 12 H GLY 12 2.170 -5.857 -0.218 89 HA2 GLY 12 HA2 GLY 12 1.213 -5.892 -3.091 90 HA3 GLY 12 HA3 GLY 12 0.190 -5.700 -1.651 91 H VAL 13 H VAL 13 3.459 -4.216 -2.184 92 HA VAL 13 HA VAL 13 2.428 -1.706 -1.325 93 HB VAL 13 HB VAL 13 4.802 -2.351 -1.018 94 HG11 VAL 13 HG11 VAL 13 6.475 -2.092 -2.829 95 HG12 VAL 13 HG12 VAL 13 5.326 -3.364 -3.295 96 HG13 VAL 13 HG13 VAL 13 5.196 -1.737 -4.018 97 HG21 VAL 13 HG21 VAL 13 5.765 -0.122 -1.350 98 HG22 VAL 13 HG22 VAL 13 4.567 0.260 -2.612 99 HG23 VAL 13 HG23 VAL 13 4.046 0.081 -0.906 100 H ALA 14 H ALA 14 3.019 -3.060 -4.666 101 HA ALA 14 HA ALA 14 3.144 -0.793 -6.106 102 HB1 ALA 14 HB1 ALA 14 3.140 -2.993 -7.206 103 HB2 ALA 14 HB2 ALA 14 1.402 -3.216 -6.863 104 HB3 ALA 14 HB3 ALA 14 1.933 -1.934 -7.995 105 H LYS 15 H LYS 15 -0.155 -2.220 -5.256 106 HA LYS 15 HA LYS 15 -1.379 0.310 -6.162 107 HB2 LYS 15 HB2 LYS 15 -2.457 -1.856 -6.630 108 HB3 LYS 15 HB3 LYS 15 -2.649 -2.180 -4.885 109 HG2 LYS 15 HG2 LYS 15 -4.054 -0.095 -4.653 110 HG3 LYS 15 HG3 LYS 15 -3.909 0.198 -6.404 111 HD2 LYS 15 HD2 LYS 15 -5.227 -2.277 -5.091 112 HD3 LYS 15 HD3 LYS 15 -6.095 -0.856 -5.721 113 HE2 LYS 15 HE2 LYS 15 -5.124 -1.339 -8.033 114 HE3 LYS 15 HE3 LYS 15 -4.454 -2.863 -7.386 115 HZ1 LYS 15 HZ1 LYS 15 -6.735 -3.583 -6.769 116 HZ2 LYS 15 HZ2 LYS 15 -6.600 -3.261 -8.474 117 HZ3 LYS 15 HZ3 LYS 15 -7.393 -2.114 -7.443 118 H ASP 16 H ASP 16 -0.954 -1.533 -3.015 119 HA ASP 16 HA ASP 16 -2.597 0.197 -1.557 120 HB2 ASP 16 HB2 ASP 16 -1.691 -2.070 -0.800 121 HB3 ASP 16 HB3 ASP 16 -0.151 -1.256 -0.402 122 H LEU 17 H LEU 17 0.789 0.770 -2.622 123 HA LEU 17 HA LEU 17 1.505 2.640 -0.676 124 HB2 LEU 17 HB2 LEU 17 2.836 1.830 -2.898 125 HB3 LEU 17 HB3 LEU 17 2.207 3.324 -3.584 126 HG LEU 17 HG LEU 17 4.009 2.952 -1.105 127 HD11 LEU 17 HD11 LEU 17 5.136 2.698 -3.348 128 HD12 LEU 17 HD12 LEU 17 5.710 4.144 -2.479 129 HD13 LEU 17 HD13 LEU 17 4.544 4.316 -3.822 130 HD21 LEU 17 HD21 LEU 17 2.577 4.859 -0.577 131 HD22 LEU 17 HD22 LEU 17 2.763 5.531 -2.229 132 HD23 LEU 17 HD23 LEU 17 4.146 5.508 -1.092 133 H ALA 18 H ALA 18 -0.268 3.130 -3.847 134 HA ALA 18 HA ALA 18 -0.837 5.884 -3.429 135 HB1 ALA 18 HB1 ALA 18 -2.478 3.746 -4.926 136 HB2 ALA 18 HB2 ALA 18 -2.782 5.506 -5.016 137 HB3 ALA 18 HB3 ALA 18 -1.247 4.828 -5.629 138 H GLY 19 H GLY 19 -2.614 2.853 -2.356 139 HA2 GLY 19 HA2 GLY 19 -4.826 3.995 -1.183 140 HA3 GLY 19 HA3 GLY 19 -3.945 2.639 -0.437 141 H LYS 20 H LYS 20 -1.382 4.166 0.118 142 HA LYS 20 HA LYS 20 -2.392 5.517 2.549 143 HB2 LYS 20 HB2 LYS 20 0.471 4.904 1.623 144 HB3 LYS 20 HB3 LYS 20 0.073 5.955 2.998 145 HG2 LYS 20 HG2 LYS 20 0.571 3.792 3.884 146 HG3 LYS 20 HG3 LYS 20 -1.170 4.088 4.110 147 HD2 LYS 20 HD2 LYS 20 -1.665 2.581 2.143 148 HD3 LYS 20 HD3 LYS 20 0.088 2.411 1.845 149 HE2 LYS 20 HE2 LYS 20 -0.591 0.410 2.989 150 HE3 LYS 20 HE3 LYS 20 0.310 1.360 4.181 151 HZ1 LYS 20 HZ1 LYS 20 -2.724 1.235 3.961 152 HZ2 LYS 20 HZ2 LYS 20 -1.830 2.071 5.208 153 HZ3 LYS 20 HZ3 LYS 20 -1.758 0.351 5.101 154 H LEU 21 H LEU 21 -0.050 6.510 -0.149 155 HA LEU 21 HA LEU 21 -0.054 9.185 0.857 156 HB2 LEU 21 HB2 LEU 21 0.540 8.243 -2.010 157 HB3 LEU 21 HB3 LEU 21 0.863 9.883 -1.395 158 HG LEU 21 HG LEU 21 2.206 7.307 -0.377 159 HD11 LEU 21 HD11 LEU 21 2.911 8.013 -2.706 160 HD12 LEU 21 HD12 LEU 21 4.241 8.174 -1.531 161 HD13 LEU 21 HD13 LEU 21 3.343 9.622 -2.067 162 HD21 LEU 21 HD21 LEU 21 2.158 8.896 1.502 163 HD22 LEU 21 HD22 LEU 21 2.674 10.238 0.435 164 HD23 LEU 21 HD23 LEU 21 3.790 8.896 0.815 165 H LEU 22 H LEU 22 -1.958 7.630 -1.813 166 HA LEU 22 HA LEU 22 -3.623 10.134 -1.956 167 HB2 LEU 22 HB2 LEU 22 -3.610 7.673 -3.767 168 HB3 LEU 22 HB3 LEU 22 -4.426 9.225 -4.073 169 HG LEU 22 HG LEU 22 -1.380 8.706 -4.013 170 HD11 LEU 22 HD11 LEU 22 -3.257 9.477 -6.335 171 HD12 LEU 22 HD12 LEU 22 -2.570 7.851 -6.056 172 HD13 LEU 22 HD13 LEU 22 -1.493 9.215 -6.448 173 HD21 LEU 22 HD21 LEU 22 -1.749 10.997 -3.149 174 HD22 LEU 22 HD22 LEU 22 -2.910 11.345 -4.470 175 HD23 LEU 22 HD23 LEU 22 -1.174 11.105 -4.825 176 H GLU 23 H GLU 23 -3.892 8.788 0.513 177 HA GLU 23 HA GLU 23 -5.993 6.847 0.350 178 HB2 GLU 23 HB2 GLU 23 -4.637 7.244 2.449 179 HB3 GLU 23 HB3 GLU 23 -5.434 8.827 2.649 180 HG2 GLU 23 HG2 GLU 23 -7.679 7.624 2.761 181 HG3 GLU 23 HG3 GLU 23 -6.815 6.063 2.664 182 H THR 24 H THR 24 -5.908 10.461 0.758 183 HA THR 24 HA THR 24 -8.542 10.995 1.090 184 HB THR 24 HB THR 24 -6.793 12.745 0.962 185 HG1 THR 24 HG1 THR 24 -8.261 14.277 -0.103 186 HG21 THR 24 HG21 THR 24 -7.034 12.495 -2.113 187 HG22 THR 24 HG22 THR 24 -5.616 11.938 -1.179 188 HG23 THR 24 HG23 THR 24 -6.035 13.671 -1.224 189 H LEU 25 H LEU 25 -7.181 9.776 -2.022 190 HA LEU 25 HA LEU 25 -9.993 9.791 -3.031 191 HB2 LEU 25 HB2 LEU 25 -9.378 10.665 -5.195 192 HB3 LEU 25 HB3 LEU 25 -8.879 11.751 -3.885 193 HG LEU 25 HG LEU 25 -6.492 10.569 -4.187 194 HD11 LEU 25 HD11 LEU 25 -7.681 10.200 -7.023 195 HD12 LEU 25 HD12 LEU 25 -7.332 8.839 -5.945 196 HD13 LEU 25 HD13 LEU 25 -6.003 9.864 -6.519 197 HD21 LEU 25 HD21 LEU 25 -7.579 12.614 -6.208 198 HD22 LEU 25 HD22 LEU 25 -5.850 12.299 -5.876 199 HD23 LEU 25 HD23 LEU 25 -6.889 12.981 -4.603 200 H LYS 26 H LYS 26 -6.704 8.150 -3.570 201 HA LYS 26 HA LYS 26 -7.900 6.286 -5.328 202 HB2 LYS 26 HB2 LYS 26 -5.394 6.535 -4.999 203 HB3 LYS 26 HB3 LYS 26 -5.550 5.747 -3.416 204 HG2 LYS 26 HG2 LYS 26 -4.872 3.989 -4.838 205 HG3 LYS 26 HG3 LYS 26 -6.614 3.719 -4.684 206 HD2 LYS 26 HD2 LYS 26 -6.985 4.724 -6.953 207 HD3 LYS 26 HD3 LYS 26 -5.286 5.259 -7.017 208 HE2 LYS 26 HE2 LYS 26 -5.506 3.318 -8.434 209 HE3 LYS 26 HE3 LYS 26 -4.510 2.872 -7.029 210 HZ1 LYS 26 HZ1 LYS 26 -7.461 2.265 -7.381 211 HZ2 LYS 26 HZ2 LYS 26 -6.468 1.731 -6.034 212 HZ3 LYS 26 HZ3 LYS 26 -6.172 1.133 -7.630 213 H CYS 27 H CYS 27 -7.255 6.094 -1.706 214 HA CYS 27 HA CYS 27 -8.281 3.501 -1.469 215 HB2 CYS 27 HB2 CYS 27 -7.038 4.612 0.404 216 HB3 CYS 27 HB3 CYS 27 -8.447 5.689 0.675 217 H LYS 28 H LYS 28 -10.039 6.694 -1.493 218 HA LYS 28 HA LYS 28 -12.545 5.499 -0.639 219 HB2 LYS 28 HB2 LYS 28 -11.950 8.089 -2.187 220 HB3 LYS 28 HB3 LYS 28 -13.601 7.516 -1.864 221 HG2 LYS 28 HG2 LYS 28 -12.977 9.183 -0.218 222 HG3 LYS 28 HG3 LYS 28 -13.271 7.617 0.584 223 HD2 LYS 28 HD2 LYS 28 -10.814 7.221 0.778 224 HD3 LYS 28 HD3 LYS 28 -10.496 8.736 -0.117 225 HE2 LYS 28 HE2 LYS 28 -11.816 8.482 2.659 226 HE3 LYS 28 HE3 LYS 28 -10.138 8.981 2.325 227 HZ1 LYS 28 HZ1 LYS 28 -11.370 10.970 2.731 228 HZ2 LYS 28 HZ2 LYS 28 -12.666 10.533 1.694 229 HZ3 LYS 28 HZ3 LYS 28 -11.108 10.938 1.011 230 H ILE 29 H ILE 29 -10.988 6.174 -3.875 231 HA ILE 29 HA ILE 29 -13.307 5.401 -5.348 232 HB ILE 29 HB ILE 29 -10.363 5.516 -6.150 233 HG12 ILE 29 HG12 ILE 29 -12.705 7.291 -7.071 234 HG13 ILE 29 HG13 ILE 29 -11.804 7.666 -5.595 235 HG21 ILE 29 HG21 ILE 29 -11.443 3.788 -7.578 236 HG22 ILE 29 HG22 ILE 29 -12.799 4.896 -7.929 237 HG23 ILE 29 HG23 ILE 29 -11.158 5.249 -8.538 238 HD11 ILE 29 HD11 ILE 29 -10.875 8.988 -7.424 239 HD12 ILE 29 HD12 ILE 29 -9.655 7.798 -6.898 240 HD13 ILE 29 HD13 ILE 29 -10.568 7.540 -8.413 241 H THR 30 H THR 30 -10.219 3.414 -4.883 242 HA THR 30 HA THR 30 -11.616 1.097 -5.818 243 HB THR 30 HB THR 30 -9.109 1.305 -5.872 244 HG1 THR 30 HG1 THR 30 -10.129 -0.833 -6.027 245 HG21 THR 30 HG21 THR 30 -9.241 0.548 -2.882 246 HG22 THR 30 HG22 THR 30 -8.711 2.140 -3.494 247 HG23 THR 30 HG23 THR 30 -7.774 0.675 -3.883 248 H GLY 31 H GLY 31 -11.469 2.605 -2.568 249 HA2 GLY 31 HA2 GLY 31 -12.717 1.948 -0.677 250 HA3 GLY 31 HA3 GLY 31 -13.316 0.540 -1.575 251 H CYS 32 H CYS 32 -10.019 1.851 -0.604 252 HA CYS 32 HA CYS 32 -8.968 -0.802 -0.403 253 HB2 CYS 32 HB2 CYS 32 -6.917 0.084 0.352 254 HB3 CYS 32 HB3 CYS 32 -7.533 1.324 -0.758 Start of MODEL 8 1 H1 GLY 1 H1 GLY 1 12.609 -11.323 11.884 2 HA2 GLY 1 HA2 GLY 1 14.514 -10.589 10.438 3 HA3 GLY 1 HA3 GLY 1 13.336 -11.577 9.514 4 H ILE 2 H ILE 2 14.978 -9.728 8.127 5 HA ILE 2 HA ILE 2 13.387 -7.275 7.731 6 HB ILE 2 HB ILE 2 15.746 -8.396 6.123 7 HG12 ILE 2 HG12 ILE 2 15.562 -6.062 8.139 8 HG13 ILE 2 HG13 ILE 2 16.278 -7.657 8.471 9 HG21 ILE 2 HG21 ILE 2 14.306 -5.683 5.883 10 HG22 ILE 2 HG22 ILE 2 15.724 -6.201 4.927 11 HG23 ILE 2 HG23 ILE 2 14.174 -7.019 4.703 12 HD11 ILE 2 HD11 ILE 2 17.365 -5.564 6.490 13 HD12 ILE 2 HD12 ILE 2 18.100 -6.128 8.006 14 HD13 ILE 2 HD13 ILE 2 17.979 -7.243 6.616 15 H LEU 3 H LEU 3 14.229 -10.223 5.671 16 HA LEU 3 HA LEU 3 12.274 -9.769 3.806 17 HB2 LEU 3 HB2 LEU 3 12.225 -12.042 3.172 18 HB3 LEU 3 HB3 LEU 3 13.907 -11.663 3.602 19 HG LEU 3 HG LEU 3 11.910 -13.201 5.407 20 HD11 LEU 3 HD11 LEU 3 12.395 -14.467 3.312 21 HD12 LEU 3 HD12 LEU 3 13.150 -15.255 4.717 22 HD13 LEU 3 HD13 LEU 3 14.150 -14.286 3.598 23 HD21 LEU 3 HD21 LEU 3 13.751 -12.213 6.802 24 HD22 LEU 3 HD22 LEU 3 14.970 -12.823 5.648 25 HD23 LEU 3 HD23 LEU 3 14.002 -13.953 6.633 26 H SER 4 H SER 4 11.708 -11.100 7.156 27 HA SER 4 HA SER 4 9.082 -12.030 6.554 28 HB2 SER 4 HB2 SER 4 8.673 -12.003 8.993 29 HB3 SER 4 HB3 SER 4 10.242 -12.748 8.582 30 HG SER 4 HG SER 4 9.940 -10.094 9.624 31 H SER 5 H SER 5 10.416 -8.784 7.554 32 HA SER 5 HA SER 5 7.794 -7.627 7.925 33 HB2 SER 5 HB2 SER 5 10.479 -6.234 7.315 34 HB3 SER 5 HB3 SER 5 8.954 -5.423 7.755 35 HG SER 5 HG SER 5 10.326 -7.270 9.474 36 H PHE 6 H PHE 6 10.192 -7.670 5.139 37 HA PHE 6 HA PHE 6 8.587 -5.921 3.554 38 HB2 PHE 6 HB2 PHE 6 10.853 -7.832 2.828 39 HB3 PHE 6 HB3 PHE 6 9.828 -7.158 1.553 40 HD1 PHE 6 HD1 PHE 6 11.789 -6.002 4.600 41 HD2 PHE 6 HD2 PHE 6 10.332 -5.010 0.669 42 HE1 PHE 6 HE1 PHE 6 12.949 -3.828 4.713 43 HE2 PHE 6 HE2 PHE 6 11.527 -2.857 0.776 44 HZ PHE 6 HZ PHE 6 12.835 -2.252 2.800 45 H LYS 7 H LYS 7 8.757 -9.608 3.557 46 HA LYS 7 HA LYS 7 6.682 -9.716 1.588 47 HB2 LYS 7 HB2 LYS 7 6.541 -12.073 1.889 48 HB3 LYS 7 HB3 LYS 7 8.240 -11.590 2.075 49 HG2 LYS 7 HG2 LYS 7 7.993 -13.125 3.813 50 HG3 LYS 7 HG3 LYS 7 7.695 -11.597 4.682 51 HD2 LYS 7 HD2 LYS 7 5.231 -12.008 4.597 52 HD3 LYS 7 HD3 LYS 7 5.482 -13.471 3.616 53 HE2 LYS 7 HE2 LYS 7 6.533 -13.065 6.492 54 HE3 LYS 7 HE3 LYS 7 5.003 -13.874 6.066 55 HZ1 LYS 7 HZ1 LYS 7 7.787 -14.865 5.369 56 HZ2 LYS 7 HZ2 LYS 7 6.305 -15.549 4.743 57 HZ3 LYS 7 HZ3 LYS 7 6.644 -15.568 6.443 58 H GLY 8 H GLY 8 6.504 -9.096 5.121 59 HA2 GLY 8 HA2 GLY 8 3.576 -9.637 5.078 60 HA3 GLY 8 HA3 GLY 8 4.565 -9.132 6.458 61 H VAL 9 H VAL 9 5.444 -7.027 3.889 62 HA VAL 9 HA VAL 9 3.237 -5.109 4.547 63 HB VAL 9 HB VAL 9 6.246 -4.594 4.905 64 HG11 VAL 9 HG11 VAL 9 5.549 -2.271 5.569 65 HG12 VAL 9 HG12 VAL 9 5.167 -2.600 3.863 66 HG13 VAL 9 HG13 VAL 9 3.867 -2.642 5.091 67 HG21 VAL 9 HG21 VAL 9 5.195 -5.786 6.858 68 HG22 VAL 9 HG22 VAL 9 5.629 -4.114 7.277 69 HG23 VAL 9 HG23 VAL 9 3.926 -4.532 6.937 70 H ALA 10 H ALA 10 6.378 -5.359 2.608 71 HA ALA 10 HA ALA 10 5.348 -3.564 0.658 72 HB1 ALA 10 HB1 ALA 10 7.796 -3.969 0.975 73 HB2 ALA 10 HB2 ALA 10 7.599 -5.644 0.374 74 HB3 ALA 10 HB3 ALA 10 7.306 -4.258 -0.721 75 H LYS 11 H LYS 11 4.725 -7.075 1.106 76 HA LYS 11 HA LYS 11 4.815 -7.876 -1.442 77 HB2 LYS 11 HB2 LYS 11 3.558 -9.750 -1.058 78 HB3 LYS 11 HB3 LYS 11 4.213 -9.376 0.538 79 HG2 LYS 11 HG2 LYS 11 1.309 -8.791 -0.423 80 HG3 LYS 11 HG3 LYS 11 1.848 -10.261 0.405 81 HD2 LYS 11 HD2 LYS 11 0.761 -9.058 2.072 82 HD3 LYS 11 HD3 LYS 11 2.486 -8.857 2.448 83 HE2 LYS 11 HE2 LYS 11 2.420 -6.564 1.575 84 HE3 LYS 11 HE3 LYS 11 0.750 -6.778 0.969 85 HZ1 LYS 11 HZ1 LYS 11 0.865 -5.534 3.114 86 HZ2 LYS 11 HZ2 LYS 11 1.571 -6.926 3.888 87 HZ3 LYS 11 HZ3 LYS 11 -0.050 -7.005 3.265 88 H GLY 12 H GLY 12 2.299 -5.537 -0.525 89 HA2 GLY 12 HA2 GLY 12 1.236 -5.858 -3.325 90 HA3 GLY 12 HA3 GLY 12 0.146 -5.751 -1.913 91 H VAL 13 H VAL 13 3.341 -4.112 -2.438 92 HA VAL 13 HA VAL 13 2.162 -1.638 -1.583 93 HB VAL 13 HB VAL 13 4.534 -2.290 -1.144 94 HG11 VAL 13 HG11 VAL 13 5.220 -3.131 -3.448 95 HG12 VAL 13 HG12 VAL 13 5.073 -1.467 -4.077 96 HG13 VAL 13 HG13 VAL 13 6.302 -1.856 -2.845 97 HG21 VAL 13 HG21 VAL 13 5.452 -0.017 -1.275 98 HG22 VAL 13 HG22 VAL 13 4.288 0.408 -2.553 99 HG23 VAL 13 HG23 VAL 13 3.713 0.091 -0.888 100 H ALA 14 H ALA 14 2.934 -3.034 -4.862 101 HA ALA 14 HA ALA 14 3.005 -0.794 -6.385 102 HB1 ALA 14 HB1 ALA 14 1.820 -2.050 -8.221 103 HB2 ALA 14 HB2 ALA 14 3.051 -3.057 -7.402 104 HB3 ALA 14 HB3 ALA 14 1.318 -3.295 -7.036 105 H LYS 15 H LYS 15 -0.149 -2.310 -5.267 106 HA LYS 15 HA LYS 15 -1.593 0.065 -6.286 107 HB2 LYS 15 HB2 LYS 15 -2.539 -2.200 -6.522 108 HB3 LYS 15 HB3 LYS 15 -2.618 -2.393 -4.750 109 HG2 LYS 15 HG2 LYS 15 -4.142 -0.383 -4.600 110 HG3 LYS 15 HG3 LYS 15 -4.121 -0.226 -6.368 111 HD2 LYS 15 HD2 LYS 15 -5.226 -2.587 -4.708 112 HD3 LYS 15 HD3 LYS 15 -6.183 -1.349 -5.561 113 HE2 LYS 15 HE2 LYS 15 -4.462 -3.562 -6.854 114 HE3 LYS 15 HE3 LYS 15 -6.229 -3.439 -6.817 115 HZ1 LYS 15 HZ1 LYS 15 -4.342 -1.600 -8.331 116 HZ2 LYS 15 HZ2 LYS 15 -6.063 -1.328 -8.154 117 HZ3 LYS 15 HZ3 LYS 15 -5.462 -2.733 -8.984 118 H ASP 16 H ASP 16 -0.880 -1.521 -3.042 119 HA ASP 16 HA ASP 16 -2.593 0.253 -1.689 120 HB2 ASP 16 HB2 ASP 16 -1.669 -1.975 -0.825 121 HB3 ASP 16 HB3 ASP 16 -0.165 -1.110 -0.401 122 H LEU 17 H LEU 17 0.794 0.803 -2.765 123 HA LEU 17 HA LEU 17 1.521 2.726 -0.905 124 HB2 LEU 17 HB2 LEU 17 2.712 1.958 -3.320 125 HB3 LEU 17 HB3 LEU 17 2.170 3.565 -3.760 126 HG LEU 17 HG LEU 17 3.978 2.827 -1.369 127 HD11 LEU 17 HD11 LEU 17 5.781 3.948 -2.674 128 HD12 LEU 17 HD12 LEU 17 4.638 4.280 -4.008 129 HD13 LEU 17 HD13 LEU 17 5.097 2.599 -3.615 130 HD21 LEU 17 HD21 LEU 17 3.020 5.579 -2.366 131 HD22 LEU 17 HD22 LEU 17 4.330 5.342 -1.170 132 HD23 LEU 17 HD23 LEU 17 2.673 4.846 -0.770 133 H ALA 18 H ALA 18 -0.332 3.173 -4.021 134 HA ALA 18 HA ALA 18 -0.901 5.934 -3.620 135 HB1 ALA 18 HB1 ALA 18 -2.553 3.771 -5.071 136 HB2 ALA 18 HB2 ALA 18 -2.856 5.535 -5.177 137 HB3 ALA 18 HB3 ALA 18 -1.329 4.844 -5.802 138 H GLY 19 H GLY 19 -2.657 2.904 -2.503 139 HA2 GLY 19 HA2 GLY 19 -4.840 4.088 -1.292 140 HA3 GLY 19 HA3 GLY 19 -3.984 2.695 -0.585 141 H LYS 20 H LYS 20 -1.376 4.158 -0.034 142 HA LYS 20 HA LYS 20 -2.314 5.422 2.459 143 HB2 LYS 20 HB2 LYS 20 0.546 4.988 1.413 144 HB3 LYS 20 HB3 LYS 20 0.126 5.923 2.864 145 HG2 LYS 20 HG2 LYS 20 0.779 3.767 3.611 146 HG3 LYS 20 HG3 LYS 20 -0.978 3.901 3.873 147 HD2 LYS 20 HD2 LYS 20 -1.389 2.483 1.850 148 HD3 LYS 20 HD3 LYS 20 0.358 2.504 1.464 149 HE2 LYS 20 HE2 LYS 20 -0.036 0.375 2.460 150 HE3 LYS 20 HE3 LYS 20 0.787 1.321 3.711 151 HZ1 LYS 20 HZ1 LYS 20 -1.396 1.719 4.822 152 HZ2 LYS 20 HZ2 LYS 20 -1.118 0.026 4.607 153 HZ3 LYS 20 HZ3 LYS 20 -2.217 0.851 3.546 154 H LEU 21 H LEU 21 -0.161 6.528 -0.339 155 HA LEU 21 HA LEU 21 -0.097 9.172 0.791 156 HB2 LEU 21 HB2 LEU 21 0.435 8.345 -2.122 157 HB3 LEU 21 HB3 LEU 21 0.824 9.931 -1.410 158 HG LEU 21 HG LEU 21 2.090 7.239 -0.604 159 HD11 LEU 21 HD11 LEU 21 2.806 8.111 -2.866 160 HD12 LEU 21 HD12 LEU 21 4.142 8.131 -1.687 161 HD13 LEU 21 HD13 LEU 21 3.295 9.649 -2.100 162 HD21 LEU 21 HD21 LEU 21 2.648 10.069 0.459 163 HD22 LEU 21 HD22 LEU 21 3.722 8.665 0.716 164 HD23 LEU 21 HD23 LEU 21 2.091 8.654 1.407 165 H LEU 22 H LEU 22 -2.080 7.687 -1.858 166 HA LEU 22 HA LEU 22 -3.689 10.228 -1.954 167 HB2 LEU 22 HB2 LEU 22 -3.787 7.783 -3.788 168 HB3 LEU 22 HB3 LEU 22 -4.523 9.378 -4.075 169 HG LEU 22 HG LEU 22 -1.510 8.695 -4.048 170 HD11 LEU 22 HD11 LEU 22 -2.768 7.935 -6.088 171 HD12 LEU 22 HD12 LEU 22 -1.610 9.235 -6.469 172 HD13 LEU 22 HD13 LEU 22 -3.354 9.604 -6.342 173 HD21 LEU 22 HD21 LEU 22 -1.750 10.992 -3.144 174 HD22 LEU 22 HD22 LEU 22 -2.890 11.423 -4.458 175 HD23 LEU 22 HD23 LEU 22 -1.171 11.086 -4.820 176 H GLU 23 H GLU 23 -3.943 8.805 0.510 177 HA GLU 23 HA GLU 23 -6.013 6.857 0.327 178 HB2 GLU 23 HB2 GLU 23 -4.616 7.271 2.412 179 HB3 GLU 23 HB3 GLU 23 -5.525 8.780 2.679 180 HG2 GLU 23 HG2 GLU 23 -7.671 7.372 2.753 181 HG3 GLU 23 HG3 GLU 23 -6.668 5.905 2.618 182 H THR 24 H THR 24 -6.049 10.456 0.865 183 HA THR 24 HA THR 24 -8.700 10.913 1.199 184 HB THR 24 HB THR 24 -7.003 12.713 1.125 185 HG1 THR 24 HG1 THR 24 -8.511 14.225 0.092 186 HG21 THR 24 HG21 THR 24 -6.257 13.713 -1.013 187 HG22 THR 24 HG22 THR 24 -7.215 12.541 -1.951 188 HG23 THR 24 HG23 THR 24 -5.787 11.991 -1.026 189 H LEU 25 H LEU 25 -7.291 9.871 -1.967 190 HA LEU 25 HA LEU 25 -10.100 9.891 -3.008 191 HB2 LEU 25 HB2 LEU 25 -9.450 10.810 -5.119 192 HB3 LEU 25 HB3 LEU 25 -8.972 11.865 -3.776 193 HG LEU 25 HG LEU 25 -6.574 10.713 -4.064 194 HD11 LEU 25 HD11 LEU 25 -6.040 10.059 -6.404 195 HD12 LEU 25 HD12 LEU 25 -7.707 10.407 -6.934 196 HD13 LEU 25 HD13 LEU 25 -7.381 9.017 -5.886 197 HD21 LEU 25 HD21 LEU 25 -5.912 12.483 -5.688 198 HD22 LEU 25 HD22 LEU 25 -6.977 13.129 -4.418 199 HD23 LEU 25 HD23 LEU 25 -7.638 12.796 -6.043 200 H LYS 26 H LYS 26 -6.804 8.247 -3.540 201 HA LYS 26 HA LYS 26 -7.997 6.371 -5.288 202 HB2 LYS 26 HB2 LYS 26 -5.544 6.500 -5.100 203 HB3 LYS 26 HB3 LYS 26 -5.600 5.996 -3.394 204 HG2 LYS 26 HG2 LYS 26 -4.919 4.105 -4.723 205 HG3 LYS 26 HG3 LYS 26 -6.509 3.744 -4.042 206 HD2 LYS 26 HD2 LYS 26 -7.605 4.162 -6.221 207 HD3 LYS 26 HD3 LYS 26 -6.093 4.827 -6.907 208 HE2 LYS 26 HE2 LYS 26 -4.986 2.596 -6.695 209 HE3 LYS 26 HE3 LYS 26 -6.463 1.915 -5.970 210 HZ1 LYS 26 HZ1 LYS 26 -7.687 2.422 -8.076 211 HZ2 LYS 26 HZ2 LYS 26 -6.320 1.386 -8.363 212 HZ3 LYS 26 HZ3 LYS 26 -6.226 3.075 -8.769 213 H CYS 27 H CYS 27 -7.323 6.148 -1.667 214 HA CYS 27 HA CYS 27 -8.378 3.575 -1.463 215 HB2 CYS 27 HB2 CYS 27 -7.105 4.637 0.412 216 HB3 CYS 27 HB3 CYS 27 -8.512 5.702 0.742 217 H LYS 28 H LYS 28 -10.095 6.785 -1.288 218 HA LYS 28 HA LYS 28 -12.632 5.633 -0.545 219 HB2 LYS 28 HB2 LYS 28 -11.880 8.232 -2.004 220 HB3 LYS 28 HB3 LYS 28 -13.572 7.711 -1.867 221 HG2 LYS 28 HG2 LYS 28 -13.000 9.309 -0.073 222 HG3 LYS 28 HG3 LYS 28 -13.532 7.731 0.564 223 HD2 LYS 28 HD2 LYS 28 -11.160 7.099 1.056 224 HD3 LYS 28 HD3 LYS 28 -10.598 8.643 0.346 225 HE2 LYS 28 HE2 LYS 28 -11.797 9.922 2.108 226 HE3 LYS 28 HE3 LYS 28 -12.485 8.415 2.775 227 HZ1 LYS 28 HZ1 LYS 28 -10.538 9.175 4.076 228 HZ2 LYS 28 HZ2 LYS 28 -9.528 9.082 2.665 229 HZ3 LYS 28 HZ3 LYS 28 -10.225 7.631 3.342 230 H ILE 29 H ILE 29 -11.066 6.270 -3.791 231 HA ILE 29 HA ILE 29 -13.438 5.449 -5.199 232 HB ILE 29 HB ILE 29 -10.545 5.725 -6.128 233 HG12 ILE 29 HG12 ILE 29 -13.026 7.406 -6.849 234 HG13 ILE 29 HG13 ILE 29 -12.013 7.795 -5.448 235 HG21 ILE 29 HG21 ILE 29 -13.044 5.039 -7.799 236 HG22 ILE 29 HG22 ILE 29 -11.448 5.460 -8.479 237 HG23 ILE 29 HG23 ILE 29 -11.635 3.974 -7.537 238 HD11 ILE 29 HD11 ILE 29 -11.302 9.190 -7.316 239 HD12 ILE 29 HD12 ILE 29 -9.994 8.036 -6.938 240 HD13 ILE 29 HD13 ILE 29 -11.037 7.780 -8.370 241 H THR 30 H THR 30 -10.235 3.607 -4.941 242 HA THR 30 HA THR 30 -11.523 1.277 -5.926 243 HB THR 30 HB THR 30 -9.019 1.617 -5.951 244 HG1 THR 30 HG1 THR 30 -9.935 -0.554 -6.246 245 HG21 THR 30 HG21 THR 30 -7.679 0.924 -3.972 246 HG22 THR 30 HG22 THR 30 -9.152 0.676 -3.009 247 HG23 THR 30 HG23 THR 30 -8.693 2.322 -3.528 248 H GLY 31 H GLY 31 -11.428 2.620 -2.600 249 HA2 GLY 31 HA2 GLY 31 -12.664 1.826 -0.754 250 HA3 GLY 31 HA3 GLY 31 -13.194 0.435 -1.719 251 H CYS 32 H CYS 32 -9.974 1.855 -0.659 252 HA CYS 32 HA CYS 32 -8.787 -0.745 -0.572 253 HB2 CYS 32 HB2 CYS 32 -6.805 0.202 0.293 254 HB3 CYS 32 HB3 CYS 32 -7.448 1.460 -0.783 Start of MODEL 9 1 H1 GLY 1 H1 GLY 1 13.081 -11.456 12.095 2 HA2 GLY 1 HA2 GLY 1 15.008 -10.509 10.816 3 HA3 GLY 1 HA3 GLY 1 13.942 -11.482 9.752 4 H ILE 2 H ILE 2 15.408 -9.626 8.410 5 HA ILE 2 HA ILE 2 13.881 -7.099 8.241 6 HB ILE 2 HB ILE 2 16.142 -8.200 6.490 7 HG12 ILE 2 HG12 ILE 2 16.105 -5.999 8.663 8 HG13 ILE 2 HG13 ILE 2 16.793 -7.629 8.852 9 HG21 ILE 2 HG21 ILE 2 16.177 -5.936 5.432 10 HG22 ILE 2 HG22 ILE 2 14.597 -6.692 5.216 11 HG23 ILE 2 HG23 ILE 2 14.802 -5.422 6.453 12 HD11 ILE 2 HD11 ILE 2 18.427 -7.112 6.955 13 HD12 ILE 2 HD12 ILE 2 17.855 -5.414 6.993 14 HD13 ILE 2 HD13 ILE 2 18.637 -6.117 8.424 15 H LEU 3 H LEU 3 14.456 -10.058 6.113 16 HA LEU 3 HA LEU 3 12.609 -9.218 4.181 17 HB2 LEU 3 HB2 LEU 3 12.545 -11.479 3.308 18 HB3 LEU 3 HB3 LEU 3 14.184 -11.044 3.820 19 HG LEU 3 HG LEU 3 13.498 -12.334 6.093 20 HD11 LEU 3 HD11 LEU 3 11.963 -14.259 5.700 21 HD12 LEU 3 HD12 LEU 3 11.658 -13.719 4.028 22 HD13 LEU 3 HD13 LEU 3 11.059 -12.764 5.400 23 HD21 LEU 3 HD21 LEU 3 14.179 -13.801 3.476 24 HD22 LEU 3 HD22 LEU 3 14.406 -14.463 5.121 25 HD23 LEU 3 HD23 LEU 3 15.348 -13.046 4.597 26 H SER 4 H SER 4 11.949 -10.842 7.376 27 HA SER 4 HA SER 4 9.313 -11.590 6.820 28 HB2 SER 4 HB2 SER 4 8.784 -11.461 9.166 29 HB3 SER 4 HB3 SER 4 10.447 -12.088 9.025 30 HG SER 4 HG SER 4 11.106 -9.855 9.588 31 H SER 5 H SER 5 10.676 -8.311 7.694 32 HA SER 5 HA SER 5 8.111 -7.089 7.968 33 HB2 SER 5 HB2 SER 5 10.755 -5.749 7.139 34 HB3 SER 5 HB3 SER 5 9.291 -4.942 7.779 35 HG SER 5 HG SER 5 10.876 -5.466 9.497 36 H PHE 6 H PHE 6 10.452 -7.226 5.093 37 HA PHE 6 HA PHE 6 8.688 -5.637 3.524 38 HB2 PHE 6 HB2 PHE 6 10.823 -7.628 2.567 39 HB3 PHE 6 HB3 PHE 6 9.922 -6.534 1.496 40 HD1 PHE 6 HD2 PHE 6 9.843 -3.954 2.314 41 HD2 PHE 6 HD1 PHE 6 12.975 -6.756 3.247 42 HE1 PHE 6 HE2 PHE 6 11.380 -2.082 2.766 43 HE2 PHE 6 HE1 PHE 6 14.556 -4.869 3.524 44 HZ PHE 6 HZ PHE 6 13.749 -2.533 3.364 45 H LYS 7 H LYS 7 9.156 -9.303 3.469 46 HA LYS 7 HA LYS 7 7.109 -9.649 1.571 47 HB2 LYS 7 HB2 LYS 7 6.970 -11.977 2.156 48 HB3 LYS 7 HB3 LYS 7 8.666 -11.462 2.262 49 HG2 LYS 7 HG2 LYS 7 8.524 -12.707 4.264 50 HG3 LYS 7 HG3 LYS 7 8.111 -11.088 4.824 51 HD2 LYS 7 HD2 LYS 7 6.388 -12.247 5.859 52 HD3 LYS 7 HD3 LYS 7 5.553 -11.965 4.317 53 HE2 LYS 7 HE2 LYS 7 7.056 -14.514 5.173 54 HE3 LYS 7 HE3 LYS 7 5.293 -14.294 5.086 55 HZ1 LYS 7 HZ1 LYS 7 6.041 -15.528 3.154 56 HZ2 LYS 7 HZ2 LYS 7 7.210 -14.334 2.732 57 HZ3 LYS 7 HZ3 LYS 7 5.492 -13.970 2.625 58 H GLY 8 H GLY 8 6.828 -9.066 5.163 59 HA2 GLY 8 HA2 GLY 8 4.041 -9.794 5.233 60 HA3 GLY 8 HA3 GLY 8 4.886 -8.769 6.414 61 H VAL 9 H VAL 9 5.837 -6.670 4.615 62 HA VAL 9 HA VAL 9 3.200 -5.265 4.437 63 HB VAL 9 HB VAL 9 6.062 -4.200 4.750 64 HG11 VAL 9 HG11 VAL 9 3.370 -2.702 4.712 65 HG12 VAL 9 HG12 VAL 9 4.956 -1.988 5.123 66 HG13 VAL 9 HG13 VAL 9 4.652 -2.581 3.472 67 HG21 VAL 9 HG21 VAL 9 5.184 -5.368 6.797 68 HG22 VAL 9 HG22 VAL 9 5.331 -3.610 7.045 69 HG23 VAL 9 HG23 VAL 9 3.726 -4.338 6.752 70 H ALA 10 H ALA 10 6.415 -5.243 2.629 71 HA ALA 10 HA ALA 10 5.326 -3.686 0.579 72 HB1 ALA 10 HB1 ALA 10 7.781 -3.922 0.904 73 HB2 ALA 10 HB2 ALA 10 7.702 -5.634 0.381 74 HB3 ALA 10 HB3 ALA 10 7.337 -4.320 -0.779 75 H LYS 11 H LYS 11 5.085 -7.254 1.000 76 HA LYS 11 HA LYS 11 4.870 -8.234 -1.447 77 HB2 LYS 11 HB2 LYS 11 2.901 -9.651 -0.802 78 HB3 LYS 11 HB3 LYS 11 4.232 -9.669 0.369 79 HG2 LYS 11 HG2 LYS 11 3.013 -8.062 1.848 80 HG3 LYS 11 HG3 LYS 11 1.669 -7.964 0.703 81 HD2 LYS 11 HD2 LYS 11 2.555 -10.534 2.150 82 HD3 LYS 11 HD3 LYS 11 1.239 -9.462 2.679 83 HE2 LYS 11 HE2 LYS 11 1.278 -11.128 0.081 84 HE3 LYS 11 HE3 LYS 11 0.333 -11.426 1.551 85 HZ1 LYS 11 HZ1 LYS 11 -1.129 -10.407 -0.036 86 HZ2 LYS 11 HZ2 LYS 11 -0.040 -9.131 -0.401 87 HZ3 LYS 11 HZ3 LYS 11 -0.809 -9.202 1.173 88 H GLY 12 H GLY 12 2.302 -5.885 -0.274 89 HA2 GLY 12 HA2 GLY 12 1.155 -6.043 -3.078 90 HA3 GLY 12 HA3 GLY 12 0.185 -5.876 -1.596 91 H VAL 13 H VAL 13 3.391 -4.310 -2.384 92 HA VAL 13 HA VAL 13 2.340 -1.844 -1.413 93 HB VAL 13 HB VAL 13 4.801 -2.507 -1.392 94 HG11 VAL 13 HG11 VAL 13 4.800 -1.452 -4.291 95 HG12 VAL 13 HG12 VAL 13 6.223 -1.925 -3.328 96 HG13 VAL 13 HG13 VAL 13 5.043 -3.164 -3.827 97 HG21 VAL 13 HG21 VAL 13 5.604 -0.159 -1.590 98 HG22 VAL 13 HG22 VAL 13 4.111 0.270 -2.466 99 HG23 VAL 13 HG23 VAL 13 4.030 -0.228 -0.753 100 H ALA 14 H ALA 14 2.648 -3.218 -4.778 101 HA ALA 14 HA ALA 14 2.398 -0.882 -6.219 102 HB1 ALA 14 HB1 ALA 14 2.571 -3.106 -7.329 103 HB2 ALA 14 HB2 ALA 14 0.917 -3.528 -6.798 104 HB3 ALA 14 HB3 ALA 14 1.169 -2.203 -7.974 105 H LYS 15 H LYS 15 -0.355 -2.767 -4.707 106 HA LYS 15 HA LYS 15 -2.288 -0.814 -5.674 107 HB2 LYS 15 HB2 LYS 15 -2.782 -3.294 -5.161 108 HB3 LYS 15 HB3 LYS 15 -2.616 -2.896 -3.439 109 HG2 LYS 15 HG2 LYS 15 -4.953 -2.830 -3.803 110 HG3 LYS 15 HG3 LYS 15 -4.511 -1.106 -3.849 111 HD2 LYS 15 HD2 LYS 15 -4.530 -1.249 -6.417 112 HD3 LYS 15 HD3 LYS 15 -4.965 -2.973 -6.278 113 HE2 LYS 15 HE2 LYS 15 -7.074 -2.266 -4.997 114 HE3 LYS 15 HE3 LYS 15 -6.626 -0.572 -5.330 115 HZ1 LYS 15 HZ1 LYS 15 -8.240 -1.348 -6.984 116 HZ2 LYS 15 HZ2 LYS 15 -7.251 -2.725 -7.383 117 HZ3 LYS 15 HZ3 LYS 15 -6.713 -1.125 -7.787 118 H ASP 16 H ASP 16 -0.752 -1.595 -2.442 119 HA ASP 16 HA ASP 16 -2.402 0.310 -1.074 120 HB2 ASP 16 HB2 ASP 16 0.215 -1.081 -0.239 121 HB3 ASP 16 HB3 ASP 16 -0.766 -0.071 0.835 122 H LEU 17 H LEU 17 0.820 0.752 -2.647 123 HA LEU 17 HA LEU 17 1.686 2.840 -1.047 124 HB2 LEU 17 HB2 LEU 17 2.641 1.833 -3.531 125 HB3 LEU 17 HB3 LEU 17 2.209 3.480 -3.952 126 HG LEU 17 HG LEU 17 4.069 2.676 -1.624 127 HD11 LEU 17 HD11 LEU 17 4.765 3.821 -4.399 128 HD12 LEU 17 HD12 LEU 17 5.079 2.145 -3.868 129 HD13 LEU 17 HD13 LEU 17 5.923 3.498 -3.076 130 HD21 LEU 17 HD21 LEU 17 2.964 4.876 -1.200 131 HD22 LEU 17 HD22 LEU 17 3.434 5.440 -2.829 132 HD23 LEU 17 HD23 LEU 17 4.681 5.118 -1.590 133 H ALA 18 H ALA 18 -0.357 3.037 -4.056 134 HA ALA 18 HA ALA 18 -0.965 5.825 -3.741 135 HB1 ALA 18 HB1 ALA 18 -2.595 3.585 -5.098 136 HB2 ALA 18 HB2 ALA 18 -2.917 5.339 -5.260 137 HB3 ALA 18 HB3 ALA 18 -1.394 4.646 -5.885 138 H GLY 19 H GLY 19 -2.640 2.754 -2.584 139 HA2 GLY 19 HA2 GLY 19 -4.878 3.871 -1.450 140 HA3 GLY 19 HA3 GLY 19 -3.996 2.525 -0.687 141 H LYS 20 H LYS 20 -1.483 4.076 -0.050 142 HA LYS 20 HA LYS 20 -2.611 5.380 2.369 143 HB2 LYS 20 HB2 LYS 20 0.257 4.596 1.614 144 HB3 LYS 20 HB3 LYS 20 -0.127 5.711 2.943 145 HG2 LYS 20 HG2 LYS 20 0.152 3.542 3.919 146 HG3 LYS 20 HG3 LYS 20 -1.563 3.995 4.041 147 HD2 LYS 20 HD2 LYS 20 -2.055 2.471 2.045 148 HD3 LYS 20 HD3 LYS 20 -0.308 2.113 1.954 149 HE2 LYS 20 HE2 LYS 20 -1.386 0.246 3.099 150 HE3 LYS 20 HE3 LYS 20 -0.431 1.130 4.306 151 HZ1 LYS 20 HZ1 LYS 20 -3.430 1.410 3.868 152 HZ2 LYS 20 HZ2 LYS 20 -2.520 2.151 5.163 153 HZ3 LYS 20 HZ3 LYS 20 -2.683 0.439 5.098 154 H LEU 21 H LEU 21 -0.092 6.333 -0.170 155 HA LEU 21 HA LEU 21 -0.044 8.999 0.841 156 HB2 LEU 21 HB2 LEU 21 0.519 8.081 -2.040 157 HB3 LEU 21 HB3 LEU 21 0.901 9.694 -1.389 158 HG LEU 21 HG LEU 21 2.171 7.043 -0.471 159 HD11 LEU 21 HD11 LEU 21 2.892 7.873 -2.755 160 HD12 LEU 21 HD12 LEU 21 4.224 7.909 -1.568 161 HD13 LEU 21 HD13 LEU 21 3.383 9.420 -2.016 162 HD21 LEU 21 HD21 LEU 21 2.689 9.919 0.500 163 HD22 LEU 21 HD22 LEU 21 3.777 8.539 0.817 164 HD23 LEU 21 HD23 LEU 21 2.141 8.534 1.494 165 H LEU 22 H LEU 22 -2.023 7.492 -1.797 166 HA LEU 22 HA LEU 22 -3.578 10.068 -1.978 167 HB2 LEU 22 HB2 LEU 22 -3.612 7.615 -3.802 168 HB3 LEU 22 HB3 LEU 22 -4.347 9.201 -4.126 169 HG LEU 22 HG LEU 22 -1.330 8.545 -3.965 170 HD11 LEU 22 HD11 LEU 22 -1.327 9.038 -6.400 171 HD12 LEU 22 HD12 LEU 22 -3.081 9.378 -6.357 172 HD13 LEU 22 HD13 LEU 22 -2.478 7.726 -6.042 173 HD21 LEU 22 HD21 LEU 22 -0.984 10.927 -4.774 174 HD22 LEU 22 HD22 LEU 22 -1.634 10.860 -3.124 175 HD23 LEU 22 HD23 LEU 22 -2.721 11.246 -4.494 176 H GLU 23 H GLU 23 -3.937 8.733 0.470 177 HA GLU 23 HA GLU 23 -6.094 6.842 0.251 178 HB2 GLU 23 HB2 GLU 23 -4.665 7.107 2.320 179 HB3 GLU 23 HB3 GLU 23 -5.428 8.692 2.618 180 HG2 GLU 23 HG2 GLU 23 -7.673 7.522 2.820 181 HG3 GLU 23 HG3 GLU 23 -6.879 5.959 2.501 182 H THR 24 H THR 24 -5.901 10.461 0.533 183 HA THR 24 HA THR 24 -8.616 10.953 1.077 184 HB THR 24 HB THR 24 -8.252 13.144 -0.204 185 HG1 THR 24 HG1 THR 24 -6.029 13.392 -1.019 186 HG21 THR 24 HG21 THR 24 -7.711 12.977 2.239 187 HG22 THR 24 HG22 THR 24 -6.585 14.069 1.390 188 HG23 THR 24 HG23 THR 24 -6.054 12.432 1.854 189 H LEU 25 H LEU 25 -7.173 9.823 -2.017 190 HA LEU 25 HA LEU 25 -9.924 10.030 -3.181 191 HB2 LEU 25 HB2 LEU 25 -9.107 10.979 -5.240 192 HB3 LEU 25 HB3 LEU 25 -8.648 11.956 -3.832 193 HG LEU 25 HG LEU 25 -6.310 10.644 -4.035 194 HD11 LEU 25 HD11 LEU 25 -7.295 10.572 -6.967 195 HD12 LEU 25 HD12 LEU 25 -7.119 9.114 -5.972 196 HD13 LEU 25 HD13 LEU 25 -5.686 10.083 -6.376 197 HD21 LEU 25 HD21 LEU 25 -6.523 13.084 -4.242 198 HD22 LEU 25 HD22 LEU 25 -7.109 12.918 -5.923 199 HD23 LEU 25 HD23 LEU 25 -5.434 12.449 -5.500 200 H LYS 26 H LYS 26 -6.700 8.232 -3.612 201 HA LYS 26 HA LYS 26 -7.916 6.460 -5.461 202 HB2 LYS 26 HB2 LYS 26 -5.417 6.595 -5.029 203 HB3 LYS 26 HB3 LYS 26 -5.667 5.784 -3.470 204 HG2 LYS 26 HG2 LYS 26 -5.018 4.016 -4.885 205 HG3 LYS 26 HG3 LYS 26 -6.777 3.836 -4.836 206 HD2 LYS 26 HD2 LYS 26 -6.973 4.907 -7.092 207 HD3 LYS 26 HD3 LYS 26 -5.251 5.363 -7.055 208 HE2 LYS 26 HE2 LYS 26 -5.490 3.468 -8.532 209 HE3 LYS 26 HE3 LYS 26 -4.577 2.954 -7.094 210 HZ1 LYS 26 HZ1 LYS 26 -6.619 1.869 -6.211 211 HZ2 LYS 26 HZ2 LYS 26 -6.261 1.303 -7.806 212 HZ3 LYS 26 HZ3 LYS 26 -7.533 2.465 -7.589 213 H CYS 27 H CYS 27 -7.410 6.199 -1.818 214 HA CYS 27 HA CYS 27 -8.564 3.654 -1.650 215 HB2 CYS 27 HB2 CYS 27 -7.318 4.662 0.267 216 HB3 CYS 27 HB3 CYS 27 -8.681 5.794 0.538 217 H LYS 28 H LYS 28 -10.142 6.940 -1.562 218 HA LYS 28 HA LYS 28 -12.747 5.906 -0.880 219 HB2 LYS 28 HB2 LYS 28 -11.847 8.466 -2.325 220 HB3 LYS 28 HB3 LYS 28 -13.561 8.023 -2.228 221 HG2 LYS 28 HG2 LYS 28 -12.956 9.599 -0.424 222 HG3 LYS 28 HG3 LYS 28 -13.582 8.052 0.202 223 HD2 LYS 28 HD2 LYS 28 -11.260 7.303 0.754 224 HD3 LYS 28 HD3 LYS 28 -10.603 8.808 0.047 225 HE2 LYS 28 HE2 LYS 28 -11.739 10.164 1.782 226 HE3 LYS 28 HE3 LYS 28 -12.560 8.716 2.427 227 HZ1 LYS 28 HZ1 LYS 28 -9.558 9.133 2.402 228 HZ2 LYS 28 HZ2 LYS 28 -10.393 7.760 3.074 229 HZ3 LYS 28 HZ3 LYS 28 -10.594 9.337 3.782 230 H ILE 29 H ILE 29 -11.068 6.462 -4.080 231 HA ILE 29 HA ILE 29 -13.439 5.805 -5.562 232 HB ILE 29 HB ILE 29 -10.501 5.843 -6.389 233 HG12 ILE 29 HG12 ILE 29 -12.806 7.713 -7.219 234 HG13 ILE 29 HG13 ILE 29 -11.838 8.026 -5.770 235 HG21 ILE 29 HG21 ILE 29 -11.670 4.179 -7.833 236 HG22 ILE 29 HG22 ILE 29 -12.983 5.345 -8.146 237 HG23 ILE 29 HG23 ILE 29 -11.339 5.641 -8.771 238 HD11 ILE 29 HD11 ILE 29 -9.734 8.107 -7.154 239 HD12 ILE 29 HD12 ILE 29 -10.717 7.917 -8.637 240 HD13 ILE 29 HD13 ILE 29 -10.930 9.352 -7.607 241 H THR 30 H THR 30 -10.410 3.734 -5.126 242 HA THR 30 HA THR 30 -11.810 1.463 -6.147 243 HB THR 30 HB THR 30 -9.302 1.679 -6.052 244 HG1 THR 30 HG1 THR 30 -10.404 -0.758 -5.038 245 HG21 THR 30 HG21 THR 30 -8.078 0.953 -4.027 246 HG22 THR 30 HG22 THR 30 -9.597 0.709 -3.132 247 HG23 THR 30 HG23 THR 30 -9.087 2.354 -3.595 248 H GLY 31 H GLY 31 -11.759 2.904 -2.853 249 HA2 GLY 31 HA2 GLY 31 -13.082 2.244 -1.018 250 HA3 GLY 31 HA3 GLY 31 -13.703 0.881 -1.971 251 H CYS 32 H CYS 32 -10.390 2.049 -0.874 252 HA CYS 32 HA CYS 32 -9.444 -0.646 -0.701 253 HB2 CYS 32 HB2 CYS 32 -7.386 0.146 0.133 254 HB3 CYS 32 HB3 CYS 32 -7.920 1.432 -0.966 Start of MODEL 10 1 H1 GLY 1 H1 GLY 1 12.568 -11.050 12.085 2 HA2 GLY 1 HA2 GLY 1 14.395 -10.532 10.470 3 HA3 GLY 1 HA3 GLY 1 13.059 -11.420 9.667 4 H ILE 2 H ILE 2 14.829 -9.631 8.216 5 HA ILE 2 HA ILE 2 13.260 -7.149 7.816 6 HB ILE 2 HB ILE 2 15.671 -8.234 6.273 7 HG12 ILE 2 HG12 ILE 2 15.450 -5.981 8.379 8 HG13 ILE 2 HG13 ILE 2 16.145 -7.593 8.676 9 HG21 ILE 2 HG21 ILE 2 15.715 -5.993 5.170 10 HG22 ILE 2 HG22 ILE 2 14.153 -6.764 4.868 11 HG23 ILE 2 HG23 ILE 2 14.277 -5.481 6.102 12 HD11 ILE 2 HD11 ILE 2 17.985 -6.075 8.332 13 HD12 ILE 2 HD12 ILE 2 17.903 -7.139 6.898 14 HD13 ILE 2 HD13 ILE 2 17.317 -5.447 6.809 15 H LEU 3 H LEU 3 14.143 -10.167 5.877 16 HA LEU 3 HA LEU 3 12.365 -9.542 3.800 17 HB2 LEU 3 HB2 LEU 3 12.501 -11.836 3.048 18 HB3 LEU 3 HB3 LEU 3 14.079 -11.271 3.624 19 HG LEU 3 HG LEU 3 13.351 -12.503 5.922 20 HD11 LEU 3 HD11 LEU 3 11.694 -14.086 3.839 21 HD12 LEU 3 HD12 LEU 3 10.972 -13.116 5.140 22 HD13 LEU 3 HD13 LEU 3 11.954 -14.536 5.545 23 HD21 LEU 3 HD21 LEU 3 14.426 -14.612 5.102 24 HD22 LEU 3 HD22 LEU 3 15.310 -13.165 4.556 25 HD23 LEU 3 HD23 LEU 3 14.243 -14.039 3.416 26 H SER 4 H SER 4 11.666 -11.009 7.058 27 HA SER 4 HA SER 4 9.044 -11.887 6.357 28 HB2 SER 4 HB2 SER 4 8.519 -11.786 8.757 29 HB3 SER 4 HB3 SER 4 10.120 -12.554 8.493 30 HG SER 4 HG SER 4 10.191 -10.856 10.175 31 H SER 5 H SER 5 10.321 -8.727 7.722 32 HA SER 5 HA SER 5 7.774 -7.489 7.861 33 HB2 SER 5 HB2 SER 5 10.483 -6.125 7.307 34 HB3 SER 5 HB3 SER 5 9.008 -5.329 7.920 35 HG SER 5 HG SER 5 9.258 -6.771 9.821 36 H PHE 6 H PHE 6 10.252 -7.518 5.149 37 HA PHE 6 HA PHE 6 8.709 -5.753 3.524 38 HB2 PHE 6 HB2 PHE 6 11.055 -7.582 2.932 39 HB3 PHE 6 HB3 PHE 6 9.986 -7.213 1.574 40 HD1 PHE 6 HD1 PHE 6 11.528 -5.351 4.501 41 HD2 PHE 6 HD2 PHE 6 10.610 -5.321 0.290 42 HE1 PHE 6 HE1 PHE 6 12.450 -3.061 4.306 43 HE2 PHE 6 HE2 PHE 6 11.523 -3.038 0.106 44 HZ PHE 6 HZ PHE 6 12.427 -1.889 2.115 45 H LYS 7 H LYS 7 8.960 -9.438 3.248 46 HA LYS 7 HA LYS 7 6.988 -9.472 1.263 47 HB2 LYS 7 HB2 LYS 7 6.734 -11.832 1.536 48 HB3 LYS 7 HB3 LYS 7 8.427 -11.429 1.883 49 HG2 LYS 7 HG2 LYS 7 7.966 -12.929 3.633 50 HG3 LYS 7 HG3 LYS 7 7.607 -11.383 4.420 51 HD2 LYS 7 HD2 LYS 7 5.084 -11.831 3.832 52 HD3 LYS 7 HD3 LYS 7 5.620 -13.376 3.144 53 HE2 LYS 7 HE2 LYS 7 4.780 -13.873 5.318 54 HE3 LYS 7 HE3 LYS 7 6.553 -13.990 5.461 55 HZ1 LYS 7 HZ1 LYS 7 4.818 -11.638 6.327 56 HZ2 LYS 7 HZ2 LYS 7 6.543 -11.706 6.517 57 HZ3 LYS 7 HZ3 LYS 7 5.539 -12.818 7.375 58 H GLY 8 H GLY 8 6.552 -9.220 4.875 59 HA2 GLY 8 HA2 GLY 8 3.744 -9.738 4.808 60 HA3 GLY 8 HA3 GLY 8 4.587 -8.771 6.042 61 H VAL 9 H VAL 9 5.672 -6.646 4.410 62 HA VAL 9 HA VAL 9 3.081 -5.194 3.992 63 HB VAL 9 HB VAL 9 5.907 -4.159 4.594 64 HG11 VAL 9 HG11 VAL 9 4.613 -2.519 3.214 65 HG12 VAL 9 HG12 VAL 9 3.228 -2.652 4.339 66 HG13 VAL 9 HG13 VAL 9 4.775 -1.948 4.895 67 HG21 VAL 9 HG21 VAL 9 4.858 -5.351 6.535 68 HG22 VAL 9 HG22 VAL 9 4.960 -3.596 6.822 69 HG23 VAL 9 HG23 VAL 9 3.397 -4.334 6.370 70 H ALA 10 H ALA 10 6.457 -5.223 2.535 71 HA ALA 10 HA ALA 10 5.742 -3.623 0.394 72 HB1 ALA 10 HB1 ALA 10 7.799 -4.475 -0.756 73 HB2 ALA 10 HB2 ALA 10 8.115 -4.168 0.976 74 HB3 ALA 10 HB3 ALA 10 7.877 -5.845 0.393 75 H LYS 11 H LYS 11 5.099 -7.186 0.697 76 HA LYS 11 HA LYS 11 5.108 -7.887 -1.930 77 HB2 LYS 11 HB2 LYS 11 3.339 -9.546 -1.552 78 HB3 LYS 11 HB3 LYS 11 4.511 -9.520 -0.214 79 HG2 LYS 11 HG2 LYS 11 2.860 -8.131 1.151 80 HG3 LYS 11 HG3 LYS 11 1.692 -8.232 -0.192 81 HD2 LYS 11 HD2 LYS 11 1.572 -10.690 -0.016 82 HD3 LYS 11 HD3 LYS 11 2.822 -10.708 1.250 83 HE2 LYS 11 HE2 LYS 11 1.324 -9.343 2.747 84 HE3 LYS 11 HE3 LYS 11 0.060 -9.359 1.487 85 HZ1 LYS 11 HZ1 LYS 11 -0.012 -11.837 1.645 86 HZ2 LYS 11 HZ2 LYS 11 -0.340 -11.091 3.187 87 HZ3 LYS 11 HZ3 LYS 11 1.214 -11.799 2.890 88 H GLY 12 H GLY 12 2.479 -5.831 -0.427 89 HA2 GLY 12 HA2 GLY 12 1.239 -5.653 -3.187 90 HA3 GLY 12 HA3 GLY 12 0.408 -5.430 -1.635 91 H VAL 13 H VAL 13 3.698 -4.146 -2.564 92 HA VAL 13 HA VAL 13 3.004 -1.635 -1.470 93 HB VAL 13 HB VAL 13 5.350 -2.439 -1.672 94 HG11 VAL 13 HG11 VAL 13 5.326 -3.274 -4.078 95 HG12 VAL 13 HG12 VAL 13 5.202 -1.581 -4.641 96 HG13 VAL 13 HG13 VAL 13 6.650 -2.127 -3.758 97 HG21 VAL 13 HG21 VAL 13 4.837 -0.047 -1.172 98 HG22 VAL 13 HG22 VAL 13 6.357 -0.209 -2.094 99 HG23 VAL 13 HG23 VAL 13 4.865 0.307 -2.928 100 H ALA 14 H ALA 14 2.894 -2.845 -4.905 101 HA ALA 14 HA ALA 14 2.811 -0.393 -6.185 102 HB1 ALA 14 HB1 ALA 14 1.162 -2.898 -6.922 103 HB2 ALA 14 HB2 ALA 14 1.481 -1.509 -8.005 104 HB3 ALA 14 HB3 ALA 14 2.834 -2.538 -7.443 105 H LYS 15 H LYS 15 -0.070 -2.218 -4.850 106 HA LYS 15 HA LYS 15 -1.826 0.034 -5.567 107 HB2 LYS 15 HB2 LYS 15 -2.377 -2.481 -3.891 108 HB3 LYS 15 HB3 LYS 15 -3.596 -1.281 -4.401 109 HG2 LYS 15 HG2 LYS 15 -3.112 -1.771 -6.813 110 HG3 LYS 15 HG3 LYS 15 -1.867 -2.958 -6.340 111 HD2 LYS 15 HD2 LYS 15 -3.620 -4.331 -5.162 112 HD3 LYS 15 HD3 LYS 15 -4.870 -3.155 -5.660 113 HE2 LYS 15 HE2 LYS 15 -4.356 -3.635 -8.078 114 HE3 LYS 15 HE3 LYS 15 -3.104 -4.806 -7.581 115 HZ1 LYS 15 HZ1 LYS 15 -5.205 -5.942 -8.148 116 HZ2 LYS 15 HZ2 LYS 15 -6.067 -5.021 -6.948 117 HZ3 LYS 15 HZ3 LYS 15 -4.840 -6.166 -6.464 118 H ASP 16 H ASP 16 -0.361 -1.367 -2.515 119 HA ASP 16 HA ASP 16 -1.870 0.126 -0.740 120 HB2 ASP 16 HB2 ASP 16 -0.274 -1.681 -0.051 121 HB3 ASP 16 HB3 ASP 16 1.100 -0.598 -0.393 122 H LEU 17 H LEU 17 1.337 1.185 -2.246 123 HA LEU 17 HA LEU 17 1.569 3.549 -0.832 124 HB2 LEU 17 HB2 LEU 17 2.223 2.907 -3.751 125 HB3 LEU 17 HB3 LEU 17 2.411 4.584 -3.205 126 HG LEU 17 HG LEU 17 3.813 2.275 -1.774 127 HD11 LEU 17 HD11 LEU 17 5.869 2.926 -3.076 128 HD12 LEU 17 HD12 LEU 17 4.923 4.144 -3.981 129 HD13 LEU 17 HD13 LEU 17 4.583 2.407 -4.197 130 HD21 LEU 17 HD21 LEU 17 3.654 4.406 -0.402 131 HD22 LEU 17 HD22 LEU 17 4.316 5.321 -1.781 132 HD23 LEU 17 HD23 LEU 17 5.322 4.121 -0.931 133 H ALA 18 H ALA 18 -0.355 3.184 -3.941 134 HA ALA 18 HA ALA 18 -1.213 5.906 -3.835 135 HB1 ALA 18 HB1 ALA 18 -3.000 5.248 -5.419 136 HB2 ALA 18 HB2 ALA 18 -1.439 4.520 -5.891 137 HB3 ALA 18 HB3 ALA 18 -2.678 3.509 -5.092 138 H GLY 19 H GLY 19 -2.739 2.827 -2.508 139 HA2 GLY 19 HA2 GLY 19 -5.047 4.024 -1.473 140 HA3 GLY 19 HA3 GLY 19 -4.234 2.627 -0.726 141 H LYS 20 H LYS 20 -1.666 4.288 -0.165 142 HA LYS 20 HA LYS 20 -2.778 5.551 2.319 143 HB2 LYS 20 HB2 LYS 20 -0.074 4.327 1.614 144 HB3 LYS 20 HB3 LYS 20 -0.210 5.553 2.891 145 HG2 LYS 20 HG2 LYS 20 -0.347 3.235 3.793 146 HG3 LYS 20 HG3 LYS 20 -1.769 4.240 4.182 147 HD2 LYS 20 HD2 LYS 20 -3.129 3.083 2.444 148 HD3 LYS 20 HD3 LYS 20 -1.690 2.208 1.872 149 HE2 LYS 20 HE2 LYS 20 -3.097 0.733 3.235 150 HE3 LYS 20 HE3 LYS 20 -1.555 1.010 4.088 151 HZ1 LYS 20 HZ1 LYS 20 -3.570 1.102 5.557 152 HZ2 LYS 20 HZ2 LYS 20 -4.133 2.501 4.691 153 HZ3 LYS 20 HZ3 LYS 20 -2.652 2.556 5.623 154 H LEU 21 H LEU 21 -0.049 6.313 -0.049 155 HA LEU 21 HA LEU 21 0.108 8.985 0.819 156 HB2 LEU 21 HB2 LEU 21 0.528 8.000 -2.073 157 HB3 LEU 21 HB3 LEU 21 1.013 9.590 -1.431 158 HG LEU 21 HG LEU 21 2.209 6.850 -0.663 159 HD11 LEU 21 HD11 LEU 21 3.398 9.313 -2.082 160 HD12 LEU 21 HD12 LEU 21 2.948 7.767 -2.862 161 HD13 LEU 21 HD13 LEU 21 4.284 7.821 -1.681 162 HD21 LEU 21 HD21 LEU 21 2.224 8.193 1.414 163 HD22 LEU 21 HD22 LEU 21 2.800 9.638 0.524 164 HD23 LEU 21 HD23 LEU 21 3.857 8.212 0.726 165 H LEU 22 H LEU 22 -2.047 7.546 -1.749 166 HA LEU 22 HA LEU 22 -3.495 10.196 -1.824 167 HB2 LEU 22 HB2 LEU 22 -3.681 7.833 -3.753 168 HB3 LEU 22 HB3 LEU 22 -4.366 9.456 -3.975 169 HG LEU 22 HG LEU 22 -1.363 8.711 -3.928 170 HD11 LEU 22 HD11 LEU 22 -2.571 7.933 -5.980 171 HD12 LEU 22 HD12 LEU 22 -1.427 9.246 -6.360 172 HD13 LEU 22 HD13 LEU 22 -3.178 9.592 -6.255 173 HD21 LEU 22 HD21 LEU 22 -2.716 11.445 -4.393 174 HD22 LEU 22 HD22 LEU 22 -0.993 11.093 -4.711 175 HD23 LEU 22 HD23 LEU 22 -1.611 11.022 -3.048 176 H GLU 23 H GLU 23 -3.859 8.850 0.576 177 HA GLU 23 HA GLU 23 -5.996 6.953 0.385 178 HB2 GLU 23 HB2 GLU 23 -4.637 7.245 2.476 179 HB3 GLU 23 HB3 GLU 23 -5.358 8.856 2.721 180 HG2 GLU 23 HG2 GLU 23 -7.649 7.754 2.893 181 HG3 GLU 23 HG3 GLU 23 -6.878 6.160 2.666 182 H THR 24 H THR 24 -5.916 10.551 0.923 183 HA THR 24 HA THR 24 -8.558 11.036 1.286 184 HB THR 24 HB THR 24 -6.833 12.832 1.228 185 HG1 THR 24 HG1 THR 24 -9.108 13.452 0.936 186 HG21 THR 24 HG21 THR 24 -6.102 13.854 -0.908 187 HG22 THR 24 HG22 THR 24 -7.047 12.670 -1.846 188 HG23 THR 24 HG23 THR 24 -5.620 12.133 -0.910 189 H LEU 25 H LEU 25 -7.207 9.962 -1.880 190 HA LEU 25 HA LEU 25 -10.021 10.065 -2.895 191 HB2 LEU 25 HB2 LEU 25 -9.363 10.970 -5.020 192 HB3 LEU 25 HB3 LEU 25 -8.838 12.011 -3.683 193 HG LEU 25 HG LEU 25 -6.480 10.762 -4.001 194 HD11 LEU 25 HD11 LEU 25 -7.652 10.520 -6.855 195 HD12 LEU 25 HD12 LEU 25 -7.375 9.111 -5.818 196 HD13 LEU 25 HD13 LEU 25 -5.996 10.098 -6.343 197 HD21 LEU 25 HD21 LEU 25 -7.490 12.899 -5.956 198 HD22 LEU 25 HD22 LEU 25 -5.773 12.519 -5.627 199 HD23 LEU 25 HD23 LEU 25 -6.796 13.195 -4.338 200 H LYS 26 H LYS 26 -6.769 8.341 -3.453 201 HA LYS 26 HA LYS 26 -8.017 6.540 -5.245 202 HB2 LYS 26 HB2 LYS 26 -5.506 6.728 -4.913 203 HB3 LYS 26 HB3 LYS 26 -5.682 5.912 -3.347 204 HG2 LYS 26 HG2 LYS 26 -5.068 4.142 -4.785 205 HG3 LYS 26 HG3 LYS 26 -6.823 3.949 -4.686 206 HD2 LYS 26 HD2 LYS 26 -7.096 5.032 -6.927 207 HD3 LYS 26 HD3 LYS 26 -5.376 5.498 -6.944 208 HE2 LYS 26 HE2 LYS 26 -5.656 3.608 -8.424 209 HE3 LYS 26 HE3 LYS 26 -4.686 3.094 -7.023 210 HZ1 LYS 26 HZ1 LYS 26 -7.653 2.589 -7.400 211 HZ2 LYS 26 HZ2 LYS 26 -6.676 1.981 -6.071 212 HZ3 LYS 26 HZ3 LYS 26 -6.394 1.424 -7.680 213 H CYS 27 H CYS 27 -7.355 6.277 -1.628 214 HA CYS 27 HA CYS 27 -8.419 3.697 -1.431 215 HB2 CYS 27 HB2 CYS 27 -7.139 4.772 0.440 216 HB3 CYS 27 HB3 CYS 27 -8.544 5.843 0.760 217 H LYS 28 H LYS 28 -10.111 6.915 -1.368 218 HA LYS 28 HA LYS 28 -12.633 5.777 -0.500 219 HB2 LYS 28 HB2 LYS 28 -11.968 8.373 -2.016 220 HB3 LYS 28 HB3 LYS 28 -13.637 7.848 -1.706 221 HG2 LYS 28 HG2 LYS 28 -12.942 9.464 0.003 222 HG3 LYS 28 HG3 LYS 28 -13.324 7.875 0.720 223 HD2 LYS 28 HD2 LYS 28 -10.910 7.368 1.005 224 HD3 LYS 28 HD3 LYS 28 -10.481 8.826 0.062 225 HE2 LYS 28 HE2 LYS 28 -10.114 9.190 2.471 226 HE3 LYS 28 HE3 LYS 28 -11.353 10.304 1.840 227 HZ1 LYS 28 HZ1 LYS 28 -11.921 9.298 4.055 228 HZ2 LYS 28 HZ2 LYS 28 -11.967 7.720 3.321 229 HZ3 LYS 28 HZ3 LYS 28 -13.119 8.959 2.866 230 H ILE 29 H ILE 29 -11.103 6.421 -3.756 231 HA ILE 29 HA ILE 29 -13.478 5.680 -5.180 232 HB ILE 29 HB ILE 29 -10.557 5.790 -6.061 233 HG12 ILE 29 HG12 ILE 29 -12.920 7.591 -6.874 234 HG13 ILE 29 HG13 ILE 29 -11.944 7.942 -5.439 235 HG21 ILE 29 HG21 ILE 29 -13.055 5.209 -7.772 236 HG22 ILE 29 HG22 ILE 29 -11.427 5.546 -8.427 237 HG23 ILE 29 HG23 ILE 29 -11.702 4.081 -7.470 238 HD11 ILE 29 HD11 ILE 29 -10.851 7.836 -8.317 239 HD12 ILE 29 HD12 ILE 29 -11.091 9.276 -7.299 240 HD13 ILE 29 HD13 ILE 29 -9.859 8.067 -6.846 241 H THR 30 H THR 30 -10.384 3.693 -4.800 242 HA THR 30 HA THR 30 -11.788 1.386 -5.753 243 HB THR 30 HB THR 30 -9.309 1.639 -5.860 244 HG1 THR 30 HG1 THR 30 -9.072 -0.692 -5.462 245 HG21 THR 30 HG21 THR 30 -7.902 0.964 -3.911 246 HG22 THR 30 HG22 THR 30 -9.350 0.734 -2.900 247 HG23 THR 30 HG23 THR 30 -8.881 2.373 -3.436 248 H GLY 31 H GLY 31 -11.594 2.822 -2.471 249 HA2 GLY 31 HA2 GLY 31 -12.780 2.100 -0.564 250 HA3 GLY 31 HA3 GLY 31 -13.389 0.712 -1.486 251 H CYS 32 H CYS 32 -10.076 2.023 -0.582 252 HA CYS 32 HA CYS 32 -8.987 -0.612 -0.464 253 HB2 CYS 32 HB2 CYS 32 -6.942 0.280 0.313 254 HB3 CYS 32 HB3 CYS 32 -7.581 1.539 -0.763 Start of MODEL 11 1 H1 GLY 1 H1 GLY 1 12.437 -9.283 12.221 2 HA2 GLY 1 HA2 GLY 1 14.183 -10.439 10.861 3 HA3 GLY 1 HA3 GLY 1 12.846 -11.363 10.115 4 H ILE 2 H ILE 2 14.690 -9.734 8.551 5 HA ILE 2 HA ILE 2 13.246 -7.227 7.962 6 HB ILE 2 HB ILE 2 15.586 -8.575 6.507 7 HG12 ILE 2 HG12 ILE 2 15.482 -6.124 8.394 8 HG13 ILE 2 HG13 ILE 2 16.082 -7.739 8.841 9 HG21 ILE 2 HG21 ILE 2 14.168 -7.169 4.955 10 HG22 ILE 2 HG22 ILE 2 14.348 -5.786 6.073 11 HG23 ILE 2 HG23 ILE 2 15.763 -6.454 5.207 12 HD11 ILE 2 HD11 ILE 2 18.013 -6.355 8.371 13 HD12 ILE 2 HD12 ILE 2 17.874 -7.535 7.037 14 HD13 ILE 2 HD13 ILE 2 17.376 -5.831 6.798 15 H LEU 3 H LEU 3 13.887 -10.431 6.252 16 HA LEU 3 HA LEU 3 12.191 -9.741 4.062 17 HB2 LEU 3 HB2 LEU 3 13.072 -12.466 5.163 18 HB3 LEU 3 HB3 LEU 3 11.878 -12.328 3.851 19 HG LEU 3 HG LEU 3 13.439 -11.123 2.394 20 HD11 LEU 3 HD11 LEU 3 14.855 -9.884 4.022 21 HD12 LEU 3 HD12 LEU 3 15.877 -10.892 2.978 22 HD13 LEU 3 HD13 LEU 3 15.528 -11.427 4.645 23 HD21 LEU 3 HD21 LEU 3 15.012 -13.009 1.931 24 HD22 LEU 3 HD22 LEU 3 13.390 -13.629 2.332 25 HD23 LEU 3 HD23 LEU 3 14.695 -13.690 3.552 26 H SER 4 H SER 4 11.468 -11.441 7.236 27 HA SER 4 HA SER 4 8.801 -12.043 6.675 28 HB2 SER 4 HB2 SER 4 8.341 -11.835 9.110 29 HB3 SER 4 HB3 SER 4 9.893 -12.687 8.826 30 HG SER 4 HG SER 4 10.089 -10.933 10.438 31 H SER 5 H SER 5 10.209 -8.891 7.924 32 HA SER 5 HA SER 5 7.672 -7.602 8.096 33 HB2 SER 5 HB2 SER 5 10.426 -6.317 7.604 34 HB3 SER 5 HB3 SER 5 8.947 -5.473 8.162 35 HG SER 5 HG SER 5 10.320 -6.193 9.981 36 H PHE 6 H PHE 6 10.154 -7.687 5.389 37 HA PHE 6 HA PHE 6 8.696 -5.782 3.820 38 HB2 PHE 6 HB2 PHE 6 10.936 -7.731 3.122 39 HB3 PHE 6 HB3 PHE 6 9.953 -7.048 1.818 40 HD1 PHE 6 HD2 PHE 6 11.760 -5.877 4.951 41 HD2 PHE 6 HD1 PHE 6 10.570 -4.941 0.917 42 HE1 PHE 6 HE2 PHE 6 13.004 -3.748 5.074 43 HE2 PHE 6 HE1 PHE 6 11.818 -2.819 1.047 44 HZ PHE 6 HZ PHE 6 13.042 -2.211 3.122 45 H LYS 7 H LYS 7 8.834 -9.479 3.436 46 HA LYS 7 HA LYS 7 6.774 -9.381 1.523 47 HB2 LYS 7 HB2 LYS 7 6.410 -11.729 1.744 48 HB3 LYS 7 HB3 LYS 7 8.142 -11.397 1.956 49 HG2 LYS 7 HG2 LYS 7 7.748 -12.991 3.618 50 HG3 LYS 7 HG3 LYS 7 7.603 -11.487 4.555 51 HD2 LYS 7 HD2 LYS 7 5.041 -11.685 4.280 52 HD3 LYS 7 HD3 LYS 7 5.292 -13.215 3.421 53 HE2 LYS 7 HE2 LYS 7 6.138 -12.641 6.335 54 HE3 LYS 7 HE3 LYS 7 4.645 -13.475 5.838 55 HZ1 LYS 7 HZ1 LYS 7 6.050 -15.230 4.737 56 HZ2 LYS 7 HZ2 LYS 7 6.256 -15.137 6.460 57 HZ3 LYS 7 HZ3 LYS 7 7.477 -14.494 5.433 58 H GLY 8 H GLY 8 6.583 -9.281 5.162 59 HA2 GLY 8 HA2 GLY 8 3.812 -9.682 5.377 60 HA3 GLY 8 HA3 GLY 8 4.759 -8.631 6.459 61 H VAL 9 H VAL 9 5.655 -6.637 4.546 62 HA VAL 9 HA VAL 9 3.010 -5.238 4.220 63 HB VAL 9 HB VAL 9 5.823 -4.134 4.765 64 HG11 VAL 9 HG11 VAL 9 3.111 -2.685 4.526 65 HG12 VAL 9 HG12 VAL 9 4.652 -1.942 5.043 66 HG13 VAL 9 HG13 VAL 9 4.477 -2.550 3.378 67 HG21 VAL 9 HG21 VAL 9 4.896 -3.549 6.996 68 HG22 VAL 9 HG22 VAL 9 3.344 -4.332 6.582 69 HG23 VAL 9 HG23 VAL 9 4.832 -5.311 6.737 70 H ALA 10 H ALA 10 6.369 -5.191 2.701 71 HA ALA 10 HA ALA 10 5.532 -3.677 0.529 72 HB1 ALA 10 HB1 ALA 10 7.774 -5.792 0.552 73 HB2 ALA 10 HB2 ALA 10 7.606 -4.462 -0.634 74 HB3 ALA 10 HB3 ALA 10 7.940 -4.090 1.081 75 H LYS 11 H LYS 11 5.008 -7.247 0.949 76 HA LYS 11 HA LYS 11 5.004 -7.976 -1.697 77 HB2 LYS 11 HB2 LYS 11 3.388 -9.751 -1.248 78 HB3 LYS 11 HB3 LYS 11 4.560 -9.605 0.083 79 HG2 LYS 11 HG2 LYS 11 2.791 -8.273 1.387 80 HG3 LYS 11 HG3 LYS 11 1.635 -8.580 0.073 81 HD2 LYS 11 HD2 LYS 11 1.709 -11.000 0.416 82 HD3 LYS 11 HD3 LYS 11 3.060 -10.878 1.562 83 HE2 LYS 11 HE2 LYS 11 1.611 -9.567 3.154 84 HE3 LYS 11 HE3 LYS 11 0.237 -9.749 2.027 85 HZ1 LYS 11 HZ1 LYS 11 1.749 -12.015 3.391 86 HZ2 LYS 11 HZ2 LYS 11 0.415 -12.217 2.282 87 HZ3 LYS 11 HZ3 LYS 11 0.166 -11.438 3.817 88 H GLY 12 H GLY 12 2.347 -6.070 -0.062 89 HA2 GLY 12 HA2 GLY 12 0.954 -5.941 -2.743 90 HA3 GLY 12 HA3 GLY 12 0.226 -5.659 -1.150 91 H VAL 13 H VAL 13 3.446 -4.413 -2.359 92 HA VAL 13 HA VAL 13 2.850 -1.877 -1.289 93 HB VAL 13 HB VAL 13 5.177 -2.648 -1.694 94 HG11 VAL 13 HG11 VAL 13 6.251 -2.414 -3.908 95 HG12 VAL 13 HG12 VAL 13 4.922 -3.589 -4.049 96 HG13 VAL 13 HG13 VAL 13 4.714 -1.922 -4.662 97 HG21 VAL 13 HG21 VAL 13 4.519 0.037 -3.012 98 HG22 VAL 13 HG22 VAL 13 4.671 -0.239 -1.250 99 HG23 VAL 13 HG23 VAL 13 6.094 -0.423 -2.311 100 H ALA 14 H ALA 14 2.391 -3.183 -4.657 101 HA ALA 14 HA ALA 14 2.196 -0.784 -5.995 102 HB1 ALA 14 HB1 ALA 14 0.464 -3.286 -6.503 103 HB2 ALA 14 HB2 ALA 14 0.676 -1.921 -7.641 104 HB3 ALA 14 HB3 ALA 14 2.076 -2.942 -7.193 105 H LYS 15 H LYS 15 -0.679 -2.524 -4.464 106 HA LYS 15 HA LYS 15 -2.360 -0.214 -4.973 107 HB2 LYS 15 HB2 LYS 15 -2.687 -2.632 -3.106 108 HB3 LYS 15 HB3 LYS 15 -3.878 -1.316 -3.141 109 HG2 LYS 15 HG2 LYS 15 -3.118 -2.885 -5.680 110 HG3 LYS 15 HG3 LYS 15 -4.439 -3.359 -4.577 111 HD2 LYS 15 HD2 LYS 15 -5.551 -1.119 -4.922 112 HD3 LYS 15 HD3 LYS 15 -4.311 -0.693 -6.130 113 HE2 LYS 15 HE2 LYS 15 -4.985 -2.655 -7.530 114 HE3 LYS 15 HE3 LYS 15 -6.235 -3.086 -6.329 115 HZ1 LYS 15 HZ1 LYS 15 -7.334 -0.900 -6.708 116 HZ2 LYS 15 HZ2 LYS 15 -7.211 -1.810 -8.182 117 HZ3 LYS 15 HZ3 LYS 15 -6.125 -0.481 -7.890 118 H ASP 16 H ASP 16 -0.506 -1.390 -2.016 119 HA ASP 16 HA ASP 16 -1.722 0.392 -0.282 120 HB2 ASP 16 HB2 ASP 16 1.191 -0.536 -0.193 121 HB3 ASP 16 HB3 ASP 16 0.381 0.365 1.111 122 H LEU 17 H LEU 17 1.465 1.195 -2.037 123 HA LEU 17 HA LEU 17 1.608 3.780 -1.066 124 HB2 LEU 17 HB2 LEU 17 2.217 2.752 -3.889 125 HB3 LEU 17 HB3 LEU 17 2.522 4.454 -3.469 126 HG LEU 17 HG LEU 17 3.804 2.148 -1.910 127 HD11 LEU 17 HD11 LEU 17 4.541 2.108 -4.341 128 HD12 LEU 17 HD12 LEU 17 5.872 2.586 -3.254 129 HD13 LEU 17 HD13 LEU 17 5.008 3.825 -4.211 130 HD21 LEU 17 HD21 LEU 17 5.437 3.938 -1.188 131 HD22 LEU 17 HD22 LEU 17 3.797 4.331 -0.641 132 HD23 LEU 17 HD23 LEU 17 4.480 5.157 -2.067 133 H ALA 18 H ALA 18 -0.480 2.710 -3.873 134 HA ALA 18 HA ALA 18 -1.422 5.367 -4.362 135 HB1 ALA 18 HB1 ALA 18 -3.344 4.282 -5.533 136 HB2 ALA 18 HB2 ALA 18 -1.786 3.543 -6.003 137 HB3 ALA 18 HB3 ALA 18 -2.879 2.693 -4.875 138 H GLY 19 H GLY 19 -2.915 2.650 -2.346 139 HA2 GLY 19 HA2 GLY 19 -5.052 4.336 -1.472 140 HA3 GLY 19 HA3 GLY 19 -4.568 2.803 -0.714 141 H LYS 20 H LYS 20 -1.665 4.376 -0.387 142 HA LYS 20 HA LYS 20 -2.536 5.557 2.239 143 HB2 LYS 20 HB2 LYS 20 0.092 4.317 1.308 144 HB3 LYS 20 HB3 LYS 20 0.026 5.489 2.643 145 HG2 LYS 20 HG2 LYS 20 -0.043 3.179 3.512 146 HG3 LYS 20 HG3 LYS 20 -1.509 4.097 3.943 147 HD2 LYS 20 HD2 LYS 20 -2.812 2.912 2.167 148 HD3 LYS 20 HD3 LYS 20 -1.316 2.130 1.596 149 HE2 LYS 20 HE2 LYS 20 -2.629 0.528 2.866 150 HE3 LYS 20 HE3 LYS 20 -1.115 0.872 3.738 151 HZ1 LYS 20 HZ1 LYS 20 -3.808 2.146 4.370 152 HZ2 LYS 20 HZ2 LYS 20 -2.341 2.306 5.311 153 HZ3 LYS 20 HZ3 LYS 20 -3.132 0.777 5.206 154 H LEU 21 H LEU 21 -0.028 6.233 -0.397 155 HA LEU 21 HA LEU 21 0.214 8.939 0.440 156 HB2 LEU 21 HB2 LEU 21 0.538 7.877 -2.435 157 HB3 LEU 21 HB3 LEU 21 1.055 9.474 -1.843 158 HG LEU 21 HG LEU 21 2.243 6.744 -1.015 159 HD11 LEU 21 HD11 LEU 21 2.911 7.535 -3.281 160 HD12 LEU 21 HD12 LEU 21 4.294 7.638 -2.158 161 HD13 LEU 21 HD13 LEU 21 3.406 9.116 -2.606 162 HD21 LEU 21 HD21 LEU 21 2.356 8.185 0.987 163 HD22 LEU 21 HD22 LEU 21 2.924 9.575 0.006 164 HD23 LEU 21 HD23 LEU 21 3.964 8.141 0.241 165 H LEU 22 H LEU 22 -2.030 7.407 -2.006 166 HA LEU 22 HA LEU 22 -3.500 10.048 -2.080 167 HB2 LEU 22 HB2 LEU 22 -3.715 7.686 -4.004 168 HB3 LEU 22 HB3 LEU 22 -4.407 9.306 -4.211 169 HG LEU 22 HG LEU 22 -1.381 8.637 -4.156 170 HD11 LEU 22 HD11 LEU 22 -2.457 7.684 -6.150 171 HD12 LEU 22 HD12 LEU 22 -1.462 9.082 -6.624 172 HD13 LEU 22 HD13 LEU 22 -3.240 9.252 -6.527 173 HD21 LEU 22 HD21 LEU 22 -1.100 10.987 -5.050 174 HD22 LEU 22 HD22 LEU 22 -1.756 10.984 -3.401 175 HD23 LEU 22 HD23 LEU 22 -2.843 11.282 -4.792 176 H GLU 23 H GLU 23 -3.756 8.726 0.325 177 HA GLU 23 HA GLU 23 -5.893 6.827 0.248 178 HB2 GLU 23 HB2 GLU 23 -4.433 7.207 2.283 179 HB3 GLU 23 HB3 GLU 23 -5.210 8.790 2.526 180 HG2 GLU 23 HG2 GLU 23 -7.455 7.595 2.770 181 HG3 GLU 23 HG3 GLU 23 -6.610 6.033 2.592 182 H THR 24 H THR 24 -5.760 10.433 0.690 183 HA THR 24 HA THR 24 -8.368 10.975 1.178 184 HB THR 24 HB THR 24 -6.630 12.716 0.984 185 HG1 THR 24 HG1 THR 24 -8.152 14.267 0.027 186 HG21 THR 24 HG21 THR 24 -7.040 12.515 -2.075 187 HG22 THR 24 HG22 THR 24 -5.574 11.945 -1.225 188 HG23 THR 24 HG23 THR 24 -5.996 13.680 -1.223 189 H LEU 25 H LEU 25 -7.214 9.798 -2.048 190 HA LEU 25 HA LEU 25 -10.091 9.869 -2.853 191 HB2 LEU 25 HB2 LEU 25 -9.645 10.809 -4.984 192 HB3 LEU 25 HB3 LEU 25 -8.936 11.831 -3.722 193 HG LEU 25 HG LEU 25 -6.672 10.492 -4.325 194 HD11 LEU 25 HD11 LEU 25 -8.212 10.356 -7.023 195 HD12 LEU 25 HD12 LEU 25 -7.883 8.922 -6.038 196 HD13 LEU 25 HD13 LEU 25 -6.530 9.852 -6.729 197 HD21 LEU 25 HD21 LEU 25 -6.910 12.934 -4.577 198 HD22 LEU 25 HD22 LEU 25 -7.812 12.706 -6.102 199 HD23 LEU 25 HD23 LEU 25 -6.087 12.235 -5.992 200 H LYS 26 H LYS 26 -6.868 8.150 -3.651 201 HA LYS 26 HA LYS 26 -8.363 6.311 -5.255 202 HB2 LYS 26 HB2 LYS 26 -5.652 5.967 -3.865 203 HB3 LYS 26 HB3 LYS 26 -6.372 4.705 -4.882 204 HG2 LYS 26 HG2 LYS 26 -5.836 7.543 -5.938 205 HG3 LYS 26 HG3 LYS 26 -4.644 6.238 -6.024 206 HD2 LYS 26 HD2 LYS 26 -6.110 4.828 -7.405 207 HD3 LYS 26 HD3 LYS 26 -7.443 5.997 -7.300 208 HE2 LYS 26 HE2 LYS 26 -6.396 6.211 -9.461 209 HE3 LYS 26 HE3 LYS 26 -6.140 7.706 -8.525 210 HZ1 LYS 26 HZ1 LYS 26 -4.072 5.493 -8.795 211 HZ2 LYS 26 HZ2 LYS 26 -3.824 7.088 -8.125 212 HZ3 LYS 26 HZ3 LYS 26 -4.136 6.914 -9.806 213 H CYS 27 H CYS 27 -7.207 6.064 -1.767 214 HA CYS 27 HA CYS 27 -8.242 3.508 -1.404 215 HB2 CYS 27 HB2 CYS 27 -6.931 4.644 0.393 216 HB3 CYS 27 HB3 CYS 27 -8.326 5.725 0.716 217 H LYS 28 H LYS 28 -10.026 6.679 -1.372 218 HA LYS 28 HA LYS 28 -12.476 5.480 -0.374 219 HB2 LYS 28 HB2 LYS 28 -11.976 8.064 -1.966 220 HB3 LYS 28 HB3 LYS 28 -13.603 7.483 -1.553 221 HG2 LYS 28 HG2 LYS 28 -12.889 9.161 0.086 222 HG3 LYS 28 HG3 LYS 28 -13.145 7.573 0.857 223 HD2 LYS 28 HD2 LYS 28 -10.694 7.194 0.994 224 HD3 LYS 28 HD3 LYS 28 -10.403 8.652 -0.003 225 HE2 LYS 28 HE2 LYS 28 -9.900 9.089 2.368 226 HE3 LYS 28 HE3 LYS 28 -11.240 10.118 1.805 227 HZ1 LYS 28 HZ1 LYS 28 -11.600 7.533 3.369 228 HZ2 LYS 28 HZ2 LYS 28 -12.850 8.691 2.973 229 HZ3 LYS 28 HZ3 LYS 28 -11.596 9.126 4.071 230 H ILE 29 H ILE 29 -11.111 6.129 -3.706 231 HA ILE 29 HA ILE 29 -13.509 5.239 -5.006 232 HB ILE 29 HB ILE 29 -10.650 5.485 -6.044 233 HG12 ILE 29 HG12 ILE 29 -13.128 7.178 -6.735 234 HG13 ILE 29 HG13 ILE 29 -12.086 7.585 -5.363 235 HG21 ILE 29 HG21 ILE 29 -11.797 3.714 -7.369 236 HG22 ILE 29 HG22 ILE 29 -13.206 4.783 -7.608 237 HG23 ILE 29 HG23 ILE 29 -11.631 5.177 -8.350 238 HD11 ILE 29 HD11 ILE 29 -10.093 7.767 -6.892 239 HD12 ILE 29 HD12 ILE 29 -11.161 7.491 -8.299 240 HD13 ILE 29 HD13 ILE 29 -11.392 8.929 -7.276 241 H THR 30 H THR 30 -10.277 3.441 -4.786 242 HA THR 30 HA THR 30 -11.575 1.059 -5.643 243 HB THR 30 HB THR 30 -9.086 1.403 -5.829 244 HG1 THR 30 HG1 THR 30 -10.004 -0.788 -5.935 245 HG21 THR 30 HG21 THR 30 -8.592 2.254 -3.490 246 HG22 THR 30 HG22 THR 30 -7.625 0.818 -3.906 247 HG23 THR 30 HG23 THR 30 -9.035 0.655 -2.829 248 H GLY 31 H GLY 31 -11.361 2.533 -2.380 249 HA2 GLY 31 HA2 GLY 31 -12.526 1.797 -0.465 250 HA3 GLY 31 HA3 GLY 31 -13.076 0.369 -1.362 251 H CYS 32 H CYS 32 -9.824 1.827 -0.465 252 HA CYS 32 HA CYS 32 -8.645 -0.774 -0.281 253 HB2 CYS 32 HB2 CYS 32 -6.632 0.201 0.462 254 HB3 CYS 32 HB3 CYS 32 -7.307 1.412 -0.650 Start of MODEL 12 1 H1 GLY 1 H1 GLY 1 11.933 -9.854 11.891 2 HA2 GLY 1 HA2 GLY 1 14.374 -10.753 10.446 3 HA3 GLY 1 HA3 GLY 1 12.746 -11.363 10.040 4 H ILE 2 H ILE 2 14.778 -9.645 8.367 5 HA ILE 2 HA ILE 2 13.208 -7.155 8.024 6 HB ILE 2 HB ILE 2 15.596 -8.231 6.436 7 HG12 ILE 2 HG12 ILE 2 15.394 -5.995 8.562 8 HG13 ILE 2 HG13 ILE 2 16.105 -7.606 8.822 9 HG21 ILE 2 HG21 ILE 2 14.055 -6.762 5.059 10 HG22 ILE 2 HG22 ILE 2 14.196 -5.488 6.302 11 HG23 ILE 2 HG23 ILE 2 15.618 -5.986 5.339 12 HD11 ILE 2 HD11 ILE 2 17.936 -6.058 8.460 13 HD12 ILE 2 HD12 ILE 2 17.830 -7.100 7.013 14 HD13 ILE 2 HD13 ILE 2 17.221 -5.416 6.966 15 H LEU 3 H LEU 3 14.066 -10.150 6.025 16 HA LEU 3 HA LEU 3 12.302 -9.471 3.976 17 HB2 LEU 3 HB2 LEU 3 12.370 -11.752 3.179 18 HB3 LEU 3 HB3 LEU 3 13.960 -11.251 3.779 19 HG LEU 3 HG LEU 3 13.180 -12.495 6.041 20 HD11 LEU 3 HD11 LEU 3 11.718 -14.472 5.622 21 HD12 LEU 3 HD12 LEU 3 11.486 -13.986 3.921 22 HD13 LEU 3 HD13 LEU 3 10.788 -13.013 5.232 23 HD21 LEU 3 HD21 LEU 3 14.189 -14.631 5.181 24 HD22 LEU 3 HD22 LEU 3 15.123 -13.205 4.668 25 HD23 LEU 3 HD23 LEU 3 14.033 -14.019 3.508 26 H SER 4 H SER 4 11.533 -11.006 7.188 27 HA SER 4 HA SER 4 8.894 -11.795 6.504 28 HB2 SER 4 HB2 SER 4 8.370 -11.617 8.911 29 HB3 SER 4 HB3 SER 4 9.946 -12.435 8.653 30 HG SER 4 HG SER 4 10.074 -10.703 10.294 31 H SER 5 H SER 5 10.209 -8.639 7.838 32 HA SER 5 HA SER 5 7.686 -7.353 7.946 33 HB2 SER 5 HB2 SER 5 10.424 -6.056 7.388 34 HB3 SER 5 HB3 SER 5 8.957 -5.230 7.999 35 HG SER 5 HG SER 5 10.406 -5.943 9.766 36 H PHE 6 H PHE 6 10.101 -7.636 5.208 37 HA PHE 6 HA PHE 6 8.639 -5.706 3.603 38 HB2 PHE 6 HB2 PHE 6 10.928 -7.612 2.942 39 HB3 PHE 6 HB3 PHE 6 9.969 -6.867 1.655 40 HD1 PHE 6 HD2 PHE 6 11.536 -5.737 4.945 41 HD2 PHE 6 HD1 PHE 6 10.844 -4.844 0.788 42 HE1 PHE 6 HE2 PHE 6 12.768 -3.619 5.193 43 HE2 PHE 6 HE1 PHE 6 12.123 -2.752 1.034 44 HZ PHE 6 HZ PHE 6 13.088 -2.125 3.236 45 H LYS 7 H LYS 7 8.988 -9.375 3.221 46 HA LYS 7 HA LYS 7 7.013 -9.502 1.267 47 HB2 LYS 7 HB2 LYS 7 6.718 -11.859 1.698 48 HB3 LYS 7 HB3 LYS 7 8.429 -11.440 1.924 49 HG2 LYS 7 HG2 LYS 7 8.119 -12.784 3.842 50 HG3 LYS 7 HG3 LYS 7 7.747 -11.183 4.472 51 HD2 LYS 7 HD2 LYS 7 5.903 -12.283 5.336 52 HD3 LYS 7 HD3 LYS 7 5.186 -11.915 3.754 53 HE2 LYS 7 HE2 LYS 7 6.532 -14.551 4.609 54 HE3 LYS 7 HE3 LYS 7 4.788 -14.258 4.417 55 HZ1 LYS 7 HZ1 LYS 7 6.851 -14.273 2.187 56 HZ2 LYS 7 HZ2 LYS 7 5.157 -13.853 1.990 57 HZ3 LYS 7 HZ3 LYS 7 5.626 -15.449 2.489 58 H GLY 8 H GLY 8 6.528 -9.142 4.868 59 HA2 GLY 8 HA2 GLY 8 3.734 -9.764 4.762 60 HA3 GLY 8 HA3 GLY 8 4.530 -8.775 6.008 61 H VAL 9 H VAL 9 5.582 -6.601 4.535 62 HA VAL 9 HA VAL 9 2.981 -5.214 4.040 63 HB VAL 9 HB VAL 9 5.779 -4.108 4.643 64 HG11 VAL 9 HG11 VAL 9 4.445 -2.501 3.263 65 HG12 VAL 9 HG12 VAL 9 3.064 -2.667 4.387 66 HG13 VAL 9 HG13 VAL 9 4.592 -1.926 4.942 67 HG21 VAL 9 HG21 VAL 9 4.753 -5.320 6.591 68 HG22 VAL 9 HG22 VAL 9 4.819 -3.563 6.870 69 HG23 VAL 9 HG23 VAL 9 3.273 -4.336 6.421 70 H ALA 10 H ALA 10 6.360 -5.218 2.595 71 HA ALA 10 HA ALA 10 5.651 -3.596 0.461 72 HB1 ALA 10 HB1 ALA 10 8.029 -4.149 1.050 73 HB2 ALA 10 HB2 ALA 10 7.791 -5.813 0.437 74 HB3 ALA 10 HB3 ALA 10 7.709 -4.424 -0.686 75 H LYS 11 H LYS 11 5.038 -7.169 0.727 76 HA LYS 11 HA LYS 11 5.088 -7.843 -1.901 77 HB2 LYS 11 HB2 LYS 11 3.343 -9.540 -1.561 78 HB3 LYS 11 HB3 LYS 11 4.492 -9.505 -0.206 79 HG2 LYS 11 HG2 LYS 11 2.798 -8.164 1.148 80 HG3 LYS 11 HG3 LYS 11 1.658 -8.258 -0.222 81 HD2 LYS 11 HD2 LYS 11 1.586 -10.725 -0.091 82 HD3 LYS 11 HD3 LYS 11 2.764 -10.726 1.245 83 HE2 LYS 11 HE2 LYS 11 1.166 -9.405 2.667 84 HE3 LYS 11 HE3 LYS 11 -0.020 -9.401 1.333 85 HZ1 LYS 11 HZ1 LYS 11 -0.524 -11.158 2.973 86 HZ2 LYS 11 HZ2 LYS 11 1.047 -11.870 2.748 87 HZ3 LYS 11 HZ3 LYS 11 -0.113 -11.871 1.440 88 H GLY 12 H GLY 12 2.376 -5.878 -0.421 89 HA2 GLY 12 HA2 GLY 12 1.126 -5.783 -3.176 90 HA3 GLY 12 HA3 GLY 12 0.297 -5.547 -1.627 91 H VAL 13 H VAL 13 3.557 -4.147 -2.427 92 HA VAL 13 HA VAL 13 2.661 -1.622 -1.528 93 HB VAL 13 HB VAL 13 5.055 -2.295 -1.530 94 HG11 VAL 13 HG11 VAL 13 5.053 -1.628 -4.550 95 HG12 VAL 13 HG12 VAL 13 6.472 -2.031 -3.553 96 HG13 VAL 13 HG13 VAL 13 5.237 -3.270 -3.874 97 HG21 VAL 13 HG21 VAL 13 5.966 -0.054 -1.995 98 HG22 VAL 13 HG22 VAL 13 4.554 0.348 -3.006 99 HG23 VAL 13 HG23 VAL 13 4.357 0.120 -1.244 100 H ALA 14 H ALA 14 2.799 -3.026 -4.903 101 HA ALA 14 HA ALA 14 2.670 -0.653 -6.295 102 HB1 ALA 14 HB1 ALA 14 1.151 -3.240 -7.002 103 HB2 ALA 14 HB2 ALA 14 1.442 -1.871 -8.115 104 HB3 ALA 14 HB3 ALA 14 2.819 -2.814 -7.473 105 H LYS 15 H LYS 15 -0.322 -2.508 -5.202 106 HA LYS 15 HA LYS 15 -1.966 -0.239 -5.974 107 HB2 LYS 15 HB2 LYS 15 -3.867 -1.446 -5.154 108 HB3 LYS 15 HB3 LYS 15 -2.795 -2.590 -6.004 109 HG2 LYS 15 HG2 LYS 15 -1.966 -3.407 -3.707 110 HG3 LYS 15 HG3 LYS 15 -3.052 -2.231 -2.939 111 HD2 LYS 15 HD2 LYS 15 -4.048 -4.447 -2.858 112 HD3 LYS 15 HD3 LYS 15 -5.050 -3.344 -3.832 113 HE2 LYS 15 HE2 LYS 15 -4.914 -5.636 -4.794 114 HE3 LYS 15 HE3 LYS 15 -4.299 -4.426 -5.933 115 HZ1 LYS 15 HZ1 LYS 15 -2.909 -6.497 -5.790 116 HZ2 LYS 15 HZ2 LYS 15 -2.540 -6.129 -4.130 117 HZ3 LYS 15 HZ3 LYS 15 -1.995 -5.084 -5.426 118 H ASP 16 H ASP 16 -0.526 -1.438 -2.861 119 HA ASP 16 HA ASP 16 -2.309 0.151 -1.278 120 HB2 ASP 16 HB2 ASP 16 -1.134 -1.909 -0.447 121 HB3 ASP 16 HB3 ASP 16 0.425 -1.037 -0.527 122 H LEU 17 H LEU 17 0.872 0.911 -2.802 123 HA LEU 17 HA LEU 17 1.619 2.898 -0.985 124 HB2 LEU 17 HB2 LEU 17 2.822 2.019 -3.320 125 HB3 LEU 17 HB3 LEU 17 2.201 3.563 -3.900 126 HG LEU 17 HG LEU 17 4.085 3.056 -1.503 127 HD11 LEU 17 HD11 LEU 17 5.150 2.773 -3.767 128 HD12 LEU 17 HD12 LEU 17 5.802 4.190 -2.907 129 HD13 LEU 17 HD13 LEU 17 4.612 4.415 -4.221 130 HD21 LEU 17 HD21 LEU 17 2.960 5.712 -2.587 131 HD22 LEU 17 HD22 LEU 17 4.329 5.593 -1.440 132 HD23 LEU 17 HD23 LEU 17 2.718 5.035 -0.947 133 H ALA 18 H ALA 18 -0.353 3.158 -4.056 134 HA ALA 18 HA ALA 18 -1.007 5.911 -3.747 135 HB1 ALA 18 HB1 ALA 18 -1.534 4.676 -5.850 136 HB2 ALA 18 HB2 ALA 18 -2.708 3.647 -4.981 137 HB3 ALA 18 HB3 ALA 18 -3.019 5.401 -5.166 138 H GLY 19 H GLY 19 -2.614 2.872 -2.431 139 HA2 GLY 19 HA2 GLY 19 -4.795 4.090 -1.231 140 HA3 GLY 19 HA3 GLY 19 -3.938 2.703 -0.504 141 H LYS 20 H LYS 20 -1.339 4.071 -0.016 142 HA LYS 20 HA LYS 20 -2.140 5.423 2.466 143 HB2 LYS 20 HB2 LYS 20 0.576 4.701 1.252 144 HB3 LYS 20 HB3 LYS 20 0.460 5.935 2.523 145 HG2 LYS 20 HG2 LYS 20 0.987 3.770 3.495 146 HG3 LYS 20 HG3 LYS 20 -0.568 4.391 4.104 147 HD2 LYS 20 HD2 LYS 20 -1.799 2.869 2.523 148 HD3 LYS 20 HD3 LYS 20 -0.244 2.236 1.920 149 HE2 LYS 20 HE2 LYS 20 -1.158 2.079 4.873 150 HE3 LYS 20 HE3 LYS 20 -1.461 0.794 3.691 151 HZ1 LYS 20 HZ1 LYS 20 1.002 0.577 3.337 152 HZ2 LYS 20 HZ2 LYS 20 0.496 0.215 4.955 153 HZ3 LYS 20 HZ3 LYS 20 1.277 1.717 4.632 154 H LEU 21 H LEU 21 -0.014 6.563 -0.328 155 HA LEU 21 HA LEU 21 -0.047 9.203 0.760 156 HB2 LEU 21 HB2 LEU 21 0.423 8.375 -2.165 157 HB3 LEU 21 HB3 LEU 21 0.757 9.993 -1.498 158 HG LEU 21 HG LEU 21 2.186 7.394 -0.672 159 HD11 LEU 21 HD11 LEU 21 4.145 8.349 -1.871 160 HD12 LEU 21 HD12 LEU 21 3.208 9.811 -2.290 161 HD13 LEU 21 HD13 LEU 21 2.764 8.231 -2.991 162 HD21 LEU 21 HD21 LEU 21 2.641 10.284 0.274 163 HD22 LEU 21 HD22 LEU 21 3.794 8.942 0.529 164 HD23 LEU 21 HD23 LEU 21 2.196 8.880 1.293 165 H LEU 22 H LEU 22 -2.093 7.669 -1.814 166 HA LEU 22 HA LEU 22 -3.692 10.217 -1.922 167 HB2 LEU 22 HB2 LEU 22 -3.795 7.763 -3.744 168 HB3 LEU 22 HB3 LEU 22 -4.533 9.354 -4.039 169 HG LEU 22 HG LEU 22 -1.514 8.701 -3.996 170 HD11 LEU 22 HD11 LEU 22 -3.364 9.525 -6.316 171 HD12 LEU 22 HD12 LEU 22 -2.742 7.875 -6.023 172 HD13 LEU 22 HD13 LEU 22 -1.612 9.192 -6.427 173 HD21 LEU 22 HD21 LEU 22 -1.795 11.012 -3.141 174 HD22 LEU 22 HD22 LEU 22 -2.936 11.398 -4.468 175 HD23 LEU 22 HD23 LEU 22 -1.211 11.080 -4.817 176 H GLU 23 H GLU 23 -3.931 8.679 0.542 177 HA GLU 23 HA GLU 23 -6.076 6.831 0.319 178 HB2 GLU 23 HB2 GLU 23 -4.658 7.213 2.424 179 HB3 GLU 23 HB3 GLU 23 -5.584 8.705 2.716 180 HG2 GLU 23 HG2 GLU 23 -7.718 7.291 2.755 181 HG3 GLU 23 HG3 GLU 23 -6.715 5.828 2.567 182 H THR 24 H THR 24 -6.002 10.425 0.901 183 HA THR 24 HA THR 24 -8.648 10.935 1.274 184 HB THR 24 HB THR 24 -6.907 12.690 1.257 185 HG1 THR 24 HG1 THR 24 -8.389 14.275 0.295 186 HG21 THR 24 HG21 THR 24 -7.151 12.646 -1.826 187 HG22 THR 24 HG22 THR 24 -5.730 12.027 -0.936 188 HG23 THR 24 HG23 THR 24 -6.155 13.758 -0.855 189 H LEU 25 H LEU 25 -7.263 9.956 -1.911 190 HA LEU 25 HA LEU 25 -10.064 10.094 -2.967 191 HB2 LEU 25 HB2 LEU 25 -9.366 11.000 -5.069 192 HB3 LEU 25 HB3 LEU 25 -8.849 12.020 -3.714 193 HG LEU 25 HG LEU 25 -6.505 10.768 -3.999 194 HD11 LEU 25 HD11 LEU 25 -5.987 10.117 -6.342 195 HD12 LEU 25 HD12 LEU 25 -7.641 10.528 -6.870 196 HD13 LEU 25 HD13 LEU 25 -7.365 9.121 -5.829 197 HD21 LEU 25 HD21 LEU 25 -5.759 12.532 -5.612 198 HD22 LEU 25 HD22 LEU 25 -6.801 13.202 -4.337 199 HD23 LEU 25 HD23 LEU 25 -7.469 12.912 -5.967 200 H LYS 26 H LYS 26 -6.842 8.325 -3.481 201 HA LYS 26 HA LYS 26 -8.078 6.523 -5.239 202 HB2 LYS 26 HB2 LYS 26 -5.603 6.527 -5.016 203 HB3 LYS 26 HB3 LYS 26 -5.752 6.087 -3.297 204 HG2 LYS 26 HG2 LYS 26 -5.098 4.077 -4.222 205 HG3 LYS 26 HG3 LYS 26 -6.837 3.851 -4.080 206 HD2 LYS 26 HD2 LYS 26 -5.226 4.510 -6.643 207 HD3 LYS 26 HD3 LYS 26 -5.933 2.944 -6.182 208 HE2 LYS 26 HE2 LYS 26 -8.257 4.146 -6.254 209 HE3 LYS 26 HE3 LYS 26 -7.398 5.457 -7.126 210 HZ1 LYS 26 HZ1 LYS 26 -8.391 3.910 -8.707 211 HZ2 LYS 26 HZ2 LYS 26 -7.545 2.565 -8.010 212 HZ3 LYS 26 HZ3 LYS 26 -6.655 3.831 -8.815 213 H CYS 27 H CYS 27 -7.578 6.184 -1.598 214 HA CYS 27 HA CYS 27 -8.943 3.714 -1.571 215 HB2 CYS 27 HB2 CYS 27 -8.441 5.742 0.677 216 HB3 CYS 27 HB3 CYS 27 -9.456 4.310 0.940 217 H LYS 28 H LYS 28 -10.305 7.055 -1.430 218 HA LYS 28 HA LYS 28 -12.958 6.120 -0.738 219 HB2 LYS 28 HB2 LYS 28 -11.957 8.650 -2.154 220 HB3 LYS 28 HB3 LYS 28 -13.688 8.280 -2.030 221 HG2 LYS 28 HG2 LYS 28 -12.930 9.806 -0.206 222 HG3 LYS 28 HG3 LYS 28 -13.676 8.302 0.392 223 HD2 LYS 28 HD2 LYS 28 -11.432 7.348 0.924 224 HD3 LYS 28 HD3 LYS 28 -10.641 8.800 0.247 225 HE2 LYS 28 HE2 LYS 28 -11.669 10.217 2.005 226 HE3 LYS 28 HE3 LYS 28 -12.584 8.820 2.638 227 HZ1 LYS 28 HZ1 LYS 28 -9.556 9.032 2.576 228 HZ2 LYS 28 HZ2 LYS 28 -10.469 7.698 3.222 229 HZ3 LYS 28 HZ3 LYS 28 -10.560 9.262 3.976 230 H ILE 29 H ILE 29 -11.150 6.433 -3.886 231 HA ILE 29 HA ILE 29 -13.514 5.746 -5.420 232 HB ILE 29 HB ILE 29 -10.550 5.766 -6.154 233 HG12 ILE 29 HG12 ILE 29 -12.835 7.592 -7.121 234 HG13 ILE 29 HG13 ILE 29 -11.888 7.970 -5.671 235 HG21 ILE 29 HG21 ILE 29 -11.307 5.444 -8.540 236 HG22 ILE 29 HG22 ILE 29 -11.670 4.029 -7.543 237 HG23 ILE 29 HG23 ILE 29 -12.974 5.176 -7.958 238 HD11 ILE 29 HD11 ILE 29 -10.947 9.208 -7.550 239 HD12 ILE 29 HD12 ILE 29 -9.763 7.981 -7.023 240 HD13 ILE 29 HD13 ILE 29 -10.723 7.729 -8.512 241 H THR 30 H THR 30 -10.473 3.761 -4.741 242 HA THR 30 HA THR 30 -12.006 1.439 -5.679 243 HB THR 30 HB THR 30 -9.639 1.936 -6.367 244 HG1 THR 30 HG1 THR 30 -9.237 -0.403 -6.363 245 HG21 THR 30 HG21 THR 30 -8.739 2.330 -3.933 246 HG22 THR 30 HG22 THR 30 -7.776 1.216 -4.941 247 HG23 THR 30 HG23 THR 30 -8.880 0.565 -3.704 248 H GLY 31 H GLY 31 -12.074 2.818 -2.590 249 HA2 GLY 31 HA2 GLY 31 -13.017 1.810 -0.711 250 HA3 GLY 31 HA3 GLY 31 -13.002 0.250 -1.550 251 H CYS 32 H CYS 32 -9.773 1.568 -1.655 252 HA CYS 32 HA CYS 32 -7.885 1.095 -0.407 253 HB2 CYS 32 HB2 CYS 32 -9.879 2.030 1.477 254 HB3 CYS 32 HB3 CYS 32 -9.137 0.612 2.231 Start of MODEL 13 1 H1 GLY 1 H1 GLY 1 12.401 -10.555 11.743 2 HA2 GLY 1 HA2 GLY 1 15.105 -10.603 10.498 3 HA3 GLY 1 HA3 GLY 1 13.725 -11.546 9.862 4 H ILE 2 H ILE 2 15.278 -9.481 8.345 5 HA ILE 2 HA ILE 2 13.495 -7.140 8.236 6 HB ILE 2 HB ILE 2 15.756 -8.014 6.358 7 HG12 ILE 2 HG12 ILE 2 15.641 -5.806 8.518 8 HG13 ILE 2 HG13 ILE 2 16.457 -7.376 8.703 9 HG21 ILE 2 HG21 ILE 2 14.162 -5.373 6.415 10 HG22 ILE 2 HG22 ILE 2 15.524 -5.749 5.320 11 HG23 ILE 2 HG23 ILE 2 14.005 -6.635 5.162 12 HD11 ILE 2 HD11 ILE 2 18.163 -5.740 8.171 13 HD12 ILE 2 HD12 ILE 2 17.971 -6.788 6.738 14 HD13 ILE 2 HD13 ILE 2 17.277 -5.137 6.755 15 H LEU 3 H LEU 3 14.267 -10.033 6.082 16 HA LEU 3 HA LEU 3 12.373 -9.321 4.172 17 HB2 LEU 3 HB2 LEU 3 12.450 -11.570 3.276 18 HB3 LEU 3 HB3 LEU 3 14.058 -11.042 3.803 19 HG LEU 3 HG LEU 3 13.434 -12.396 6.057 20 HD11 LEU 3 HD11 LEU 3 11.024 -12.967 5.314 21 HD12 LEU 3 HD12 LEU 3 12.017 -14.402 5.636 22 HD13 LEU 3 HD13 LEU 3 11.710 -13.881 3.957 23 HD21 LEU 3 HD21 LEU 3 14.227 -13.790 3.431 24 HD22 LEU 3 HD22 LEU 3 14.476 -14.456 5.072 25 HD23 LEU 3 HD23 LEU 3 15.336 -12.978 4.575 26 H SER 4 H SER 4 11.782 -11.076 7.326 27 HA SER 4 HA SER 4 9.167 -11.899 6.668 28 HB2 SER 4 HB2 SER 4 8.622 -11.919 9.046 29 HB3 SER 4 HB3 SER 4 10.259 -12.591 8.816 30 HG SER 4 HG SER 4 11.031 -10.468 9.576 31 H SER 5 H SER 5 10.346 -8.711 8.040 32 HA SER 5 HA SER 5 7.704 -7.592 8.163 33 HB2 SER 5 HB2 SER 5 10.395 -6.128 7.799 34 HB3 SER 5 HB3 SER 5 8.871 -5.401 8.375 35 HG SER 5 HG SER 5 9.086 -6.906 10.232 36 H PHE 6 H PHE 6 10.299 -7.656 5.581 37 HA PHE 6 HA PHE 6 8.947 -5.644 4.067 38 HB2 PHE 6 HB2 PHE 6 11.484 -6.433 3.916 39 HB3 PHE 6 HB3 PHE 6 10.882 -7.598 2.724 40 HD1 PHE 6 HD1 PHE 6 10.933 -3.974 3.728 41 HD2 PHE 6 HD2 PHE 6 10.446 -6.713 0.442 42 HE1 PHE 6 HE1 PHE 6 10.987 -2.078 2.144 43 HE2 PHE 6 HE2 PHE 6 10.521 -4.810 -1.142 44 HZ PHE 6 HZ PHE 6 10.785 -2.489 -0.298 45 H LYS 7 H LYS 7 9.215 -9.292 3.502 46 HA LYS 7 HA LYS 7 7.271 -9.225 1.439 47 HB2 LYS 7 HB2 LYS 7 7.076 -11.617 1.601 48 HB3 LYS 7 HB3 LYS 7 8.767 -11.165 1.900 49 HG2 LYS 7 HG2 LYS 7 8.469 -12.756 3.594 50 HG3 LYS 7 HG3 LYS 7 8.010 -11.297 4.493 51 HD2 LYS 7 HD2 LYS 7 5.547 -11.848 3.970 52 HD3 LYS 7 HD3 LYS 7 6.116 -13.337 3.180 53 HE2 LYS 7 HE2 LYS 7 7.181 -14.055 5.363 54 HE3 LYS 7 HE3 LYS 7 6.560 -12.571 6.137 55 HZ1 LYS 7 HZ1 LYS 7 5.092 -14.487 6.583 56 HZ2 LYS 7 HZ2 LYS 7 4.860 -14.754 4.881 57 HZ3 LYS 7 HZ3 LYS 7 4.250 -13.300 5.630 58 H GLY 8 H GLY 8 6.883 -9.215 5.065 59 HA2 GLY 8 HA2 GLY 8 4.129 -9.917 5.051 60 HA3 GLY 8 HA3 GLY 8 4.922 -8.909 6.285 61 H VAL 9 H VAL 9 5.806 -6.680 4.750 62 HA VAL 9 HA VAL 9 3.124 -5.400 4.413 63 HB VAL 9 HB VAL 9 5.899 -4.201 4.944 64 HG11 VAL 9 HG11 VAL 9 4.480 -2.613 3.633 65 HG12 VAL 9 HG12 VAL 9 3.134 -2.847 4.787 66 HG13 VAL 9 HG13 VAL 9 4.650 -2.063 5.318 67 HG21 VAL 9 HG21 VAL 9 3.455 -4.536 6.789 68 HG22 VAL 9 HG22 VAL 9 4.965 -5.482 6.898 69 HG23 VAL 9 HG23 VAL 9 4.991 -3.729 7.211 70 H ALA 10 H ALA 10 6.451 -5.213 2.839 71 HA ALA 10 HA ALA 10 5.549 -3.589 0.787 72 HB1 ALA 10 HB1 ALA 10 7.816 -5.653 0.568 73 HB2 ALA 10 HB2 ALA 10 7.601 -4.213 -0.470 74 HB3 ALA 10 HB3 ALA 10 7.977 -4.009 1.266 75 H LYS 11 H LYS 11 5.167 -7.191 0.994 76 HA LYS 11 HA LYS 11 5.168 -7.897 -1.597 77 HB2 LYS 11 HB2 LYS 11 3.391 -9.562 -1.234 78 HB3 LYS 11 HB3 LYS 11 4.576 -9.552 0.086 79 HG2 LYS 11 HG2 LYS 11 2.968 -8.152 1.482 80 HG3 LYS 11 HG3 LYS 11 1.758 -8.262 0.181 81 HD2 LYS 11 HD2 LYS 11 2.900 -10.715 1.652 82 HD3 LYS 11 HD3 LYS 11 1.391 -9.872 2.080 83 HE2 LYS 11 HE2 LYS 11 0.482 -10.347 -0.239 84 HE3 LYS 11 HE3 LYS 11 1.941 -11.314 -0.589 85 HZ1 LYS 11 HZ1 LYS 11 1.388 -12.801 1.298 86 HZ2 LYS 11 HZ2 LYS 11 0.096 -12.740 0.133 87 HZ3 LYS 11 HZ3 LYS 11 -0.052 -11.870 1.629 88 H GLY 12 H GLY 12 2.415 -5.935 -0.179 89 HA2 GLY 12 HA2 GLY 12 1.192 -5.930 -2.951 90 HA3 GLY 12 HA3 GLY 12 0.321 -5.748 -1.416 91 H VAL 13 H VAL 13 3.512 -4.190 -2.189 92 HA VAL 13 HA VAL 13 2.420 -1.708 -1.296 93 HB VAL 13 HB VAL 13 4.830 -2.321 -1.077 94 HG11 VAL 13 HG11 VAL 13 5.095 -1.530 -4.051 95 HG12 VAL 13 HG12 VAL 13 6.426 -1.921 -2.933 96 HG13 VAL 13 HG13 VAL 13 5.285 -3.193 -3.428 97 HG21 VAL 13 HG21 VAL 13 5.701 -0.036 -1.357 98 HG22 VAL 13 HG22 VAL 13 4.381 0.358 -2.485 99 HG23 VAL 13 HG23 VAL 13 4.021 0.043 -0.762 100 H ALA 14 H ALA 14 2.975 -3.084 -4.638 101 HA ALA 14 HA ALA 14 2.992 -0.805 -6.093 102 HB1 ALA 14 HB1 ALA 14 3.082 -3.025 -7.178 103 HB2 ALA 14 HB2 ALA 14 1.360 -3.321 -6.812 104 HB3 ALA 14 HB3 ALA 14 1.821 -2.029 -7.959 105 H LYS 15 H LYS 15 -0.173 -2.404 -5.125 106 HA LYS 15 HA LYS 15 -1.614 -0.039 -6.140 107 HB2 LYS 15 HB2 LYS 15 -2.502 -2.333 -6.416 108 HB3 LYS 15 HB3 LYS 15 -2.623 -2.532 -4.648 109 HG2 LYS 15 HG2 LYS 15 -4.305 -0.702 -4.511 110 HG3 LYS 15 HG3 LYS 15 -4.115 -0.356 -6.253 111 HD2 LYS 15 HD2 LYS 15 -4.942 -2.645 -6.826 112 HD3 LYS 15 HD3 LYS 15 -5.116 -3.040 -5.094 113 HE2 LYS 15 HE2 LYS 15 -6.852 -1.287 -4.831 114 HE3 LYS 15 HE3 LYS 15 -6.632 -0.767 -6.527 115 HZ1 LYS 15 HZ1 LYS 15 -7.368 -3.014 -7.281 116 HZ2 LYS 15 HZ2 LYS 15 -8.584 -2.234 -6.328 117 HZ3 LYS 15 HZ3 LYS 15 -7.615 -3.494 -5.620 118 H ASP 16 H ASP 16 -0.928 -1.600 -2.896 119 HA ASP 16 HA ASP 16 -2.573 0.162 -1.447 120 HB2 ASP 16 HB2 ASP 16 -1.578 -1.969 -0.525 121 HB3 ASP 16 HB3 ASP 16 0.030 -1.187 -0.514 122 H LEU 17 H LEU 17 0.708 0.805 -2.784 123 HA LEU 17 HA LEU 17 1.502 2.688 -0.885 124 HB2 LEU 17 HB2 LEU 17 2.715 1.873 -3.224 125 HB3 LEU 17 HB3 LEU 17 2.129 3.434 -3.783 126 HG LEU 17 HG LEU 17 3.964 2.868 -1.365 127 HD11 LEU 17 HD11 LEU 17 5.067 2.602 -3.617 128 HD12 LEU 17 HD12 LEU 17 5.718 4.002 -2.729 129 HD13 LEU 17 HD13 LEU 17 4.550 4.254 -4.058 130 HD21 LEU 17 HD21 LEU 17 4.235 5.409 -1.275 131 HD22 LEU 17 HD22 LEU 17 2.619 4.849 -0.797 132 HD23 LEU 17 HD23 LEU 17 2.872 5.546 -2.428 133 H ALA 18 H ALA 18 -0.361 3.157 -3.996 134 HA ALA 18 HA ALA 18 -0.921 5.917 -3.563 135 HB1 ALA 18 HB1 ALA 18 -2.864 5.543 -5.145 136 HB2 ALA 18 HB2 ALA 18 -1.332 4.857 -5.760 137 HB3 ALA 18 HB3 ALA 18 -2.564 3.777 -5.051 138 H GLY 19 H GLY 19 -2.686 2.868 -2.496 139 HA2 GLY 19 HA2 GLY 19 -4.885 4.040 -1.295 140 HA3 GLY 19 HA3 GLY 19 -4.035 2.639 -0.592 141 H LYS 20 H LYS 20 -1.451 4.021 -0.004 142 HA LYS 20 HA LYS 20 -2.353 5.345 2.477 143 HB2 LYS 20 HB2 LYS 20 0.392 4.499 1.432 144 HB3 LYS 20 HB3 LYS 20 0.249 5.722 2.711 145 HG2 LYS 20 HG2 LYS 20 0.600 3.511 3.676 146 HG3 LYS 20 HG3 LYS 20 -0.957 4.204 4.195 147 HD2 LYS 20 HD2 LYS 20 -2.159 2.782 2.501 148 HD3 LYS 20 HD3 LYS 20 -0.602 2.074 1.995 149 HE2 LYS 20 HE2 LYS 20 -1.750 1.919 4.868 150 HE3 LYS 20 HE3 LYS 20 -2.015 0.669 3.639 151 HZ1 LYS 20 HZ1 LYS 20 0.673 1.443 4.823 152 HZ2 LYS 20 HZ2 LYS 20 0.454 0.340 3.485 153 HZ3 LYS 20 HZ3 LYS 20 -0.202 -0.023 5.051 154 H LEU 21 H LEU 21 0.017 6.424 -0.142 155 HA LEU 21 HA LEU 21 -0.021 9.058 0.942 156 HB2 LEU 21 HB2 LEU 21 0.593 8.231 -1.955 157 HB3 LEU 21 HB3 LEU 21 0.912 9.844 -1.270 158 HG LEU 21 HG LEU 21 2.264 7.231 -0.366 159 HD11 LEU 21 HD11 LEU 21 3.401 9.643 -1.913 160 HD12 LEU 21 HD12 LEU 21 2.981 8.072 -2.648 161 HD13 LEU 21 HD13 LEU 21 4.296 8.169 -1.447 162 HD21 LEU 21 HD21 LEU 21 2.688 10.117 0.612 163 HD22 LEU 21 HD22 LEU 21 3.816 8.770 0.927 164 HD23 LEU 21 HD23 LEU 21 2.179 8.712 1.598 165 H LEU 22 H LEU 22 -1.938 7.599 -1.776 166 HA LEU 22 HA LEU 22 -3.547 10.145 -1.871 167 HB2 LEU 22 HB2 LEU 22 -3.555 7.745 -3.765 168 HB3 LEU 22 HB3 LEU 22 -4.324 9.327 -4.034 169 HG LEU 22 HG LEU 22 -1.295 8.720 -3.923 170 HD11 LEU 22 HD11 LEU 22 -1.335 9.297 -6.344 171 HD12 LEU 22 HD12 LEU 22 -3.094 9.600 -6.265 172 HD13 LEU 22 HD13 LEU 22 -2.455 7.950 -6.017 173 HD21 LEU 22 HD21 LEU 22 -2.738 11.413 -4.344 174 HD22 LEU 22 HD22 LEU 22 -1.001 11.133 -4.659 175 HD23 LEU 22 HD23 LEU 22 -1.624 11.000 -3.003 176 H GLU 23 H GLU 23 -3.913 8.775 0.546 177 HA GLU 23 HA GLU 23 -6.019 6.840 0.298 178 HB2 GLU 23 HB2 GLU 23 -4.714 7.165 2.432 179 HB3 GLU 23 HB3 GLU 23 -5.476 8.760 2.646 180 HG2 GLU 23 HG2 GLU 23 -7.752 7.620 2.732 181 HG3 GLU 23 HG3 GLU 23 -6.943 6.041 2.544 182 H THR 24 H THR 24 -5.966 10.446 0.867 183 HA THR 24 HA THR 24 -8.619 10.929 1.145 184 HB THR 24 HB THR 24 -6.889 12.706 1.169 185 HG1 THR 24 HG1 THR 24 -8.347 14.278 0.149 186 HG21 THR 24 HG21 THR 24 -5.640 12.032 -0.980 187 HG22 THR 24 HG22 THR 24 -6.080 13.761 -0.932 188 HG23 THR 24 HG23 THR 24 -7.037 12.630 -1.920 189 H LEU 25 H LEU 25 -7.155 9.920 -1.994 190 HA LEU 25 HA LEU 25 -9.937 10.023 -3.101 191 HB2 LEU 25 HB2 LEU 25 -9.210 10.950 -5.193 192 HB3 LEU 25 HB3 LEU 25 -8.727 11.973 -3.827 193 HG LEU 25 HG LEU 25 -6.364 10.731 -4.082 194 HD11 LEU 25 HD11 LEU 25 -5.806 10.091 -6.418 195 HD12 LEU 25 HD12 LEU 25 -7.448 10.512 -6.974 196 HD13 LEU 25 HD13 LEU 25 -7.198 9.097 -5.939 197 HD21 LEU 25 HD21 LEU 25 -5.608 12.500 -5.671 198 HD22 LEU 25 HD22 LEU 25 -6.670 13.165 -4.408 199 HD23 LEU 25 HD23 LEU 25 -7.313 12.887 -6.050 200 H LYS 26 H LYS 26 -6.671 8.301 -3.557 201 HA LYS 26 HA LYS 26 -7.880 6.527 -5.408 202 HB2 LYS 26 HB2 LYS 26 -5.369 6.718 -5.033 203 HB3 LYS 26 HB3 LYS 26 -5.568 5.844 -3.500 204 HG2 LYS 26 HG2 LYS 26 -4.941 4.131 -5.000 205 HG3 LYS 26 HG3 LYS 26 -6.696 3.936 -4.917 206 HD2 LYS 26 HD2 LYS 26 -6.954 5.081 -7.125 207 HD3 LYS 26 HD3 LYS 26 -5.235 5.556 -7.112 208 HE2 LYS 26 HE2 LYS 26 -5.532 3.703 -8.651 209 HE3 LYS 26 HE3 LYS 26 -4.522 3.177 -7.283 210 HZ1 LYS 26 HZ1 LYS 26 -6.228 1.498 -7.967 211 HZ2 LYS 26 HZ2 LYS 26 -7.494 2.620 -7.568 212 HZ3 LYS 26 HZ3 LYS 26 -6.434 1.983 -6.324 213 H CYS 27 H CYS 27 -7.268 6.187 -1.780 214 HA CYS 27 HA CYS 27 -8.343 3.636 -1.616 215 HB2 CYS 27 HB2 CYS 27 -7.234 4.566 0.360 216 HB3 CYS 27 HB3 CYS 27 -8.495 5.828 0.507 217 H LYS 28 H LYS 28 -10.052 6.871 -1.442 218 HA LYS 28 HA LYS 28 -12.589 5.749 -0.715 219 HB2 LYS 28 HB2 LYS 28 -11.860 8.352 -2.180 220 HB3 LYS 28 HB3 LYS 28 -13.549 7.844 -1.967 221 HG2 LYS 28 HG2 LYS 28 -12.929 9.420 -0.193 222 HG3 LYS 28 HG3 LYS 28 -13.369 7.823 0.470 223 HD2 LYS 28 HD2 LYS 28 -10.971 7.280 0.865 224 HD3 LYS 28 HD3 LYS 28 -10.486 8.769 0.002 225 HE2 LYS 28 HE2 LYS 28 -10.253 9.060 2.427 226 HE3 LYS 28 HE3 LYS 28 -11.473 10.184 1.777 227 HZ1 LYS 28 HZ1 LYS 28 -13.269 8.785 2.669 228 HZ2 LYS 28 HZ2 LYS 28 -12.133 9.093 3.927 229 HZ3 LYS 28 HZ3 LYS 28 -12.127 7.543 3.136 230 H ILE 29 H ILE 29 -11.022 6.336 -3.954 231 HA ILE 29 HA ILE 29 -13.388 5.569 -5.398 232 HB ILE 29 HB ILE 29 -10.445 5.628 -6.228 233 HG12 ILE 29 HG12 ILE 29 -12.778 7.433 -7.125 234 HG13 ILE 29 HG13 ILE 29 -11.810 7.817 -5.693 235 HG21 ILE 29 HG21 ILE 29 -12.914 5.029 -7.969 236 HG22 ILE 29 HG22 ILE 29 -11.270 5.327 -8.600 237 HG23 ILE 29 HG23 ILE 29 -11.581 3.895 -7.608 238 HD11 ILE 29 HD11 ILE 29 -10.697 7.618 -8.557 239 HD12 ILE 29 HD12 ILE 29 -10.925 9.087 -7.579 240 HD13 ILE 29 HD13 ILE 29 -9.712 7.875 -7.086 241 H THR 30 H THR 30 -10.344 3.647 -4.644 242 HA THR 30 HA THR 30 -11.735 1.255 -5.627 243 HB THR 30 HB THR 30 -9.305 1.697 -6.069 244 HG1 THR 30 HG1 THR 30 -9.973 -0.800 -4.842 245 HG21 THR 30 HG21 THR 30 -8.544 2.410 -3.744 246 HG22 THR 30 HG22 THR 30 -7.629 1.016 -4.351 247 HG23 THR 30 HG23 THR 30 -8.911 0.774 -3.146 248 H GLY 31 H GLY 31 -12.196 2.754 -2.617 249 HA2 GLY 31 HA2 GLY 31 -12.800 1.872 -0.541 250 HA3 GLY 31 HA3 GLY 31 -13.180 0.367 -1.419 251 H CYS 32 H CYS 32 -10.023 2.141 -1.126 252 HA CYS 32 HA CYS 32 -7.896 1.278 -0.630 253 HB2 CYS 32 HB2 CYS 32 -9.633 0.500 1.767 254 HB3 CYS 32 HB3 CYS 32 -7.920 0.011 1.675 Start of MODEL 14 1 H1 GLY 1 H1 GLY 1 13.012 -11.622 12.033 2 HA2 GLY 1 HA2 GLY 1 14.869 -10.606 10.705 3 HA3 GLY 1 HA3 GLY 1 13.836 -11.652 9.676 4 H ILE 2 H ILE 2 15.303 -9.569 8.454 5 HA ILE 2 HA ILE 2 13.566 -7.216 8.220 6 HB ILE 2 HB ILE 2 15.914 -8.129 6.469 7 HG12 ILE 2 HG12 ILE 2 15.715 -5.920 8.624 8 HG13 ILE 2 HG13 ILE 2 16.496 -7.502 8.848 9 HG21 ILE 2 HG21 ILE 2 15.783 -5.863 5.420 10 HG22 ILE 2 HG22 ILE 2 14.257 -6.717 5.179 11 HG23 ILE 2 HG23 ILE 2 14.371 -5.458 6.439 12 HD11 ILE 2 HD11 ILE 2 18.253 -5.893 8.415 13 HD12 ILE 2 HD12 ILE 2 18.123 -6.931 6.968 14 HD13 ILE 2 HD13 ILE 2 17.454 -5.269 6.957 15 H LEU 3 H LEU 3 14.400 -10.118 6.102 16 HA LEU 3 HA LEU 3 12.600 -9.362 4.105 17 HB2 LEU 3 HB2 LEU 3 12.726 -11.594 3.179 18 HB3 LEU 3 HB3 LEU 3 14.307 -11.078 3.791 19 HG LEU 3 HG LEU 3 13.580 -12.467 5.991 20 HD11 LEU 3 HD11 LEU 3 11.213 -13.026 5.130 21 HD12 LEU 3 HD12 LEU 3 12.193 -14.467 5.470 22 HD13 LEU 3 HD13 LEU 3 11.961 -13.917 3.788 23 HD21 LEU 3 HD21 LEU 3 15.550 -13.017 4.590 24 HD22 LEU 3 HD22 LEU 3 14.500 -13.813 3.380 25 HD23 LEU 3 HD23 LEU 3 14.672 -14.506 5.020 26 H SER 4 H SER 4 11.877 -11.154 7.207 27 HA SER 4 HA SER 4 9.282 -11.948 6.387 28 HB2 SER 4 HB2 SER 4 8.652 -12.142 8.724 29 HB3 SER 4 HB3 SER 4 10.308 -12.779 8.530 30 HG SER 4 HG SER 4 11.007 -10.699 9.466 31 H SER 5 H SER 5 10.469 -8.853 7.946 32 HA SER 5 HA SER 5 7.833 -7.718 8.094 33 HB2 SER 5 HB2 SER 5 10.542 -6.264 7.855 34 HB3 SER 5 HB3 SER 5 9.014 -5.552 8.440 35 HG SER 5 HG SER 5 9.177 -7.155 10.218 36 H PHE 6 H PHE 6 10.488 -7.615 5.567 37 HA PHE 6 HA PHE 6 9.180 -5.548 4.116 38 HB2 PHE 6 HB2 PHE 6 11.655 -6.211 3.910 39 HB3 PHE 6 HB3 PHE 6 11.143 -7.568 2.884 40 HD1 PHE 6 HD2 PHE 6 11.005 -3.836 3.319 41 HD2 PHE 6 HD1 PHE 6 10.551 -7.080 0.525 42 HE1 PHE 6 HE2 PHE 6 10.931 -2.216 1.452 43 HE2 PHE 6 HE1 PHE 6 10.511 -5.455 -1.344 44 HZ PHE 6 HZ PHE 6 10.693 -3.021 -0.886 45 H LYS 7 H LYS 7 9.309 -9.198 3.478 46 HA LYS 7 HA LYS 7 7.414 -8.972 1.366 47 HB2 LYS 7 HB2 LYS 7 7.099 -11.356 1.428 48 HB3 LYS 7 HB3 LYS 7 8.809 -10.989 1.745 49 HG2 LYS 7 HG2 LYS 7 8.408 -12.669 3.342 50 HG3 LYS 7 HG3 LYS 7 8.096 -11.219 4.313 51 HD2 LYS 7 HD2 LYS 7 5.566 -11.567 3.779 52 HD3 LYS 7 HD3 LYS 7 6.031 -13.083 2.984 53 HE2 LYS 7 HE2 LYS 7 7.026 -13.901 5.155 54 HE3 LYS 7 HE3 LYS 7 6.569 -12.364 5.940 55 HZ1 LYS 7 HZ1 LYS 7 4.627 -14.349 4.714 56 HZ2 LYS 7 HZ2 LYS 7 4.193 -12.847 5.488 57 HZ3 LYS 7 HZ3 LYS 7 4.927 -14.125 6.413 58 H GLY 8 H GLY 8 6.988 -9.190 4.994 59 HA2 GLY 8 HA2 GLY 8 4.232 -9.758 4.965 60 HA3 GLY 8 HA3 GLY 8 5.049 -8.795 6.222 61 H VAL 9 H VAL 9 5.967 -6.560 4.648 62 HA VAL 9 HA VAL 9 3.306 -5.216 4.386 63 HB VAL 9 HB VAL 9 6.131 -4.086 4.791 64 HG11 VAL 9 HG11 VAL 9 4.720 -2.492 3.482 65 HG12 VAL 9 HG12 VAL 9 3.403 -2.654 4.682 66 HG13 VAL 9 HG13 VAL 9 4.958 -1.904 5.147 67 HG21 VAL 9 HG21 VAL 9 5.221 -5.291 6.802 68 HG22 VAL 9 HG22 VAL 9 5.313 -3.532 7.070 69 HG23 VAL 9 HG23 VAL 9 3.738 -4.298 6.720 70 H ALA 10 H ALA 10 6.572 -5.147 2.691 71 HA ALA 10 HA ALA 10 5.564 -3.546 0.648 72 HB1 ALA 10 HB1 ALA 10 8.015 -3.841 1.111 73 HB2 ALA 10 HB2 ALA 10 7.925 -5.499 0.435 74 HB3 ALA 10 HB3 ALA 10 7.640 -4.084 -0.620 75 H LYS 11 H LYS 11 5.237 -7.137 0.911 76 HA LYS 11 HA LYS 11 5.327 -7.816 -1.727 77 HB2 LYS 11 HB2 LYS 11 3.729 -9.650 -1.353 78 HB3 LYS 11 HB3 LYS 11 4.890 -9.501 -0.018 79 HG2 LYS 11 HG2 LYS 11 3.054 -8.223 1.301 80 HG3 LYS 11 HG3 LYS 11 1.946 -8.564 -0.052 81 HD2 LYS 11 HD2 LYS 11 2.136 -10.992 0.300 82 HD3 LYS 11 HD3 LYS 11 3.428 -10.775 1.506 83 HE2 LYS 11 HE2 LYS 11 1.310 -11.286 2.628 84 HE3 LYS 11 HE3 LYS 11 1.870 -9.657 3.075 85 HZ1 LYS 11 HZ1 LYS 11 -0.239 -10.223 0.962 86 HZ2 LYS 11 HZ2 LYS 11 0.203 -8.651 1.598 87 HZ3 LYS 11 HZ3 LYS 11 -0.580 -9.803 2.615 88 H GLY 12 H GLY 12 2.519 -6.041 -0.198 89 HA2 GLY 12 HA2 GLY 12 1.251 -5.953 -2.943 90 HA3 GLY 12 HA3 GLY 12 0.424 -5.751 -1.388 91 H VAL 13 H VAL 13 3.626 -4.273 -2.356 92 HA VAL 13 HA VAL 13 2.664 -1.770 -1.363 93 HB VAL 13 HB VAL 13 5.083 -2.380 -1.318 94 HG11 VAL 13 HG11 VAL 13 6.541 -2.014 -3.264 95 HG12 VAL 13 HG12 VAL 13 5.363 -3.281 -3.677 96 HG13 VAL 13 HG13 VAL 13 5.150 -1.617 -4.302 97 HG21 VAL 13 HG21 VAL 13 4.315 -0.030 -0.942 98 HG22 VAL 13 HG22 VAL 13 5.906 -0.066 -1.748 99 HG23 VAL 13 HG23 VAL 13 4.435 0.281 -2.697 100 H ALA 14 H ALA 14 3.032 -3.104 -4.747 101 HA ALA 14 HA ALA 14 2.972 -0.792 -6.163 102 HB1 ALA 14 HB1 ALA 14 1.725 -2.000 -7.991 103 HB2 ALA 14 HB2 ALA 14 3.016 -3.013 -7.281 104 HB3 ALA 14 HB3 ALA 14 1.308 -3.303 -6.838 105 H LYS 15 H LYS 15 -0.029 -2.428 -4.866 106 HA LYS 15 HA LYS 15 -1.641 -0.165 -5.879 107 HB2 LYS 15 HB2 LYS 15 -2.298 -2.569 -6.054 108 HB3 LYS 15 HB3 LYS 15 -2.515 -2.642 -4.282 109 HG2 LYS 15 HG2 LYS 15 -4.227 -0.776 -4.458 110 HG3 LYS 15 HG3 LYS 15 -4.038 -0.782 -6.231 111 HD2 LYS 15 HD2 LYS 15 -5.094 -3.121 -4.508 112 HD3 LYS 15 HD3 LYS 15 -6.059 -2.036 -5.542 113 HE2 LYS 15 HE2 LYS 15 -4.706 -2.887 -7.562 114 HE3 LYS 15 HE3 LYS 15 -3.986 -4.117 -6.483 115 HZ1 LYS 15 HZ1 LYS 15 -6.937 -3.816 -7.085 116 HZ2 LYS 15 HZ2 LYS 15 -6.241 -4.974 -5.977 117 HZ3 LYS 15 HZ3 LYS 15 -5.875 -5.054 -7.678 118 H ASP 16 H ASP 16 -0.718 -1.630 -2.634 119 HA ASP 16 HA ASP 16 -2.303 0.072 -1.078 120 HB2 ASP 16 HB2 ASP 16 -1.035 -1.861 -0.124 121 HB3 ASP 16 HB3 ASP 16 0.504 -1.009 -0.421 122 H LEU 17 H LEU 17 0.993 0.724 -2.476 123 HA LEU 17 HA LEU 17 1.637 2.899 -0.964 124 HB2 LEU 17 HB2 LEU 17 2.617 1.951 -3.520 125 HB3 LEU 17 HB3 LEU 17 2.226 3.638 -3.807 126 HG LEU 17 HG LEU 17 4.076 2.596 -1.581 127 HD11 LEU 17 HD11 LEU 17 5.919 3.544 -2.968 128 HD12 LEU 17 HD12 LEU 17 4.751 4.066 -4.214 129 HD13 LEU 17 HD13 LEU 17 5.031 2.330 -3.920 130 HD21 LEU 17 HD21 LEU 17 4.729 5.041 -1.339 131 HD22 LEU 17 HD22 LEU 17 3.040 4.752 -0.877 132 HD23 LEU 17 HD23 LEU 17 3.413 5.470 -2.470 133 H ALA 18 H ALA 18 -0.369 2.953 -4.011 134 HA ALA 18 HA ALA 18 -1.015 5.736 -3.808 135 HB1 ALA 18 HB1 ALA 18 -2.639 3.449 -5.097 136 HB2 ALA 18 HB2 ALA 18 -2.941 5.198 -5.327 137 HB3 ALA 18 HB3 ALA 18 -1.416 4.467 -5.907 138 H GLY 19 H GLY 19 -2.755 2.714 -2.610 139 HA2 GLY 19 HA2 GLY 19 -4.983 3.950 -1.530 140 HA3 GLY 19 HA3 GLY 19 -4.196 2.541 -0.778 141 H LYS 20 H LYS 20 -1.595 4.110 -0.185 142 HA LYS 20 HA LYS 20 -2.702 5.303 2.313 143 HB2 LYS 20 HB2 LYS 20 0.135 4.474 1.534 144 HB3 LYS 20 HB3 LYS 20 -0.313 5.195 3.096 145 HG2 LYS 20 HG2 LYS 20 -1.563 2.595 2.010 146 HG3 LYS 20 HG3 LYS 20 -0.107 2.626 3.037 147 HD2 LYS 20 HD2 LYS 20 -1.334 3.739 4.870 148 HD3 LYS 20 HD3 LYS 20 -2.858 3.706 3.951 149 HE2 LYS 20 HE2 LYS 20 -1.296 1.169 4.708 150 HE3 LYS 20 HE3 LYS 20 -2.603 1.876 5.689 151 HZ1 LYS 20 HZ1 LYS 20 -2.941 0.847 2.853 152 HZ2 LYS 20 HZ2 LYS 20 -4.180 1.599 3.815 153 HZ3 LYS 20 HZ3 LYS 20 -3.479 0.087 4.307 154 H LEU 21 H LEU 21 -0.104 6.265 -0.153 155 HA LEU 21 HA LEU 21 -0.001 8.895 0.984 156 HB2 LEU 21 HB2 LEU 21 0.570 8.090 -1.929 157 HB3 LEU 21 HB3 LEU 21 0.965 9.668 -1.204 158 HG LEU 21 HG LEU 21 2.198 6.963 -0.417 159 HD11 LEU 21 HD11 LEU 21 3.449 9.424 -1.798 160 HD12 LEU 21 HD12 LEU 21 2.962 7.929 -2.641 161 HD13 LEU 21 HD13 LEU 21 4.276 7.883 -1.435 162 HD21 LEU 21 HD21 LEU 21 2.161 8.323 1.634 163 HD22 LEU 21 HD22 LEU 21 2.727 9.767 0.735 164 HD23 LEU 21 HD23 LEU 21 3.806 8.364 0.978 165 H LEU 22 H LEU 22 -2.032 7.463 -1.667 166 HA LEU 22 HA LEU 22 -3.499 10.090 -1.811 167 HB2 LEU 22 HB2 LEU 22 -3.695 7.675 -3.672 168 HB3 LEU 22 HB3 LEU 22 -4.312 9.314 -3.956 169 HG LEU 22 HG LEU 22 -1.345 8.457 -3.834 170 HD11 LEU 22 HD11 LEU 22 -3.067 9.406 -6.204 171 HD12 LEU 22 HD12 LEU 22 -2.558 7.720 -5.902 172 HD13 LEU 22 HD13 LEU 22 -1.336 8.965 -6.266 173 HD21 LEU 22 HD21 LEU 22 -2.567 11.241 -4.343 174 HD22 LEU 22 HD22 LEU 22 -0.854 10.811 -4.623 175 HD23 LEU 22 HD23 LEU 22 -1.510 10.780 -2.973 176 H GLU 23 H GLU 23 -3.850 8.572 0.631 177 HA GLU 23 HA GLU 23 -6.086 6.817 0.384 178 HB2 GLU 23 HB2 GLU 23 -4.716 7.010 2.473 179 HB3 GLU 23 HB3 GLU 23 -5.354 8.653 2.749 180 HG2 GLU 23 HG2 GLU 23 -7.694 7.694 2.926 181 HG3 GLU 23 HG3 GLU 23 -7.032 6.060 2.649 182 H THR 24 H THR 24 -5.840 10.411 0.938 183 HA THR 24 HA THR 24 -8.488 11.000 1.276 184 HB THR 24 HB THR 24 -6.677 12.702 1.293 185 HG1 THR 24 HG1 THR 24 -8.091 14.339 0.317 186 HG21 THR 24 HG21 THR 24 -6.888 12.658 -1.794 187 HG22 THR 24 HG22 THR 24 -5.496 12.003 -0.886 188 HG23 THR 24 HG23 THR 24 -5.870 13.746 -0.817 189 H LEU 25 H LEU 25 -7.098 9.887 -1.851 190 HA LEU 25 HA LEU 25 -9.871 10.122 -2.948 191 HB2 LEU 25 HB2 LEU 25 -9.117 10.986 -5.062 192 HB3 LEU 25 HB3 LEU 25 -8.605 12.008 -3.704 193 HG LEU 25 HG LEU 25 -6.289 10.697 -3.929 194 HD11 LEU 25 HD11 LEU 25 -5.737 10.008 -6.255 195 HD12 LEU 25 HD12 LEU 25 -7.370 10.452 -6.822 196 HD13 LEU 25 HD13 LEU 25 -7.149 9.052 -5.756 197 HD21 LEU 25 HD21 LEU 25 -7.156 12.846 -5.945 198 HD22 LEU 25 HD22 LEU 25 -5.467 12.417 -5.545 199 HD23 LEU 25 HD23 LEU 25 -6.519 13.132 -4.301 200 H LYS 26 H LYS 26 -6.704 8.243 -3.410 201 HA LYS 26 HA LYS 26 -7.926 6.460 -5.196 202 HB2 LYS 26 HB2 LYS 26 -5.497 6.413 -4.841 203 HB3 LYS 26 HB3 LYS 26 -5.697 5.913 -3.146 204 HG2 LYS 26 HG2 LYS 26 -5.040 3.990 -4.455 205 HG3 LYS 26 HG3 LYS 26 -6.692 3.723 -3.871 206 HD2 LYS 26 HD2 LYS 26 -7.631 4.237 -6.103 207 HD3 LYS 26 HD3 LYS 26 -6.039 4.801 -6.693 208 HE2 LYS 26 HE2 LYS 26 -5.110 2.490 -6.445 209 HE3 LYS 26 HE3 LYS 26 -6.678 1.916 -5.825 210 HZ1 LYS 26 HZ1 LYS 26 -6.432 1.401 -8.210 211 HZ2 LYS 26 HZ2 LYS 26 -6.181 3.081 -8.587 212 HZ3 LYS 26 HZ3 LYS 26 -7.727 2.541 -7.993 213 H CYS 27 H CYS 27 -7.529 6.063 -1.540 214 HA CYS 27 HA CYS 27 -9.006 3.677 -1.456 215 HB2 CYS 27 HB2 CYS 27 -8.657 5.860 0.671 216 HB3 CYS 27 HB3 CYS 27 -9.616 4.395 0.987 217 H LYS 28 H LYS 28 -10.248 7.093 -1.505 218 HA LYS 28 HA LYS 28 -12.947 6.257 -0.839 219 HB2 LYS 28 HB2 LYS 28 -11.873 8.756 -2.262 220 HB3 LYS 28 HB3 LYS 28 -13.610 8.429 -2.103 221 HG2 LYS 28 HG2 LYS 28 -12.843 9.941 -0.303 222 HG3 LYS 28 HG3 LYS 28 -13.520 8.418 0.332 223 HD2 LYS 28 HD2 LYS 28 -11.244 7.554 0.829 224 HD3 LYS 28 HD3 LYS 28 -10.515 8.952 -0.010 225 HE2 LYS 28 HE2 LYS 28 -10.352 9.223 2.423 226 HE3 LYS 28 HE3 LYS 28 -11.376 10.502 1.724 227 HZ1 LYS 28 HZ1 LYS 28 -12.272 9.518 3.841 228 HZ2 LYS 28 HZ2 LYS 28 -12.447 7.981 3.046 229 HZ3 LYS 28 HZ3 LYS 28 -13.386 9.367 2.535 230 H ILE 29 H ILE 29 -11.077 6.591 -3.953 231 HA ILE 29 HA ILE 29 -13.436 6.022 -5.537 232 HB ILE 29 HB ILE 29 -10.464 6.001 -6.244 233 HG12 ILE 29 HG12 ILE 29 -12.682 7.938 -7.139 234 HG13 ILE 29 HG13 ILE 29 -11.742 8.219 -5.663 235 HG21 ILE 29 HG21 ILE 29 -12.895 5.578 -8.089 236 HG22 ILE 29 HG22 ILE 29 -11.214 5.811 -8.646 237 HG23 ILE 29 HG23 ILE 29 -11.638 4.364 -7.719 238 HD11 ILE 29 HD11 ILE 29 -10.546 8.072 -8.498 239 HD12 ILE 29 HD12 ILE 29 -10.741 9.514 -7.474 240 HD13 ILE 29 HD13 ILE 29 -9.601 8.230 -6.987 241 H THR 30 H THR 30 -10.431 3.923 -5.005 242 HA THR 30 HA THR 30 -11.846 1.705 -6.093 243 HB THR 30 HB THR 30 -9.348 1.865 -6.040 244 HG1 THR 30 HG1 THR 30 -9.234 -0.485 -5.710 245 HG21 THR 30 HG21 THR 30 -9.632 0.900 -3.109 246 HG22 THR 30 HG22 THR 30 -9.014 2.504 -3.594 247 HG23 THR 30 HG23 THR 30 -8.114 1.029 -4.018 248 H GLY 31 H GLY 31 -11.619 2.910 -2.688 249 HA2 GLY 31 HA2 GLY 31 -12.914 2.125 -0.850 250 HA3 GLY 31 HA3 GLY 31 -13.569 0.831 -1.871 251 H CYS 32 H CYS 32 -10.418 2.006 -0.400 252 HA CYS 32 HA CYS 32 -9.195 -0.613 -0.880 253 HB2 CYS 32 HB2 CYS 32 -7.176 0.287 0.117 254 HB3 CYS 32 HB3 CYS 32 -7.857 1.543 -0.951 Start of MODEL 15 1 H1 GLY 1 H1 GLY 1 13.286 -11.292 12.111 2 HA2 GLY 1 HA2 GLY 1 15.149 -10.391 10.715 3 HA3 GLY 1 HA3 GLY 1 14.030 -11.385 9.726 4 H ILE 2 H ILE 2 15.489 -9.512 8.333 5 HA ILE 2 HA ILE 2 13.903 -7.021 8.155 6 HB ILE 2 HB ILE 2 16.188 -8.053 6.392 7 HG12 ILE 2 HG12 ILE 2 16.135 -5.923 8.635 8 HG13 ILE 2 HG13 ILE 2 16.867 -7.541 8.756 9 HG21 ILE 2 HG21 ILE 2 14.595 -6.521 5.192 10 HG22 ILE 2 HG22 ILE 2 14.837 -5.279 6.451 11 HG23 ILE 2 HG23 ILE 2 16.186 -5.778 5.386 12 HD11 ILE 2 HD11 ILE 2 18.668 -5.974 8.354 13 HD12 ILE 2 HD12 ILE 2 18.454 -6.915 6.850 14 HD13 ILE 2 HD13 ILE 2 17.844 -5.234 6.965 15 H LEU 3 H LEU 3 14.571 -9.971 6.042 16 HA LEU 3 HA LEU 3 12.714 -9.189 4.091 17 HB2 LEU 3 HB2 LEU 3 12.727 -11.454 3.227 18 HB3 LEU 3 HB3 LEU 3 14.349 -10.974 3.756 19 HG LEU 3 HG LEU 3 13.664 -12.270 6.028 20 HD11 LEU 3 HD11 LEU 3 11.250 -12.776 5.282 21 HD12 LEU 3 HD12 LEU 3 12.197 -14.238 5.624 22 HD13 LEU 3 HD13 LEU 3 11.912 -13.730 3.937 23 HD21 LEU 3 HD21 LEU 3 14.655 -14.372 5.086 24 HD22 LEU 3 HD22 LEU 3 15.562 -12.928 4.573 25 HD23 LEU 3 HD23 LEU 3 14.441 -13.728 3.432 26 H SER 4 H SER 4 12.087 -10.837 7.286 27 HA SER 4 HA SER 4 9.460 -11.634 6.678 28 HB2 SER 4 HB2 SER 4 8.928 -11.589 9.036 29 HB3 SER 4 HB3 SER 4 10.597 -12.199 8.873 30 HG SER 4 HG SER 4 11.241 -9.982 9.513 31 H SER 5 H SER 5 10.780 -8.379 7.671 32 HA SER 5 HA SER 5 8.173 -7.209 7.966 33 HB2 SER 5 HB2 SER 5 10.856 -5.818 7.358 34 HB3 SER 5 HB3 SER 5 9.320 -5.006 7.756 35 HG SER 5 HG SER 5 10.666 -6.811 9.538 36 H PHE 6 H PHE 6 10.615 -7.169 5.164 37 HA PHE 6 HA PHE 6 8.862 -5.591 3.602 38 HB2 PHE 6 HB2 PHE 6 11.021 -7.537 2.623 39 HB3 PHE 6 HB3 PHE 6 10.107 -6.452 1.554 40 HD1 PHE 6 HD2 PHE 6 9.963 -3.859 2.499 41 HD2 PHE 6 HD1 PHE 6 13.196 -6.636 3.121 42 HE1 PHE 6 HE2 PHE 6 11.484 -1.982 2.958 43 HE2 PHE 6 HE1 PHE 6 14.751 -4.731 3.407 44 HZ PHE 6 HZ PHE 6 13.891 -2.407 3.407 45 H LYS 7 H LYS 7 9.317 -9.282 3.421 46 HA LYS 7 HA LYS 7 7.238 -9.409 1.501 47 HB2 LYS 7 HB2 LYS 7 7.189 -11.763 1.676 48 HB3 LYS 7 HB3 LYS 7 8.864 -11.242 1.942 49 HG2 LYS 7 HG2 LYS 7 8.539 -12.954 3.509 50 HG3 LYS 7 HG3 LYS 7 8.369 -11.490 4.502 51 HD2 LYS 7 HD2 LYS 7 5.931 -11.761 4.599 52 HD3 LYS 7 HD3 LYS 7 5.930 -12.999 3.323 53 HE2 LYS 7 HE2 LYS 7 7.270 -13.368 6.072 54 HE3 LYS 7 HE3 LYS 7 5.585 -13.826 5.711 55 HZ1 LYS 7 HZ1 LYS 7 8.045 -15.047 4.414 56 HZ2 LYS 7 HZ2 LYS 7 6.395 -15.353 3.929 57 HZ3 LYS 7 HZ3 LYS 7 6.950 -15.781 5.516 58 H GLY 8 H GLY 8 7.057 -9.086 5.094 59 HA2 GLY 8 HA2 GLY 8 4.276 -9.784 5.248 60 HA3 GLY 8 HA3 GLY 8 5.148 -8.730 6.385 61 H VAL 9 H VAL 9 6.029 -6.705 4.400 62 HA VAL 9 HA VAL 9 3.368 -5.324 4.183 63 HB VAL 9 HB VAL 9 6.199 -4.236 4.668 64 HG11 VAL 9 HG11 VAL 9 5.062 -2.035 4.981 65 HG12 VAL 9 HG12 VAL 9 4.852 -2.624 3.312 66 HG13 VAL 9 HG13 VAL 9 3.503 -2.753 4.480 67 HG21 VAL 9 HG21 VAL 9 3.752 -4.409 6.526 68 HG22 VAL 9 HG22 VAL 9 5.218 -5.423 6.647 69 HG23 VAL 9 HG23 VAL 9 5.329 -3.666 6.917 70 H ALA 10 H ALA 10 6.668 -5.191 2.545 71 HA ALA 10 HA ALA 10 5.877 -3.767 0.368 72 HB1 ALA 10 HB1 ALA 10 7.846 -6.126 0.285 73 HB2 ALA 10 HB2 ALA 10 7.727 -4.815 -0.926 74 HB3 ALA 10 HB3 ALA 10 8.245 -4.441 0.741 75 H LYS 11 H LYS 11 5.402 -7.347 0.851 76 HA LYS 11 HA LYS 11 5.076 -8.230 -1.630 77 HB2 LYS 11 HB2 LYS 11 3.368 -9.859 -0.910 78 HB3 LYS 11 HB3 LYS 11 4.679 -9.701 0.267 79 HG2 LYS 11 HG2 LYS 11 3.265 -8.218 1.699 80 HG3 LYS 11 HG3 LYS 11 1.908 -8.332 0.566 81 HD2 LYS 11 HD2 LYS 11 3.010 -10.965 1.628 82 HD3 LYS 11 HD3 LYS 11 2.098 -9.928 2.746 83 HE2 LYS 11 HE2 LYS 11 0.627 -11.591 1.707 84 HE3 LYS 11 HE3 LYS 11 0.118 -9.934 1.305 85 HZ1 LYS 11 HZ1 LYS 11 -0.006 -11.514 -0.609 86 HZ2 LYS 11 HZ2 LYS 11 1.720 -11.727 -0.546 87 HZ3 LYS 11 HZ3 LYS 11 1.001 -10.169 -0.948 88 H GLY 12 H GLY 12 2.484 -6.105 -0.146 89 HA2 GLY 12 HA2 GLY 12 1.089 -6.242 -2.838 90 HA3 GLY 12 HA3 GLY 12 0.261 -6.178 -1.266 91 H VAL 13 H VAL 13 3.284 -4.402 -2.220 92 HA VAL 13 HA VAL 13 2.017 -1.974 -1.270 93 HB VAL 13 HB VAL 13 4.413 -2.505 -0.877 94 HG11 VAL 13 HG11 VAL 13 6.123 -1.955 -2.601 95 HG12 VAL 13 HG12 VAL 13 5.098 -3.268 -3.222 96 HG13 VAL 13 HG13 VAL 13 4.853 -1.598 -3.801 97 HG21 VAL 13 HG21 VAL 13 3.905 0.184 -2.235 98 HG22 VAL 13 HG22 VAL 13 3.480 -0.198 -0.543 99 HG23 VAL 13 HG23 VAL 13 5.190 -0.161 -1.051 100 H ALA 14 H ALA 14 2.804 -3.363 -4.551 101 HA ALA 14 HA ALA 14 2.804 -1.194 -6.122 102 HB1 ALA 14 HB1 ALA 14 1.061 -3.685 -6.654 103 HB2 ALA 14 HB2 ALA 14 1.552 -2.487 -7.890 104 HB3 ALA 14 HB3 ALA 14 2.787 -3.488 -7.074 105 H LYS 15 H LYS 15 -0.335 -2.609 -4.855 106 HA LYS 15 HA LYS 15 -1.766 -0.272 -5.985 107 HB2 LYS 15 HB2 LYS 15 -2.667 -2.593 -6.158 108 HB3 LYS 15 HB3 LYS 15 -2.842 -2.661 -4.384 109 HG2 LYS 15 HG2 LYS 15 -4.437 -0.718 -4.461 110 HG3 LYS 15 HG3 LYS 15 -4.215 -0.592 -6.229 111 HD2 LYS 15 HD2 LYS 15 -5.126 -2.932 -6.508 112 HD3 LYS 15 HD3 LYS 15 -5.394 -3.028 -4.745 113 HE2 LYS 15 HE2 LYS 15 -6.986 -1.086 -4.887 114 HE3 LYS 15 HE3 LYS 15 -6.690 -0.966 -6.643 115 HZ1 LYS 15 HZ1 LYS 15 -7.900 -3.366 -5.230 116 HZ2 LYS 15 HZ2 LYS 15 -7.607 -3.238 -6.945 117 HZ3 LYS 15 HZ3 LYS 15 -8.765 -2.192 -6.177 118 H ASP 16 H ASP 16 -1.130 -1.755 -2.677 119 HA ASP 16 HA ASP 16 -2.684 0.094 -1.269 120 HB2 ASP 16 HB2 ASP 16 -1.673 -1.960 -0.233 121 HB3 ASP 16 HB3 ASP 16 -0.058 -1.209 -0.339 122 H LEU 17 H LEU 17 0.624 0.568 -2.623 123 HA LEU 17 HA LEU 17 1.448 2.650 -1.009 124 HB2 LEU 17 HB2 LEU 17 2.469 1.633 -3.435 125 HB3 LEU 17 HB3 LEU 17 1.964 3.231 -3.950 126 HG LEU 17 HG LEU 17 3.837 2.631 -1.566 127 HD11 LEU 17 HD11 LEU 17 4.511 3.647 -4.398 128 HD12 LEU 17 HD12 LEU 17 4.889 2.020 -3.762 129 HD13 LEU 17 HD13 LEU 17 5.665 3.455 -3.046 130 HD21 LEU 17 HD21 LEU 17 2.624 4.788 -1.279 131 HD22 LEU 17 HD22 LEU 17 3.092 5.291 -2.930 132 HD23 LEU 17 HD23 LEU 17 4.336 5.094 -1.656 133 H ALA 18 H ALA 18 -0.567 2.849 -4.050 134 HA ALA 18 HA ALA 18 -1.146 5.641 -3.758 135 HB1 ALA 18 HB1 ALA 18 -3.086 5.186 -5.287 136 HB2 ALA 18 HB2 ALA 18 -1.573 4.453 -5.897 137 HB3 ALA 18 HB3 ALA 18 -2.809 3.425 -5.117 138 H GLY 19 H GLY 19 -2.924 2.608 -2.651 139 HA2 GLY 19 HA2 GLY 19 -5.120 3.811 -1.504 140 HA3 GLY 19 HA3 GLY 19 -4.319 2.390 -0.788 141 H LYS 20 H LYS 20 -1.721 4.016 -0.204 142 HA LYS 20 HA LYS 20 -2.833 5.196 2.308 143 HB2 LYS 20 HB2 LYS 20 -0.042 4.200 1.590 144 HB3 LYS 20 HB3 LYS 20 -0.463 4.977 3.131 145 HG2 LYS 20 HG2 LYS 20 -1.867 2.447 2.072 146 HG3 LYS 20 HG3 LYS 20 -0.427 2.395 3.120 147 HD2 LYS 20 HD2 LYS 20 -1.621 3.650 4.906 148 HD3 LYS 20 HD3 LYS 20 -3.130 3.645 3.962 149 HE2 LYS 20 HE2 LYS 20 -1.680 1.087 4.858 150 HE3 LYS 20 HE3 LYS 20 -2.993 1.877 5.765 151 HZ1 LYS 20 HZ1 LYS 20 -3.267 0.728 2.971 152 HZ2 LYS 20 HZ2 LYS 20 -4.513 1.571 3.841 153 HZ3 LYS 20 HZ3 LYS 20 -3.888 0.060 4.434 154 H LEU 21 H LEU 21 -0.066 6.068 -0.020 155 HA LEU 21 HA LEU 21 -0.011 8.709 1.090 156 HB2 LEU 21 HB2 LEU 21 0.761 7.829 -1.754 157 HB3 LEU 21 HB3 LEU 21 1.073 9.446 -1.077 158 HG LEU 21 HG LEU 21 2.302 6.820 -0.049 159 HD11 LEU 21 HD11 LEU 21 4.422 7.711 -1.007 160 HD12 LEU 21 HD12 LEU 21 3.600 9.217 -1.503 161 HD13 LEU 21 HD13 LEU 21 3.185 7.674 -2.291 162 HD21 LEU 21 HD21 LEU 21 3.800 8.353 1.330 163 HD22 LEU 21 HD22 LEU 21 2.123 8.310 1.897 164 HD23 LEU 21 HD23 LEU 21 2.703 9.706 0.937 165 H LEU 22 H LEU 22 -1.891 7.279 -1.672 166 HA LEU 22 HA LEU 22 -3.355 9.905 -1.874 167 HB2 LEU 22 HB2 LEU 22 -3.455 7.498 -3.752 168 HB3 LEU 22 HB3 LEU 22 -4.092 9.126 -4.051 169 HG LEU 22 HG LEU 22 -1.116 8.321 -3.815 170 HD11 LEU 22 HD11 LEU 22 -2.765 9.237 -6.251 171 HD12 LEU 22 HD12 LEU 22 -2.229 7.562 -5.930 172 HD13 LEU 22 HD13 LEU 22 -1.023 8.835 -6.248 173 HD21 LEU 22 HD21 LEU 22 -1.352 10.639 -2.964 174 HD22 LEU 22 HD22 LEU 22 -2.368 11.085 -4.371 175 HD23 LEU 22 HD23 LEU 22 -0.639 10.684 -4.590 176 H GLU 23 H GLU 23 -3.821 8.500 0.552 177 HA GLU 23 HA GLU 23 -6.067 6.726 0.235 178 HB2 GLU 23 HB2 GLU 23 -4.751 6.866 2.358 179 HB3 GLU 23 HB3 GLU 23 -5.343 8.522 2.637 180 HG2 GLU 23 HG2 GLU 23 -7.714 7.642 2.742 181 HG3 GLU 23 HG3 GLU 23 -7.099 5.991 2.465 182 H THR 24 H THR 24 -5.728 10.303 0.897 183 HA THR 24 HA THR 24 -8.349 10.976 1.166 184 HB THR 24 HB THR 24 -6.479 12.637 1.265 185 HG1 THR 24 HG1 THR 24 -8.687 13.444 0.904 186 HG21 THR 24 HG21 THR 24 -6.561 12.610 -1.821 187 HG22 THR 24 HG22 THR 24 -5.229 11.925 -0.849 188 HG23 THR 24 HG23 THR 24 -5.578 13.674 -0.788 189 H LEU 25 H LEU 25 -6.929 9.899 -1.950 190 HA LEU 25 HA LEU 25 -9.656 10.306 -3.124 191 HB2 LEU 25 HB2 LEU 25 -8.777 11.130 -5.195 192 HB3 LEU 25 HB3 LEU 25 -8.229 12.102 -3.815 193 HG LEU 25 HG LEU 25 -6.004 10.631 -3.989 194 HD11 LEU 25 HD11 LEU 25 -6.925 9.062 -5.853 195 HD12 LEU 25 HD12 LEU 25 -5.442 9.926 -6.312 196 HD13 LEU 25 HD13 LEU 25 -7.028 10.480 -6.913 197 HD21 LEU 25 HD21 LEU 25 -6.050 13.072 -4.334 198 HD22 LEU 25 HD22 LEU 25 -6.662 12.849 -5.999 199 HD23 LEU 25 HD23 LEU 25 -5.017 12.297 -5.559 200 H LYS 26 H LYS 26 -6.614 8.209 -3.462 201 HA LYS 26 HA LYS 26 -7.896 6.561 -5.353 202 HB2 LYS 26 HB2 LYS 26 -5.425 6.469 -4.776 203 HB3 LYS 26 HB3 LYS 26 -5.839 5.651 -3.256 204 HG2 LYS 26 HG2 LYS 26 -5.233 3.883 -4.711 205 HG3 LYS 26 HG3 LYS 26 -7.006 3.822 -4.702 206 HD2 LYS 26 HD2 LYS 26 -7.078 4.954 -6.938 207 HD3 LYS 26 HD3 LYS 26 -5.328 5.283 -6.855 208 HE2 LYS 26 HE2 LYS 26 -5.673 3.447 -8.381 209 HE3 LYS 26 HE3 LYS 26 -4.839 2.822 -6.937 210 HZ1 LYS 26 HZ1 LYS 26 -7.812 2.599 -7.496 211 HZ2 LYS 26 HZ2 LYS 26 -6.969 1.868 -6.137 212 HZ3 LYS 26 HZ3 LYS 26 -6.650 1.338 -7.754 213 H CYS 27 H CYS 27 -7.621 6.130 -1.693 214 HA CYS 27 HA CYS 27 -9.211 3.790 -1.678 215 HB2 CYS 27 HB2 CYS 27 -8.759 5.910 0.501 216 HB3 CYS 27 HB3 CYS 27 -9.785 4.484 0.775 217 H LYS 28 H LYS 28 -10.228 7.279 -1.698 218 HA LYS 28 HA LYS 28 -12.981 6.617 -1.053 219 HB2 LYS 28 HB2 LYS 28 -11.726 9.044 -2.450 220 HB3 LYS 28 HB3 LYS 28 -13.484 8.832 -2.325 221 HG2 LYS 28 HG2 LYS 28 -12.637 10.280 -0.502 222 HG3 LYS 28 HG3 LYS 28 -13.453 8.813 0.103 223 HD2 LYS 28 HD2 LYS 28 -11.273 7.759 0.655 224 HD3 LYS 28 HD3 LYS 28 -10.405 9.095 -0.149 225 HE2 LYS 28 HE2 LYS 28 -10.292 9.340 2.288 226 HE3 LYS 28 HE3 LYS 28 -11.186 10.704 1.571 227 HZ1 LYS 28 HZ1 LYS 28 -12.498 8.273 2.841 228 HZ2 LYS 28 HZ2 LYS 28 -13.304 9.735 2.315 229 HZ3 LYS 28 HZ3 LYS 28 -12.220 9.786 3.653 230 H ILE 29 H ILE 29 -11.061 6.796 -4.149 231 HA ILE 29 HA ILE 29 -13.432 6.389 -5.758 232 HB ILE 29 HB ILE 29 -10.463 6.102 -6.414 233 HG12 ILE 29 HG12 ILE 29 -12.500 8.192 -7.399 234 HG13 ILE 29 HG13 ILE 29 -11.576 8.429 -5.905 235 HG21 ILE 29 HG21 ILE 29 -11.189 5.924 -8.825 236 HG22 ILE 29 HG22 ILE 29 -11.739 4.534 -7.875 237 HG23 ILE 29 HG23 ILE 29 -12.892 5.834 -8.291 238 HD11 ILE 29 HD11 ILE 29 -10.327 8.121 -8.705 239 HD12 ILE 29 HD12 ILE 29 -10.433 9.600 -7.720 240 HD13 ILE 29 HD13 ILE 29 -9.410 8.244 -7.173 241 H THR 30 H THR 30 -10.635 4.045 -5.136 242 HA THR 30 HA THR 30 -12.252 1.934 -6.193 243 HB THR 30 HB THR 30 -9.767 1.878 -6.209 244 HG1 THR 30 HG1 THR 30 -11.027 -0.423 -5.068 245 HG21 THR 30 HG21 THR 30 -9.999 1.057 -3.235 246 HG22 THR 30 HG22 THR 30 -9.236 2.558 -3.829 247 HG23 THR 30 HG23 THR 30 -8.531 0.974 -4.237 248 H GLY 31 H GLY 31 -11.873 3.171 -2.817 249 HA2 GLY 31 HA2 GLY 31 -13.195 2.518 -0.945 250 HA3 GLY 31 HA3 GLY 31 -13.966 1.265 -1.935 251 H CYS 32 H CYS 32 -10.702 2.213 -0.551 252 HA CYS 32 HA CYS 32 -9.687 -0.486 -1.020 253 HB2 CYS 32 HB2 CYS 32 -7.601 0.257 -0.040 254 HB3 CYS 32 HB3 CYS 32 -8.194 1.554 -1.113 Start of MODEL 16 1 H1 GLY 1 H1 GLY 1 12.526 -10.769 12.481 2 HA2 GLY 1 HA2 GLY 1 14.362 -10.467 10.827 3 HA3 GLY 1 HA3 GLY 1 12.969 -11.311 10.080 4 H ILE 2 H ILE 2 14.772 -9.835 8.460 5 HA ILE 2 HA ILE 2 13.506 -7.180 8.020 6 HB ILE 2 HB ILE 2 15.908 -8.534 6.686 7 HG12 ILE 2 HG12 ILE 2 15.692 -6.205 8.713 8 HG13 ILE 2 HG13 ILE 2 16.234 -7.861 9.083 9 HG21 ILE 2 HG21 ILE 2 16.257 -6.336 5.538 10 HG22 ILE 2 HG22 ILE 2 14.698 -7.042 5.103 11 HG23 ILE 2 HG23 ILE 2 14.760 -5.703 6.290 12 HD11 ILE 2 HD11 ILE 2 17.706 -5.816 7.310 13 HD12 ILE 2 HD12 ILE 2 18.217 -6.481 8.875 14 HD13 ILE 2 HD13 ILE 2 18.168 -7.543 7.439 15 H LEU 3 H LEU 3 14.152 -10.239 6.033 16 HA LEU 3 HA LEU 3 12.339 -9.435 3.994 17 HB2 LEU 3 HB2 LEU 3 13.145 -12.220 4.999 18 HB3 LEU 3 HB3 LEU 3 11.986 -12.036 3.669 19 HG LEU 3 HG LEU 3 14.772 -10.758 3.522 20 HD11 LEU 3 HD11 LEU 3 15.470 -12.761 2.156 21 HD12 LEU 3 HD12 LEU 3 13.914 -13.555 2.536 22 HD13 LEU 3 HD13 LEU 3 15.092 -13.213 3.837 23 HD21 LEU 3 HD21 LEU 3 14.326 -10.836 1.038 24 HD22 LEU 3 HD22 LEU 3 13.073 -9.877 1.849 25 HD23 LEU 3 HD23 LEU 3 12.720 -11.550 1.342 26 H SER 4 H SER 4 11.746 -11.312 7.098 27 HA SER 4 HA SER 4 9.091 -11.929 6.638 28 HB2 SER 4 HB2 SER 4 8.672 -11.771 9.066 29 HB3 SER 4 HB3 SER 4 10.273 -12.524 8.774 30 HG SER 4 HG SER 4 10.341 -10.756 10.392 31 H SER 5 H SER 5 10.498 -8.747 7.767 32 HA SER 5 HA SER 5 7.938 -7.496 8.066 33 HB2 SER 5 HB2 SER 5 10.670 -6.173 7.539 34 HB3 SER 5 HB3 SER 5 9.159 -5.322 7.951 35 HG SER 5 HG SER 5 10.421 -7.241 9.675 36 H PHE 6 H PHE 6 10.380 -7.371 5.267 37 HA PHE 6 HA PHE 6 8.665 -5.669 3.792 38 HB2 PHE 6 HB2 PHE 6 10.803 -7.600 2.725 39 HB3 PHE 6 HB3 PHE 6 9.914 -6.450 1.703 40 HD1 PHE 6 HD1 PHE 6 9.794 -3.918 2.689 41 HD2 PHE 6 HD2 PHE 6 12.957 -6.751 3.399 42 HE1 PHE 6 HE1 PHE 6 11.313 -2.070 3.278 43 HE2 PHE 6 HE2 PHE 6 14.525 -4.870 3.802 44 HZ PHE 6 HZ PHE 6 13.690 -2.538 3.833 45 H LYS 7 H LYS 7 9.064 -9.341 3.383 46 HA LYS 7 HA LYS 7 7.037 -9.380 1.431 47 HB2 LYS 7 HB2 LYS 7 6.869 -11.752 1.635 48 HB3 LYS 7 HB3 LYS 7 8.561 -11.280 1.896 49 HG2 LYS 7 HG2 LYS 7 8.247 -12.910 3.542 50 HG3 LYS 7 HG3 LYS 7 7.956 -11.429 4.483 51 HD2 LYS 7 HD2 LYS 7 5.444 -11.816 4.184 52 HD3 LYS 7 HD3 LYS 7 5.794 -13.284 3.253 53 HE2 LYS 7 HE2 LYS 7 6.595 -12.822 6.196 54 HE3 LYS 7 HE3 LYS 7 5.136 -13.687 5.653 55 HZ1 LYS 7 HZ1 LYS 7 6.610 -15.324 4.462 56 HZ2 LYS 7 HZ2 LYS 7 6.814 -15.314 6.192 57 HZ3 LYS 7 HZ3 LYS 7 8.006 -14.577 5.201 58 H GLY 8 H GLY 8 6.766 -9.273 5.063 59 HA2 GLY 8 HA2 GLY 8 3.979 -9.837 5.138 60 HA3 GLY 8 HA3 GLY 8 4.853 -8.837 6.323 61 H VAL 9 H VAL 9 5.800 -6.711 4.590 62 HA VAL 9 HA VAL 9 3.165 -5.305 4.353 63 HB VAL 9 HB VAL 9 6.014 -4.244 4.776 64 HG11 VAL 9 HG11 VAL 9 4.652 -2.611 3.455 65 HG12 VAL 9 HG12 VAL 9 3.323 -2.742 4.644 66 HG13 VAL 9 HG13 VAL 9 4.893 -2.033 5.121 67 HG21 VAL 9 HG21 VAL 9 3.607 -4.398 6.686 68 HG22 VAL 9 HG22 VAL 9 5.066 -5.425 6.776 69 HG23 VAL 9 HG23 VAL 9 5.198 -3.668 7.044 70 H ALA 10 H ALA 10 6.430 -5.219 2.650 71 HA ALA 10 HA ALA 10 5.379 -3.658 0.579 72 HB1 ALA 10 HB1 ALA 10 7.828 -3.850 1.025 73 HB2 ALA 10 HB2 ALA 10 7.806 -5.546 0.451 74 HB3 ALA 10 HB3 ALA 10 7.471 -4.208 -0.688 75 H LYS 11 H LYS 11 5.057 -7.230 0.939 76 HA LYS 11 HA LYS 11 5.114 -8.024 -1.659 77 HB2 LYS 11 HB2 LYS 11 3.377 -9.728 -1.228 78 HB3 LYS 11 HB3 LYS 11 4.552 -9.626 0.100 79 HG2 LYS 11 HG2 LYS 11 2.870 -8.241 1.431 80 HG3 LYS 11 HG3 LYS 11 1.708 -8.399 0.088 81 HD2 LYS 11 HD2 LYS 11 1.630 -10.848 0.331 82 HD3 LYS 11 HD3 LYS 11 2.865 -10.809 1.614 83 HE2 LYS 11 HE2 LYS 11 1.348 -9.455 3.071 84 HE3 LYS 11 HE3 LYS 11 0.108 -9.440 1.787 85 HZ1 LYS 11 HZ1 LYS 11 -0.362 -11.164 3.482 86 HZ2 LYS 11 HZ2 LYS 11 1.174 -11.923 3.181 87 HZ3 LYS 11 HZ3 LYS 11 -0.051 -11.901 1.936 88 H GLY 12 H GLY 12 2.401 -6.027 -0.237 89 HA2 GLY 12 HA2 GLY 12 1.155 -6.003 -2.997 90 HA3 GLY 12 HA3 GLY 12 0.299 -5.781 -1.458 91 H VAL 13 H VAL 13 3.532 -4.356 -2.385 92 HA VAL 13 HA VAL 13 2.613 -1.817 -1.465 93 HB VAL 13 HB VAL 13 5.035 -2.485 -1.469 94 HG11 VAL 13 HG11 VAL 13 5.004 -1.762 -4.466 95 HG12 VAL 13 HG12 VAL 13 6.432 -2.159 -3.475 96 HG13 VAL 13 HG13 VAL 13 5.221 -3.418 -3.821 97 HG21 VAL 13 HG21 VAL 13 4.319 -0.114 -1.101 98 HG22 VAL 13 HG22 VAL 13 5.887 -0.192 -1.947 99 HG23 VAL 13 HG23 VAL 13 4.402 0.176 -2.862 100 H ALA 14 H ALA 14 2.827 -3.296 -4.794 101 HA ALA 14 HA ALA 14 2.727 -1.052 -6.319 102 HB1 ALA 14 HB1 ALA 14 1.378 -2.329 -8.022 103 HB2 ALA 14 HB2 ALA 14 2.702 -3.314 -7.334 104 HB3 ALA 14 HB3 ALA 14 1.020 -3.578 -6.792 105 H LYS 15 H LYS 15 -0.275 -2.615 -4.883 106 HA LYS 15 HA LYS 15 -1.871 -0.347 -5.866 107 HB2 LYS 15 HB2 LYS 15 -2.704 -2.748 -5.749 108 HB3 LYS 15 HB3 LYS 15 -2.717 -2.614 -3.971 109 HG2 LYS 15 HG2 LYS 15 -4.308 -0.606 -4.221 110 HG3 LYS 15 HG3 LYS 15 -4.315 -0.904 -5.979 111 HD2 LYS 15 HD2 LYS 15 -5.187 -3.301 -5.464 112 HD3 LYS 15 HD3 LYS 15 -5.262 -2.812 -3.751 113 HE2 LYS 15 HE2 LYS 15 -7.499 -2.520 -4.526 114 HE3 LYS 15 HE3 LYS 15 -6.821 -0.875 -4.534 115 HZ1 LYS 15 HZ1 LYS 15 -8.095 -1.301 -6.578 116 HZ2 LYS 15 HZ2 LYS 15 -7.172 -2.734 -6.920 117 HZ3 LYS 15 HZ3 LYS 15 -6.426 -1.174 -7.027 118 H ASP 16 H ASP 16 -0.783 -1.682 -2.621 119 HA ASP 16 HA ASP 16 -2.280 0.102 -1.086 120 HB2 ASP 16 HB2 ASP 16 -1.043 -1.883 -0.150 121 HB3 ASP 16 HB3 ASP 16 0.502 -1.025 -0.401 122 H LEU 17 H LEU 17 0.969 0.663 -2.605 123 HA LEU 17 HA LEU 17 1.729 2.816 -1.096 124 HB2 LEU 17 HB2 LEU 17 2.656 1.821 -3.622 125 HB3 LEU 17 HB3 LEU 17 2.217 3.481 -3.992 126 HG LEU 17 HG LEU 17 4.144 2.581 -1.762 127 HD11 LEU 17 HD11 LEU 17 4.725 3.941 -4.473 128 HD12 LEU 17 HD12 LEU 17 5.055 2.229 -4.098 129 HD13 LEU 17 HD13 LEU 17 5.933 3.511 -3.228 130 HD21 LEU 17 HD21 LEU 17 3.402 5.402 -2.758 131 HD22 LEU 17 HD22 LEU 17 4.743 5.044 -1.629 132 HD23 LEU 17 HD23 LEU 17 3.065 4.739 -1.132 133 H ALA 18 H ALA 18 -0.369 2.905 -4.080 134 HA ALA 18 HA ALA 18 -0.995 5.696 -3.825 135 HB1 ALA 18 HB1 ALA 18 -2.641 3.429 -5.124 136 HB2 ALA 18 HB2 ALA 18 -2.950 5.182 -5.318 137 HB3 ALA 18 HB3 ALA 18 -1.435 4.464 -5.942 138 H GLY 19 H GLY 19 -2.685 2.643 -2.640 139 HA2 GLY 19 HA2 GLY 19 -4.912 3.820 -1.518 140 HA3 GLY 19 HA3 GLY 19 -4.081 2.429 -0.777 141 H LYS 20 H LYS 20 -1.509 4.083 -0.224 142 HA LYS 20 HA LYS 20 -2.615 5.301 2.271 143 HB2 LYS 20 HB2 LYS 20 0.234 4.487 1.520 144 HB3 LYS 20 HB3 LYS 20 -0.262 5.205 3.070 145 HG2 LYS 20 HG2 LYS 20 -1.298 2.515 1.953 146 HG3 LYS 20 HG3 LYS 20 0.006 2.707 3.154 147 HD2 LYS 20 HD2 LYS 20 -1.683 3.884 4.692 148 HD3 LYS 20 HD3 LYS 20 -2.973 3.415 3.546 149 HE2 LYS 20 HE2 LYS 20 -2.393 1.007 3.846 150 HE3 LYS 20 HE3 LYS 20 -1.115 1.453 5.009 151 HZ1 LYS 20 HZ1 LYS 20 -4.084 2.017 5.335 152 HZ2 LYS 20 HZ2 LYS 20 -2.837 2.467 6.471 153 HZ3 LYS 20 HZ3 LYS 20 -3.175 0.789 6.165 154 H LEU 21 H LEU 21 -0.008 6.213 -0.210 155 HA LEU 21 HA LEU 21 0.080 8.865 0.874 156 HB2 LEU 21 HB2 LEU 21 0.673 8.002 -2.020 157 HB3 LEU 21 HB3 LEU 21 1.053 9.599 -1.325 158 HG LEU 21 HG LEU 21 2.299 6.918 -0.475 159 HD11 LEU 21 HD11 LEU 21 4.373 7.821 -1.509 160 HD12 LEU 21 HD12 LEU 21 3.548 9.358 -1.893 161 HD13 LEU 21 HD13 LEU 21 3.063 7.855 -2.720 162 HD21 LEU 21 HD21 LEU 21 2.244 8.322 1.546 163 HD22 LEU 21 HD22 LEU 21 2.805 9.750 0.619 164 HD23 LEU 21 HD23 LEU 21 3.892 8.359 0.895 165 H LEU 22 H LEU 22 -1.892 7.382 -1.794 166 HA LEU 22 HA LEU 22 -3.416 9.975 -1.968 167 HB2 LEU 22 HB2 LEU 22 -3.496 7.539 -3.814 168 HB3 LEU 22 HB3 LEU 22 -4.191 9.144 -4.121 169 HG LEU 22 HG LEU 22 -1.190 8.417 -3.958 170 HD11 LEU 22 HD11 LEU 22 -2.348 7.623 -6.038 171 HD12 LEU 22 HD12 LEU 22 -1.174 8.916 -6.394 172 HD13 LEU 22 HD13 LEU 22 -2.922 9.286 -6.352 173 HD21 LEU 22 HD21 LEU 22 -2.518 11.149 -4.490 174 HD22 LEU 22 HD22 LEU 22 -0.787 10.788 -4.758 175 HD23 LEU 22 HD23 LEU 22 -1.451 10.735 -3.112 176 H GLU 23 H GLU 23 -3.787 8.560 0.479 177 HA GLU 23 HA GLU 23 -5.980 6.720 0.223 178 HB2 GLU 23 HB2 GLU 23 -4.621 6.929 2.316 179 HB3 GLU 23 HB3 GLU 23 -5.277 8.565 2.591 180 HG2 GLU 23 HG2 GLU 23 -7.607 7.581 2.739 181 HG3 GLU 23 HG3 GLU 23 -6.918 5.953 2.477 182 H THR 24 H THR 24 -5.768 10.316 0.828 183 HA THR 24 HA THR 24 -8.422 10.865 1.169 184 HB THR 24 HB THR 24 -6.627 12.583 1.248 185 HG1 THR 24 HG1 THR 24 -8.059 14.237 0.328 186 HG21 THR 24 HG21 THR 24 -5.439 11.969 -0.954 187 HG22 THR 24 HG22 THR 24 -5.830 13.705 -0.825 188 HG23 THR 24 HG23 THR 24 -6.836 12.642 -1.841 189 H LEU 25 H LEU 25 -7.013 9.844 -1.970 190 HA LEU 25 HA LEU 25 -9.774 10.131 -3.096 191 HB2 LEU 25 HB2 LEU 25 -8.959 10.981 -5.191 192 HB3 LEU 25 HB3 LEU 25 -8.428 11.979 -3.824 193 HG LEU 25 HG LEU 25 -6.154 10.576 -4.033 194 HD11 LEU 25 HD11 LEU 25 -7.220 10.397 -6.934 195 HD12 LEU 25 HD12 LEU 25 -7.056 8.982 -5.877 196 HD13 LEU 25 HD13 LEU 25 -5.608 9.891 -6.360 197 HD21 LEU 25 HD21 LEU 25 -5.251 12.278 -5.619 198 HD22 LEU 25 HD22 LEU 25 -6.285 13.020 -4.374 199 HD23 LEU 25 HD23 LEU 25 -6.919 12.780 -6.028 200 H LYS 26 H LYS 26 -6.657 8.163 -3.484 201 HA LYS 26 HA LYS 26 -7.898 6.445 -5.336 202 HB2 LYS 26 HB2 LYS 26 -5.420 6.454 -4.805 203 HB3 LYS 26 HB3 LYS 26 -5.767 5.654 -3.259 204 HG2 LYS 26 HG2 LYS 26 -5.104 3.890 -4.689 205 HG3 LYS 26 HG3 LYS 26 -6.873 3.741 -4.638 206 HD2 LYS 26 HD2 LYS 26 -7.045 4.822 -6.896 207 HD3 LYS 26 HD3 LYS 26 -5.310 5.234 -6.857 208 HE2 LYS 26 HE2 LYS 26 -5.601 3.350 -8.337 209 HE3 LYS 26 HE3 LYS 26 -4.709 2.797 -6.900 210 HZ1 LYS 26 HZ1 LYS 26 -6.769 1.752 -6.035 211 HZ2 LYS 26 HZ2 LYS 26 -6.470 1.220 -7.655 212 HZ3 LYS 26 HZ3 LYS 26 -7.683 2.426 -7.376 213 H CYS 27 H CYS 27 -7.535 6.034 -1.682 214 HA CYS 27 HA CYS 27 -9.037 3.648 -1.615 215 HB2 CYS 27 HB2 CYS 27 -8.623 5.802 0.533 216 HB3 CYS 27 HB3 CYS 27 -9.603 4.350 0.840 217 H LYS 28 H LYS 28 -10.206 7.086 -1.680 218 HA LYS 28 HA LYS 28 -12.911 6.304 -0.950 219 HB2 LYS 28 HB2 LYS 28 -11.802 8.789 -2.365 220 HB3 LYS 28 HB3 LYS 28 -13.545 8.501 -2.182 221 HG2 LYS 28 HG2 LYS 28 -12.699 9.969 -0.374 222 HG3 LYS 28 HG3 LYS 28 -13.422 8.462 0.249 223 HD2 LYS 28 HD2 LYS 28 -11.173 7.504 0.703 224 HD3 LYS 28 HD3 LYS 28 -10.404 8.889 -0.119 225 HE2 LYS 28 HE2 LYS 28 -10.197 9.120 2.309 226 HE3 LYS 28 HE3 LYS 28 -11.202 10.438 1.654 227 HZ1 LYS 28 HZ1 LYS 28 -12.086 9.441 3.765 228 HZ2 LYS 28 HZ2 LYS 28 -12.308 7.918 2.949 229 HZ3 LYS 28 HZ3 LYS 28 -13.224 9.333 2.479 230 H ILE 29 H ILE 29 -11.080 6.577 -4.094 231 HA ILE 29 HA ILE 29 -13.470 6.083 -5.647 232 HB ILE 29 HB ILE 29 -10.508 5.891 -6.369 233 HG12 ILE 29 HG12 ILE 29 -12.635 7.908 -7.310 234 HG13 ILE 29 HG13 ILE 29 -11.677 8.182 -5.844 235 HG21 ILE 29 HG21 ILE 29 -12.968 5.536 -8.192 236 HG22 ILE 29 HG22 ILE 29 -11.280 5.674 -8.763 237 HG23 ILE 29 HG23 ILE 29 -11.768 4.273 -7.795 238 HD11 ILE 29 HD11 ILE 29 -10.497 7.901 -8.676 239 HD12 ILE 29 HD12 ILE 29 -10.622 9.379 -7.692 240 HD13 ILE 29 HD13 ILE 29 -9.542 8.058 -7.171 241 H THR 30 H THR 30 -10.580 3.846 -5.089 242 HA THR 30 HA THR 30 -12.130 1.667 -6.084 243 HB THR 30 HB THR 30 -9.635 1.668 -6.122 244 HG1 THR 30 HG1 THR 30 -10.807 -0.395 -6.253 245 HG21 THR 30 HG21 THR 30 -9.814 0.950 -3.123 246 HG22 THR 30 HG22 THR 30 -9.162 2.488 -3.752 247 HG23 THR 30 HG23 THR 30 -8.347 0.959 -4.123 248 H GLY 31 H GLY 31 -11.752 2.942 -2.722 249 HA2 GLY 31 HA2 GLY 31 -13.005 2.246 -0.820 250 HA3 GLY 31 HA3 GLY 31 -13.747 0.959 -1.788 251 H CYS 32 H CYS 32 -10.492 2.035 -0.471 252 HA CYS 32 HA CYS 32 -9.389 -0.625 -0.958 253 HB2 CYS 32 HB2 CYS 32 -7.311 0.187 -0.014 254 HB3 CYS 32 HB3 CYS 32 -7.967 1.462 -1.076 Start of MODEL 17 1 H1 GLY 1 H1 GLY 1 12.739 -11.090 12.117 2 HA2 GLY 1 HA2 GLY 1 14.606 -10.151 10.746 3 HA3 GLY 1 HA3 GLY 1 13.581 -11.256 9.773 4 H ILE 2 H ILE 2 15.045 -9.276 8.419 5 HA ILE 2 HA ILE 2 13.289 -6.945 8.022 6 HB ILE 2 HB ILE 2 15.718 -7.904 6.413 7 HG12 ILE 2 HG12 ILE 2 15.404 -5.611 8.466 8 HG13 ILE 2 HG13 ILE 2 16.196 -7.171 8.788 9 HG21 ILE 2 HG21 ILE 2 14.138 -5.263 6.214 10 HG22 ILE 2 HG22 ILE 2 15.598 -5.680 5.270 11 HG23 ILE 2 HG23 ILE 2 14.101 -6.576 5.002 12 HD11 ILE 2 HD11 ILE 2 17.202 -5.005 6.846 13 HD12 ILE 2 HD12 ILE 2 17.947 -5.557 8.361 14 HD13 ILE 2 HD13 ILE 2 17.891 -6.656 6.954 15 H LEU 3 H LEU 3 14.235 -9.958 6.109 16 HA LEU 3 HA LEU 3 12.461 -9.379 4.027 17 HB2 LEU 3 HB2 LEU 3 12.621 -11.673 3.280 18 HB3 LEU 3 HB3 LEU 3 14.188 -11.098 3.876 19 HG LEU 3 HG LEU 3 13.448 -12.318 6.162 20 HD11 LEU 3 HD11 LEU 3 11.092 -12.959 5.336 21 HD12 LEU 3 HD12 LEU 3 12.079 -14.365 5.782 22 HD13 LEU 3 HD13 LEU 3 11.851 -13.938 4.064 23 HD21 LEU 3 HD21 LEU 3 14.561 -14.421 5.360 24 HD22 LEU 3 HD22 LEU 3 15.433 -12.964 4.823 25 HD23 LEU 3 HD23 LEU 3 14.397 -13.856 3.670 26 H SER 4 H SER 4 11.719 -10.925 7.253 27 HA SER 4 HA SER 4 9.123 -11.767 6.486 28 HB2 SER 4 HB2 SER 4 8.493 -11.828 8.812 29 HB3 SER 4 HB3 SER 4 10.170 -12.425 8.691 30 HG SER 4 HG SER 4 10.779 -10.244 9.465 31 H SER 5 H SER 5 10.389 -8.559 7.677 32 HA SER 5 HA SER 5 7.766 -7.396 7.910 33 HB2 SER 5 HB2 SER 5 10.490 -6.003 7.503 34 HB3 SER 5 HB3 SER 5 8.949 -5.194 7.886 35 HG SER 5 HG SER 5 10.205 -7.113 9.615 36 H PHE 6 H PHE 6 10.285 -7.428 5.236 37 HA PHE 6 HA PHE 6 8.723 -5.638 3.603 38 HB2 PHE 6 HB2 PHE 6 11.119 -7.422 2.990 39 HB3 PHE 6 HB3 PHE 6 10.119 -6.817 1.661 40 HD1 PHE 6 HD2 PHE 6 11.694 -5.482 4.855 41 HD2 PHE 6 HD1 PHE 6 10.697 -4.713 0.734 42 HE1 PHE 6 HE2 PHE 6 12.765 -3.262 5.004 43 HE2 PHE 6 HE1 PHE 6 11.770 -2.500 0.892 44 HZ PHE 6 HZ PHE 6 12.804 -1.760 3.026 45 H LYS 7 H LYS 7 9.221 -9.294 3.270 46 HA LYS 7 HA LYS 7 7.230 -9.438 1.291 47 HB2 LYS 7 HB2 LYS 7 7.186 -11.815 1.517 48 HB3 LYS 7 HB3 LYS 7 8.842 -11.280 1.862 49 HG2 LYS 7 HG2 LYS 7 8.553 -12.803 3.621 50 HG3 LYS 7 HG3 LYS 7 7.964 -11.330 4.424 51 HD2 LYS 7 HD2 LYS 7 5.569 -12.040 3.821 52 HD3 LYS 7 HD3 LYS 7 6.247 -13.510 3.080 53 HE2 LYS 7 HE2 LYS 7 7.233 -14.154 5.318 54 HE3 LYS 7 HE3 LYS 7 6.508 -12.691 6.042 55 HZ1 LYS 7 HZ1 LYS 7 4.259 -13.532 5.420 56 HZ2 LYS 7 HZ2 LYS 7 5.100 -14.672 6.429 57 HZ3 LYS 7 HZ3 LYS 7 4.973 -14.961 4.720 58 H GLY 8 H GLY 8 6.843 -9.188 4.896 59 HA2 GLY 8 HA2 GLY 8 4.084 -9.977 4.878 60 HA3 GLY 8 HA3 GLY 8 4.867 -8.961 6.108 61 H VAL 9 H VAL 9 5.771 -6.754 4.465 62 HA VAL 9 HA VAL 9 3.080 -5.476 4.109 63 HB VAL 9 HB VAL 9 5.833 -4.268 4.728 64 HG11 VAL 9 HG11 VAL 9 4.565 -2.139 5.067 65 HG12 VAL 9 HG12 VAL 9 4.442 -2.686 3.377 66 HG13 VAL 9 HG13 VAL 9 3.066 -2.926 4.494 67 HG21 VAL 9 HG21 VAL 9 4.855 -5.562 6.644 68 HG22 VAL 9 HG22 VAL 9 4.861 -3.809 6.964 69 HG23 VAL 9 HG23 VAL 9 3.340 -4.625 6.499 70 H ALA 10 H ALA 10 6.443 -5.231 2.638 71 HA ALA 10 HA ALA 10 5.606 -3.668 0.515 72 HB1 ALA 10 HB1 ALA 10 7.696 -4.371 -0.664 73 HB2 ALA 10 HB2 ALA 10 8.017 -4.064 1.067 74 HB3 ALA 10 HB3 ALA 10 7.883 -5.745 0.466 75 H LYS 11 H LYS 11 5.253 -7.280 0.794 76 HA LYS 11 HA LYS 11 5.240 -7.950 -1.839 77 HB2 LYS 11 HB2 LYS 11 3.601 -9.746 -1.427 78 HB3 LYS 11 HB3 LYS 11 4.814 -9.647 -0.130 79 HG2 LYS 11 HG2 LYS 11 3.122 -8.432 1.323 80 HG3 LYS 11 HG3 LYS 11 1.931 -8.533 -0.001 81 HD2 LYS 11 HD2 LYS 11 1.800 -10.940 0.103 82 HD3 LYS 11 HD3 LYS 11 3.206 -11.064 1.183 83 HE2 LYS 11 HE2 LYS 11 1.085 -11.412 2.413 84 HE3 LYS 11 HE3 LYS 11 1.986 -10.012 3.040 85 HZ1 LYS 11 HZ1 LYS 11 -0.338 -9.808 1.096 86 HZ2 LYS 11 HZ2 LYS 11 0.453 -8.478 1.924 87 HZ3 LYS 11 HZ3 LYS 11 -0.470 -9.621 2.821 88 H GLY 12 H GLY 12 2.506 -6.130 -0.231 89 HA2 GLY 12 HA2 GLY 12 1.115 -6.107 -2.920 90 HA3 GLY 12 HA3 GLY 12 0.346 -5.920 -1.332 91 H VAL 13 H VAL 13 3.461 -4.384 -2.458 92 HA VAL 13 HA VAL 13 2.485 -1.880 -1.461 93 HB VAL 13 HB VAL 13 4.918 -2.528 -1.499 94 HG11 VAL 13 HG11 VAL 13 4.829 -1.682 -4.465 95 HG12 VAL 13 HG12 VAL 13 6.282 -2.096 -3.516 96 HG13 VAL 13 HG13 VAL 13 5.085 -3.358 -3.897 97 HG21 VAL 13 HG21 VAL 13 4.171 -0.185 -1.023 98 HG22 VAL 13 HG22 VAL 13 5.739 -0.218 -1.872 99 HG23 VAL 13 HG23 VAL 13 4.251 0.175 -2.770 100 H ALA 14 H ALA 14 2.570 -3.345 -4.789 101 HA ALA 14 HA ALA 14 2.566 -1.158 -6.338 102 HB1 ALA 14 HB1 ALA 14 0.667 -3.546 -6.736 103 HB2 ALA 14 HB2 ALA 14 1.064 -2.324 -7.983 104 HB3 ALA 14 HB3 ALA 14 2.342 -3.389 -7.328 105 H LYS 15 H LYS 15 -0.719 -2.389 -5.123 106 HA LYS 15 HA LYS 15 -1.868 0.210 -5.865 107 HB2 LYS 15 HB2 LYS 15 -3.024 -2.191 -4.325 108 HB3 LYS 15 HB3 LYS 15 -3.869 -0.629 -4.457 109 HG2 LYS 15 HG2 LYS 15 -3.871 -0.747 -6.924 110 HG3 LYS 15 HG3 LYS 15 -3.006 -2.311 -6.881 111 HD2 LYS 15 HD2 LYS 15 -4.919 -3.385 -5.723 112 HD3 LYS 15 HD3 LYS 15 -5.748 -1.816 -5.528 113 HE2 LYS 15 HE2 LYS 15 -5.997 -1.586 -7.993 114 HE3 LYS 15 HE3 LYS 15 -5.136 -3.131 -8.244 115 HZ1 LYS 15 HZ1 LYS 15 -6.927 -4.310 -7.028 116 HZ2 LYS 15 HZ2 LYS 15 -7.595 -3.397 -8.351 117 HZ3 LYS 15 HZ3 LYS 15 -7.754 -2.803 -6.726 118 H ASP 16 H ASP 16 -1.076 -1.510 -2.720 119 HA ASP 16 HA ASP 16 -2.279 0.308 -1.078 120 HB2 ASP 16 HB2 ASP 16 -1.132 -1.806 -0.281 121 HB3 ASP 16 HB3 ASP 16 0.444 -0.989 -0.465 122 H LEU 17 H LEU 17 0.990 0.731 -2.586 123 HA LEU 17 HA LEU 17 1.859 2.854 -1.083 124 HB2 LEU 17 HB2 LEU 17 2.702 1.822 -3.618 125 HB3 LEU 17 HB3 LEU 17 2.298 3.485 -4.003 126 HG LEU 17 HG LEU 17 4.234 2.595 -1.776 127 HD11 LEU 17 HD11 LEU 17 5.122 2.117 -4.087 128 HD12 LEU 17 HD12 LEU 17 6.030 3.428 -3.296 129 HD13 LEU 17 HD13 LEU 17 4.819 3.813 -4.552 130 HD21 LEU 17 HD21 LEU 17 4.895 5.036 -1.724 131 HD22 LEU 17 HD22 LEU 17 3.200 4.810 -1.242 132 HD23 LEU 17 HD23 LEU 17 3.584 5.397 -2.886 133 H ALA 18 H ALA 18 -0.263 3.038 -4.050 134 HA ALA 18 HA ALA 18 -0.807 5.850 -3.710 135 HB1 ALA 18 HB1 ALA 18 -2.448 3.688 -5.177 136 HB2 ALA 18 HB2 ALA 18 -2.707 5.455 -5.290 137 HB3 ALA 18 HB3 ALA 18 -1.188 4.730 -5.895 138 H GLY 19 H GLY 19 -2.561 2.787 -2.662 139 HA2 GLY 19 HA2 GLY 19 -4.820 3.982 -1.587 140 HA3 GLY 19 HA3 GLY 19 -4.049 2.541 -0.879 141 H LYS 20 H LYS 20 -1.446 4.194 -0.235 142 HA LYS 20 HA LYS 20 -2.595 5.386 2.261 143 HB2 LYS 20 HB2 LYS 20 0.275 4.579 1.583 144 HB3 LYS 20 HB3 LYS 20 -0.293 5.263 3.125 145 HG2 LYS 20 HG2 LYS 20 -1.149 2.550 1.917 146 HG3 LYS 20 HG3 LYS 20 -0.030 2.811 3.277 147 HD2 LYS 20 HD2 LYS 20 -2.021 3.964 4.511 148 HD3 LYS 20 HD3 LYS 20 -3.070 3.314 3.214 149 HE2 LYS 20 HE2 LYS 20 -2.267 0.985 3.768 150 HE3 LYS 20 HE3 LYS 20 -1.316 1.655 5.118 151 HZ1 LYS 20 HZ1 LYS 20 -3.419 2.521 6.117 152 HZ2 LYS 20 HZ2 LYS 20 -3.474 0.795 5.901 153 HZ3 LYS 20 HZ3 LYS 20 -4.336 1.830 4.801 154 H LEU 21 H LEU 21 -0.006 6.269 -0.249 155 HA LEU 21 HA LEU 21 0.159 8.913 0.843 156 HB2 LEU 21 HB2 LEU 21 0.660 8.043 -2.065 157 HB3 LEU 21 HB3 LEU 21 1.083 9.635 -1.387 158 HG LEU 21 HG LEU 21 2.305 6.942 -0.541 159 HD11 LEU 21 HD11 LEU 21 3.016 7.812 -2.822 160 HD12 LEU 21 HD12 LEU 21 4.364 7.795 -1.653 161 HD13 LEU 21 HD13 LEU 21 3.546 9.331 -2.053 162 HD21 LEU 21 HD21 LEU 21 2.900 9.785 0.479 163 HD22 LEU 21 HD22 LEU 21 3.968 8.379 0.749 164 HD23 LEU 21 HD23 LEU 21 2.342 8.388 1.453 165 H LEU 22 H LEU 22 -1.874 7.515 -1.830 166 HA LEU 22 HA LEU 22 -3.393 10.115 -1.892 167 HB2 LEU 22 HB2 LEU 22 -3.565 7.728 -3.795 168 HB3 LEU 22 HB3 LEU 22 -4.242 9.355 -4.034 169 HG LEU 22 HG LEU 22 -1.254 8.564 -4.012 170 HD11 LEU 22 HD11 LEU 22 -3.055 9.584 -6.294 171 HD12 LEU 22 HD12 LEU 22 -2.521 7.893 -6.077 172 HD13 LEU 22 HD13 LEU 22 -1.323 9.166 -6.424 173 HD21 LEU 22 HD21 LEU 22 -2.534 11.347 -4.372 174 HD22 LEU 22 HD22 LEU 22 -0.825 10.958 -4.726 175 HD23 LEU 22 HD23 LEU 22 -1.424 10.849 -3.058 176 H GLU 23 H GLU 23 -3.702 8.635 0.528 177 HA GLU 23 HA GLU 23 -5.836 6.764 0.290 178 HB2 GLU 23 HB2 GLU 23 -4.466 7.031 2.383 179 HB3 GLU 23 HB3 GLU 23 -5.227 8.615 2.678 180 HG2 GLU 23 HG2 GLU 23 -7.489 7.456 2.816 181 HG3 GLU 23 HG3 GLU 23 -6.677 5.888 2.548 182 H THR 24 H THR 24 -5.756 10.350 0.900 183 HA THR 24 HA THR 24 -8.403 10.851 1.260 184 HB THR 24 HB THR 24 -6.657 12.608 1.248 185 HG1 THR 24 HG1 THR 24 -8.129 14.200 0.280 186 HG21 THR 24 HG21 THR 24 -6.896 12.544 -1.836 187 HG22 THR 24 HG22 THR 24 -5.475 11.940 -0.937 188 HG23 THR 24 HG23 THR 24 -5.904 13.671 -0.878 189 H LEU 25 H LEU 25 -7.050 9.789 -1.910 190 HA LEU 25 HA LEU 25 -9.860 9.921 -2.925 191 HB2 LEU 25 HB2 LEU 25 -9.208 10.880 -5.037 192 HB3 LEU 25 HB3 LEU 25 -8.698 11.890 -3.671 193 HG LEU 25 HG LEU 25 -6.333 10.674 -4.009 194 HD11 LEU 25 HD11 LEU 25 -5.832 10.075 -6.362 195 HD12 LEU 25 HD12 LEU 25 -7.487 10.505 -6.878 196 HD13 LEU 25 HD13 LEU 25 -7.215 9.069 -5.877 197 HD21 LEU 25 HD21 LEU 25 -7.353 12.857 -5.917 198 HD22 LEU 25 HD22 LEU 25 -5.636 12.479 -5.589 199 HD23 LEU 25 HD23 LEU 25 -6.670 13.113 -4.287 200 H LYS 26 H LYS 26 -6.608 8.241 -3.566 201 HA LYS 26 HA LYS 26 -7.879 6.445 -5.345 202 HB2 LYS 26 HB2 LYS 26 -5.375 6.618 -5.169 203 HB3 LYS 26 HB3 LYS 26 -5.467 5.985 -3.512 204 HG2 LYS 26 HG2 LYS 26 -4.857 4.050 -4.560 205 HG3 LYS 26 HG3 LYS 26 -6.596 3.823 -4.680 206 HD2 LYS 26 HD2 LYS 26 -4.676 4.914 -6.856 207 HD3 LYS 26 HD3 LYS 26 -5.324 3.261 -6.776 208 HE2 LYS 26 HE2 LYS 26 -6.951 5.811 -7.360 209 HE3 LYS 26 HE3 LYS 26 -6.454 4.568 -8.515 210 HZ1 LYS 26 HZ1 LYS 26 -8.385 4.111 -6.221 211 HZ2 LYS 26 HZ2 LYS 26 -7.783 2.884 -7.309 212 HZ3 LYS 26 HZ3 LYS 26 -8.765 4.192 -7.903 213 H CYS 27 H CYS 27 -7.176 6.134 -1.748 214 HA CYS 27 HA CYS 27 -8.274 3.558 -1.584 215 HB2 CYS 27 HB2 CYS 27 -6.966 4.566 0.298 216 HB3 CYS 27 HB3 CYS 27 -8.336 5.677 0.634 217 H LYS 28 H LYS 28 -9.928 6.807 -1.418 218 HA LYS 28 HA LYS 28 -12.439 5.663 -0.535 219 HB2 LYS 28 HB2 LYS 28 -11.793 8.299 -1.980 220 HB3 LYS 28 HB3 LYS 28 -13.461 7.771 -1.673 221 HG2 LYS 28 HG2 LYS 28 -12.751 9.322 0.089 222 HG3 LYS 28 HG3 LYS 28 -13.120 7.708 0.754 223 HD2 LYS 28 HD2 LYS 28 -10.693 7.198 0.973 224 HD3 LYS 28 HD3 LYS 28 -10.295 8.703 0.092 225 HE2 LYS 28 HE2 LYS 28 -9.888 8.970 2.504 226 HE3 LYS 28 HE3 LYS 28 -11.166 10.084 1.956 227 HZ1 LYS 28 HZ1 LYS 28 -12.874 8.646 2.957 228 HZ2 LYS 28 HZ2 LYS 28 -11.656 8.961 4.132 229 HZ3 LYS 28 HZ3 LYS 28 -11.682 7.419 3.327 230 H ILE 29 H ILE 29 -10.985 6.356 -3.813 231 HA ILE 29 HA ILE 29 -13.398 5.708 -5.204 232 HB ILE 29 HB ILE 29 -10.483 5.706 -6.117 233 HG12 ILE 29 HG12 ILE 29 -12.792 7.581 -6.917 234 HG13 ILE 29 HG13 ILE 29 -11.786 7.904 -5.495 235 HG21 ILE 29 HG21 ILE 29 -13.004 5.197 -7.810 236 HG22 ILE 29 HG22 ILE 29 -11.371 5.483 -8.476 237 HG23 ILE 29 HG23 ILE 29 -11.684 4.030 -7.515 238 HD11 ILE 29 HD11 ILE 29 -10.737 7.752 -8.388 239 HD12 ILE 29 HD12 ILE 29 -10.909 9.200 -7.368 240 HD13 ILE 29 HD13 ILE 29 -9.715 7.947 -6.932 241 H THR 30 H THR 30 -10.395 3.607 -4.802 242 HA THR 30 HA THR 30 -11.907 1.346 -5.769 243 HB THR 30 HB THR 30 -9.423 1.520 -5.992 244 HG1 THR 30 HG1 THR 30 -9.252 -0.817 -5.605 245 HG21 THR 30 HG21 THR 30 -7.959 0.793 -4.114 246 HG22 THR 30 HG22 THR 30 -9.365 0.607 -3.034 247 HG23 THR 30 HG23 THR 30 -8.862 2.231 -3.581 248 H GLY 31 H GLY 31 -11.658 2.811 -2.528 249 HA2 GLY 31 HA2 GLY 31 -12.756 2.109 -0.575 250 HA3 GLY 31 HA3 GLY 31 -13.438 0.742 -1.482 251 H CYS 32 H CYS 32 -10.031 1.916 -0.736 252 HA CYS 32 HA CYS 32 -9.060 -0.752 -0.607 253 HB2 CYS 32 HB2 CYS 32 -6.963 0.056 0.136 254 HB3 CYS 32 HB3 CYS 32 -7.567 1.343 -0.929 Start of MODEL 18 1 H1 GLY 1 H1 GLY 1 12.672 -11.341 12.017 2 HA2 GLY 1 HA2 GLY 1 14.556 -10.399 10.673 3 HA3 GLY 1 HA3 GLY 1 13.510 -11.457 9.670 4 H ILE 2 H ILE 2 15.001 -9.485 8.356 5 HA ILE 2 HA ILE 2 13.301 -7.098 8.038 6 HB ILE 2 HB ILE 2 15.700 -8.058 6.388 7 HG12 ILE 2 HG12 ILE 2 15.467 -5.840 8.531 8 HG13 ILE 2 HG13 ILE 2 16.210 -7.435 8.789 9 HG21 ILE 2 HG21 ILE 2 14.103 -6.623 5.047 10 HG22 ILE 2 HG22 ILE 2 14.202 -5.361 6.307 11 HG23 ILE 2 HG23 ILE 2 15.637 -5.794 5.331 12 HD11 ILE 2 HD11 ILE 2 17.278 -5.236 6.919 13 HD12 ILE 2 HD12 ILE 2 18.009 -5.860 8.413 14 HD13 ILE 2 HD13 ILE 2 17.914 -6.909 6.971 15 H LEU 3 H LEU 3 14.182 -10.068 6.034 16 HA LEU 3 HA LEU 3 12.418 -9.377 3.970 17 HB2 LEU 3 HB2 LEU 3 12.558 -11.639 3.127 18 HB3 LEU 3 HB3 LEU 3 14.128 -11.097 3.745 19 HG LEU 3 HG LEU 3 13.376 -12.415 5.977 20 HD11 LEU 3 HD11 LEU 3 11.765 -13.926 3.810 21 HD12 LEU 3 HD12 LEU 3 11.013 -12.996 5.123 22 HD13 LEU 3 HD13 LEU 3 11.986 -14.429 5.508 23 HD21 LEU 3 HD21 LEU 3 14.312 -13.850 3.419 24 HD22 LEU 3 HD22 LEU 3 14.470 -14.492 5.080 25 HD23 LEU 3 HD23 LEU 3 15.358 -13.022 4.609 26 H SER 4 H SER 4 11.678 -11.053 7.131 27 HA SER 4 HA SER 4 9.077 -11.850 6.351 28 HB2 SER 4 HB2 SER 4 8.456 -11.986 8.678 29 HB3 SER 4 HB3 SER 4 10.132 -12.582 8.530 30 HG SER 4 HG SER 4 10.749 -10.426 9.367 31 H SER 5 H SER 5 10.363 -8.681 7.631 32 HA SER 5 HA SER 5 7.744 -7.516 7.898 33 HB2 SER 5 HB2 SER 5 10.469 -6.117 7.524 34 HB3 SER 5 HB3 SER 5 8.926 -5.317 7.918 35 HG SER 5 HG SER 5 10.176 -7.275 9.609 36 H PHE 6 H PHE 6 10.294 -7.404 5.242 37 HA PHE 6 HA PHE 6 8.717 -5.658 3.629 38 HB2 PHE 6 HB2 PHE 6 11.130 -7.393 3.022 39 HB3 PHE 6 HB3 PHE 6 10.072 -6.994 1.662 40 HD1 PHE 6 HD1 PHE 6 11.563 -5.242 4.679 41 HD2 PHE 6 HD2 PHE 6 10.587 -4.998 0.489 42 HE1 PHE 6 HE1 PHE 6 12.411 -2.917 4.607 43 HE2 PHE 6 HE2 PHE 6 11.441 -2.686 0.424 44 HZ PHE 6 HZ PHE 6 12.333 -1.626 2.485 45 H LYS 7 H LYS 7 9.109 -9.325 3.187 46 HA LYS 7 HA LYS 7 7.075 -9.325 1.259 47 HB2 LYS 7 HB2 LYS 7 6.885 -11.705 1.422 48 HB3 LYS 7 HB3 LYS 7 8.581 -11.251 1.688 49 HG2 LYS 7 HG2 LYS 7 8.288 -12.863 3.354 50 HG3 LYS 7 HG3 LYS 7 7.918 -11.389 4.279 51 HD2 LYS 7 HD2 LYS 7 5.411 -11.863 3.814 52 HD3 LYS 7 HD3 LYS 7 5.904 -13.381 3.040 53 HE2 LYS 7 HE2 LYS 7 6.421 -12.598 5.983 54 HE3 LYS 7 HE3 LYS 7 5.130 -13.678 5.399 55 HZ1 LYS 7 HZ1 LYS 7 6.908 -15.205 4.494 56 HZ2 LYS 7 HZ2 LYS 7 6.920 -15.040 6.226 57 HZ3 LYS 7 HZ3 LYS 7 8.117 -14.228 5.297 58 H GLY 8 H GLY 8 6.761 -9.300 4.894 59 HA2 GLY 8 HA2 GLY 8 3.994 -9.925 4.938 60 HA3 GLY 8 HA3 GLY 8 4.830 -8.916 6.143 61 H VAL 9 H VAL 9 5.719 -6.735 4.485 62 HA VAL 9 HA VAL 9 3.041 -5.418 4.158 63 HB VAL 9 HB VAL 9 5.817 -4.251 4.756 64 HG11 VAL 9 HG11 VAL 9 3.066 -2.871 4.561 65 HG12 VAL 9 HG12 VAL 9 4.582 -2.107 5.116 66 HG13 VAL 9 HG13 VAL 9 4.429 -2.646 3.426 67 HG21 VAL 9 HG21 VAL 9 4.851 -5.538 6.676 68 HG22 VAL 9 HG22 VAL 9 4.875 -3.786 7.003 69 HG23 VAL 9 HG23 VAL 9 3.342 -4.588 6.553 70 H ALA 10 H ALA 10 6.396 -5.217 2.666 71 HA ALA 10 HA ALA 10 5.578 -3.626 0.569 72 HB1 ALA 10 HB1 ALA 10 7.651 -4.352 -0.630 73 HB2 ALA 10 HB2 ALA 10 7.981 -4.067 1.103 74 HB3 ALA 10 HB3 ALA 10 7.818 -5.740 0.486 75 H LYS 11 H LYS 11 5.159 -7.236 0.785 76 HA LYS 11 HA LYS 11 5.204 -7.855 -1.859 77 HB2 LYS 11 HB2 LYS 11 3.598 -9.684 -1.517 78 HB3 LYS 11 HB3 LYS 11 4.751 -9.573 -0.168 79 HG2 LYS 11 HG2 LYS 11 2.954 -8.346 1.184 80 HG3 LYS 11 HG3 LYS 11 1.817 -8.575 -0.168 81 HD2 LYS 11 HD2 LYS 11 1.926 -11.018 0.015 82 HD3 LYS 11 HD3 LYS 11 3.196 -10.936 1.256 83 HE2 LYS 11 HE2 LYS 11 1.623 -9.729 2.806 84 HE3 LYS 11 HE3 LYS 11 0.335 -9.842 1.574 85 HZ1 LYS 11 HZ1 LYS 11 0.130 -11.625 3.256 86 HZ2 LYS 11 HZ2 LYS 11 1.738 -12.189 2.909 87 HZ3 LYS 11 HZ3 LYS 11 0.485 -12.316 1.699 88 H GLY 12 H GLY 12 2.406 -6.110 -0.273 89 HA2 GLY 12 HA2 GLY 12 1.098 -6.009 -3.001 90 HA3 GLY 12 HA3 GLY 12 0.282 -5.867 -1.433 91 H VAL 13 H VAL 13 3.422 -4.287 -2.424 92 HA VAL 13 HA VAL 13 2.388 -1.819 -1.387 93 HB VAL 13 HB VAL 13 4.817 -2.419 -1.316 94 HG11 VAL 13 HG11 VAL 13 6.292 -1.950 -3.242 95 HG12 VAL 13 HG12 VAL 13 5.140 -3.224 -3.706 96 HG13 VAL 13 HG13 VAL 13 4.896 -1.545 -4.274 97 HG21 VAL 13 HG21 VAL 13 5.619 -0.078 -1.651 98 HG22 VAL 13 HG22 VAL 13 4.156 0.279 -2.606 99 HG23 VAL 13 HG23 VAL 13 4.018 -0.095 -0.864 100 H ALA 14 H ALA 14 2.787 -3.126 -4.776 101 HA ALA 14 HA ALA 14 2.695 -0.839 -6.213 102 HB1 ALA 14 HB1 ALA 14 1.385 -2.054 -7.995 103 HB2 ALA 14 HB2 ALA 14 2.682 -3.073 -7.306 104 HB3 ALA 14 HB3 ALA 14 0.983 -3.337 -6.814 105 H LYS 15 H LYS 15 -0.293 -2.420 -4.820 106 HA LYS 15 HA LYS 15 -1.934 -0.157 -5.797 107 HB2 LYS 15 HB2 LYS 15 -2.640 -2.608 -4.085 108 HB3 LYS 15 HB3 LYS 15 -3.797 -1.374 -4.655 109 HG2 LYS 15 HG2 LYS 15 -3.411 -1.954 -7.002 110 HG3 LYS 15 HG3 LYS 15 -1.993 -2.952 -6.599 111 HD2 LYS 15 HD2 LYS 15 -3.898 -4.391 -7.147 112 HD3 LYS 15 HD3 LYS 15 -3.403 -4.632 -5.452 113 HE2 LYS 15 HE2 LYS 15 -5.329 -3.251 -4.662 114 HE3 LYS 15 HE3 LYS 15 -5.775 -2.870 -6.351 115 HZ1 LYS 15 HZ1 LYS 15 -5.744 -5.646 -5.109 116 HZ2 LYS 15 HZ2 LYS 15 -6.220 -5.271 -6.745 117 HZ3 LYS 15 HZ3 LYS 15 -7.161 -4.683 -5.408 118 H ASP 16 H ASP 16 -0.881 -1.547 -2.556 119 HA ASP 16 HA ASP 16 -2.411 0.240 -1.052 120 HB2 ASP 16 HB2 ASP 16 -1.215 -1.762 -0.088 121 HB3 ASP 16 HB3 ASP 16 0.341 -0.908 -0.281 122 H LEU 17 H LEU 17 0.896 0.751 -2.445 123 HA LEU 17 HA LEU 17 1.652 2.926 -0.994 124 HB2 LEU 17 HB2 LEU 17 2.529 1.900 -3.544 125 HB3 LEU 17 HB3 LEU 17 2.147 3.577 -3.887 126 HG LEU 17 HG LEU 17 4.043 2.620 -1.656 127 HD11 LEU 17 HD11 LEU 17 4.953 2.180 -3.975 128 HD12 LEU 17 HD12 LEU 17 5.872 3.455 -3.137 129 HD13 LEU 17 HD13 LEU 17 4.683 3.892 -4.397 130 HD21 LEU 17 HD21 LEU 17 4.735 5.051 -1.555 131 HD22 LEU 17 HD22 LEU 17 3.035 4.831 -1.086 132 HD23 LEU 17 HD23 LEU 17 3.434 5.446 -2.716 133 H ALA 18 H ALA 18 -0.454 3.019 -3.978 134 HA ALA 18 HA ALA 18 -1.029 5.824 -3.720 135 HB1 ALA 18 HB1 ALA 18 -1.471 4.618 -5.850 136 HB2 ALA 18 HB2 ALA 18 -2.705 3.601 -5.052 137 HB3 ALA 18 HB3 ALA 18 -2.975 5.361 -5.231 138 H GLY 19 H GLY 19 -2.767 2.795 -2.551 139 HA2 GLY 19 HA2 GLY 19 -4.990 4.021 -1.445 140 HA3 GLY 19 HA3 GLY 19 -4.201 2.599 -0.716 141 H LYS 20 H LYS 20 -1.585 4.259 -0.171 142 HA LYS 20 HA LYS 20 -2.676 5.508 2.322 143 HB2 LYS 20 HB2 LYS 20 0.183 4.701 1.595 144 HB3 LYS 20 HB3 LYS 20 -0.359 5.399 3.140 145 HG2 LYS 20 HG2 LYS 20 -1.220 2.670 1.980 146 HG3 LYS 20 HG3 LYS 20 -0.062 2.959 3.299 147 HD2 LYS 20 HD2 LYS 20 -2.053 4.115 4.576 148 HD3 LYS 20 HD3 LYS 20 -3.102 3.439 3.299 149 HE2 LYS 20 HE2 LYS 20 -3.247 1.937 5.139 150 HE3 LYS 20 HE3 LYS 20 -2.260 1.111 3.911 151 HZ1 LYS 20 HZ1 LYS 20 -1.393 0.861 6.223 152 HZ2 LYS 20 HZ2 LYS 20 -1.174 2.579 6.344 153 HZ3 LYS 20 HZ3 LYS 20 -0.224 1.632 5.226 154 H LEU 21 H LEU 21 -0.105 6.346 -0.225 155 HA LEU 21 HA LEU 21 0.044 9.013 0.821 156 HB2 LEU 21 HB2 LEU 21 0.581 8.097 -2.067 157 HB3 LEU 21 HB3 LEU 21 0.996 9.697 -1.402 158 HG LEU 21 HG LEU 21 2.207 7.012 -0.521 159 HD11 LEU 21 HD11 LEU 21 2.953 7.879 -2.794 160 HD12 LEU 21 HD12 LEU 21 4.283 7.859 -1.604 161 HD13 LEU 21 HD13 LEU 21 3.473 9.397 -2.016 162 HD21 LEU 21 HD21 LEU 21 2.785 9.857 0.503 163 HD22 LEU 21 HD22 LEU 21 3.849 8.452 0.794 164 HD23 LEU 21 HD23 LEU 21 2.212 8.463 1.470 165 H LEU 22 H LEU 22 -1.955 7.536 -1.835 166 HA LEU 22 HA LEU 22 -3.485 10.126 -1.986 167 HB2 LEU 22 HB2 LEU 22 -3.631 7.680 -3.818 168 HB3 LEU 22 HB3 LEU 22 -4.313 9.295 -4.110 169 HG LEU 22 HG LEU 22 -1.319 8.525 -4.035 170 HD11 LEU 22 HD11 LEU 22 -1.368 9.051 -6.464 171 HD12 LEU 22 HD12 LEU 22 -3.105 9.460 -6.366 172 HD13 LEU 22 HD13 LEU 22 -2.561 7.780 -6.092 173 HD21 LEU 22 HD21 LEU 22 -1.510 10.836 -3.154 174 HD22 LEU 22 HD22 LEU 22 -2.614 11.285 -4.491 175 HD23 LEU 22 HD23 LEU 22 -0.900 10.899 -4.819 176 H GLU 23 H GLU 23 -3.812 8.779 0.481 177 HA GLU 23 HA GLU 23 -5.942 6.879 0.300 178 HB2 GLU 23 HB2 GLU 23 -4.571 7.178 2.378 179 HB3 GLU 23 HB3 GLU 23 -5.298 8.785 2.634 180 HG2 GLU 23 HG2 GLU 23 -7.584 7.679 2.811 181 HG3 GLU 23 HG3 GLU 23 -6.808 6.088 2.581 182 H THR 24 H THR 24 -5.845 10.478 0.863 183 HA THR 24 HA THR 24 -8.491 10.975 1.198 184 HB THR 24 HB THR 24 -6.746 12.762 1.193 185 HG1 THR 24 HG1 THR 24 -9.011 13.407 0.874 186 HG21 THR 24 HG21 THR 24 -6.908 12.646 -1.887 187 HG22 THR 24 HG22 THR 24 -5.505 12.079 -0.937 188 HG23 THR 24 HG23 THR 24 -5.970 13.802 -0.912 189 H LEU 25 H LEU 25 -7.100 9.939 -1.960 190 HA LEU 25 HA LEU 25 -9.890 10.130 -3.034 191 HB2 LEU 25 HB2 LEU 25 -9.158 11.017 -5.142 192 HB3 LEU 25 HB3 LEU 25 -8.627 12.031 -3.786 193 HG LEU 25 HG LEU 25 -6.312 10.707 -4.062 194 HD11 LEU 25 HD11 LEU 25 -5.804 10.042 -6.399 195 HD12 LEU 25 HD12 LEU 25 -7.436 10.518 -6.941 196 HD13 LEU 25 HD13 LEU 25 -7.225 9.097 -5.904 197 HD21 LEU 25 HD21 LEU 25 -7.206 12.891 -6.027 198 HD22 LEU 25 HD22 LEU 25 -5.512 12.445 -5.667 199 HD23 LEU 25 HD23 LEU 25 -6.536 13.147 -4.391 200 H LYS 26 H LYS 26 -6.688 8.299 -3.545 201 HA LYS 26 HA LYS 26 -8.045 6.525 -5.303 202 HB2 LYS 26 HB2 LYS 26 -5.516 6.624 -5.159 203 HB3 LYS 26 HB3 LYS 26 -5.617 5.934 -3.526 204 HG2 LYS 26 HG2 LYS 26 -5.208 3.966 -4.648 205 HG3 LYS 26 HG3 LYS 26 -6.967 3.938 -4.817 206 HD2 LYS 26 HD2 LYS 26 -4.899 4.874 -6.913 207 HD3 LYS 26 HD3 LYS 26 -5.824 3.353 -6.918 208 HE2 LYS 26 HE2 LYS 26 -7.974 4.739 -7.113 209 HE3 LYS 26 HE3 LYS 26 -6.942 6.191 -7.332 210 HZ1 LYS 26 HZ1 LYS 26 -5.901 5.139 -9.299 211 HZ2 LYS 26 HZ2 LYS 26 -7.623 5.299 -9.489 212 HZ3 LYS 26 HZ3 LYS 26 -6.936 3.746 -9.121 213 H CYS 27 H CYS 27 -7.256 6.213 -1.715 214 HA CYS 27 HA CYS 27 -8.432 3.700 -1.488 215 HB2 CYS 27 HB2 CYS 27 -7.133 4.724 0.388 216 HB3 CYS 27 HB3 CYS 27 -8.497 5.853 0.692 217 H LYS 28 H LYS 28 -10.024 6.973 -1.415 218 HA LYS 28 HA LYS 28 -12.593 5.922 -0.602 219 HB2 LYS 28 HB2 LYS 28 -11.807 8.482 -2.115 220 HB3 LYS 28 HB3 LYS 28 -13.504 8.012 -1.882 221 HG2 LYS 28 HG2 LYS 28 -12.822 9.617 -0.148 222 HG3 LYS 28 HG3 LYS 28 -13.314 8.051 0.552 223 HD2 LYS 28 HD2 LYS 28 -10.944 7.434 0.962 224 HD3 LYS 28 HD3 LYS 28 -10.398 8.870 0.049 225 HE2 LYS 28 HE2 LYS 28 -10.156 9.220 2.477 226 HE3 LYS 28 HE3 LYS 28 -11.297 10.392 1.771 227 HZ1 LYS 28 HZ1 LYS 28 -12.134 7.849 3.212 228 HZ2 LYS 28 HZ2 LYS 28 -13.186 9.148 2.691 229 HZ3 LYS 28 HZ3 LYS 28 -12.045 9.423 3.950 230 H ILE 29 H ILE 29 -11.031 6.517 -3.857 231 HA ILE 29 HA ILE 29 -13.417 5.790 -5.274 232 HB ILE 29 HB ILE 29 -10.500 5.887 -6.175 233 HG12 ILE 29 HG12 ILE 29 -12.862 7.699 -6.968 234 HG13 ILE 29 HG13 ILE 29 -11.865 8.047 -5.546 235 HG21 ILE 29 HG21 ILE 29 -13.011 5.317 -7.867 236 HG22 ILE 29 HG22 ILE 29 -11.385 5.641 -8.532 237 HG23 ILE 29 HG23 ILE 29 -11.664 4.180 -7.573 238 HD11 ILE 29 HD11 ILE 29 -11.024 9.368 -7.418 239 HD12 ILE 29 HD12 ILE 29 -9.796 8.149 -6.982 240 HD13 ILE 29 HD13 ILE 29 -10.812 7.927 -8.439 241 H THR 30 H THR 30 -10.319 3.795 -4.942 242 HA THR 30 HA THR 30 -11.721 1.511 -5.906 243 HB THR 30 HB THR 30 -9.199 1.741 -5.960 244 HG1 THR 30 HG1 THR 30 -10.224 -0.393 -6.209 245 HG21 THR 30 HG21 THR 30 -9.338 0.837 -3.008 246 HG22 THR 30 HG22 THR 30 -8.839 2.467 -3.539 247 HG23 THR 30 HG23 THR 30 -7.871 1.043 -3.997 248 H GLY 31 H GLY 31 -11.582 2.912 -2.611 249 HA2 GLY 31 HA2 GLY 31 -12.839 2.197 -0.750 250 HA3 GLY 31 HA3 GLY 31 -13.439 0.824 -1.701 251 H CYS 32 H CYS 32 -10.134 2.072 -0.681 252 HA CYS 32 HA CYS 32 -9.110 -0.590 -0.532 253 HB2 CYS 32 HB2 CYS 32 -7.071 0.254 0.308 254 HB3 CYS 32 HB3 CYS 32 -7.643 1.530 -0.787 Start of MODEL 19 1 H1 GLY 1 H1 GLY 1 12.832 -9.326 12.159 2 HA2 GLY 1 HA2 GLY 1 14.551 -10.431 10.723 3 HA3 GLY 1 HA3 GLY 1 13.202 -11.337 9.978 4 H ILE 2 H ILE 2 15.054 -9.549 8.497 5 HA ILE 2 HA ILE 2 13.542 -7.080 8.017 6 HB ILE 2 HB ILE 2 15.847 -8.334 6.431 7 HG12 ILE 2 HG12 ILE 2 15.758 -5.941 8.393 8 HG13 ILE 2 HG13 ILE 2 16.416 -7.551 8.764 9 HG21 ILE 2 HG21 ILE 2 14.533 -5.563 6.115 10 HG22 ILE 2 HG22 ILE 2 15.936 -6.169 5.188 11 HG23 ILE 2 HG23 ILE 2 14.353 -6.918 4.966 12 HD11 ILE 2 HD11 ILE 2 18.130 -7.238 6.898 13 HD12 ILE 2 HD12 ILE 2 17.579 -5.540 6.743 14 HD13 ILE 2 HD13 ILE 2 18.293 -6.103 8.268 15 H LEU 3 H LEU 3 14.140 -10.230 6.198 16 HA LEU 3 HA LEU 3 12.307 -9.490 4.134 17 HB2 LEU 3 HB2 LEU 3 13.347 -12.214 5.056 18 HB3 LEU 3 HB3 LEU 3 12.041 -12.118 3.864 19 HG LEU 3 HG LEU 3 14.292 -12.419 2.842 20 HD11 LEU 3 HD11 LEU 3 12.386 -11.430 1.526 21 HD12 LEU 3 HD12 LEU 3 13.985 -10.879 0.969 22 HD13 LEU 3 HD13 LEU 3 12.962 -9.788 1.926 23 HD21 LEU 3 HD21 LEU 3 15.664 -10.992 4.376 24 HD22 LEU 3 HD22 LEU 3 14.873 -9.520 3.730 25 HD23 LEU 3 HD23 LEU 3 15.891 -10.528 2.670 26 H SER 4 H SER 4 11.790 -11.448 7.208 27 HA SER 4 HA SER 4 9.155 -12.135 6.719 28 HB2 SER 4 HB2 SER 4 8.738 -12.036 9.172 29 HB3 SER 4 HB3 SER 4 10.335 -12.775 8.830 30 HG SER 4 HG SER 4 10.450 -11.062 10.495 31 H SER 5 H SER 5 10.350 -8.974 8.135 32 HA SER 5 HA SER 5 7.711 -7.837 8.255 33 HB2 SER 5 HB2 SER 5 10.423 -6.397 7.998 34 HB3 SER 5 HB3 SER 5 8.894 -5.657 8.547 35 HG SER 5 HG SER 5 9.022 -7.213 10.369 36 H PHE 6 H PHE 6 10.344 -7.740 5.710 37 HA PHE 6 HA PHE 6 9.034 -5.669 4.265 38 HB2 PHE 6 HB2 PHE 6 11.506 -6.308 4.048 39 HB3 PHE 6 HB3 PHE 6 11.008 -7.682 3.040 40 HD1 PHE 6 HD1 PHE 6 10.806 -3.947 3.416 41 HD2 PHE 6 HD2 PHE 6 10.451 -7.249 0.675 42 HE1 PHE 6 HE1 PHE 6 10.752 -2.364 1.518 43 HE2 PHE 6 HE2 PHE 6 10.426 -5.660 -1.223 44 HZ PHE 6 HZ PHE 6 10.572 -3.216 -0.808 45 H LYS 7 H LYS 7 9.195 -9.315 3.572 46 HA LYS 7 HA LYS 7 7.258 -9.094 1.514 47 HB2 LYS 7 HB2 LYS 7 6.937 -11.473 1.580 48 HB3 LYS 7 HB3 LYS 7 8.653 -11.112 1.869 49 HG2 LYS 7 HG2 LYS 7 8.256 -12.815 3.444 50 HG3 LYS 7 HG3 LYS 7 8.018 -11.374 4.445 51 HD2 LYS 7 HD2 LYS 7 5.450 -11.665 3.963 52 HD3 LYS 7 HD3 LYS 7 5.872 -13.184 3.154 53 HE2 LYS 7 HE2 LYS 7 6.894 -14.029 5.300 54 HE3 LYS 7 HE3 LYS 7 6.486 -12.486 6.100 55 HZ1 LYS 7 HZ1 LYS 7 4.818 -14.215 6.601 56 HZ2 LYS 7 HZ2 LYS 7 4.476 -14.423 4.907 57 HZ3 LYS 7 HZ3 LYS 7 4.091 -12.918 5.700 58 H GLY 8 H GLY 8 6.904 -9.371 5.156 59 HA2 GLY 8 HA2 GLY 8 4.158 -9.896 5.206 60 HA3 GLY 8 HA3 GLY 8 5.005 -8.917 6.429 61 H VAL 9 H VAL 9 5.865 -6.702 4.784 62 HA VAL 9 HA VAL 9 3.183 -5.378 4.560 63 HB VAL 9 HB VAL 9 5.993 -4.229 5.016 64 HG11 VAL 9 HG11 VAL 9 4.583 -2.626 3.712 65 HG12 VAL 9 HG12 VAL 9 3.254 -2.816 4.894 66 HG13 VAL 9 HG13 VAL 9 4.798 -2.063 5.388 67 HG21 VAL 9 HG21 VAL 9 3.582 -4.492 6.911 68 HG22 VAL 9 HG22 VAL 9 5.073 -5.473 6.992 69 HG23 VAL 9 HG23 VAL 9 5.147 -3.717 7.290 70 H ALA 10 H ALA 10 6.463 -5.223 2.894 71 HA ALA 10 HA ALA 10 5.405 -3.621 0.863 72 HB1 ALA 10 HB1 ALA 10 7.855 -3.786 1.365 73 HB2 ALA 10 HB2 ALA 10 7.867 -5.445 0.688 74 HB3 ALA 10 HB3 ALA 10 7.534 -4.045 -0.375 75 H LYS 11 H LYS 11 5.187 -7.217 1.085 76 HA LYS 11 HA LYS 11 5.379 -7.848 -1.573 77 HB2 LYS 11 HB2 LYS 11 3.870 -9.763 -1.260 78 HB3 LYS 11 HB3 LYS 11 4.982 -9.571 0.112 79 HG2 LYS 11 HG2 LYS 11 3.038 -8.382 1.367 80 HG3 LYS 11 HG3 LYS 11 1.978 -8.822 0.011 81 HD2 LYS 11 HD2 LYS 11 2.353 -11.231 0.390 82 HD3 LYS 11 HD3 LYS 11 3.592 -10.907 1.626 83 HE2 LYS 11 HE2 LYS 11 1.876 -9.777 3.076 84 HE3 LYS 11 HE3 LYS 11 0.619 -10.161 1.866 85 HZ1 LYS 11 HZ1 LYS 11 1.102 -12.576 2.194 86 HZ2 LYS 11 HZ2 LYS 11 0.650 -11.814 3.691 87 HZ3 LYS 11 HZ3 LYS 11 2.320 -12.183 3.382 88 H GLY 12 H GLY 12 2.483 -6.215 -0.054 89 HA2 GLY 12 HA2 GLY 12 1.240 -6.131 -2.807 90 HA3 GLY 12 HA3 GLY 12 0.401 -5.929 -1.258 91 H VAL 13 H VAL 13 3.593 -4.405 -2.178 92 HA VAL 13 HA VAL 13 2.552 -1.900 -1.254 93 HB VAL 13 HB VAL 13 4.977 -2.470 -1.119 94 HG11 VAL 13 HG11 VAL 13 6.497 -2.123 -3.027 95 HG12 VAL 13 HG12 VAL 13 5.352 -3.416 -3.452 96 HG13 VAL 13 HG13 VAL 13 5.134 -1.770 -4.117 97 HG21 VAL 13 HG21 VAL 13 4.156 -0.112 -0.840 98 HG22 VAL 13 HG22 VAL 13 5.796 -0.169 -1.538 99 HG23 VAL 13 HG23 VAL 13 4.396 0.154 -2.590 100 H ALA 14 H ALA 14 3.046 -3.296 -4.595 101 HA ALA 14 HA ALA 14 3.038 -1.035 -6.063 102 HB1 ALA 14 HB1 ALA 14 1.373 -3.542 -6.738 103 HB2 ALA 14 HB2 ALA 14 1.838 -2.268 -7.905 104 HB3 ALA 14 HB3 ALA 14 3.096 -3.273 -7.129 105 H LYS 15 H LYS 15 -0.075 -2.603 -4.918 106 HA LYS 15 HA LYS 15 -1.557 -0.300 -6.019 107 HB2 LYS 15 HB2 LYS 15 -2.320 -2.698 -6.187 108 HB3 LYS 15 HB3 LYS 15 -2.609 -2.708 -4.426 109 HG2 LYS 15 HG2 LYS 15 -4.284 -0.838 -4.705 110 HG3 LYS 15 HG3 LYS 15 -3.933 -0.787 -6.457 111 HD2 LYS 15 HD2 LYS 15 -4.690 -3.203 -6.661 112 HD3 LYS 15 HD3 LYS 15 -5.134 -3.185 -4.932 113 HE2 LYS 15 HE2 LYS 15 -6.793 -1.341 -5.395 114 HE3 LYS 15 HE3 LYS 15 -6.316 -1.349 -7.116 115 HZ1 LYS 15 HZ1 LYS 15 -7.072 -3.691 -7.311 116 HZ2 LYS 15 HZ2 LYS 15 -8.360 -2.657 -6.781 117 HZ3 LYS 15 HZ3 LYS 15 -7.555 -3.688 -5.633 118 H ASP 16 H ASP 16 -0.850 -1.764 -2.725 119 HA ASP 16 HA ASP 16 -2.478 0.013 -1.289 120 HB2 ASP 16 HB2 ASP 16 -1.358 -2.008 -0.276 121 HB3 ASP 16 HB3 ASP 16 0.219 -1.180 -0.397 122 H LEU 17 H LEU 17 0.810 0.595 -2.664 123 HA LEU 17 HA LEU 17 1.599 2.619 -0.977 124 HB2 LEU 17 HB2 LEU 17 2.682 1.693 -3.387 125 HB3 LEU 17 HB3 LEU 17 2.141 3.284 -3.898 126 HG LEU 17 HG LEU 17 4.039 2.637 -1.551 127 HD11 LEU 17 HD11 LEU 17 5.056 2.274 -3.828 128 HD12 LEU 17 HD12 LEU 17 5.803 3.654 -2.984 129 HD13 LEU 17 HD13 LEU 17 4.614 3.943 -4.286 130 HD21 LEU 17 HD21 LEU 17 3.093 5.356 -2.653 131 HD22 LEU 17 HD22 LEU 17 4.438 5.147 -1.490 132 HD23 LEU 17 HD23 LEU 17 2.784 4.703 -1.017 133 H ALA 18 H ALA 18 -0.392 2.920 -4.022 134 HA ALA 18 HA ALA 18 -0.980 5.702 -3.663 135 HB1 ALA 18 HB1 ALA 18 -1.411 4.566 -5.831 136 HB2 ALA 18 HB2 ALA 18 -2.628 3.505 -5.070 137 HB3 ALA 18 HB3 ALA 18 -2.931 5.263 -5.199 138 H GLY 19 H GLY 19 -2.737 2.642 -2.609 139 HA2 GLY 19 HA2 GLY 19 -4.965 3.777 -1.477 140 HA3 GLY 19 HA3 GLY 19 -4.125 2.389 -0.743 141 H LYS 20 H LYS 20 -1.579 4.004 -0.102 142 HA LYS 20 HA LYS 20 -2.746 5.218 2.369 143 HB2 LYS 20 HB2 LYS 20 0.127 4.399 1.729 144 HB3 LYS 20 HB3 LYS 20 -0.463 5.059 3.273 145 HG2 LYS 20 HG2 LYS 20 -1.350 2.389 1.990 146 HG3 LYS 20 HG3 LYS 20 -0.215 2.586 3.350 147 HD2 LYS 20 HD2 LYS 20 -2.149 3.720 4.655 148 HD3 LYS 20 HD3 LYS 20 -3.242 3.178 3.346 149 HE2 LYS 20 HE2 LYS 20 -2.557 0.800 3.760 150 HE3 LYS 20 HE3 LYS 20 -1.515 1.340 5.103 151 HZ1 LYS 20 HZ1 LYS 20 -3.514 2.258 6.246 152 HZ2 LYS 20 HZ2 LYS 20 -3.689 0.556 5.930 153 HZ3 LYS 20 HZ3 LYS 20 -4.529 1.708 4.938 154 H LEU 21 H LEU 21 -0.039 6.138 -0.008 155 HA LEU 21 HA LEU 21 0.013 8.773 1.125 156 HB2 LEU 21 HB2 LEU 21 0.740 7.941 -1.746 157 HB3 LEU 21 HB3 LEU 21 1.073 9.538 -1.030 158 HG LEU 21 HG LEU 21 2.302 6.872 -0.118 159 HD11 LEU 21 HD11 LEU 21 4.416 7.798 -1.058 160 HD12 LEU 21 HD12 LEU 21 3.590 9.322 -1.488 161 HD13 LEU 21 HD13 LEU 21 3.164 7.809 -2.328 162 HD21 LEU 21 HD21 LEU 21 2.728 9.711 0.989 163 HD22 LEU 21 HD22 LEU 21 3.821 8.335 1.313 164 HD23 LEU 21 HD23 LEU 21 2.148 8.276 1.893 165 H LEU 22 H LEU 22 -1.865 7.346 -1.638 166 HA LEU 22 HA LEU 22 -3.368 9.951 -1.819 167 HB2 LEU 22 HB2 LEU 22 -3.406 7.540 -3.700 168 HB3 LEU 22 HB3 LEU 22 -4.098 9.146 -3.999 169 HG LEU 22 HG LEU 22 -1.098 8.435 -3.767 170 HD11 LEU 22 HD11 LEU 22 -2.192 7.653 -5.885 171 HD12 LEU 22 HD12 LEU 22 -1.023 8.960 -6.198 172 HD13 LEU 22 HD13 LEU 22 -2.775 9.313 -6.199 173 HD21 LEU 22 HD21 LEU 22 -0.696 10.816 -4.539 174 HD22 LEU 22 HD22 LEU 22 -1.395 10.740 -2.909 175 HD23 LEU 22 HD23 LEU 22 -2.435 11.160 -4.307 176 H GLU 23 H GLU 23 -3.826 8.546 0.600 177 HA GLU 23 HA GLU 23 -6.029 6.722 0.268 178 HB2 GLU 23 HB2 GLU 23 -4.693 6.914 2.390 179 HB3 GLU 23 HB3 GLU 23 -5.388 8.532 2.679 180 HG2 GLU 23 HG2 GLU 23 -7.698 7.478 2.736 181 HG3 GLU 23 HG3 GLU 23 -6.950 5.876 2.499 182 H THR 24 H THR 24 -5.775 10.307 0.907 183 HA THR 24 HA THR 24 -8.406 10.954 1.168 184 HB THR 24 HB THR 24 -6.574 12.615 1.235 185 HG1 THR 24 HG1 THR 24 -7.933 14.280 0.226 186 HG21 THR 24 HG21 THR 24 -5.344 11.902 -0.912 187 HG22 THR 24 HG22 THR 24 -5.685 13.652 -0.840 188 HG23 THR 24 HG23 THR 24 -6.695 12.595 -1.857 189 H LEU 25 H LEU 25 -6.940 9.898 -1.948 190 HA LEU 25 HA LEU 25 -9.677 10.200 -3.135 191 HB2 LEU 25 HB2 LEU 25 -8.808 11.020 -5.214 192 HB3 LEU 25 HB3 LEU 25 -8.293 12.018 -3.841 193 HG LEU 25 HG LEU 25 -6.034 10.592 -3.997 194 HD11 LEU 25 HD11 LEU 25 -5.451 9.881 -6.306 195 HD12 LEU 25 HD12 LEU 25 -7.050 10.391 -6.913 196 HD13 LEU 25 HD13 LEU 25 -6.912 8.987 -5.837 197 HD21 LEU 25 HD21 LEU 25 -6.739 12.783 -6.033 198 HD22 LEU 25 HD22 LEU 25 -5.085 12.271 -5.586 199 HD23 LEU 25 HD23 LEU 25 -6.136 13.037 -4.371 200 H LYS 26 H LYS 26 -6.586 8.180 -3.432 201 HA LYS 26 HA LYS 26 -7.802 6.478 -5.313 202 HB2 LYS 26 HB2 LYS 26 -5.339 6.444 -4.700 203 HB3 LYS 26 HB3 LYS 26 -5.755 5.642 -3.173 204 HG2 LYS 26 HG2 LYS 26 -5.064 3.887 -4.606 205 HG3 LYS 26 HG3 LYS 26 -6.833 3.749 -4.582 206 HD2 LYS 26 HD2 LYS 26 -6.982 4.798 -6.840 207 HD3 LYS 26 HD3 LYS 26 -5.261 5.260 -6.777 208 HE2 LYS 26 HE2 LYS 26 -5.484 3.368 -8.265 209 HE3 LYS 26 HE3 LYS 26 -4.583 2.849 -6.821 210 HZ1 LYS 26 HZ1 LYS 26 -6.264 1.194 -7.555 211 HZ2 LYS 26 HZ2 LYS 26 -7.530 2.360 -7.341 212 HZ3 LYS 26 HZ3 LYS 26 -6.627 1.755 -5.961 213 H CYS 27 H CYS 27 -7.582 6.098 -1.647 214 HA CYS 27 HA CYS 27 -9.119 3.716 -1.647 215 HB2 CYS 27 HB2 CYS 27 -8.725 5.834 0.545 216 HB3 CYS 27 HB3 CYS 27 -9.706 4.371 0.800 217 H LYS 28 H LYS 28 -10.198 7.196 -1.573 218 HA LYS 28 HA LYS 28 -12.948 6.490 -1.026 219 HB2 LYS 28 HB2 LYS 28 -11.668 8.936 -2.360 220 HB3 LYS 28 HB3 LYS 28 -13.428 8.716 -2.335 221 HG2 LYS 28 HG2 LYS 28 -12.655 10.155 -0.455 222 HG3 LYS 28 HG3 LYS 28 -13.547 8.709 0.084 223 HD2 LYS 28 HD2 LYS 28 -11.412 7.581 0.724 224 HD3 LYS 28 HD3 LYS 28 -10.478 8.975 0.112 225 HE2 LYS 28 HE2 LYS 28 -11.525 10.452 1.824 226 HE3 LYS 28 HE3 LYS 28 -12.544 9.101 2.395 227 HZ1 LYS 28 HZ1 LYS 28 -9.514 9.176 2.494 228 HZ2 LYS 28 HZ2 LYS 28 -10.513 7.863 3.061 229 HZ3 LYS 28 HZ3 LYS 28 -10.583 9.415 3.843 230 H ILE 29 H ILE 29 -10.987 6.683 -4.094 231 HA ILE 29 HA ILE 29 -13.345 6.252 -5.725 232 HB ILE 29 HB ILE 29 -10.367 6.028 -6.364 233 HG12 ILE 29 HG12 ILE 29 -12.440 8.074 -7.362 234 HG13 ILE 29 HG13 ILE 29 -11.543 8.329 -5.856 235 HG21 ILE 29 HG21 ILE 29 -11.596 4.436 -7.838 236 HG22 ILE 29 HG22 ILE 29 -12.776 5.709 -8.255 237 HG23 ILE 29 HG23 ILE 29 -11.074 5.842 -8.779 238 HD11 ILE 29 HD11 ILE 29 -10.248 8.055 -8.638 239 HD12 ILE 29 HD12 ILE 29 -10.402 9.529 -7.653 240 HD13 ILE 29 HD13 ILE 29 -9.355 8.197 -7.094 241 H THR 30 H THR 30 -10.509 3.950 -5.122 242 HA THR 30 HA THR 30 -12.099 1.832 -6.197 243 HB THR 30 HB THR 30 -9.615 1.804 -6.219 244 HG1 THR 30 HG1 THR 30 -9.645 -0.541 -5.842 245 HG21 THR 30 HG21 THR 30 -8.356 0.927 -4.243 246 HG22 THR 30 HG22 THR 30 -9.839 0.910 -3.264 247 HG23 THR 30 HG23 THR 30 -9.133 2.462 -3.794 248 H GLY 31 H GLY 31 -11.698 3.001 -2.801 249 HA2 GLY 31 HA2 GLY 31 -13.020 2.309 -0.939 250 HA3 GLY 31 HA3 GLY 31 -13.757 1.040 -1.934 251 H CYS 32 H CYS 32 -10.534 2.076 -0.529 252 HA CYS 32 HA CYS 32 -9.422 -0.579 -1.041 253 HB2 CYS 32 HB2 CYS 32 -7.360 0.231 -0.054 254 HB3 CYS 32 HB3 CYS 32 -8.006 1.513 -1.114 Start of MODEL 20 1 H1 GLY 1 H1 GLY 1 12.063 -9.829 11.716 2 HA2 GLY 1 HA2 GLY 1 14.577 -10.576 10.309 3 HA3 GLY 1 HA3 GLY 1 12.999 -11.297 9.885 4 H ILE 2 H ILE 2 14.933 -9.451 8.230 5 HA ILE 2 HA ILE 2 13.228 -7.057 7.878 6 HB ILE 2 HB ILE 2 15.679 -8.005 6.304 7 HG12 ILE 2 HG12 ILE 2 15.337 -5.768 8.412 8 HG13 ILE 2 HG13 ILE 2 16.128 -7.337 8.692 9 HG21 ILE 2 HG21 ILE 2 15.586 -5.764 5.198 10 HG22 ILE 2 HG22 ILE 2 14.077 -6.635 4.902 11 HG23 ILE 2 HG23 ILE 2 14.125 -5.349 6.141 12 HD11 ILE 2 HD11 ILE 2 17.878 -5.698 8.337 13 HD12 ILE 2 HD12 ILE 2 17.844 -6.756 6.897 14 HD13 ILE 2 HD13 ILE 2 17.147 -5.106 6.830 15 H LEU 3 H LEU 3 14.237 -9.998 5.874 16 HA LEU 3 HA LEU 3 12.440 -9.418 3.822 17 HB2 LEU 3 HB2 LEU 3 12.620 -11.709 3.049 18 HB3 LEU 3 HB3 LEU 3 14.183 -11.115 3.637 19 HG LEU 3 HG LEU 3 13.468 -12.369 5.920 20 HD11 LEU 3 HD11 LEU 3 12.123 -14.429 5.528 21 HD12 LEU 3 HD12 LEU 3 11.871 -13.988 3.818 22 HD13 LEU 3 HD13 LEU 3 11.115 -13.032 5.110 23 HD21 LEU 3 HD21 LEU 3 15.457 -12.983 4.561 24 HD22 LEU 3 HD22 LEU 3 14.417 -13.873 3.411 25 HD23 LEU 3 HD23 LEU 3 14.602 -14.451 5.093 26 H SER 4 H SER 4 11.744 -10.975 7.040 27 HA SER 4 HA SER 4 9.136 -11.871 6.316 28 HB2 SER 4 HB2 SER 4 8.611 -11.806 8.730 29 HB3 SER 4 HB3 SER 4 10.213 -12.562 8.439 30 HG SER 4 HG SER 4 10.291 -10.893 10.146 31 H SER 5 H SER 5 10.333 -8.731 7.796 32 HA SER 5 HA SER 5 7.781 -7.527 7.940 33 HB2 SER 5 HB2 SER 5 10.463 -6.119 7.378 34 HB3 SER 5 HB3 SER 5 8.990 -5.355 8.034 35 HG SER 5 HG SER 5 9.292 -6.834 9.901 36 H PHE 6 H PHE 6 10.191 -7.620 5.179 37 HA PHE 6 HA PHE 6 8.642 -5.734 3.631 38 HB2 PHE 6 HB2 PHE 6 10.979 -7.553 2.917 39 HB3 PHE 6 HB3 PHE 6 9.961 -6.889 1.631 40 HD1 PHE 6 HD1 PHE 6 11.595 -5.652 4.839 41 HD2 PHE 6 HD2 PHE 6 10.618 -4.797 0.731 42 HE1 PHE 6 HE1 PHE 6 12.721 -3.464 5.020 43 HE2 PHE 6 HE2 PHE 6 11.765 -2.624 0.918 44 HZ PHE 6 HZ PHE 6 12.821 -1.944 3.060 45 H LYS 7 H LYS 7 9.051 -9.394 3.132 46 HA LYS 7 HA LYS 7 6.999 -9.411 1.229 47 HB2 LYS 7 HB2 LYS 7 6.814 -11.805 1.430 48 HB3 LYS 7 HB3 LYS 7 8.512 -11.326 1.631 49 HG2 LYS 7 HG2 LYS 7 8.304 -12.906 3.336 50 HG3 LYS 7 HG3 LYS 7 7.928 -11.426 4.249 51 HD2 LYS 7 HD2 LYS 7 5.418 -11.963 3.861 52 HD3 LYS 7 HD3 LYS 7 5.932 -13.488 3.114 53 HE2 LYS 7 HE2 LYS 7 6.497 -12.598 6.020 54 HE3 LYS 7 HE3 LYS 7 5.233 -13.742 5.503 55 HZ1 LYS 7 HZ1 LYS 7 7.088 -15.007 6.333 56 HZ2 LYS 7 HZ2 LYS 7 8.234 -14.187 5.343 57 HZ3 LYS 7 HZ3 LYS 7 7.038 -15.235 4.609 58 H GLY 8 H GLY 8 6.694 -9.336 4.853 59 HA2 GLY 8 HA2 GLY 8 3.930 -10.003 4.907 60 HA3 GLY 8 HA3 GLY 8 4.759 -8.980 6.103 61 H VAL 9 H VAL 9 5.624 -6.764 4.623 62 HA VAL 9 HA VAL 9 2.947 -5.495 4.187 63 HB VAL 9 HB VAL 9 5.697 -4.270 4.795 64 HG11 VAL 9 HG11 VAL 9 4.419 -2.146 5.121 65 HG12 VAL 9 HG12 VAL 9 4.294 -2.706 3.436 66 HG13 VAL 9 HG13 VAL 9 2.923 -2.945 4.559 67 HG21 VAL 9 HG21 VAL 9 3.210 -4.630 6.575 68 HG22 VAL 9 HG22 VAL 9 4.733 -5.551 6.726 69 HG23 VAL 9 HG23 VAL 9 4.723 -3.795 7.029 70 H ALA 10 H ALA 10 6.314 -5.292 2.731 71 HA ALA 10 HA ALA 10 5.492 -3.691 0.627 72 HB1 ALA 10 HB1 ALA 10 7.610 -4.342 -0.527 73 HB2 ALA 10 HB2 ALA 10 7.901 -4.075 1.215 74 HB3 ALA 10 HB3 ALA 10 7.791 -5.741 0.571 75 H LYS 11 H LYS 11 5.068 -7.290 0.839 76 HA LYS 11 HA LYS 11 5.213 -7.946 -1.792 77 HB2 LYS 11 HB2 LYS 11 3.515 -9.704 -1.517 78 HB3 LYS 11 HB3 LYS 11 4.626 -9.644 -0.133 79 HG2 LYS 11 HG2 LYS 11 2.844 -8.357 1.177 80 HG3 LYS 11 HG3 LYS 11 1.746 -8.504 -0.222 81 HD2 LYS 11 HD2 LYS 11 1.765 -10.967 -0.080 82 HD3 LYS 11 HD3 LYS 11 2.919 -10.924 1.276 83 HE2 LYS 11 HE2 LYS 11 1.249 -9.658 2.668 84 HE3 LYS 11 HE3 LYS 11 0.084 -9.710 1.317 85 HZ1 LYS 11 HZ1 LYS 11 0.095 -12.181 1.435 86 HZ2 LYS 11 HZ2 LYS 11 -0.373 -11.478 2.956 87 HZ3 LYS 11 HZ3 LYS 11 1.231 -12.125 2.761 88 H GLY 12 H GLY 12 2.405 -6.095 -0.355 89 HA2 GLY 12 HA2 GLY 12 1.243 -5.958 -3.149 90 HA3 GLY 12 HA3 GLY 12 0.346 -5.818 -1.624 91 H VAL 13 H VAL 13 3.574 -4.303 -2.440 92 HA VAL 13 HA VAL 13 2.601 -1.841 -1.382 93 HB VAL 13 HB VAL 13 5.019 -2.459 -1.351 94 HG11 VAL 13 HG11 VAL 13 5.305 -3.253 -3.744 95 HG12 VAL 13 HG12 VAL 13 5.083 -1.570 -4.307 96 HG13 VAL 13 HG13 VAL 13 6.479 -1.998 -3.291 97 HG21 VAL 13 HG21 VAL 13 4.346 0.248 -2.611 98 HG22 VAL 13 HG22 VAL 13 4.254 -0.128 -0.866 99 HG23 VAL 13 HG23 VAL 13 5.835 -0.121 -1.695 100 H ALA 14 H ALA 14 2.983 -3.070 -4.811 101 HA ALA 14 HA ALA 14 2.791 -0.712 -6.164 102 HB1 ALA 14 HB1 ALA 14 2.919 -2.905 -7.345 103 HB2 ALA 14 HB2 ALA 14 1.239 -3.289 -6.867 104 HB3 ALA 14 HB3 ALA 14 1.563 -1.939 -7.997 105 H LYS 15 H LYS 15 -0.056 -2.535 -4.785 106 HA LYS 15 HA LYS 15 -1.861 -0.368 -5.689 107 HB2 LYS 15 HB2 LYS 15 -2.413 -2.908 -4.058 108 HB3 LYS 15 HB3 LYS 15 -3.636 -1.742 -4.633 109 HG2 LYS 15 HG2 LYS 15 -3.051 -2.216 -7.005 110 HG3 LYS 15 HG3 LYS 15 -1.687 -3.241 -6.506 111 HD2 LYS 15 HD2 LYS 15 -3.511 -4.669 -7.217 112 HD3 LYS 15 HD3 LYS 15 -3.255 -4.894 -5.468 113 HE2 LYS 15 HE2 LYS 15 -5.256 -3.487 -4.969 114 HE3 LYS 15 HE3 LYS 15 -5.441 -3.095 -6.702 115 HZ1 LYS 15 HZ1 LYS 15 -5.877 -5.483 -7.171 116 HZ2 LYS 15 HZ2 LYS 15 -6.991 -4.878 -5.984 117 HZ3 LYS 15 HZ3 LYS 15 -5.655 -5.873 -5.487 118 H ASP 16 H ASP 16 -0.589 -1.715 -2.501 119 HA ASP 16 HA ASP 16 -2.243 -0.073 -0.936 120 HB2 ASP 16 HB2 ASP 16 -0.905 -1.969 0.005 121 HB3 ASP 16 HB3 ASP 16 0.593 -1.032 -0.229 122 H LEU 17 H LEU 17 1.142 0.621 -2.155 123 HA LEU 17 HA LEU 17 1.571 2.984 -0.893 124 HB2 LEU 17 HB2 LEU 17 2.570 1.896 -3.451 125 HB3 LEU 17 HB3 LEU 17 2.217 3.589 -3.723 126 HG LEU 17 HG LEU 17 4.055 2.548 -1.500 127 HD11 LEU 17 HD11 LEU 17 4.727 3.973 -4.161 128 HD12 LEU 17 HD12 LEU 17 4.992 2.239 -3.848 129 HD13 LEU 17 HD13 LEU 17 5.901 3.455 -2.918 130 HD21 LEU 17 HD21 LEU 17 3.059 4.738 -0.823 131 HD22 LEU 17 HD22 LEU 17 3.405 5.412 -2.440 132 HD23 LEU 17 HD23 LEU 17 4.739 4.996 -1.327 133 H ALA 18 H ALA 18 -0.353 2.581 -3.951 134 HA ALA 18 HA ALA 18 -1.047 5.326 -4.182 135 HB1 ALA 18 HB1 ALA 18 -2.880 4.550 -5.672 136 HB2 ALA 18 HB2 ALA 18 -1.387 3.645 -6.020 137 HB3 ALA 18 HB3 ALA 18 -2.702 2.877 -5.085 138 H GLY 19 H GLY 19 -2.835 2.550 -2.547 139 HA2 GLY 19 HA2 GLY 19 -5.005 4.147 -1.680 140 HA3 GLY 19 HA3 GLY 19 -4.462 2.652 -0.882 141 H LYS 20 H LYS 20 -1.638 4.128 -0.388 142 HA LYS 20 HA LYS 20 -2.621 5.307 2.167 143 HB2 LYS 20 HB2 LYS 20 0.178 4.481 1.245 144 HB3 LYS 20 HB3 LYS 20 -0.192 5.228 2.816 145 HG2 LYS 20 HG2 LYS 20 -1.431 2.567 1.850 146 HG3 LYS 20 HG3 LYS 20 0.051 2.692 2.833 147 HD2 LYS 20 HD2 LYS 20 -1.253 3.864 4.649 148 HD3 LYS 20 HD3 LYS 20 -2.758 3.621 3.720 149 HE2 LYS 20 HE2 LYS 20 -2.467 1.159 3.812 150 HE3 LYS 20 HE3 LYS 20 -0.936 1.355 4.710 151 HZ1 LYS 20 HZ1 LYS 20 -3.675 2.266 5.664 152 HZ2 LYS 20 HZ2 LYS 20 -2.181 2.453 6.545 153 HZ3 LYS 20 HZ3 LYS 20 -2.810 0.865 6.225 154 H LEU 21 H LEU 21 -0.133 6.272 -0.411 155 HA LEU 21 HA LEU 21 -0.013 8.905 0.735 156 HB2 LEU 21 HB2 LEU 21 0.551 8.084 -2.174 157 HB3 LEU 21 HB3 LEU 21 0.939 9.671 -1.461 158 HG LEU 21 HG LEU 21 2.180 6.983 -0.631 159 HD11 LEU 21 HD11 LEU 21 3.418 9.407 -2.086 160 HD12 LEU 21 HD12 LEU 21 2.943 7.879 -2.877 161 HD13 LEU 21 HD13 LEU 21 4.258 7.886 -1.672 162 HD21 LEU 21 HD21 LEU 21 2.711 9.816 0.452 163 HD22 LEU 21 HD22 LEU 21 3.794 8.421 0.717 164 HD23 LEU 21 HD23 LEU 21 2.156 8.394 1.389 165 H LEU 22 H LEU 22 -2.091 7.458 -1.880 166 HA LEU 22 HA LEU 22 -3.584 10.078 -1.950 167 HB2 LEU 22 HB2 LEU 22 -3.800 7.684 -3.819 168 HB3 LEU 22 HB3 LEU 22 -4.479 9.311 -4.064 169 HG LEU 22 HG LEU 22 -1.478 8.554 -4.066 170 HD11 LEU 22 HD11 LEU 22 -2.694 7.746 -6.089 171 HD12 LEU 22 HD12 LEU 22 -1.597 9.086 -6.503 172 HD13 LEU 22 HD13 LEU 22 -3.355 9.385 -6.365 173 HD21 LEU 22 HD21 LEU 22 -2.832 11.288 -4.544 174 HD22 LEU 22 HD22 LEU 22 -1.114 10.925 -4.880 175 HD23 LEU 22 HD23 LEU 22 -1.713 10.870 -3.210 176 H GLU 23 H GLU 23 -3.826 8.639 0.479 177 HA GLU 23 HA GLU 23 -6.046 6.841 0.355 178 HB2 GLU 23 HB2 GLU 23 -4.573 7.064 2.378 179 HB3 GLU 23 HB3 GLU 23 -5.225 8.698 2.673 180 HG2 GLU 23 HG2 GLU 23 -7.544 7.680 2.941 181 HG3 GLU 23 HG3 GLU 23 -6.840 6.060 2.690 182 H THR 24 H THR 24 -5.753 10.429 0.836 183 HA THR 24 HA THR 24 -8.349 11.067 1.318 184 HB THR 24 HB THR 24 -6.531 12.743 1.164 185 HG1 THR 24 HG1 THR 24 -7.980 14.370 0.221 186 HG21 THR 24 HG21 THR 24 -5.841 13.707 -1.025 187 HG22 THR 24 HG22 THR 24 -6.926 12.597 -1.900 188 HG23 THR 24 HG23 THR 24 -5.489 11.958 -1.054 189 H LEU 25 H LEU 25 -7.201 9.849 -1.886 190 HA LEU 25 HA LEU 25 -10.052 10.061 -2.754 191 HB2 LEU 25 HB2 LEU 25 -9.505 10.972 -4.902 192 HB3 LEU 25 HB3 LEU 25 -8.827 11.976 -3.608 193 HG LEU 25 HG LEU 25 -6.578 10.589 -4.100 194 HD11 LEU 25 HD11 LEU 25 -7.714 9.034 -5.860 195 HD12 LEU 25 HD12 LEU 25 -6.309 9.935 -6.479 196 HD13 LEU 25 HD13 LEU 25 -7.967 10.470 -6.866 197 HD21 LEU 25 HD21 LEU 25 -5.876 12.332 -5.759 198 HD22 LEU 25 HD22 LEU 25 -6.760 13.046 -4.391 199 HD23 LEU 25 HD23 LEU 25 -7.587 12.814 -5.956 200 H LYS 26 H LYS 26 -6.896 8.229 -3.505 201 HA LYS 26 HA LYS 26 -8.361 6.436 -5.177 202 HB2 LYS 26 HB2 LYS 26 -5.797 5.957 -3.553 203 HB3 LYS 26 HB3 LYS 26 -6.495 4.751 -4.650 204 HG2 LYS 26 HG2 LYS 26 -5.651 7.571 -5.584 205 HG3 LYS 26 HG3 LYS 26 -4.596 6.144 -5.605 206 HD2 LYS 26 HD2 LYS 26 -6.235 4.944 -7.104 207 HD3 LYS 26 HD3 LYS 26 -7.197 6.445 -7.217 208 HE2 LYS 26 HE2 LYS 26 -5.218 7.654 -8.166 209 HE3 LYS 26 HE3 LYS 26 -4.241 6.164 -8.051 210 HZ1 LYS 26 HZ1 LYS 26 -6.749 6.486 -9.729 211 HZ2 LYS 26 HZ2 LYS 26 -5.789 5.034 -9.603 212 HZ3 LYS 26 HZ3 LYS 26 -5.111 6.466 -10.319 213 H CYS 27 H CYS 27 -7.395 6.154 -1.632 214 HA CYS 27 HA CYS 27 -8.539 3.639 -1.331 215 HB2 CYS 27 HB2 CYS 27 -7.193 4.695 0.496 216 HB3 CYS 27 HB3 CYS 27 -8.554 5.822 0.821 217 H LYS 28 H LYS 28 -10.185 6.880 -1.318 218 HA LYS 28 HA LYS 28 -12.708 5.788 -0.379 219 HB2 LYS 28 HB2 LYS 28 -12.058 8.340 -1.969 220 HB3 LYS 28 HB3 LYS 28 -13.718 7.833 -1.587 221 HG2 LYS 28 HG2 LYS 28 -12.963 9.494 0.017 222 HG3 LYS 28 HG3 LYS 28 -13.308 7.953 0.845 223 HD2 LYS 28 HD2 LYS 28 -10.873 7.438 0.976 224 HD3 LYS 28 HD3 LYS 28 -10.500 8.925 0.055 225 HE2 LYS 28 HE2 LYS 28 -11.768 8.775 2.863 226 HE3 LYS 28 HE3 LYS 28 -10.070 9.166 2.489 227 HZ1 LYS 28 HZ1 LYS 28 -11.176 11.230 2.901 228 HZ2 LYS 28 HZ2 LYS 28 -12.509 10.865 1.883 229 HZ3 LYS 28 HZ3 LYS 28 -10.938 11.168 1.180 230 H ILE 29 H ILE 29 -11.238 6.412 -3.670 231 HA ILE 29 HA ILE 29 -13.631 5.647 -5.048 232 HB ILE 29 HB ILE 29 -10.733 5.776 -5.992 233 HG12 ILE 29 HG12 ILE 29 -13.107 7.584 -6.750 234 HG13 ILE 29 HG13 ILE 29 -12.106 7.927 -5.330 235 HG21 ILE 29 HG21 ILE 29 -11.656 5.542 -8.336 236 HG22 ILE 29 HG22 ILE 29 -11.910 4.073 -7.382 237 HG23 ILE 29 HG23 ILE 29 -13.268 5.201 -7.648 238 HD11 ILE 29 HD11 ILE 29 -11.280 9.262 -7.199 239 HD12 ILE 29 HD12 ILE 29 -10.045 8.048 -6.770 240 HD13 ILE 29 HD13 ILE 29 -11.059 7.826 -8.226 241 H THR 30 H THR 30 -10.496 3.702 -4.750 242 HA THR 30 HA THR 30 -11.859 1.383 -5.691 243 HB THR 30 HB THR 30 -9.372 1.667 -5.791 244 HG1 THR 30 HG1 THR 30 -9.125 -0.665 -5.394 245 HG21 THR 30 HG21 THR 30 -9.429 0.762 -2.826 246 HG22 THR 30 HG22 THR 30 -8.964 2.398 -3.371 247 HG23 THR 30 HG23 THR 30 -7.979 0.991 -3.836 248 H GLY 31 H GLY 31 -11.641 2.795 -2.388 249 HA2 GLY 31 HA2 GLY 31 -12.876 2.077 -0.505 250 HA3 GLY 31 HA3 GLY 31 -13.473 0.692 -1.437 251 H CYS 32 H CYS 32 -10.189 2.006 -0.439 252 HA CYS 32 HA CYS 32 -9.103 -0.640 -0.318 253 HB2 CYS 32 HB2 CYS 32 -7.066 0.248 0.478 254 HB3 CYS 32 HB3 CYS 32 -7.686 1.503 -0.612
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