NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
627775 | 5w0y | 30301 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 1H GLY 1 -22.116 10.260 2.259 2 H2 GLY 1 2H GLY 1 -21.231 11.194 3.353 3 H3 GLY 1 3H GLY 1 -22.396 10.104 3.917 4 HA2 GLY 1 1HA GLY 1 -20.183 9.216 4.242 5 HA3 GLY 1 2HA GLY 1 -21.113 8.243 3.112 6 H SER 2 H SER 2 -18.133 9.023 3.572 7 HA SER 2 HA SER 2 -17.486 10.083 0.936 8 HB2 SER 2 1HB SER 2 -16.294 10.922 2.956 9 HB3 SER 2 2HB SER 2 -15.642 9.306 3.212 10 HG SER 2 HG SER 2 -15.249 10.387 0.687 11 H GLY 3 H GLY 3 -17.735 7.095 2.587 12 HA2 GLY 3 1HA GLY 3 -17.738 5.031 1.365 13 HA3 GLY 3 2HA GLY 3 -16.548 5.721 0.268 14 H SER 4 H SER 4 -15.395 6.805 2.985 15 HA SER 4 HA SER 4 -13.649 4.495 3.353 16 HB2 SER 4 1HB SER 4 -12.202 6.234 4.554 17 HB3 SER 4 2HB SER 4 -12.395 6.427 2.813 18 HG SER 4 HG SER 4 -13.566 7.899 4.912 19 H SER 5 H SER 5 -15.521 3.547 4.538 20 HA SER 5 HA SER 5 -15.884 4.506 7.252 21 HB2 SER 5 1HB SER 5 -16.944 1.997 5.924 22 HB3 SER 5 2HB SER 5 -17.489 2.685 7.454 23 HG SER 5 HG SER 5 -17.834 4.655 5.968 24 H GLN 6 H GLN 6 -14.198 2.028 5.489 25 HA GLN 6 HA GLN 6 -13.302 0.678 7.891 26 HB2 GLN 6 1HB GLN 6 -12.596 0.206 4.992 27 HB3 GLN 6 2HB GLN 6 -12.118 -0.822 6.331 28 HG2 GLN 6 1HG GLN 6 -14.948 -0.287 5.481 29 HG3 GLN 6 2HG GLN 6 -14.004 -1.720 5.078 30 HE21 GLN 6 1HE2 GLN 6 -14.430 -3.262 8.179 31 HE22 GLN 6 2HE2 GLN 6 -13.566 -3.240 6.683 32 H CYS 7 H CYS 7 -10.875 0.132 7.912 33 HA CYS 7 HA CYS 7 -8.707 0.708 8.094 34 HB2 CYS 7 2HB CYS 7 -8.796 1.299 5.732 35 HB3 CYS 7 1HB CYS 7 -9.414 2.888 6.144 36 H ASN 8 H ASN 8 -8.202 1.382 10.049 37 HA ASN 8 HA ASN 8 -9.288 3.900 11.046 38 HB2 ASN 8 1HB ASN 8 -7.667 1.765 12.452 39 HB3 ASN 8 2HB ASN 8 -8.334 3.199 13.224 40 HD21 ASN 8 1HD2 ASN 8 -10.646 -0.032 12.473 41 HD22 ASN 8 2HD2 ASN 8 -9.005 0.064 11.938 42 H ALA 9 H ALA 9 -6.525 2.773 9.504 43 HA ALA 9 HA ALA 9 -4.730 4.713 10.738 44 HB1 ALA 9 1HB ALA 9 -2.986 3.669 9.388 45 HB2 ALA 9 2HB ALA 9 -4.196 2.671 8.583 46 HB3 ALA 9 3HB ALA 9 -3.886 2.461 10.306 47 H GLY 10 H GLY 10 -7.038 4.876 8.463 48 HA2 GLY 10 1HA GLY 10 -6.620 7.391 7.582 49 HA3 GLY 10 2HA GLY 10 -5.638 6.436 6.477 50 HA PRO 11 HA PRO 11 -9.837 6.195 4.666 51 HB2 PRO 11 2HB PRO 11 -9.230 6.948 2.179 52 HB3 PRO 11 1HB PRO 11 -9.416 8.147 3.467 53 HG2 PRO 11 2HG PRO 11 -6.923 6.994 2.293 54 HG3 PRO 11 1HG PRO 11 -7.272 8.676 2.734 55 HD2 PRO 11 2HD PRO 11 -5.842 6.906 4.303 56 HD3 PRO 11 1HD PRO 11 -6.693 8.335 4.922 57 H VAL 12 H VAL 12 -10.592 4.770 2.978 58 HA VAL 12 HA VAL 12 -9.248 2.273 2.951 59 HB VAL 12 HB VAL 12 -11.057 1.644 1.265 60 HG11 VAL 12 1HG1 VAL 12 -11.915 2.783 3.923 61 HG12 VAL 12 2HG1 VAL 12 -11.228 1.180 3.659 62 HG13 VAL 12 3HG1 VAL 12 -12.800 1.589 2.973 63 HG21 VAL 12 1HG2 VAL 12 -11.471 3.921 0.411 64 HG22 VAL 12 2HG2 VAL 12 -12.092 4.390 1.992 65 HG23 VAL 12 3HG2 VAL 12 -12.941 3.175 1.040 66 H GLN 13 H GLN 13 -8.049 1.282 1.381 67 HA GLN 13 HA GLN 13 -7.370 2.975 -0.932 68 HB2 GLN 13 1HB GLN 13 -5.547 0.989 0.433 69 HB3 GLN 13 2HB GLN 13 -5.128 2.096 -0.859 70 HG2 GLN 13 1HG GLN 13 -6.015 2.954 1.876 71 HG3 GLN 13 2HG GLN 13 -4.338 2.806 1.360 72 HE21 GLN 13 1HE2 GLN 13 -5.736 6.303 0.972 73 HE22 GLN 13 2HE2 GLN 13 -5.898 5.140 2.242 74 H CYS 14 H CYS 14 -7.105 2.066 -2.895 75 HA CYS 14 HA CYS 14 -7.862 -0.762 -3.220 76 HB2 CYS 14 2HB CYS 14 -9.602 0.691 -4.108 77 HB3 CYS 14 1HB CYS 14 -8.423 1.598 -5.042 78 H CYS 15 H CYS 15 -5.969 -1.755 -3.435 79 HA CYS 15 HA CYS 15 -3.812 -0.465 -4.925 80 HB2 CYS 15 2HB CYS 15 -3.792 -2.977 -3.235 81 HB3 CYS 15 1HB CYS 15 -2.382 -2.219 -3.951 82 H ASN 16 H ASN 16 -2.892 -1.317 -6.727 83 HA ASN 16 HA ASN 16 -4.308 -3.155 -8.352 84 HB2 ASN 16 1HB ASN 16 -2.638 -1.377 -9.062 85 HB3 ASN 16 2HB ASN 16 -1.390 -2.490 -8.542 86 HD21 ASN 16 1HD2 ASN 16 -1.329 -3.568 -11.855 87 HD22 ASN 16 2HD2 ASN 16 -0.536 -2.651 -10.619 88 H THR 17 H THR 17 -1.732 -3.407 -6.049 89 HA THR 17 HA THR 17 -2.027 -6.292 -5.968 90 HB THR 17 HB THR 17 0.598 -4.959 -6.672 91 HG1 THR 17 1HG THR 17 -1.311 -5.897 -8.181 92 HG21 THR 17 1HG2 THR 17 0.038 -7.816 -5.879 93 HG22 THR 17 2HG2 THR 17 1.093 -6.663 -5.053 94 HG23 THR 17 3HG2 THR 17 1.525 -7.273 -6.653 95 H LEU 18 H LEU 18 -2.123 -6.838 -3.868 96 HA LEU 18 HA LEU 18 -0.671 -5.207 -1.912 97 HB2 LEU 18 1HB LEU 18 -2.742 -7.377 -1.611 98 HB3 LEU 18 2HB LEU 18 -1.791 -6.810 -0.254 99 HG LEU 18 HG LEU 18 -3.710 -5.178 -1.895 100 HD11 LEU 18 1HD1 LEU 18 -3.798 -5.921 1.028 101 HD12 LEU 18 2HD1 LEU 18 -4.663 -6.797 -0.236 102 HD13 LEU 18 3HD1 LEU 18 -5.051 -5.109 0.086 103 HD21 LEU 18 1HD2 LEU 18 -1.799 -3.828 -1.253 104 HD22 LEU 18 2HD2 LEU 18 -1.957 -4.367 0.417 105 HD23 LEU 18 3HD2 LEU 18 -3.216 -3.373 -0.313 106 H THR 19 H THR 19 1.299 -5.767 -1.447 107 HA THR 19 HA THR 19 2.036 -8.550 -1.195 108 HB THR 19 HB THR 19 2.400 -8.266 -3.563 109 HG1 THR 19 1HG THR 19 4.150 -9.380 -3.282 110 HG21 THR 19 1HG2 THR 19 2.537 -5.896 -3.818 111 HG22 THR 19 2HG2 THR 19 4.048 -6.578 -4.420 112 HG23 THR 19 3HG2 THR 19 3.996 -5.816 -2.830 113 H SER 20 H SER 20 4.718 -8.361 -0.915 114 HA SER 20 HA SER 20 4.896 -6.702 1.489 115 HB2 SER 20 1HB SER 20 6.744 -8.888 0.501 116 HB3 SER 20 2HB SER 20 6.781 -8.125 2.092 117 HG SER 20 HG SER 20 4.580 -9.581 1.036 118 H ALA 21 H ALA 21 6.927 -5.567 1.925 119 HA ALA 21 HA ALA 21 7.569 -3.831 -0.214 120 HB1 ALA 21 1HB ALA 21 8.976 -4.168 2.432 121 HB2 ALA 21 2HB ALA 21 7.577 -3.137 2.130 122 HB3 ALA 21 3HB ALA 21 9.115 -2.789 1.341 123 H SER 22 H SER 22 8.678 -6.903 0.368 124 HA SER 22 HA SER 22 11.355 -6.518 -0.630 125 HB2 SER 22 1HB SER 22 10.739 -8.318 1.004 126 HB3 SER 22 2HB SER 22 9.851 -9.104 -0.289 127 HG SER 22 HG SER 22 12.264 -8.542 -1.220 128 H ASN 23 H ASN 23 8.278 -6.680 -1.944 129 HA ASN 23 HA ASN 23 8.831 -8.058 -4.378 130 HB2 ASN 23 1HB ASN 23 6.527 -7.550 -3.360 131 HB3 ASN 23 2HB ASN 23 6.718 -5.928 -4.010 132 HD21 ASN 23 1HD2 ASN 23 5.694 -9.016 -6.394 133 HD22 ASN 23 2HD2 ASN 23 6.078 -9.234 -4.720 134 H SER 24 H SER 24 9.487 -7.285 -6.311 135 HA SER 24 HA SER 24 11.188 -5.073 -6.412 136 HB2 SER 24 1HB SER 24 10.970 -5.476 -8.950 137 HB3 SER 24 2HB SER 24 11.588 -6.800 -7.961 138 HG SER 24 HG SER 24 9.515 -6.858 -9.575 139 H GLN 25 H GLN 25 7.780 -5.406 -7.152 140 HA GLN 25 HA GLN 25 7.434 -2.970 -8.523 141 HB2 GLN 25 1HB GLN 25 5.791 -4.861 -8.464 142 HB3 GLN 25 2HB GLN 25 5.431 -4.438 -6.791 143 HG2 GLN 25 1HG GLN 25 3.749 -3.517 -8.177 144 HG3 GLN 25 2HG GLN 25 4.751 -2.210 -7.550 145 HE21 GLN 25 1HE2 GLN 25 5.924 -1.139 -10.646 146 HE22 GLN 25 2HE2 GLN 25 6.085 -1.066 -8.928 147 H ALA 26 H ALA 26 7.176 -3.916 -5.135 148 HA ALA 26 HA ALA 26 6.299 -1.378 -4.198 149 HB1 ALA 26 1HB ALA 26 7.602 -3.655 -2.707 150 HB2 ALA 26 2HB ALA 26 5.871 -3.442 -2.970 151 HB3 ALA 26 3HB ALA 26 6.762 -2.286 -1.979 152 H ALA 27 H ALA 27 9.461 -3.042 -3.969 153 HA ALA 27 HA ALA 27 10.752 -0.927 -2.642 154 HB1 ALA 27 1HB ALA 27 11.642 -3.210 -2.695 155 HB2 ALA 27 2HB ALA 27 12.841 -2.029 -3.229 156 HB3 ALA 27 3HB ALA 27 11.998 -3.029 -4.414 157 H GLY 28 H GLY 28 10.279 -1.545 -6.085 158 HA2 GLY 28 1HA GLY 28 11.971 0.427 -7.120 159 HA3 GLY 28 2HA GLY 28 10.457 -0.085 -7.859 160 H LEU 29 H LEU 29 8.613 0.649 -6.068 161 HA LEU 29 HA LEU 29 8.310 3.445 -6.418 162 HB2 LEU 29 1HB LEU 29 6.890 1.543 -4.593 163 HB3 LEU 29 2HB LEU 29 6.344 3.140 -4.975 164 HG LEU 29 HG LEU 29 6.582 0.869 -6.938 165 HD11 LEU 29 1HD1 LEU 29 4.100 1.050 -6.958 166 HD12 LEU 29 2HD1 LEU 29 4.220 2.145 -5.578 167 HD13 LEU 29 3HD1 LEU 29 4.772 0.474 -5.434 168 HD21 LEU 29 1HD2 LEU 29 5.514 3.672 -7.283 169 HD22 LEU 29 2HD2 LEU 29 5.401 2.376 -8.475 170 HD23 LEU 29 3HD2 LEU 29 6.978 3.014 -8.013 171 H ILE 30 H ILE 30 8.921 1.445 -3.551 172 HA ILE 30 HA ILE 30 9.086 3.359 -1.577 173 HB ILE 30 HB ILE 30 10.664 0.818 -1.925 174 HG12 ILE 30 1HG1 ILE 30 8.234 1.475 -0.262 175 HG13 ILE 30 2HG1 ILE 30 8.190 0.653 -1.813 176 HG21 ILE 30 1HG2 ILE 30 10.278 2.277 0.672 177 HG22 ILE 30 2HG2 ILE 30 11.702 2.515 -0.339 178 HG23 ILE 30 3HG2 ILE 30 11.349 0.919 0.327 179 HD11 ILE 30 1HD1 ILE 30 7.966 -0.865 0.081 180 HD12 ILE 30 2HD1 ILE 30 9.561 -0.373 0.653 181 HD13 ILE 30 3HD1 ILE 30 9.396 -1.210 -0.891 182 H GLN 31 H GLN 31 11.681 2.188 -3.675 183 HA GLN 31 HA GLN 31 13.564 3.998 -2.616 184 HB2 GLN 31 1HB GLN 31 13.548 2.138 -4.960 185 HB3 GLN 31 2HB GLN 31 14.911 3.219 -4.668 186 HG2 GLN 31 1HG GLN 31 15.009 2.199 -2.351 187 HG3 GLN 31 2HG GLN 31 13.866 1.004 -2.946 188 HE21 GLN 31 1HE2 GLN 31 16.764 -0.860 -3.606 189 HE22 GLN 31 2HE2 GLN 31 15.425 -0.614 -2.529 190 H GLN 32 H GLN 32 11.119 4.282 -5.035 191 HA GLN 32 HA GLN 32 12.289 6.524 -6.398 192 HB2 GLN 32 1HB GLN 32 9.498 5.424 -6.228 193 HB3 GLN 32 2HB GLN 32 9.793 6.988 -6.968 194 HG2 GLN 32 1HG GLN 32 11.048 4.399 -7.833 195 HG3 GLN 32 2HG GLN 32 9.641 5.158 -8.573 196 HE21 GLN 32 1HE2 GLN 32 12.895 6.022 -10.309 197 HE22 GLN 32 2HE2 GLN 32 12.270 4.527 -9.708 198 H LEU 33 H LEU 33 10.152 6.078 -3.672 199 HA LEU 33 HA LEU 33 9.752 8.910 -3.274 200 HB2 LEU 33 1HB LEU 33 9.181 6.850 -1.190 201 HB3 LEU 33 2HB LEU 33 8.294 8.312 -1.567 202 HG LEU 33 HG LEU 33 8.336 5.865 -3.331 203 HD11 LEU 33 1HD1 LEU 33 7.320 5.453 -1.108 204 HD12 LEU 33 2HD1 LEU 33 6.204 5.292 -2.459 205 HD13 LEU 33 3HD1 LEU 33 6.160 6.738 -1.449 206 HD21 LEU 33 1HD2 LEU 33 6.821 8.452 -3.397 207 HD22 LEU 33 2HD2 LEU 33 6.203 6.991 -4.178 208 HD23 LEU 33 3HD2 LEU 33 7.758 7.675 -4.681 209 H GLY 34 H GLY 34 11.903 6.438 -2.264 210 HA2 GLY 34 1HA GLY 34 13.928 6.616 -1.158 211 HA3 GLY 34 2HA GLY 34 13.565 8.301 -0.808 212 H LEU 35 H LEU 35 11.639 5.438 -0.096 213 HA LEU 35 HA LEU 35 11.261 6.348 2.614 214 HB2 LEU 35 1HB LEU 35 10.176 4.083 1.005 215 HB3 LEU 35 2HB LEU 35 9.827 4.235 2.705 216 HG LEU 35 HG LEU 35 9.056 6.141 0.512 217 HD11 LEU 35 1HD1 LEU 35 7.706 4.129 0.644 218 HD12 LEU 35 2HD1 LEU 35 6.785 5.541 1.161 219 HD13 LEU 35 3HD1 LEU 35 7.425 4.418 2.362 220 HD21 LEU 35 1HD2 LEU 35 9.638 7.449 2.452 221 HD22 LEU 35 2HD2 LEU 35 8.686 6.390 3.490 222 HD23 LEU 35 3HD2 LEU 35 7.883 7.400 2.289 223 H SER 36 H SER 36 12.631 5.879 4.171 224 HA SER 36 HA SER 36 14.104 3.344 4.094 225 HB2 SER 36 1HB SER 36 15.399 5.454 4.413 226 HB3 SER 36 2HB SER 36 14.509 5.738 5.906 227 HG SER 36 HG SER 36 16.039 4.605 6.781 228 H GLY 37 H GLY 37 13.937 1.843 5.760 229 HA2 GLY 37 1HA GLY 37 13.375 1.349 8.069 230 HA3 GLY 37 2HA GLY 37 12.055 2.500 7.939 231 H VAL 38 H VAL 38 11.631 1.241 5.148 232 HA VAL 38 HA VAL 38 9.647 -0.670 6.033 233 HB VAL 38 HB VAL 38 10.382 -0.051 3.173 234 HG11 VAL 38 1HG1 VAL 38 7.772 -0.819 4.459 235 HG12 VAL 38 2HG1 VAL 38 8.858 -1.925 3.622 236 HG13 VAL 38 3HG1 VAL 38 8.074 -0.617 2.734 237 HG21 VAL 38 1HG2 VAL 38 10.073 2.090 4.290 238 HG22 VAL 38 2HG2 VAL 38 8.534 1.539 4.951 239 HG23 VAL 38 3HG2 VAL 38 8.720 1.752 3.210 240 H GLY 39 H GLY 39 10.371 -2.650 6.539 241 HA2 GLY 39 1HA GLY 39 12.697 -3.786 5.241 242 HA3 GLY 39 2HA GLY 39 11.794 -4.495 6.570 243 H ALA 40 H ALA 40 12.199 -6.435 5.130 244 HA ALA 40 HA ALA 40 10.847 -6.474 2.595 245 HB1 ALA 40 1HB ALA 40 12.334 -8.597 4.119 246 HB2 ALA 40 2HB ALA 40 12.911 -7.648 2.747 247 HB3 ALA 40 3HB ALA 40 11.637 -8.844 2.521 248 H ASN 41 H ASN 41 10.025 -7.393 5.820 249 HA ASN 41 HA ASN 41 7.870 -9.146 4.922 250 HB2 ASN 41 1HB ASN 41 9.301 -9.763 6.872 251 HB3 ASN 41 2HB ASN 41 8.671 -8.370 7.738 252 HD21 ASN 41 1HD2 ASN 41 5.704 -9.904 8.691 253 HD22 ASN 41 2HD2 ASN 41 6.651 -8.460 8.626 254 H VAL 42 H VAL 42 8.337 -5.925 5.327 255 HA VAL 42 HA VAL 42 5.967 -5.096 6.648 256 HB VAL 42 HB VAL 42 7.707 -3.555 4.722 257 HG11 VAL 42 1HG1 VAL 42 5.724 -2.598 6.787 258 HG12 VAL 42 2HG1 VAL 42 5.646 -2.350 5.042 259 HG13 VAL 42 3HG1 VAL 42 6.919 -1.568 5.994 260 HG21 VAL 42 1HG2 VAL 42 7.850 -3.974 7.679 261 HG22 VAL 42 2HG2 VAL 42 8.706 -2.686 6.829 262 HG23 VAL 42 3HG2 VAL 42 9.062 -4.376 6.455 263 HA PRO 43 HA PRO 43 3.118 -5.671 3.306 264 HB2 PRO 43 2HB PRO 43 1.168 -4.032 4.484 265 HB3 PRO 43 1HB PRO 43 1.307 -5.772 4.644 266 HG2 PRO 43 2HG PRO 43 1.750 -3.786 6.627 267 HG3 PRO 43 1HG PRO 43 1.889 -5.542 6.792 268 HD2 PRO 43 2HD PRO 43 3.970 -3.543 6.578 269 HD3 PRO 43 1HD PRO 43 4.115 -5.255 6.990 270 H VAL 44 H VAL 44 2.630 -4.541 1.467 271 HA VAL 44 HA VAL 44 2.515 -1.626 1.621 272 HB VAL 44 HB VAL 44 3.899 -1.346 -0.388 273 HG11 VAL 44 1HG1 VAL 44 5.279 -2.745 1.894 274 HG12 VAL 44 2HG1 VAL 44 4.969 -1.016 1.739 275 HG13 VAL 44 3HG1 VAL 44 6.100 -1.810 0.643 276 HG21 VAL 44 1HG2 VAL 44 4.278 -4.308 -0.111 277 HG22 VAL 44 2HG2 VAL 44 5.394 -3.288 -1.011 278 HG23 VAL 44 3HG2 VAL 44 3.707 -3.398 -1.514 279 H GLY 45 H GLY 45 1.409 -0.660 -0.137 280 HA2 GLY 45 1HA GLY 45 -0.196 -2.593 -1.676 281 HA3 GLY 45 2HA GLY 45 -0.803 -1.038 -1.153 282 H ILE 46 H ILE 46 0.246 -2.688 -3.684 283 HA ILE 46 HA ILE 46 1.898 -0.740 -5.008 284 HB ILE 46 HB ILE 46 0.625 -3.343 -5.821 285 HG12 ILE 46 1HG1 ILE 46 2.797 -4.248 -5.880 286 HG13 ILE 46 2HG1 ILE 46 3.547 -2.680 -6.004 287 HG21 ILE 46 1HG2 ILE 46 0.478 -1.852 -7.747 288 HG22 ILE 46 2HG2 ILE 46 1.641 -3.152 -8.025 289 HG23 ILE 46 3HG2 ILE 46 2.209 -1.531 -7.630 290 HD11 ILE 46 1HD1 ILE 46 2.251 -3.795 -3.550 291 HD12 ILE 46 2HD1 ILE 46 3.063 -2.233 -3.680 292 HD13 ILE 46 3HD1 ILE 46 3.983 -3.726 -3.879 293 H ASN 47 H ASN 47 1.098 1.016 -5.997 294 HA ASN 47 HA ASN 47 -0.227 2.381 -7.250 295 HB2 ASN 47 1HB ASN 47 0.043 0.329 -8.778 296 HB3 ASN 47 2HB ASN 47 -1.571 -0.106 -8.274 297 HD21 ASN 47 1HD2 ASN 47 -3.165 2.050 -10.426 298 HD22 ASN 47 2HD2 ASN 47 -3.271 0.808 -9.232 299 H CYS 48 H CYS 48 -1.103 2.349 -4.760 300 HA CYS 48 HA CYS 48 -3.897 1.502 -4.769 301 HB2 CYS 48 2HB CYS 48 -1.941 1.356 -2.820 302 HB3 CYS 48 1HB CYS 48 -2.941 2.709 -2.314 303 H ASN 49 H ASN 49 -5.564 2.815 -4.668 304 HA ASN 49 HA ASN 49 -5.108 5.689 -4.221 305 HB2 ASN 49 1HB ASN 49 -6.983 6.136 -5.798 306 HB3 ASN 49 2HB ASN 49 -5.588 5.414 -6.574 307 HD21 ASN 49 1HD2 ASN 49 -7.261 2.508 -7.566 308 HD22 ASN 49 2HD2 ASN 49 -5.744 3.314 -7.375 309 HA PRO 50 HA PRO 50 -8.207 5.274 -1.198 310 HB2 PRO 50 2HB PRO 50 -9.237 7.783 -1.117 311 HB3 PRO 50 1HB PRO 50 -7.620 7.393 -0.547 312 HG2 PRO 50 2HG PRO 50 -8.484 8.804 -2.980 313 HG3 PRO 50 1HG PRO 50 -6.965 8.906 -2.090 314 HD2 PRO 50 2HD PRO 50 -7.478 7.462 -4.477 315 HD3 PRO 50 1HD PRO 50 -5.990 7.437 -3.527 316 H ILE 51 H ILE 51 -10.032 4.173 -1.338 317 HA ILE 51 HA ILE 51 -11.694 4.317 -3.669 318 HB ILE 51 HB ILE 51 -12.575 2.907 -1.184 319 HG12 ILE 51 1HG1 ILE 51 -10.381 1.982 -3.050 320 HG13 ILE 51 2HG1 ILE 51 -10.201 2.365 -1.344 321 HG21 ILE 51 1HG2 ILE 51 -13.439 1.299 -2.797 322 HG22 ILE 51 2HG2 ILE 51 -12.673 2.189 -4.114 323 HG23 ILE 51 3HG2 ILE 51 -13.988 2.928 -3.197 324 HD11 ILE 51 1HD1 ILE 51 -11.834 0.112 -2.481 325 HD12 ILE 51 2HD1 ILE 51 -11.655 0.497 -0.769 326 HD13 ILE 51 3HD1 ILE 51 -10.256 -0.030 -1.706 327 H THR 52 H THR 52 -12.524 6.418 -3.668 328 HA THR 52 HA THR 52 -14.430 6.949 -1.493 329 HB THR 52 HB THR 52 -14.033 9.378 -1.919 330 HG1 THR 52 1HG THR 52 -12.192 8.267 -3.757 331 HG21 THR 52 1HG2 THR 52 -11.594 7.747 -1.179 332 HG22 THR 52 2HG2 THR 52 -12.903 8.200 -0.087 333 HG23 THR 52 3HG2 THR 52 -11.859 9.446 -0.775 334 H GLY 53 H GLY 53 -14.593 5.679 -4.245 335 HA2 GLY 53 1HA GLY 53 -16.775 7.362 -5.291 336 HA3 GLY 53 2HA GLY 53 -15.854 6.210 -6.249 337 H ILE 54 H ILE 54 -18.267 6.564 -3.739 338 HA ILE 54 HA ILE 54 -18.762 3.832 -3.295 339 HB ILE 54 HB ILE 54 -20.621 6.188 -2.954 340 HG12 ILE 54 1HG1 ILE 54 -18.910 4.690 -0.954 341 HG13 ILE 54 2HG1 ILE 54 -18.525 6.270 -1.627 342 HG21 ILE 54 1HG2 ILE 54 -20.850 3.408 -1.802 343 HG22 ILE 54 2HG2 ILE 54 -21.806 4.026 -3.150 344 HG23 ILE 54 3HG2 ILE 54 -21.966 4.752 -1.547 345 HD11 ILE 54 1HD1 ILE 54 -20.939 5.635 0.052 346 HD12 ILE 54 2HD1 ILE 54 -20.482 7.220 -0.569 347 HD13 ILE 54 3HD1 ILE 54 -19.465 6.414 0.623 348 H GLY 55 H GLY 55 -19.784 2.361 -4.434 349 HA2 GLY 55 1HA GLY 55 -21.880 2.030 -5.855 350 HA3 GLY 55 2HA GLY 55 -21.130 3.233 -6.898 351 H ALA 56 H ALA 56 -18.462 2.140 -6.149 352 HA ALA 56 HA ALA 56 -18.248 0.234 -8.278 353 HB1 ALA 56 1HB ALA 56 -16.514 1.910 -7.858 354 HB2 ALA 56 2HB ALA 56 -15.865 0.271 -7.780 355 HB3 ALA 56 3HB ALA 56 -16.178 1.168 -6.294 356 H GLY 57 H GLY 57 -19.144 -1.694 -7.867 357 HA2 GLY 57 1HA GLY 57 -18.804 -3.910 -7.091 358 HA3 GLY 57 2HA GLY 57 -18.001 -3.260 -5.668 359 H SER 58 H SER 58 -19.140 -3.847 -3.951 360 HA SER 58 HA SER 58 -22.046 -3.954 -4.058 361 HB2 SER 58 1HB SER 58 -20.724 -5.775 -2.981 362 HB3 SER 58 2HB SER 58 -20.161 -4.620 -1.778 363 HG SER 58 HG SER 58 -22.880 -4.630 -2.040 364 H GLY 59 H GLY 59 -19.919 -1.588 -3.717 365 HA2 GLY 59 1HA GLY 59 -21.417 0.471 -2.899 366 HA3 GLY 59 2HA GLY 59 -20.954 -0.254 -1.362 367 H SER 60 H SER 60 -18.956 0.140 -0.557 368 HA SER 60 HA SER 60 -17.022 1.392 -2.383 369 HB2 SER 60 1HB SER 60 -15.840 2.013 -0.190 370 HB3 SER 60 2HB SER 60 -17.347 2.857 -0.546 371 HG SER 60 HG SER 60 -18.274 1.919 1.101 372 H SER 61 H SER 61 -15.508 0.086 -3.123 373 HA SER 61 HA SER 61 -14.079 -1.746 -1.503 374 HB2 SER 61 1HB SER 61 -14.808 -3.815 -2.763 375 HB3 SER 61 2HB SER 61 -16.005 -3.164 -1.649 376 HG SER 61 HG SER 61 -16.357 -2.011 -4.032 377 H CYS 62 H CYS 62 -12.695 -3.228 -3.023 378 HA CYS 62 HA CYS 62 -11.836 -1.527 -5.268 379 HB2 CYS 62 2HB CYS 62 -10.217 -1.400 -3.469 380 HB3 CYS 62 1HB CYS 62 -10.147 -3.156 -3.362 381 H ASN 63 H ASN 63 -11.808 -2.427 -7.172 382 HA ASN 63 HA ASN 63 -12.672 -5.031 -7.715 383 HB2 ASN 63 1HB ASN 63 -12.764 -3.137 -9.321 384 HB3 ASN 63 2HB ASN 63 -11.011 -3.223 -9.488 385 HD21 ASN 63 1HD2 ASN 63 -11.029 -5.966 -11.644 386 HD22 ASN 63 2HD2 ASN 63 -10.093 -4.922 -10.630 387 H ALA 64 H ALA 64 -9.470 -3.694 -7.261 388 HA ALA 64 HA ALA 64 -8.223 -6.202 -8.037 389 HB1 ALA 64 1HB ALA 64 -7.270 -4.047 -8.797 390 HB2 ALA 64 2HB ALA 64 -6.125 -5.036 -7.890 391 HB3 ALA 64 3HB ALA 64 -6.898 -3.651 -7.117 392 H ASN 65 H ASN 65 -7.085 -4.152 -5.400 393 HA ASN 65 HA ASN 65 -7.778 -6.225 -3.442 394 HB2 ASN 65 1HB ASN 65 -5.023 -5.019 -3.544 395 HB3 ASN 65 2HB ASN 65 -5.569 -6.350 -2.544 396 HD21 ASN 65 1HD2 ASN 65 -4.378 -6.959 -6.376 397 HD22 ASN 65 2HD2 ASN 65 -4.639 -5.368 -5.748 398 HA PRO 66 HA PRO 66 -8.562 -2.327 -1.343 399 HB2 PRO 66 2HB PRO 66 -10.307 -3.272 0.439 400 HB3 PRO 66 1HB PRO 66 -10.748 -3.103 -1.263 401 HG2 PRO 66 2HG PRO 66 -9.982 -5.554 0.260 402 HG3 PRO 66 1HG PRO 66 -11.226 -5.351 -0.988 403 HD2 PRO 66 2HD PRO 66 -8.664 -6.381 -1.410 404 HD3 PRO 66 1HD PRO 66 -9.726 -5.735 -2.674 405 H ALA 67 H ALA 67 -7.447 -1.435 0.324 406 HA ALA 67 HA ALA 67 -6.532 -3.148 2.502 407 HB1 ALA 67 1HB ALA 67 -4.604 -1.574 0.803 408 HB2 ALA 67 2HB ALA 67 -4.786 -3.329 0.797 409 HB3 ALA 67 3HB ALA 67 -4.203 -2.508 2.244 410 H CYS 68 H CYS 68 -5.567 -2.013 4.251 411 HA CYS 68 HA CYS 68 -6.083 0.889 4.314 412 HB2 CYS 68 2HB CYS 68 -7.436 -0.253 5.987 413 HB3 CYS 68 1HB CYS 68 -6.025 -1.121 6.582 414 H CYS 69 H CYS 69 -4.302 2.160 4.598 415 HA CYS 69 HA CYS 69 -1.805 0.755 5.261 416 HB2 CYS 69 2HB CYS 69 -2.472 2.036 2.835 417 HB3 CYS 69 1HB CYS 69 -1.248 3.013 3.611 418 H ASP 70 H ASP 70 -0.137 2.023 6.152 419 HA ASP 70 HA ASP 70 -1.005 3.977 8.041 420 HB2 ASP 70 1HB ASP 70 0.896 2.418 8.434 421 HB3 ASP 70 2HB ASP 70 1.808 3.243 7.182 422 H ASN 71 H ASN 71 0.837 4.022 5.025 423 HA ASN 71 HA ASN 71 0.053 6.809 4.605 424 HB2 ASN 71 1HB ASN 71 2.918 5.845 4.592 425 HB3 ASN 71 2HB ASN 71 2.409 7.302 3.757 426 HD21 ASN 71 1HD2 ASN 71 3.695 7.827 7.292 427 HD22 ASN 71 2HD2 ASN 71 4.230 6.768 6.034 428 H VAL 72 H VAL 72 -0.363 7.234 2.473 429 HA VAL 72 HA VAL 72 0.669 5.312 0.503 430 HB VAL 72 HB VAL 72 -2.081 6.559 0.344 431 HG11 VAL 72 1HG1 VAL 72 -0.959 6.172 -1.815 432 HG12 VAL 72 2HG1 VAL 72 -2.369 5.131 -1.601 433 HG13 VAL 72 3HG1 VAL 72 -0.745 4.475 -1.384 434 HG21 VAL 72 1HG2 VAL 72 -2.018 4.852 2.086 435 HG22 VAL 72 2HG2 VAL 72 -1.291 3.710 0.956 436 HG23 VAL 72 3HG2 VAL 72 -2.936 4.287 0.691 437 H TYR 73 H TYR 73 1.806 6.233 -1.019 438 HA TYR 73 HA TYR 73 1.875 9.155 -1.085 439 HB2 TYR 73 2HB TYR 73 3.779 7.055 -2.137 440 HB3 TYR 73 1HB TYR 73 4.060 8.796 -2.214 441 HD1 TYR 73 1HD TYR 73 3.685 5.924 0.090 442 HD2 TYR 73 2HD TYR 73 4.869 9.991 -0.311 443 HE1 TYR 73 1HE TYR 73 4.650 5.856 2.350 444 HE2 TYR 73 2HE TYR 73 5.840 9.935 1.948 445 HH TYR 73 HH TYR 73 5.584 8.664 4.030 446 H THR 74 H THR 74 2.281 10.131 -3.287 447 HA THR 74 HA THR 74 -0.152 9.662 -4.645 448 HB THR 74 HB THR 74 2.009 11.402 -5.775 449 HG1 THR 74 1HG THR 74 0.407 11.965 -3.474 450 HG21 THR 74 1HG2 THR 74 -0.986 11.690 -5.502 451 HG22 THR 74 2HG2 THR 74 -0.105 11.288 -6.977 452 HG23 THR 74 3HG2 THR 74 0.085 12.880 -6.241 453 H ASN 75 H ASN 75 3.094 8.585 -5.281 454 HA ASN 75 HA ASN 75 2.714 7.825 -7.991 455 HB2 ASN 75 1HB ASN 75 4.612 6.336 -7.683 456 HB3 ASN 75 2HB ASN 75 4.952 7.865 -6.886 457 HD21 ASN 75 1HD2 ASN 75 5.799 4.882 -4.750 458 HD22 ASN 75 2HD2 ASN 75 6.093 5.218 -6.418 459 H GLY 76 H GLY 76 1.518 6.724 -5.038 460 HA2 GLY 76 1HA GLY 76 -0.419 5.371 -4.966 461 HA3 GLY 76 2HA GLY 76 0.169 4.494 -6.377 462 H LEU 77 H LEU 77 2.527 5.192 -3.930 463 HA LEU 77 HA LEU 77 2.629 2.326 -3.369 464 HB2 LEU 77 1HB LEU 77 4.671 3.500 -4.064 465 HB3 LEU 77 2HB LEU 77 4.538 4.552 -2.684 466 HG LEU 77 HG LEU 77 6.262 2.665 -2.590 467 HD11 LEU 77 1HD1 LEU 77 4.270 2.915 -0.350 468 HD12 LEU 77 2HD1 LEU 77 5.663 3.958 -0.630 469 HD13 LEU 77 3HD1 LEU 77 5.904 2.257 -0.212 470 HD21 LEU 77 1HD2 LEU 77 4.820 0.893 -3.435 471 HD22 LEU 77 2HD2 LEU 77 3.793 1.046 -2.007 472 HD23 LEU 77 3HD2 LEU 77 5.466 0.506 -1.842 473 H GLY 78 H GLY 78 1.674 1.542 -1.658 474 HA2 GLY 78 1HA GLY 78 1.146 3.324 0.620 475 HA3 GLY 78 2HA GLY 78 0.296 1.824 0.272 476 H VAL 79 H VAL 79 1.876 2.883 2.640 477 HA VAL 79 HA VAL 79 3.646 0.537 2.908 478 HB VAL 79 HB VAL 79 4.756 2.802 3.054 479 HG11 VAL 79 1HG1 VAL 79 3.349 3.006 5.695 480 HG12 VAL 79 2HG1 VAL 79 2.954 3.946 4.259 481 HG13 VAL 79 3HG1 VAL 79 4.531 4.134 5.029 482 HG21 VAL 79 1HG2 VAL 79 6.141 2.211 4.986 483 HG22 VAL 79 2HG2 VAL 79 5.805 0.812 3.966 484 HG23 VAL 79 3HG2 VAL 79 4.930 1.029 5.483 485 H GLN 80 H GLN 80 3.155 -0.914 4.389 486 HA GLN 80 HA GLN 80 2.157 -2.007 6.088 487 HB2 GLN 80 1HB GLN 80 1.768 0.815 7.010 488 HB3 GLN 80 2HB GLN 80 1.013 -0.505 7.891 489 HG2 GLN 80 1HG GLN 80 3.922 -0.442 7.237 490 HG3 GLN 80 2HG GLN 80 3.273 0.283 8.709 491 HE21 GLN 80 1HE2 GLN 80 4.420 -3.250 9.238 492 HE22 GLN 80 2HE2 GLN 80 5.138 -1.867 8.492 493 H CYS 81 H CYS 81 0.865 -1.943 3.788 494 HA CYS 81 HA CYS 81 -1.913 -1.228 4.202 495 HB2 CYS 81 2HB CYS 81 -0.432 -2.428 1.878 496 HB3 CYS 81 1HB CYS 81 -2.184 -2.455 1.936 497 H ASN 82 H ASN 82 -3.140 -2.446 5.399 498 HA ASN 82 HA ASN 82 -2.758 -5.350 5.349 499 HB2 ASN 82 1HB ASN 82 -4.458 -5.300 7.260 500 HB3 ASN 82 2HB ASN 82 -2.865 -4.638 7.589 501 HD21 ASN 82 1HD2 ASN 82 -3.997 -1.412 8.248 502 HD22 ASN 82 2HD2 ASN 82 -2.647 -2.457 7.985 503 HA PRO 83 HA PRO 83 -5.989 -5.856 2.433 504 HB2 PRO 83 2HB PRO 83 -6.391 -8.495 3.697 505 HB3 PRO 83 1HB PRO 83 -5.969 -8.098 2.032 506 HG2 PRO 83 2HG PRO 83 -4.173 -9.142 3.720 507 HG3 PRO 83 1HG PRO 83 -3.716 -7.944 2.497 508 HD2 PRO 83 2HD PRO 83 -4.135 -7.590 5.436 509 HD3 PRO 83 1HD PRO 83 -2.927 -6.852 4.366 510 H ILE 84 H ILE 84 -8.052 -5.327 2.412 511 HA ILE 84 HA ILE 84 -9.545 -5.243 4.902 512 HB ILE 84 HB ILE 84 -10.264 -4.247 2.160 513 HG12 ILE 84 1HG1 ILE 84 -8.337 -3.103 3.178 514 HG13 ILE 84 2HG1 ILE 84 -9.720 -2.037 3.017 515 HG21 ILE 84 1HG2 ILE 84 -11.648 -3.788 4.787 516 HG22 ILE 84 2HG2 ILE 84 -12.278 -4.693 3.408 517 HG23 ILE 84 3HG2 ILE 84 -12.027 -2.950 3.282 518 HD11 ILE 84 1HD1 ILE 84 -8.648 -1.688 5.139 519 HD12 ILE 84 2HD1 ILE 84 -8.793 -3.401 5.525 520 HD13 ILE 84 3HD1 ILE 84 -10.240 -2.404 5.390 521 H ASN 85 H ASN 85 -11.492 -6.239 5.235 522 HA ASN 85 HA ASN 85 -11.932 -8.725 3.823 523 HB2 ASN 85 1HB ASN 85 -12.156 -8.575 6.301 524 HB3 ASN 85 2HB ASN 85 -13.507 -7.469 6.095 525 HD21 ASN 85 1HD2 ASN 85 -14.540 -11.083 6.603 526 HD22 ASN 85 2HD2 ASN 85 -13.341 -10.102 7.375 527 H VAL 86 H VAL 86 -12.816 -8.503 1.901 528 HA VAL 86 HA VAL 86 -15.367 -7.064 1.724 529 HB VAL 86 HB VAL 86 -14.794 -6.706 -0.735 530 HG11 VAL 86 1HG1 VAL 86 -14.730 -4.882 0.877 531 HG12 VAL 86 2HG1 VAL 86 -13.439 -4.714 -0.312 532 HG13 VAL 86 3HG1 VAL 86 -13.075 -5.308 1.308 533 HG21 VAL 86 1HG2 VAL 86 -12.942 -8.361 -0.780 534 HG22 VAL 86 2HG2 VAL 86 -11.981 -7.252 0.198 535 HG23 VAL 86 3HG2 VAL 86 -12.497 -6.783 -1.423 536 H ASN 87 H ASN 87 -16.455 -8.934 2.178 537 HA ASN 87 HA ASN 87 -17.247 -11.065 2.026 538 HB2 ASN 87 1HB ASN 87 -16.703 -10.505 -0.896 539 HB3 ASN 87 2HB ASN 87 -17.409 -12.019 -0.349 540 HD21 ASN 87 1HD2 ASN 87 -19.733 -8.794 0.557 541 HD22 ASN 87 2HD2 ASN 87 -18.082 -8.865 1.063 542 H LEU 88 H LEU 88 -14.774 -10.912 2.987 543 HA LEU 88 HA LEU 88 -12.688 -12.117 1.567 544 HB2 LEU 88 1HB LEU 88 -12.444 -10.735 3.615 545 HB3 LEU 88 2HB LEU 88 -13.078 -12.070 4.554 546 HG LEU 88 HG LEU 88 -11.137 -13.449 3.807 547 HD11 LEU 88 1HD1 LEU 88 -9.198 -12.281 2.853 548 HD12 LEU 88 2HD1 LEU 88 -10.179 -10.826 2.674 549 HD13 LEU 88 3HD1 LEU 88 -10.582 -12.280 1.761 550 HD21 LEU 88 1HD2 LEU 88 -10.501 -10.878 5.249 551 HD22 LEU 88 2HD2 LEU 88 -9.509 -12.335 5.270 552 HD23 LEU 88 3HD2 LEU 88 -11.125 -12.359 5.975 Start of MODEL 2 1 H1 GLY 1 1H GLY 1 -19.796 12.154 0.440 2 H2 GLY 1 2H GLY 1 -18.928 13.527 0.895 3 H3 GLY 1 3H GLY 1 -20.598 13.464 1.142 4 HA2 GLY 1 1HA GLY 1 -19.465 13.117 3.221 5 HA3 GLY 1 2HA GLY 1 -20.323 11.665 2.728 6 H SER 2 H SER 2 -18.709 10.794 4.344 7 HA SER 2 HA SER 2 -16.025 10.467 3.268 8 HB2 SER 2 1HB SER 2 -16.387 10.950 5.694 9 HB3 SER 2 2HB SER 2 -17.200 9.393 5.846 10 HG SER 2 HG SER 2 -15.253 8.704 6.252 11 H GLY 3 H GLY 3 -15.457 8.767 2.076 12 HA2 GLY 3 1HA GLY 3 -17.334 6.554 1.779 13 HA3 GLY 3 2HA GLY 3 -15.923 6.865 0.778 14 H SER 4 H SER 4 -14.577 7.281 3.571 15 HA SER 4 HA SER 4 -13.636 4.536 3.710 16 HB2 SER 4 1HB SER 4 -12.633 7.023 5.111 17 HB3 SER 4 2HB SER 4 -11.835 5.449 5.100 18 HG SER 4 HG SER 4 -12.284 7.198 2.912 19 H SER 5 H SER 5 -15.531 3.631 4.695 20 HA SER 5 HA SER 5 -16.049 4.363 7.449 21 HB2 SER 5 1HB SER 5 -17.582 2.292 7.263 22 HB3 SER 5 2HB SER 5 -18.008 3.728 6.342 23 HG SER 5 HG SER 5 -18.076 2.310 4.766 24 H GLN 6 H GLN 6 -14.143 2.149 5.653 25 HA GLN 6 HA GLN 6 -13.385 0.627 8.013 26 HB2 GLN 6 1HB GLN 6 -12.672 0.353 5.110 27 HB3 GLN 6 2HB GLN 6 -11.918 -0.615 6.357 28 HG2 GLN 6 1HG GLN 6 -13.611 -1.888 5.344 29 HG3 GLN 6 2HG GLN 6 -14.170 -1.469 6.959 30 HE21 GLN 6 1HE2 GLN 6 -15.883 0.705 3.960 31 HE22 GLN 6 2HE2 GLN 6 -14.165 0.545 4.069 32 H CYS 7 H CYS 7 -10.964 0.232 8.195 33 HA CYS 7 HA CYS 7 -8.812 0.821 8.370 34 HB2 CYS 7 2HB CYS 7 -9.495 3.077 6.514 35 HB3 CYS 7 1HB CYS 7 -7.882 2.470 6.886 36 H ASN 8 H ASN 8 -8.291 1.469 10.316 37 HA ASN 8 HA ASN 8 -9.313 3.975 11.390 38 HB2 ASN 8 1HB ASN 8 -9.296 1.962 12.821 39 HB3 ASN 8 2HB ASN 8 -7.546 1.870 12.663 40 HD21 ASN 8 1HD2 ASN 8 -7.475 3.542 15.719 41 HD22 ASN 8 2HD2 ASN 8 -7.257 2.046 14.881 42 H ALA 9 H ALA 9 -6.396 2.608 10.090 43 HA ALA 9 HA ALA 9 -4.676 4.690 11.115 44 HB1 ALA 9 1HB ALA 9 -3.844 2.405 10.826 45 HB2 ALA 9 2HB ALA 9 -2.906 3.565 9.885 46 HB3 ALA 9 3HB ALA 9 -4.094 2.537 9.086 47 H GLY 10 H GLY 10 -6.959 4.839 8.855 48 HA2 GLY 10 1HA GLY 10 -6.371 7.246 7.779 49 HA3 GLY 10 2HA GLY 10 -5.505 6.134 6.730 50 HA PRO 11 HA PRO 11 -9.726 6.161 5.011 51 HB2 PRO 11 2HB PRO 11 -9.119 6.801 2.499 52 HB3 PRO 11 1HB PRO 11 -9.101 8.035 3.764 53 HG2 PRO 11 2HG PRO 11 -6.822 6.623 2.461 54 HG3 PRO 11 1HG PRO 11 -6.937 8.304 3.005 55 HD2 PRO 11 2HD PRO 11 -5.740 6.177 4.399 56 HD3 PRO 11 1HD PRO 11 -6.155 7.766 5.070 57 H VAL 12 H VAL 12 -10.600 4.890 3.140 58 HA VAL 12 HA VAL 12 -9.458 2.266 3.107 59 HB VAL 12 HB VAL 12 -11.268 1.814 1.366 60 HG11 VAL 12 1HG1 VAL 12 -11.505 1.207 3.688 61 HG12 VAL 12 2HG1 VAL 12 -13.042 1.824 3.073 62 HG13 VAL 12 3HG1 VAL 12 -12.022 2.846 4.093 63 HG21 VAL 12 1HG2 VAL 12 -12.161 4.578 2.206 64 HG22 VAL 12 2HG2 VAL 12 -13.082 3.446 1.216 65 HG23 VAL 12 3HG2 VAL 12 -11.575 4.129 0.604 66 H GLN 13 H GLN 13 -7.911 1.569 1.821 67 HA GLN 13 HA GLN 13 -7.352 3.157 -0.592 68 HB2 GLN 13 1HB GLN 13 -5.376 1.197 0.497 69 HB3 GLN 13 2HB GLN 13 -5.100 2.661 -0.422 70 HG2 GLN 13 1HG GLN 13 -6.056 2.670 2.425 71 HG3 GLN 13 2HG GLN 13 -4.361 2.685 1.970 72 HE21 GLN 13 1HE2 GLN 13 -6.351 6.014 0.706 73 HE22 GLN 13 2HE2 GLN 13 -6.945 4.446 0.320 74 H CYS 14 H CYS 14 -6.886 2.138 -2.507 75 HA CYS 14 HA CYS 14 -7.704 -0.677 -2.713 76 HB2 CYS 14 2HB CYS 14 -9.527 0.701 -3.515 77 HB3 CYS 14 1HB CYS 14 -8.439 1.612 -4.554 78 H CYS 15 H CYS 15 -6.047 -1.819 -3.345 79 HA CYS 15 HA CYS 15 -3.918 -0.498 -4.883 80 HB2 CYS 15 2HB CYS 15 -3.666 -2.828 -2.971 81 HB3 CYS 15 1HB CYS 15 -2.354 -1.886 -3.689 82 H ASN 16 H ASN 16 -3.021 -1.499 -6.592 83 HA ASN 16 HA ASN 16 -4.492 -3.447 -8.008 84 HB2 ASN 16 1HB ASN 16 -2.868 -1.725 -8.934 85 HB3 ASN 16 2HB ASN 16 -1.590 -2.804 -8.403 86 HD21 ASN 16 1HD2 ASN 16 -3.812 -3.686 -11.680 87 HD22 ASN 16 2HD2 ASN 16 -4.269 -2.422 -10.589 88 H THR 17 H THR 17 -1.372 -3.621 -6.345 89 HA THR 17 HA THR 17 -1.807 -6.508 -5.990 90 HB THR 17 HB THR 17 0.832 -5.150 -6.605 91 HG1 THR 17 1HG THR 17 -0.962 -6.724 -8.128 92 HG21 THR 17 1HG2 THR 17 1.257 -6.959 -5.107 93 HG22 THR 17 2HG2 THR 17 1.677 -7.505 -6.735 94 HG23 THR 17 3HG2 THR 17 0.162 -8.024 -5.995 95 H LEU 18 H LEU 18 -2.019 -6.933 -3.874 96 HA LEU 18 HA LEU 18 -0.574 -5.284 -1.943 97 HB2 LEU 18 1HB LEU 18 -2.634 -7.462 -1.623 98 HB3 LEU 18 2HB LEU 18 -1.743 -6.805 -0.264 99 HG LEU 18 HG LEU 18 -3.599 -5.265 -2.070 100 HD11 LEU 18 1HD1 LEU 18 -3.874 -6.003 0.840 101 HD12 LEU 18 2HD1 LEU 18 -4.694 -6.825 -0.488 102 HD13 LEU 18 3HD1 LEU 18 -5.046 -5.131 -0.148 103 HD21 LEU 18 1HD2 LEU 18 -2.037 -4.372 0.350 104 HD22 LEU 18 2HD2 LEU 18 -3.252 -3.417 -0.500 105 HD23 LEU 18 3HD2 LEU 18 -1.758 -3.867 -1.317 106 H THR 19 H THR 19 1.312 -5.867 -1.171 107 HA THR 19 HA THR 19 2.098 -8.595 -0.869 108 HB THR 19 HB THR 19 2.471 -8.478 -3.250 109 HG1 THR 19 1HG THR 19 4.194 -9.590 -2.799 110 HG21 THR 19 1HG2 THR 19 2.596 -6.165 -3.737 111 HG22 THR 19 2HG2 THR 19 4.166 -6.837 -4.180 112 HG23 THR 19 3HG2 THR 19 3.985 -5.941 -2.673 113 H SER 20 H SER 20 4.817 -8.303 -0.678 114 HA SER 20 HA SER 20 4.980 -6.497 1.627 115 HB2 SER 20 1HB SER 20 7.049 -7.913 2.132 116 HB3 SER 20 2HB SER 20 5.493 -8.738 2.238 117 HG SER 20 HG SER 20 5.873 -9.721 0.300 118 H ALA 21 H ALA 21 7.118 -5.457 2.002 119 HA ALA 21 HA ALA 21 7.835 -3.912 -0.272 120 HB1 ALA 21 1HB ALA 21 7.843 -3.018 1.998 121 HB2 ALA 21 2HB ALA 21 9.409 -2.815 1.215 122 HB3 ALA 21 3HB ALA 21 9.181 -4.086 2.416 123 H SER 22 H SER 22 8.689 -6.987 0.424 124 HA SER 22 HA SER 22 11.440 -6.856 -0.459 125 HB2 SER 22 1HB SER 22 10.370 -8.568 1.191 126 HB3 SER 22 2HB SER 22 9.818 -9.368 -0.268 127 HG SER 22 HG SER 22 11.729 -10.289 -0.004 128 H ASN 23 H ASN 23 8.387 -6.839 -1.866 129 HA ASN 23 HA ASN 23 9.013 -8.285 -4.270 130 HB2 ASN 23 1HB ASN 23 6.668 -7.802 -3.245 131 HB3 ASN 23 2HB ASN 23 6.813 -6.238 -4.036 132 HD21 ASN 23 1HD2 ASN 23 6.064 -9.591 -6.176 133 HD22 ASN 23 2HD2 ASN 23 6.428 -9.646 -4.485 134 H SER 24 H SER 24 9.688 -7.485 -6.206 135 HA SER 24 HA SER 24 11.248 -5.143 -6.198 136 HB2 SER 24 1HB SER 24 10.254 -6.736 -8.572 137 HB3 SER 24 2HB SER 24 11.602 -5.600 -8.572 138 HG SER 24 HG SER 24 12.801 -6.974 -7.396 139 H GLN 25 H GLN 25 7.938 -5.746 -7.048 140 HA GLN 25 HA GLN 25 7.396 -3.424 -8.524 141 HB2 GLN 25 1HB GLN 25 5.936 -5.511 -8.099 142 HB3 GLN 25 2HB GLN 25 5.481 -4.724 -6.593 143 HG2 GLN 25 1HG GLN 25 3.796 -4.189 -8.103 144 HG3 GLN 25 2HG GLN 25 4.809 -2.751 -7.985 145 HE21 GLN 25 1HE2 GLN 25 5.628 -4.883 -11.343 146 HE22 GLN 25 2HE2 GLN 25 5.750 -5.592 -9.773 147 H ALA 26 H ALA 26 7.193 -4.181 -5.086 148 HA ALA 26 HA ALA 26 6.271 -1.607 -4.285 149 HB1 ALA 26 1HB ALA 26 6.748 -2.420 -2.009 150 HB2 ALA 26 2HB ALA 26 7.524 -3.845 -2.700 151 HB3 ALA 26 3HB ALA 26 5.801 -3.571 -2.953 152 H ALA 27 H ALA 27 9.438 -3.236 -3.958 153 HA ALA 27 HA ALA 27 10.704 -1.084 -2.667 154 HB1 ALA 27 1HB ALA 27 11.618 -3.355 -2.662 155 HB2 ALA 27 2HB ALA 27 12.809 -2.186 -3.238 156 HB3 ALA 27 3HB ALA 27 11.965 -3.225 -4.387 157 H GLY 28 H GLY 28 10.277 -1.780 -6.106 158 HA2 GLY 28 1HA GLY 28 11.927 0.200 -7.171 159 HA3 GLY 28 2HA GLY 28 10.405 -0.323 -7.886 160 H LEU 29 H LEU 29 8.543 0.432 -6.184 161 HA LEU 29 HA LEU 29 8.217 3.208 -6.538 162 HB2 LEU 29 1HB LEU 29 6.850 1.320 -4.660 163 HB3 LEU 29 2HB LEU 29 6.277 2.906 -5.056 164 HG LEU 29 HG LEU 29 6.514 0.612 -6.993 165 HD11 LEU 29 1HD1 LEU 29 4.150 1.874 -5.623 166 HD12 LEU 29 2HD1 LEU 29 4.727 0.214 -5.451 167 HD13 LEU 29 3HD1 LEU 29 4.031 0.752 -6.979 168 HD21 LEU 29 1HD2 LEU 29 5.392 3.391 -7.354 169 HD22 LEU 29 2HD2 LEU 29 5.298 2.081 -8.532 170 HD23 LEU 29 3HD2 LEU 29 6.864 2.758 -8.091 171 H ILE 30 H ILE 30 8.874 1.286 -3.619 172 HA ILE 30 HA ILE 30 9.048 3.264 -1.706 173 HB ILE 30 HB ILE 30 10.663 0.738 -1.981 174 HG12 ILE 30 1HG1 ILE 30 8.208 1.381 -0.347 175 HG13 ILE 30 2HG1 ILE 30 8.188 0.526 -1.879 176 HG21 ILE 30 1HG2 ILE 30 10.228 2.256 0.575 177 HG22 ILE 30 2HG2 ILE 30 11.643 2.526 -0.442 178 HG23 ILE 30 3HG2 ILE 30 11.350 0.932 0.264 179 HD11 ILE 30 1HD1 ILE 30 9.433 -1.288 -0.913 180 HD12 ILE 30 2HD1 ILE 30 7.990 -0.954 0.047 181 HD13 ILE 30 3HD1 ILE 30 9.571 -0.414 0.612 182 H GLN 31 H GLN 31 11.604 2.034 -3.795 183 HA GLN 31 HA GLN 31 13.540 3.817 -2.823 184 HB2 GLN 31 1HB GLN 31 13.387 1.972 -5.171 185 HB3 GLN 31 2HB GLN 31 14.778 3.034 -4.946 186 HG2 GLN 31 1HG GLN 31 15.035 2.000 -2.676 187 HG3 GLN 31 2HG GLN 31 13.783 0.856 -3.148 188 HE21 GLN 31 1HE2 GLN 31 16.442 -1.181 -4.118 189 HE22 GLN 31 2HE2 GLN 31 15.220 -0.869 -2.935 190 H GLN 32 H GLN 32 11.006 4.177 -5.149 191 HA GLN 32 HA GLN 32 12.253 6.365 -6.536 192 HB2 GLN 32 1HB GLN 32 9.370 5.490 -6.352 193 HB3 GLN 32 2HB GLN 32 9.902 6.856 -7.322 194 HG2 GLN 32 1HG GLN 32 11.027 4.111 -7.707 195 HG3 GLN 32 2HG GLN 32 9.526 4.619 -8.468 196 HE21 GLN 32 1HE2 GLN 32 12.593 7.002 -9.649 197 HE22 GLN 32 2HE2 GLN 32 12.133 6.893 -7.993 198 H LEU 33 H LEU 33 9.904 6.015 -3.954 199 HA LEU 33 HA LEU 33 9.526 8.812 -3.553 200 HB2 LEU 33 1HB LEU 33 9.082 6.786 -1.402 201 HB3 LEU 33 2HB LEU 33 8.141 8.212 -1.781 202 HG LEU 33 HG LEU 33 8.202 5.718 -3.473 203 HD11 LEU 33 1HD1 LEU 33 7.215 5.406 -1.206 204 HD12 LEU 33 2HD1 LEU 33 6.113 5.123 -2.547 205 HD13 LEU 33 3HD1 LEU 33 6.013 6.626 -1.629 206 HD21 LEU 33 1HD2 LEU 33 7.604 7.516 -4.856 207 HD22 LEU 33 2HD2 LEU 33 6.611 8.259 -3.601 208 HD23 LEU 33 3HD2 LEU 33 6.076 6.761 -4.376 209 H GLY 34 H GLY 34 11.741 6.420 -2.428 210 HA2 GLY 34 1HA GLY 34 13.765 6.714 -1.343 211 HA3 GLY 34 2HA GLY 34 13.348 8.398 -1.055 212 H LEU 35 H LEU 35 11.524 5.492 -0.264 213 HA LEU 35 HA LEU 35 11.030 6.489 2.383 214 HB2 LEU 35 1HB LEU 35 10.161 4.089 0.849 215 HB3 LEU 35 2HB LEU 35 9.805 4.228 2.551 216 HG LEU 35 HG LEU 35 8.869 6.064 0.355 217 HD11 LEU 35 1HD1 LEU 35 7.394 4.164 2.163 218 HD12 LEU 35 2HD1 LEU 35 7.711 3.930 0.444 219 HD13 LEU 35 3HD1 LEU 35 6.659 5.241 0.977 220 HD21 LEU 35 1HD2 LEU 35 9.293 7.394 2.312 221 HD22 LEU 35 2HD2 LEU 35 8.467 6.220 3.335 222 HD23 LEU 35 3HD2 LEU 35 7.553 7.156 2.153 223 H SER 36 H SER 36 12.484 6.281 3.926 224 HA SER 36 HA SER 36 14.046 3.813 4.122 225 HB2 SER 36 1HB SER 36 15.297 5.127 5.896 226 HB3 SER 36 2HB SER 36 15.414 5.775 4.260 227 HG SER 36 HG SER 36 13.843 6.717 6.426 228 H GLY 37 H GLY 37 13.644 2.341 5.695 229 HA2 GLY 37 1HA GLY 37 13.031 2.011 8.075 230 HA3 GLY 37 2HA GLY 37 11.691 3.108 7.780 231 H VAL 38 H VAL 38 11.435 1.780 5.056 232 HA VAL 38 HA VAL 38 9.613 -0.316 5.897 233 HB VAL 38 HB VAL 38 10.292 0.564 3.083 234 HG11 VAL 38 1HG1 VAL 38 9.169 -1.571 3.199 235 HG12 VAL 38 2HG1 VAL 38 8.068 -0.349 2.563 236 HG13 VAL 38 3HG1 VAL 38 7.918 -0.888 4.235 237 HG21 VAL 38 1HG2 VAL 38 9.540 2.495 4.360 238 HG22 VAL 38 2HG2 VAL 38 8.126 1.598 4.911 239 HG23 VAL 38 3HG2 VAL 38 8.304 2.000 3.204 240 H GLY 39 H GLY 39 10.542 -2.202 6.383 241 HA2 GLY 39 1HA GLY 39 12.854 -3.166 4.890 242 HA3 GLY 39 2HA GLY 39 12.185 -3.882 6.351 243 H ALA 40 H ALA 40 12.696 -5.753 4.674 244 HA ALA 40 HA ALA 40 10.864 -6.047 2.513 245 HB1 ALA 40 1HB ALA 40 12.635 -8.129 3.784 246 HB2 ALA 40 2HB ALA 40 13.109 -7.035 2.485 247 HB3 ALA 40 3HB ALA 40 11.857 -8.243 2.206 248 H ASN 41 H ASN 41 10.631 -6.713 5.850 249 HA ASN 41 HA ASN 41 8.583 -8.747 5.545 250 HB2 ASN 41 1HB ASN 41 8.588 -8.820 7.972 251 HB3 ASN 41 2HB ASN 41 10.241 -8.880 7.382 252 HD21 ASN 41 1HD2 ASN 41 8.972 -5.858 9.742 253 HD22 ASN 41 2HD2 ASN 41 7.908 -7.098 9.176 254 H VAL 42 H VAL 42 8.589 -5.559 5.097 255 HA VAL 42 HA VAL 42 6.295 -4.825 6.706 256 HB VAL 42 HB VAL 42 7.846 -3.231 4.665 257 HG11 VAL 42 1HG1 VAL 42 5.816 -2.354 6.713 258 HG12 VAL 42 2HG1 VAL 42 5.692 -2.202 4.959 259 HG13 VAL 42 3HG1 VAL 42 6.902 -1.263 5.848 260 HG21 VAL 42 1HG2 VAL 42 9.285 -3.851 6.415 261 HG22 VAL 42 2HG2 VAL 42 8.057 -3.491 7.636 262 HG23 VAL 42 3HG2 VAL 42 8.798 -2.180 6.716 263 HA PRO 43 HA PRO 43 3.376 -5.720 3.463 264 HB2 PRO 43 2HB PRO 43 1.362 -4.189 4.726 265 HB3 PRO 43 1HB PRO 43 1.586 -5.922 4.824 266 HG2 PRO 43 2HG PRO 43 1.957 -4.025 6.873 267 HG3 PRO 43 1HG PRO 43 2.285 -5.763 6.942 268 HD2 PRO 43 2HD PRO 43 4.139 -3.530 6.703 269 HD3 PRO 43 1HD PRO 43 4.475 -5.216 7.116 270 H VAL 44 H VAL 44 2.782 -4.618 1.634 271 HA VAL 44 HA VAL 44 2.563 -1.706 1.799 272 HB VAL 44 HB VAL 44 3.911 -1.362 -0.206 273 HG11 VAL 44 1HG1 VAL 44 5.351 -2.825 1.997 274 HG12 VAL 44 2HG1 VAL 44 5.049 -1.089 1.887 275 HG13 VAL 44 3HG1 VAL 44 6.146 -1.868 0.746 276 HG21 VAL 44 1HG2 VAL 44 5.395 -3.265 -0.946 277 HG22 VAL 44 2HG2 VAL 44 3.695 -3.376 -1.395 278 HG23 VAL 44 3HG2 VAL 44 4.318 -4.329 -0.045 279 H GLY 45 H GLY 45 1.765 -0.815 -0.316 280 HA2 GLY 45 1HA GLY 45 0.027 -2.759 -1.686 281 HA3 GLY 45 2HA GLY 45 -0.561 -1.172 -1.215 282 H ILE 46 H ILE 46 0.197 -2.787 -3.782 283 HA ILE 46 HA ILE 46 1.916 -0.844 -5.109 284 HB ILE 46 HB ILE 46 0.755 -3.499 -5.955 285 HG12 ILE 46 1HG1 ILE 46 2.962 -4.376 -5.913 286 HG13 ILE 46 2HG1 ILE 46 3.682 -2.794 -5.887 287 HG21 ILE 46 1HG2 ILE 46 0.731 -2.010 -7.871 288 HG22 ILE 46 2HG2 ILE 46 1.956 -3.263 -8.073 289 HG23 ILE 46 3HG2 ILE 46 2.434 -1.629 -7.615 290 HD11 ILE 46 1HD1 ILE 46 2.195 -4.035 -3.611 291 HD12 ILE 46 2HD1 ILE 46 3.042 -2.486 -3.593 292 HD13 ILE 46 3HD1 ILE 46 3.948 -3.987 -3.795 293 H ASN 47 H ASN 47 0.946 0.872 -5.981 294 HA ASN 47 HA ASN 47 -0.470 2.180 -7.177 295 HB2 ASN 47 1HB ASN 47 -0.287 0.141 -8.763 296 HB3 ASN 47 2HB ASN 47 -1.882 -0.279 -8.167 297 HD21 ASN 47 1HD2 ASN 47 -1.370 2.802 -10.742 298 HD22 ASN 47 2HD2 ASN 47 -0.024 2.048 -9.960 299 H CYS 48 H CYS 48 -1.169 2.372 -4.772 300 HA CYS 48 HA CYS 48 -3.902 1.461 -4.358 301 HB2 CYS 48 2HB CYS 48 -2.066 2.965 -2.495 302 HB3 CYS 48 1HB CYS 48 -3.612 2.250 -2.087 303 H ASN 49 H ASN 49 -5.624 2.757 -4.271 304 HA ASN 49 HA ASN 49 -5.228 5.647 -4.070 305 HB2 ASN 49 1HB ASN 49 -7.070 6.018 -5.709 306 HB3 ASN 49 2HB ASN 49 -5.637 5.300 -6.427 307 HD21 ASN 49 1HD2 ASN 49 -7.220 2.348 -7.399 308 HD22 ASN 49 2HD2 ASN 49 -5.731 3.204 -7.201 309 HA PRO 50 HA PRO 50 -8.330 5.349 -0.994 310 HB2 PRO 50 2HB PRO 50 -9.232 8.055 -1.623 311 HB3 PRO 50 1HB PRO 50 -8.338 7.484 -0.211 312 HG2 PRO 50 2HG PRO 50 -7.218 9.078 -2.093 313 HG3 PRO 50 1HG PRO 50 -6.288 7.872 -1.186 314 HD2 PRO 50 2HD PRO 50 -7.422 7.698 -3.958 315 HD3 PRO 50 1HD PRO 50 -5.825 7.200 -3.370 316 H ILE 51 H ILE 51 -10.196 4.296 -1.165 317 HA ILE 51 HA ILE 51 -11.787 4.502 -3.559 318 HB ILE 51 HB ILE 51 -12.759 3.043 -1.137 319 HG12 ILE 51 1HG1 ILE 51 -10.521 2.125 -2.955 320 HG13 ILE 51 2HG1 ILE 51 -10.387 2.460 -1.235 321 HG21 ILE 51 1HG2 ILE 51 -14.047 3.179 -3.273 322 HG22 ILE 51 2HG2 ILE 51 -13.655 1.532 -2.780 323 HG23 ILE 51 3HG2 ILE 51 -12.733 2.310 -4.066 324 HD11 ILE 51 1HD1 ILE 51 -10.477 0.077 -1.657 325 HD12 ILE 51 2HD1 ILE 51 -12.029 0.272 -2.473 326 HD13 ILE 51 3HD1 ILE 51 -11.890 0.612 -0.748 327 H THR 52 H THR 52 -12.546 6.659 -3.489 328 HA THR 52 HA THR 52 -14.551 7.106 -1.378 329 HB THR 52 HB THR 52 -14.152 9.542 -1.645 330 HG1 THR 52 1HG THR 52 -12.046 8.625 -3.343 331 HG21 THR 52 1HG2 THR 52 -13.040 8.280 0.139 332 HG22 THR 52 2HG2 THR 52 -12.008 9.583 -0.453 333 HG23 THR 52 3HG2 THR 52 -11.699 7.918 -0.947 334 H GLY 53 H GLY 53 -14.393 6.159 -4.389 335 HA2 GLY 53 1HA GLY 53 -16.610 7.823 -5.364 336 HA3 GLY 53 2HA GLY 53 -15.664 6.699 -6.334 337 H ILE 54 H ILE 54 -18.218 7.002 -3.965 338 HA ILE 54 HA ILE 54 -18.717 4.262 -3.565 339 HB ILE 54 HB ILE 54 -20.707 6.527 -3.373 340 HG12 ILE 54 1HG1 ILE 54 -18.928 5.304 -1.246 341 HG13 ILE 54 2HG1 ILE 54 -18.714 6.898 -1.962 342 HG21 ILE 54 1HG2 ILE 54 -21.634 4.206 -3.499 343 HG22 ILE 54 2HG2 ILE 54 -22.012 5.060 -1.999 344 HG23 ILE 54 3HG2 ILE 54 -20.746 3.832 -2.019 345 HD11 ILE 54 1HD1 ILE 54 -20.838 7.614 -1.020 346 HD12 ILE 54 2HD1 ILE 54 -19.746 7.025 0.234 347 HD13 ILE 54 3HD1 ILE 54 -21.076 6.010 -0.324 348 H GLY 55 H GLY 55 -19.873 2.796 -4.644 349 HA2 GLY 55 1HA GLY 55 -21.240 3.655 -7.100 350 HA3 GLY 55 2HA GLY 55 -20.654 2.034 -6.764 351 H ALA 56 H ALA 56 -23.387 3.525 -7.250 352 HA ALA 56 HA ALA 56 -25.021 2.988 -5.042 353 HB1 ALA 56 1HB ALA 56 -25.778 2.991 -7.963 354 HB2 ALA 56 2HB ALA 56 -25.714 4.406 -6.914 355 HB3 ALA 56 3HB ALA 56 -26.890 3.130 -6.601 356 H GLY 57 H GLY 57 -25.244 1.079 -4.094 357 HA2 GLY 57 1HA GLY 57 -26.531 -1.060 -4.545 358 HA3 GLY 57 2HA GLY 57 -25.327 -1.327 -5.797 359 H SER 58 H SER 58 -23.059 -1.462 -5.087 360 HA SER 58 HA SER 58 -22.965 -3.084 -2.663 361 HB2 SER 58 1HB SER 58 -20.653 -3.695 -3.658 362 HB3 SER 58 2HB SER 58 -22.097 -4.292 -4.473 363 HG SER 58 HG SER 58 -21.857 -2.772 -6.045 364 H GLY 59 H GLY 59 -22.486 0.059 -3.333 365 HA2 GLY 59 1HA GLY 59 -21.562 1.676 -1.935 366 HA3 GLY 59 2HA GLY 59 -20.735 0.401 -1.047 367 H SER 60 H SER 60 -18.781 1.587 -1.077 368 HA SER 60 HA SER 60 -17.565 2.260 -3.599 369 HB2 SER 60 1HB SER 60 -16.300 2.167 -0.849 370 HB3 SER 60 2HB SER 60 -15.699 3.029 -2.266 371 HG SER 60 HG SER 60 -17.426 3.874 -0.425 372 H SER 61 H SER 61 -16.546 0.834 -4.867 373 HA SER 61 HA SER 61 -15.622 -1.670 -3.634 374 HB2 SER 61 1HB SER 61 -15.889 -2.643 -5.932 375 HB3 SER 61 2HB SER 61 -17.397 -2.082 -5.211 376 HG SER 61 HG SER 61 -17.554 -0.562 -6.678 377 H CYS 62 H CYS 62 -13.652 -2.527 -4.179 378 HA CYS 62 HA CYS 62 -11.734 -0.669 -5.382 379 HB2 CYS 62 2HB CYS 62 -11.106 -1.489 -3.189 380 HB3 CYS 62 1HB CYS 62 -11.351 -3.160 -3.695 381 H ASN 63 H ASN 63 -10.685 -1.131 -7.253 382 HA ASN 63 HA ASN 63 -11.867 -2.996 -9.023 383 HB2 ASN 63 1HB ASN 63 -10.137 -2.367 -10.620 384 HB3 ASN 63 2HB ASN 63 -10.806 -0.930 -9.853 385 HD21 ASN 63 1HD2 ASN 63 -7.038 -0.922 -10.108 386 HD22 ASN 63 2HD2 ASN 63 -8.285 -1.322 -11.236 387 H ALA 64 H ALA 64 -9.312 -3.275 -6.762 388 HA ALA 64 HA ALA 64 -8.656 -5.898 -7.864 389 HB1 ALA 64 1HB ALA 64 -7.078 -4.189 -8.733 390 HB2 ALA 64 2HB ALA 64 -6.305 -5.486 -7.809 391 HB3 ALA 64 3HB ALA 64 -6.546 -3.899 -7.072 392 H ASN 65 H ASN 65 -6.763 -4.312 -5.383 393 HA ASN 65 HA ASN 65 -8.000 -6.089 -3.387 394 HB2 ASN 65 1HB ASN 65 -5.087 -5.448 -3.728 395 HB3 ASN 65 2HB ASN 65 -5.745 -6.385 -2.405 396 HD21 ASN 65 1HD2 ASN 65 -5.169 -8.011 -6.065 397 HD22 ASN 65 2HD2 ASN 65 -4.959 -6.325 -5.774 398 HA PRO 66 HA PRO 66 -8.293 -2.152 -1.283 399 HB2 PRO 66 2HB PRO 66 -10.094 -2.972 0.535 400 HB3 PRO 66 1HB PRO 66 -10.544 -2.620 -1.137 401 HG2 PRO 66 2HG PRO 66 -10.126 -5.250 0.197 402 HG3 PRO 66 1HG PRO 66 -11.304 -4.794 -1.042 403 HD2 PRO 66 2HD PRO 66 -8.921 -6.158 -1.510 404 HD3 PRO 66 1HD PRO 66 -9.850 -5.278 -2.736 405 H ALA 67 H ALA 67 -7.361 -1.359 0.558 406 HA ALA 67 HA ALA 67 -6.480 -3.157 2.653 407 HB1 ALA 67 1HB ALA 67 -4.116 -2.606 2.418 408 HB2 ALA 67 2HB ALA 67 -4.471 -1.673 0.964 409 HB3 ALA 67 3HB ALA 67 -4.722 -3.417 0.976 410 H CYS 68 H CYS 68 -5.740 -2.073 4.515 411 HA CYS 68 HA CYS 68 -6.073 0.855 4.490 412 HB2 CYS 68 2HB CYS 68 -5.982 -0.935 6.927 413 HB3 CYS 68 1HB CYS 68 -6.420 0.762 6.870 414 H CYS 69 H CYS 69 -4.211 1.939 4.417 415 HA CYS 69 HA CYS 69 -1.810 0.550 5.367 416 HB2 CYS 69 2HB CYS 69 -1.823 2.830 3.410 417 HB3 CYS 69 1HB CYS 69 -0.575 1.630 3.709 418 H ASP 70 H ASP 70 -0.077 1.962 6.182 419 HA ASP 70 HA ASP 70 -1.099 3.821 8.113 420 HB2 ASP 70 1HB ASP 70 0.854 2.300 8.516 421 HB3 ASP 70 2HB ASP 70 1.792 3.269 7.379 422 H ASN 71 H ASN 71 1.064 4.077 5.304 423 HA ASN 71 HA ASN 71 -0.140 6.665 4.673 424 HB2 ASN 71 1HB ASN 71 2.854 6.293 4.472 425 HB3 ASN 71 2HB ASN 71 1.937 7.767 4.232 426 HD21 ASN 71 1HD2 ASN 71 3.311 6.713 7.844 427 HD22 ASN 71 2HD2 ASN 71 3.583 5.780 6.414 428 H VAL 72 H VAL 72 -0.677 6.661 2.503 429 HA VAL 72 HA VAL 72 1.082 5.044 0.787 430 HB VAL 72 HB VAL 72 -0.579 4.447 -0.619 431 HG11 VAL 72 1HG1 VAL 72 -1.241 3.520 1.489 432 HG12 VAL 72 2HG1 VAL 72 -2.673 3.935 0.545 433 HG13 VAL 72 3HG1 VAL 72 -2.163 4.972 1.877 434 HG21 VAL 72 1HG2 VAL 72 -2.146 6.913 0.094 435 HG22 VAL 72 2HG2 VAL 72 -2.578 5.728 -1.142 436 HG23 VAL 72 3HG2 VAL 72 -1.108 6.699 -1.322 437 H TYR 73 H TYR 73 1.385 5.937 -1.398 438 HA TYR 73 HA TYR 73 1.604 8.869 -1.262 439 HB2 TYR 73 2HB TYR 73 3.606 6.833 -2.219 440 HB3 TYR 73 1HB TYR 73 3.826 8.579 -2.358 441 HD1 TYR 73 1HD TYR 73 4.426 9.902 -0.428 442 HD2 TYR 73 2HD TYR 73 3.647 5.739 -0.003 443 HE1 TYR 73 1HE TYR 73 5.331 9.969 1.856 444 HE2 TYR 73 2HE TYR 73 4.548 5.792 2.290 445 HH TYR 73 HH TYR 73 5.041 8.619 3.991 446 H THR 74 H THR 74 1.939 9.833 -3.477 447 HA THR 74 HA THR 74 -0.425 9.099 -4.860 448 HB THR 74 HB THR 74 0.340 10.993 -6.438 449 HG1 THR 74 1HG THR 74 1.896 12.354 -5.087 450 HG21 THR 74 1HG2 THR 74 -0.101 11.519 -3.496 451 HG22 THR 74 2HG2 THR 74 -1.360 11.264 -4.704 452 HG23 THR 74 3HG2 THR 74 -0.327 12.691 -4.794 453 H ASN 75 H ASN 75 2.848 8.175 -5.390 454 HA ASN 75 HA ASN 75 2.552 7.435 -8.137 455 HB2 ASN 75 1HB ASN 75 4.516 6.037 -7.804 456 HB3 ASN 75 2HB ASN 75 4.777 7.584 -7.014 457 HD21 ASN 75 1HD2 ASN 75 5.723 4.640 -4.863 458 HD22 ASN 75 2HD2 ASN 75 5.995 4.957 -6.538 459 H GLY 76 H GLY 76 1.359 6.320 -5.196 460 HA2 GLY 76 1HA GLY 76 -0.514 4.852 -5.175 461 HA3 GLY 76 2HA GLY 76 0.207 3.968 -6.514 462 H LEU 77 H LEU 77 2.487 4.845 -4.102 463 HA LEU 77 HA LEU 77 2.649 2.022 -3.383 464 HB2 LEU 77 1HB LEU 77 4.659 3.238 -4.119 465 HB3 LEU 77 2HB LEU 77 4.490 4.321 -2.766 466 HG LEU 77 HG LEU 77 6.253 2.459 -2.623 467 HD11 LEU 77 1HD1 LEU 77 5.661 3.810 -0.711 468 HD12 LEU 77 2HD1 LEU 77 5.879 2.125 -0.226 469 HD13 LEU 77 3HD1 LEU 77 4.252 2.797 -0.402 470 HD21 LEU 77 1HD2 LEU 77 3.804 0.841 -1.959 471 HD22 LEU 77 2HD2 LEU 77 5.485 0.321 -1.805 472 HD23 LEU 77 3HD2 LEU 77 4.808 0.649 -3.399 473 H GLY 78 H GLY 78 1.640 1.310 -1.667 474 HA2 GLY 78 1HA GLY 78 1.061 3.180 0.525 475 HA3 GLY 78 2HA GLY 78 0.225 1.667 0.222 476 H VAL 79 H VAL 79 1.832 2.895 2.540 477 HA VAL 79 HA VAL 79 3.670 0.630 2.973 478 HB VAL 79 HB VAL 79 3.435 3.128 4.663 479 HG11 VAL 79 1HG1 VAL 79 5.714 2.498 5.378 480 HG12 VAL 79 2HG1 VAL 79 5.586 1.029 4.410 481 HG13 VAL 79 3HG1 VAL 79 4.506 1.279 5.782 482 HG21 VAL 79 1HG2 VAL 79 4.011 3.778 2.393 483 HG22 VAL 79 2HG2 VAL 79 5.367 2.650 2.410 484 HG23 VAL 79 3HG2 VAL 79 5.350 4.031 3.510 485 H GLN 80 H GLN 80 3.243 -0.849 4.486 486 HA GLN 80 HA GLN 80 2.214 -2.024 6.111 487 HB2 GLN 80 1HB GLN 80 1.782 0.791 7.057 488 HB3 GLN 80 2HB GLN 80 1.054 -0.543 7.936 489 HG2 GLN 80 1HG GLN 80 3.967 -0.427 7.278 490 HG3 GLN 80 2HG GLN 80 3.301 0.269 8.758 491 HE21 GLN 80 1HE2 GLN 80 4.516 -3.253 9.263 492 HE22 GLN 80 2HE2 GLN 80 5.221 -1.848 8.535 493 H CYS 81 H CYS 81 0.927 -2.309 4.016 494 HA CYS 81 HA CYS 81 -1.842 -1.390 4.264 495 HB2 CYS 81 2HB CYS 81 -0.399 -2.714 1.962 496 HB3 CYS 81 1HB CYS 81 -2.092 -2.249 1.946 497 H ASN 82 H ASN 82 -3.145 -2.675 5.365 498 HA ASN 82 HA ASN 82 -2.776 -5.577 5.097 499 HB2 ASN 82 1HB ASN 82 -4.339 -5.788 7.025 500 HB3 ASN 82 2HB ASN 82 -2.868 -4.910 7.401 501 HD21 ASN 82 1HD2 ASN 82 -6.499 -3.124 7.649 502 HD22 ASN 82 2HD2 ASN 82 -6.306 -4.693 6.948 503 HA PRO 83 HA PRO 83 -6.042 -5.861 2.200 504 HB2 PRO 83 2HB PRO 83 -6.582 -8.557 3.249 505 HB3 PRO 83 1HB PRO 83 -6.031 -8.066 1.647 506 HG2 PRO 83 2HG PRO 83 -4.400 -9.300 3.386 507 HG3 PRO 83 1HG PRO 83 -3.811 -8.060 2.264 508 HD2 PRO 83 2HD PRO 83 -4.424 -7.838 5.186 509 HD3 PRO 83 1HD PRO 83 -3.093 -7.128 4.251 510 H ILE 84 H ILE 84 -8.258 -5.781 1.992 511 HA ILE 84 HA ILE 84 -9.792 -5.828 4.512 512 HB ILE 84 HB ILE 84 -10.382 -4.245 2.019 513 HG12 ILE 84 1HG1 ILE 84 -8.442 -3.345 3.117 514 HG13 ILE 84 2HG1 ILE 84 -9.812 -2.290 3.440 515 HG21 ILE 84 1HG2 ILE 84 -12.434 -4.787 3.161 516 HG22 ILE 84 2HG2 ILE 84 -12.053 -3.082 3.429 517 HG23 ILE 84 3HG2 ILE 84 -11.747 -4.263 4.702 518 HD11 ILE 84 1HD1 ILE 84 -10.088 -3.342 5.632 519 HD12 ILE 84 2HD1 ILE 84 -8.501 -2.599 5.440 520 HD13 ILE 84 3HD1 ILE 84 -8.677 -4.347 5.310 521 H ASN 85 H ASN 85 -11.764 -6.740 4.558 522 HA ASN 85 HA ASN 85 -12.308 -8.844 2.679 523 HB2 ASN 85 1HB ASN 85 -12.694 -9.253 5.036 524 HB3 ASN 85 2HB ASN 85 -13.771 -7.866 5.139 525 HD21 ASN 85 1HD2 ASN 85 -16.571 -9.544 3.889 526 HD22 ASN 85 2HD2 ASN 85 -15.853 -8.019 4.275 527 H VAL 86 H VAL 86 -13.165 -8.299 0.787 528 HA VAL 86 HA VAL 86 -15.535 -6.577 0.808 529 HB VAL 86 HB VAL 86 -14.884 -5.844 -1.530 530 HG11 VAL 86 1HG1 VAL 86 -13.090 -4.998 0.738 531 HG12 VAL 86 2HG1 VAL 86 -14.697 -4.361 0.393 532 HG13 VAL 86 3HG1 VAL 86 -13.377 -4.086 -0.743 533 HG21 VAL 86 1HG2 VAL 86 -13.193 -7.588 -1.926 534 HG22 VAL 86 2HG2 VAL 86 -12.166 -6.846 -0.698 535 HG23 VAL 86 3HG2 VAL 86 -12.554 -5.964 -2.176 536 H ASN 87 H ASN 87 -16.864 -8.282 0.859 537 HA ASN 87 HA ASN 87 -18.250 -9.891 0.037 538 HB2 ASN 87 1HB ASN 87 -18.036 -8.880 -2.208 539 HB3 ASN 87 2HB ASN 87 -16.574 -9.819 -2.484 540 HD21 ASN 87 1HD2 ASN 87 -19.938 -12.097 -2.095 541 HD22 ASN 87 2HD2 ASN 87 -19.543 -10.902 -0.909 542 H LEU 88 H LEU 88 -14.815 -10.229 -0.268 543 HA LEU 88 HA LEU 88 -13.362 -11.796 0.411 544 HB2 LEU 88 1HB LEU 88 -14.880 -12.191 2.324 545 HB3 LEU 88 2HB LEU 88 -15.746 -13.377 1.364 546 HG LEU 88 HG LEU 88 -13.579 -14.639 1.160 547 HD11 LEU 88 1HD1 LEU 88 -12.733 -12.720 3.317 548 HD12 LEU 88 2HD1 LEU 88 -12.038 -12.861 1.704 549 HD13 LEU 88 3HD1 LEU 88 -11.866 -14.184 2.858 550 HD21 LEU 88 1HD2 LEU 88 -13.755 -15.633 3.393 551 HD22 LEU 88 2HD2 LEU 88 -15.340 -15.354 2.672 552 HD23 LEU 88 3HD2 LEU 88 -14.734 -14.263 3.918 Start of MODEL 3 1 H1 GLY 1 1H GLY 1 -19.938 9.240 5.896 2 H2 GLY 1 2H GLY 1 -19.960 8.787 4.269 3 H3 GLY 1 3H GLY 1 -19.816 10.415 4.689 4 HA2 GLY 1 1HA GLY 1 -17.664 10.011 5.688 5 HA3 GLY 1 2HA GLY 1 -17.812 8.310 5.267 6 H SER 2 H SER 2 -15.646 9.746 4.411 7 HA SER 2 HA SER 2 -16.016 10.830 1.798 8 HB2 SER 2 1HB SER 2 -14.117 11.467 3.245 9 HB3 SER 2 2HB SER 2 -13.493 9.823 3.146 10 HG SER 2 HG SER 2 -12.433 10.649 1.516 11 H GLY 3 H GLY 3 -15.119 7.689 3.097 12 HA2 GLY 3 1HA GLY 3 -16.038 6.283 0.828 13 HA3 GLY 3 2HA GLY 3 -14.285 6.417 0.767 14 H SER 4 H SER 4 -16.850 4.614 1.894 15 HA SER 4 HA SER 4 -17.027 2.746 3.159 16 HB2 SER 4 1HB SER 4 -14.010 2.799 3.070 17 HB3 SER 4 2HB SER 4 -14.988 1.429 3.592 18 HG SER 4 HG SER 4 -15.435 2.579 1.062 19 H SER 5 H SER 5 -16.337 1.742 5.320 20 HA SER 5 HA SER 5 -15.905 3.898 7.282 21 HB2 SER 5 1HB SER 5 -17.480 1.330 7.525 22 HB3 SER 5 2HB SER 5 -17.199 2.472 8.831 23 HG SER 5 HG SER 5 -18.177 4.052 7.241 24 H GLN 6 H GLN 6 -14.190 1.764 5.825 25 HA GLN 6 HA GLN 6 -13.089 0.340 8.097 26 HB2 GLN 6 1HB GLN 6 -12.298 0.168 5.206 27 HB3 GLN 6 2HB GLN 6 -11.784 -0.919 6.479 28 HG2 GLN 6 1HG GLN 6 -14.565 -0.603 5.384 29 HG3 GLN 6 2HG GLN 6 -13.467 -1.959 5.138 30 HE21 GLN 6 1HE2 GLN 6 -14.148 -3.483 8.212 31 HE22 GLN 6 2HE2 GLN 6 -13.101 -3.405 6.838 32 H CYS 7 H CYS 7 -10.698 0.178 8.224 33 HA CYS 7 HA CYS 7 -8.612 0.961 8.421 34 HB2 CYS 7 2HB CYS 7 -9.387 3.037 6.408 35 HB3 CYS 7 1HB CYS 7 -7.764 2.430 6.760 36 H ASN 8 H ASN 8 -8.311 1.768 10.372 37 HA ASN 8 HA ASN 8 -9.605 4.252 11.166 38 HB2 ASN 8 1HB ASN 8 -7.938 2.293 12.756 39 HB3 ASN 8 2HB ASN 8 -8.720 3.719 13.425 40 HD21 ASN 8 1HD2 ASN 8 -10.818 0.333 12.691 41 HD22 ASN 8 2HD2 ASN 8 -9.164 0.509 12.216 42 H ALA 9 H ALA 9 -6.509 3.109 10.162 43 HA ALA 9 HA ALA 9 -5.081 5.363 11.335 44 HB1 ALA 9 1HB ALA 9 -3.068 4.281 10.518 45 HB2 ALA 9 2HB ALA 9 -4.036 3.108 9.628 46 HB3 ALA 9 3HB ALA 9 -4.072 3.122 11.390 47 H GLY 10 H GLY 10 -7.000 5.153 8.800 48 HA2 GLY 10 1HA GLY 10 -6.316 7.439 7.490 49 HA3 GLY 10 2HA GLY 10 -5.364 6.196 6.685 50 HA PRO 11 HA PRO 11 -9.687 6.155 4.921 51 HB2 PRO 11 2HB PRO 11 -9.185 7.010 2.433 52 HB3 PRO 11 1HB PRO 11 -9.408 8.152 3.765 53 HG2 PRO 11 2HG PRO 11 -6.875 7.153 2.530 54 HG3 PRO 11 1HG PRO 11 -7.315 8.813 2.976 55 HD2 PRO 11 2HD PRO 11 -5.749 7.201 4.533 56 HD3 PRO 11 1HD PRO 11 -6.782 8.486 5.189 57 H VAL 12 H VAL 12 -10.454 4.757 3.217 58 HA VAL 12 HA VAL 12 -9.027 2.315 3.086 59 HB VAL 12 HB VAL 12 -10.844 1.659 1.429 60 HG11 VAL 12 1HG1 VAL 12 -12.554 1.502 3.163 61 HG12 VAL 12 2HG1 VAL 12 -11.706 2.716 4.121 62 HG13 VAL 12 3HG1 VAL 12 -10.956 1.149 3.822 63 HG21 VAL 12 1HG2 VAL 12 -12.767 3.129 1.237 64 HG22 VAL 12 2HG2 VAL 12 -11.324 3.949 0.637 65 HG23 VAL 12 3HG2 VAL 12 -11.966 4.345 2.230 66 H GLN 13 H GLN 13 -7.778 1.442 1.538 67 HA GLN 13 HA GLN 13 -7.309 3.083 -0.863 68 HB2 GLN 13 1HB GLN 13 -5.325 1.235 0.472 69 HB3 GLN 13 2HB GLN 13 -5.022 2.321 -0.873 70 HG2 GLN 13 1HG GLN 13 -5.787 3.175 1.900 71 HG3 GLN 13 2HG GLN 13 -4.153 3.169 1.244 72 HE21 GLN 13 1HE2 GLN 13 -5.911 6.519 0.945 73 HE22 GLN 13 2HE2 GLN 13 -5.878 5.358 2.228 74 H CYS 14 H CYS 14 -7.061 2.066 -2.814 75 HA CYS 14 HA CYS 14 -7.701 -0.804 -2.875 76 HB2 CYS 14 2HB CYS 14 -9.557 0.512 -3.750 77 HB3 CYS 14 1HB CYS 14 -8.479 1.332 -4.873 78 H CYS 15 H CYS 15 -5.812 -1.737 -3.138 79 HA CYS 15 HA CYS 15 -3.786 -0.554 -4.864 80 HB2 CYS 15 2HB CYS 15 -3.732 -2.927 -2.989 81 HB3 CYS 15 1HB CYS 15 -2.361 -2.415 -3.961 82 H ASN 16 H ASN 16 -2.866 -1.641 -6.606 83 HA ASN 16 HA ASN 16 -4.513 -3.507 -8.017 84 HB2 ASN 16 1HB ASN 16 -2.868 -1.766 -8.966 85 HB3 ASN 16 2HB ASN 16 -1.628 -2.951 -8.591 86 HD21 ASN 16 1HD2 ASN 16 -2.105 -4.068 -11.856 87 HD22 ASN 16 2HD2 ASN 16 -1.092 -3.201 -10.758 88 H THR 17 H THR 17 -1.567 -3.624 -6.134 89 HA THR 17 HA THR 17 -1.881 -6.520 -5.847 90 HB THR 17 HB THR 17 0.738 -5.138 -6.500 91 HG1 THR 17 1HG THR 17 -1.156 -6.422 -8.014 92 HG21 THR 17 1HG2 THR 17 1.185 -6.880 -4.923 93 HG22 THR 17 2HG2 THR 17 1.645 -7.460 -6.526 94 HG23 THR 17 3HG2 THR 17 0.136 -8.003 -5.796 95 H LEU 18 H LEU 18 -1.919 -7.024 -3.745 96 HA LEU 18 HA LEU 18 -0.573 -5.238 -1.844 97 HB2 LEU 18 1HB LEU 18 -2.619 -7.423 -1.465 98 HB3 LEU 18 2HB LEU 18 -1.748 -6.700 -0.126 99 HG LEU 18 HG LEU 18 -3.601 -5.264 -2.017 100 HD11 LEU 18 1HD1 LEU 18 -4.713 -6.735 -0.383 101 HD12 LEU 18 2HD1 LEU 18 -5.040 -5.028 -0.088 102 HD13 LEU 18 3HD1 LEU 18 -3.873 -5.887 0.917 103 HD21 LEU 18 1HD2 LEU 18 -1.768 -3.826 -1.322 104 HD22 LEU 18 2HD2 LEU 18 -2.068 -4.240 0.365 105 HD23 LEU 18 3HD2 LEU 18 -3.275 -3.339 -0.553 106 H THR 19 H THR 19 1.343 -5.780 -1.149 107 HA THR 19 HA THR 19 2.109 -8.521 -0.759 108 HB THR 19 HB THR 19 2.500 -8.396 -3.137 109 HG1 THR 19 1HG THR 19 4.132 -9.571 -2.465 110 HG21 THR 19 1HG2 THR 19 4.004 -5.860 -2.538 111 HG22 THR 19 2HG2 THR 19 2.650 -6.100 -3.649 112 HG23 THR 19 3HG2 THR 19 4.236 -6.765 -4.033 113 H SER 20 H SER 20 4.844 -8.190 -0.545 114 HA SER 20 HA SER 20 4.950 -6.302 1.705 115 HB2 SER 20 1HB SER 20 6.954 -7.804 2.359 116 HB3 SER 20 2HB SER 20 5.331 -8.468 2.549 117 HG SER 20 HG SER 20 7.370 -9.244 0.881 118 H ALA 21 H ALA 21 7.143 -5.369 2.121 119 HA ALA 21 HA ALA 21 7.938 -3.928 -0.189 120 HB1 ALA 21 1HB ALA 21 7.964 -2.944 2.030 121 HB2 ALA 21 2HB ALA 21 9.563 -2.858 1.289 122 HB3 ALA 21 3HB ALA 21 9.228 -4.066 2.533 123 H SER 22 H SER 22 8.714 -7.023 0.573 124 HA SER 22 HA SER 22 11.432 -7.014 -0.317 125 HB2 SER 22 1HB SER 22 10.941 -9.513 -0.278 126 HB3 SER 22 2HB SER 22 10.841 -8.678 1.255 127 HG SER 22 HG SER 22 8.779 -9.655 -0.401 128 H ASN 23 H ASN 23 8.443 -6.696 -1.770 129 HA ASN 23 HA ASN 23 8.966 -8.255 -4.148 130 HB2 ASN 23 1HB ASN 23 6.655 -7.665 -3.083 131 HB3 ASN 23 2HB ASN 23 6.835 -6.138 -3.934 132 HD21 ASN 23 1HD2 ASN 23 5.883 -9.528 -5.914 133 HD22 ASN 23 2HD2 ASN 23 6.272 -9.526 -4.231 134 H SER 24 H SER 24 9.711 -7.526 -6.063 135 HA SER 24 HA SER 24 11.274 -5.176 -6.120 136 HB2 SER 24 1HB SER 24 10.360 -6.895 -8.439 137 HB3 SER 24 2HB SER 24 11.711 -5.762 -8.450 138 HG SER 24 HG SER 24 12.101 -7.357 -6.394 139 H GLN 25 H GLN 25 7.960 -5.787 -6.894 140 HA GLN 25 HA GLN 25 7.479 -3.548 -8.555 141 HB2 GLN 25 1HB GLN 25 5.951 -5.543 -8.187 142 HB3 GLN 25 2HB GLN 25 5.538 -4.837 -6.624 143 HG2 GLN 25 1HG GLN 25 3.834 -4.217 -8.095 144 HG3 GLN 25 2HG GLN 25 4.841 -2.791 -7.854 145 HE21 GLN 25 1HE2 GLN 25 4.682 -2.420 -11.322 146 HE22 GLN 25 2HE2 GLN 25 4.163 -1.843 -9.776 147 H ALA 26 H ALA 26 7.219 -4.144 -5.086 148 HA ALA 26 HA ALA 26 6.273 -1.538 -4.429 149 HB1 ALA 26 1HB ALA 26 6.688 -2.230 -2.124 150 HB2 ALA 26 2HB ALA 26 7.565 -3.648 -2.701 151 HB3 ALA 26 3HB ALA 26 5.839 -3.487 -3.024 152 H ALA 27 H ALA 27 9.444 -3.139 -4.144 153 HA ALA 27 HA ALA 27 10.751 -0.999 -2.890 154 HB1 ALA 27 1HB ALA 27 12.840 -2.070 -3.628 155 HB2 ALA 27 2HB ALA 27 11.908 -3.133 -4.685 156 HB3 ALA 27 3HB ALA 27 11.705 -3.229 -2.935 157 H GLY 28 H GLY 28 10.110 -1.605 -6.300 158 HA2 GLY 28 1HA GLY 28 11.727 0.392 -7.405 159 HA3 GLY 28 2HA GLY 28 10.184 -0.135 -8.068 160 H LEU 29 H LEU 29 8.354 0.594 -6.360 161 HA LEU 29 HA LEU 29 8.017 3.374 -6.599 162 HB2 LEU 29 1HB LEU 29 6.726 1.421 -4.736 163 HB3 LEU 29 2HB LEU 29 6.132 3.015 -5.058 164 HG LEU 29 HG LEU 29 6.314 0.788 -7.079 165 HD11 LEU 29 1HD1 LEU 29 4.584 0.353 -5.464 166 HD12 LEU 29 2HD1 LEU 29 3.844 0.880 -6.976 167 HD13 LEU 29 3HD1 LEU 29 3.977 2.002 -5.619 168 HD21 LEU 29 1HD2 LEU 29 5.023 2.312 -8.517 169 HD22 LEU 29 2HD2 LEU 29 6.618 2.955 -8.130 170 HD23 LEU 29 3HD2 LEU 29 5.189 3.582 -7.304 171 H ILE 30 H ILE 30 8.818 1.365 -3.792 172 HA ILE 30 HA ILE 30 9.049 3.278 -1.816 173 HB ILE 30 HB ILE 30 10.609 0.744 -2.251 174 HG12 ILE 30 1HG1 ILE 30 8.273 1.404 -0.461 175 HG13 ILE 30 2HG1 ILE 30 8.147 0.578 -2.004 176 HG21 ILE 30 1HG2 ILE 30 11.752 2.419 -0.726 177 HG22 ILE 30 2HG2 ILE 30 11.409 0.833 -0.034 178 HG23 ILE 30 3HG2 ILE 30 10.379 2.206 0.364 179 HD11 ILE 30 1HD1 ILE 30 9.641 -0.444 0.390 180 HD12 ILE 30 2HD1 ILE 30 9.391 -1.286 -1.141 181 HD13 ILE 30 3HD1 ILE 30 8.017 -0.928 -0.093 182 H GLN 31 H GLN 31 11.520 2.141 -4.063 183 HA GLN 31 HA GLN 31 13.493 3.895 -3.112 184 HB2 GLN 31 1HB GLN 31 13.218 2.138 -5.509 185 HB3 GLN 31 2HB GLN 31 14.604 3.221 -5.355 186 HG2 GLN 31 1HG GLN 31 15.009 2.121 -3.122 187 HG3 GLN 31 2HG GLN 31 13.786 0.945 -3.591 188 HE21 GLN 31 1HE2 GLN 31 15.818 -0.778 -5.839 189 HE22 GLN 31 2HE2 GLN 31 14.211 -0.492 -5.265 190 H GLN 32 H GLN 32 10.859 4.311 -5.308 191 HA GLN 32 HA GLN 32 11.985 6.581 -6.672 192 HB2 GLN 32 1HB GLN 32 9.137 5.636 -6.343 193 HB3 GLN 32 2HB GLN 32 9.577 7.057 -7.277 194 HG2 GLN 32 1HG GLN 32 10.577 4.279 -7.826 195 HG3 GLN 32 2HG GLN 32 9.191 5.025 -8.614 196 HE21 GLN 32 1HE2 GLN 32 11.070 6.994 -10.792 197 HE22 GLN 32 2HE2 GLN 32 9.520 6.666 -10.103 198 H LEU 33 H LEU 33 9.836 6.087 -3.941 199 HA LEU 33 HA LEU 33 9.501 8.880 -3.397 200 HB2 LEU 33 1HB LEU 33 9.082 6.770 -1.332 201 HB3 LEU 33 2HB LEU 33 8.146 8.219 -1.634 202 HG LEU 33 HG LEU 33 8.132 5.782 -3.412 203 HD11 LEU 33 1HD1 LEU 33 7.216 5.350 -1.162 204 HD12 LEU 33 2HD1 LEU 33 6.025 5.218 -2.449 205 HD13 LEU 33 3HD1 LEU 33 6.053 6.651 -1.421 206 HD21 LEU 33 1HD2 LEU 33 7.501 7.641 -4.708 207 HD22 LEU 33 2HD2 LEU 33 6.538 8.329 -3.398 208 HD23 LEU 33 3HD2 LEU 33 5.990 6.861 -4.218 209 H GLY 34 H GLY 34 11.724 6.395 -2.540 210 HA2 GLY 34 1HA GLY 34 13.814 6.594 -1.553 211 HA3 GLY 34 2HA GLY 34 13.436 8.261 -1.137 212 H LEU 35 H LEU 35 11.534 5.398 -0.410 213 HA LEU 35 HA LEU 35 11.292 6.225 2.332 214 HB2 LEU 35 1HB LEU 35 10.154 3.997 0.714 215 HB3 LEU 35 2HB LEU 35 9.918 4.058 2.441 216 HG LEU 35 HG LEU 35 8.969 6.069 0.411 217 HD11 LEU 35 1HD1 LEU 35 7.482 4.180 2.222 218 HD12 LEU 35 2HD1 LEU 35 7.689 3.998 0.480 219 HD13 LEU 35 3HD1 LEU 35 6.754 5.350 1.120 220 HD21 LEU 35 1HD2 LEU 35 8.736 6.091 3.416 221 HD22 LEU 35 2HD2 LEU 35 7.863 7.166 2.325 222 HD23 LEU 35 3HD2 LEU 35 9.622 7.244 2.417 223 H SER 36 H SER 36 12.970 5.855 3.638 224 HA SER 36 HA SER 36 14.196 3.193 3.613 225 HB2 SER 36 1HB SER 36 15.713 5.177 3.638 226 HB3 SER 36 2HB SER 36 15.021 5.649 5.188 227 HG SER 36 HG SER 36 16.408 3.230 4.622 228 H GLY 37 H GLY 37 14.232 1.930 5.528 229 HA2 GLY 37 1HA GLY 37 13.644 1.606 7.843 230 HA3 GLY 37 2HA GLY 37 12.378 2.811 7.645 231 H VAL 38 H VAL 38 11.512 1.710 5.087 232 HA VAL 38 HA VAL 38 9.683 -0.294 5.985 233 HB VAL 38 HB VAL 38 10.395 0.443 3.135 234 HG11 VAL 38 1HG1 VAL 38 8.105 -0.312 2.654 235 HG12 VAL 38 2HG1 VAL 38 7.930 -0.799 4.340 236 HG13 VAL 38 3HG1 VAL 38 9.115 -1.599 3.311 237 HG21 VAL 38 1HG2 VAL 38 8.502 2.016 3.243 238 HG22 VAL 38 2HG2 VAL 38 9.805 2.460 4.347 239 HG23 VAL 38 3HG2 VAL 38 8.348 1.687 4.970 240 H GLY 39 H GLY 39 10.456 -2.250 6.526 241 HA2 GLY 39 1HA GLY 39 12.718 -3.395 5.086 242 HA3 GLY 39 2HA GLY 39 12.023 -3.998 6.582 243 H ALA 40 H ALA 40 12.375 -6.027 5.203 244 HA ALA 40 HA ALA 40 10.697 -6.399 2.931 245 HB1 ALA 40 1HB ALA 40 12.293 -8.388 4.534 246 HB2 ALA 40 2HB ALA 40 12.815 -7.549 3.073 247 HB3 ALA 40 3HB ALA 40 11.509 -8.731 2.994 248 H ASN 41 H ASN 41 10.224 -6.827 6.303 249 HA ASN 41 HA ASN 41 8.061 -8.741 5.998 250 HB2 ASN 41 1HB ASN 41 9.584 -8.777 7.972 251 HB3 ASN 41 2HB ASN 41 8.955 -7.207 8.453 252 HD21 ASN 41 1HD2 ASN 41 6.801 -8.983 10.524 253 HD22 ASN 41 2HD2 ASN 41 8.175 -7.941 10.397 254 H VAL 42 H VAL 42 8.426 -5.481 5.585 255 HA VAL 42 HA VAL 42 6.004 -4.563 6.814 256 HB VAL 42 HB VAL 42 7.753 -3.135 4.815 257 HG11 VAL 42 1HG1 VAL 42 6.881 -1.093 5.941 258 HG12 VAL 42 2HG1 VAL 42 5.712 -2.112 6.792 259 HG13 VAL 42 3HG1 VAL 42 5.651 -1.983 5.032 260 HG21 VAL 42 1HG2 VAL 42 8.701 -2.094 6.871 261 HG22 VAL 42 2HG2 VAL 42 9.112 -3.793 6.603 262 HG23 VAL 42 3HG2 VAL 42 7.872 -3.355 7.790 263 HA PRO 43 HA PRO 43 3.349 -5.558 3.393 264 HB2 PRO 43 2HB PRO 43 1.342 -3.898 4.581 265 HB3 PRO 43 1HB PRO 43 1.418 -5.650 4.556 266 HG2 PRO 43 2HG PRO 43 1.715 -4.035 6.790 267 HG3 PRO 43 1HG PRO 43 2.143 -5.748 6.680 268 HD2 PRO 43 2HD PRO 43 3.877 -3.371 6.653 269 HD3 PRO 43 1HD PRO 43 4.264 -5.038 7.090 270 H VAL 44 H VAL 44 2.831 -4.477 1.535 271 HA VAL 44 HA VAL 44 2.694 -1.557 1.623 272 HB VAL 44 HB VAL 44 4.101 -1.344 -0.385 273 HG11 VAL 44 1HG1 VAL 44 6.288 -1.791 0.692 274 HG12 VAL 44 2HG1 VAL 44 5.441 -2.675 1.963 275 HG13 VAL 44 3HG1 VAL 44 5.151 -0.950 1.745 276 HG21 VAL 44 1HG2 VAL 44 5.588 -3.321 -0.922 277 HG22 VAL 44 2HG2 VAL 44 3.907 -3.434 -1.439 278 HG23 VAL 44 3HG2 VAL 44 4.450 -4.297 0.004 279 H GLY 45 H GLY 45 1.676 -0.646 -0.241 280 HA2 GLY 45 1HA GLY 45 0.029 -2.623 -1.676 281 HA3 GLY 45 2HA GLY 45 -0.562 -1.042 -1.209 282 H ILE 46 H ILE 46 0.315 -2.754 -3.709 283 HA ILE 46 HA ILE 46 1.952 -0.832 -5.143 284 HB ILE 46 HB ILE 46 0.752 -3.501 -5.883 285 HG12 ILE 46 1HG1 ILE 46 2.931 -4.418 -5.835 286 HG13 ILE 46 2HG1 ILE 46 3.690 -2.856 -5.914 287 HG21 ILE 46 1HG2 ILE 46 2.413 -1.696 -7.622 288 HG22 ILE 46 2HG2 ILE 46 0.714 -2.111 -7.852 289 HG23 ILE 46 3HG2 ILE 46 1.956 -3.354 -8.013 290 HD11 ILE 46 1HD1 ILE 46 3.124 -2.420 -3.620 291 HD12 ILE 46 2HD1 ILE 46 4.001 -3.945 -3.781 292 HD13 ILE 46 3HD1 ILE 46 2.253 -3.952 -3.533 293 H ASN 47 H ASN 47 0.991 0.845 -6.149 294 HA ASN 47 HA ASN 47 -0.439 2.057 -7.449 295 HB2 ASN 47 1HB ASN 47 -0.176 -0.049 -8.899 296 HB3 ASN 47 2HB ASN 47 -1.724 -0.546 -8.252 297 HD21 ASN 47 1HD2 ASN 47 -1.482 2.365 -11.061 298 HD22 ASN 47 2HD2 ASN 47 -0.079 1.768 -10.249 299 H CYS 48 H CYS 48 -1.180 2.233 -4.963 300 HA CYS 48 HA CYS 48 -3.956 1.357 -4.737 301 HB2 CYS 48 2HB CYS 48 -1.869 1.643 -2.859 302 HB3 CYS 48 1HB CYS 48 -3.079 2.846 -2.464 303 H ASN 49 H ASN 49 -5.630 2.636 -4.876 304 HA ASN 49 HA ASN 49 -5.245 5.542 -4.618 305 HB2 ASN 49 1HB ASN 49 -7.202 5.805 -6.170 306 HB3 ASN 49 2HB ASN 49 -5.753 5.168 -6.928 307 HD21 ASN 49 1HD2 ASN 49 -7.185 2.123 -7.833 308 HD22 ASN 49 2HD2 ASN 49 -5.747 3.073 -7.696 309 HA PRO 50 HA PRO 50 -8.052 5.232 -1.300 310 HB2 PRO 50 2HB PRO 50 -9.058 7.914 -1.940 311 HB3 PRO 50 1HB PRO 50 -8.109 7.382 -0.550 312 HG2 PRO 50 2HG PRO 50 -7.055 8.949 -2.472 313 HG3 PRO 50 1HG PRO 50 -6.093 7.723 -1.624 314 HD2 PRO 50 2HD PRO 50 -7.381 7.582 -4.327 315 HD3 PRO 50 1HD PRO 50 -5.756 7.070 -3.840 316 H ILE 51 H ILE 51 -9.949 4.211 -1.204 317 HA ILE 51 HA ILE 51 -11.709 4.260 -3.495 318 HB ILE 51 HB ILE 51 -12.486 2.938 -0.934 319 HG12 ILE 51 1HG1 ILE 51 -10.381 1.905 -2.846 320 HG13 ILE 51 2HG1 ILE 51 -10.113 2.371 -1.173 321 HG21 ILE 51 1HG2 ILE 51 -13.492 1.336 -2.395 322 HG22 ILE 51 2HG2 ILE 51 -12.645 2.002 -3.791 323 HG23 ILE 51 3HG2 ILE 51 -13.903 2.943 -2.994 324 HD11 ILE 51 1HD1 ILE 51 -11.517 0.557 -0.414 325 HD12 ILE 51 2HD1 ILE 51 -10.226 -0.051 -1.452 326 HD13 ILE 51 3HD1 ILE 51 -11.866 0.111 -2.082 327 H THR 52 H THR 52 -12.405 6.436 -3.445 328 HA THR 52 HA THR 52 -14.273 7.016 -1.251 329 HB THR 52 HB THR 52 -13.789 9.435 -1.688 330 HG1 THR 52 1HG THR 52 -12.891 9.489 -3.697 331 HG21 THR 52 1HG2 THR 52 -12.714 8.286 0.169 332 HG22 THR 52 2HG2 THR 52 -11.572 9.406 -0.575 333 HG23 THR 52 3HG2 THR 52 -11.454 7.676 -0.905 334 H GLY 53 H GLY 53 -14.608 5.717 -3.931 335 HA2 GLY 53 1HA GLY 53 -16.110 7.581 -5.526 336 HA3 GLY 53 2HA GLY 53 -15.932 5.859 -5.817 337 H ILE 54 H ILE 54 -17.577 8.196 -3.745 338 HA ILE 54 HA ILE 54 -19.813 6.300 -3.491 339 HB ILE 54 HB ILE 54 -19.110 8.708 -1.803 340 HG12 ILE 54 1HG1 ILE 54 -19.222 5.754 -1.142 341 HG13 ILE 54 2HG1 ILE 54 -17.753 6.696 -1.374 342 HG21 ILE 54 1HG2 ILE 54 -21.541 8.498 -2.121 343 HG22 ILE 54 2HG2 ILE 54 -21.056 8.187 -0.451 344 HG23 ILE 54 3HG2 ILE 54 -21.463 6.841 -1.516 345 HD11 ILE 54 1HD1 ILE 54 -18.231 6.330 0.983 346 HD12 ILE 54 2HD1 ILE 54 -19.791 7.130 0.796 347 HD13 ILE 54 3HD1 ILE 54 -18.301 8.045 0.575 348 H GLY 55 H GLY 55 -21.732 6.784 -4.369 349 HA2 GLY 55 1HA GLY 55 -23.147 8.979 -4.715 350 HA3 GLY 55 2HA GLY 55 -21.916 9.236 -5.942 351 H ALA 56 H ALA 56 -21.618 7.371 -7.499 352 HA ALA 56 HA ALA 56 -24.127 6.533 -8.576 353 HB1 ALA 56 1HB ALA 56 -21.339 5.572 -9.235 354 HB2 ALA 56 2HB ALA 56 -22.172 6.919 -10.009 355 HB3 ALA 56 3HB ALA 56 -22.790 5.278 -10.194 356 H GLY 57 H GLY 57 -21.635 5.124 -6.580 357 HA2 GLY 57 1HA GLY 57 -23.499 2.920 -5.962 358 HA3 GLY 57 2HA GLY 57 -21.753 2.697 -6.007 359 H SER 58 H SER 58 -23.990 2.626 -3.849 360 HA SER 58 HA SER 58 -23.191 4.645 -1.978 361 HB2 SER 58 1HB SER 58 -24.732 2.094 -1.452 362 HB3 SER 58 2HB SER 58 -24.696 3.538 -0.441 363 HG SER 58 HG SER 58 -25.406 4.183 -2.958 364 H GLY 59 H GLY 59 -22.540 1.211 -2.445 365 HA2 GLY 59 1HA GLY 59 -20.606 1.236 -0.250 366 HA3 GLY 59 2HA GLY 59 -21.154 -0.182 -1.137 367 H SER 60 H SER 60 -18.832 2.318 -0.923 368 HA SER 60 HA SER 60 -17.788 2.411 -3.492 369 HB2 SER 60 1HB SER 60 -15.624 3.025 -2.244 370 HB3 SER 60 2HB SER 60 -17.038 4.034 -1.956 371 HG SER 60 HG SER 60 -16.625 1.825 -0.292 372 H SER 61 H SER 61 -16.520 1.119 -4.689 373 HA SER 61 HA SER 61 -15.765 -1.455 -3.483 374 HB2 SER 61 1HB SER 61 -17.605 -1.660 -5.084 375 HB3 SER 61 2HB SER 61 -16.643 -0.850 -6.315 376 HG SER 61 HG SER 61 -16.039 -3.340 -5.082 377 H CYS 62 H CYS 62 -13.861 -2.448 -4.176 378 HA CYS 62 HA CYS 62 -11.862 -0.607 -5.273 379 HB2 CYS 62 2HB CYS 62 -11.187 -1.459 -3.149 380 HB3 CYS 62 1HB CYS 62 -11.632 -3.105 -3.582 381 H ASN 63 H ASN 63 -10.838 -1.025 -7.144 382 HA ASN 63 HA ASN 63 -11.999 -2.891 -8.951 383 HB2 ASN 63 1HB ASN 63 -10.155 -2.151 -10.497 384 HB3 ASN 63 2HB ASN 63 -11.189 -0.856 -9.895 385 HD21 ASN 63 1HD2 ASN 63 -7.222 -0.965 -9.051 386 HD22 ASN 63 2HD2 ASN 63 -8.022 -2.275 -9.855 387 H ALA 64 H ALA 64 -9.512 -3.215 -6.652 388 HA ALA 64 HA ALA 64 -8.777 -5.767 -7.839 389 HB1 ALA 64 1HB ALA 64 -7.201 -4.082 -8.730 390 HB2 ALA 64 2HB ALA 64 -6.418 -5.358 -7.792 391 HB3 ALA 64 3HB ALA 64 -6.661 -3.761 -7.078 392 H ASN 65 H ASN 65 -6.822 -4.226 -5.374 393 HA ASN 65 HA ASN 65 -8.023 -6.034 -3.375 394 HB2 ASN 65 1HB ASN 65 -5.101 -5.418 -3.733 395 HB3 ASN 65 2HB ASN 65 -5.769 -6.407 -2.452 396 HD21 ASN 65 1HD2 ASN 65 -5.254 -7.879 -6.197 397 HD22 ASN 65 2HD2 ASN 65 -5.024 -6.208 -5.834 398 HA PRO 66 HA PRO 66 -8.264 -2.112 -1.244 399 HB2 PRO 66 2HB PRO 66 -10.009 -2.967 0.629 400 HB3 PRO 66 1HB PRO 66 -10.501 -2.554 -1.017 401 HG2 PRO 66 2HG PRO 66 -10.128 -5.220 0.232 402 HG3 PRO 66 1HG PRO 66 -11.281 -4.712 -1.008 403 HD2 PRO 66 2HD PRO 66 -8.905 -6.112 -1.461 404 HD3 PRO 66 1HD PRO 66 -9.835 -5.234 -2.687 405 H ALA 67 H ALA 67 -7.310 -1.302 0.577 406 HA ALA 67 HA ALA 67 -6.323 -3.117 2.629 407 HB1 ALA 67 1HB ALA 67 -4.012 -2.414 2.383 408 HB2 ALA 67 2HB ALA 67 -4.447 -1.416 0.995 409 HB3 ALA 67 3HB ALA 67 -4.588 -3.173 0.899 410 H CYS 68 H CYS 68 -5.814 -2.108 4.556 411 HA CYS 68 HA CYS 68 -6.212 0.800 4.661 412 HB2 CYS 68 2HB CYS 68 -6.032 -1.141 6.971 413 HB3 CYS 68 1HB CYS 68 -6.437 0.561 7.069 414 H CYS 69 H CYS 69 -4.353 1.776 4.218 415 HA CYS 69 HA CYS 69 -1.880 0.574 5.197 416 HB2 CYS 69 2HB CYS 69 -2.169 2.879 3.281 417 HB3 CYS 69 1HB CYS 69 -0.757 1.879 3.570 418 H ASP 70 H ASP 70 -0.322 1.830 6.279 419 HA ASP 70 HA ASP 70 -1.391 3.697 8.157 420 HB2 ASP 70 1HB ASP 70 0.492 2.118 8.639 421 HB3 ASP 70 2HB ASP 70 1.505 3.054 7.549 422 H ASN 71 H ASN 71 0.822 3.914 5.412 423 HA ASN 71 HA ASN 71 -0.136 6.623 4.877 424 HB2 ASN 71 1HB ASN 71 2.806 5.894 5.012 425 HB3 ASN 71 2HB ASN 71 2.181 7.387 4.326 426 HD21 ASN 71 1HD2 ASN 71 2.601 6.921 8.314 427 HD22 ASN 71 2HD2 ASN 71 2.913 5.641 7.191 428 H VAL 72 H VAL 72 -0.263 7.042 2.664 429 HA VAL 72 HA VAL 72 1.174 5.252 0.881 430 HB VAL 72 HB VAL 72 -0.608 4.042 0.350 431 HG11 VAL 72 1HG1 VAL 72 -1.775 4.481 2.325 432 HG12 VAL 72 2HG1 VAL 72 -2.943 4.664 1.015 433 HG13 VAL 72 3HG1 VAL 72 -2.252 6.093 1.785 434 HG21 VAL 72 1HG2 VAL 72 -2.178 4.899 -1.266 435 HG22 VAL 72 2HG2 VAL 72 -0.576 5.567 -1.590 436 HG23 VAL 72 3HG2 VAL 72 -1.802 6.559 -0.801 437 H TYR 73 H TYR 73 1.732 6.096 -1.051 438 HA TYR 73 HA TYR 73 1.631 9.030 -1.057 439 HB2 TYR 73 2HB TYR 73 3.677 7.108 -2.193 440 HB3 TYR 73 1HB TYR 73 3.801 8.864 -2.236 441 HD1 TYR 73 1HD TYR 73 3.723 5.930 0.034 442 HD2 TYR 73 2HD TYR 73 4.611 10.077 -0.350 443 HE1 TYR 73 1HE TYR 73 4.768 5.900 2.261 444 HE2 TYR 73 2HE TYR 73 5.661 10.058 1.873 445 HH TYR 73 HH TYR 73 6.273 7.117 3.604 446 H THR 74 H THR 74 1.835 10.024 -3.242 447 HA THR 74 HA THR 74 -0.539 9.315 -4.580 448 HB THR 74 HB THR 74 1.539 11.292 -5.518 449 HG1 THR 74 1HG THR 74 1.105 12.111 -3.584 450 HG21 THR 74 1HG2 THR 74 -0.247 10.839 -7.139 451 HG22 THR 74 2HG2 THR 74 -0.383 12.470 -6.481 452 HG23 THR 74 3HG2 THR 74 -1.456 11.194 -5.907 453 H ASN 75 H ASN 75 2.744 8.405 -5.210 454 HA ASN 75 HA ASN 75 2.407 7.658 -7.936 455 HB2 ASN 75 1HB ASN 75 4.362 6.252 -7.646 456 HB3 ASN 75 2HB ASN 75 4.640 7.778 -6.823 457 HD21 ASN 75 1HD2 ASN 75 5.580 4.763 -4.756 458 HD22 ASN 75 2HD2 ASN 75 5.841 5.128 -6.424 459 H GLY 76 H GLY 76 1.235 6.496 -4.996 460 HA2 GLY 76 1HA GLY 76 -0.624 5.038 -4.935 461 HA3 GLY 76 2HA GLY 76 0.008 4.209 -6.354 462 H LEU 77 H LEU 77 2.355 4.987 -3.937 463 HA LEU 77 HA LEU 77 2.508 2.137 -3.282 464 HB2 LEU 77 1HB LEU 77 4.514 3.310 -4.105 465 HB3 LEU 77 2HB LEU 77 4.425 4.402 -2.752 466 HG LEU 77 HG LEU 77 6.160 2.506 -2.680 467 HD11 LEU 77 1HD1 LEU 77 5.913 2.193 -0.274 468 HD12 LEU 77 2HD1 LEU 77 4.277 2.860 -0.361 469 HD13 LEU 77 3HD1 LEU 77 5.663 3.878 -0.747 470 HD21 LEU 77 1HD2 LEU 77 4.636 0.726 -3.383 471 HD22 LEU 77 2HD2 LEU 77 3.724 0.931 -1.884 472 HD23 LEU 77 3HD2 LEU 77 5.405 0.386 -1.835 473 H GLY 78 H GLY 78 1.573 1.456 -1.499 474 HA2 GLY 78 1HA GLY 78 1.239 3.359 0.720 475 HA3 GLY 78 2HA GLY 78 0.244 1.937 0.460 476 H VAL 79 H VAL 79 1.786 2.805 2.792 477 HA VAL 79 HA VAL 79 3.597 0.496 3.063 478 HB VAL 79 HB VAL 79 4.566 2.860 3.323 479 HG11 VAL 79 1HG1 VAL 79 3.056 2.767 5.919 480 HG12 VAL 79 2HG1 VAL 79 2.732 3.850 4.566 481 HG13 VAL 79 3HG1 VAL 79 4.252 3.976 5.452 482 HG21 VAL 79 1HG2 VAL 79 5.985 2.242 5.192 483 HG22 VAL 79 2HG2 VAL 79 5.722 0.870 4.116 484 HG23 VAL 79 3HG2 VAL 79 4.851 0.971 5.647 485 H GLN 80 H GLN 80 3.292 -0.875 4.751 486 HA GLN 80 HA GLN 80 2.188 -2.038 6.344 487 HB2 GLN 80 1HB GLN 80 1.447 0.756 7.208 488 HB3 GLN 80 2HB GLN 80 1.027 -0.674 8.135 489 HG2 GLN 80 1HG GLN 80 3.854 -0.342 7.388 490 HG3 GLN 80 2HG GLN 80 3.213 0.780 8.586 491 HE21 GLN 80 1HE2 GLN 80 3.960 -3.079 9.523 492 HE22 GLN 80 2HE2 GLN 80 4.165 -2.449 7.931 493 H CYS 81 H CYS 81 0.991 -2.089 4.000 494 HA CYS 81 HA CYS 81 -1.804 -1.325 4.256 495 HB2 CYS 81 2HB CYS 81 -0.305 -2.625 1.975 496 HB3 CYS 81 1HB CYS 81 -2.007 -2.198 1.936 497 H ASN 82 H ASN 82 -3.066 -2.616 5.386 498 HA ASN 82 HA ASN 82 -2.636 -5.514 5.135 499 HB2 ASN 82 1HB ASN 82 -4.258 -5.739 7.033 500 HB3 ASN 82 2HB ASN 82 -2.767 -4.902 7.428 501 HD21 ASN 82 1HD2 ASN 82 -4.306 -1.942 8.355 502 HD22 ASN 82 2HD2 ASN 82 -2.838 -2.812 8.082 503 HA PRO 83 HA PRO 83 -5.819 -5.864 2.179 504 HB2 PRO 83 2HB PRO 83 -6.215 -8.628 3.083 505 HB3 PRO 83 1HB PRO 83 -5.628 -8.030 1.531 506 HG2 PRO 83 2HG PRO 83 -4.003 -9.249 3.290 507 HG3 PRO 83 1HG PRO 83 -3.439 -7.935 2.242 508 HD2 PRO 83 2HD PRO 83 -4.196 -7.859 5.138 509 HD3 PRO 83 1HD PRO 83 -2.857 -7.055 4.298 510 H ILE 84 H ILE 84 -7.963 -5.647 2.010 511 HA ILE 84 HA ILE 84 -9.579 -6.052 4.441 512 HB ILE 84 HB ILE 84 -10.242 -4.330 2.064 513 HG12 ILE 84 1HG1 ILE 84 -8.268 -3.452 3.148 514 HG13 ILE 84 2HG1 ILE 84 -9.650 -2.431 3.526 515 HG21 ILE 84 1HG2 ILE 84 -12.201 -5.045 3.312 516 HG22 ILE 84 2HG2 ILE 84 -11.909 -3.320 3.549 517 HG23 ILE 84 3HG2 ILE 84 -11.467 -4.469 4.811 518 HD11 ILE 84 1HD1 ILE 84 -9.864 -3.514 5.694 519 HD12 ILE 84 2HD1 ILE 84 -8.268 -2.792 5.484 520 HD13 ILE 84 3HD1 ILE 84 -8.477 -4.535 5.319 521 H ASN 85 H ASN 85 -11.482 -7.118 4.342 522 HA ASN 85 HA ASN 85 -11.938 -8.882 2.085 523 HB2 ASN 85 1HB ASN 85 -12.187 -9.840 4.292 524 HB3 ASN 85 2HB ASN 85 -13.318 -8.574 4.762 525 HD21 ASN 85 1HD2 ASN 85 -15.823 -10.865 4.018 526 HD22 ASN 85 2HD2 ASN 85 -14.961 -9.995 5.241 527 H VAL 86 H VAL 86 -13.146 -8.267 0.438 528 HA VAL 86 HA VAL 86 -15.392 -6.453 0.937 529 HB VAL 86 HB VAL 86 -14.961 -5.484 -1.373 530 HG11 VAL 86 1HG1 VAL 86 -14.525 -4.231 0.664 531 HG12 VAL 86 2HG1 VAL 86 -13.299 -3.881 -0.556 532 HG13 VAL 86 3HG1 VAL 86 -12.925 -4.963 0.786 533 HG21 VAL 86 1HG2 VAL 86 -12.234 -6.692 -0.935 534 HG22 VAL 86 2HG2 VAL 86 -12.695 -5.605 -2.247 535 HG23 VAL 86 3HG2 VAL 86 -13.404 -7.216 -2.145 536 H ASN 87 H ASN 87 -16.786 -8.143 0.964 537 HA ASN 87 HA ASN 87 -18.400 -9.483 0.068 538 HB2 ASN 87 1HB ASN 87 -18.573 -8.195 -1.934 539 HB3 ASN 87 2HB ASN 87 -17.037 -8.800 -2.541 540 HD21 ASN 87 1HD2 ASN 87 -18.362 -11.670 -3.975 541 HD22 ASN 87 2HD2 ASN 87 -16.955 -10.765 -3.545 542 H LEU 88 H LEU 88 -15.065 -9.994 -0.345 543 HA LEU 88 HA LEU 88 -13.707 -11.767 -0.245 544 HB2 LEU 88 1HB LEU 88 -15.029 -12.367 1.726 545 HB3 LEU 88 2HB LEU 88 -16.171 -13.229 0.707 546 HG LEU 88 HG LEU 88 -14.320 -14.741 0.021 547 HD11 LEU 88 1HD1 LEU 88 -12.433 -13.303 0.482 548 HD12 LEU 88 2HD1 LEU 88 -12.296 -14.798 1.407 549 HD13 LEU 88 3HD1 LEU 88 -12.818 -13.314 2.202 550 HD21 LEU 88 1HD2 LEU 88 -14.914 -14.615 2.972 551 HD22 LEU 88 2HD2 LEU 88 -14.296 -16.023 2.109 552 HD23 LEU 88 3HD2 LEU 88 -15.906 -15.401 1.743 Start of MODEL 4 1 H1 GLY 1 1H GLY 1 -9.985 12.856 3.368 2 H2 GLY 1 2H GLY 1 -10.505 11.764 4.548 3 H3 GLY 1 3H GLY 1 -11.575 12.921 3.938 4 HA2 GLY 1 1HA GLY 1 -11.487 11.898 1.754 5 HA3 GLY 1 2HA GLY 1 -10.377 10.695 2.388 6 H SER 2 H SER 2 -13.659 11.710 2.143 7 HA SER 2 HA SER 2 -14.591 9.635 3.964 8 HB2 SER 2 1HB SER 2 -16.185 11.624 2.331 9 HB3 SER 2 2HB SER 2 -16.800 10.603 3.630 10 HG SER 2 HG SER 2 -14.949 12.747 3.816 11 H GLY 3 H GLY 3 -15.656 7.801 3.324 12 HA2 GLY 3 1HA GLY 3 -16.791 7.316 0.824 13 HA3 GLY 3 2HA GLY 3 -15.118 6.781 0.745 14 H SER 4 H SER 4 -14.619 5.662 3.106 15 HA SER 4 HA SER 4 -16.756 3.724 3.609 16 HB2 SER 4 1HB SER 4 -15.334 2.666 1.950 17 HB3 SER 4 2HB SER 4 -13.900 3.027 2.910 18 HG SER 4 HG SER 4 -15.738 1.003 3.173 19 H SER 5 H SER 5 -16.650 2.694 5.623 20 HA SER 5 HA SER 5 -15.298 4.235 7.664 21 HB2 SER 5 1HB SER 5 -17.156 1.854 7.855 22 HB3 SER 5 2HB SER 5 -16.550 2.772 9.230 23 HG SER 5 HG SER 5 -17.533 4.563 7.627 24 H GLN 6 H GLN 6 -14.539 1.622 5.752 25 HA GLN 6 HA GLN 6 -13.228 -0.067 7.606 26 HB2 GLN 6 1HB GLN 6 -12.787 0.255 4.639 27 HB3 GLN 6 2HB GLN 6 -12.141 -1.054 5.614 28 HG2 GLN 6 1HG GLN 6 -15.053 -0.478 5.130 29 HG3 GLN 6 2HG GLN 6 -14.098 -1.758 4.382 30 HE21 GLN 6 1HE2 GLN 6 -16.085 -2.915 7.382 31 HE22 GLN 6 2HE2 GLN 6 -16.498 -1.889 6.053 32 H CYS 7 H CYS 7 -10.893 -0.484 7.592 33 HA CYS 7 HA CYS 7 -8.739 0.073 7.900 34 HB2 CYS 7 2HB CYS 7 -8.702 0.990 5.670 35 HB3 CYS 7 1HB CYS 7 -9.440 2.481 6.238 36 H ASN 8 H ASN 8 -8.180 0.492 9.886 37 HA ASN 8 HA ASN 8 -9.395 2.699 11.336 38 HB2 ASN 8 1HB ASN 8 -9.226 0.490 12.409 39 HB3 ASN 8 2HB ASN 8 -7.473 0.549 12.259 40 HD21 ASN 8 1HD2 ASN 8 -9.397 2.571 15.206 41 HD22 ASN 8 2HD2 ASN 8 -10.260 1.852 13.886 42 H ALA 9 H ALA 9 -6.544 2.066 9.591 43 HA ALA 9 HA ALA 9 -4.927 3.980 11.082 44 HB1 ALA 9 1HB ALA 9 -3.895 1.888 10.335 45 HB2 ALA 9 2HB ALA 9 -3.104 3.296 9.623 46 HB3 ALA 9 3HB ALA 9 -4.221 2.329 8.660 47 H GLY 10 H GLY 10 -7.267 4.284 8.846 48 HA2 GLY 10 1HA GLY 10 -7.120 6.892 8.316 49 HA3 GLY 10 2HA GLY 10 -5.950 6.259 7.169 50 HA PRO 11 HA PRO 11 -9.858 5.936 4.889 51 HB2 PRO 11 2HB PRO 11 -8.956 6.792 2.532 52 HB3 PRO 11 1HB PRO 11 -9.244 7.921 3.860 53 HG2 PRO 11 2HG PRO 11 -6.672 6.798 2.847 54 HG3 PRO 11 1HG PRO 11 -7.027 8.426 3.449 55 HD2 PRO 11 2HD PRO 11 -5.833 6.368 4.913 56 HD3 PRO 11 1HD PRO 11 -6.564 7.834 5.594 57 H VAL 12 H VAL 12 -10.432 4.753 2.902 58 HA VAL 12 HA VAL 12 -9.095 2.204 2.815 59 HB VAL 12 HB VAL 12 -10.894 1.689 1.080 60 HG11 VAL 12 1HG1 VAL 12 -11.758 2.572 3.830 61 HG12 VAL 12 2HG1 VAL 12 -11.049 1.010 3.416 62 HG13 VAL 12 3HG1 VAL 12 -12.631 1.459 2.774 63 HG21 VAL 12 1HG2 VAL 12 -11.331 4.053 0.460 64 HG22 VAL 12 2HG2 VAL 12 -12.019 4.317 2.062 65 HG23 VAL 12 3HG2 VAL 12 -12.789 3.187 0.949 66 H GLN 13 H GLN 13 -7.787 1.434 1.253 67 HA GLN 13 HA GLN 13 -7.333 3.176 -1.082 68 HB2 GLN 13 1HB GLN 13 -5.392 1.180 0.097 69 HB3 GLN 13 2HB GLN 13 -5.084 2.300 -1.214 70 HG2 GLN 13 1HG GLN 13 -5.712 3.093 1.614 71 HG3 GLN 13 2HG GLN 13 -4.103 3.023 0.899 72 HE21 GLN 13 1HE2 GLN 13 -5.657 6.472 0.788 73 HE22 GLN 13 2HE2 GLN 13 -5.627 5.270 2.030 74 H CYS 14 H CYS 14 -7.306 2.321 -3.085 75 HA CYS 14 HA CYS 14 -8.026 -0.522 -3.345 76 HB2 CYS 14 2HB CYS 14 -9.730 0.938 -4.283 77 HB3 CYS 14 1HB CYS 14 -8.528 1.797 -5.233 78 H CYS 15 H CYS 15 -6.391 -1.753 -3.881 79 HA CYS 15 HA CYS 15 -4.099 -0.522 -5.259 80 HB2 CYS 15 2HB CYS 15 -4.057 -2.730 -3.193 81 HB3 CYS 15 1HB CYS 15 -2.660 -1.922 -3.900 82 H ASN 16 H ASN 16 -3.126 -1.590 -6.862 83 HA ASN 16 HA ASN 16 -4.481 -3.633 -8.275 84 HB2 ASN 16 1HB ASN 16 -2.810 -1.899 -9.148 85 HB3 ASN 16 2HB ASN 16 -1.567 -2.975 -8.543 86 HD21 ASN 16 1HD2 ASN 16 -2.353 -3.564 -12.169 87 HD22 ASN 16 2HD2 ASN 16 -2.067 -2.130 -11.247 88 H THR 17 H THR 17 -1.629 -3.638 -6.190 89 HA THR 17 HA THR 17 -1.951 -6.523 -5.818 90 HB THR 17 HB THR 17 0.663 -5.182 -6.567 91 HG1 THR 17 1HG THR 17 -1.270 -6.538 -7.966 92 HG21 THR 17 1HG2 THR 17 1.581 -7.504 -6.488 93 HG22 THR 17 2HG2 THR 17 0.086 -8.016 -5.705 94 HG23 THR 17 3HG2 THR 17 1.145 -6.847 -4.909 95 H LEU 18 H LEU 18 -2.047 -6.930 -3.695 96 HA LEU 18 HA LEU 18 -0.619 -5.151 -1.854 97 HB2 LEU 18 1HB LEU 18 -2.646 -7.334 -1.362 98 HB3 LEU 18 2HB LEU 18 -1.796 -6.491 -0.081 99 HG LEU 18 HG LEU 18 -3.675 -5.252 -2.074 100 HD11 LEU 18 1HD1 LEU 18 -4.726 -6.639 -0.298 101 HD12 LEU 18 2HD1 LEU 18 -5.155 -4.934 -0.204 102 HD13 LEU 18 3HD1 LEU 18 -3.960 -5.603 0.906 103 HD21 LEU 18 1HD2 LEU 18 -3.394 -3.203 -0.757 104 HD22 LEU 18 2HD2 LEU 18 -1.886 -3.714 -1.508 105 HD23 LEU 18 3HD2 LEU 18 -2.157 -4.005 0.210 106 H THR 19 H THR 19 1.378 -5.675 -1.557 107 HA THR 19 HA THR 19 2.100 -8.441 -1.018 108 HB THR 19 HB THR 19 2.475 -8.300 -3.400 109 HG1 THR 19 1HG THR 19 4.096 -9.483 -2.621 110 HG21 THR 19 1HG2 THR 19 2.615 -5.944 -3.794 111 HG22 THR 19 2HG2 THR 19 4.123 -6.666 -4.352 112 HG23 THR 19 3HG2 THR 19 4.074 -5.811 -2.811 113 H SER 20 H SER 20 4.780 -8.225 -0.699 114 HA SER 20 HA SER 20 4.898 -6.370 1.557 115 HB2 SER 20 1HB SER 20 6.954 -7.717 2.154 116 HB3 SER 20 2HB SER 20 5.447 -8.630 2.142 117 HG SER 20 HG SER 20 6.208 -9.823 0.597 118 H ALA 21 H ALA 21 7.019 -5.316 1.967 119 HA ALA 21 HA ALA 21 7.729 -3.702 -0.252 120 HB1 ALA 21 1HB ALA 21 9.314 -2.664 1.280 121 HB2 ALA 21 2HB ALA 21 9.070 -3.977 2.434 122 HB3 ALA 21 3HB ALA 21 7.741 -2.886 2.045 123 H SER 22 H SER 22 8.613 -6.792 0.374 124 HA SER 22 HA SER 22 11.354 -6.593 -0.535 125 HB2 SER 22 1HB SER 22 10.645 -8.280 1.157 126 HB3 SER 22 2HB SER 22 9.664 -9.050 -0.079 127 HG SER 22 HG SER 22 12.358 -8.589 -0.654 128 H ASN 23 H ASN 23 8.296 -6.634 -1.893 129 HA ASN 23 HA ASN 23 8.842 -8.148 -4.257 130 HB2 ASN 23 1HB ASN 23 6.541 -7.596 -3.275 131 HB3 ASN 23 2HB ASN 23 6.743 -5.993 -3.968 132 HD21 ASN 23 1HD2 ASN 23 5.756 -9.150 -6.284 133 HD22 ASN 23 2HD2 ASN 23 6.156 -9.331 -4.609 134 H SER 24 H SER 24 9.549 -7.462 -6.208 135 HA SER 24 HA SER 24 11.278 -5.266 -6.323 136 HB2 SER 24 1HB SER 24 11.449 -7.294 -7.756 137 HB3 SER 24 2HB SER 24 10.032 -6.750 -8.649 138 HG SER 24 HG SER 24 12.620 -5.989 -8.894 139 H GLN 25 H GLN 25 7.885 -5.582 -7.120 140 HA GLN 25 HA GLN 25 7.584 -3.178 -8.564 141 HB2 GLN 25 1HB GLN 25 5.899 -5.030 -8.468 142 HB3 GLN 25 2HB GLN 25 5.551 -4.570 -6.799 143 HG2 GLN 25 1HG GLN 25 3.880 -3.639 -8.179 144 HG3 GLN 25 2HG GLN 25 4.919 -2.339 -7.602 145 HE21 GLN 25 1HE2 GLN 25 6.064 -1.377 -10.751 146 HE22 GLN 25 2HE2 GLN 25 6.258 -1.254 -9.038 147 H ALA 26 H ALA 26 7.263 -4.028 -5.156 148 HA ALA 26 HA ALA 26 6.351 -1.486 -4.295 149 HB1 ALA 26 1HB ALA 26 5.920 -3.504 -3.018 150 HB2 ALA 26 2HB ALA 26 6.822 -2.340 -2.044 151 HB3 ALA 26 3HB ALA 26 7.648 -3.727 -2.751 152 H ALA 27 H ALA 27 9.537 -3.084 -4.016 153 HA ALA 27 HA ALA 27 10.758 -0.967 -2.630 154 HB1 ALA 27 1HB ALA 27 12.063 -3.053 -4.380 155 HB2 ALA 27 2HB ALA 27 11.678 -3.229 -2.668 156 HB3 ALA 27 3HB ALA 27 12.879 -2.044 -3.185 157 H GLY 28 H GLY 28 10.436 -1.559 -6.102 158 HA2 GLY 28 1HA GLY 28 12.150 0.455 -7.028 159 HA3 GLY 28 2HA GLY 28 10.703 -0.099 -7.864 160 H LEU 29 H LEU 29 8.755 0.576 -6.108 161 HA LEU 29 HA LEU 29 8.370 3.361 -6.486 162 HB2 LEU 29 1HB LEU 29 6.976 1.411 -4.692 163 HB3 LEU 29 2HB LEU 29 6.379 2.994 -5.091 164 HG LEU 29 HG LEU 29 6.740 0.721 -7.037 165 HD11 LEU 29 1HD1 LEU 29 4.889 0.301 -5.573 166 HD12 LEU 29 2HD1 LEU 29 4.261 0.821 -7.137 167 HD13 LEU 29 3HD1 LEU 29 4.296 1.949 -5.780 168 HD21 LEU 29 1HD2 LEU 29 5.619 3.496 -7.428 169 HD22 LEU 29 2HD2 LEU 29 5.556 2.194 -8.616 170 HD23 LEU 29 3HD2 LEU 29 7.111 2.861 -8.123 171 H ILE 30 H ILE 30 8.925 1.384 -3.594 172 HA ILE 30 HA ILE 30 8.970 3.288 -1.613 173 HB ILE 30 HB ILE 30 10.603 0.784 -1.923 174 HG12 ILE 30 1HG1 ILE 30 8.125 1.405 -0.323 175 HG13 ILE 30 2HG1 ILE 30 8.132 0.586 -1.876 176 HG21 ILE 30 1HG2 ILE 30 11.288 0.892 0.305 177 HG22 ILE 30 2HG2 ILE 30 10.126 2.153 0.698 178 HG23 ILE 30 3HG2 ILE 30 11.539 2.538 -0.286 179 HD11 ILE 30 1HD1 ILE 30 9.345 -1.258 -0.928 180 HD12 ILE 30 2HD1 ILE 30 7.884 -0.938 0.008 181 HD13 ILE 30 3HD1 ILE 30 9.454 -0.422 0.621 182 H GLN 31 H GLN 31 11.666 2.195 -3.605 183 HA GLN 31 HA GLN 31 13.491 3.971 -2.405 184 HB2 GLN 31 1HB GLN 31 13.594 2.183 -4.801 185 HB3 GLN 31 2HB GLN 31 14.948 3.236 -4.388 186 HG2 GLN 31 1HG GLN 31 14.923 2.144 -2.123 187 HG3 GLN 31 2HG GLN 31 13.761 1.001 -2.787 188 HE21 GLN 31 1HE2 GLN 31 16.533 -0.991 -3.459 189 HE22 GLN 31 2HE2 GLN 31 15.152 -0.722 -2.454 190 H GLN 32 H GLN 32 11.170 4.313 -4.933 191 HA GLN 32 HA GLN 32 12.405 6.616 -6.138 192 HB2 GLN 32 1HB GLN 32 9.609 5.509 -6.168 193 HB3 GLN 32 2HB GLN 32 9.959 7.088 -6.850 194 HG2 GLN 32 1HG GLN 32 11.304 4.539 -7.695 195 HG3 GLN 32 2HG GLN 32 9.899 5.253 -8.488 196 HE21 GLN 32 1HE2 GLN 32 13.622 6.787 -9.044 197 HE22 GLN 32 2HE2 GLN 32 13.304 5.583 -7.844 198 H LEU 33 H LEU 33 10.182 6.026 -3.513 199 HA LEU 33 HA LEU 33 9.670 8.829 -3.035 200 HB2 LEU 33 1HB LEU 33 9.066 6.683 -1.045 201 HB3 LEU 33 2HB LEU 33 8.144 8.122 -1.436 202 HG LEU 33 HG LEU 33 8.375 5.730 -3.260 203 HD11 LEU 33 1HD1 LEU 33 7.266 5.181 -1.128 204 HD12 LEU 33 2HD1 LEU 33 6.202 5.072 -2.526 205 HD13 LEU 33 3HD1 LEU 33 6.093 6.460 -1.444 206 HD21 LEU 33 1HD2 LEU 33 6.734 8.241 -3.322 207 HD22 LEU 33 2HD2 LEU 33 6.254 6.783 -4.196 208 HD23 LEU 33 3HD2 LEU 33 7.792 7.574 -4.572 209 H GLY 34 H GLY 34 11.898 6.423 -2.064 210 HA2 GLY 34 1HA GLY 34 13.863 6.643 -0.872 211 HA3 GLY 34 2HA GLY 34 13.413 8.299 -0.482 212 H LEU 35 H LEU 35 11.446 5.463 0.046 213 HA LEU 35 HA LEU 35 10.981 6.184 2.769 214 HB2 LEU 35 1HB LEU 35 10.110 3.970 0.985 215 HB3 LEU 35 2HB LEU 35 9.792 3.865 2.698 216 HG LEU 35 HG LEU 35 8.810 6.025 0.836 217 HD11 LEU 35 1HD1 LEU 35 7.722 3.865 0.505 218 HD12 LEU 35 2HD1 LEU 35 6.620 5.043 1.218 219 HD13 LEU 35 3HD1 LEU 35 7.345 3.790 2.226 220 HD21 LEU 35 1HD2 LEU 35 9.189 6.934 3.045 221 HD22 LEU 35 2HD2 LEU 35 8.330 5.582 3.780 222 HD23 LEU 35 3HD2 LEU 35 7.459 6.740 2.776 223 H SER 36 H SER 36 12.593 5.932 4.177 224 HA SER 36 HA SER 36 14.109 3.432 4.184 225 HB2 SER 36 1HB SER 36 15.328 5.616 4.347 226 HB3 SER 36 2HB SER 36 14.514 5.910 5.882 227 HG SER 36 HG SER 36 16.047 3.576 5.402 228 H GLY 37 H GLY 37 14.040 2.006 5.913 229 HA2 GLY 37 1HA GLY 37 13.458 1.468 8.191 230 HA3 GLY 37 2HA GLY 37 12.154 2.644 8.089 231 H VAL 38 H VAL 38 11.722 1.466 5.276 232 HA VAL 38 HA VAL 38 9.767 -0.522 6.094 233 HB VAL 38 HB VAL 38 10.431 0.461 3.308 234 HG11 VAL 38 1HG1 VAL 38 7.989 -0.890 4.438 235 HG12 VAL 38 2HG1 VAL 38 9.169 -1.602 3.341 236 HG13 VAL 38 3HG1 VAL 38 8.146 -0.274 2.794 237 HG21 VAL 38 1HG2 VAL 38 8.543 2.009 3.568 238 HG22 VAL 38 2HG2 VAL 38 9.843 2.361 4.706 239 HG23 VAL 38 3HG2 VAL 38 8.389 1.529 5.257 240 H GLY 39 H GLY 39 10.578 -2.506 6.456 241 HA2 GLY 39 1HA GLY 39 12.806 -3.499 4.844 242 HA3 GLY 39 2HA GLY 39 12.200 -4.216 6.329 243 H ALA 40 H ALA 40 12.422 -6.189 4.957 244 HA ALA 40 HA ALA 40 10.740 -6.478 2.671 245 HB1 ALA 40 1HB ALA 40 12.315 -8.504 4.247 246 HB2 ALA 40 2HB ALA 40 12.816 -7.686 2.766 247 HB3 ALA 40 3HB ALA 40 11.487 -8.844 2.730 248 H ASN 41 H ASN 41 10.320 -7.038 6.051 249 HA ASN 41 HA ASN 41 8.058 -8.821 5.656 250 HB2 ASN 41 1HB ASN 41 9.395 -7.725 8.132 251 HB3 ASN 41 2HB ASN 41 7.977 -8.758 8.176 252 HD21 ASN 41 1HD2 ASN 41 10.085 -11.417 6.556 253 HD22 ASN 41 2HD2 ASN 41 8.782 -10.441 5.980 254 H VAL 42 H VAL 42 8.286 -5.763 5.064 255 HA VAL 42 HA VAL 42 6.064 -4.797 6.696 256 HB VAL 42 HB VAL 42 7.790 -3.276 4.739 257 HG11 VAL 42 1HG1 VAL 42 5.817 -2.336 6.819 258 HG12 VAL 42 2HG1 VAL 42 5.726 -2.088 5.074 259 HG13 VAL 42 3HG1 VAL 42 6.995 -1.291 6.021 260 HG21 VAL 42 1HG2 VAL 42 7.970 -3.669 7.697 261 HG22 VAL 42 2HG2 VAL 42 8.818 -2.387 6.827 262 HG23 VAL 42 3HG2 VAL 42 9.171 -4.083 6.465 263 HA PRO 43 HA PRO 43 3.283 -5.503 3.327 264 HB2 PRO 43 2HB PRO 43 1.250 -3.955 4.471 265 HB3 PRO 43 1HB PRO 43 1.474 -5.682 4.660 266 HG2 PRO 43 2HG PRO 43 1.808 -3.640 6.609 267 HG3 PRO 43 1HG PRO 43 2.004 -5.385 6.813 268 HD2 PRO 43 2HD PRO 43 4.026 -3.327 6.593 269 HD3 PRO 43 1HD PRO 43 4.221 -5.030 7.026 270 H VAL 44 H VAL 44 2.676 -4.387 1.506 271 HA VAL 44 HA VAL 44 2.532 -1.472 1.634 272 HB VAL 44 HB VAL 44 3.899 -1.165 -0.361 273 HG11 VAL 44 1HG1 VAL 44 5.037 -0.913 1.734 274 HG12 VAL 44 2HG1 VAL 44 6.122 -1.704 0.590 275 HG13 VAL 44 3HG1 VAL 44 5.315 -2.650 1.843 276 HG21 VAL 44 1HG2 VAL 44 3.623 -3.197 -1.530 277 HG22 VAL 44 2HG2 VAL 44 4.282 -4.137 -0.188 278 HG23 VAL 44 3HG2 VAL 44 5.335 -3.082 -1.123 279 H GLY 45 H GLY 45 1.647 -0.580 -0.415 280 HA2 GLY 45 1HA GLY 45 -0.071 -2.562 -1.761 281 HA3 GLY 45 2HA GLY 45 -0.636 -0.952 -1.351 282 H ILE 46 H ILE 46 0.065 -2.662 -3.860 283 HA ILE 46 HA ILE 46 1.823 -0.819 -5.274 284 HB ILE 46 HB ILE 46 0.644 -3.517 -5.916 285 HG12 ILE 46 1HG1 ILE 46 2.861 -4.351 -5.936 286 HG13 ILE 46 2HG1 ILE 46 3.543 -2.756 -6.062 287 HG21 ILE 46 1HG2 ILE 46 1.746 -3.434 -8.099 288 HG22 ILE 46 2HG2 ILE 46 2.198 -1.757 -7.799 289 HG23 ILE 46 3HG2 ILE 46 0.497 -2.198 -7.943 290 HD11 ILE 46 1HD1 ILE 46 2.998 -2.298 -3.763 291 HD12 ILE 46 2HD1 ILE 46 3.969 -3.765 -3.919 292 HD13 ILE 46 3HD1 ILE 46 2.232 -3.883 -3.625 293 H ASN 47 H ASN 47 0.938 0.831 -6.350 294 HA ASN 47 HA ASN 47 -0.469 2.096 -7.616 295 HB2 ASN 47 1HB ASN 47 -0.337 -0.040 -9.048 296 HB3 ASN 47 2HB ASN 47 -1.905 -0.442 -8.378 297 HD21 ASN 47 1HD2 ASN 47 -1.529 2.385 -11.251 298 HD22 ASN 47 2HD2 ASN 47 -0.151 1.707 -10.457 299 H CYS 48 H CYS 48 -1.116 2.329 -5.119 300 HA CYS 48 HA CYS 48 -3.899 1.567 -4.736 301 HB2 CYS 48 2HB CYS 48 -1.960 2.918 -2.852 302 HB3 CYS 48 1HB CYS 48 -3.577 2.393 -2.449 303 H ASN 49 H ASN 49 -5.539 2.931 -4.828 304 HA ASN 49 HA ASN 49 -5.031 5.775 -4.376 305 HB2 ASN 49 1HB ASN 49 -6.866 6.281 -6.090 306 HB3 ASN 49 2HB ASN 49 -5.284 5.849 -6.704 307 HD21 ASN 49 1HD2 ASN 49 -7.941 2.776 -6.953 308 HD22 ASN 49 2HD2 ASN 49 -7.628 3.555 -5.441 309 HA PRO 50 HA PRO 50 -7.987 5.273 -1.278 310 HB2 PRO 50 2HB PRO 50 -8.789 8.080 -1.583 311 HB3 PRO 50 1HB PRO 50 -7.932 7.300 -0.250 312 HG2 PRO 50 2HG PRO 50 -6.704 9.024 -1.915 313 HG3 PRO 50 1HG PRO 50 -5.861 7.634 -1.209 314 HD2 PRO 50 2HD PRO 50 -7.036 7.945 -3.949 315 HD3 PRO 50 1HD PRO 50 -5.476 7.250 -3.469 316 H ILE 51 H ILE 51 -9.937 4.379 -1.350 317 HA ILE 51 HA ILE 51 -11.632 4.808 -3.644 318 HB ILE 51 HB ILE 51 -12.562 3.258 -1.264 319 HG12 ILE 51 1HG1 ILE 51 -10.450 2.321 -3.221 320 HG13 ILE 51 2HG1 ILE 51 -10.211 2.596 -1.500 321 HG21 ILE 51 1HG2 ILE 51 -13.942 3.538 -3.303 322 HG22 ILE 51 2HG2 ILE 51 -13.547 1.852 -2.969 323 HG23 ILE 51 3HG2 ILE 51 -12.683 2.724 -4.235 324 HD11 ILE 51 1HD1 ILE 51 -12.011 0.523 -2.718 325 HD12 ILE 51 2HD1 ILE 51 -11.763 0.793 -0.994 326 HD13 ILE 51 3HD1 ILE 51 -10.427 0.234 -2.000 327 H THR 52 H THR 52 -12.209 6.999 -3.379 328 HA THR 52 HA THR 52 -14.028 7.484 -1.120 329 HB THR 52 HB THR 52 -13.329 9.898 -1.293 330 HG1 THR 52 1HG THR 52 -11.052 8.938 -2.680 331 HG21 THR 52 1HG2 THR 52 -11.187 9.547 -0.105 332 HG22 THR 52 2HG2 THR 52 -11.199 7.857 -0.615 333 HG23 THR 52 3HG2 THR 52 -12.452 8.461 0.469 334 H GLY 53 H GLY 53 -14.099 6.890 -4.272 335 HA2 GLY 53 1HA GLY 53 -15.686 9.043 -5.285 336 HA3 GLY 53 2HA GLY 53 -15.480 7.463 -6.030 337 H ILE 54 H ILE 54 -16.438 5.800 -4.093 338 HA ILE 54 HA ILE 54 -19.281 6.509 -4.017 339 HB ILE 54 HB ILE 54 -17.953 3.812 -3.682 340 HG12 ILE 54 1HG1 ILE 54 -17.823 4.629 -5.984 341 HG13 ILE 54 2HG1 ILE 54 -18.953 3.287 -5.869 342 HG21 ILE 54 1HG2 ILE 54 -20.082 4.127 -2.409 343 HG22 ILE 54 2HG2 ILE 54 -20.131 2.843 -3.625 344 HG23 ILE 54 3HG2 ILE 54 -20.894 4.399 -3.955 345 HD11 ILE 54 1HD1 ILE 54 -19.835 4.990 -7.320 346 HD12 ILE 54 2HD1 ILE 54 -19.650 6.206 -6.059 347 HD13 ILE 54 3HD1 ILE 54 -20.814 4.899 -5.856 348 H GLY 55 H GLY 55 -20.493 6.188 -2.093 349 HA2 GLY 55 1HA GLY 55 -19.106 5.403 0.321 350 HA3 GLY 55 2HA GLY 55 -19.599 7.082 0.259 351 H ALA 56 H ALA 56 -21.991 7.283 -0.588 352 HA ALA 56 HA ALA 56 -23.574 5.814 1.342 353 HB1 ALA 56 1HB ALA 56 -23.931 8.207 1.122 354 HB2 ALA 56 2HB ALA 56 -25.392 7.329 0.668 355 HB3 ALA 56 3HB ALA 56 -24.347 8.007 -0.579 356 H GLY 57 H GLY 57 -24.303 3.879 0.832 357 HA2 GLY 57 1HA GLY 57 -26.177 3.171 -0.940 358 HA3 GLY 57 2HA GLY 57 -24.727 3.115 -1.935 359 H SER 58 H SER 58 -23.967 1.124 -2.132 360 HA SER 58 HA SER 58 -24.390 -0.817 -0.001 361 HB2 SER 58 1HB SER 58 -23.043 -1.181 -2.690 362 HB3 SER 58 2HB SER 58 -23.570 -2.460 -1.595 363 HG SER 58 HG SER 58 -25.706 -1.100 -1.919 364 H GLY 59 H GLY 59 -22.145 1.478 -0.814 365 HA2 GLY 59 1HA GLY 59 -20.263 1.830 0.657 366 HA3 GLY 59 2HA GLY 59 -20.045 0.085 0.710 367 H SER 60 H SER 60 -17.952 1.809 0.101 368 HA SER 60 HA SER 60 -17.651 1.695 -2.796 369 HB2 SER 60 1HB SER 60 -15.440 2.882 -2.211 370 HB3 SER 60 2HB SER 60 -16.941 3.776 -1.951 371 HG SER 60 HG SER 60 -15.448 3.875 -0.172 372 H SER 61 H SER 61 -16.326 0.319 -3.836 373 HA SER 61 HA SER 61 -14.771 -1.568 -2.207 374 HB2 SER 61 1HB SER 61 -15.469 -3.299 -3.958 375 HB3 SER 61 2HB SER 61 -16.710 -2.786 -2.815 376 HG SER 61 HG SER 61 -17.832 -2.202 -4.478 377 H CYS 62 H CYS 62 -13.367 -2.960 -3.846 378 HA CYS 62 HA CYS 62 -12.086 -1.074 -5.703 379 HB2 CYS 62 2HB CYS 62 -10.706 -1.188 -3.726 380 HB3 CYS 62 1HB CYS 62 -10.778 -2.947 -3.721 381 H ASN 63 H ASN 63 -11.454 -1.862 -7.616 382 HA ASN 63 HA ASN 63 -12.587 -4.203 -8.666 383 HB2 ASN 63 1HB ASN 63 -10.913 -3.793 -10.562 384 HB3 ASN 63 2HB ASN 63 -12.080 -2.511 -10.232 385 HD21 ASN 63 1HD2 ASN 63 -8.101 -1.912 -9.835 386 HD22 ASN 63 2HD2 ASN 63 -8.766 -3.454 -10.249 387 H ALA 64 H ALA 64 -9.614 -3.671 -7.017 388 HA ALA 64 HA ALA 64 -8.728 -6.358 -7.793 389 HB1 ALA 64 1HB ALA 64 -7.393 -4.527 -8.789 390 HB2 ALA 64 2HB ALA 64 -6.451 -5.609 -7.754 391 HB3 ALA 64 3HB ALA 64 -6.935 -4.017 -7.159 392 H ASN 65 H ASN 65 -7.200 -4.267 -5.401 393 HA ASN 65 HA ASN 65 -8.270 -5.999 -3.281 394 HB2 ASN 65 1HB ASN 65 -5.391 -5.151 -3.501 395 HB3 ASN 65 2HB ASN 65 -6.079 -6.166 -2.249 396 HD21 ASN 65 1HD2 ASN 65 -5.056 -7.683 -5.856 397 HD22 ASN 65 2HD2 ASN 65 -5.027 -5.988 -5.540 398 HA PRO 66 HA PRO 66 -8.670 -1.971 -1.357 399 HB2 PRO 66 2HB PRO 66 -10.462 -2.731 0.485 400 HB3 PRO 66 1HB PRO 66 -10.918 -2.502 -1.207 401 HG2 PRO 66 2HG PRO 66 -10.439 -5.022 0.302 402 HG3 PRO 66 1HG PRO 66 -11.622 -4.686 -0.975 403 HD2 PRO 66 2HD PRO 66 -9.164 -5.989 -1.313 404 HD3 PRO 66 1HD PRO 66 -10.151 -5.289 -2.608 405 H ALA 67 H ALA 67 -7.384 -1.180 0.238 406 HA ALA 67 HA ALA 67 -6.489 -3.027 2.339 407 HB1 ALA 67 1HB ALA 67 -4.634 -1.367 0.642 408 HB2 ALA 67 2HB ALA 67 -4.820 -3.119 0.570 409 HB3 ALA 67 3HB ALA 67 -4.165 -2.363 2.021 410 H CYS 68 H CYS 68 -5.611 -2.076 4.169 411 HA CYS 68 HA CYS 68 -6.118 0.805 4.499 412 HB2 CYS 68 2HB CYS 68 -7.362 -0.594 6.072 413 HB3 CYS 68 1HB CYS 68 -5.877 -1.388 6.576 414 H CYS 69 H CYS 69 -4.366 2.046 4.551 415 HA CYS 69 HA CYS 69 -1.792 0.765 5.195 416 HB2 CYS 69 2HB CYS 69 -2.584 2.040 2.795 417 HB3 CYS 69 1HB CYS 69 -1.375 3.055 3.551 418 H ASP 70 H ASP 70 -0.144 2.182 6.001 419 HA ASP 70 HA ASP 70 -1.185 4.020 7.960 420 HB2 ASP 70 1HB ASP 70 0.768 2.414 8.299 421 HB3 ASP 70 2HB ASP 70 1.717 3.497 7.295 422 H ASN 71 H ASN 71 0.654 4.135 4.972 423 HA ASN 71 HA ASN 71 -0.144 6.886 4.523 424 HB2 ASN 71 1HB ASN 71 2.798 6.128 4.581 425 HB3 ASN 71 2HB ASN 71 2.163 7.630 3.933 426 HD21 ASN 71 1HD2 ASN 71 2.784 7.147 7.885 427 HD22 ASN 71 2HD2 ASN 71 3.053 5.885 6.741 428 H VAL 72 H VAL 72 -0.147 7.363 2.273 429 HA VAL 72 HA VAL 72 1.126 5.393 0.543 430 HB VAL 72 HB VAL 72 -0.703 4.647 -0.453 431 HG11 VAL 72 1HG1 VAL 72 -2.151 6.148 1.705 432 HG12 VAL 72 2HG1 VAL 72 -1.584 4.476 1.746 433 HG13 VAL 72 3HG1 VAL 72 -2.894 4.937 0.658 434 HG21 VAL 72 1HG2 VAL 72 -0.807 6.710 -1.782 435 HG22 VAL 72 2HG2 VAL 72 -1.888 7.408 -0.572 436 HG23 VAL 72 3HG2 VAL 72 -2.397 5.994 -1.498 437 H TYR 73 H TYR 73 1.575 6.177 -1.594 438 HA TYR 73 HA TYR 73 1.816 9.115 -1.655 439 HB2 TYR 73 2HB TYR 73 3.778 7.002 -2.536 440 HB3 TYR 73 1HB TYR 73 3.988 8.728 -2.826 441 HD1 TYR 73 1HD TYR 73 3.926 6.094 -0.246 442 HD2 TYR 73 2HD TYR 73 4.666 10.206 -1.055 443 HE1 TYR 73 1HE TYR 73 4.984 6.327 1.965 444 HE2 TYR 73 2HE TYR 73 5.727 10.452 1.148 445 HH TYR 73 HH TYR 73 5.660 9.342 3.351 446 H THR 74 H THR 74 2.214 9.945 -3.897 447 HA THR 74 HA THR 74 -0.150 9.296 -5.318 448 HB THR 74 HB THR 74 2.045 11.112 -6.295 449 HG1 THR 74 1HG THR 74 1.713 12.102 -4.432 450 HG21 THR 74 1HG2 THR 74 -0.958 11.218 -6.603 451 HG22 THR 74 2HG2 THR 74 0.178 10.686 -7.842 452 HG23 THR 74 3HG2 THR 74 0.198 12.360 -7.289 453 H ASN 75 H ASN 75 3.152 8.334 -5.718 454 HA ASN 75 HA ASN 75 2.993 7.426 -8.403 455 HB2 ASN 75 1HB ASN 75 4.947 6.079 -7.894 456 HB3 ASN 75 2HB ASN 75 5.133 7.654 -7.131 457 HD21 ASN 75 1HD2 ASN 75 5.971 4.783 -4.832 458 HD22 ASN 75 2HD2 ASN 75 6.356 5.072 -6.488 459 H GLY 76 H GLY 76 1.602 6.437 -5.509 460 HA2 GLY 76 1HA GLY 76 -0.291 5.022 -5.544 461 HA3 GLY 76 2HA GLY 76 0.451 4.100 -6.847 462 H LEU 77 H LEU 77 2.600 4.949 -4.281 463 HA LEU 77 HA LEU 77 2.634 2.122 -3.528 464 HB2 LEU 77 1HB LEU 77 4.716 3.247 -4.227 465 HB3 LEU 77 2HB LEU 77 4.552 4.355 -2.893 466 HG LEU 77 HG LEU 77 6.238 2.446 -2.652 467 HD11 LEU 77 1HD1 LEU 77 4.144 2.797 -0.519 468 HD12 LEU 77 2HD1 LEU 77 5.562 3.816 -0.768 469 HD13 LEU 77 3HD1 LEU 77 5.764 2.130 -0.281 470 HD21 LEU 77 1HD2 LEU 77 5.392 0.322 -1.898 471 HD22 LEU 77 2HD2 LEU 77 4.767 0.679 -3.508 472 HD23 LEU 77 3HD2 LEU 77 3.730 0.880 -2.093 473 H GLY 78 H GLY 78 1.641 1.471 -1.770 474 HA2 GLY 78 1HA GLY 78 1.142 3.423 0.374 475 HA3 GLY 78 2HA GLY 78 0.245 1.931 0.133 476 H VAL 79 H VAL 79 1.733 2.990 2.487 477 HA VAL 79 HA VAL 79 3.620 0.749 2.819 478 HB VAL 79 HB VAL 79 4.566 3.112 2.912 479 HG11 VAL 79 1HG1 VAL 79 4.337 4.370 4.964 480 HG12 VAL 79 2HG1 VAL 79 3.178 3.190 5.573 481 HG13 VAL 79 3HG1 VAL 79 2.776 4.173 4.165 482 HG21 VAL 79 1HG2 VAL 79 6.058 2.617 4.770 483 HG22 VAL 79 2HG2 VAL 79 5.776 1.191 3.770 484 HG23 VAL 79 3HG2 VAL 79 4.955 1.355 5.323 485 H GLN 80 H GLN 80 3.178 -0.700 4.317 486 HA GLN 80 HA GLN 80 2.185 -1.833 5.992 487 HB2 GLN 80 1HB GLN 80 1.829 0.982 6.921 488 HB3 GLN 80 2HB GLN 80 0.955 -0.290 7.762 489 HG2 GLN 80 1HG GLN 80 3.887 -0.453 7.257 490 HG3 GLN 80 2HG GLN 80 3.240 0.396 8.662 491 HE21 GLN 80 1HE2 GLN 80 4.036 -3.204 9.422 492 HE22 GLN 80 2HE2 GLN 80 4.921 -1.943 8.635 493 H CYS 81 H CYS 81 0.885 -1.877 3.733 494 HA CYS 81 HA CYS 81 -1.920 -1.223 4.146 495 HB2 CYS 81 2HB CYS 81 -0.407 -2.343 1.805 496 HB3 CYS 81 1HB CYS 81 -2.152 -2.454 1.874 497 H ASN 82 H ASN 82 -3.219 -2.530 5.181 498 HA ASN 82 HA ASN 82 -2.779 -5.430 4.919 499 HB2 ASN 82 1HB ASN 82 -4.250 -5.655 6.936 500 HB3 ASN 82 2HB ASN 82 -2.721 -4.846 7.237 501 HD21 ASN 82 1HD2 ASN 82 -4.152 -1.828 8.223 502 HD22 ASN 82 2HD2 ASN 82 -2.715 -2.685 7.791 503 HA PRO 83 HA PRO 83 -6.254 -5.616 2.259 504 HB2 PRO 83 2HB PRO 83 -6.781 -8.290 3.386 505 HB3 PRO 83 1HB PRO 83 -6.407 -7.827 1.727 506 HG2 PRO 83 2HG PRO 83 -4.621 -9.103 3.269 507 HG3 PRO 83 1HG PRO 83 -4.129 -7.879 2.084 508 HD2 PRO 83 2HD PRO 83 -4.378 -7.648 5.056 509 HD3 PRO 83 1HD PRO 83 -3.166 -6.950 3.965 510 H ILE 84 H ILE 84 -8.325 -5.045 2.374 511 HA ILE 84 HA ILE 84 -9.579 -4.749 4.953 512 HB ILE 84 HB ILE 84 -10.562 -4.086 2.186 513 HG12 ILE 84 1HG1 ILE 84 -8.651 -2.740 2.858 514 HG13 ILE 84 2HG1 ILE 84 -10.110 -1.760 2.838 515 HG21 ILE 84 1HG2 ILE 84 -11.784 -3.380 4.841 516 HG22 ILE 84 2HG2 ILE 84 -12.470 -4.453 3.619 517 HG23 ILE 84 3HG2 ILE 84 -12.291 -2.730 3.282 518 HD11 ILE 84 1HD1 ILE 84 -10.276 -2.050 5.287 519 HD12 ILE 84 2HD1 ILE 84 -8.828 -1.194 4.760 520 HD13 ILE 84 3HD1 ILE 84 -8.723 -2.885 5.247 521 H ASN 85 H ASN 85 -11.513 -5.630 5.582 522 HA ASN 85 HA ASN 85 -12.045 -8.328 4.753 523 HB2 ASN 85 1HB ASN 85 -12.273 -7.796 7.080 524 HB3 ASN 85 2HB ASN 85 -13.342 -6.445 6.734 525 HD21 ASN 85 1HD2 ASN 85 -15.886 -8.605 7.714 526 HD22 ASN 85 2HD2 ASN 85 -14.918 -7.223 8.097 527 H VAL 86 H VAL 86 -12.688 -8.215 2.643 528 HA VAL 86 HA VAL 86 -15.392 -7.174 2.195 529 HB VAL 86 HB VAL 86 -14.643 -6.875 -0.252 530 HG11 VAL 86 1HG1 VAL 86 -13.508 -5.046 1.861 531 HG12 VAL 86 2HG1 VAL 86 -15.146 -4.990 1.208 532 HG13 VAL 86 3HG1 VAL 86 -13.768 -4.623 0.169 533 HG21 VAL 86 1HG2 VAL 86 -12.511 -8.101 0.003 534 HG22 VAL 86 2HG2 VAL 86 -11.922 -6.806 1.047 535 HG23 VAL 86 3HG2 VAL 86 -12.294 -6.477 -0.645 536 H ASN 87 H ASN 87 -16.260 -9.159 2.603 537 HA ASN 87 HA ASN 87 -16.799 -11.353 2.407 538 HB2 ASN 87 1HB ASN 87 -17.314 -10.739 0.055 539 HB3 ASN 87 2HB ASN 87 -15.649 -11.097 -0.390 540 HD21 ASN 87 1HD2 ASN 87 -16.886 -14.213 -1.338 541 HD22 ASN 87 2HD2 ASN 87 -16.289 -12.672 -1.847 542 H LEU 88 H LEU 88 -14.736 -10.995 3.893 543 HA LEU 88 HA LEU 88 -12.286 -12.117 2.987 544 HB2 LEU 88 1HB LEU 88 -12.450 -10.459 4.813 545 HB3 LEU 88 2HB LEU 88 -13.241 -11.663 5.810 546 HG LEU 88 HG LEU 88 -11.199 -13.053 5.723 547 HD11 LEU 88 1HD1 LEU 88 -9.126 -12.086 4.869 548 HD12 LEU 88 2HD1 LEU 88 -10.020 -10.687 4.276 549 HD13 LEU 88 3HD1 LEU 88 -10.320 -12.283 3.588 550 HD21 LEU 88 1HD2 LEU 88 -11.548 -11.532 7.588 551 HD22 LEU 88 2HD2 LEU 88 -10.785 -10.224 6.685 552 HD23 LEU 88 3HD2 LEU 88 -9.835 -11.625 7.179 Start of MODEL 5 1 H1 GLY 1 1H GLY 1 -17.515 11.584 1.459 2 H2 GLY 1 2H GLY 1 -17.961 12.960 2.332 3 H3 GLY 1 3H GLY 1 -19.127 12.091 1.470 4 HA2 GLY 1 1HA GLY 1 -17.619 11.108 3.823 5 HA3 GLY 1 2HA GLY 1 -19.299 11.623 3.824 6 H SER 2 H SER 2 -18.472 9.096 4.668 7 HA SER 2 HA SER 2 -19.021 6.909 4.496 8 HB2 SER 2 1HB SER 2 -20.874 7.803 2.277 9 HB3 SER 2 2HB SER 2 -20.972 6.292 3.180 10 HG SER 2 HG SER 2 -22.234 8.411 3.789 11 H GLY 3 H GLY 3 -16.910 8.150 2.782 12 HA2 GLY 3 1HA GLY 3 -16.767 6.157 0.629 13 HA3 GLY 3 2HA GLY 3 -15.735 7.575 0.791 14 H SER 4 H SER 4 -14.731 7.490 3.214 15 HA SER 4 HA SER 4 -13.282 4.962 3.313 16 HB2 SER 4 1HB SER 4 -11.833 6.276 4.974 17 HB3 SER 4 2HB SER 4 -11.786 6.796 3.291 18 HG SER 4 HG SER 4 -13.275 7.972 5.409 19 H SER 5 H SER 5 -15.229 3.905 4.131 20 HA SER 5 HA SER 5 -16.059 4.534 6.827 21 HB2 SER 5 1HB SER 5 -17.485 2.467 6.514 22 HB3 SER 5 2HB SER 5 -17.774 3.758 5.349 23 HG SER 5 HG SER 5 -17.128 1.246 4.848 24 H GLN 6 H GLN 6 -13.944 2.333 5.205 25 HA GLN 6 HA GLN 6 -13.475 0.811 7.659 26 HB2 GLN 6 1HB GLN 6 -12.480 0.270 4.861 27 HB3 GLN 6 2HB GLN 6 -12.338 -0.806 6.242 28 HG2 GLN 6 1HG GLN 6 -14.910 0.057 4.942 29 HG3 GLN 6 2HG GLN 6 -14.108 -1.498 4.732 30 HE21 GLN 6 1HE2 GLN 6 -15.257 -2.860 7.735 31 HE22 GLN 6 2HE2 GLN 6 -14.167 -3.000 6.398 32 H CYS 7 H CYS 7 -11.110 0.138 7.916 33 HA CYS 7 HA CYS 7 -8.904 0.544 8.175 34 HB2 CYS 7 2HB CYS 7 -8.762 1.179 5.853 35 HB3 CYS 7 1HB CYS 7 -9.403 2.772 6.217 36 H ASN 8 H ASN 8 -8.315 1.176 10.104 37 HA ASN 8 HA ASN 8 -9.335 3.668 11.211 38 HB2 ASN 8 1HB ASN 8 -7.861 1.323 12.384 39 HB3 ASN 8 2HB ASN 8 -8.036 2.829 13.275 40 HD21 ASN 8 1HD2 ASN 8 -10.918 1.403 14.603 41 HD22 ASN 8 2HD2 ASN 8 -9.278 1.890 14.868 42 H ALA 9 H ALA 9 -6.518 2.459 9.714 43 HA ALA 9 HA ALA 9 -4.711 4.354 10.937 44 HB1 ALA 9 1HB ALA 9 -4.266 2.503 8.599 45 HB2 ALA 9 2HB ALA 9 -3.918 2.132 10.287 46 HB3 ALA 9 3HB ALA 9 -3.021 3.408 9.461 47 H GLY 10 H GLY 10 -7.068 4.678 8.686 48 HA2 GLY 10 1HA GLY 10 -6.763 7.242 8.015 49 HA3 GLY 10 2HA GLY 10 -5.641 6.470 6.904 50 HA PRO 11 HA PRO 11 -9.565 6.238 4.652 51 HB2 PRO 11 2HB PRO 11 -8.609 6.873 2.243 52 HB3 PRO 11 1HB PRO 11 -8.839 8.105 3.488 53 HG2 PRO 11 2HG PRO 11 -6.334 6.789 2.566 54 HG3 PRO 11 1HG PRO 11 -6.598 8.465 3.070 55 HD2 PRO 11 2HD PRO 11 -5.524 6.423 4.653 56 HD3 PRO 11 1HD PRO 11 -6.158 7.969 5.243 57 H VAL 12 H VAL 12 -10.219 4.947 2.763 58 HA VAL 12 HA VAL 12 -8.990 2.336 2.816 59 HB VAL 12 HB VAL 12 -10.852 1.783 1.160 60 HG11 VAL 12 1HG1 VAL 12 -10.977 1.243 3.533 61 HG12 VAL 12 2HG1 VAL 12 -12.557 1.704 2.897 62 HG13 VAL 12 3HG1 VAL 12 -11.628 2.848 3.869 63 HG21 VAL 12 1HG2 VAL 12 -11.253 4.078 0.379 64 HG22 VAL 12 2HG2 VAL 12 -11.822 4.522 1.987 65 HG23 VAL 12 3HG2 VAL 12 -12.718 3.344 1.031 66 H GLN 13 H GLN 13 -7.757 1.434 1.250 67 HA GLN 13 HA GLN 13 -7.292 3.073 -1.156 68 HB2 GLN 13 1HB GLN 13 -5.359 1.102 0.070 69 HB3 GLN 13 2HB GLN 13 -5.054 2.195 -1.266 70 HG2 GLN 13 1HG GLN 13 -5.638 3.023 1.561 71 HG3 GLN 13 2HG GLN 13 -4.048 2.967 0.807 72 HE21 GLN 13 1HE2 GLN 13 -5.622 6.397 0.728 73 HE22 GLN 13 2HE2 GLN 13 -5.514 5.198 1.973 74 H CYS 14 H CYS 14 -7.267 2.139 -3.115 75 HA CYS 14 HA CYS 14 -7.943 -0.719 -3.277 76 HB2 CYS 14 2HB CYS 14 -9.696 0.787 -4.164 77 HB3 CYS 14 1HB CYS 14 -8.537 1.473 -5.289 78 H CYS 15 H CYS 15 -6.204 -1.833 -3.696 79 HA CYS 15 HA CYS 15 -4.020 -0.583 -5.218 80 HB2 CYS 15 2HB CYS 15 -3.870 -2.794 -3.161 81 HB3 CYS 15 1HB CYS 15 -2.514 -1.938 -3.893 82 H ASN 16 H ASN 16 -2.997 -1.696 -6.795 83 HA ASN 16 HA ASN 16 -4.432 -3.715 -8.182 84 HB2 ASN 16 1HB ASN 16 -2.805 -1.985 -9.132 85 HB3 ASN 16 2HB ASN 16 -1.537 -3.062 -8.581 86 HD21 ASN 16 1HD2 ASN 16 -1.955 -5.423 -11.108 87 HD22 ASN 16 2HD2 ASN 16 -1.233 -5.043 -9.586 88 H THR 17 H THR 17 -1.632 -3.711 -6.076 89 HA THR 17 HA THR 17 -1.882 -6.600 -5.758 90 HB THR 17 HB THR 17 0.726 -5.245 -6.507 91 HG1 THR 17 1HG THR 17 -0.937 -7.113 -7.884 92 HG21 THR 17 1HG2 THR 17 1.598 -7.595 -6.533 93 HG22 THR 17 2HG2 THR 17 0.113 -8.089 -5.718 94 HG23 THR 17 3HG2 THR 17 1.222 -6.960 -4.930 95 H LEU 18 H LEU 18 -2.043 -6.935 -3.626 96 HA LEU 18 HA LEU 18 -0.591 -5.175 -1.786 97 HB2 LEU 18 1HB LEU 18 -2.633 -7.335 -1.287 98 HB3 LEU 18 2HB LEU 18 -1.799 -6.473 -0.011 99 HG LEU 18 HG LEU 18 -3.622 -5.233 -2.057 100 HD11 LEU 18 1HD1 LEU 18 -4.767 -6.639 -0.366 101 HD12 LEU 18 2HD1 LEU 18 -5.170 -4.929 -0.225 102 HD13 LEU 18 3HD1 LEU 18 -4.029 -5.660 0.904 103 HD21 LEU 18 1HD2 LEU 18 -1.852 -3.715 -1.381 104 HD22 LEU 18 2HD2 LEU 18 -2.211 -4.029 0.316 105 HD23 LEU 18 3HD2 LEU 18 -3.395 -3.208 -0.700 106 H THR 19 H THR 19 1.452 -5.790 -1.949 107 HA THR 19 HA THR 19 2.092 -8.573 -1.278 108 HB THR 19 HB THR 19 2.480 -8.325 -3.659 109 HG1 THR 19 1HG THR 19 4.140 -9.545 -3.286 110 HG21 THR 19 1HG2 THR 19 2.742 -5.977 -3.953 111 HG22 THR 19 2HG2 THR 19 4.243 -6.733 -4.487 112 HG23 THR 19 3HG2 THR 19 4.166 -5.943 -2.912 113 H SER 20 H SER 20 4.794 -8.405 -1.006 114 HA SER 20 HA SER 20 4.947 -6.727 1.390 115 HB2 SER 20 1HB SER 20 6.825 -8.922 0.477 116 HB3 SER 20 2HB SER 20 6.764 -8.175 2.073 117 HG SER 20 HG SER 20 4.327 -9.057 1.535 118 H ALA 21 H ALA 21 6.923 -5.560 1.839 119 HA ALA 21 HA ALA 21 7.600 -3.880 -0.338 120 HB1 ALA 21 1HB ALA 21 7.425 -3.109 1.978 121 HB2 ALA 21 2HB ALA 21 8.976 -2.692 1.253 122 HB3 ALA 21 3HB ALA 21 8.867 -4.038 2.388 123 H SER 22 H SER 22 8.723 -6.890 0.212 124 HA SER 22 HA SER 22 11.464 -6.408 -0.585 125 HB2 SER 22 1HB SER 22 10.838 -8.265 0.965 126 HB3 SER 22 2HB SER 22 9.988 -9.029 -0.367 127 HG SER 22 HG SER 22 12.180 -8.735 -1.458 128 H ASN 23 H ASN 23 8.435 -6.716 -2.044 129 HA ASN 23 HA ASN 23 9.198 -7.987 -4.480 130 HB2 ASN 23 1HB ASN 23 6.822 -7.712 -3.562 131 HB3 ASN 23 2HB ASN 23 6.892 -6.057 -4.148 132 HD21 ASN 23 1HD2 ASN 23 6.343 -9.145 -6.701 133 HD22 ASN 23 2HD2 ASN 23 6.707 -9.403 -5.030 134 H SER 24 H SER 24 9.855 -7.117 -6.385 135 HA SER 24 HA SER 24 11.361 -4.748 -6.306 136 HB2 SER 24 1HB SER 24 10.396 -6.254 -8.745 137 HB3 SER 24 2HB SER 24 11.755 -5.134 -8.677 138 HG SER 24 HG SER 24 11.516 -7.726 -7.604 139 H GLN 25 H GLN 25 8.044 -5.377 -7.229 140 HA GLN 25 HA GLN 25 7.542 -2.960 -8.597 141 HB2 GLN 25 1HB GLN 25 6.021 -4.967 -8.553 142 HB3 GLN 25 2HB GLN 25 5.610 -4.549 -6.888 143 HG2 GLN 25 1HG GLN 25 3.891 -3.733 -8.281 144 HG3 GLN 25 2HG GLN 25 4.829 -2.362 -7.696 145 HE21 GLN 25 1HE2 GLN 25 5.929 -1.317 -10.837 146 HE22 GLN 25 2HE2 GLN 25 6.098 -1.183 -9.119 147 H ALA 26 H ALA 26 7.276 -3.964 -5.234 148 HA ALA 26 HA ALA 26 6.288 -1.482 -4.257 149 HB1 ALA 26 1HB ALA 26 7.645 -3.779 -2.849 150 HB2 ALA 26 2HB ALA 26 5.908 -3.535 -3.041 151 HB3 ALA 26 3HB ALA 26 6.853 -2.425 -2.045 152 H ALA 27 H ALA 27 9.499 -3.030 -4.060 153 HA ALA 27 HA ALA 27 10.708 -0.915 -2.655 154 HB1 ALA 27 1HB ALA 27 12.831 -1.968 -3.239 155 HB2 ALA 27 2HB ALA 27 12.015 -2.966 -4.442 156 HB3 ALA 27 3HB ALA 27 11.644 -3.170 -2.730 157 H GLY 28 H GLY 28 10.356 -1.482 -6.132 158 HA2 GLY 28 1HA GLY 28 12.035 0.566 -7.050 159 HA3 GLY 28 2HA GLY 28 10.595 -0.006 -7.884 160 H LEU 29 H LEU 29 8.722 0.629 -5.920 161 HA LEU 29 HA LEU 29 8.288 3.428 -6.365 162 HB2 LEU 29 1HB LEU 29 6.892 1.431 -4.625 163 HB3 LEU 29 2HB LEU 29 6.293 3.024 -4.974 164 HG LEU 29 HG LEU 29 6.655 0.800 -6.976 165 HD11 LEU 29 1HD1 LEU 29 4.190 0.916 -7.106 166 HD12 LEU 29 2HD1 LEU 29 4.203 2.051 -5.755 167 HD13 LEU 29 3HD1 LEU 29 4.778 0.398 -5.526 168 HD21 LEU 29 1HD2 LEU 29 5.520 2.323 -8.543 169 HD22 LEU 29 2HD2 LEU 29 7.083 2.948 -8.019 170 HD23 LEU 29 3HD2 LEU 29 5.596 3.605 -7.333 171 H ILE 30 H ILE 30 8.847 1.417 -3.496 172 HA ILE 30 HA ILE 30 8.905 3.292 -1.484 173 HB ILE 30 HB ILE 30 10.580 0.817 -1.846 174 HG12 ILE 30 1HG1 ILE 30 8.065 1.335 -0.264 175 HG13 ILE 30 2HG1 ILE 30 8.116 0.553 -1.837 176 HG21 ILE 30 1HG2 ILE 30 11.216 0.882 0.403 177 HG22 ILE 30 2HG2 ILE 30 10.036 2.126 0.793 178 HG23 ILE 30 3HG2 ILE 30 11.465 2.538 -0.160 179 HD11 ILE 30 1HD1 ILE 30 7.883 -1.031 -0.011 180 HD12 ILE 30 2HD1 ILE 30 9.415 -0.478 0.665 181 HD13 ILE 30 3HD1 ILE 30 9.379 -1.275 -0.909 182 H GLN 31 H GLN 31 11.546 2.274 -3.576 183 HA GLN 31 HA GLN 31 13.394 4.027 -2.372 184 HB2 GLN 31 1HB GLN 31 13.469 2.289 -4.808 185 HB3 GLN 31 2HB GLN 31 14.841 3.296 -4.339 186 HG2 GLN 31 1HG GLN 31 14.820 2.133 -2.141 187 HG3 GLN 31 2HG GLN 31 13.554 1.088 -2.773 188 HE21 GLN 31 1HE2 GLN 31 15.675 -0.923 -4.654 189 HE22 GLN 31 2HE2 GLN 31 14.048 -0.438 -4.325 190 H GLN 32 H GLN 32 11.025 4.404 -4.849 191 HA GLN 32 HA GLN 32 12.228 6.732 -6.035 192 HB2 GLN 32 1HB GLN 32 9.426 5.637 -6.012 193 HB3 GLN 32 2HB GLN 32 9.771 7.222 -6.684 194 HG2 GLN 32 1HG GLN 32 11.036 4.654 -7.590 195 HG3 GLN 32 2HG GLN 32 9.653 5.435 -8.353 196 HE21 GLN 32 1HE2 GLN 32 13.424 6.779 -8.972 197 HE22 GLN 32 2HE2 GLN 32 13.073 5.560 -7.798 198 H LEU 33 H LEU 33 10.033 6.088 -3.399 199 HA LEU 33 HA LEU 33 9.515 8.872 -2.868 200 HB2 LEU 33 1HB LEU 33 8.968 6.693 -0.901 201 HB3 LEU 33 2HB LEU 33 8.034 8.135 -1.240 202 HG LEU 33 HG LEU 33 8.230 5.772 -3.106 203 HD11 LEU 33 1HD1 LEU 33 6.063 5.118 -2.345 204 HD12 LEU 33 2HD1 LEU 33 5.984 6.489 -1.241 205 HD13 LEU 33 3HD1 LEU 33 7.154 5.198 -0.965 206 HD21 LEU 33 1HD2 LEU 33 6.572 8.276 -3.107 207 HD22 LEU 33 2HD2 LEU 33 6.115 6.831 -4.016 208 HD23 LEU 33 3HD2 LEU 33 7.639 7.658 -4.374 209 H GLY 34 H GLY 34 11.779 6.474 -1.932 210 HA2 GLY 34 1HA GLY 34 13.709 6.662 -0.681 211 HA3 GLY 34 2HA GLY 34 13.279 8.330 -0.320 212 H LEU 35 H LEU 35 11.458 5.363 0.213 213 HA LEU 35 HA LEU 35 10.864 6.166 2.915 214 HB2 LEU 35 1HB LEU 35 10.030 3.923 1.149 215 HB3 LEU 35 2HB LEU 35 9.659 3.870 2.851 216 HG LEU 35 HG LEU 35 8.736 5.958 0.884 217 HD11 LEU 35 1HD1 LEU 35 6.529 5.013 1.285 218 HD12 LEU 35 2HD1 LEU 35 7.239 3.796 2.347 219 HD13 LEU 35 3HD1 LEU 35 7.634 3.805 0.628 220 HD21 LEU 35 1HD2 LEU 35 8.202 5.672 3.837 221 HD22 LEU 35 2HD2 LEU 35 7.344 6.771 2.759 222 HD23 LEU 35 3HD2 LEU 35 9.068 6.985 3.045 223 H SER 36 H SER 36 12.602 5.988 4.218 224 HA SER 36 HA SER 36 14.109 3.494 4.276 225 HB2 SER 36 1HB SER 36 15.386 4.866 6.096 226 HB3 SER 36 2HB SER 36 15.574 5.310 4.399 227 HG SER 36 HG SER 36 14.854 7.193 4.943 228 H GLY 37 H GLY 37 13.710 1.934 5.719 229 HA2 GLY 37 1HA GLY 37 13.305 1.457 8.129 230 HA3 GLY 37 2HA GLY 37 11.985 2.614 8.025 231 H VAL 38 H VAL 38 11.539 1.461 5.219 232 HA VAL 38 HA VAL 38 9.654 -0.597 6.010 233 HB VAL 38 HB VAL 38 10.311 0.407 3.230 234 HG11 VAL 38 1HG1 VAL 38 9.105 -1.682 3.246 235 HG12 VAL 38 2HG1 VAL 38 8.038 -0.383 2.715 236 HG13 VAL 38 3HG1 VAL 38 7.909 -1.017 4.354 237 HG21 VAL 38 1HG2 VAL 38 8.233 1.421 5.169 238 HG22 VAL 38 2HG2 VAL 38 8.386 1.910 3.482 239 HG23 VAL 38 3HG2 VAL 38 9.671 2.289 4.629 240 H GLY 39 H GLY 39 10.504 -2.566 6.357 241 HA2 GLY 39 1HA GLY 39 12.801 -3.477 4.815 242 HA3 GLY 39 2HA GLY 39 12.119 -4.264 6.229 243 H ALA 40 H ALA 40 12.391 -6.207 4.891 244 HA ALA 40 HA ALA 40 10.906 -6.442 2.457 245 HB1 ALA 40 1HB ALA 40 12.967 -7.648 2.673 246 HB2 ALA 40 2HB ALA 40 11.653 -8.817 2.543 247 HB3 ALA 40 3HB ALA 40 12.380 -8.481 4.112 248 H ASN 41 H ASN 41 10.341 -7.324 5.798 249 HA ASN 41 HA ASN 41 8.079 -9.007 5.110 250 HB2 ASN 41 1HB ASN 41 9.220 -8.191 7.788 251 HB3 ASN 41 2HB ASN 41 7.913 -9.341 7.560 252 HD21 ASN 41 1HD2 ASN 41 10.417 -11.472 5.704 253 HD22 ASN 41 2HD2 ASN 41 9.091 -10.505 5.165 254 H VAL 42 H VAL 42 8.281 -5.952 4.807 255 HA VAL 42 HA VAL 42 6.069 -5.080 6.488 256 HB VAL 42 HB VAL 42 7.780 -3.507 4.557 257 HG11 VAL 42 1HG1 VAL 42 5.750 -2.614 6.600 258 HG12 VAL 42 2HG1 VAL 42 5.721 -2.322 4.860 259 HG13 VAL 42 3HG1 VAL 42 6.951 -1.545 5.871 260 HG21 VAL 42 1HG2 VAL 42 9.146 -4.308 6.302 261 HG22 VAL 42 2HG2 VAL 42 7.917 -3.932 7.517 262 HG23 VAL 42 3HG2 VAL 42 8.761 -2.625 6.681 263 HA PRO 43 HA PRO 43 3.214 -5.717 3.153 264 HB2 PRO 43 2HB PRO 43 1.211 -4.184 4.382 265 HB3 PRO 43 1HB PRO 43 1.415 -5.920 4.496 266 HG2 PRO 43 2HG PRO 43 1.802 -3.969 6.522 267 HG3 PRO 43 1HG PRO 43 1.990 -5.722 6.647 268 HD2 PRO 43 2HD PRO 43 4.017 -3.668 6.488 269 HD3 PRO 43 1HD PRO 43 4.213 -5.389 6.831 270 H VAL 44 H VAL 44 2.688 -4.557 1.348 271 HA VAL 44 HA VAL 44 2.497 -1.652 1.581 272 HB VAL 44 HB VAL 44 3.900 -1.282 -0.396 273 HG11 VAL 44 1HG1 VAL 44 4.946 -1.023 1.761 274 HG12 VAL 44 2HG1 VAL 44 6.098 -1.744 0.636 275 HG13 VAL 44 3HG1 VAL 44 5.287 -2.751 1.838 276 HG21 VAL 44 1HG2 VAL 44 4.318 -4.243 -0.216 277 HG22 VAL 44 2HG2 VAL 44 5.427 -3.180 -1.071 278 HG23 VAL 44 3HG2 VAL 44 3.748 -3.298 -1.593 279 H GLY 45 H GLY 45 1.549 -0.673 -0.326 280 HA2 GLY 45 1HA GLY 45 -0.123 -2.601 -1.794 281 HA3 GLY 45 2HA GLY 45 -0.644 -0.976 -1.385 282 H ILE 46 H ILE 46 0.123 -2.733 -3.864 283 HA ILE 46 HA ILE 46 1.877 -0.890 -5.272 284 HB ILE 46 HB ILE 46 0.696 -3.584 -5.905 285 HG12 ILE 46 1HG1 ILE 46 2.930 -4.393 -5.982 286 HG13 ILE 46 2HG1 ILE 46 3.582 -2.784 -6.095 287 HG21 ILE 46 1HG2 ILE 46 0.498 -2.286 -7.935 288 HG22 ILE 46 2HG2 ILE 46 1.760 -3.507 -8.106 289 HG23 ILE 46 3HG2 ILE 46 2.197 -1.821 -7.826 290 HD11 ILE 46 1HD1 ILE 46 4.044 -3.817 -3.971 291 HD12 ILE 46 2HD1 ILE 46 2.311 -3.956 -3.661 292 HD13 ILE 46 3HD1 ILE 46 3.062 -2.362 -3.789 293 H ASN 47 H ASN 47 1.010 0.775 -6.324 294 HA ASN 47 HA ASN 47 -0.370 2.076 -7.573 295 HB2 ASN 47 1HB ASN 47 -0.243 -0.138 -8.990 296 HB3 ASN 47 2HB ASN 47 -1.910 -0.329 -8.478 297 HD21 ASN 47 1HD2 ASN 47 -1.591 1.521 -11.742 298 HD22 ASN 47 2HD2 ASN 47 -0.859 0.077 -11.136 299 H CYS 48 H CYS 48 -1.090 2.308 -5.127 300 HA CYS 48 HA CYS 48 -3.855 1.481 -4.766 301 HB2 CYS 48 2HB CYS 48 -1.992 2.923 -2.875 302 HB3 CYS 48 1HB CYS 48 -3.586 2.319 -2.492 303 H ASN 49 H ASN 49 -5.533 2.806 -4.809 304 HA ASN 49 HA ASN 49 -5.079 5.679 -4.504 305 HB2 ASN 49 1HB ASN 49 -7.034 6.017 -6.129 306 HB3 ASN 49 2HB ASN 49 -5.479 5.590 -6.821 307 HD21 ASN 49 1HD2 ASN 49 -6.549 2.539 -8.139 308 HD22 ASN 49 2HD2 ASN 49 -5.215 3.578 -7.769 309 HA PRO 50 HA PRO 50 -8.010 5.209 -1.411 310 HB2 PRO 50 2HB PRO 50 -8.863 7.773 -1.106 311 HB3 PRO 50 1HB PRO 50 -7.261 7.225 -0.634 312 HG2 PRO 50 2HG PRO 50 -8.104 8.884 -2.905 313 HG3 PRO 50 1HG PRO 50 -6.540 8.781 -2.096 314 HD2 PRO 50 2HD PRO 50 -7.302 7.587 -4.558 315 HD3 PRO 50 1HD PRO 50 -5.771 7.373 -3.698 316 H ILE 51 H ILE 51 -9.917 4.273 -1.459 317 HA ILE 51 HA ILE 51 -11.707 4.709 -3.665 318 HB ILE 51 HB ILE 51 -12.544 3.102 -1.298 319 HG12 ILE 51 1HG1 ILE 51 -10.436 2.232 -3.287 320 HG13 ILE 51 2HG1 ILE 51 -10.164 2.528 -1.576 321 HG21 ILE 51 1HG2 ILE 51 -12.662 2.600 -4.275 322 HG22 ILE 51 2HG2 ILE 51 -13.935 3.375 -3.332 323 HG23 ILE 51 3HG2 ILE 51 -13.505 1.694 -3.017 324 HD11 ILE 51 1HD1 ILE 51 -10.333 0.158 -2.043 325 HD12 ILE 51 2HD1 ILE 51 -11.938 0.400 -2.733 326 HD13 ILE 51 3HD1 ILE 51 -11.662 0.696 -1.017 327 H THR 52 H THR 52 -12.354 6.878 -3.350 328 HA THR 52 HA THR 52 -14.069 7.272 -0.998 329 HB THR 52 HB THR 52 -13.675 9.703 -1.302 330 HG1 THR 52 1HG THR 52 -12.837 10.296 -3.149 331 HG21 THR 52 1HG2 THR 52 -11.372 9.692 -0.466 332 HG22 THR 52 2HG2 THR 52 -11.163 8.037 -1.042 333 HG23 THR 52 3HG2 THR 52 -12.305 8.379 0.258 334 H GLY 53 H GLY 53 -13.931 7.225 -4.428 335 HA2 GLY 53 1HA GLY 53 -16.423 8.587 -4.869 336 HA3 GLY 53 2HA GLY 53 -15.545 7.610 -6.041 337 H ILE 54 H ILE 54 -15.391 5.302 -4.331 338 HA ILE 54 HA ILE 54 -18.117 4.304 -4.647 339 HB ILE 54 HB ILE 54 -15.586 2.766 -4.049 340 HG12 ILE 54 1HG1 ILE 54 -15.436 3.802 -6.247 341 HG13 ILE 54 2HG1 ILE 54 -15.679 2.068 -6.417 342 HG21 ILE 54 1HG2 ILE 54 -17.668 1.668 -3.320 343 HG22 ILE 54 2HG2 ILE 54 -16.840 0.787 -4.608 344 HG23 ILE 54 3HG2 ILE 54 -18.265 1.758 -4.979 345 HD11 ILE 54 1HD1 ILE 54 -17.766 4.209 -6.758 346 HD12 ILE 54 2HD1 ILE 54 -18.063 2.475 -6.859 347 HD13 ILE 54 3HD1 ILE 54 -17.009 3.258 -8.034 348 H GLY 55 H GLY 55 -19.158 3.155 -2.924 349 HA2 GLY 55 1HA GLY 55 -18.538 2.370 -0.528 350 HA3 GLY 55 2HA GLY 55 -18.288 4.089 -0.287 351 H ALA 56 H ALA 56 -19.914 4.969 0.769 352 HA ALA 56 HA ALA 56 -22.002 5.514 1.466 353 HB1 ALA 56 1HB ALA 56 -23.825 5.467 -0.159 354 HB2 ALA 56 2HB ALA 56 -22.853 4.450 -1.226 355 HB3 ALA 56 3HB ALA 56 -22.347 6.103 -0.881 356 H GLY 57 H GLY 57 -20.937 2.990 2.202 357 HA2 GLY 57 1HA GLY 57 -23.282 1.738 3.219 358 HA3 GLY 57 2HA GLY 57 -22.567 0.785 1.925 359 H SER 58 H SER 58 -21.690 -0.902 2.964 360 HA SER 58 HA SER 58 -20.388 -0.587 5.511 361 HB2 SER 58 1HB SER 58 -20.567 -3.023 3.727 362 HB3 SER 58 2HB SER 58 -20.110 -3.005 5.431 363 HG SER 58 HG SER 58 -22.142 -2.839 5.982 364 H GLY 59 H GLY 59 -19.387 -1.553 2.241 365 HA2 GLY 59 1HA GLY 59 -16.703 -0.550 2.827 366 HA3 GLY 59 2HA GLY 59 -16.856 -2.236 2.347 367 H SER 60 H SER 60 -15.714 0.319 1.091 368 HA SER 60 HA SER 60 -17.261 0.632 -1.302 369 HB2 SER 60 1HB SER 60 -14.417 1.544 -0.930 370 HB3 SER 60 2HB SER 60 -15.704 2.290 -1.893 371 HG SER 60 HG SER 60 -15.420 3.449 0.025 372 H SER 61 H SER 61 -17.216 -0.707 -2.961 373 HA SER 61 HA SER 61 -15.590 -2.981 -3.092 374 HB2 SER 61 1HB SER 61 -17.102 -1.678 -5.366 375 HB3 SER 61 2HB SER 61 -16.624 -3.372 -5.246 376 HG SER 61 HG SER 61 -17.957 -3.320 -3.224 377 H CYS 62 H CYS 62 -13.518 -3.124 -3.585 378 HA CYS 62 HA CYS 62 -12.297 -1.170 -5.396 379 HB2 CYS 62 2HB CYS 62 -11.032 -1.398 -3.401 380 HB3 CYS 62 1HB CYS 62 -11.175 -3.150 -3.418 381 H ASN 63 H ASN 63 -11.541 -1.724 -7.344 382 HA ASN 63 HA ASN 63 -12.524 -3.967 -8.677 383 HB2 ASN 63 1HB ASN 63 -10.771 -3.341 -10.437 384 HB3 ASN 63 2HB ASN 63 -11.989 -2.129 -10.044 385 HD21 ASN 63 1HD2 ASN 63 -8.054 -1.473 -9.373 386 HD22 ASN 63 2HD2 ASN 63 -8.651 -2.998 -9.928 387 H ALA 64 H ALA 64 -9.523 -3.504 -6.954 388 HA ALA 64 HA ALA 64 -8.712 -6.196 -7.814 389 HB1 ALA 64 1HB ALA 64 -7.333 -4.393 -8.776 390 HB2 ALA 64 2HB ALA 64 -6.413 -5.512 -7.765 391 HB3 ALA 64 3HB ALA 64 -6.857 -3.922 -7.142 392 H ASN 65 H ASN 65 -7.168 -4.171 -5.353 393 HA ASN 65 HA ASN 65 -8.130 -6.035 -3.288 394 HB2 ASN 65 1HB ASN 65 -5.285 -5.084 -3.491 395 HB3 ASN 65 2HB ASN 65 -5.925 -6.230 -2.333 396 HD21 ASN 65 1HD2 ASN 65 -4.855 -7.387 -6.064 397 HD22 ASN 65 2HD2 ASN 65 -4.929 -5.722 -5.608 398 HA PRO 66 HA PRO 66 -8.621 -2.039 -1.304 399 HB2 PRO 66 2HB PRO 66 -10.412 -2.846 0.515 400 HB3 PRO 66 1HB PRO 66 -10.860 -2.614 -1.179 401 HG2 PRO 66 2HG PRO 66 -10.313 -5.137 0.308 402 HG3 PRO 66 1HG PRO 66 -11.520 -4.812 -0.948 403 HD2 PRO 66 2HD PRO 66 -9.060 -6.067 -1.350 404 HD3 PRO 66 1HD PRO 66 -10.051 -5.326 -2.620 405 H ALA 67 H ALA 67 -7.418 -1.223 0.324 406 HA ALA 67 HA ALA 67 -6.533 -3.023 2.457 407 HB1 ALA 67 1HB ALA 67 -4.640 -1.419 0.746 408 HB2 ALA 67 2HB ALA 67 -4.826 -3.171 0.729 409 HB3 ALA 67 3HB ALA 67 -4.201 -2.367 2.168 410 H CYS 68 H CYS 68 -5.680 -2.011 4.272 411 HA CYS 68 HA CYS 68 -6.109 0.896 4.481 412 HB2 CYS 68 2HB CYS 68 -7.451 -0.362 6.084 413 HB3 CYS 68 1HB CYS 68 -6.027 -1.239 6.628 414 H CYS 69 H CYS 69 -4.307 2.127 4.760 415 HA CYS 69 HA CYS 69 -1.824 0.658 5.337 416 HB2 CYS 69 2HB CYS 69 -2.508 1.961 2.948 417 HB3 CYS 69 1HB CYS 69 -1.314 2.981 3.723 418 H ASP 70 H ASP 70 -0.098 1.888 6.193 419 HA ASP 70 HA ASP 70 -0.829 3.759 8.216 420 HB2 ASP 70 1HB ASP 70 1.040 2.235 8.515 421 HB3 ASP 70 2HB ASP 70 1.846 2.886 7.106 422 H ASN 71 H ASN 71 0.775 3.921 5.100 423 HA ASN 71 HA ASN 71 -0.159 6.636 4.680 424 HB2 ASN 71 1HB ASN 71 2.801 5.979 4.694 425 HB3 ASN 71 2HB ASN 71 2.134 7.376 3.865 426 HD21 ASN 71 1HD2 ASN 71 2.758 7.398 7.839 427 HD22 ASN 71 2HD2 ASN 71 3.044 5.998 6.860 428 H VAL 72 H VAL 72 -0.385 7.072 2.459 429 HA VAL 72 HA VAL 72 0.947 5.209 0.643 430 HB VAL 72 HB VAL 72 -0.897 4.463 -0.334 431 HG11 VAL 72 1HG1 VAL 72 -3.066 4.727 0.833 432 HG12 VAL 72 2HG1 VAL 72 -2.294 5.906 1.894 433 HG13 VAL 72 3HG1 VAL 72 -1.730 4.234 1.875 434 HG21 VAL 72 1HG2 VAL 72 -1.032 6.559 -1.608 435 HG22 VAL 72 2HG2 VAL 72 -2.087 7.227 -0.359 436 HG23 VAL 72 3HG2 VAL 72 -2.618 5.838 -1.309 437 H TYR 73 H TYR 73 1.338 6.068 -1.469 438 HA TYR 73 HA TYR 73 1.513 9.007 -1.442 439 HB2 TYR 73 2HB TYR 73 3.569 6.991 -2.350 440 HB3 TYR 73 1HB TYR 73 3.747 8.740 -2.489 441 HD1 TYR 73 1HD TYR 73 4.227 10.097 -0.532 442 HD2 TYR 73 2HD TYR 73 3.709 5.888 -0.169 443 HE1 TYR 73 1HE TYR 73 5.142 10.183 1.748 444 HE2 TYR 73 2HE TYR 73 4.627 5.961 2.114 445 HH TYR 73 HH TYR 73 5.077 8.904 3.799 446 H THR 74 H THR 74 1.817 9.926 -3.648 447 HA THR 74 HA THR 74 -0.438 9.075 -5.149 448 HB THR 74 HB THR 74 1.573 11.130 -6.048 449 HG1 THR 74 1HG THR 74 0.295 11.134 -3.746 450 HG21 THR 74 1HG2 THR 74 -0.190 10.563 -7.653 451 HG22 THR 74 2HG2 THR 74 -0.399 12.202 -7.036 452 HG23 THR 74 3HG2 THR 74 -1.415 10.896 -6.428 453 H ASN 75 H ASN 75 2.898 8.297 -5.397 454 HA ASN 75 HA ASN 75 2.907 7.483 -8.128 455 HB2 ASN 75 1HB ASN 75 4.877 6.191 -7.590 456 HB3 ASN 75 2HB ASN 75 4.983 7.731 -6.748 457 HD21 ASN 75 1HD2 ASN 75 5.807 4.768 -4.568 458 HD22 ASN 75 2HD2 ASN 75 6.238 5.147 -6.196 459 H GLY 76 H GLY 76 1.453 6.349 -5.307 460 HA2 GLY 76 1HA GLY 76 -0.371 4.838 -5.449 461 HA3 GLY 76 2HA GLY 76 0.466 3.994 -6.747 462 H LEU 77 H LEU 77 2.506 4.879 -4.116 463 HA LEU 77 HA LEU 77 2.606 2.041 -3.387 464 HB2 LEU 77 1HB LEU 77 4.662 3.212 -4.101 465 HB3 LEU 77 2HB LEU 77 4.490 4.302 -2.755 466 HG LEU 77 HG LEU 77 6.213 2.425 -2.548 467 HD11 LEU 77 1HD1 LEU 77 5.758 2.059 -0.180 468 HD12 LEU 77 2HD1 LEU 77 4.124 2.698 -0.400 469 HD13 LEU 77 3HD1 LEU 77 5.520 3.748 -0.637 470 HD21 LEU 77 1HD2 LEU 77 4.775 0.643 -3.423 471 HD22 LEU 77 2HD2 LEU 77 3.744 0.797 -1.997 472 HD23 LEU 77 3HD2 LEU 77 5.421 0.274 -1.825 473 H GLY 78 H GLY 78 1.765 1.346 -1.562 474 HA2 GLY 78 1HA GLY 78 1.247 3.311 0.575 475 HA3 GLY 78 2HA GLY 78 0.310 1.847 0.325 476 H VAL 79 H VAL 79 1.828 2.847 2.678 477 HA VAL 79 HA VAL 79 3.730 0.612 2.975 478 HB VAL 79 HB VAL 79 4.689 2.943 3.150 479 HG11 VAL 79 1HG1 VAL 79 2.782 3.987 4.281 480 HG12 VAL 79 2HG1 VAL 79 4.323 4.282 5.086 481 HG13 VAL 79 3HG1 VAL 79 3.199 3.093 5.742 482 HG21 VAL 79 1HG2 VAL 79 5.826 1.032 4.126 483 HG22 VAL 79 2HG2 VAL 79 4.902 1.232 5.616 484 HG23 VAL 79 3HG2 VAL 79 6.049 2.475 5.115 485 H GLN 80 H GLN 80 3.239 -0.913 4.380 486 HA GLN 80 HA GLN 80 2.193 -2.139 5.957 487 HB2 GLN 80 1HB GLN 80 1.797 0.600 7.116 488 HB3 GLN 80 2HB GLN 80 1.055 -0.802 7.874 489 HG2 GLN 80 1HG GLN 80 3.964 -0.695 7.242 490 HG3 GLN 80 2HG GLN 80 3.318 -0.033 8.747 491 HE21 GLN 80 1HE2 GLN 80 4.443 -3.604 9.111 492 HE22 GLN 80 2HE2 GLN 80 5.175 -2.188 8.433 493 H CYS 81 H CYS 81 0.884 -2.051 3.742 494 HA CYS 81 HA CYS 81 -1.881 -1.280 4.197 495 HB2 CYS 81 2HB CYS 81 -0.449 -2.426 1.810 496 HB3 CYS 81 1HB CYS 81 -2.198 -2.381 1.883 497 H ASN 82 H ASN 82 -3.113 -2.555 5.365 498 HA ASN 82 HA ASN 82 -2.803 -5.458 5.089 499 HB2 ASN 82 1HB ASN 82 -4.273 -5.643 7.063 500 HB3 ASN 82 2HB ASN 82 -2.824 -4.713 7.393 501 HD21 ASN 82 1HD2 ASN 82 -6.507 -3.068 7.735 502 HD22 ASN 82 2HD2 ASN 82 -6.265 -4.659 7.102 503 HA PRO 83 HA PRO 83 -6.225 -5.625 2.342 504 HB2 PRO 83 2HB PRO 83 -6.745 -8.312 3.431 505 HB3 PRO 83 1HB PRO 83 -6.320 -7.832 1.789 506 HG2 PRO 83 2HG PRO 83 -4.578 -9.105 3.390 507 HG3 PRO 83 1HG PRO 83 -4.058 -7.884 2.213 508 HD2 PRO 83 2HD PRO 83 -4.394 -7.640 5.176 509 HD3 PRO 83 1HD PRO 83 -3.153 -6.946 4.118 510 H ILE 84 H ILE 84 -8.324 -5.140 2.426 511 HA ILE 84 HA ILE 84 -9.574 -4.795 4.999 512 HB ILE 84 HB ILE 84 -10.529 -4.220 2.200 513 HG12 ILE 84 1HG1 ILE 84 -8.686 -2.811 2.915 514 HG13 ILE 84 2HG1 ILE 84 -10.170 -1.871 2.840 515 HG21 ILE 84 1HG2 ILE 84 -11.865 -3.443 4.779 516 HG22 ILE 84 2HG2 ILE 84 -12.456 -4.652 3.638 517 HG23 ILE 84 3HG2 ILE 84 -12.366 -2.955 3.160 518 HD11 ILE 84 1HD1 ILE 84 -8.940 -1.259 4.796 519 HD12 ILE 84 2HD1 ILE 84 -8.838 -2.943 5.307 520 HD13 ILE 84 3HD1 ILE 84 -10.398 -2.123 5.284 521 H ASN 85 H ASN 85 -11.581 -5.659 5.600 522 HA ASN 85 HA ASN 85 -11.881 -8.448 4.979 523 HB2 ASN 85 1HB ASN 85 -12.188 -7.553 7.270 524 HB3 ASN 85 2HB ASN 85 -13.572 -6.621 6.713 525 HD21 ASN 85 1HD2 ASN 85 -13.915 -10.558 7.583 526 HD22 ASN 85 2HD2 ASN 85 -12.381 -9.761 7.552 527 H VAL 86 H VAL 86 -12.396 -8.348 2.773 528 HA VAL 86 HA VAL 86 -15.181 -7.635 2.214 529 HB VAL 86 HB VAL 86 -14.395 -7.154 -0.174 530 HG11 VAL 86 1HG1 VAL 86 -13.767 -4.841 0.352 531 HG12 VAL 86 2HG1 VAL 86 -13.522 -5.300 2.036 532 HG13 VAL 86 3HG1 VAL 86 -15.132 -5.387 1.326 533 HG21 VAL 86 1HG2 VAL 86 -12.148 -8.171 0.142 534 HG22 VAL 86 2HG2 VAL 86 -11.728 -6.815 1.189 535 HG23 VAL 86 3HG2 VAL 86 -12.103 -6.538 -0.511 536 H ASN 87 H ASN 87 -15.836 -9.734 2.496 537 HA ASN 87 HA ASN 87 -16.156 -11.957 2.105 538 HB2 ASN 87 1HB ASN 87 -14.791 -11.403 -0.549 539 HB3 ASN 87 2HB ASN 87 -15.670 -12.870 -0.143 540 HD21 ASN 87 1HD2 ASN 87 -18.829 -11.529 -0.750 541 HD22 ASN 87 2HD2 ASN 87 -17.913 -12.829 -0.067 542 H LEU 88 H LEU 88 -14.008 -11.106 3.591 543 HA LEU 88 HA LEU 88 -11.468 -11.914 2.763 544 HB2 LEU 88 1HB LEU 88 -11.970 -10.369 4.650 545 HB3 LEU 88 2HB LEU 88 -12.472 -11.754 5.598 546 HG LEU 88 HG LEU 88 -10.178 -12.692 5.370 547 HD11 LEU 88 1HD1 LEU 88 -9.493 -11.589 3.327 548 HD12 LEU 88 2HD1 LEU 88 -8.379 -11.185 4.633 549 HD13 LEU 88 3HD1 LEU 88 -9.591 -10.014 4.116 550 HD21 LEU 88 1HD2 LEU 88 -10.825 -11.452 7.359 551 HD22 LEU 88 2HD2 LEU 88 -10.359 -9.939 6.582 552 HD23 LEU 88 3HD2 LEU 88 -9.135 -11.152 6.955 Start of MODEL 6 1 H1 GLY 1 1H GLY 1 -13.187 11.811 6.014 2 H2 GLY 1 2H GLY 1 -11.983 12.224 7.130 3 H3 GLY 1 3H GLY 1 -13.611 12.308 7.574 4 HA2 GLY 1 1HA GLY 1 -12.560 10.357 8.519 5 HA3 GLY 1 2HA GLY 1 -13.842 9.934 7.394 6 H SER 2 H SER 2 -13.222 8.079 6.510 7 HA SER 2 HA SER 2 -10.552 7.969 5.276 8 HB2 SER 2 1HB SER 2 -12.007 5.775 6.769 9 HB3 SER 2 2HB SER 2 -10.534 5.526 5.835 10 HG SER 2 HG SER 2 -9.553 6.053 7.606 11 H GLY 3 H GLY 3 -13.354 8.564 4.287 12 HA2 GLY 3 1HA GLY 3 -14.378 8.211 2.226 13 HA3 GLY 3 2HA GLY 3 -13.256 6.888 1.928 14 H SER 4 H SER 4 -13.597 5.102 3.736 15 HA SER 4 HA SER 4 -16.479 4.547 3.919 16 HB2 SER 4 1HB SER 4 -15.189 2.998 2.415 17 HB3 SER 4 2HB SER 4 -14.237 2.515 3.816 18 HG SER 4 HG SER 4 -17.035 2.182 3.441 19 H SER 5 H SER 5 -16.398 2.487 5.756 20 HA SER 5 HA SER 5 -15.749 3.926 8.179 21 HB2 SER 5 1HB SER 5 -16.959 1.183 7.771 22 HB3 SER 5 2HB SER 5 -16.860 2.044 9.306 23 HG SER 5 HG SER 5 -18.889 2.379 8.387 24 H GLN 6 H GLN 6 -14.156 1.800 6.145 25 HA GLN 6 HA GLN 6 -12.650 0.428 8.177 26 HB2 GLN 6 1HB GLN 6 -12.351 0.427 5.194 27 HB3 GLN 6 2HB GLN 6 -11.456 -0.613 6.283 28 HG2 GLN 6 1HG GLN 6 -14.439 -0.603 5.902 29 HG3 GLN 6 2HG GLN 6 -13.306 -1.780 5.240 30 HE21 GLN 6 1HE2 GLN 6 -12.954 -3.591 8.209 31 HE22 GLN 6 2HE2 GLN 6 -12.342 -3.280 6.623 32 H CYS 7 H CYS 7 -10.277 0.386 8.049 33 HA CYS 7 HA CYS 7 -8.211 1.237 8.032 34 HB2 CYS 7 2HB CYS 7 -9.275 3.326 6.173 35 HB3 CYS 7 1HB CYS 7 -7.604 2.777 6.334 36 H ASN 8 H ASN 8 -7.494 2.116 9.818 37 HA ASN 8 HA ASN 8 -8.930 4.351 11.006 38 HB2 ASN 8 1HB ASN 8 -6.697 2.631 12.105 39 HB3 ASN 8 2HB ASN 8 -7.546 3.881 13.007 40 HD21 ASN 8 1HD2 ASN 8 -8.956 0.422 13.567 41 HD22 ASN 8 2HD2 ASN 8 -7.334 1.021 13.528 42 H ALA 9 H ALA 9 -5.640 3.570 9.938 43 HA ALA 9 HA ALA 9 -4.586 6.081 10.831 44 HB1 ALA 9 1HB ALA 9 -2.482 5.329 9.898 45 HB2 ALA 9 2HB ALA 9 -3.302 4.008 9.069 46 HB3 ALA 9 3HB ALA 9 -3.234 4.034 10.829 47 H GLY 10 H GLY 10 -6.226 5.110 8.063 48 HA2 GLY 10 1HA GLY 10 -5.926 7.681 6.856 49 HA3 GLY 10 2HA GLY 10 -5.040 6.446 5.974 50 HA PRO 11 HA PRO 11 -9.435 6.355 4.506 51 HB2 PRO 11 2HB PRO 11 -9.050 7.041 1.953 52 HB3 PRO 11 1HB PRO 11 -9.133 8.269 3.224 53 HG2 PRO 11 2HG PRO 11 -6.735 7.075 1.898 54 HG3 PRO 11 1HG PRO 11 -7.066 8.777 2.273 55 HD2 PRO 11 2HD PRO 11 -5.489 7.157 3.822 56 HD3 PRO 11 1HD PRO 11 -6.389 8.547 4.457 57 H VAL 12 H VAL 12 -10.364 4.895 2.973 58 HA VAL 12 HA VAL 12 -9.058 2.389 2.883 59 HB VAL 12 HB VAL 12 -10.998 1.735 1.365 60 HG11 VAL 12 1HG1 VAL 12 -12.592 1.715 3.183 61 HG12 VAL 12 2HG1 VAL 12 -11.713 3.001 4.009 62 HG13 VAL 12 3HG1 VAL 12 -10.974 1.410 3.812 63 HG21 VAL 12 1HG2 VAL 12 -11.443 3.973 0.452 64 HG22 VAL 12 2HG2 VAL 12 -11.933 4.523 2.055 65 HG23 VAL 12 3HG2 VAL 12 -12.873 3.286 1.224 66 H GLN 13 H GLN 13 -7.834 1.451 1.353 67 HA GLN 13 HA GLN 13 -7.397 3.018 -1.106 68 HB2 GLN 13 1HB GLN 13 -5.432 1.177 0.266 69 HB3 GLN 13 2HB GLN 13 -5.137 2.119 -1.179 70 HG2 GLN 13 1HG GLN 13 -5.763 3.261 1.525 71 HG3 GLN 13 2HG GLN 13 -4.156 3.118 0.819 72 HE21 GLN 13 1HE2 GLN 13 -5.767 6.504 0.278 73 HE22 GLN 13 2HE2 GLN 13 -5.719 5.468 1.660 74 H CYS 14 H CYS 14 -7.382 2.052 -3.031 75 HA CYS 14 HA CYS 14 -7.910 -0.838 -3.126 76 HB2 CYS 14 2HB CYS 14 -9.786 0.485 -3.993 77 HB3 CYS 14 1HB CYS 14 -8.713 1.303 -5.119 78 H CYS 15 H CYS 15 -6.062 -1.788 -3.480 79 HA CYS 15 HA CYS 15 -4.041 -0.463 -5.143 80 HB2 CYS 15 2HB CYS 15 -3.652 -2.693 -3.144 81 HB3 CYS 15 1HB CYS 15 -2.409 -1.668 -3.863 82 H ASN 16 H ASN 16 -3.074 -1.483 -6.796 83 HA ASN 16 HA ASN 16 -4.476 -3.469 -8.211 84 HB2 ASN 16 1HB ASN 16 -2.825 -1.729 -9.103 85 HB3 ASN 16 2HB ASN 16 -1.573 -2.840 -8.581 86 HD21 ASN 16 1HD2 ASN 16 -1.722 -4.158 -11.798 87 HD22 ASN 16 2HD2 ASN 16 -0.836 -3.202 -10.663 88 H THR 17 H THR 17 -1.721 -3.573 -6.067 89 HA THR 17 HA THR 17 -2.038 -6.459 -5.819 90 HB THR 17 HB THR 17 0.598 -5.160 -6.564 91 HG1 THR 17 1HG THR 17 -1.309 -6.017 -8.100 92 HG21 THR 17 1HG2 THR 17 -0.043 -8.000 -5.769 93 HG22 THR 17 2HG2 THR 17 1.058 -6.879 -4.959 94 HG23 THR 17 3HG2 THR 17 1.453 -7.507 -6.560 95 H LEU 18 H LEU 18 -2.023 -6.973 -3.720 96 HA LEU 18 HA LEU 18 -0.593 -5.204 -1.857 97 HB2 LEU 18 1HB LEU 18 -2.685 -7.330 -1.397 98 HB3 LEU 18 2HB LEU 18 -1.795 -6.564 -0.096 99 HG LEU 18 HG LEU 18 -3.620 -5.169 -2.040 100 HD11 LEU 18 1HD1 LEU 18 -5.105 -4.883 -0.173 101 HD12 LEU 18 2HD1 LEU 18 -3.947 -5.649 0.915 102 HD13 LEU 18 3HD1 LEU 18 -4.738 -6.600 -0.343 103 HD21 LEU 18 1HD2 LEU 18 -3.280 -3.206 -0.606 104 HD22 LEU 18 2HD2 LEU 18 -1.791 -3.725 -1.387 105 HD23 LEU 18 3HD2 LEU 18 -2.070 -4.101 0.312 106 H THR 19 H THR 19 1.394 -5.783 -1.526 107 HA THR 19 HA THR 19 2.050 -8.573 -1.057 108 HB THR 19 HB THR 19 2.410 -8.412 -3.433 109 HG1 THR 19 1HG THR 19 4.075 -9.604 -2.923 110 HG21 THR 19 1HG2 THR 19 2.584 -6.073 -3.828 111 HG22 THR 19 2HG2 THR 19 4.103 -6.794 -4.362 112 HG23 THR 19 3HG2 THR 19 4.025 -5.944 -2.818 113 H SER 20 H SER 20 4.754 -8.406 -0.845 114 HA SER 20 HA SER 20 4.997 -6.749 1.545 115 HB2 SER 20 1HB SER 20 6.923 -8.816 0.462 116 HB3 SER 20 2HB SER 20 6.889 -8.142 2.091 117 HG SER 20 HG SER 20 4.522 -9.295 1.279 118 H ALA 21 H ALA 21 6.998 -5.570 1.926 119 HA ALA 21 HA ALA 21 7.640 -3.829 -0.210 120 HB1 ALA 21 1HB ALA 21 9.059 -4.193 2.427 121 HB2 ALA 21 2HB ALA 21 7.657 -3.159 2.151 122 HB3 ALA 21 3HB ALA 21 9.188 -2.801 1.351 123 H SER 22 H SER 22 8.716 -6.907 0.437 124 HA SER 22 HA SER 22 11.395 -6.594 -0.578 125 HB2 SER 22 1HB SER 22 10.583 -8.343 1.123 126 HB3 SER 22 2HB SER 22 9.921 -9.191 -0.259 127 HG SER 22 HG SER 22 12.092 -9.107 -1.157 128 H ASN 23 H ASN 23 8.345 -6.665 -1.920 129 HA ASN 23 HA ASN 23 8.937 -8.130 -4.323 130 HB2 ASN 23 1HB ASN 23 6.604 -7.678 -3.315 131 HB3 ASN 23 2HB ASN 23 6.742 -6.072 -4.022 132 HD21 ASN 23 1HD2 ASN 23 5.906 -9.289 -6.312 133 HD22 ASN 23 2HD2 ASN 23 6.269 -9.430 -4.627 134 H SER 24 H SER 24 9.614 -7.337 -6.271 135 HA SER 24 HA SER 24 11.163 -4.978 -6.246 136 HB2 SER 24 1HB SER 24 10.256 -6.678 -8.575 137 HB3 SER 24 2HB SER 24 11.527 -5.459 -8.638 138 HG SER 24 HG SER 24 12.629 -6.692 -7.011 139 H GLN 25 H GLN 25 7.838 -5.558 -7.002 140 HA GLN 25 HA GLN 25 7.385 -3.210 -8.534 141 HB2 GLN 25 1HB GLN 25 5.813 -5.162 -8.390 142 HB3 GLN 25 2HB GLN 25 5.442 -4.679 -6.733 143 HG2 GLN 25 1HG GLN 25 3.725 -3.872 -8.145 144 HG3 GLN 25 2HG GLN 25 4.690 -2.509 -7.586 145 HE21 GLN 25 1HE2 GLN 25 5.782 -1.544 -10.751 146 HE22 GLN 25 2HE2 GLN 25 5.968 -1.378 -9.041 147 H ALA 26 H ALA 26 7.109 -4.043 -5.117 148 HA ALA 26 HA ALA 26 6.186 -1.480 -4.282 149 HB1 ALA 26 1HB ALA 26 6.632 -2.328 -2.022 150 HB2 ALA 26 2HB ALA 26 7.439 -3.733 -2.717 151 HB3 ALA 26 3HB ALA 26 5.716 -3.482 -2.992 152 H ALA 27 H ALA 27 9.332 -3.139 -3.954 153 HA ALA 27 HA ALA 27 10.631 -1.008 -2.664 154 HB1 ALA 27 1HB ALA 27 12.711 -2.151 -3.242 155 HB2 ALA 27 2HB ALA 27 11.840 -3.173 -4.387 156 HB3 ALA 27 3HB ALA 27 11.500 -3.293 -2.660 157 H GLY 28 H GLY 28 10.123 -1.684 -6.081 158 HA2 GLY 28 1HA GLY 28 11.836 0.252 -7.160 159 HA3 GLY 28 2HA GLY 28 10.332 -0.288 -7.898 160 H LEU 29 H LEU 29 8.535 0.493 -5.973 161 HA LEU 29 HA LEU 29 8.228 3.291 -6.455 162 HB2 LEU 29 1HB LEU 29 6.816 1.443 -4.574 163 HB3 LEU 29 2HB LEU 29 6.276 3.045 -4.980 164 HG LEU 29 HG LEU 29 6.475 0.740 -6.916 165 HD11 LEU 29 1HD1 LEU 29 4.124 2.015 -5.537 166 HD12 LEU 29 2HD1 LEU 29 4.687 0.350 -5.377 167 HD13 LEU 29 3HD1 LEU 29 3.994 0.905 -6.901 168 HD21 LEU 29 1HD2 LEU 29 5.185 2.267 -8.403 169 HD22 LEU 29 2HD2 LEU 29 6.831 2.809 -8.075 170 HD23 LEU 29 3HD2 LEU 29 5.471 3.572 -7.241 171 H ILE 30 H ILE 30 8.790 1.353 -3.534 172 HA ILE 30 HA ILE 30 8.972 3.289 -1.595 173 HB ILE 30 HB ILE 30 10.603 0.770 -1.871 174 HG12 ILE 30 1HG1 ILE 30 8.084 1.353 -0.313 175 HG13 ILE 30 2HG1 ILE 30 8.123 0.529 -1.864 176 HG21 ILE 30 1HG2 ILE 30 11.183 0.921 0.403 177 HG22 ILE 30 2HG2 ILE 30 10.036 2.222 0.692 178 HG23 ILE 30 3HG2 ILE 30 11.495 2.532 -0.252 179 HD11 ILE 30 1HD1 ILE 30 7.888 -1.011 0.007 180 HD12 ILE 30 2HD1 ILE 30 9.428 -0.449 0.661 181 HD13 ILE 30 3HD1 ILE 30 9.380 -1.287 -0.891 182 H GLN 31 H GLN 31 11.568 2.085 -3.674 183 HA GLN 31 HA GLN 31 13.490 3.806 -2.557 184 HB2 GLN 31 1HB GLN 31 13.445 2.033 -4.965 185 HB3 GLN 31 2HB GLN 31 14.829 3.075 -4.633 186 HG2 GLN 31 1HG GLN 31 14.875 1.967 -2.343 187 HG3 GLN 31 2HG GLN 31 13.755 0.792 -3.028 188 HE21 GLN 31 1HE2 GLN 31 16.150 -0.873 -4.938 189 HE22 GLN 31 2HE2 GLN 31 14.469 -0.618 -4.624 190 H GLN 32 H GLN 32 11.081 4.263 -4.981 191 HA GLN 32 HA GLN 32 12.404 6.503 -6.236 192 HB2 GLN 32 1HB GLN 32 9.542 5.556 -6.253 193 HB3 GLN 32 2HB GLN 32 10.041 7.041 -7.044 194 HG2 GLN 32 1HG GLN 32 11.111 4.304 -7.662 195 HG3 GLN 32 2HG GLN 32 9.849 5.145 -8.559 196 HE21 GLN 32 1HE2 GLN 32 12.029 7.222 -10.318 197 HE22 GLN 32 2HE2 GLN 32 10.397 6.882 -9.865 198 H LEU 33 H LEU 33 10.224 5.980 -3.588 199 HA LEU 33 HA LEU 33 9.664 8.791 -3.214 200 HB2 LEU 33 1HB LEU 33 9.053 6.647 -1.222 201 HB3 LEU 33 2HB LEU 33 8.151 8.106 -1.570 202 HG LEU 33 HG LEU 33 8.338 5.768 -3.465 203 HD11 LEU 33 1HD1 LEU 33 7.249 5.176 -1.314 204 HD12 LEU 33 2HD1 LEU 33 6.203 5.065 -2.726 205 HD13 LEU 33 3HD1 LEU 33 6.057 6.440 -1.629 206 HD21 LEU 33 1HD2 LEU 33 6.142 6.908 -4.231 207 HD22 LEU 33 2HD2 LEU 33 7.700 7.548 -4.762 208 HD23 LEU 33 3HD2 LEU 33 6.824 8.338 -3.446 209 H GLY 34 H GLY 34 11.903 6.442 -2.138 210 HA2 GLY 34 1HA GLY 34 13.790 6.648 -0.834 211 HA3 GLY 34 2HA GLY 34 13.375 8.336 -0.556 212 H LEU 35 H LEU 35 11.543 5.391 0.078 213 HA LEU 35 HA LEU 35 10.846 6.377 2.693 214 HB2 LEU 35 1HB LEU 35 10.041 4.027 1.054 215 HB3 LEU 35 2HB LEU 35 9.559 4.151 2.726 216 HG LEU 35 HG LEU 35 8.851 6.046 0.503 217 HD11 LEU 35 1HD1 LEU 35 6.578 5.273 0.924 218 HD12 LEU 35 2HD1 LEU 35 7.192 4.142 2.131 219 HD13 LEU 35 3HD1 LEU 35 7.640 3.954 0.435 220 HD21 LEU 35 1HD2 LEU 35 7.418 7.139 2.211 221 HD22 LEU 35 2HD2 LEU 35 9.143 7.333 2.512 222 HD23 LEU 35 3HD2 LEU 35 8.212 6.160 3.445 223 H SER 36 H SER 36 12.375 6.195 4.192 224 HA SER 36 HA SER 36 13.898 3.752 4.477 225 HB2 SER 36 1HB SER 36 13.884 6.289 6.127 226 HB3 SER 36 2HB SER 36 15.075 5.000 6.200 227 HG SER 36 HG SER 36 15.246 5.522 3.793 228 H GLY 37 H GLY 37 13.736 2.378 6.272 229 HA2 GLY 37 1HA GLY 37 12.881 1.873 8.472 230 HA3 GLY 37 2HA GLY 37 11.499 2.900 8.121 231 H VAL 38 H VAL 38 11.188 1.800 5.428 232 HA VAL 38 HA VAL 38 9.548 -0.474 6.062 233 HB VAL 38 HB VAL 38 10.317 0.514 3.311 234 HG11 VAL 38 1HG1 VAL 38 8.123 -0.441 2.698 235 HG12 VAL 38 2HG1 VAL 38 7.953 -1.040 4.348 236 HG13 VAL 38 3HG1 VAL 38 9.249 -1.646 3.321 237 HG21 VAL 38 1HG2 VAL 38 8.058 1.461 5.073 238 HG22 VAL 38 2HG2 VAL 38 8.284 1.892 3.377 239 HG23 VAL 38 3HG2 VAL 38 9.467 2.402 4.583 240 H GLY 39 H GLY 39 10.289 -2.486 6.215 241 HA2 GLY 39 1HA GLY 39 12.909 -3.178 5.165 242 HA3 GLY 39 2HA GLY 39 11.942 -4.142 6.259 243 H ALA 40 H ALA 40 11.692 -6.018 5.310 244 HA ALA 40 HA ALA 40 10.972 -6.071 2.459 245 HB1 ALA 40 1HB ALA 40 12.222 -8.227 4.154 246 HB2 ALA 40 2HB ALA 40 13.042 -7.240 2.946 247 HB3 ALA 40 3HB ALA 40 11.801 -8.390 2.451 248 H ASN 41 H ASN 41 10.186 -7.512 5.601 249 HA ASN 41 HA ASN 41 8.006 -9.065 4.569 250 HB2 ASN 41 1HB ASN 41 9.314 -9.696 6.594 251 HB3 ASN 41 2HB ASN 41 8.627 -8.314 7.437 252 HD21 ASN 41 1HD2 ASN 41 5.845 -11.092 6.362 253 HD22 ASN 41 2HD2 ASN 41 6.945 -10.448 5.196 254 H VAL 42 H VAL 42 8.435 -5.849 5.466 255 HA VAL 42 HA VAL 42 6.038 -5.042 6.571 256 HB VAL 42 HB VAL 42 7.755 -3.510 4.620 257 HG11 VAL 42 1HG1 VAL 42 6.889 -1.519 5.864 258 HG12 VAL 42 2HG1 VAL 42 5.690 -2.581 6.611 259 HG13 VAL 42 3HG1 VAL 42 5.683 -2.340 4.863 260 HG21 VAL 42 1HG2 VAL 42 7.874 -3.897 7.584 261 HG22 VAL 42 2HG2 VAL 42 8.676 -2.557 6.762 262 HG23 VAL 42 3HG2 VAL 42 9.128 -4.223 6.382 263 HA PRO 43 HA PRO 43 3.183 -5.755 3.258 264 HB2 PRO 43 2HB PRO 43 1.150 -4.281 4.496 265 HB3 PRO 43 1HB PRO 43 1.410 -6.008 4.632 266 HG2 PRO 43 2HG PRO 43 1.775 -3.996 6.618 267 HG3 PRO 43 1HG PRO 43 1.966 -5.746 6.785 268 HD2 PRO 43 2HD PRO 43 3.986 -3.703 6.599 269 HD3 PRO 43 1HD PRO 43 4.193 -5.425 6.930 270 H VAL 44 H VAL 44 2.649 -4.589 1.453 271 HA VAL 44 HA VAL 44 2.446 -1.680 1.709 272 HB VAL 44 HB VAL 44 3.843 -1.311 -0.277 273 HG11 VAL 44 1HG1 VAL 44 5.213 -2.775 1.973 274 HG12 VAL 44 2HG1 VAL 44 4.908 -1.040 1.861 275 HG13 VAL 44 3HG1 VAL 44 6.046 -1.808 0.752 276 HG21 VAL 44 1HG2 VAL 44 5.363 -3.230 -0.937 277 HG22 VAL 44 2HG2 VAL 44 3.690 -3.311 -1.481 278 HG23 VAL 44 3HG2 VAL 44 4.220 -4.276 -0.100 279 H GLY 45 H GLY 45 1.554 -0.689 -0.266 280 HA2 GLY 45 1HA GLY 45 -0.147 -2.610 -1.718 281 HA3 GLY 45 2HA GLY 45 -0.688 -1.002 -1.276 282 H ILE 46 H ILE 46 0.049 -2.688 -3.799 283 HA ILE 46 HA ILE 46 1.846 -0.855 -5.162 284 HB ILE 46 HB ILE 46 0.587 -3.499 -5.873 285 HG12 ILE 46 1HG1 ILE 46 2.788 -4.396 -5.895 286 HG13 ILE 46 2HG1 ILE 46 3.514 -2.816 -5.968 287 HG21 ILE 46 1HG2 ILE 46 2.208 -1.750 -7.710 288 HG22 ILE 46 2HG2 ILE 46 0.495 -2.134 -7.872 289 HG23 ILE 46 3HG2 ILE 46 1.705 -3.407 -8.046 290 HD11 ILE 46 1HD1 ILE 46 2.960 -2.406 -3.667 291 HD12 ILE 46 2HD1 ILE 46 3.868 -3.909 -3.845 292 HD13 ILE 46 3HD1 ILE 46 2.123 -3.958 -3.583 293 H ASN 47 H ASN 47 0.982 0.886 -6.092 294 HA ASN 47 HA ASN 47 -0.385 2.275 -7.259 295 HB2 ASN 47 1HB ASN 47 -0.233 0.108 -8.811 296 HB3 ASN 47 2HB ASN 47 -1.943 0.016 -8.422 297 HD21 ASN 47 1HD2 ASN 47 -1.299 2.058 -11.513 298 HD22 ASN 47 2HD2 ASN 47 -0.735 0.509 -10.984 299 H CYS 48 H CYS 48 -1.228 2.542 -4.952 300 HA CYS 48 HA CYS 48 -3.925 1.511 -4.589 301 HB2 CYS 48 2HB CYS 48 -2.167 3.119 -2.739 302 HB3 CYS 48 1HB CYS 48 -3.734 2.461 -2.338 303 H ASN 49 H ASN 49 -5.698 2.682 -4.859 304 HA ASN 49 HA ASN 49 -5.459 5.595 -4.654 305 HB2 ASN 49 1HB ASN 49 -7.276 5.836 -6.325 306 HB3 ASN 49 2HB ASN 49 -5.825 5.115 -7.000 307 HD21 ASN 49 1HD2 ASN 49 -7.358 2.113 -7.880 308 HD22 ASN 49 2HD2 ASN 49 -5.886 3.012 -7.730 309 HA PRO 50 HA PRO 50 -8.337 5.276 -1.449 310 HB2 PRO 50 2HB PRO 50 -9.448 7.893 -2.146 311 HB3 PRO 50 1HB PRO 50 -8.459 7.437 -0.756 312 HG2 PRO 50 2HG PRO 50 -7.515 9.002 -2.746 313 HG3 PRO 50 1HG PRO 50 -6.482 7.876 -1.850 314 HD2 PRO 50 2HD PRO 50 -7.738 7.554 -4.551 315 HD3 PRO 50 1HD PRO 50 -6.095 7.144 -4.027 316 H ILE 51 H ILE 51 -10.156 4.151 -1.373 317 HA ILE 51 HA ILE 51 -11.954 4.117 -3.626 318 HB ILE 51 HB ILE 51 -12.613 2.808 -1.023 319 HG12 ILE 51 1HG1 ILE 51 -10.542 1.833 -2.997 320 HG13 ILE 51 2HG1 ILE 51 -10.229 2.339 -1.345 321 HG21 ILE 51 1HG2 ILE 51 -12.885 1.930 -3.897 322 HG22 ILE 51 2HG2 ILE 51 -14.159 2.680 -2.931 323 HG23 ILE 51 3HG2 ILE 51 -13.532 1.093 -2.483 324 HD11 ILE 51 1HD1 ILE 51 -11.890 -0.021 -2.173 325 HD12 ILE 51 2HD1 ILE 51 -11.555 0.481 -0.515 326 HD13 ILE 51 3HD1 ILE 51 -10.241 -0.079 -1.550 327 H THR 52 H THR 52 -12.724 6.275 -3.585 328 HA THR 52 HA THR 52 -14.577 6.809 -1.367 329 HB THR 52 HB THR 52 -14.232 9.236 -1.889 330 HG1 THR 52 1HG THR 52 -12.617 9.827 -3.279 331 HG21 THR 52 1HG2 THR 52 -11.766 7.663 -1.124 332 HG22 THR 52 2HG2 THR 52 -13.053 8.172 -0.031 333 HG23 THR 52 3HG2 THR 52 -12.026 9.379 -0.806 334 H GLY 53 H GLY 53 -14.622 5.660 -4.300 335 HA2 GLY 53 1HA GLY 53 -16.566 7.346 -5.588 336 HA3 GLY 53 2HA GLY 53 -16.030 5.763 -6.131 337 H ILE 54 H ILE 54 -18.123 7.432 -3.856 338 HA ILE 54 HA ILE 54 -19.502 4.983 -3.161 339 HB ILE 54 HB ILE 54 -20.124 7.843 -2.403 340 HG12 ILE 54 1HG1 ILE 54 -18.809 5.639 -0.795 341 HG13 ILE 54 2HG1 ILE 54 -17.946 6.970 -1.557 342 HG21 ILE 54 1HG2 ILE 54 -22.088 6.367 -2.345 343 HG22 ILE 54 2HG2 ILE 54 -21.606 6.891 -0.728 344 HG23 ILE 54 3HG2 ILE 54 -21.213 5.262 -1.281 345 HD11 ILE 54 1HD1 ILE 54 -18.269 7.366 0.814 346 HD12 ILE 54 2HD1 ILE 54 -20.016 7.226 0.609 347 HD13 ILE 54 3HD1 ILE 54 -19.142 8.556 -0.150 348 H GLY 55 H GLY 55 -20.553 4.220 -4.906 349 HA2 GLY 55 1HA GLY 55 -22.999 4.448 -5.575 350 HA3 GLY 55 2HA GLY 55 -22.487 6.008 -6.208 351 H ALA 56 H ALA 56 -23.020 5.488 -8.329 352 HA ALA 56 HA ALA 56 -22.671 4.749 -10.442 353 HB1 ALA 56 1HB ALA 56 -19.934 4.038 -9.395 354 HB2 ALA 56 2HB ALA 56 -20.413 5.592 -10.078 355 HB3 ALA 56 3HB ALA 56 -20.391 4.151 -11.094 356 H GLY 57 H GLY 57 -23.756 2.929 -8.419 357 HA2 GLY 57 1HA GLY 57 -24.460 0.712 -9.609 358 HA3 GLY 57 2HA GLY 57 -22.776 0.312 -9.302 359 H SER 58 H SER 58 -22.267 -0.571 -7.398 360 HA SER 58 HA SER 58 -24.386 -0.920 -5.446 361 HB2 SER 58 1HB SER 58 -22.987 -2.848 -6.114 362 HB3 SER 58 2HB SER 58 -21.565 -2.025 -5.477 363 HG SER 58 HG SER 58 -23.535 -3.406 -4.166 364 H GLY 59 H GLY 59 -21.253 0.661 -5.738 365 HA2 GLY 59 1HA GLY 59 -21.469 2.831 -4.298 366 HA3 GLY 59 2HA GLY 59 -21.468 1.656 -2.993 367 H SER 60 H SER 60 -19.546 2.508 -2.134 368 HA SER 60 HA SER 60 -17.167 2.719 -3.678 369 HB2 SER 60 1HB SER 60 -16.084 2.833 -1.365 370 HB3 SER 60 2HB SER 60 -17.294 4.066 -1.722 371 HG SER 60 HG SER 60 -18.109 1.670 -0.507 372 H SER 61 H SER 61 -15.979 1.099 -4.421 373 HA SER 61 HA SER 61 -15.491 -1.255 -2.833 374 HB2 SER 61 1HB SER 61 -16.257 -2.723 -4.834 375 HB3 SER 61 2HB SER 61 -17.487 -2.090 -3.739 376 HG SER 61 HG SER 61 -17.560 -0.265 -5.337 377 H CYS 62 H CYS 62 -13.705 -2.424 -3.529 378 HA CYS 62 HA CYS 62 -11.966 -0.947 -5.332 379 HB2 CYS 62 2HB CYS 62 -11.042 -1.593 -3.179 380 HB3 CYS 62 1HB CYS 62 -11.424 -3.285 -3.484 381 H ASN 63 H ASN 63 -11.029 -1.766 -7.147 382 HA ASN 63 HA ASN 63 -12.474 -3.890 -8.481 383 HB2 ASN 63 1HB ASN 63 -11.957 -1.844 -9.710 384 HB3 ASN 63 2HB ASN 63 -10.237 -2.078 -9.416 385 HD21 ASN 63 1HD2 ASN 63 -9.760 -4.232 -12.089 386 HD22 ASN 63 2HD2 ASN 63 -9.089 -3.431 -10.711 387 H ALA 64 H ALA 64 -9.485 -3.486 -6.810 388 HA ALA 64 HA ALA 64 -8.660 -6.163 -7.704 389 HB1 ALA 64 1HB ALA 64 -6.826 -3.851 -7.082 390 HB2 ALA 64 2HB ALA 64 -7.199 -4.478 -8.690 391 HB3 ALA 64 3HB ALA 64 -6.325 -5.482 -7.531 392 H ASN 65 H ASN 65 -7.014 -4.201 -5.292 393 HA ASN 65 HA ASN 65 -7.944 -6.085 -3.223 394 HB2 ASN 65 1HB ASN 65 -5.156 -4.988 -3.477 395 HB3 ASN 65 2HB ASN 65 -5.714 -6.117 -2.263 396 HD21 ASN 65 1HD2 ASN 65 -4.647 -7.363 -5.960 397 HD22 ASN 65 2HD2 ASN 65 -4.789 -5.685 -5.567 398 HA PRO 66 HA PRO 66 -8.640 -2.160 -1.165 399 HB2 PRO 66 2HB PRO 66 -10.316 -3.141 0.697 400 HB3 PRO 66 1HB PRO 66 -10.829 -2.853 -0.967 401 HG2 PRO 66 2HG PRO 66 -10.144 -5.413 0.380 402 HG3 PRO 66 1HG PRO 66 -11.375 -5.086 -0.850 403 HD2 PRO 66 2HD PRO 66 -8.860 -6.210 -1.318 404 HD3 PRO 66 1HD PRO 66 -9.902 -5.475 -2.548 405 H ALA 67 H ALA 67 -7.516 -1.286 0.514 406 HA ALA 67 HA ALA 67 -6.434 -3.032 2.588 407 HB1 ALA 67 1HB ALA 67 -4.806 -3.128 0.749 408 HB2 ALA 67 2HB ALA 67 -4.144 -2.366 2.194 409 HB3 ALA 67 3HB ALA 67 -4.642 -1.374 0.823 410 H CYS 68 H CYS 68 -5.693 -1.968 4.417 411 HA CYS 68 HA CYS 68 -6.028 0.958 4.454 412 HB2 CYS 68 2HB CYS 68 -6.133 -0.892 6.839 413 HB3 CYS 68 1HB CYS 68 -6.486 0.822 6.815 414 H CYS 69 H CYS 69 -4.247 2.130 4.860 415 HA CYS 69 HA CYS 69 -1.815 0.591 5.474 416 HB2 CYS 69 2HB CYS 69 -2.466 1.982 3.138 417 HB3 CYS 69 1HB CYS 69 -1.285 2.984 3.959 418 H ASP 70 H ASP 70 -0.044 1.814 6.356 419 HA ASP 70 HA ASP 70 -0.792 3.678 8.400 420 HB2 ASP 70 1HB ASP 70 1.094 2.117 8.680 421 HB3 ASP 70 2HB ASP 70 1.938 2.878 7.336 422 H ASN 71 H ASN 71 0.842 3.774 5.318 423 HA ASN 71 HA ASN 71 0.206 6.599 4.959 424 HB2 ASN 71 1HB ASN 71 3.008 5.465 4.880 425 HB3 ASN 71 2HB ASN 71 2.574 6.950 4.049 426 HD21 ASN 71 1HD2 ASN 71 4.004 7.480 7.500 427 HD22 ASN 71 2HD2 ASN 71 4.462 6.419 6.211 428 H VAL 72 H VAL 72 -0.221 7.031 2.774 429 HA VAL 72 HA VAL 72 1.016 5.206 0.862 430 HB VAL 72 HB VAL 72 -0.853 4.501 -0.079 431 HG11 VAL 72 1HG1 VAL 72 -1.687 4.260 2.127 432 HG12 VAL 72 2HG1 VAL 72 -3.013 4.781 1.087 433 HG13 VAL 72 3HG1 VAL 72 -2.232 5.939 2.164 434 HG21 VAL 72 1HG2 VAL 72 -0.956 6.600 -1.337 435 HG22 VAL 72 2HG2 VAL 72 -1.987 7.286 -0.076 436 HG23 VAL 72 3HG2 VAL 72 -2.555 5.913 -1.029 437 H TYR 73 H TYR 73 1.334 6.130 -1.249 438 HA TYR 73 HA TYR 73 1.644 9.056 -1.112 439 HB2 TYR 73 2HB TYR 73 3.649 7.006 -2.066 440 HB3 TYR 73 1HB TYR 73 3.888 8.752 -2.104 441 HD1 TYR 73 1HD TYR 73 4.373 9.983 -0.070 442 HD2 TYR 73 2HD TYR 73 3.698 5.782 0.057 443 HE1 TYR 73 1HE TYR 73 5.231 9.916 2.233 444 HE2 TYR 73 2HE TYR 73 4.557 5.702 2.363 445 HH TYR 73 HH TYR 73 5.908 6.947 3.862 446 H THR 74 H THR 74 1.950 10.042 -3.254 447 HA THR 74 HA THR 74 -0.232 9.267 -4.877 448 HB THR 74 HB THR 74 1.860 11.232 -5.758 449 HG1 THR 74 1HG THR 74 -0.133 11.594 -3.740 450 HG21 THR 74 1HG2 THR 74 -0.032 10.805 -7.254 451 HG22 THR 74 2HG2 THR 74 -0.102 12.441 -6.604 452 HG23 THR 74 3HG2 THR 74 -1.156 11.188 -5.950 453 H ASN 75 H ASN 75 3.124 8.500 -5.014 454 HA ASN 75 HA ASN 75 3.349 7.655 -7.698 455 HB2 ASN 75 1HB ASN 75 5.250 7.817 -6.087 456 HB3 ASN 75 2HB ASN 75 4.608 6.443 -5.224 457 HD21 ASN 75 1HD2 ASN 75 7.032 4.791 -6.969 458 HD22 ASN 75 2HD2 ASN 75 6.601 5.539 -5.494 459 H GLY 76 H GLY 76 1.555 6.522 -5.059 460 HA2 GLY 76 1HA GLY 76 -0.258 5.038 -5.326 461 HA3 GLY 76 2HA GLY 76 0.620 4.231 -6.622 462 H LEU 77 H LEU 77 2.551 4.966 -3.911 463 HA LEU 77 HA LEU 77 2.616 2.105 -3.280 464 HB2 LEU 77 1HB LEU 77 4.686 3.270 -3.980 465 HB3 LEU 77 2HB LEU 77 4.532 4.326 -2.603 466 HG LEU 77 HG LEU 77 6.238 2.426 -2.468 467 HD11 LEU 77 1HD1 LEU 77 5.600 3.736 -0.536 468 HD12 LEU 77 2HD1 LEU 77 5.813 2.039 -0.097 469 HD13 LEU 77 3HD1 LEU 77 4.189 2.710 -0.285 470 HD21 LEU 77 1HD2 LEU 77 3.752 0.824 -1.908 471 HD22 LEU 77 2HD2 LEU 77 5.423 0.273 -1.753 472 HD23 LEU 77 3HD2 LEU 77 4.771 0.670 -3.341 473 H GLY 78 H GLY 78 1.886 1.357 -1.393 474 HA2 GLY 78 1HA GLY 78 1.373 3.323 0.748 475 HA3 GLY 78 2HA GLY 78 0.390 1.891 0.487 476 H VAL 79 H VAL 79 1.894 2.804 2.845 477 HA VAL 79 HA VAL 79 3.801 0.570 3.170 478 HB VAL 79 HB VAL 79 3.643 3.115 4.810 479 HG11 VAL 79 1HG1 VAL 79 5.851 2.448 5.622 480 HG12 VAL 79 2HG1 VAL 79 5.756 0.972 4.662 481 HG13 VAL 79 3HG1 VAL 79 4.628 1.232 5.993 482 HG21 VAL 79 1HG2 VAL 79 4.265 3.619 2.504 483 HG22 VAL 79 2HG2 VAL 79 5.588 2.456 2.612 484 HG23 VAL 79 3HG2 VAL 79 5.591 3.900 3.629 485 H GLN 80 H GLN 80 3.159 -0.995 4.469 486 HA GLN 80 HA GLN 80 2.130 -2.188 6.077 487 HB2 GLN 80 1HB GLN 80 1.749 0.564 7.226 488 HB3 GLN 80 2HB GLN 80 1.036 -0.841 8.003 489 HG2 GLN 80 1HG GLN 80 3.938 -0.710 7.323 490 HG3 GLN 80 2HG GLN 80 3.309 -0.043 8.833 491 HE21 GLN 80 1HE2 GLN 80 4.460 -3.606 9.203 492 HE22 GLN 80 2HE2 GLN 80 5.176 -2.200 8.492 493 H CYS 81 H CYS 81 0.863 -2.051 3.842 494 HA CYS 81 HA CYS 81 -1.931 -1.308 4.264 495 HB2 CYS 81 2HB CYS 81 -0.433 -2.336 1.856 496 HB3 CYS 81 1HB CYS 81 -2.182 -2.265 1.892 497 H ASN 82 H ASN 82 -3.253 -2.706 5.218 498 HA ASN 82 HA ASN 82 -2.692 -5.567 4.883 499 HB2 ASN 82 1HB ASN 82 -4.305 -5.873 6.804 500 HB3 ASN 82 2HB ASN 82 -2.787 -5.082 7.189 501 HD21 ASN 82 1HD2 ASN 82 -4.738 -2.835 8.971 502 HD22 ASN 82 2HD2 ASN 82 -3.611 -4.145 9.013 503 HA PRO 83 HA PRO 83 -6.051 -5.993 2.096 504 HB2 PRO 83 2HB PRO 83 -6.360 -8.753 3.059 505 HB3 PRO 83 1HB PRO 83 -5.890 -8.168 1.463 506 HG2 PRO 83 2HG PRO 83 -4.129 -9.352 3.108 507 HG3 PRO 83 1HG PRO 83 -3.658 -8.034 2.018 508 HD2 PRO 83 2HD PRO 83 -4.225 -7.949 4.959 509 HD3 PRO 83 1HD PRO 83 -2.945 -7.140 4.030 510 H ILE 84 H ILE 84 -8.121 -5.491 2.219 511 HA ILE 84 HA ILE 84 -9.606 -5.972 4.694 512 HB ILE 84 HB ILE 84 -10.475 -4.446 2.249 513 HG12 ILE 84 1HG1 ILE 84 -8.509 -3.381 3.142 514 HG13 ILE 84 2HG1 ILE 84 -9.917 -2.426 3.592 515 HG21 ILE 84 1HG2 ILE 84 -11.576 -4.543 5.046 516 HG22 ILE 84 2HG2 ILE 84 -12.368 -5.102 3.568 517 HG23 ILE 84 3HG2 ILE 84 -12.075 -3.377 3.821 518 HD11 ILE 84 1HD1 ILE 84 -9.886 -3.400 5.810 519 HD12 ILE 84 2HD1 ILE 84 -8.351 -2.619 5.430 520 HD13 ILE 84 3HD1 ILE 84 -8.486 -4.376 5.366 521 H ASN 85 H ASN 85 -11.426 -7.142 4.800 522 HA ASN 85 HA ASN 85 -11.792 -9.188 2.795 523 HB2 ASN 85 1HB ASN 85 -11.850 -9.730 5.199 524 HB3 ASN 85 2HB ASN 85 -13.233 -8.672 5.406 525 HD21 ASN 85 1HD2 ASN 85 -14.136 -12.327 5.049 526 HD22 ASN 85 2HD2 ASN 85 -12.884 -11.524 5.933 527 H VAL 86 H VAL 86 -12.965 -8.746 1.070 528 HA VAL 86 HA VAL 86 -15.401 -7.144 1.401 529 HB VAL 86 HB VAL 86 -14.977 -6.276 -0.950 530 HG11 VAL 86 1HG1 VAL 86 -14.686 -4.874 1.011 531 HG12 VAL 86 2HG1 VAL 86 -13.443 -4.518 -0.187 532 HG13 VAL 86 3HG1 VAL 86 -13.049 -5.491 1.229 533 HG21 VAL 86 1HG2 VAL 86 -12.707 -6.285 -1.786 534 HG22 VAL 86 2HG2 VAL 86 -13.264 -7.942 -1.561 535 HG23 VAL 86 3HG2 VAL 86 -12.167 -7.215 -0.388 536 H ASN 87 H ASN 87 -16.607 -8.966 1.524 537 HA ASN 87 HA ASN 87 -17.958 -10.637 0.814 538 HB2 ASN 87 1HB ASN 87 -16.942 -9.778 -1.887 539 HB3 ASN 87 2HB ASN 87 -18.012 -11.164 -1.700 540 HD21 ASN 87 1HD2 ASN 87 -19.860 -7.920 -2.319 541 HD22 ASN 87 2HD2 ASN 87 -18.441 -8.595 -3.046 542 H LEU 88 H LEU 88 -14.628 -10.630 0.349 543 HA LEU 88 HA LEU 88 -13.005 -12.179 0.337 544 HB2 LEU 88 1HB LEU 88 -14.156 -12.627 2.498 545 HB3 LEU 88 2HB LEU 88 -15.088 -13.880 1.698 546 HG LEU 88 HG LEU 88 -12.942 -15.039 1.169 547 HD11 LEU 88 1HD1 LEU 88 -10.957 -14.406 2.471 548 HD12 LEU 88 2HD1 LEU 88 -11.802 -12.964 3.031 549 HD13 LEU 88 3HD1 LEU 88 -11.428 -13.158 1.318 550 HD21 LEU 88 1HD2 LEU 88 -12.625 -15.905 3.443 551 HD22 LEU 88 2HD2 LEU 88 -14.332 -15.742 3.034 552 HD23 LEU 88 3HD2 LEU 88 -13.559 -14.552 4.079 Start of MODEL 7 1 H1 GLY 1 1H GLY 1 -13.694 9.548 8.208 2 H2 GLY 1 2H GLY 1 -13.697 8.469 6.905 3 H3 GLY 1 3H GLY 1 -14.838 8.307 8.142 4 HA2 GLY 1 1HA GLY 1 -15.866 10.389 7.548 5 HA3 GLY 1 2HA GLY 1 -14.658 10.618 6.294 6 H SER 2 H SER 2 -16.467 10.787 4.828 7 HA SER 2 HA SER 2 -18.261 8.614 4.423 8 HB2 SER 2 1HB SER 2 -18.692 11.017 3.782 9 HB3 SER 2 2HB SER 2 -17.550 10.804 2.459 10 HG SER 2 HG SER 2 -20.093 9.668 2.827 11 H GLY 3 H GLY 3 -18.152 6.919 3.002 12 HA2 GLY 3 1HA GLY 3 -17.214 5.415 1.521 13 HA3 GLY 3 2HA GLY 3 -16.082 6.670 1.031 14 H SER 4 H SER 4 -14.404 7.206 2.720 15 HA SER 4 HA SER 4 -13.055 4.816 3.517 16 HB2 SER 4 1HB SER 4 -12.414 7.712 4.110 17 HB3 SER 4 2HB SER 4 -11.330 6.345 4.359 18 HG SER 4 HG SER 4 -11.394 7.737 2.248 19 H SER 5 H SER 5 -14.777 4.013 4.883 20 HA SER 5 HA SER 5 -14.755 5.234 7.559 21 HB2 SER 5 1HB SER 5 -16.681 3.191 6.433 22 HB3 SER 5 2HB SER 5 -16.828 4.047 7.967 23 HG SER 5 HG SER 5 -16.520 5.881 6.093 24 H GLN 6 H GLN 6 -13.625 2.609 5.724 25 HA GLN 6 HA GLN 6 -13.495 0.812 7.997 26 HB2 GLN 6 1HB GLN 6 -12.722 0.422 5.112 27 HB3 GLN 6 2HB GLN 6 -12.519 -0.803 6.355 28 HG2 GLN 6 1HG GLN 6 -15.119 0.416 5.463 29 HG3 GLN 6 2HG GLN 6 -14.525 -1.199 5.085 30 HE21 GLN 6 1HE2 GLN 6 -14.793 -1.961 8.756 31 HE22 GLN 6 2HE2 GLN 6 -13.452 -1.723 7.693 32 H CYS 7 H CYS 7 -11.733 0.123 8.958 33 HA CYS 7 HA CYS 7 -9.600 -0.077 9.686 34 HB2 CYS 7 2HB CYS 7 -9.050 -0.255 7.223 35 HB3 CYS 7 1HB CYS 7 -8.665 1.460 7.275 36 H ASN 8 H ASN 8 -8.454 1.011 11.158 37 HA ASN 8 HA ASN 8 -9.154 3.813 11.558 38 HB2 ASN 8 1HB ASN 8 -7.679 1.859 13.334 39 HB3 ASN 8 2HB ASN 8 -8.091 3.510 13.783 40 HD21 ASN 8 1HD2 ASN 8 -10.598 1.014 15.047 41 HD22 ASN 8 2HD2 ASN 8 -8.871 1.061 15.072 42 H ALA 9 H ALA 9 -6.673 2.110 10.103 43 HA ALA 9 HA ALA 9 -4.477 3.743 11.020 44 HB1 ALA 9 1HB ALA 9 -4.543 1.719 8.792 45 HB2 ALA 9 2HB ALA 9 -4.168 1.367 10.478 46 HB3 ALA 9 3HB ALA 9 -3.101 2.414 9.537 47 H GLY 10 H GLY 10 -6.883 4.121 8.761 48 HA2 GLY 10 1HA GLY 10 -6.151 6.584 7.827 49 HA3 GLY 10 2HA GLY 10 -5.399 5.455 6.707 50 HA PRO 11 HA PRO 11 -9.638 5.785 5.117 51 HB2 PRO 11 2HB PRO 11 -9.064 6.482 2.615 52 HB3 PRO 11 1HB PRO 11 -8.926 7.658 3.925 53 HG2 PRO 11 2HG PRO 11 -6.794 6.205 2.456 54 HG3 PRO 11 1HG PRO 11 -6.766 7.825 3.165 55 HD2 PRO 11 2HD PRO 11 -5.748 5.428 4.298 56 HD3 PRO 11 1HD PRO 11 -5.875 7.013 5.085 57 H VAL 12 H VAL 12 -10.490 4.765 2.937 58 HA VAL 12 HA VAL 12 -9.453 2.058 2.830 59 HB VAL 12 HB VAL 12 -11.343 1.650 1.231 60 HG11 VAL 12 1HG1 VAL 12 -13.056 1.685 2.957 61 HG12 VAL 12 2HG1 VAL 12 -12.077 2.792 3.922 62 HG13 VAL 12 3HG1 VAL 12 -11.505 1.151 3.610 63 HG21 VAL 12 1HG2 VAL 12 -12.030 4.497 1.948 64 HG22 VAL 12 2HG2 VAL 12 -13.154 3.363 1.205 65 HG23 VAL 12 3HG2 VAL 12 -11.696 3.851 0.343 66 H GLN 13 H GLN 13 -8.137 1.326 1.333 67 HA GLN 13 HA GLN 13 -7.612 3.082 -0.979 68 HB2 GLN 13 1HB GLN 13 -5.580 1.086 -0.095 69 HB3 GLN 13 2HB GLN 13 -5.354 2.633 -0.888 70 HG2 GLN 13 1HG GLN 13 -6.231 2.405 1.970 71 HG3 GLN 13 2HG GLN 13 -4.543 2.398 1.487 72 HE21 GLN 13 1HE2 GLN 13 -6.392 5.886 0.507 73 HE22 GLN 13 2HE2 GLN 13 -7.026 4.377 -0.023 74 H CYS 14 H CYS 14 -7.249 2.135 -2.946 75 HA CYS 14 HA CYS 14 -7.957 -0.709 -3.187 76 HB2 CYS 14 2HB CYS 14 -9.745 0.671 -4.101 77 HB3 CYS 14 1HB CYS 14 -8.600 1.566 -5.088 78 H CYS 15 H CYS 15 -6.304 -1.873 -3.801 79 HA CYS 15 HA CYS 15 -4.052 -0.517 -5.136 80 HB2 CYS 15 2HB CYS 15 -3.930 -2.791 -3.146 81 HB3 CYS 15 1HB CYS 15 -2.567 -1.893 -3.815 82 H ASN 16 H ASN 16 -3.086 -1.494 -6.798 83 HA ASN 16 HA ASN 16 -4.411 -3.497 -8.272 84 HB2 ASN 16 1HB ASN 16 -2.791 -1.773 -9.145 85 HB3 ASN 16 2HB ASN 16 -1.506 -2.764 -8.480 86 HD21 ASN 16 1HD2 ASN 16 -1.580 -5.170 -11.010 87 HD22 ASN 16 2HD2 ASN 16 -1.021 -4.758 -9.428 88 H THR 17 H THR 17 -1.546 -3.591 -6.212 89 HA THR 17 HA THR 17 -1.865 -6.493 -5.956 90 HB THR 17 HB THR 17 0.754 -5.112 -6.612 91 HG1 THR 17 1HG THR 17 0.603 -6.384 -8.520 92 HG21 THR 17 1HG2 THR 17 1.207 -6.888 -5.068 93 HG22 THR 17 2HG2 THR 17 1.660 -7.433 -6.685 94 HG23 THR 17 3HG2 THR 17 0.154 -7.993 -5.957 95 H LEU 18 H LEU 18 -1.954 -7.005 -3.859 96 HA LEU 18 HA LEU 18 -0.606 -5.276 -1.911 97 HB2 LEU 18 1HB LEU 18 -2.614 -7.501 -1.594 98 HB3 LEU 18 2HB LEU 18 -1.755 -6.808 -0.234 99 HG LEU 18 HG LEU 18 -3.612 -5.320 -2.078 100 HD11 LEU 18 1HD1 LEU 18 -5.124 -5.248 -0.212 101 HD12 LEU 18 2HD1 LEU 18 -3.948 -6.047 0.829 102 HD13 LEU 18 3HD1 LEU 18 -4.689 -6.931 -0.506 103 HD21 LEU 18 1HD2 LEU 18 -3.338 -3.469 -0.499 104 HD22 LEU 18 2HD2 LEU 18 -1.814 -3.893 -1.271 105 HD23 LEU 18 3HD2 LEU 18 -2.135 -4.404 0.386 106 H THR 19 H THR 19 1.399 -5.762 -1.514 107 HA THR 19 HA THR 19 2.186 -8.525 -1.099 108 HB THR 19 HB THR 19 2.590 -8.331 -3.460 109 HG1 THR 19 1HG THR 19 4.305 -9.424 -2.890 110 HG21 THR 19 1HG2 THR 19 4.202 -6.600 -4.348 111 HG22 THR 19 2HG2 THR 19 4.014 -5.756 -2.811 112 HG23 THR 19 3HG2 THR 19 2.619 -5.996 -3.865 113 H SER 20 H SER 20 4.830 -8.308 -0.708 114 HA SER 20 HA SER 20 4.948 -6.430 1.539 115 HB2 SER 20 1HB SER 20 6.710 -8.804 0.874 116 HB3 SER 20 2HB SER 20 6.821 -7.821 2.333 117 HG SER 20 HG SER 20 4.479 -9.229 1.560 118 H ALA 21 H ALA 21 7.089 -5.412 1.958 119 HA ALA 21 HA ALA 21 7.887 -3.909 -0.316 120 HB1 ALA 21 1HB ALA 21 7.846 -2.980 1.938 121 HB2 ALA 21 2HB ALA 21 9.443 -2.820 1.206 122 HB3 ALA 21 3HB ALA 21 9.148 -4.069 2.416 123 H SER 22 H SER 22 8.663 -6.975 0.412 124 HA SER 22 HA SER 22 11.418 -6.951 -0.420 125 HB2 SER 22 1HB SER 22 10.329 -8.667 1.135 126 HB3 SER 22 2HB SER 22 9.577 -9.327 -0.298 127 HG SER 22 HG SER 22 12.242 -8.966 -0.650 128 H ASN 23 H ASN 23 8.306 -6.984 -1.867 129 HA ASN 23 HA ASN 23 8.911 -8.334 -4.290 130 HB2 ASN 23 1HB ASN 23 6.585 -7.764 -3.325 131 HB3 ASN 23 2HB ASN 23 6.819 -6.167 -4.026 132 HD21 ASN 23 1HD2 ASN 23 5.903 -9.343 -6.358 133 HD22 ASN 23 2HD2 ASN 23 6.256 -9.522 -4.673 134 H SER 24 H SER 24 9.547 -7.576 -6.249 135 HA SER 24 HA SER 24 11.297 -5.372 -6.302 136 HB2 SER 24 1HB SER 24 11.502 -7.369 -7.764 137 HB3 SER 24 2HB SER 24 10.065 -6.851 -8.641 138 HG SER 24 HG SER 24 12.278 -5.124 -8.364 139 H GLN 25 H GLN 25 7.909 -5.723 -7.130 140 HA GLN 25 HA GLN 25 7.576 -3.340 -8.586 141 HB2 GLN 25 1HB GLN 25 5.926 -5.266 -8.366 142 HB3 GLN 25 2HB GLN 25 5.523 -4.625 -6.775 143 HG2 GLN 25 1HG GLN 25 3.901 -3.824 -8.264 144 HG3 GLN 25 2HG GLN 25 4.971 -2.478 -7.877 145 HE21 GLN 25 1HE2 GLN 25 5.000 -1.836 -11.306 146 HE22 GLN 25 2HE2 GLN 25 4.453 -1.340 -9.742 147 H ALA 26 H ALA 26 7.192 -4.150 -5.181 148 HA ALA 26 HA ALA 26 6.336 -1.602 -4.319 149 HB1 ALA 26 1HB ALA 26 6.891 -2.440 -2.072 150 HB2 ALA 26 2HB ALA 26 7.680 -3.837 -2.802 151 HB3 ALA 26 3HB ALA 26 5.944 -3.600 -3.004 152 H ALA 27 H ALA 27 9.527 -3.192 -4.114 153 HA ALA 27 HA ALA 27 10.791 -1.074 -2.780 154 HB1 ALA 27 1HB ALA 27 12.047 -3.131 -4.601 155 HB2 ALA 27 2HB ALA 27 11.714 -3.342 -2.882 156 HB3 ALA 27 3HB ALA 27 12.891 -2.140 -3.412 157 H GLY 28 H GLY 28 10.390 -1.679 -6.254 158 HA2 GLY 28 1HA GLY 28 12.047 0.353 -7.225 159 HA3 GLY 28 2HA GLY 28 10.587 -0.218 -8.026 160 H LEU 29 H LEU 29 8.781 0.472 -5.984 161 HA LEU 29 HA LEU 29 8.378 3.277 -6.487 162 HB2 LEU 29 1HB LEU 29 6.949 1.325 -4.723 163 HB3 LEU 29 2HB LEU 29 6.375 2.919 -5.097 164 HG LEU 29 HG LEU 29 6.697 0.658 -7.061 165 HD11 LEU 29 1HD1 LEU 29 4.815 0.297 -5.629 166 HD12 LEU 29 2HD1 LEU 29 4.224 0.848 -7.196 167 HD13 LEU 29 3HD1 LEU 29 4.282 1.966 -5.832 168 HD21 LEU 29 1HD2 LEU 29 5.585 2.175 -8.654 169 HD22 LEU 29 2HD2 LEU 29 7.162 2.778 -8.146 170 HD23 LEU 29 3HD2 LEU 29 5.691 3.476 -7.466 171 H ILE 30 H ILE 30 8.930 1.268 -3.619 172 HA ILE 30 HA ILE 30 9.009 3.160 -1.615 173 HB ILE 30 HB ILE 30 10.681 0.676 -1.937 174 HG12 ILE 30 1HG1 ILE 30 8.095 1.186 -0.466 175 HG13 ILE 30 2HG1 ILE 30 8.224 0.384 -2.022 176 HG21 ILE 30 1HG2 ILE 30 11.196 0.757 0.357 177 HG22 ILE 30 2HG2 ILE 30 10.023 2.035 0.657 178 HG23 ILE 30 3HG2 ILE 30 11.503 2.393 -0.239 179 HD11 ILE 30 1HD1 ILE 30 9.439 -1.428 -1.020 180 HD12 ILE 30 2HD1 ILE 30 7.918 -1.163 -0.166 181 HD13 ILE 30 3HD1 ILE 30 9.435 -0.602 0.539 182 H GLN 31 H GLN 31 11.653 2.058 -3.674 183 HA GLN 31 HA GLN 31 13.535 3.785 -2.498 184 HB2 GLN 31 1HB GLN 31 13.526 2.105 -4.978 185 HB3 GLN 31 2HB GLN 31 14.920 3.086 -4.527 186 HG2 GLN 31 1HG GLN 31 14.988 1.852 -2.379 187 HG3 GLN 31 2HG GLN 31 13.666 0.851 -2.971 188 HE21 GLN 31 1HE2 GLN 31 17.077 -0.663 -3.584 189 HE22 GLN 31 2HE2 GLN 31 16.399 0.127 -2.203 190 H GLN 32 H GLN 32 11.132 4.219 -4.935 191 HA GLN 32 HA GLN 32 12.371 6.504 -6.169 192 HB2 GLN 32 1HB GLN 32 9.616 5.341 -6.185 193 HB3 GLN 32 2HB GLN 32 9.834 7.000 -6.718 194 HG2 GLN 32 1HG GLN 32 11.236 4.603 -7.864 195 HG3 GLN 32 2HG GLN 32 9.825 5.403 -8.551 196 HE21 GLN 32 1HE2 GLN 32 13.071 6.597 -10.069 197 HE22 GLN 32 2HE2 GLN 32 12.465 5.017 -9.707 198 H LEU 33 H LEU 33 10.159 5.957 -3.530 199 HA LEU 33 HA LEU 33 9.721 8.766 -3.050 200 HB2 LEU 33 1HB LEU 33 9.090 6.647 -1.050 201 HB3 LEU 33 2HB LEU 33 8.189 8.094 -1.449 202 HG LEU 33 HG LEU 33 8.380 5.688 -3.261 203 HD11 LEU 33 1HD1 LEU 33 6.235 5.026 -2.503 204 HD12 LEU 33 2HD1 LEU 33 6.095 6.443 -1.465 205 HD13 LEU 33 3HD1 LEU 33 7.280 5.190 -1.094 206 HD21 LEU 33 1HD2 LEU 33 6.721 8.193 -3.305 207 HD22 LEU 33 2HD2 LEU 33 6.300 6.743 -4.223 208 HD23 LEU 33 3HD2 LEU 33 7.823 7.582 -4.544 209 H GLY 34 H GLY 34 11.894 6.301 -2.060 210 HA2 GLY 34 1HA GLY 34 13.850 6.450 -0.838 211 HA3 GLY 34 2HA GLY 34 13.480 8.139 -0.507 212 H LEU 35 H LEU 35 11.490 5.314 0.101 213 HA LEU 35 HA LEU 35 10.791 6.247 2.692 214 HB2 LEU 35 1HB LEU 35 10.178 3.819 1.091 215 HB3 LEU 35 2HB LEU 35 9.671 3.912 2.756 216 HG LEU 35 HG LEU 35 8.833 5.714 0.498 217 HD11 LEU 35 1HD1 LEU 35 7.750 3.555 0.494 218 HD12 LEU 35 2HD1 LEU 35 6.610 4.807 0.985 219 HD13 LEU 35 3HD1 LEU 35 7.322 3.743 2.195 220 HD21 LEU 35 1HD2 LEU 35 8.207 5.880 3.437 221 HD22 LEU 35 2HD2 LEU 35 7.339 6.760 2.180 222 HD23 LEU 35 3HD2 LEU 35 9.051 7.080 2.459 223 H SER 36 H SER 36 12.455 6.271 4.121 224 HA SER 36 HA SER 36 13.999 3.879 4.613 225 HB2 SER 36 1HB SER 36 13.995 6.526 6.077 226 HB3 SER 36 2HB SER 36 15.224 5.274 6.156 227 HG SER 36 HG SER 36 15.523 5.631 3.856 228 H GLY 37 H GLY 37 13.500 2.414 6.133 229 HA2 GLY 37 1HA GLY 37 12.729 2.000 8.434 230 HA3 GLY 37 2HA GLY 37 11.436 3.149 8.120 231 H VAL 38 H VAL 38 11.623 1.717 5.306 232 HA VAL 38 HA VAL 38 9.596 -0.297 5.933 233 HB VAL 38 HB VAL 38 10.500 0.746 3.239 234 HG11 VAL 38 1HG1 VAL 38 9.452 -1.427 3.103 235 HG12 VAL 38 2HG1 VAL 38 8.369 -0.194 2.453 236 HG13 VAL 38 3HG1 VAL 38 8.088 -0.858 4.062 237 HG21 VAL 38 1HG2 VAL 38 9.568 2.555 4.566 238 HG22 VAL 38 2HG2 VAL 38 8.144 1.579 4.927 239 HG23 VAL 38 3HG2 VAL 38 8.457 2.104 3.273 240 H GLY 39 H GLY 39 10.492 -2.219 6.410 241 HA2 GLY 39 1HA GLY 39 12.847 -3.163 4.951 242 HA3 GLY 39 2HA GLY 39 12.146 -3.908 6.385 243 H ALA 40 H ALA 40 12.596 -5.776 4.714 244 HA ALA 40 HA ALA 40 10.805 -5.945 2.500 245 HB1 ALA 40 1HB ALA 40 11.709 -8.162 2.152 246 HB2 ALA 40 2HB ALA 40 12.430 -8.149 3.762 247 HB3 ALA 40 3HB ALA 40 13.016 -7.038 2.525 248 H ASN 41 H ASN 41 10.512 -6.716 5.826 249 HA ASN 41 HA ASN 41 8.425 -8.672 5.517 250 HB2 ASN 41 1HB ASN 41 8.230 -8.564 7.925 251 HB3 ASN 41 2HB ASN 41 9.932 -8.612 7.496 252 HD21 ASN 41 1HD2 ASN 41 9.038 -5.973 10.083 253 HD22 ASN 41 2HD2 ASN 41 8.491 -7.601 9.885 254 H VAL 42 H VAL 42 8.592 -5.340 5.276 255 HA VAL 42 HA VAL 42 6.166 -4.587 6.548 256 HB VAL 42 HB VAL 42 7.850 -3.128 4.515 257 HG11 VAL 42 1HG1 VAL 42 6.857 -1.084 5.571 258 HG12 VAL 42 2HG1 VAL 42 5.651 -2.141 6.318 259 HG13 VAL 42 3HG1 VAL 42 5.748 -2.019 4.560 260 HG21 VAL 42 1HG2 VAL 42 8.647 -1.957 6.587 261 HG22 VAL 42 2HG2 VAL 42 9.172 -3.630 6.371 262 HG23 VAL 42 3HG2 VAL 42 7.866 -3.249 7.502 263 HA PRO 43 HA PRO 43 3.415 -5.636 3.208 264 HB2 PRO 43 2HB PRO 43 1.257 -4.274 4.340 265 HB3 PRO 43 1HB PRO 43 1.653 -5.962 4.588 266 HG2 PRO 43 2HG PRO 43 1.821 -3.808 6.452 267 HG3 PRO 43 1HG PRO 43 2.125 -5.528 6.728 268 HD2 PRO 43 2HD PRO 43 4.014 -3.364 6.442 269 HD3 PRO 43 1HD PRO 43 4.321 -5.040 6.905 270 H VAL 44 H VAL 44 2.745 -4.547 1.376 271 HA VAL 44 HA VAL 44 2.498 -1.640 1.534 272 HB VAL 44 HB VAL 44 3.904 -1.284 -0.442 273 HG11 VAL 44 1HG1 VAL 44 4.948 -0.945 1.693 274 HG12 VAL 44 2HG1 VAL 44 6.112 -1.708 0.607 275 HG13 VAL 44 3HG1 VAL 44 5.295 -2.666 1.844 276 HG21 VAL 44 1HG2 VAL 44 3.795 -3.325 -1.596 277 HG22 VAL 44 2HG2 VAL 44 4.377 -4.232 -0.198 278 HG23 VAL 44 3HG2 VAL 44 5.470 -3.164 -1.070 279 H GLY 45 H GLY 45 1.461 -0.709 -0.302 280 HA2 GLY 45 1HA GLY 45 -0.102 -2.681 -1.834 281 HA3 GLY 45 2HA GLY 45 -0.709 -1.098 -1.377 282 H ILE 46 H ILE 46 0.120 -2.718 -3.918 283 HA ILE 46 HA ILE 46 1.851 -0.783 -5.232 284 HB ILE 46 HB ILE 46 0.720 -3.463 -6.022 285 HG12 ILE 46 1HG1 ILE 46 2.948 -4.286 -6.004 286 HG13 ILE 46 2HG1 ILE 46 3.620 -2.683 -6.057 287 HG21 ILE 46 1HG2 ILE 46 0.617 -2.037 -7.985 288 HG22 ILE 46 2HG2 ILE 46 1.865 -3.271 -8.172 289 HG23 ILE 46 3HG2 ILE 46 2.317 -1.612 -7.780 290 HD11 ILE 46 1HD1 ILE 46 3.994 -3.757 -3.938 291 HD12 ILE 46 2HD1 ILE 46 2.251 -3.907 -3.701 292 HD13 ILE 46 3HD1 ILE 46 3.004 -2.310 -3.759 293 H ASN 47 H ASN 47 0.912 0.932 -6.142 294 HA ASN 47 HA ASN 47 -0.504 2.263 -7.322 295 HB2 ASN 47 1HB ASN 47 -0.363 0.234 -8.930 296 HB3 ASN 47 2HB ASN 47 -1.957 -0.176 -8.318 297 HD21 ASN 47 1HD2 ASN 47 -2.153 1.936 -11.410 298 HD22 ASN 47 2HD2 ASN 47 -1.253 0.517 -11.004 299 H CYS 48 H CYS 48 -1.182 2.418 -4.891 300 HA CYS 48 HA CYS 48 -3.931 1.532 -4.498 301 HB2 CYS 48 2HB CYS 48 -2.001 2.907 -2.625 302 HB3 CYS 48 1HB CYS 48 -3.612 2.355 -2.205 303 H ASN 49 H ASN 49 -5.615 2.832 -4.657 304 HA ASN 49 HA ASN 49 -5.225 5.698 -4.191 305 HB2 ASN 49 1HB ASN 49 -7.056 6.107 -5.926 306 HB3 ASN 49 2HB ASN 49 -5.467 5.690 -6.532 307 HD21 ASN 49 1HD2 ASN 49 -8.055 2.549 -6.672 308 HD22 ASN 49 2HD2 ASN 49 -7.751 3.381 -5.185 309 HA PRO 50 HA PRO 50 -8.320 5.193 -1.195 310 HB2 PRO 50 2HB PRO 50 -9.231 7.939 -1.639 311 HB3 PRO 50 1HB PRO 50 -8.376 7.260 -0.252 312 HG2 PRO 50 2HG PRO 50 -7.195 8.981 -1.962 313 HG3 PRO 50 1HG PRO 50 -6.298 7.682 -1.155 314 HD2 PRO 50 2HD PRO 50 -7.394 7.781 -3.945 315 HD3 PRO 50 1HD PRO 50 -5.810 7.213 -3.382 316 H ILE 51 H ILE 51 -10.268 4.279 -1.272 317 HA ILE 51 HA ILE 51 -11.893 4.647 -3.647 318 HB ILE 51 HB ILE 51 -12.809 2.985 -1.335 319 HG12 ILE 51 1HG1 ILE 51 -10.637 2.174 -3.290 320 HG13 ILE 51 2HG1 ILE 51 -10.420 2.424 -1.562 321 HG21 ILE 51 1HG2 ILE 51 -14.161 3.277 -3.392 322 HG22 ILE 51 2HG2 ILE 51 -13.697 1.598 -3.118 323 HG23 ILE 51 3HG2 ILE 51 -12.848 2.560 -4.330 324 HD11 ILE 51 1HD1 ILE 51 -11.943 0.571 -1.109 325 HD12 ILE 51 2HD1 ILE 51 -10.556 0.071 -2.076 326 HD13 ILE 51 3HD1 ILE 51 -12.126 0.312 -2.844 327 H THR 52 H THR 52 -12.572 6.824 -3.314 328 HA THR 52 HA THR 52 -14.400 7.144 -1.029 329 HB THR 52 HB THR 52 -13.969 9.612 -1.269 330 HG1 THR 52 1HG THR 52 -11.951 10.089 -2.409 331 HG21 THR 52 1HG2 THR 52 -11.553 7.886 -0.699 332 HG22 THR 52 2HG2 THR 52 -12.853 8.233 0.441 333 HG23 THR 52 3HG2 THR 52 -11.811 9.537 -0.130 334 H GLY 53 H GLY 53 -14.918 6.114 -3.788 335 HA2 GLY 53 1HA GLY 53 -17.239 7.873 -4.266 336 HA3 GLY 53 2HA GLY 53 -16.272 7.288 -5.613 337 H ILE 54 H ILE 54 -16.551 5.090 -3.040 338 HA ILE 54 HA ILE 54 -18.772 3.671 -4.313 339 HB ILE 54 HB ILE 54 -16.140 2.372 -3.602 340 HG12 ILE 54 1HG1 ILE 54 -17.371 2.926 -6.307 341 HG13 ILE 54 2HG1 ILE 54 -15.977 3.755 -5.627 342 HG21 ILE 54 1HG2 ILE 54 -18.036 0.883 -3.254 343 HG22 ILE 54 2HG2 ILE 54 -17.078 0.364 -4.640 344 HG23 ILE 54 3HG2 ILE 54 -18.605 1.208 -4.890 345 HD11 ILE 54 1HD1 ILE 54 -16.122 0.835 -6.332 346 HD12 ILE 54 2HD1 ILE 54 -14.723 1.666 -5.653 347 HD13 ILE 54 3HD1 ILE 54 -15.309 2.092 -7.261 348 H GLY 55 H GLY 55 -19.990 2.367 -2.922 349 HA2 GLY 55 1HA GLY 55 -20.695 1.370 -0.980 350 HA3 GLY 55 2HA GLY 55 -19.035 1.452 -0.420 351 H ALA 56 H ALA 56 -21.976 3.384 -0.792 352 HA ALA 56 HA ALA 56 -21.086 5.331 1.142 353 HB1 ALA 56 1HB ALA 56 -23.259 6.373 0.799 354 HB2 ALA 56 2HB ALA 56 -23.801 4.973 -0.127 355 HB3 ALA 56 3HB ALA 56 -22.503 5.993 -0.748 356 H GLY 57 H GLY 57 -20.722 3.985 2.969 357 HA2 GLY 57 1HA GLY 57 -21.676 3.799 5.166 358 HA3 GLY 57 2HA GLY 57 -23.223 3.430 4.422 359 H SER 58 H SER 58 -22.247 1.512 2.555 360 HA SER 58 HA SER 58 -22.209 -0.754 4.338 361 HB2 SER 58 1HB SER 58 -22.336 -2.001 2.097 362 HB3 SER 58 2HB SER 58 -23.697 -0.963 2.520 363 HG SER 58 HG SER 58 -22.869 -0.712 0.330 364 H GLY 59 H GLY 59 -19.873 1.070 2.678 365 HA2 GLY 59 1HA GLY 59 -17.528 0.614 3.086 366 HA3 GLY 59 2HA GLY 59 -17.909 -1.103 3.024 367 H SER 60 H SER 60 -16.052 0.707 1.447 368 HA SER 60 HA SER 60 -17.206 0.623 -1.215 369 HB2 SER 60 1HB SER 60 -14.409 1.517 -0.785 370 HB3 SER 60 2HB SER 60 -15.703 2.246 -1.751 371 HG SER 60 HG SER 60 -16.494 3.233 0.002 372 H SER 61 H SER 61 -16.477 -0.633 -2.887 373 HA SER 61 HA SER 61 -14.703 -2.843 -2.176 374 HB2 SER 61 1HB SER 61 -16.512 -2.526 -4.583 375 HB3 SER 61 2HB SER 61 -15.670 -3.992 -4.084 376 HG SER 61 HG SER 61 -17.032 -4.246 -2.420 377 H CYS 62 H CYS 62 -12.972 -3.440 -3.533 378 HA CYS 62 HA CYS 62 -11.917 -1.219 -5.144 379 HB2 CYS 62 2HB CYS 62 -10.455 -1.669 -3.328 380 HB3 CYS 62 1HB CYS 62 -10.556 -3.409 -3.587 381 H ASN 63 H ASN 63 -11.131 -1.551 -7.153 382 HA ASN 63 HA ASN 63 -12.259 -3.535 -8.771 383 HB2 ASN 63 1HB ASN 63 -11.579 -1.377 -9.657 384 HB3 ASN 63 2HB ASN 63 -9.898 -1.709 -9.257 385 HD21 ASN 63 1HD2 ASN 63 -9.239 -3.537 -12.137 386 HD22 ASN 63 2HD2 ASN 63 -8.685 -2.976 -10.596 387 H ALA 64 H ALA 64 -9.144 -3.361 -7.153 388 HA ALA 64 HA ALA 64 -8.533 -6.046 -8.195 389 HB1 ALA 64 1HB ALA 64 -6.559 -3.948 -7.306 390 HB2 ALA 64 2HB ALA 64 -6.963 -4.329 -8.978 391 HB3 ALA 64 3HB ALA 64 -6.176 -5.538 -7.966 392 H ASN 65 H ASN 65 -6.766 -4.460 -5.627 393 HA ASN 65 HA ASN 65 -7.958 -6.334 -3.688 394 HB2 ASN 65 1HB ASN 65 -5.096 -5.415 -3.856 395 HB3 ASN 65 2HB ASN 65 -5.748 -6.415 -2.576 396 HD21 ASN 65 1HD2 ASN 65 -4.806 -7.985 -6.190 397 HD22 ASN 65 2HD2 ASN 65 -4.799 -6.283 -5.912 398 HA PRO 66 HA PRO 66 -8.675 -2.441 -1.615 399 HB2 PRO 66 2HB PRO 66 -10.435 -3.350 0.170 400 HB3 PRO 66 1HB PRO 66 -10.866 -3.216 -1.537 401 HG2 PRO 66 2HG PRO 66 -10.075 -5.635 0.031 402 HG3 PRO 66 1HG PRO 66 -11.340 -5.462 -1.198 403 HD2 PRO 66 2HD PRO 66 -8.807 -6.502 -1.668 404 HD3 PRO 66 1HD PRO 66 -9.859 -5.815 -2.917 405 H ALA 67 H ALA 67 -7.565 -1.537 0.010 406 HA ALA 67 HA ALA 67 -6.749 -3.131 2.302 407 HB1 ALA 67 1HB ALA 67 -4.949 -3.533 0.715 408 HB2 ALA 67 2HB ALA 67 -4.376 -2.534 2.049 409 HB3 ALA 67 3HB ALA 67 -4.737 -1.799 0.487 410 H CYS 68 H CYS 68 -5.754 -1.791 3.965 411 HA CYS 68 HA CYS 68 -6.078 1.098 3.532 412 HB2 CYS 68 2HB CYS 68 -6.633 1.394 5.855 413 HB3 CYS 68 1HB CYS 68 -7.727 0.194 5.180 414 H CYS 69 H CYS 69 -4.348 2.364 4.273 415 HA CYS 69 HA CYS 69 -1.999 0.773 5.025 416 HB2 CYS 69 2HB CYS 69 -2.426 2.066 2.583 417 HB3 CYS 69 1HB CYS 69 -1.259 3.053 3.439 418 H ASP 70 H ASP 70 -0.350 1.841 6.075 419 HA ASP 70 HA ASP 70 -1.088 3.720 8.039 420 HB2 ASP 70 1HB ASP 70 0.744 2.133 8.330 421 HB3 ASP 70 2HB ASP 70 1.622 2.860 7.005 422 H ASN 71 H ASN 71 0.699 3.956 5.008 423 HA ASN 71 HA ASN 71 -0.255 6.650 4.553 424 HB2 ASN 71 1HB ASN 71 2.723 6.105 4.774 425 HB3 ASN 71 2HB ASN 71 2.026 7.555 4.068 426 HD21 ASN 71 1HD2 ASN 71 2.473 7.181 8.042 427 HD22 ASN 71 2HD2 ASN 71 2.924 5.939 6.923 428 H VAL 72 H VAL 72 -0.571 6.896 2.337 429 HA VAL 72 HA VAL 72 1.128 5.202 0.640 430 HB VAL 72 HB VAL 72 -0.530 4.606 -0.753 431 HG11 VAL 72 1HG1 VAL 72 -2.708 4.283 0.350 432 HG12 VAL 72 2HG1 VAL 72 -2.157 5.323 1.665 433 HG13 VAL 72 3HG1 VAL 72 -1.333 3.797 1.344 434 HG21 VAL 72 1HG2 VAL 72 -0.935 6.840 -1.585 435 HG22 VAL 72 2HG2 VAL 72 -1.991 7.175 -0.208 436 HG23 VAL 72 3HG2 VAL 72 -2.453 5.952 -1.394 437 H TYR 73 H TYR 73 1.432 6.116 -1.578 438 HA TYR 73 HA TYR 73 1.748 9.042 -1.424 439 HB2 TYR 73 2HB TYR 73 3.752 6.990 -2.347 440 HB3 TYR 73 1HB TYR 73 3.989 8.734 -2.444 441 HD1 TYR 73 1HD TYR 73 4.399 10.041 -0.418 442 HD2 TYR 73 2HD TYR 73 3.894 5.822 -0.233 443 HE1 TYR 73 1HE TYR 73 5.278 10.038 1.878 444 HE2 TYR 73 2HE TYR 73 4.771 5.810 2.062 445 HH TYR 73 HH TYR 73 5.132 8.627 3.897 446 H THR 74 H THR 74 2.299 9.945 -3.639 447 HA THR 74 HA THR 74 -0.049 9.431 -5.128 448 HB THR 74 HB THR 74 2.224 11.178 -6.042 449 HG1 THR 74 1HG THR 74 1.887 12.418 -4.365 450 HG21 THR 74 1HG2 THR 74 -0.775 11.412 -6.320 451 HG22 THR 74 2HG2 THR 74 0.342 10.916 -7.592 452 HG23 THR 74 3HG2 THR 74 0.409 12.557 -6.949 453 H ASN 75 H ASN 75 3.260 8.406 -5.559 454 HA ASN 75 HA ASN 75 3.054 7.582 -8.263 455 HB2 ASN 75 1HB ASN 75 4.941 6.118 -7.814 456 HB3 ASN 75 2HB ASN 75 5.213 7.661 -7.015 457 HD21 ASN 75 1HD2 ASN 75 5.935 4.693 -4.806 458 HD22 ASN 75 2HD2 ASN 75 6.314 5.006 -6.461 459 H GLY 76 H GLY 76 1.727 6.470 -5.349 460 HA2 GLY 76 1HA GLY 76 -0.256 5.145 -5.448 461 HA3 GLY 76 2HA GLY 76 0.464 4.231 -6.769 462 H LEU 77 H LEU 77 2.639 4.958 -4.208 463 HA LEU 77 HA LEU 77 2.624 2.114 -3.522 464 HB2 LEU 77 1HB LEU 77 4.713 3.211 -4.235 465 HB3 LEU 77 2HB LEU 77 4.596 4.298 -2.880 466 HG LEU 77 HG LEU 77 6.259 2.369 -2.706 467 HD11 LEU 77 1HD1 LEU 77 5.828 1.994 -0.339 468 HD12 LEU 77 2HD1 LEU 77 4.208 2.680 -0.528 469 HD13 LEU 77 3HD1 LEU 77 5.629 3.694 -0.778 470 HD21 LEU 77 1HD2 LEU 77 5.414 0.235 -1.997 471 HD22 LEU 77 2HD2 LEU 77 4.752 0.641 -3.581 472 HD23 LEU 77 3HD2 LEU 77 3.751 0.810 -2.136 473 H GLY 78 H GLY 78 1.823 1.389 -1.674 474 HA2 GLY 78 1HA GLY 78 1.287 3.350 0.458 475 HA3 GLY 78 2HA GLY 78 0.355 1.889 0.197 476 H VAL 79 H VAL 79 1.914 2.955 2.544 477 HA VAL 79 HA VAL 79 3.743 0.675 2.912 478 HB VAL 79 HB VAL 79 4.659 3.053 3.148 479 HG11 VAL 79 1HG1 VAL 79 4.306 4.247 5.187 480 HG12 VAL 79 2HG1 VAL 79 3.196 3.007 5.762 481 HG13 VAL 79 3HG1 VAL 79 2.762 4.000 4.372 482 HG21 VAL 79 1HG2 VAL 79 6.054 2.471 5.070 483 HG22 VAL 79 2HG2 VAL 79 5.849 1.105 3.974 484 HG23 VAL 79 3HG2 VAL 79 4.935 1.172 5.482 485 H GLN 80 H GLN 80 3.220 -0.844 4.300 486 HA GLN 80 HA GLN 80 2.184 -2.059 5.893 487 HB2 GLN 80 1HB GLN 80 1.557 0.655 7.066 488 HB3 GLN 80 2HB GLN 80 1.234 -0.869 7.876 489 HG2 GLN 80 1HG GLN 80 3.964 -0.188 6.924 490 HG3 GLN 80 2HG GLN 80 3.364 0.421 8.471 491 HE21 GLN 80 1HE2 GLN 80 5.178 -2.822 8.880 492 HE22 GLN 80 2HE2 GLN 80 5.566 -1.327 8.107 493 H CYS 81 H CYS 81 0.845 -1.921 3.650 494 HA CYS 81 HA CYS 81 -1.913 -1.153 4.115 495 HB2 CYS 81 2HB CYS 81 -0.576 -2.499 1.767 496 HB3 CYS 81 1HB CYS 81 -2.309 -2.291 1.874 497 H ASN 82 H ASN 82 -3.384 -2.403 5.022 498 HA ASN 82 HA ASN 82 -2.936 -5.313 4.935 499 HB2 ASN 82 1HB ASN 82 -4.683 -3.866 6.919 500 HB3 ASN 82 2HB ASN 82 -4.227 -5.553 6.946 501 HD21 ASN 82 1HD2 ASN 82 -0.716 -4.344 7.670 502 HD22 ASN 82 2HD2 ASN 82 -1.439 -5.009 6.242 503 HA PRO 83 HA PRO 83 -6.377 -5.542 2.269 504 HB2 PRO 83 2HB PRO 83 -7.078 -8.160 3.365 505 HB3 PRO 83 1HB PRO 83 -6.436 -7.752 1.776 506 HG2 PRO 83 2HG PRO 83 -4.979 -9.051 3.644 507 HG3 PRO 83 1HG PRO 83 -4.256 -7.957 2.454 508 HD2 PRO 83 2HD PRO 83 -4.890 -7.463 5.342 509 HD3 PRO 83 1HD PRO 83 -3.485 -6.950 4.388 510 H ILE 84 H ILE 84 -8.444 -4.971 2.244 511 HA ILE 84 HA ILE 84 -9.872 -4.568 4.723 512 HB ILE 84 HB ILE 84 -10.636 -4.056 1.861 513 HG12 ILE 84 1HG1 ILE 84 -8.781 -2.676 2.649 514 HG13 ILE 84 2HG1 ILE 84 -10.221 -1.705 2.393 515 HG21 ILE 84 1HG2 ILE 84 -12.087 -3.184 4.340 516 HG22 ILE 84 2HG2 ILE 84 -12.651 -4.375 3.163 517 HG23 ILE 84 3HG2 ILE 84 -12.469 -2.683 2.693 518 HD11 ILE 84 1HD1 ILE 84 -9.131 -1.017 4.409 519 HD12 ILE 84 2HD1 ILE 84 -9.156 -2.666 5.027 520 HD13 ILE 84 3HD1 ILE 84 -10.667 -1.785 4.810 521 H ASN 85 H ASN 85 -11.863 -5.450 5.237 522 HA ASN 85 HA ASN 85 -12.259 -8.180 4.467 523 HB2 ASN 85 1HB ASN 85 -12.732 -7.624 6.739 524 HB3 ASN 85 2HB ASN 85 -13.775 -6.289 6.267 525 HD21 ASN 85 1HD2 ASN 85 -16.402 -8.460 6.983 526 HD22 ASN 85 2HD2 ASN 85 -15.495 -7.065 7.459 527 H VAL 86 H VAL 86 -12.896 -8.437 2.424 528 HA VAL 86 HA VAL 86 -15.425 -7.192 1.633 529 HB VAL 86 HB VAL 86 -14.563 -7.299 -0.763 530 HG11 VAL 86 1HG1 VAL 86 -13.363 -5.161 -0.583 531 HG12 VAL 86 2HG1 VAL 86 -13.227 -5.396 1.158 532 HG13 VAL 86 3HG1 VAL 86 -14.813 -5.192 0.418 533 HG21 VAL 86 1HG2 VAL 86 -12.165 -7.285 -1.113 534 HG22 VAL 86 2HG2 VAL 86 -12.639 -8.774 -0.293 535 HG23 VAL 86 3HG2 VAL 86 -11.886 -7.466 0.619 536 H ASN 87 H ASN 87 -16.553 -8.951 2.243 537 HA ASN 87 HA ASN 87 -17.589 -10.968 2.053 538 HB2 ASN 87 1HB ASN 87 -17.393 -10.828 -0.381 539 HB3 ASN 87 2HB ASN 87 -15.742 -11.426 -0.307 540 HD21 ASN 87 1HD2 ASN 87 -18.902 -13.964 -0.039 541 HD22 ASN 87 2HD2 ASN 87 -19.107 -12.252 0.103 542 H LEU 88 H LEU 88 -14.428 -10.404 2.714 543 HA LEU 88 HA LEU 88 -12.849 -11.339 3.994 544 HB2 LEU 88 1HB LEU 88 -14.772 -11.548 5.536 545 HB3 LEU 88 2HB LEU 88 -15.065 -13.163 4.912 546 HG LEU 88 HG LEU 88 -12.760 -13.777 5.671 547 HD11 LEU 88 1HD1 LEU 88 -12.929 -11.105 7.048 548 HD12 LEU 88 2HD1 LEU 88 -11.787 -11.570 5.787 549 HD13 LEU 88 3HD1 LEU 88 -11.716 -12.342 7.368 550 HD21 LEU 88 1HD2 LEU 88 -13.397 -14.033 8.012 551 HD22 LEU 88 2HD2 LEU 88 -14.754 -14.386 6.943 552 HD23 LEU 88 3HD2 LEU 88 -14.682 -12.846 7.797 Start of MODEL 8 1 H1 GLY 1 1H GLY 1 -22.671 0.781 2.943 2 H2 GLY 1 2H GLY 1 -23.517 2.113 3.545 3 H3 GLY 1 3H GLY 1 -22.170 1.520 4.376 4 HA2 GLY 1 1HA GLY 1 -20.711 2.158 2.587 5 HA3 GLY 1 2HA GLY 1 -22.098 2.711 1.662 6 H SER 2 H SER 2 -19.781 3.504 4.033 7 HA SER 2 HA SER 2 -20.976 6.172 4.299 8 HB2 SER 2 1HB SER 2 -21.516 4.862 6.334 9 HB3 SER 2 2HB SER 2 -19.797 4.567 6.586 10 HG SER 2 HG SER 2 -19.526 6.565 7.258 11 H GLY 3 H GLY 3 -19.264 6.221 2.495 12 HA2 GLY 3 1HA GLY 3 -17.236 7.015 1.767 13 HA3 GLY 3 2HA GLY 3 -17.033 7.672 3.385 14 H SER 4 H SER 4 -15.105 7.102 4.099 15 HA SER 4 HA SER 4 -14.038 4.459 3.513 16 HB2 SER 4 1HB SER 4 -12.569 6.448 3.303 17 HB3 SER 4 2HB SER 4 -12.792 6.778 5.020 18 HG SER 4 HG SER 4 -11.831 4.721 5.433 19 H SER 5 H SER 5 -15.857 3.535 4.806 20 HA SER 5 HA SER 5 -15.908 3.944 7.639 21 HB2 SER 5 1HB SER 5 -17.473 1.965 7.584 22 HB3 SER 5 2HB SER 5 -17.958 3.323 6.569 23 HG SER 5 HG SER 5 -18.148 1.374 5.432 24 H GLN 6 H GLN 6 -14.073 2.020 5.511 25 HA GLN 6 HA GLN 6 -13.195 0.250 7.670 26 HB2 GLN 6 1HB GLN 6 -12.396 0.261 4.757 27 HB3 GLN 6 2HB GLN 6 -11.974 -0.965 5.938 28 HG2 GLN 6 1HG GLN 6 -14.749 -0.337 4.965 29 HG3 GLN 6 2HG GLN 6 -13.755 -1.703 4.464 30 HE21 GLN 6 1HE2 GLN 6 -15.825 -1.782 7.939 31 HE22 GLN 6 2HE2 GLN 6 -15.717 -0.352 6.971 32 H CYS 7 H CYS 7 -10.807 -0.086 7.826 33 HA CYS 7 HA CYS 7 -8.672 0.561 8.102 34 HB2 CYS 7 2HB CYS 7 -8.712 1.206 5.758 35 HB3 CYS 7 1HB CYS 7 -9.378 2.771 6.192 36 H ASN 8 H ASN 8 -8.149 1.240 10.044 37 HA ASN 8 HA ASN 8 -9.268 3.717 11.100 38 HB2 ASN 8 1HB ASN 8 -7.585 1.545 12.358 39 HB3 ASN 8 2HB ASN 8 -8.022 3.028 13.197 40 HD21 ASN 8 1HD2 ASN 8 -10.698 0.027 12.728 41 HD22 ASN 8 2HD2 ASN 8 -9.157 0.001 11.943 42 H ALA 9 H ALA 9 -6.405 2.570 9.603 43 HA ALA 9 HA ALA 9 -4.652 4.518 10.842 44 HB1 ALA 9 1HB ALA 9 -3.820 2.279 10.322 45 HB2 ALA 9 2HB ALA 9 -2.900 3.524 9.478 46 HB3 ALA 9 3HB ALA 9 -4.102 2.574 8.606 47 H GLY 10 H GLY 10 -6.897 4.719 8.472 48 HA2 GLY 10 1HA GLY 10 -6.409 7.277 7.667 49 HA3 GLY 10 2HA GLY 10 -5.470 6.296 6.549 50 HA PRO 11 HA PRO 11 -9.654 6.187 4.736 51 HB2 PRO 11 2HB PRO 11 -9.082 7.111 2.315 52 HB3 PRO 11 1HB PRO 11 -9.183 8.223 3.688 53 HG2 PRO 11 2HG PRO 11 -6.773 7.063 2.361 54 HG3 PRO 11 1HG PRO 11 -7.043 8.724 2.924 55 HD2 PRO 11 2HD PRO 11 -5.659 6.763 4.329 56 HD3 PRO 11 1HD PRO 11 -6.382 8.213 5.054 57 H VAL 12 H VAL 12 -10.452 4.815 3.093 58 HA VAL 12 HA VAL 12 -9.115 2.348 2.857 59 HB VAL 12 HB VAL 12 -10.960 1.796 1.204 60 HG11 VAL 12 1HG1 VAL 12 -11.817 2.880 3.880 61 HG12 VAL 12 2HG1 VAL 12 -11.056 1.310 3.616 62 HG13 VAL 12 3HG1 VAL 12 -12.643 1.650 2.924 63 HG21 VAL 12 1HG2 VAL 12 -11.380 4.087 0.420 64 HG22 VAL 12 2HG2 VAL 12 -11.946 4.531 2.030 65 HG23 VAL 12 3HG2 VAL 12 -12.841 3.349 1.076 66 H GLN 13 H GLN 13 -7.871 1.486 1.322 67 HA GLN 13 HA GLN 13 -7.384 3.124 -1.076 68 HB2 GLN 13 1HB GLN 13 -5.428 1.228 0.234 69 HB3 GLN 13 2HB GLN 13 -5.115 2.316 -1.106 70 HG2 GLN 13 1HG GLN 13 -5.833 3.180 1.679 71 HG3 GLN 13 2HG GLN 13 -4.206 3.129 1.008 72 HE21 GLN 13 1HE2 GLN 13 -5.836 6.529 0.749 73 HE22 GLN 13 2HE2 GLN 13 -5.805 5.365 2.027 74 H CYS 14 H CYS 14 -7.227 2.133 -3.028 75 HA CYS 14 HA CYS 14 -7.952 -0.719 -3.134 76 HB2 CYS 14 2HB CYS 14 -9.705 0.709 -4.064 77 HB3 CYS 14 1HB CYS 14 -8.547 1.485 -5.132 78 H CYS 15 H CYS 15 -6.067 -1.724 -3.311 79 HA CYS 15 HA CYS 15 -3.950 -0.586 -4.973 80 HB2 CYS 15 2HB CYS 15 -3.965 -2.911 -3.032 81 HB3 CYS 15 1HB CYS 15 -2.559 -2.405 -3.953 82 H ASN 16 H ASN 16 -3.004 -1.725 -6.683 83 HA ASN 16 HA ASN 16 -4.650 -3.661 -8.027 84 HB2 ASN 16 1HB ASN 16 -3.034 -1.882 -9.024 85 HB3 ASN 16 2HB ASN 16 -1.804 -3.095 -8.731 86 HD21 ASN 16 1HD2 ASN 16 -3.302 -3.342 -12.180 87 HD22 ASN 16 2HD2 ASN 16 -2.757 -1.994 -11.244 88 H THR 17 H THR 17 -1.797 -3.674 -6.036 89 HA THR 17 HA THR 17 -1.991 -6.569 -5.789 90 HB THR 17 HB THR 17 0.549 -5.153 -6.642 91 HG1 THR 17 1HG THR 17 -1.417 -6.481 -7.959 92 HG21 THR 17 1HG2 THR 17 1.144 -6.806 -4.992 93 HG22 THR 17 2HG2 THR 17 1.570 -7.417 -6.592 94 HG23 THR 17 3HG2 THR 17 0.125 -8.014 -5.778 95 H LEU 18 H LEU 18 -2.040 -7.009 -3.680 96 HA LEU 18 HA LEU 18 -0.596 -5.243 -1.836 97 HB2 LEU 18 1HB LEU 18 -2.613 -7.427 -1.321 98 HB3 LEU 18 2HB LEU 18 -1.769 -6.553 -0.058 99 HG LEU 18 HG LEU 18 -3.638 -5.338 -2.077 100 HD11 LEU 18 1HD1 LEU 18 -3.981 -5.764 0.888 101 HD12 LEU 18 2HD1 LEU 18 -4.748 -6.738 -0.368 102 HD13 LEU 18 3HD1 LEU 18 -5.147 -5.027 -0.211 103 HD21 LEU 18 1HD2 LEU 18 -1.870 -3.805 -1.434 104 HD22 LEU 18 2HD2 LEU 18 -2.206 -4.114 0.268 105 HD23 LEU 18 3HD2 LEU 18 -3.410 -3.311 -0.738 106 H THR 19 H THR 19 1.426 -5.785 -1.805 107 HA THR 19 HA THR 19 2.137 -8.553 -1.188 108 HB THR 19 HB THR 19 2.546 -8.361 -3.561 109 HG1 THR 19 1HG THR 19 4.338 -9.406 -3.258 110 HG21 THR 19 1HG2 THR 19 4.179 -6.689 -4.455 111 HG22 THR 19 2HG2 THR 19 4.112 -5.870 -2.895 112 HG23 THR 19 3HG2 THR 19 2.661 -5.991 -3.892 113 H SER 20 H SER 20 4.797 -8.336 -0.853 114 HA SER 20 HA SER 20 4.906 -6.535 1.453 115 HB2 SER 20 1HB SER 20 6.722 -8.843 0.713 116 HB3 SER 20 2HB SER 20 6.713 -7.968 2.244 117 HG SER 20 HG SER 20 4.282 -8.698 2.051 118 H ALA 21 H ALA 21 6.996 -5.465 1.903 119 HA ALA 21 HA ALA 21 7.662 -3.817 -0.299 120 HB1 ALA 21 1HB ALA 21 9.197 -2.728 1.255 121 HB2 ALA 21 2HB ALA 21 8.991 -4.056 2.397 122 HB3 ALA 21 3HB ALA 21 7.624 -3.015 1.997 123 H SER 22 H SER 22 8.709 -6.871 0.258 124 HA SER 22 HA SER 22 11.430 -6.515 -0.645 125 HB2 SER 22 1HB SER 22 10.805 -8.309 0.959 126 HB3 SER 22 2HB SER 22 9.843 -9.059 -0.304 127 HG SER 22 HG SER 22 12.556 -9.079 0.090 128 H ASN 23 H ASN 23 8.340 -6.757 -2.025 129 HA ASN 23 HA ASN 23 8.975 -8.147 -4.423 130 HB2 ASN 23 1HB ASN 23 6.638 -7.714 -3.474 131 HB3 ASN 23 2HB ASN 23 6.776 -6.088 -4.129 132 HD21 ASN 23 1HD2 ASN 23 5.987 -9.238 -6.536 133 HD22 ASN 23 2HD2 ASN 23 6.346 -9.438 -4.854 134 H SER 24 H SER 24 9.587 -7.415 -6.389 135 HA SER 24 HA SER 24 11.230 -5.181 -6.590 136 HB2 SER 24 1HB SER 24 11.465 -7.022 -8.129 137 HB3 SER 24 2HB SER 24 9.829 -6.783 -8.736 138 HG SER 24 HG SER 24 12.140 -5.564 -9.465 139 H GLN 25 H GLN 25 7.799 -5.555 -7.295 140 HA GLN 25 HA GLN 25 7.391 -3.125 -8.636 141 HB2 GLN 25 1HB GLN 25 5.788 -5.079 -8.455 142 HB3 GLN 25 2HB GLN 25 5.430 -4.534 -6.817 143 HG2 GLN 25 1HG GLN 25 3.735 -3.710 -8.226 144 HG3 GLN 25 2HG GLN 25 4.764 -2.357 -7.764 145 HE21 GLN 25 1HE2 GLN 25 4.464 -3.520 -11.635 146 HE22 GLN 25 2HE2 GLN 25 3.825 -4.479 -10.346 147 H ALA 26 H ALA 26 7.050 -4.038 -5.233 148 HA ALA 26 HA ALA 26 6.242 -1.509 -4.286 149 HB1 ALA 26 1HB ALA 26 6.828 -2.409 -2.073 150 HB2 ALA 26 2HB ALA 26 7.605 -3.789 -2.852 151 HB3 ALA 26 3HB ALA 26 5.866 -3.543 -3.021 152 H ALA 27 H ALA 27 9.427 -3.121 -4.196 153 HA ALA 27 HA ALA 27 10.753 -1.058 -2.841 154 HB1 ALA 27 1HB ALA 27 12.824 -2.114 -3.599 155 HB2 ALA 27 2HB ALA 27 11.917 -3.066 -4.775 156 HB3 ALA 27 3HB ALA 27 11.661 -3.321 -3.049 157 H GLY 28 H GLY 28 10.255 -1.554 -6.319 158 HA2 GLY 28 1HA GLY 28 11.907 0.490 -7.271 159 HA3 GLY 28 2HA GLY 28 10.424 -0.046 -8.054 160 H LEU 29 H LEU 29 8.660 0.592 -5.980 161 HA LEU 29 HA LEU 29 8.264 3.408 -6.396 162 HB2 LEU 29 1HB LEU 29 6.865 1.410 -4.662 163 HB3 LEU 29 2HB LEU 29 6.296 3.022 -4.964 164 HG LEU 29 HG LEU 29 6.575 0.856 -7.040 165 HD11 LEU 29 1HD1 LEU 29 4.109 0.972 -7.087 166 HD12 LEU 29 2HD1 LEU 29 4.163 2.060 -5.700 167 HD13 LEU 29 3HD1 LEU 29 4.744 0.402 -5.545 168 HD21 LEU 29 1HD2 LEU 29 5.380 2.442 -8.503 169 HD22 LEU 29 2HD2 LEU 29 6.968 3.036 -8.019 170 HD23 LEU 29 3HD2 LEU 29 5.516 3.675 -7.248 171 H ILE 30 H ILE 30 8.890 1.328 -3.599 172 HA ILE 30 HA ILE 30 9.027 3.164 -1.553 173 HB ILE 30 HB ILE 30 10.659 0.676 -2.007 174 HG12 ILE 30 1HG1 ILE 30 8.168 1.203 -0.388 175 HG13 ILE 30 2HG1 ILE 30 8.202 0.421 -1.958 176 HG21 ILE 30 1HG2 ILE 30 10.180 1.932 0.671 177 HG22 ILE 30 2HG2 ILE 30 11.584 2.368 -0.305 178 HG23 ILE 30 3HG2 ILE 30 11.356 0.698 0.223 179 HD11 ILE 30 1HD1 ILE 30 9.434 -1.423 -1.044 180 HD12 ILE 30 2HD1 ILE 30 7.962 -1.144 -0.110 181 HD13 ILE 30 3HD1 ILE 30 9.522 -0.620 0.524 182 H GLN 31 H GLN 31 11.594 2.117 -3.721 183 HA GLN 31 HA GLN 31 13.531 3.799 -2.572 184 HB2 GLN 31 1HB GLN 31 13.411 2.178 -5.090 185 HB3 GLN 31 2HB GLN 31 14.836 3.129 -4.664 186 HG2 GLN 31 1HG GLN 31 14.981 1.852 -2.563 187 HG3 GLN 31 2HG GLN 31 13.593 0.906 -3.083 188 HE21 GLN 31 1HE2 GLN 31 16.732 0.408 -5.594 189 HE22 GLN 31 2HE2 GLN 31 16.060 1.970 -5.293 190 H GLN 32 H GLN 32 11.043 4.322 -4.911 191 HA GLN 32 HA GLN 32 12.263 6.650 -6.094 192 HB2 GLN 32 1HB GLN 32 9.451 5.582 -6.044 193 HB3 GLN 32 2HB GLN 32 9.800 7.176 -6.693 194 HG2 GLN 32 1HG GLN 32 11.021 4.606 -7.657 195 HG3 GLN 32 2HG GLN 32 9.657 5.438 -8.400 196 HE21 GLN 32 1HE2 GLN 32 12.991 6.302 -9.974 197 HE22 GLN 32 2HE2 GLN 32 12.311 4.793 -9.469 198 H LEU 33 H LEU 33 10.198 5.982 -3.365 199 HA LEU 33 HA LEU 33 9.695 8.782 -2.824 200 HB2 LEU 33 1HB LEU 33 9.118 6.592 -0.880 201 HB3 LEU 33 2HB LEU 33 8.213 8.058 -1.193 202 HG LEU 33 HG LEU 33 8.340 5.715 -3.090 203 HD11 LEU 33 1HD1 LEU 33 7.270 5.129 -0.958 204 HD12 LEU 33 2HD1 LEU 33 6.157 5.110 -2.321 205 HD13 LEU 33 3HD1 LEU 33 6.133 6.459 -1.186 206 HD21 LEU 33 1HD2 LEU 33 7.789 7.644 -4.320 207 HD22 LEU 33 2HD2 LEU 33 6.731 8.253 -3.044 208 HD23 LEU 33 3HD2 LEU 33 6.252 6.832 -3.985 209 H GLY 34 H GLY 34 11.990 6.397 -2.022 210 HA2 GLY 34 1HA GLY 34 13.909 6.495 -0.759 211 HA3 GLY 34 2HA GLY 34 13.522 8.170 -0.366 212 H LEU 35 H LEU 35 11.647 5.237 0.145 213 HA LEU 35 HA LEU 35 10.931 6.058 2.779 214 HB2 LEU 35 1HB LEU 35 10.358 3.701 1.069 215 HB3 LEU 35 2HB LEU 35 9.925 3.657 2.759 216 HG LEU 35 HG LEU 35 8.935 5.656 0.734 217 HD11 LEU 35 1HD1 LEU 35 8.015 3.447 0.377 218 HD12 LEU 35 2HD1 LEU 35 6.787 4.521 1.047 219 HD13 LEU 35 3HD1 LEU 35 7.578 3.333 2.081 220 HD21 LEU 35 1HD2 LEU 35 8.275 5.287 3.651 221 HD22 LEU 35 2HD2 LEU 35 7.379 6.320 2.539 222 HD23 LEU 35 3HD2 LEU 35 9.063 6.681 2.912 223 H SER 36 H SER 36 12.286 5.933 4.408 224 HA SER 36 HA SER 36 14.091 3.668 4.661 225 HB2 SER 36 1HB SER 36 13.805 6.161 6.356 226 HB3 SER 36 2HB SER 36 15.120 4.998 6.412 227 HG SER 36 HG SER 36 14.654 6.014 3.907 228 H GLY 37 H GLY 37 13.954 2.217 6.390 229 HA2 GLY 37 1HA GLY 37 13.118 1.523 8.515 230 HA3 GLY 37 2HA GLY 37 11.748 2.600 8.295 231 H VAL 38 H VAL 38 11.359 1.648 5.520 232 HA VAL 38 HA VAL 38 9.583 -0.528 6.126 233 HB VAL 38 HB VAL 38 10.325 0.628 3.428 234 HG11 VAL 38 1HG1 VAL 38 9.263 -1.533 3.244 235 HG12 VAL 38 2HG1 VAL 38 8.136 -0.275 2.740 236 HG13 VAL 38 3HG1 VAL 38 7.970 -1.025 4.328 237 HG21 VAL 38 1HG2 VAL 38 8.296 1.985 3.651 238 HG22 VAL 38 2HG2 VAL 38 9.475 2.369 4.905 239 HG23 VAL 38 3HG2 VAL 38 8.071 1.374 5.290 240 H GLY 39 H GLY 39 10.426 -2.494 6.447 241 HA2 GLY 39 1HA GLY 39 12.720 -3.380 4.853 242 HA3 GLY 39 2HA GLY 39 12.129 -4.143 6.323 243 H ALA 40 H ALA 40 12.364 -6.101 4.925 244 HA ALA 40 HA ALA 40 10.733 -6.351 2.604 245 HB1 ALA 40 1HB ALA 40 11.451 -8.725 2.645 246 HB2 ALA 40 2HB ALA 40 12.249 -8.414 4.186 247 HB3 ALA 40 3HB ALA 40 12.787 -7.578 2.730 248 H ASN 41 H ASN 41 10.291 -7.182 5.975 249 HA ASN 41 HA ASN 41 8.026 -8.890 5.439 250 HB2 ASN 41 1HB ASN 41 9.224 -7.853 8.011 251 HB3 ASN 41 2HB ASN 41 7.831 -8.923 7.946 252 HD21 ASN 41 1HD2 ASN 41 9.669 -11.803 7.240 253 HD22 ASN 41 2HD2 ASN 41 8.109 -11.059 7.267 254 H VAL 42 H VAL 42 8.310 -5.740 5.112 255 HA VAL 42 HA VAL 42 6.007 -4.861 6.635 256 HB VAL 42 HB VAL 42 7.715 -3.337 4.668 257 HG11 VAL 42 1HG1 VAL 42 5.682 -2.397 6.688 258 HG12 VAL 42 2HG1 VAL 42 5.626 -2.184 4.936 259 HG13 VAL 42 3HG1 VAL 42 6.854 -1.343 5.895 260 HG21 VAL 42 1HG2 VAL 42 8.669 -2.379 6.775 261 HG22 VAL 42 2HG2 VAL 42 9.093 -4.057 6.417 262 HG23 VAL 42 3HG2 VAL 42 7.858 -3.693 7.632 263 HA PRO 43 HA PRO 43 3.218 -5.623 3.276 264 HB2 PRO 43 2HB PRO 43 1.189 -4.063 4.426 265 HB3 PRO 43 1HB PRO 43 1.394 -5.795 4.591 266 HG2 PRO 43 2HG PRO 43 1.734 -3.792 6.572 267 HG3 PRO 43 1HG PRO 43 1.940 -5.540 6.746 268 HD2 PRO 43 2HD PRO 43 3.949 -3.464 6.555 269 HD3 PRO 43 1HD PRO 43 4.157 -5.171 6.966 270 H VAL 44 H VAL 44 2.722 -4.518 1.431 271 HA VAL 44 HA VAL 44 2.473 -1.610 1.609 272 HB VAL 44 HB VAL 44 3.833 -1.247 -0.390 273 HG11 VAL 44 1HG1 VAL 44 6.062 -1.696 0.600 274 HG12 VAL 44 2HG1 VAL 44 5.272 -2.674 1.840 275 HG13 VAL 44 3HG1 VAL 44 4.930 -0.948 1.727 276 HG21 VAL 44 1HG2 VAL 44 5.359 -3.114 -1.107 277 HG22 VAL 44 2HG2 VAL 44 3.665 -3.283 -1.560 278 HG23 VAL 44 3HG2 VAL 44 4.313 -4.201 -0.197 279 H GLY 45 H GLY 45 1.539 -0.685 -0.363 280 HA2 GLY 45 1HA GLY 45 -0.152 -2.654 -1.762 281 HA3 GLY 45 2HA GLY 45 -0.749 -1.082 -1.269 282 H ILE 46 H ILE 46 0.166 -2.768 -3.795 283 HA ILE 46 HA ILE 46 1.774 -0.818 -5.211 284 HB ILE 46 HB ILE 46 0.597 -3.499 -5.941 285 HG12 ILE 46 1HG1 ILE 46 2.793 -4.362 -5.931 286 HG13 ILE 46 2HG1 ILE 46 3.508 -2.784 -6.089 287 HG21 ILE 46 1HG2 ILE 46 0.464 -2.052 -7.900 288 HG22 ILE 46 2HG2 ILE 46 1.661 -3.328 -8.125 289 HG23 ILE 46 3HG2 ILE 46 2.184 -1.688 -7.750 290 HD11 ILE 46 1HD1 ILE 46 2.217 -3.866 -3.618 291 HD12 ILE 46 2HD1 ILE 46 2.988 -2.286 -3.780 292 HD13 ILE 46 3HD1 ILE 46 3.948 -3.757 -3.935 293 H ASN 47 H ASN 47 0.887 0.800 -6.384 294 HA ASN 47 HA ASN 47 -0.537 1.975 -7.730 295 HB2 ASN 47 1HB ASN 47 -0.308 -0.218 -9.039 296 HB3 ASN 47 2HB ASN 47 -1.848 -0.668 -8.344 297 HD21 ASN 47 1HD2 ASN 47 -2.118 2.670 -10.631 298 HD22 ASN 47 2HD2 ASN 47 -0.987 2.583 -9.331 299 H CYS 48 H CYS 48 -1.299 2.382 -5.286 300 HA CYS 48 HA CYS 48 -4.055 1.426 -4.993 301 HB2 CYS 48 2HB CYS 48 -1.973 1.481 -3.160 302 HB3 CYS 48 1HB CYS 48 -2.999 2.828 -2.698 303 H ASN 49 H ASN 49 -5.719 2.713 -5.066 304 HA ASN 49 HA ASN 49 -5.324 5.610 -4.715 305 HB2 ASN 49 1HB ASN 49 -7.297 5.888 -6.290 306 HB3 ASN 49 2HB ASN 49 -5.792 5.363 -7.031 307 HD21 ASN 49 1HD2 ASN 49 -7.021 2.287 -8.113 308 HD22 ASN 49 2HD2 ASN 49 -5.638 3.299 -7.865 309 HA PRO 50 HA PRO 50 -8.172 5.246 -1.442 310 HB2 PRO 50 2HB PRO 50 -9.110 7.970 -1.934 311 HB3 PRO 50 1HB PRO 50 -8.123 7.358 -0.604 312 HG2 PRO 50 2HG PRO 50 -7.126 8.994 -2.513 313 HG3 PRO 50 1HG PRO 50 -6.145 7.750 -1.718 314 HD2 PRO 50 2HD PRO 50 -7.485 7.678 -4.399 315 HD3 PRO 50 1HD PRO 50 -5.855 7.148 -3.948 316 H ILE 51 H ILE 51 -10.105 4.289 -1.384 317 HA ILE 51 HA ILE 51 -11.858 4.522 -3.677 318 HB ILE 51 HB ILE 51 -12.679 2.995 -1.255 319 HG12 ILE 51 1HG1 ILE 51 -10.514 2.106 -3.173 320 HG13 ILE 51 2HG1 ILE 51 -10.286 2.470 -1.468 321 HG21 ILE 51 1HG2 ILE 51 -13.536 1.459 -2.947 322 HG22 ILE 51 2HG2 ILE 51 -12.765 2.410 -4.217 323 HG23 ILE 51 3HG2 ILE 51 -14.084 3.104 -3.272 324 HD11 ILE 51 1HD1 ILE 51 -10.375 0.083 -1.843 325 HD12 ILE 51 2HD1 ILE 51 -11.965 0.247 -2.589 326 HD13 ILE 51 3HD1 ILE 51 -11.752 0.615 -0.878 327 H THR 52 H THR 52 -12.535 6.703 -3.437 328 HA THR 52 HA THR 52 -14.391 7.100 -1.187 329 HB THR 52 HB THR 52 -14.000 9.541 -1.472 330 HG1 THR 52 1HG THR 52 -12.353 10.235 -2.818 331 HG21 THR 52 1HG2 THR 52 -12.756 8.224 0.203 332 HG22 THR 52 2HG2 THR 52 -11.800 9.569 -0.422 333 HG23 THR 52 3HG2 THR 52 -11.489 7.928 -0.990 334 H GLY 53 H GLY 53 -14.491 6.181 -4.199 335 HA2 GLY 53 1HA GLY 53 -16.669 7.929 -5.073 336 HA3 GLY 53 2HA GLY 53 -15.900 6.670 -6.030 337 H ILE 54 H ILE 54 -17.822 7.048 -3.068 338 HA ILE 54 HA ILE 54 -18.804 4.390 -3.093 339 HB ILE 54 HB ILE 54 -19.719 6.866 -1.638 340 HG12 ILE 54 1HG1 ILE 54 -19.021 5.474 0.351 341 HG13 ILE 54 2HG1 ILE 54 -18.388 4.291 -0.783 342 HG21 ILE 54 1HG2 ILE 54 -21.321 5.517 -0.408 343 HG22 ILE 54 2HG2 ILE 54 -20.905 4.106 -1.379 344 HG23 ILE 54 3HG2 ILE 54 -21.694 5.492 -2.133 345 HD11 ILE 54 1HD1 ILE 54 -16.820 5.949 -1.640 346 HD12 ILE 54 2HD1 ILE 54 -16.626 5.704 0.096 347 HD13 ILE 54 3HD1 ILE 54 -17.459 7.139 -0.504 348 H GLY 55 H GLY 55 -20.164 3.556 -4.478 349 HA2 GLY 55 1HA GLY 55 -22.667 4.007 -5.094 350 HA3 GLY 55 2HA GLY 55 -21.930 5.316 -6.005 351 H ALA 56 H ALA 56 -21.003 1.946 -5.446 352 HA ALA 56 HA ALA 56 -21.231 1.389 -8.294 353 HB1 ALA 56 1HB ALA 56 -18.951 2.255 -8.006 354 HB2 ALA 56 2HB ALA 56 -18.952 0.553 -8.466 355 HB3 ALA 56 3HB ALA 56 -18.639 1.014 -6.793 356 H GLY 57 H GLY 57 -22.935 0.404 -6.537 357 HA2 GLY 57 1HA GLY 57 -23.764 -1.851 -6.536 358 HA3 GLY 57 2HA GLY 57 -22.111 -2.415 -6.347 359 H SER 58 H SER 58 -21.107 -2.267 -4.315 360 HA SER 58 HA SER 58 -23.009 -2.466 -2.127 361 HB2 SER 58 1HB SER 58 -20.033 -3.004 -2.137 362 HB3 SER 58 2HB SER 58 -21.189 -3.482 -0.894 363 HG SER 58 HG SER 58 -20.619 -5.154 -2.436 364 H GLY 59 H GLY 59 -21.508 0.058 -3.456 365 HA2 GLY 59 1HA GLY 59 -21.556 2.201 -2.330 366 HA3 GLY 59 2HA GLY 59 -21.057 1.377 -0.857 367 H SER 60 H SER 60 -18.922 1.062 -0.454 368 HA SER 60 HA SER 60 -17.044 2.179 -2.412 369 HB2 SER 60 1HB SER 60 -16.952 3.105 -0.114 370 HB3 SER 60 2HB SER 60 -16.619 1.493 0.515 371 HG SER 60 HG SER 60 -14.897 3.285 -0.435 372 H SER 61 H SER 61 -15.955 0.791 -3.651 373 HA SER 61 HA SER 61 -15.271 -1.842 -2.611 374 HB2 SER 61 1HB SER 61 -17.470 -2.118 -3.713 375 HB3 SER 61 2HB SER 61 -16.800 -1.448 -5.197 376 HG SER 61 HG SER 61 -15.761 -3.756 -3.910 377 H CYS 62 H CYS 62 -13.466 -2.732 -3.534 378 HA CYS 62 HA CYS 62 -11.939 -0.948 -5.281 379 HB2 CYS 62 2HB CYS 62 -10.810 -1.563 -3.230 380 HB3 CYS 62 1HB CYS 62 -11.088 -3.273 -3.547 381 H ASN 63 H ASN 63 -11.228 -1.547 -7.237 382 HA ASN 63 HA ASN 63 -12.527 -3.688 -8.593 383 HB2 ASN 63 1HB ASN 63 -12.008 -1.618 -9.760 384 HB3 ASN 63 2HB ASN 63 -10.290 -1.835 -9.442 385 HD21 ASN 63 1HD2 ASN 63 -9.720 -3.885 -12.174 386 HD22 ASN 63 2HD2 ASN 63 -9.096 -3.081 -10.774 387 H ALA 64 H ALA 64 -9.524 -3.354 -6.927 388 HA ALA 64 HA ALA 64 -8.732 -6.008 -7.909 389 HB1 ALA 64 1HB ALA 64 -7.252 -4.245 -8.763 390 HB2 ALA 64 2HB ALA 64 -6.406 -5.383 -7.713 391 HB3 ALA 64 3HB ALA 64 -6.858 -3.789 -7.105 392 H ASN 65 H ASN 65 -7.067 -4.241 -5.366 393 HA ASN 65 HA ASN 65 -8.189 -6.110 -3.380 394 HB2 ASN 65 1HB ASN 65 -5.291 -5.321 -3.599 395 HB3 ASN 65 2HB ASN 65 -5.971 -6.399 -2.399 396 HD21 ASN 65 1HD2 ASN 65 -5.114 -7.687 -6.149 397 HD22 ASN 65 2HD2 ASN 65 -5.042 -6.018 -5.715 398 HA PRO 66 HA PRO 66 -8.618 -2.156 -1.317 399 HB2 PRO 66 2HB PRO 66 -10.358 -2.983 0.549 400 HB3 PRO 66 1HB PRO 66 -10.844 -2.771 -1.137 401 HG2 PRO 66 2HG PRO 66 -10.197 -5.279 0.349 402 HG3 PRO 66 1HG PRO 66 -11.469 -4.986 -0.852 403 HD2 PRO 66 2HD PRO 66 -9.026 -6.204 -1.379 404 HD3 PRO 66 1HD PRO 66 -10.051 -5.431 -2.600 405 H ALA 67 H ALA 67 -7.452 -1.288 0.335 406 HA ALA 67 HA ALA 67 -6.472 -3.060 2.448 407 HB1 ALA 67 1HB ALA 67 -4.794 -3.148 0.669 408 HB2 ALA 67 2HB ALA 67 -4.166 -2.373 2.123 409 HB3 ALA 67 3HB ALA 67 -4.640 -1.393 0.735 410 H CYS 68 H CYS 68 -5.579 -2.001 4.244 411 HA CYS 68 HA CYS 68 -6.102 0.893 4.422 412 HB2 CYS 68 2HB CYS 68 -7.375 -0.360 6.084 413 HB3 CYS 68 1HB CYS 68 -5.916 -1.184 6.620 414 H CYS 69 H CYS 69 -4.327 2.137 4.502 415 HA CYS 69 HA CYS 69 -1.788 0.784 5.083 416 HB2 CYS 69 2HB CYS 69 -2.136 3.113 3.210 417 HB3 CYS 69 1HB CYS 69 -0.746 2.070 3.403 418 H ASP 70 H ASP 70 -0.143 2.022 6.051 419 HA ASP 70 HA ASP 70 -1.053 3.937 7.971 420 HB2 ASP 70 1HB ASP 70 0.774 2.353 8.454 421 HB3 ASP 70 2HB ASP 70 1.767 3.120 7.220 422 H ASN 71 H ASN 71 1.104 4.087 5.155 423 HA ASN 71 HA ASN 71 0.111 6.774 4.587 424 HB2 ASN 71 1HB ASN 71 3.083 6.166 4.556 425 HB3 ASN 71 2HB ASN 71 2.321 7.689 4.130 426 HD21 ASN 71 1HD2 ASN 71 3.278 6.814 7.922 427 HD22 ASN 71 2HD2 ASN 71 3.578 5.739 6.599 428 H VAL 72 H VAL 72 -0.401 6.861 2.447 429 HA VAL 72 HA VAL 72 1.241 5.226 0.659 430 HB VAL 72 HB VAL 72 -0.543 3.949 0.249 431 HG11 VAL 72 1HG1 VAL 72 -2.896 4.639 0.684 432 HG12 VAL 72 2HG1 VAL 72 -2.261 6.159 1.318 433 HG13 VAL 72 3HG1 VAL 72 -1.827 4.626 2.084 434 HG21 VAL 72 1HG2 VAL 72 -1.993 4.688 -1.546 435 HG22 VAL 72 2HG2 VAL 72 -0.335 5.222 -1.830 436 HG23 VAL 72 3HG2 VAL 72 -1.541 6.366 -1.243 437 H TYR 73 H TYR 73 1.897 6.079 -1.169 438 HA TYR 73 HA TYR 73 1.785 9.005 -1.157 439 HB2 TYR 73 2HB TYR 73 3.866 7.070 -2.199 440 HB3 TYR 73 1HB TYR 73 4.016 8.823 -2.225 441 HD1 TYR 73 1HD TYR 73 3.731 5.892 0.034 442 HD2 TYR 73 2HD TYR 73 4.764 10.007 -0.306 443 HE1 TYR 73 1HE TYR 73 4.641 5.838 2.319 444 HE2 TYR 73 2HE TYR 73 5.688 9.963 1.973 445 HH TYR 73 HH TYR 73 5.439 8.652 4.040 446 H THR 74 H THR 74 2.150 10.028 -3.328 447 HA THR 74 HA THR 74 -0.174 9.347 -4.798 448 HB THR 74 HB THR 74 1.909 11.400 -5.533 449 HG1 THR 74 1HG THR 74 0.201 11.230 -3.395 450 HG21 THR 74 1HG2 THR 74 0.181 10.973 -7.248 451 HG22 THR 74 2HG2 THR 74 0.039 12.588 -6.552 452 HG23 THR 74 3HG2 THR 74 -1.069 11.311 -6.051 453 H ASN 75 H ASN 75 3.123 8.470 -5.213 454 HA ASN 75 HA ASN 75 3.012 7.802 -7.974 455 HB2 ASN 75 1HB ASN 75 4.911 6.347 -7.541 456 HB3 ASN 75 2HB ASN 75 5.137 7.856 -6.666 457 HD21 ASN 75 1HD2 ASN 75 5.824 4.780 -4.582 458 HD22 ASN 75 2HD2 ASN 75 6.229 5.160 -6.216 459 H GLY 76 H GLY 76 1.616 6.537 -5.150 460 HA2 GLY 76 1HA GLY 76 -0.287 5.114 -5.326 461 HA3 GLY 76 2HA GLY 76 0.482 4.308 -6.687 462 H LEU 77 H LEU 77 2.585 4.998 -4.039 463 HA LEU 77 HA LEU 77 2.620 2.131 -3.422 464 HB2 LEU 77 1HB LEU 77 4.697 3.273 -4.114 465 HB3 LEU 77 2HB LEU 77 4.563 4.328 -2.732 466 HG LEU 77 HG LEU 77 6.237 2.382 -2.611 467 HD11 LEU 77 1HD1 LEU 77 5.813 1.980 -0.243 468 HD12 LEU 77 2HD1 LEU 77 4.204 2.696 -0.415 469 HD13 LEU 77 3HD1 LEU 77 5.641 3.687 -0.660 470 HD21 LEU 77 1HD2 LEU 77 5.380 0.253 -1.906 471 HD22 LEU 77 2HD2 LEU 77 4.711 0.674 -3.482 472 HD23 LEU 77 3HD2 LEU 77 3.720 0.842 -2.028 473 H GLY 78 H GLY 78 1.644 1.435 -1.646 474 HA2 GLY 78 1HA GLY 78 1.225 3.364 0.535 475 HA3 GLY 78 2HA GLY 78 0.237 1.942 0.259 476 H VAL 79 H VAL 79 1.971 3.029 2.512 477 HA VAL 79 HA VAL 79 3.731 0.720 2.962 478 HB VAL 79 HB VAL 79 3.420 3.222 4.651 479 HG11 VAL 79 1HG1 VAL 79 4.367 1.338 5.855 480 HG12 VAL 79 2HG1 VAL 79 5.594 2.573 5.579 481 HG13 VAL 79 3HG1 VAL 79 5.574 1.113 4.590 482 HG21 VAL 79 1HG2 VAL 79 4.186 3.782 2.391 483 HG22 VAL 79 2HG2 VAL 79 5.542 2.671 2.595 484 HG23 VAL 79 3HG2 VAL 79 5.402 4.096 3.629 485 H GLN 80 H GLN 80 3.272 -0.769 4.467 486 HA GLN 80 HA GLN 80 2.140 -1.995 5.980 487 HB2 GLN 80 1HB GLN 80 1.635 0.781 7.024 488 HB3 GLN 80 2HB GLN 80 0.974 -0.632 7.836 489 HG2 GLN 80 1HG GLN 80 3.872 -0.395 7.202 490 HG3 GLN 80 2HG GLN 80 3.186 0.295 8.676 491 HE21 GLN 80 1HE2 GLN 80 4.435 -3.199 9.209 492 HE22 GLN 80 2HE2 GLN 80 5.136 -1.789 8.494 493 H CYS 81 H CYS 81 0.929 -1.939 3.694 494 HA CYS 81 HA CYS 81 -1.847 -1.127 4.024 495 HB2 CYS 81 2HB CYS 81 -0.432 -2.382 1.667 496 HB3 CYS 81 1HB CYS 81 -2.134 -1.960 1.695 497 H ASN 82 H ASN 82 -2.894 -2.410 5.340 498 HA ASN 82 HA ASN 82 -2.611 -5.308 5.025 499 HB2 ASN 82 1HB ASN 82 -4.069 -5.461 7.046 500 HB3 ASN 82 2HB ASN 82 -2.551 -4.624 7.313 501 HD21 ASN 82 1HD2 ASN 82 -4.017 -1.596 8.198 502 HD22 ASN 82 2HD2 ASN 82 -2.570 -2.455 7.811 503 HA PRO 83 HA PRO 83 -6.046 -5.574 2.345 504 HB2 PRO 83 2HB PRO 83 -6.506 -8.273 3.437 505 HB3 PRO 83 1HB PRO 83 -6.090 -7.783 1.793 506 HG2 PRO 83 2HG PRO 83 -4.320 -9.016 3.386 507 HG3 PRO 83 1HG PRO 83 -3.824 -7.767 2.229 508 HD2 PRO 83 2HD PRO 83 -4.210 -7.560 5.191 509 HD3 PRO 83 1HD PRO 83 -2.955 -6.843 4.162 510 H ILE 84 H ILE 84 -8.080 -4.929 2.498 511 HA ILE 84 HA ILE 84 -9.494 -4.983 5.023 512 HB ILE 84 HB ILE 84 -10.429 -4.126 2.297 513 HG12 ILE 84 1HG1 ILE 84 -8.603 -2.724 3.032 514 HG13 ILE 84 2HG1 ILE 84 -10.108 -1.826 3.160 515 HG21 ILE 84 1HG2 ILE 84 -12.249 -2.983 3.426 516 HG22 ILE 84 2HG2 ILE 84 -11.689 -3.615 4.972 517 HG23 ILE 84 3HG2 ILE 84 -12.295 -4.719 3.737 518 HD11 ILE 84 1HD1 ILE 84 -8.737 -1.406 5.081 519 HD12 ILE 84 2HD1 ILE 84 -8.613 -3.133 5.408 520 HD13 ILE 84 3HD1 ILE 84 -10.168 -2.317 5.562 521 H ASN 85 H ASN 85 -11.183 -6.205 5.533 522 HA ASN 85 HA ASN 85 -11.397 -8.718 4.161 523 HB2 ASN 85 1HB ASN 85 -11.424 -8.586 6.627 524 HB3 ASN 85 2HB ASN 85 -12.922 -7.671 6.551 525 HD21 ASN 85 1HD2 ASN 85 -13.386 -11.408 7.115 526 HD22 ASN 85 2HD2 ASN 85 -12.247 -10.281 7.770 527 H VAL 86 H VAL 86 -12.404 -8.632 2.312 528 HA VAL 86 HA VAL 86 -15.113 -7.510 2.222 529 HB VAL 86 HB VAL 86 -14.611 -7.047 -0.251 530 HG11 VAL 86 1HG1 VAL 86 -13.545 -4.897 0.222 531 HG12 VAL 86 2HG1 VAL 86 -13.090 -5.476 1.825 532 HG13 VAL 86 3HG1 VAL 86 -14.793 -5.267 1.413 533 HG21 VAL 86 1HG2 VAL 86 -12.281 -6.754 -0.873 534 HG22 VAL 86 2HG2 VAL 86 -12.571 -8.419 -0.371 535 HG23 VAL 86 3HG2 VAL 86 -11.767 -7.295 0.724 536 H ASN 87 H ASN 87 -15.962 -9.496 2.638 537 HA ASN 87 HA ASN 87 -16.794 -11.573 2.257 538 HB2 ASN 87 1HB ASN 87 -17.256 -10.898 -0.042 539 HB3 ASN 87 2HB ASN 87 -15.597 -11.240 -0.507 540 HD21 ASN 87 1HD2 ASN 87 -16.114 -14.631 -1.022 541 HD22 ASN 87 2HD2 ASN 87 -15.006 -13.302 -0.983 542 H LEU 88 H LEU 88 -13.606 -10.741 2.233 543 HA LEU 88 HA LEU 88 -11.643 -11.699 2.703 544 HB2 LEU 88 1HB LEU 88 -13.035 -12.381 4.681 545 HB3 LEU 88 2HB LEU 88 -13.278 -13.930 3.896 546 HG LEU 88 HG LEU 88 -10.820 -14.268 3.909 547 HD11 LEU 88 1HD1 LEU 88 -10.836 -11.751 5.559 548 HD12 LEU 88 2HD1 LEU 88 -10.069 -11.982 3.988 549 HD13 LEU 88 3HD1 LEU 88 -9.464 -12.846 5.401 550 HD21 LEU 88 1HD2 LEU 88 -12.073 -13.772 6.605 551 HD22 LEU 88 2HD2 LEU 88 -10.655 -14.774 6.293 552 HD23 LEU 88 3HD2 LEU 88 -12.226 -15.244 5.646 Start of MODEL 9 1 H1 GLY 1 1H GLY 1 -15.339 7.544 8.240 2 H2 GLY 1 2H GLY 1 -14.182 8.779 8.212 3 H3 GLY 1 3H GLY 1 -13.729 7.207 8.638 4 HA2 GLY 1 1HA GLY 1 -13.034 7.728 6.390 5 HA3 GLY 1 2HA GLY 1 -14.197 6.411 6.431 6 H SER 2 H SER 2 -13.496 8.392 4.311 7 HA SER 2 HA SER 2 -15.965 9.899 4.035 8 HB2 SER 2 1HB SER 2 -14.817 10.663 1.879 9 HB3 SER 2 2HB SER 2 -14.039 11.124 3.394 10 HG SER 2 HG SER 2 -12.500 10.302 1.965 11 H GLY 3 H GLY 3 -14.138 7.623 1.970 12 HA2 GLY 3 1HA GLY 3 -16.543 7.047 0.443 13 HA3 GLY 3 2HA GLY 3 -14.931 6.421 0.132 14 H SER 4 H SER 4 -14.655 5.566 2.958 15 HA SER 4 HA SER 4 -16.680 3.512 3.255 16 HB2 SER 4 1HB SER 4 -15.122 2.426 1.742 17 HB3 SER 4 2HB SER 4 -13.767 2.862 2.778 18 HG SER 4 HG SER 4 -15.886 1.064 3.370 19 H SER 5 H SER 5 -16.531 2.411 5.306 20 HA SER 5 HA SER 5 -15.531 4.222 7.351 21 HB2 SER 5 1HB SER 5 -17.386 1.847 7.473 22 HB3 SER 5 2HB SER 5 -16.905 2.803 8.870 23 HG SER 5 HG SER 5 -18.256 3.767 6.556 24 H GLN 6 H GLN 6 -14.152 1.839 5.747 25 HA GLN 6 HA GLN 6 -12.996 0.412 7.973 26 HB2 GLN 6 1HB GLN 6 -12.151 0.310 5.097 27 HB3 GLN 6 2HB GLN 6 -11.774 -0.862 6.344 28 HG2 GLN 6 1HG GLN 6 -14.523 -0.295 5.260 29 HG3 GLN 6 2HG GLN 6 -13.495 -1.640 4.779 30 HE21 GLN 6 1HE2 GLN 6 -13.810 -2.862 8.334 31 HE22 GLN 6 2HE2 GLN 6 -12.507 -2.125 7.471 32 H CYS 7 H CYS 7 -10.646 0.319 8.248 33 HA CYS 7 HA CYS 7 -8.552 1.100 8.443 34 HB2 CYS 7 2HB CYS 7 -9.262 3.078 6.313 35 HB3 CYS 7 1HB CYS 7 -7.658 2.453 6.714 36 H ASN 8 H ASN 8 -8.219 2.050 10.336 37 HA ASN 8 HA ASN 8 -9.477 4.607 10.945 38 HB2 ASN 8 1HB ASN 8 -9.558 2.939 12.695 39 HB3 ASN 8 2HB ASN 8 -7.808 2.746 12.646 40 HD21 ASN 8 1HD2 ASN 8 -9.518 5.835 14.656 41 HD22 ASN 8 2HD2 ASN 8 -10.439 4.816 13.606 42 H ALA 9 H ALA 9 -6.271 3.289 10.328 43 HA ALA 9 HA ALA 9 -4.963 5.735 11.157 44 HB1 ALA 9 1HB ALA 9 -3.790 3.282 9.853 45 HB2 ALA 9 2HB ALA 9 -3.886 3.584 11.586 46 HB3 ALA 9 3HB ALA 9 -2.881 4.612 10.566 47 H GLY 10 H GLY 10 -6.796 5.332 8.645 48 HA2 GLY 10 1HA GLY 10 -5.946 7.441 7.147 49 HA3 GLY 10 2HA GLY 10 -5.085 6.068 6.463 50 HA PRO 11 HA PRO 11 -9.417 6.243 4.663 51 HB2 PRO 11 2HB PRO 11 -8.838 6.990 2.154 52 HB3 PRO 11 1HB PRO 11 -9.042 8.184 3.443 53 HG2 PRO 11 2HG PRO 11 -6.521 7.025 2.322 54 HG3 PRO 11 1HG PRO 11 -6.909 8.725 2.654 55 HD2 PRO 11 2HD PRO 11 -5.441 7.201 4.356 56 HD3 PRO 11 1HD PRO 11 -6.513 8.500 4.920 57 H VAL 12 H VAL 12 -10.230 4.826 3.032 58 HA VAL 12 HA VAL 12 -8.891 2.333 2.940 59 HB VAL 12 HB VAL 12 -10.758 1.730 1.298 60 HG11 VAL 12 1HG1 VAL 12 -11.556 2.806 3.997 61 HG12 VAL 12 2HG1 VAL 12 -10.798 1.242 3.711 62 HG13 VAL 12 3HG1 VAL 12 -12.404 1.573 3.064 63 HG21 VAL 12 1HG2 VAL 12 -11.176 4.067 0.558 64 HG22 VAL 12 2HG2 VAL 12 -11.822 4.422 2.161 65 HG23 VAL 12 3HG2 VAL 12 -12.628 3.245 1.126 66 H GLN 13 H GLN 13 -7.633 1.435 1.419 67 HA GLN 13 HA GLN 13 -7.148 3.045 -0.996 68 HB2 GLN 13 1HB GLN 13 -5.269 1.062 0.293 69 HB3 GLN 13 2HB GLN 13 -4.923 2.104 -1.073 70 HG2 GLN 13 1HG GLN 13 -5.531 3.025 1.717 71 HG3 GLN 13 2HG GLN 13 -3.937 2.941 0.973 72 HE21 GLN 13 1HE2 GLN 13 -5.607 6.358 0.742 73 HE22 GLN 13 2HE2 GLN 13 -5.563 5.207 2.033 74 H CYS 14 H CYS 14 -7.219 2.138 -2.949 75 HA CYS 14 HA CYS 14 -7.797 -0.741 -3.082 76 HB2 CYS 14 2HB CYS 14 -9.632 0.588 -3.990 77 HB3 CYS 14 1HB CYS 14 -8.528 1.422 -5.077 78 H CYS 15 H CYS 15 -6.112 -1.862 -3.610 79 HA CYS 15 HA CYS 15 -3.942 -0.560 -5.103 80 HB2 CYS 15 2HB CYS 15 -3.754 -2.857 -3.151 81 HB3 CYS 15 1HB CYS 15 -2.419 -1.929 -3.834 82 H ASN 16 H ASN 16 -3.038 -1.530 -6.802 83 HA ASN 16 HA ASN 16 -4.472 -3.469 -8.271 84 HB2 ASN 16 1HB ASN 16 -2.802 -1.704 -9.100 85 HB3 ASN 16 2HB ASN 16 -1.564 -2.863 -8.661 86 HD21 ASN 16 1HD2 ASN 16 -1.796 -4.016 -11.934 87 HD22 ASN 16 2HD2 ASN 16 -0.860 -3.164 -10.755 88 H THR 17 H THR 17 -1.740 -3.631 -6.111 89 HA THR 17 HA THR 17 -2.035 -6.522 -5.940 90 HB THR 17 HB THR 17 0.587 -5.189 -6.675 91 HG1 THR 17 1HG THR 17 -1.388 -6.403 -8.099 92 HG21 THR 17 1HG2 THR 17 1.494 -7.505 -6.676 93 HG22 THR 17 2HG2 THR 17 -0.002 -8.051 -5.919 94 HG23 THR 17 3HG2 THR 17 1.055 -6.919 -5.070 95 H LEU 18 H LEU 18 -2.127 -7.000 -3.832 96 HA LEU 18 HA LEU 18 -0.642 -5.323 -1.941 97 HB2 LEU 18 1HB LEU 18 -2.749 -7.439 -1.539 98 HB3 LEU 18 2HB LEU 18 -1.810 -6.784 -0.213 99 HG LEU 18 HG LEU 18 -3.641 -5.207 -2.011 100 HD11 LEU 18 1HD1 LEU 18 -4.763 -6.748 -0.412 101 HD12 LEU 18 2HD1 LEU 18 -5.096 -5.044 -0.111 102 HD13 LEU 18 3HD1 LEU 18 -3.941 -5.909 0.906 103 HD21 LEU 18 1HD2 LEU 18 -1.770 -3.855 -1.273 104 HD22 LEU 18 2HD2 LEU 18 -2.028 -4.368 0.395 105 HD23 LEU 18 3HD2 LEU 18 -3.235 -3.375 -0.420 106 H THR 19 H THR 19 1.343 -5.885 -1.625 107 HA THR 19 HA THR 19 2.034 -8.668 -1.169 108 HB THR 19 HB THR 19 2.430 -8.485 -3.540 109 HG1 THR 19 1HG THR 19 4.275 -9.470 -3.363 110 HG21 THR 19 1HG2 THR 19 4.001 -5.993 -2.900 111 HG22 THR 19 2HG2 THR 19 2.569 -6.138 -3.924 112 HG23 THR 19 3HG2 THR 19 4.101 -6.835 -4.445 113 H SER 20 H SER 20 4.765 -8.406 -0.889 114 HA SER 20 HA SER 20 4.882 -6.582 1.406 115 HB2 SER 20 1HB SER 20 6.973 -8.008 1.923 116 HB3 SER 20 2HB SER 20 5.393 -8.770 2.108 117 HG SER 20 HG SER 20 7.434 -9.402 0.431 118 H ALA 21 H ALA 21 7.041 -5.576 1.830 119 HA ALA 21 HA ALA 21 7.707 -3.956 -0.399 120 HB1 ALA 21 1HB ALA 21 9.276 -2.872 1.101 121 HB2 ALA 21 2HB ALA 21 9.093 -4.186 2.264 122 HB3 ALA 21 3HB ALA 21 7.725 -3.135 1.898 123 H SER 22 H SER 22 8.778 -7.025 0.404 124 HA SER 22 HA SER 22 11.420 -6.856 -0.593 125 HB2 SER 22 1HB SER 22 11.075 -9.374 -0.632 126 HB3 SER 22 2HB SER 22 10.906 -8.600 0.928 127 HG SER 22 HG SER 22 9.097 -10.004 -0.518 128 H ASN 23 H ASN 23 8.337 -6.836 -2.017 129 HA ASN 23 HA ASN 23 8.953 -8.203 -4.456 130 HB2 ASN 23 1HB ASN 23 6.622 -7.762 -3.469 131 HB3 ASN 23 2HB ASN 23 6.782 -6.127 -4.093 132 HD21 ASN 23 1HD2 ASN 23 6.007 -9.234 -6.572 133 HD22 ASN 23 2HD2 ASN 23 6.421 -9.481 -4.910 134 H SER 24 H SER 24 9.654 -7.406 -6.362 135 HA SER 24 HA SER 24 11.315 -5.162 -6.379 136 HB2 SER 24 1HB SER 24 11.538 -7.094 -7.917 137 HB3 SER 24 2HB SER 24 10.086 -6.566 -8.764 138 HG SER 24 HG SER 24 11.579 -5.592 -9.932 139 H GLN 25 H GLN 25 7.925 -5.501 -7.186 140 HA GLN 25 HA GLN 25 7.596 -3.039 -8.523 141 HB2 GLN 25 1HB GLN 25 5.933 -4.907 -8.527 142 HB3 GLN 25 2HB GLN 25 5.580 -4.545 -6.836 143 HG2 GLN 25 1HG GLN 25 3.900 -3.554 -8.160 144 HG3 GLN 25 2HG GLN 25 4.927 -2.279 -7.509 145 HE21 GLN 25 1HE2 GLN 25 5.797 -3.069 -11.403 146 HE22 GLN 25 2HE2 GLN 25 5.845 -4.312 -10.203 147 H ALA 26 H ALA 26 7.076 -4.045 -5.174 148 HA ALA 26 HA ALA 26 6.246 -1.546 -4.183 149 HB1 ALA 26 1HB ALA 26 6.742 -2.501 -1.977 150 HB2 ALA 26 2HB ALA 26 7.562 -3.855 -2.756 151 HB3 ALA 26 3HB ALA 26 5.832 -3.617 -2.994 152 H ALA 27 H ALA 27 9.430 -3.160 -3.919 153 HA ALA 27 HA ALA 27 10.673 -1.010 -2.591 154 HB1 ALA 27 1HB ALA 27 11.920 -3.162 -4.297 155 HB2 ALA 27 2HB ALA 27 11.631 -3.239 -2.559 156 HB3 ALA 27 3HB ALA 27 12.795 -2.085 -3.211 157 H GLY 28 H GLY 28 10.161 -1.637 -6.013 158 HA2 GLY 28 1HA GLY 28 11.831 0.347 -7.072 159 HA3 GLY 28 2HA GLY 28 10.300 -0.164 -7.778 160 H LEU 29 H LEU 29 8.412 0.572 -6.196 161 HA LEU 29 HA LEU 29 8.093 3.347 -6.394 162 HB2 LEU 29 1HB LEU 29 6.749 1.371 -4.593 163 HB3 LEU 29 2HB LEU 29 6.170 2.975 -4.899 164 HG LEU 29 HG LEU 29 6.390 0.785 -6.956 165 HD11 LEU 29 1HD1 LEU 29 4.034 1.999 -5.525 166 HD12 LEU 29 2HD1 LEU 29 4.608 0.333 -5.413 167 HD13 LEU 29 3HD1 LEU 29 3.913 0.925 -6.921 168 HD21 LEU 29 1HD2 LEU 29 5.301 3.593 -7.168 169 HD22 LEU 29 2HD2 LEU 29 5.157 2.346 -8.406 170 HD23 LEU 29 3HD2 LEU 29 6.746 2.967 -7.963 171 H ILE 30 H ILE 30 8.774 1.343 -3.542 172 HA ILE 30 HA ILE 30 8.939 3.267 -1.574 173 HB ILE 30 HB ILE 30 10.537 0.745 -1.935 174 HG12 ILE 30 1HG1 ILE 30 8.145 1.367 -0.208 175 HG13 ILE 30 2HG1 ILE 30 8.052 0.588 -1.780 176 HG21 ILE 30 1HG2 ILE 30 11.606 2.431 -0.379 177 HG22 ILE 30 2HG2 ILE 30 11.231 0.855 0.321 178 HG23 ILE 30 3HG2 ILE 30 10.187 2.234 0.652 179 HD11 ILE 30 1HD1 ILE 30 7.891 -0.980 0.079 180 HD12 ILE 30 2HD1 ILE 30 9.504 -0.502 0.611 181 HD13 ILE 30 3HD1 ILE 30 9.288 -1.298 -0.950 182 H GLN 31 H GLN 31 11.508 2.107 -3.695 183 HA GLN 31 HA GLN 31 13.436 3.884 -2.718 184 HB2 GLN 31 1HB GLN 31 13.210 2.139 -5.129 185 HB3 GLN 31 2HB GLN 31 14.593 3.220 -4.940 186 HG2 GLN 31 1HG GLN 31 15.004 2.114 -2.742 187 HG3 GLN 31 2HG GLN 31 13.720 0.983 -3.149 188 HE21 GLN 31 1HE2 GLN 31 15.606 -0.906 -5.375 189 HE22 GLN 31 2HE2 GLN 31 14.037 -0.529 -4.752 190 H GLN 32 H GLN 32 10.904 4.230 -5.087 191 HA GLN 32 HA GLN 32 12.009 6.501 -6.424 192 HB2 GLN 32 1HB GLN 32 9.146 5.602 -6.080 193 HB3 GLN 32 2HB GLN 32 9.629 6.953 -7.092 194 HG2 GLN 32 1HG GLN 32 10.531 4.113 -7.469 195 HG3 GLN 32 2HG GLN 32 9.182 4.864 -8.313 196 HE21 GLN 32 1HE2 GLN 32 11.466 5.482 -10.860 197 HE22 GLN 32 2HE2 GLN 32 10.115 4.551 -10.310 198 H LEU 33 H LEU 33 9.946 6.016 -3.645 199 HA LEU 33 HA LEU 33 9.532 8.831 -3.184 200 HB2 LEU 33 1HB LEU 33 9.049 6.721 -1.125 201 HB3 LEU 33 2HB LEU 33 8.133 8.181 -1.443 202 HG LEU 33 HG LEU 33 8.156 5.775 -3.260 203 HD11 LEU 33 1HD1 LEU 33 6.006 6.585 -1.322 204 HD12 LEU 33 2HD1 LEU 33 7.199 5.325 -1.008 205 HD13 LEU 33 3HD1 LEU 33 6.065 5.147 -2.342 206 HD21 LEU 33 1HD2 LEU 33 6.040 6.871 -4.089 207 HD22 LEU 33 2HD2 LEU 33 7.558 7.676 -4.512 208 HD23 LEU 33 3HD2 LEU 33 6.554 8.316 -3.207 209 H GLY 34 H GLY 34 11.772 6.399 -2.294 210 HA2 GLY 34 1HA GLY 34 13.773 6.548 -1.153 211 HA3 GLY 34 2HA GLY 34 13.428 8.245 -0.837 212 H LEU 35 H LEU 35 11.387 5.495 -0.090 213 HA LEU 35 HA LEU 35 10.911 6.435 2.549 214 HB2 LEU 35 1HB LEU 35 10.092 4.056 0.973 215 HB3 LEU 35 2HB LEU 35 9.779 4.088 2.690 216 HG LEU 35 HG LEU 35 8.747 6.058 0.657 217 HD11 LEU 35 1HD1 LEU 35 6.581 5.067 1.157 218 HD12 LEU 35 2HD1 LEU 35 7.353 3.919 2.250 219 HD13 LEU 35 3HD1 LEU 35 7.702 3.863 0.523 220 HD21 LEU 35 1HD2 LEU 35 7.418 6.952 2.513 221 HD22 LEU 35 2HD2 LEU 35 9.145 7.145 2.799 222 HD23 LEU 35 3HD2 LEU 35 8.253 5.869 3.626 223 H SER 36 H SER 36 12.398 6.304 4.077 224 HA SER 36 HA SER 36 14.017 3.872 4.287 225 HB2 SER 36 1HB SER 36 15.179 6.084 4.296 226 HB3 SER 36 2HB SER 36 14.311 6.498 5.773 227 HG SER 36 HG SER 36 15.676 5.346 6.868 228 H GLY 37 H GLY 37 13.400 2.362 5.678 229 HA2 GLY 37 1HA GLY 37 12.814 2.051 8.129 230 HA3 GLY 37 2HA GLY 37 11.454 3.106 7.771 231 H VAL 38 H VAL 38 11.476 1.721 5.018 232 HA VAL 38 HA VAL 38 9.631 -0.402 5.779 233 HB VAL 38 HB VAL 38 10.321 0.556 2.997 234 HG11 VAL 38 1HG1 VAL 38 8.104 -0.363 2.452 235 HG12 VAL 38 2HG1 VAL 38 7.956 -0.939 4.111 236 HG13 VAL 38 3HG1 VAL 38 9.215 -1.587 3.063 237 HG21 VAL 38 1HG2 VAL 38 8.322 1.974 3.130 238 HG22 VAL 38 2HG2 VAL 38 9.551 2.460 4.300 239 HG23 VAL 38 3HG2 VAL 38 8.139 1.545 4.831 240 H GLY 39 H GLY 39 10.593 -2.291 6.205 241 HA2 GLY 39 1HA GLY 39 12.940 -3.131 4.675 242 HA3 GLY 39 2HA GLY 39 12.339 -3.883 6.147 243 H ALA 40 H ALA 40 12.672 -5.872 4.808 244 HA ALA 40 HA ALA 40 11.079 -6.251 2.470 245 HB1 ALA 40 1HB ALA 40 11.901 -8.545 2.525 246 HB2 ALA 40 2HB ALA 40 12.534 -8.289 4.149 247 HB3 ALA 40 3HB ALA 40 13.214 -7.399 2.787 248 H ASN 41 H ASN 41 10.663 -7.007 5.867 249 HA ASN 41 HA ASN 41 8.372 -8.709 5.341 250 HB2 ASN 41 1HB ASN 41 9.820 -7.893 7.852 251 HB3 ASN 41 2HB ASN 41 8.319 -8.808 7.891 252 HD21 ASN 41 1HD2 ASN 41 9.757 -11.838 6.982 253 HD22 ASN 41 2HD2 ASN 41 8.308 -10.937 7.263 254 H VAL 42 H VAL 42 8.371 -5.791 4.741 255 HA VAL 42 HA VAL 42 6.265 -4.870 6.549 256 HB VAL 42 HB VAL 42 7.816 -3.314 4.479 257 HG11 VAL 42 1HG1 VAL 42 6.946 -1.333 5.719 258 HG12 VAL 42 2HG1 VAL 42 5.851 -2.416 6.587 259 HG13 VAL 42 3HG1 VAL 42 5.702 -2.230 4.838 260 HG21 VAL 42 1HG2 VAL 42 8.103 -3.616 7.440 261 HG22 VAL 42 2HG2 VAL 42 8.841 -2.300 6.526 262 HG23 VAL 42 3HG2 VAL 42 9.294 -3.974 6.187 263 HA PRO 43 HA PRO 43 3.282 -5.804 3.400 264 HB2 PRO 43 2HB PRO 43 1.298 -4.278 4.716 265 HB3 PRO 43 1HB PRO 43 1.535 -6.011 4.811 266 HG2 PRO 43 2HG PRO 43 1.970 -4.093 6.841 267 HG3 PRO 43 1HG PRO 43 2.275 -5.834 6.914 268 HD2 PRO 43 2HD PRO 43 4.150 -3.639 6.643 269 HD3 PRO 43 1HD PRO 43 4.477 -5.339 7.002 270 H VAL 44 H VAL 44 2.747 -4.708 1.547 271 HA VAL 44 HA VAL 44 2.523 -1.792 1.718 272 HB VAL 44 HB VAL 44 3.902 -1.439 -0.246 273 HG11 VAL 44 1HG1 VAL 44 5.032 -1.254 1.858 274 HG12 VAL 44 2HG1 VAL 44 6.119 -2.029 0.706 275 HG13 VAL 44 3HG1 VAL 44 5.287 -2.998 1.926 276 HG21 VAL 44 1HG2 VAL 44 3.668 -3.388 -1.518 277 HG22 VAL 44 2HG2 VAL 44 4.190 -4.421 -0.184 278 HG23 VAL 44 3HG2 VAL 44 5.356 -3.387 -1.005 279 H GLY 45 H GLY 45 1.675 -0.858 -0.309 280 HA2 GLY 45 1HA GLY 45 -0.045 -2.783 -1.731 281 HA3 GLY 45 2HA GLY 45 -0.608 -1.186 -1.263 282 H ILE 46 H ILE 46 0.144 -2.823 -3.814 283 HA ILE 46 HA ILE 46 1.895 -0.936 -5.165 284 HB ILE 46 HB ILE 46 0.642 -3.567 -5.934 285 HG12 ILE 46 1HG1 ILE 46 2.830 -4.469 -5.971 286 HG13 ILE 46 2HG1 ILE 46 3.565 -2.894 -6.056 287 HG21 ILE 46 1HG2 ILE 46 2.254 -1.766 -7.729 288 HG22 ILE 46 2HG2 ILE 46 0.533 -2.120 -7.886 289 HG23 ILE 46 3HG2 ILE 46 1.726 -3.402 -8.117 290 HD11 ILE 46 1HD1 ILE 46 2.234 -4.055 -3.645 291 HD12 ILE 46 2HD1 ILE 46 3.036 -2.486 -3.738 292 HD13 ILE 46 3HD1 ILE 46 3.970 -3.968 -3.943 293 H ASN 47 H ASN 47 1.039 0.774 -6.169 294 HA ASN 47 HA ASN 47 -0.373 2.129 -7.321 295 HB2 ASN 47 1HB ASN 47 -0.245 0.126 -8.910 296 HB3 ASN 47 2HB ASN 47 -1.794 -0.360 -8.249 297 HD21 ASN 47 1HD2 ASN 47 -3.141 1.424 -10.918 298 HD22 ASN 47 2HD2 ASN 47 -2.786 -0.126 -10.255 299 H CYS 48 H CYS 48 -1.036 2.295 -4.870 300 HA CYS 48 HA CYS 48 -3.793 1.464 -4.462 301 HB2 CYS 48 2HB CYS 48 -1.855 2.837 -2.598 302 HB3 CYS 48 1HB CYS 48 -3.456 2.280 -2.179 303 H ASN 49 H ASN 49 -5.443 2.794 -4.642 304 HA ASN 49 HA ASN 49 -4.968 5.652 -4.258 305 HB2 ASN 49 1HB ASN 49 -6.773 6.095 -5.970 306 HB3 ASN 49 2HB ASN 49 -5.260 5.485 -6.620 307 HD21 ASN 49 1HD2 ASN 49 -6.621 2.518 -7.856 308 HD22 ASN 49 2HD2 ASN 49 -5.190 3.415 -7.478 309 HA PRO 50 HA PRO 50 -8.000 5.324 -1.197 310 HB2 PRO 50 2HB PRO 50 -8.878 8.064 -1.797 311 HB3 PRO 50 1HB PRO 50 -8.063 7.443 -0.359 312 HG2 PRO 50 2HG PRO 50 -6.804 9.045 -2.117 313 HG3 PRO 50 1HG PRO 50 -5.955 7.746 -1.259 314 HD2 PRO 50 2HD PRO 50 -7.026 7.783 -4.059 315 HD3 PRO 50 1HD PRO 50 -5.469 7.175 -3.465 316 H ILE 51 H ILE 51 -9.909 4.375 -1.236 317 HA ILE 51 HA ILE 51 -11.577 4.541 -3.586 318 HB ILE 51 HB ILE 51 -12.411 3.210 -1.030 319 HG12 ILE 51 1HG1 ILE 51 -10.399 2.146 -3.030 320 HG13 ILE 51 2HG1 ILE 51 -10.081 2.538 -1.346 321 HG21 ILE 51 1HG2 ILE 51 -13.467 1.636 -2.543 322 HG22 ILE 51 2HG2 ILE 51 -12.726 2.439 -3.928 323 HG23 ILE 51 3HG2 ILE 51 -13.941 3.283 -2.964 324 HD11 ILE 51 1HD1 ILE 51 -10.286 0.144 -1.679 325 HD12 ILE 51 2HD1 ILE 51 -11.913 0.368 -2.323 326 HD13 ILE 51 3HD1 ILE 51 -11.573 0.754 -0.637 327 H THR 52 H THR 52 -12.147 6.779 -3.492 328 HA THR 52 HA THR 52 -14.079 7.381 -1.366 329 HB THR 52 HB THR 52 -13.381 9.766 -1.560 330 HG1 THR 52 1HG THR 52 -11.756 10.330 -2.866 331 HG21 THR 52 1HG2 THR 52 -11.215 9.458 -0.371 332 HG22 THR 52 2HG2 THR 52 -11.255 7.749 -0.810 333 HG23 THR 52 3HG2 THR 52 -12.499 8.420 0.245 334 H GLY 53 H GLY 53 -14.364 6.358 -4.212 335 HA2 GLY 53 1HA GLY 53 -16.521 8.183 -4.921 336 HA3 GLY 53 2HA GLY 53 -15.239 8.007 -6.109 337 H ILE 54 H ILE 54 -17.284 5.922 -4.066 338 HA ILE 54 HA ILE 54 -17.219 3.758 -5.917 339 HB ILE 54 HB ILE 54 -19.153 4.238 -3.649 340 HG12 ILE 54 1HG1 ILE 54 -16.580 2.639 -3.749 341 HG13 ILE 54 2HG1 ILE 54 -16.806 4.165 -2.901 342 HG21 ILE 54 1HG2 ILE 54 -19.596 1.852 -3.782 343 HG22 ILE 54 2HG2 ILE 54 -18.465 1.698 -5.125 344 HG23 ILE 54 3HG2 ILE 54 -19.950 2.627 -5.328 345 HD11 ILE 54 1HD1 ILE 54 -18.436 3.096 -1.428 346 HD12 ILE 54 2HD1 ILE 54 -16.870 2.289 -1.367 347 HD13 ILE 54 3HD1 ILE 54 -18.197 1.570 -2.278 348 H GLY 55 H GLY 55 -18.170 3.755 -7.805 349 HA2 GLY 55 1HA GLY 55 -20.141 3.699 -9.134 350 HA3 GLY 55 2HA GLY 55 -20.875 4.865 -8.040 351 H ALA 56 H ALA 56 -20.143 7.049 -8.097 352 HA ALA 56 HA ALA 56 -19.177 7.847 -10.739 353 HB1 ALA 56 1HB ALA 56 -20.370 9.527 -8.533 354 HB2 ALA 56 2HB ALA 56 -21.248 8.877 -9.919 355 HB3 ALA 56 3HB ALA 56 -19.977 10.075 -10.163 356 H GLY 57 H GLY 57 -16.979 7.353 -10.480 357 HA2 GLY 57 1HA GLY 57 -15.259 9.350 -9.789 358 HA3 GLY 57 2HA GLY 57 -15.451 8.436 -8.300 359 H SER 58 H SER 58 -12.975 8.581 -9.335 360 HA SER 58 HA SER 58 -12.420 6.347 -11.060 361 HB2 SER 58 1HB SER 58 -10.504 7.990 -9.385 362 HB3 SER 58 2HB SER 58 -10.083 6.945 -10.742 363 HG SER 58 HG SER 58 -11.573 8.380 -11.977 364 H GLY 59 H GLY 59 -12.147 7.082 -7.622 365 HA2 GLY 59 1HA GLY 59 -11.105 4.420 -7.059 366 HA3 GLY 59 2HA GLY 59 -11.300 5.731 -5.903 367 H SER 60 H SER 60 -13.286 3.639 -7.984 368 HA SER 60 HA SER 60 -15.430 3.700 -6.049 369 HB2 SER 60 1HB SER 60 -15.245 2.010 -8.551 370 HB3 SER 60 2HB SER 60 -16.694 2.387 -7.619 371 HG SER 60 HG SER 60 -15.812 4.706 -8.180 372 H SER 61 H SER 61 -16.459 1.404 -5.604 373 HA SER 61 HA SER 61 -15.045 0.072 -3.735 374 HB2 SER 61 1HB SER 61 -17.445 -0.337 -4.282 375 HB3 SER 61 2HB SER 61 -16.934 -1.290 -5.674 376 HG SER 61 HG SER 61 -16.415 -2.896 -4.401 377 H CYS 62 H CYS 62 -13.387 -1.328 -3.629 378 HA CYS 62 HA CYS 62 -11.671 -1.284 -5.863 379 HB2 CYS 62 2HB CYS 62 -10.975 -1.256 -3.433 380 HB3 CYS 62 1HB CYS 62 -11.279 -2.994 -3.416 381 H ASN 63 H ASN 63 -11.830 -2.482 -7.574 382 HA ASN 63 HA ASN 63 -13.041 -5.077 -7.621 383 HB2 ASN 63 1HB ASN 63 -11.245 -4.417 -9.853 384 HB3 ASN 63 2HB ASN 63 -12.946 -4.866 -9.881 385 HD21 ASN 63 1HD2 ASN 63 -11.792 -0.979 -9.975 386 HD22 ASN 63 2HD2 ASN 63 -10.658 -2.258 -9.658 387 H ALA 64 H ALA 64 -9.886 -3.769 -7.166 388 HA ALA 64 HA ALA 64 -8.555 -6.278 -7.767 389 HB1 ALA 64 1HB ALA 64 -7.304 -3.674 -6.907 390 HB2 ALA 64 2HB ALA 64 -7.681 -4.087 -8.578 391 HB3 ALA 64 3HB ALA 64 -6.508 -5.051 -7.674 392 H ASN 65 H ASN 65 -7.134 -4.295 -5.321 393 HA ASN 65 HA ASN 65 -8.025 -6.138 -3.210 394 HB2 ASN 65 1HB ASN 65 -5.185 -5.215 -3.551 395 HB3 ASN 65 2HB ASN 65 -5.778 -6.319 -2.332 396 HD21 ASN 65 1HD2 ASN 65 -4.900 -7.581 -6.075 397 HD22 ASN 65 2HD2 ASN 65 -4.899 -5.909 -5.640 398 HA PRO 66 HA PRO 66 -8.399 -2.111 -1.243 399 HB2 PRO 66 2HB PRO 66 -10.210 -2.874 0.574 400 HB3 PRO 66 1HB PRO 66 -10.653 -2.628 -1.118 401 HG2 PRO 66 2HG PRO 66 -10.168 -5.175 0.359 402 HG3 PRO 66 1HG PRO 66 -11.380 -4.810 -0.885 403 HD2 PRO 66 2HD PRO 66 -8.960 -6.126 -1.322 404 HD3 PRO 66 1HD PRO 66 -9.938 -5.343 -2.573 405 H ALA 67 H ALA 67 -7.385 -1.302 0.565 406 HA ALA 67 HA ALA 67 -6.539 -3.115 2.676 407 HB1 ALA 67 1HB ALA 67 -4.511 -1.639 0.998 408 HB2 ALA 67 2HB ALA 67 -4.791 -3.381 0.981 409 HB3 ALA 67 3HB ALA 67 -4.169 -2.603 2.435 410 H CYS 68 H CYS 68 -5.896 -2.103 4.556 411 HA CYS 68 HA CYS 68 -6.122 0.824 4.633 412 HB2 CYS 68 2HB CYS 68 -5.891 -1.075 6.972 413 HB3 CYS 68 1HB CYS 68 -6.294 0.630 7.031 414 H CYS 69 H CYS 69 -4.258 1.854 4.382 415 HA CYS 69 HA CYS 69 -1.813 0.489 5.246 416 HB2 CYS 69 2HB CYS 69 -2.025 2.799 3.326 417 HB3 CYS 69 1HB CYS 69 -0.654 1.743 3.604 418 H ASP 70 H ASP 70 -0.210 1.695 6.329 419 HA ASP 70 HA ASP 70 -1.233 3.544 8.246 420 HB2 ASP 70 1HB ASP 70 0.646 1.878 8.612 421 HB3 ASP 70 2HB ASP 70 1.665 2.934 7.649 422 H ASN 71 H ASN 71 0.869 3.783 5.423 423 HA ASN 71 HA ASN 71 -0.008 6.537 5.021 424 HB2 ASN 71 1HB ASN 71 2.925 5.757 5.056 425 HB3 ASN 71 2HB ASN 71 2.305 7.289 4.459 426 HD21 ASN 71 1HD2 ASN 71 2.891 6.665 8.389 427 HD22 ASN 71 2HD2 ASN 71 3.176 5.445 7.200 428 H VAL 72 H VAL 72 -0.273 6.988 2.841 429 HA VAL 72 HA VAL 72 1.088 5.197 0.962 430 HB VAL 72 HB VAL 72 -0.757 4.467 -0.022 431 HG11 VAL 72 1HG1 VAL 72 -2.182 5.863 2.222 432 HG12 VAL 72 2HG1 VAL 72 -1.563 4.211 2.203 433 HG13 VAL 72 3HG1 VAL 72 -2.912 4.659 1.159 434 HG21 VAL 72 1HG2 VAL 72 -1.971 7.223 0.011 435 HG22 VAL 72 2HG2 VAL 72 -2.491 5.847 -0.968 436 HG23 VAL 72 3HG2 VAL 72 -0.913 6.590 -1.253 437 H TYR 73 H TYR 73 1.391 6.119 -1.172 438 HA TYR 73 HA TYR 73 1.623 9.054 -1.049 439 HB2 TYR 73 2HB TYR 73 3.644 7.059 -2.081 440 HB3 TYR 73 1HB TYR 73 3.837 8.812 -2.113 441 HD1 TYR 73 1HD TYR 73 4.226 10.053 -0.029 442 HD2 TYR 73 2HD TYR 73 3.884 5.811 -0.019 443 HE1 TYR 73 1HE TYR 73 5.128 9.989 2.256 444 HE2 TYR 73 2HE TYR 73 4.793 5.735 2.265 445 HH TYR 73 HH TYR 73 6.171 7.124 3.748 446 H THR 74 H THR 74 1.993 10.007 -3.264 447 HA THR 74 HA THR 74 -0.366 9.319 -4.682 448 HB THR 74 HB THR 74 0.369 11.220 -6.208 449 HG1 THR 74 1HG THR 74 2.205 12.267 -5.742 450 HG21 THR 74 1HG2 THR 74 -1.201 11.556 -4.374 451 HG22 THR 74 2HG2 THR 74 -0.106 12.933 -4.503 452 HG23 THR 74 3HG2 THR 74 0.138 11.727 -3.239 453 H ASN 75 H ASN 75 2.923 8.408 -5.153 454 HA ASN 75 HA ASN 75 2.718 7.711 -7.907 455 HB2 ASN 75 1HB ASN 75 4.643 6.276 -7.533 456 HB3 ASN 75 2HB ASN 75 4.893 7.792 -6.677 457 HD21 ASN 75 1HD2 ASN 75 5.656 4.722 -4.604 458 HD22 ASN 75 2HD2 ASN 75 5.993 5.078 -6.258 459 H GLY 76 H GLY 76 1.443 6.491 -5.018 460 HA2 GLY 76 1HA GLY 76 -0.463 5.063 -5.090 461 HA3 GLY 76 2HA GLY 76 0.250 4.238 -6.473 462 H LEU 77 H LEU 77 2.427 4.994 -3.893 463 HA LEU 77 HA LEU 77 2.542 2.132 -3.291 464 HB2 LEU 77 1HB LEU 77 4.588 3.317 -3.983 465 HB3 LEU 77 2HB LEU 77 4.436 4.370 -2.606 466 HG LEU 77 HG LEU 77 6.163 2.484 -2.487 467 HD11 LEU 77 1HD1 LEU 77 5.545 3.777 -0.541 468 HD12 LEU 77 2HD1 LEU 77 5.762 2.076 -0.113 469 HD13 LEU 77 3HD1 LEU 77 4.136 2.749 -0.282 470 HD21 LEU 77 1HD2 LEU 77 4.707 0.721 -3.354 471 HD22 LEU 77 2HD2 LEU 77 3.693 0.861 -1.914 472 HD23 LEU 77 3HD2 LEU 77 5.368 0.324 -1.769 473 H GLY 78 H GLY 78 1.643 1.361 -1.528 474 HA2 GLY 78 1HA GLY 78 1.125 3.211 0.710 475 HA3 GLY 78 2HA GLY 78 0.203 1.752 0.378 476 H VAL 79 H VAL 79 1.816 2.739 2.744 477 HA VAL 79 HA VAL 79 3.592 0.399 3.001 478 HB VAL 79 HB VAL 79 4.600 2.727 3.247 479 HG11 VAL 79 1HG1 VAL 79 3.145 2.704 5.875 480 HG12 VAL 79 2HG1 VAL 79 2.756 3.734 4.500 481 HG13 VAL 79 3HG1 VAL 79 4.306 3.910 5.320 482 HG21 VAL 79 1HG2 VAL 79 5.744 0.750 4.055 483 HG22 VAL 79 2HG2 VAL 79 4.848 0.830 5.572 484 HG23 VAL 79 3HG2 VAL 79 5.995 2.103 5.157 485 H GLN 80 H GLN 80 3.354 -0.962 4.697 486 HA GLN 80 HA GLN 80 2.245 -2.205 6.212 487 HB2 GLN 80 1HB GLN 80 1.784 0.569 7.280 488 HB3 GLN 80 2HB GLN 80 1.152 -0.845 8.114 489 HG2 GLN 80 1HG GLN 80 4.028 -0.565 7.358 490 HG3 GLN 80 2HG GLN 80 3.394 0.033 8.892 491 HE21 GLN 80 1HE2 GLN 80 4.752 -3.480 9.155 492 HE22 GLN 80 2HE2 GLN 80 5.374 -2.028 8.449 493 H CYS 81 H CYS 81 0.965 -2.288 4.045 494 HA CYS 81 HA CYS 81 -1.789 -1.394 4.353 495 HB2 CYS 81 2HB CYS 81 -0.407 -2.789 2.061 496 HB3 CYS 81 1HB CYS 81 -2.092 -2.295 2.059 497 H ASN 82 H ASN 82 -3.171 -2.600 5.393 498 HA ASN 82 HA ASN 82 -2.861 -5.521 5.214 499 HB2 ASN 82 1HB ASN 82 -4.497 -5.598 7.147 500 HB3 ASN 82 2HB ASN 82 -2.906 -4.948 7.498 501 HD21 ASN 82 1HD2 ASN 82 -4.053 -1.804 8.441 502 HD22 ASN 82 2HD2 ASN 82 -2.700 -2.820 8.094 503 HA PRO 83 HA PRO 83 -6.088 -5.652 2.273 504 HB2 PRO 83 2HB PRO 83 -6.552 -8.413 3.196 505 HB3 PRO 83 1HB PRO 83 -6.067 -7.825 1.604 506 HG2 PRO 83 2HG PRO 83 -4.347 -9.098 3.212 507 HG3 PRO 83 1HG PRO 83 -3.828 -7.768 2.160 508 HD2 PRO 83 2HD PRO 83 -4.370 -7.757 5.102 509 HD3 PRO 83 1HD PRO 83 -3.089 -6.944 4.186 510 H ILE 84 H ILE 84 -8.201 -5.343 2.142 511 HA ILE 84 HA ILE 84 -9.863 -5.683 4.541 512 HB ILE 84 HB ILE 84 -10.446 -4.169 2.001 513 HG12 ILE 84 1HG1 ILE 84 -8.638 -3.113 3.196 514 HG13 ILE 84 2HG1 ILE 84 -10.103 -2.159 3.412 515 HG21 ILE 84 1HG2 ILE 84 -12.484 -4.919 3.109 516 HG22 ILE 84 2HG2 ILE 84 -12.304 -3.168 3.221 517 HG23 ILE 84 3HG2 ILE 84 -11.934 -4.181 4.615 518 HD11 ILE 84 1HD1 ILE 84 -8.915 -2.336 5.491 519 HD12 ILE 84 2HD1 ILE 84 -8.929 -4.093 5.380 520 HD13 ILE 84 3HD1 ILE 84 -10.440 -3.212 5.596 521 H ASN 85 H ASN 85 -11.801 -6.751 4.446 522 HA ASN 85 HA ASN 85 -12.001 -8.798 2.399 523 HB2 ASN 85 1HB ASN 85 -12.271 -9.466 4.728 524 HB3 ASN 85 2HB ASN 85 -13.566 -8.301 4.943 525 HD21 ASN 85 1HD2 ASN 85 -14.717 -11.872 4.319 526 HD22 ASN 85 2HD2 ASN 85 -13.417 -11.238 5.272 527 H VAL 86 H VAL 86 -12.995 -8.267 0.587 528 HA VAL 86 HA VAL 86 -15.502 -6.758 0.760 529 HB VAL 86 HB VAL 86 -14.980 -5.855 -1.547 530 HG11 VAL 86 1HG1 VAL 86 -13.144 -5.018 0.690 531 HG12 VAL 86 2HG1 VAL 86 -14.797 -4.461 0.438 532 HG13 VAL 86 3HG1 VAL 86 -13.542 -4.053 -0.731 533 HG21 VAL 86 1HG2 VAL 86 -12.189 -6.777 -0.883 534 HG22 VAL 86 2HG2 VAL 86 -12.651 -5.777 -2.261 535 HG23 VAL 86 3HG2 VAL 86 -13.221 -7.441 -2.148 536 H ASN 87 H ASN 87 -16.672 -8.580 0.784 537 HA ASN 87 HA ASN 87 -17.762 -10.446 0.085 538 HB2 ASN 87 1HB ASN 87 -16.542 -9.864 -2.628 539 HB3 ASN 87 2HB ASN 87 -17.813 -11.039 -2.310 540 HD21 ASN 87 1HD2 ASN 87 -19.140 -7.736 -3.541 541 HD22 ASN 87 2HD2 ASN 87 -17.837 -8.746 -4.069 542 H LEU 88 H LEU 88 -14.726 -10.155 0.667 543 HA LEU 88 HA LEU 88 -12.900 -11.406 0.979 544 HB2 LEU 88 1HB LEU 88 -14.510 -12.658 2.336 545 HB3 LEU 88 2HB LEU 88 -14.898 -13.660 0.949 546 HG LEU 88 HG LEU 88 -12.542 -14.433 0.915 547 HD11 LEU 88 1HD1 LEU 88 -11.163 -14.059 2.917 548 HD12 LEU 88 2HD1 LEU 88 -12.369 -12.918 3.512 549 HD13 LEU 88 3HD1 LEU 88 -11.480 -12.569 2.030 550 HD21 LEU 88 1HD2 LEU 88 -14.055 -14.885 3.481 551 HD22 LEU 88 2HD2 LEU 88 -12.761 -15.909 2.862 552 HD23 LEU 88 3HD2 LEU 88 -14.275 -15.768 1.971 Start of MODEL 10 1 H1 GLY 1 1H GLY 1 -11.731 11.869 6.632 2 H2 GLY 1 2H GLY 1 -13.107 12.824 6.410 3 H3 GLY 1 3H GLY 1 -12.321 12.155 5.073 4 HA2 GLY 1 1HA GLY 1 -12.891 9.930 5.811 5 HA3 GLY 1 2HA GLY 1 -13.718 10.631 7.196 6 H SER 2 H SER 2 -15.794 10.142 6.825 7 HA SER 2 HA SER 2 -17.866 10.150 5.909 8 HB2 SER 2 1HB SER 2 -16.821 12.449 4.237 9 HB3 SER 2 2HB SER 2 -18.513 12.080 4.578 10 HG SER 2 HG SER 2 -17.829 12.321 6.881 11 H GLY 3 H GLY 3 -16.498 8.149 4.954 12 HA2 GLY 3 1HA GLY 3 -17.626 7.371 2.590 13 HA3 GLY 3 2HA GLY 3 -16.142 8.182 2.108 14 H SER 4 H SER 4 -14.332 7.483 3.919 15 HA SER 4 HA SER 4 -13.918 4.675 3.435 16 HB2 SER 4 1HB SER 4 -12.283 6.654 5.043 17 HB3 SER 4 2HB SER 4 -11.766 5.033 4.582 18 HG SER 4 HG SER 4 -12.379 7.186 2.827 19 H SER 5 H SER 5 -15.629 3.717 4.588 20 HA SER 5 HA SER 5 -16.006 4.191 7.385 21 HB2 SER 5 1HB SER 5 -17.019 1.941 5.634 22 HB3 SER 5 2HB SER 5 -17.609 2.341 7.247 23 HG SER 5 HG SER 5 -18.931 3.245 5.618 24 H GLN 6 H GLN 6 -14.065 2.088 5.467 25 HA GLN 6 HA GLN 6 -13.374 0.447 7.782 26 HB2 GLN 6 1HB GLN 6 -12.517 0.204 4.895 27 HB3 GLN 6 2HB GLN 6 -12.132 -0.939 6.168 28 HG2 GLN 6 1HG GLN 6 -14.928 -0.295 5.283 29 HG3 GLN 6 2HG GLN 6 -13.966 -1.631 4.658 30 HE21 GLN 6 1HE2 GLN 6 -15.617 -3.541 7.061 31 HE22 GLN 6 2HE2 GLN 6 -15.461 -3.133 5.386 32 H CYS 7 H CYS 7 -10.984 -0.063 7.965 33 HA CYS 7 HA CYS 7 -8.794 0.431 8.156 34 HB2 CYS 7 2HB CYS 7 -8.805 1.118 5.833 35 HB3 CYS 7 1HB CYS 7 -9.422 2.698 6.286 36 H ASN 8 H ASN 8 -8.185 1.029 10.077 37 HA ASN 8 HA ASN 8 -9.208 3.472 11.287 38 HB2 ASN 8 1HB ASN 8 -7.520 1.228 12.418 39 HB3 ASN 8 2HB ASN 8 -8.070 2.623 13.340 40 HD21 ASN 8 1HD2 ASN 8 -10.563 -0.462 12.529 41 HD22 ASN 8 2HD2 ASN 8 -8.984 -0.356 11.828 42 H ALA 9 H ALA 9 -6.446 2.403 9.610 43 HA ALA 9 HA ALA 9 -4.601 4.194 10.952 44 HB1 ALA 9 1HB ALA 9 -4.149 2.464 8.527 45 HB2 ALA 9 2HB ALA 9 -3.857 1.973 10.195 46 HB3 ALA 9 3HB ALA 9 -2.911 3.280 9.484 47 H GLY 10 H GLY 10 -6.904 4.538 8.617 48 HA2 GLY 10 1HA GLY 10 -6.563 7.144 7.996 49 HA3 GLY 10 2HA GLY 10 -5.488 6.337 6.859 50 HA PRO 11 HA PRO 11 -9.564 6.212 4.787 51 HB2 PRO 11 2HB PRO 11 -8.709 6.868 2.330 52 HB3 PRO 11 1HB PRO 11 -8.970 8.095 3.574 53 HG2 PRO 11 2HG PRO 11 -6.422 6.868 2.624 54 HG3 PRO 11 1HG PRO 11 -6.760 8.552 3.064 55 HD2 PRO 11 2HD PRO 11 -5.518 6.713 4.711 56 HD3 PRO 11 1HD PRO 11 -6.362 8.167 5.275 57 H VAL 12 H VAL 12 -10.228 4.916 2.856 58 HA VAL 12 HA VAL 12 -8.915 2.341 2.934 59 HB VAL 12 HB VAL 12 -10.768 1.692 1.312 60 HG11 VAL 12 1HG1 VAL 12 -10.855 1.201 3.696 61 HG12 VAL 12 2HG1 VAL 12 -12.454 1.603 3.070 62 HG13 VAL 12 3HG1 VAL 12 -11.550 2.793 4.006 63 HG21 VAL 12 1HG2 VAL 12 -11.854 4.394 2.107 64 HG22 VAL 12 2HG2 VAL 12 -12.674 3.176 1.133 65 HG23 VAL 12 3HG2 VAL 12 -11.235 3.982 0.508 66 H GLN 13 H GLN 13 -7.671 1.454 1.385 67 HA GLN 13 HA GLN 13 -7.205 3.093 -1.016 68 HB2 GLN 13 1HB GLN 13 -5.299 1.095 0.211 69 HB3 GLN 13 2HB GLN 13 -4.976 2.184 -1.124 70 HG2 GLN 13 1HG GLN 13 -5.534 2.998 1.712 71 HG3 GLN 13 2HG GLN 13 -3.959 2.962 0.925 72 HE21 GLN 13 1HE2 GLN 13 -5.570 6.379 0.916 73 HE22 GLN 13 2HE2 GLN 13 -5.433 5.167 2.144 74 H CYS 14 H CYS 14 -7.226 2.178 -2.980 75 HA CYS 14 HA CYS 14 -7.892 -0.678 -3.136 76 HB2 CYS 14 2HB CYS 14 -9.658 0.702 -4.078 77 HB3 CYS 14 1HB CYS 14 -8.507 1.545 -5.105 78 H CYS 15 H CYS 15 -6.165 -1.807 -3.516 79 HA CYS 15 HA CYS 15 -3.950 -0.596 -5.024 80 HB2 CYS 15 2HB CYS 15 -3.857 -2.818 -2.975 81 HB3 CYS 15 1HB CYS 15 -2.481 -1.965 -3.678 82 H ASN 16 H ASN 16 -3.039 -1.651 -6.683 83 HA ASN 16 HA ASN 16 -4.527 -3.637 -8.057 84 HB2 ASN 16 1HB ASN 16 -2.909 -1.874 -9.007 85 HB3 ASN 16 2HB ASN 16 -1.648 -3.018 -8.589 86 HD21 ASN 16 1HD2 ASN 16 -2.023 -4.293 -11.800 87 HD22 ASN 16 2HD2 ASN 16 -1.032 -3.407 -10.692 88 H THR 17 H THR 17 -1.589 -3.705 -6.128 89 HA THR 17 HA THR 17 -1.863 -6.607 -5.881 90 HB THR 17 HB THR 17 0.709 -5.194 -6.637 91 HG1 THR 17 1HG THR 17 -1.177 -6.715 -8.002 92 HG21 THR 17 1HG2 THR 17 1.676 -7.501 -6.643 93 HG22 THR 17 2HG2 THR 17 0.217 -8.053 -5.818 94 HG23 THR 17 3HG2 THR 17 1.282 -6.878 -5.040 95 H LEU 18 H LEU 18 -2.024 -7.015 -3.764 96 HA LEU 18 HA LEU 18 -0.562 -5.331 -1.870 97 HB2 LEU 18 1HB LEU 18 -2.602 -7.522 -1.473 98 HB3 LEU 18 2HB LEU 18 -1.721 -6.784 -0.148 99 HG LEU 18 HG LEU 18 -3.595 -5.363 -2.026 100 HD11 LEU 18 1HD1 LEU 18 -5.059 -5.170 -0.126 101 HD12 LEU 18 2HD1 LEU 18 -3.872 -5.955 0.916 102 HD13 LEU 18 3HD1 LEU 18 -4.664 -6.874 -0.367 103 HD21 LEU 18 1HD2 LEU 18 -1.782 -3.906 -1.340 104 HD22 LEU 18 2HD2 LEU 18 -2.046 -4.344 0.348 105 HD23 LEU 18 3HD2 LEU 18 -3.278 -3.441 -0.535 106 H THR 19 H THR 19 1.406 -5.881 -1.348 107 HA THR 19 HA THR 19 2.146 -8.651 -1.044 108 HB THR 19 HB THR 19 2.421 -8.389 -3.446 109 HG1 THR 19 1HG THR 19 4.054 -9.657 -3.108 110 HG21 THR 19 1HG2 THR 19 4.146 -6.025 -2.740 111 HG22 THR 19 2HG2 THR 19 2.724 -6.068 -3.789 112 HG23 THR 19 3HG2 THR 19 4.226 -6.833 -4.303 113 H SER 20 H SER 20 4.846 -8.454 -0.907 114 HA SER 20 HA SER 20 5.103 -6.863 1.525 115 HB2 SER 20 1HB SER 20 6.967 -8.951 0.369 116 HB3 SER 20 2HB SER 20 7.026 -8.274 1.997 117 HG SER 20 HG SER 20 4.714 -9.119 2.054 118 H ALA 21 H ALA 21 6.977 -5.596 1.922 119 HA ALA 21 HA ALA 21 7.590 -3.809 -0.167 120 HB1 ALA 21 1HB ALA 21 7.561 -3.204 2.215 121 HB2 ALA 21 2HB ALA 21 9.072 -2.748 1.430 122 HB3 ALA 21 3HB ALA 21 9.014 -4.172 2.469 123 H SER 22 H SER 22 8.902 -6.836 0.507 124 HA SER 22 HA SER 22 11.538 -6.337 -0.501 125 HB2 SER 22 1HB SER 22 10.953 -8.175 1.102 126 HB3 SER 22 2HB SER 22 10.123 -8.980 -0.208 127 HG SER 22 HG SER 22 11.963 -9.690 -0.889 128 H ASN 23 H ASN 23 8.467 -6.743 -1.882 129 HA ASN 23 HA ASN 23 9.179 -8.060 -4.298 130 HB2 ASN 23 1HB ASN 23 6.816 -7.696 -3.340 131 HB3 ASN 23 2HB ASN 23 6.912 -6.082 -4.028 132 HD21 ASN 23 1HD2 ASN 23 6.272 -9.305 -6.379 133 HD22 ASN 23 2HD2 ASN 23 6.627 -9.464 -4.693 134 H SER 24 H SER 24 9.891 -7.267 -6.206 135 HA SER 24 HA SER 24 11.369 -4.891 -6.228 136 HB2 SER 24 1HB SER 24 10.395 -6.519 -8.582 137 HB3 SER 24 2HB SER 24 11.718 -5.354 -8.606 138 HG SER 24 HG SER 24 12.865 -6.669 -7.188 139 H GLN 25 H GLN 25 8.046 -5.530 -7.074 140 HA GLN 25 HA GLN 25 7.526 -3.176 -8.536 141 HB2 GLN 25 1HB GLN 25 6.017 -5.193 -8.351 142 HB3 GLN 25 2HB GLN 25 5.617 -4.664 -6.715 143 HG2 GLN 25 1HG GLN 25 3.886 -3.934 -8.124 144 HG3 GLN 25 2HG GLN 25 4.846 -2.525 -7.681 145 HE21 GLN 25 1HE2 GLN 25 4.570 -3.727 -11.542 146 HE22 GLN 25 2HE2 GLN 25 3.988 -4.708 -10.238 147 H ALA 26 H ALA 26 7.227 -4.028 -5.118 148 HA ALA 26 HA ALA 26 6.310 -1.471 -4.274 149 HB1 ALA 26 1HB ALA 26 7.562 -3.734 -2.719 150 HB2 ALA 26 2HB ALA 26 5.838 -3.478 -2.993 151 HB3 ALA 26 3HB ALA 26 6.757 -2.331 -2.014 152 H ALA 27 H ALA 27 9.451 -3.133 -3.980 153 HA ALA 27 HA ALA 27 10.758 -1.044 -2.639 154 HB1 ALA 27 1HB ALA 27 12.835 -2.175 -3.248 155 HB2 ALA 27 2HB ALA 27 11.964 -3.160 -4.424 156 HB3 ALA 27 3HB ALA 27 11.620 -3.332 -2.704 157 H GLY 28 H GLY 28 10.390 -1.661 -6.116 158 HA2 GLY 28 1HA GLY 28 12.106 0.331 -7.064 159 HA3 GLY 28 2HA GLY 28 10.635 -0.191 -7.876 160 H LEU 29 H LEU 29 8.723 0.528 -6.098 161 HA LEU 29 HA LEU 29 8.391 3.313 -6.482 162 HB2 LEU 29 1HB LEU 29 6.993 1.418 -4.632 163 HB3 LEU 29 2HB LEU 29 6.421 3.004 -5.046 164 HG LEU 29 HG LEU 29 6.697 0.693 -6.961 165 HD11 LEU 29 1HD1 LEU 29 4.302 1.983 -5.674 166 HD12 LEU 29 2HD1 LEU 29 4.863 0.322 -5.468 167 HD13 LEU 29 3HD1 LEU 29 4.217 0.850 -7.022 168 HD21 LEU 29 1HD2 LEU 29 5.516 2.158 -8.545 169 HD22 LEU 29 2HD2 LEU 29 7.092 2.805 -8.090 170 HD23 LEU 29 3HD2 LEU 29 5.625 3.482 -7.384 171 H ILE 30 H ILE 30 8.951 1.360 -3.565 172 HA ILE 30 HA ILE 30 9.123 3.295 -1.620 173 HB ILE 30 HB ILE 30 10.725 0.760 -1.907 174 HG12 ILE 30 1HG1 ILE 30 8.225 1.389 -0.337 175 HG13 ILE 30 2HG1 ILE 30 8.253 0.547 -1.877 176 HG21 ILE 30 1HG2 ILE 30 11.368 0.903 0.341 177 HG22 ILE 30 2HG2 ILE 30 10.215 2.189 0.681 178 HG23 ILE 30 3HG2 ILE 30 11.651 2.528 -0.292 179 HD11 ILE 30 1HD1 ILE 30 9.549 -0.420 0.654 180 HD12 ILE 30 2HD1 ILE 30 9.462 -1.280 -0.885 181 HD13 ILE 30 3HD1 ILE 30 7.988 -0.951 0.027 182 H GLN 31 H GLN 31 11.709 2.073 -3.683 183 HA GLN 31 HA GLN 31 13.662 3.782 -2.600 184 HB2 GLN 31 1HB GLN 31 13.557 2.006 -5.008 185 HB3 GLN 31 2HB GLN 31 14.977 2.990 -4.659 186 HG2 GLN 31 1HG GLN 31 15.071 1.860 -2.433 187 HG3 GLN 31 2HG GLN 31 13.771 0.811 -2.992 188 HE21 GLN 31 1HE2 GLN 31 17.216 -0.641 -3.561 189 HE22 GLN 31 2HE2 GLN 31 16.509 0.165 -2.205 190 H GLN 32 H GLN 32 11.243 4.221 -5.025 191 HA GLN 32 HA GLN 32 12.565 6.444 -6.302 192 HB2 GLN 32 1HB GLN 32 9.726 5.448 -6.301 193 HB3 GLN 32 2HB GLN 32 10.153 6.981 -7.044 194 HG2 GLN 32 1HG GLN 32 11.372 4.337 -7.781 195 HG3 GLN 32 2HG GLN 32 10.009 5.089 -8.606 196 HE21 GLN 32 1HE2 GLN 32 12.412 6.359 -10.800 197 HE22 GLN 32 2HE2 GLN 32 11.148 5.206 -10.546 198 H LEU 33 H LEU 33 10.134 6.028 -3.802 199 HA LEU 33 HA LEU 33 9.774 8.828 -3.339 200 HB2 LEU 33 1HB LEU 33 9.150 6.758 -1.286 201 HB3 LEU 33 2HB LEU 33 8.259 8.206 -1.696 202 HG LEU 33 HG LEU 33 8.404 5.773 -3.470 203 HD11 LEU 33 1HD1 LEU 33 7.339 5.265 -1.313 204 HD12 LEU 33 2HD1 LEU 33 6.228 5.173 -2.675 205 HD13 LEU 33 3HD1 LEU 33 6.188 6.571 -1.601 206 HD21 LEU 33 1HD2 LEU 33 6.863 8.337 -3.553 207 HD22 LEU 33 2HD2 LEU 33 6.241 6.874 -4.326 208 HD23 LEU 33 3HD2 LEU 33 7.800 7.550 -4.832 209 H GLY 34 H GLY 34 11.934 6.382 -2.254 210 HA2 GLY 34 1HA GLY 34 13.935 6.614 -1.117 211 HA3 GLY 34 2HA GLY 34 13.539 8.302 -0.812 212 H LEU 35 H LEU 35 11.579 5.495 -0.096 213 HA LEU 35 HA LEU 35 11.013 6.457 2.521 214 HB2 LEU 35 1HB LEU 35 10.300 3.978 1.031 215 HB3 LEU 35 2HB LEU 35 9.791 4.227 2.678 216 HG LEU 35 HG LEU 35 9.018 5.819 0.255 217 HD11 LEU 35 1HD1 LEU 35 7.816 3.742 0.558 218 HD12 LEU 35 2HD1 LEU 35 6.763 5.120 0.877 219 HD13 LEU 35 3HD1 LEU 35 7.429 4.190 2.219 220 HD21 LEU 35 1HD2 LEU 35 8.492 6.405 3.160 221 HD22 LEU 35 2HD2 LEU 35 7.634 7.164 1.821 222 HD23 LEU 35 3HD2 LEU 35 9.369 7.414 2.009 223 H SER 36 H SER 36 12.520 6.365 4.041 224 HA SER 36 HA SER 36 14.069 3.928 4.386 225 HB2 SER 36 1HB SER 36 14.300 6.620 5.746 226 HB3 SER 36 2HB SER 36 15.437 5.287 5.865 227 HG SER 36 HG SER 36 15.021 5.835 3.285 228 H GLY 37 H GLY 37 13.072 2.445 5.611 229 HA2 GLY 37 1HA GLY 37 12.524 2.325 8.167 230 HA3 GLY 37 2HA GLY 37 11.178 3.337 7.663 231 H VAL 38 H VAL 38 10.906 2.008 5.095 232 HA VAL 38 HA VAL 38 9.260 -0.212 5.893 233 HB VAL 38 HB VAL 38 10.052 0.434 3.059 234 HG11 VAL 38 1HG1 VAL 38 7.549 -0.711 4.289 235 HG12 VAL 38 2HG1 VAL 38 8.804 -1.621 3.454 236 HG13 VAL 38 3HG1 VAL 38 7.826 -0.450 2.567 237 HG21 VAL 38 1HG2 VAL 38 7.916 1.803 4.693 238 HG22 VAL 38 2HG2 VAL 38 8.136 1.974 2.952 239 HG23 VAL 38 3HG2 VAL 38 9.384 2.545 4.059 240 H GLY 39 H GLY 39 10.048 -2.153 6.283 241 HA2 GLY 39 1HA GLY 39 12.689 -2.938 5.509 242 HA3 GLY 39 2HA GLY 39 11.538 -3.894 6.418 243 H ALA 40 H ALA 40 11.471 -5.781 5.408 244 HA ALA 40 HA ALA 40 11.053 -5.766 2.492 245 HB1 ALA 40 1HB ALA 40 12.298 -7.921 4.197 246 HB2 ALA 40 2HB ALA 40 13.165 -6.802 3.146 247 HB3 ALA 40 3HB ALA 40 12.067 -7.991 2.450 248 H ASN 41 H ASN 41 10.164 -7.369 5.525 249 HA ASN 41 HA ASN 41 8.040 -8.853 4.263 250 HB2 ASN 41 1HB ASN 41 8.840 -8.552 7.163 251 HB3 ASN 41 2HB ASN 41 7.542 -9.590 6.601 252 HD21 ASN 41 1HD2 ASN 41 9.882 -12.152 6.565 253 HD22 ASN 41 2HD2 ASN 41 8.442 -11.490 7.258 254 H VAL 42 H VAL 42 8.423 -5.745 5.293 255 HA VAL 42 HA VAL 42 6.038 -5.057 6.547 256 HB VAL 42 HB VAL 42 7.659 -3.411 4.601 257 HG11 VAL 42 1HG1 VAL 42 5.516 -2.356 4.889 258 HG12 VAL 42 2HG1 VAL 42 6.718 -1.469 5.838 259 HG13 VAL 42 3HG1 VAL 42 5.599 -2.574 6.639 260 HG21 VAL 42 1HG2 VAL 42 9.101 -4.028 6.325 261 HG22 VAL 42 2HG2 VAL 42 7.833 -3.874 7.547 262 HG23 VAL 42 3HG2 VAL 42 8.504 -2.430 6.785 263 HA PRO 43 HA PRO 43 3.102 -5.776 3.305 264 HB2 PRO 43 2HB PRO 43 1.131 -4.200 4.555 265 HB3 PRO 43 1HB PRO 43 1.309 -5.939 4.663 266 HG2 PRO 43 2HG PRO 43 1.755 -4.001 6.687 267 HG3 PRO 43 1HG PRO 43 1.939 -5.757 6.802 268 HD2 PRO 43 2HD PRO 43 3.961 -3.708 6.619 269 HD3 PRO 43 1HD PRO 43 4.169 -5.433 6.941 270 H VAL 44 H VAL 44 2.738 -4.666 1.451 271 HA VAL 44 HA VAL 44 2.483 -1.754 1.632 272 HB VAL 44 HB VAL 44 3.944 -1.398 -0.293 273 HG11 VAL 44 1HG1 VAL 44 5.263 -2.881 1.974 274 HG12 VAL 44 2HG1 VAL 44 4.942 -1.148 1.883 275 HG13 VAL 44 3HG1 VAL 44 6.114 -1.887 0.790 276 HG21 VAL 44 1HG2 VAL 44 5.477 -3.299 -0.944 277 HG22 VAL 44 2HG2 VAL 44 3.809 -3.409 -1.502 278 HG23 VAL 44 3HG2 VAL 44 4.345 -4.366 -0.117 279 H GLY 45 H GLY 45 1.458 -0.803 -0.181 280 HA2 GLY 45 1HA GLY 45 -0.113 -2.749 -1.732 281 HA3 GLY 45 2HA GLY 45 -0.686 -1.152 -1.294 282 H ILE 46 H ILE 46 0.185 -2.847 -3.789 283 HA ILE 46 HA ILE 46 1.889 -0.923 -5.149 284 HB ILE 46 HB ILE 46 0.716 -3.594 -5.915 285 HG12 ILE 46 1HG1 ILE 46 2.910 -4.468 -5.869 286 HG13 ILE 46 2HG1 ILE 46 3.632 -2.890 -6.000 287 HG21 ILE 46 1HG2 ILE 46 0.629 -2.164 -7.872 288 HG22 ILE 46 2HG2 ILE 46 1.855 -3.418 -8.068 289 HG23 ILE 46 3HG2 ILE 46 2.337 -1.769 -7.674 290 HD11 ILE 46 1HD1 ILE 46 3.114 -2.409 -3.707 291 HD12 ILE 46 2HD1 ILE 46 4.018 -3.918 -3.850 292 HD13 ILE 46 3HD1 ILE 46 2.276 -3.957 -3.560 293 H ASN 47 H ASN 47 0.979 0.742 -6.189 294 HA ASN 47 HA ASN 47 -0.461 2.019 -7.399 295 HB2 ASN 47 1HB ASN 47 -0.331 -0.055 -8.906 296 HB3 ASN 47 2HB ASN 47 -1.871 -0.519 -8.204 297 HD21 ASN 47 1HD2 ASN 47 -1.635 2.456 -10.940 298 HD22 ASN 47 2HD2 ASN 47 -0.222 1.773 -10.212 299 H CYS 48 H CYS 48 -1.091 2.277 -4.946 300 HA CYS 48 HA CYS 48 -3.837 1.426 -4.488 301 HB2 CYS 48 2HB CYS 48 -1.900 2.893 -2.694 302 HB3 CYS 48 1HB CYS 48 -3.500 2.360 -2.239 303 H ASN 49 H ASN 49 -5.530 2.749 -4.498 304 HA ASN 49 HA ASN 49 -5.078 5.629 -4.370 305 HB2 ASN 49 1HB ASN 49 -6.844 6.011 -6.066 306 HB3 ASN 49 2HB ASN 49 -5.436 5.199 -6.724 307 HD21 ASN 49 1HD2 ASN 49 -7.167 2.314 -7.660 308 HD22 ASN 49 2HD2 ASN 49 -5.639 3.107 -7.488 309 HA PRO 50 HA PRO 50 -8.038 5.404 -1.218 310 HB2 PRO 50 2HB PRO 50 -8.883 8.146 -1.798 311 HB3 PRO 50 1HB PRO 50 -7.967 7.531 -0.419 312 HG2 PRO 50 2HG PRO 50 -6.839 9.096 -2.309 313 HG3 PRO 50 1HG PRO 50 -5.934 7.824 -1.469 314 HD2 PRO 50 2HD PRO 50 -7.198 7.764 -4.186 315 HD3 PRO 50 1HD PRO 50 -5.597 7.188 -3.692 316 H ILE 51 H ILE 51 -9.911 4.387 -1.293 317 HA ILE 51 HA ILE 51 -11.679 4.642 -3.557 318 HB ILE 51 HB ILE 51 -12.454 3.222 -1.037 319 HG12 ILE 51 1HG1 ILE 51 -10.417 2.226 -3.048 320 HG13 ILE 51 2HG1 ILE 51 -10.095 2.626 -1.366 321 HG21 ILE 51 1HG2 ILE 51 -12.716 2.493 -3.952 322 HG22 ILE 51 2HG2 ILE 51 -13.958 3.307 -2.996 323 HG23 ILE 51 3HG2 ILE 51 -13.465 1.663 -2.586 324 HD11 ILE 51 1HD1 ILE 51 -10.251 0.229 -1.693 325 HD12 ILE 51 2HD1 ILE 51 -11.883 0.415 -2.338 326 HD13 ILE 51 3HD1 ILE 51 -11.549 0.811 -0.652 327 H THR 52 H THR 52 -12.287 6.857 -3.377 328 HA THR 52 HA THR 52 -14.048 7.431 -1.097 329 HB THR 52 HB THR 52 -13.289 9.834 -1.350 330 HG1 THR 52 1HG THR 52 -11.070 8.697 -2.716 331 HG21 THR 52 1HG2 THR 52 -11.195 7.780 -0.602 332 HG22 THR 52 2HG2 THR 52 -12.469 8.386 0.458 333 HG23 THR 52 3HG2 THR 52 -11.200 9.474 -0.107 334 H GLY 53 H GLY 53 -14.594 6.522 -3.951 335 HA2 GLY 53 1HA GLY 53 -16.580 8.599 -4.527 336 HA3 GLY 53 2HA GLY 53 -15.438 8.190 -5.794 337 H ILE 54 H ILE 54 -17.165 6.149 -3.461 338 HA ILE 54 HA ILE 54 -17.775 4.152 -5.359 339 HB ILE 54 HB ILE 54 -19.095 4.673 -2.692 340 HG12 ILE 54 1HG1 ILE 54 -16.817 2.821 -3.440 341 HG13 ILE 54 2HG1 ILE 54 -16.652 4.325 -2.541 342 HG21 ILE 54 1HG2 ILE 54 -20.437 3.251 -4.172 343 HG22 ILE 54 2HG2 ILE 54 -19.803 2.343 -2.798 344 HG23 ILE 54 3HG2 ILE 54 -19.055 2.177 -4.387 345 HD11 ILE 54 1HD1 ILE 54 -17.981 3.390 -0.728 346 HD12 ILE 54 2HD1 ILE 54 -16.572 2.388 -1.076 347 HD13 ILE 54 3HD1 ILE 54 -18.170 1.890 -1.635 348 H GLY 55 H GLY 55 -19.148 4.237 -6.950 349 HA2 GLY 55 1HA GLY 55 -21.340 4.416 -7.834 350 HA3 GLY 55 2HA GLY 55 -21.734 5.567 -6.563 351 H ALA 56 H ALA 56 -19.212 7.016 -6.981 352 HA ALA 56 HA ALA 56 -20.193 8.810 -9.016 353 HB1 ALA 56 1HB ALA 56 -17.757 8.975 -7.245 354 HB2 ALA 56 2HB ALA 56 -19.330 9.711 -6.932 355 HB3 ALA 56 3HB ALA 56 -18.352 10.262 -8.291 356 H GLY 57 H GLY 57 -17.683 6.420 -8.675 357 HA2 GLY 57 1HA GLY 57 -16.694 5.349 -10.539 358 HA3 GLY 57 2HA GLY 57 -17.073 6.757 -11.520 359 H SER 58 H SER 58 -15.944 8.255 -8.998 360 HA SER 58 HA SER 58 -13.353 8.698 -10.085 361 HB2 SER 58 1HB SER 58 -14.392 9.524 -7.363 362 HB3 SER 58 2HB SER 58 -13.072 10.264 -8.267 363 HG SER 58 HG SER 58 -14.895 10.505 -9.943 364 H GLY 59 H GLY 59 -14.657 6.555 -7.731 365 HA2 GLY 59 1HA GLY 59 -12.434 4.910 -7.554 366 HA3 GLY 59 2HA GLY 59 -12.313 6.052 -6.220 367 H SER 60 H SER 60 -14.521 3.751 -7.743 368 HA SER 60 HA SER 60 -16.081 3.562 -5.313 369 HB2 SER 60 1HB SER 60 -16.446 2.001 -7.876 370 HB3 SER 60 2HB SER 60 -17.625 2.230 -6.582 371 HG SER 60 HG SER 60 -17.097 3.802 -8.707 372 H SER 61 H SER 61 -16.805 1.210 -4.774 373 HA SER 61 HA SER 61 -15.043 -0.082 -3.287 374 HB2 SER 61 1HB SER 61 -17.023 -1.530 -5.056 375 HB3 SER 61 2HB SER 61 -16.366 -2.111 -3.527 376 HG SER 61 HG SER 61 -17.523 -0.620 -2.435 377 H CYS 62 H CYS 62 -13.234 -1.203 -3.441 378 HA CYS 62 HA CYS 62 -11.729 -0.984 -5.760 379 HB2 CYS 62 2HB CYS 62 -10.832 -1.195 -3.434 380 HB3 CYS 62 1HB CYS 62 -11.186 -2.920 -3.512 381 H ASN 63 H ASN 63 -11.488 -2.125 -7.499 382 HA ASN 63 HA ASN 63 -12.937 -4.587 -7.903 383 HB2 ASN 63 1HB ASN 63 -11.003 -3.872 -9.976 384 HB3 ASN 63 2HB ASN 63 -12.742 -4.087 -10.101 385 HD21 ASN 63 1HD2 ASN 63 -11.103 -0.399 -9.720 386 HD22 ASN 63 2HD2 ASN 63 -10.157 -1.841 -9.531 387 H ALA 64 H ALA 64 -9.717 -3.552 -7.193 388 HA ALA 64 HA ALA 64 -8.596 -6.171 -7.818 389 HB1 ALA 64 1HB ALA 64 -7.166 -3.661 -6.954 390 HB2 ALA 64 2HB ALA 64 -7.460 -4.128 -8.627 391 HB3 ALA 64 3HB ALA 64 -6.434 -5.132 -7.600 392 H ASN 65 H ASN 65 -7.074 -4.312 -5.334 393 HA ASN 65 HA ASN 65 -8.198 -6.083 -3.270 394 HB2 ASN 65 1HB ASN 65 -5.308 -5.296 -3.534 395 HB3 ASN 65 2HB ASN 65 -5.979 -6.275 -2.249 396 HD21 ASN 65 1HD2 ASN 65 -5.126 -7.851 -5.879 397 HD22 ASN 65 2HD2 ASN 65 -5.051 -6.152 -5.576 398 HA PRO 66 HA PRO 66 -8.573 -2.078 -1.303 399 HB2 PRO 66 2HB PRO 66 -10.386 -2.839 0.519 400 HB3 PRO 66 1HB PRO 66 -10.827 -2.595 -1.177 401 HG2 PRO 66 2HG PRO 66 -10.358 -5.133 0.314 402 HG3 PRO 66 1HG PRO 66 -11.543 -4.776 -0.955 403 HD2 PRO 66 2HD PRO 66 -9.108 -6.096 -1.326 404 HD3 PRO 66 1HD PRO 66 -10.075 -5.344 -2.607 405 H ALA 67 H ALA 67 -7.311 -1.307 0.307 406 HA ALA 67 HA ALA 67 -6.530 -3.131 2.461 407 HB1 ALA 67 1HB ALA 67 -4.556 -1.608 0.767 408 HB2 ALA 67 2HB ALA 67 -4.811 -3.353 0.751 409 HB3 ALA 67 3HB ALA 67 -4.172 -2.571 2.196 410 H CYS 68 H CYS 68 -5.721 -2.144 4.306 411 HA CYS 68 HA CYS 68 -6.118 0.765 4.479 412 HB2 CYS 68 2HB CYS 68 -7.462 -0.455 6.085 413 HB3 CYS 68 1HB CYS 68 -6.054 -1.343 6.651 414 H CYS 69 H CYS 69 -4.305 1.874 4.341 415 HA CYS 69 HA CYS 69 -1.815 0.561 5.195 416 HB2 CYS 69 2HB CYS 69 -2.486 1.907 2.796 417 HB3 CYS 69 1HB CYS 69 -1.269 2.863 3.611 418 H ASP 70 H ASP 70 -0.188 1.897 6.109 419 HA ASP 70 HA ASP 70 -1.260 3.708 8.065 420 HB2 ASP 70 1HB ASP 70 0.601 2.091 8.512 421 HB3 ASP 70 2HB ASP 70 1.629 3.046 7.461 422 H ASN 71 H ASN 71 0.703 3.868 5.165 423 HA ASN 71 HA ASN 71 -0.025 6.654 4.784 424 HB2 ASN 71 1HB ASN 71 2.887 5.812 4.935 425 HB3 ASN 71 2HB ASN 71 2.326 7.351 4.302 426 HD21 ASN 71 1HD2 ASN 71 2.767 6.762 8.260 427 HD22 ASN 71 2HD2 ASN 71 3.061 5.519 7.098 428 H VAL 72 H VAL 72 -0.206 7.106 2.595 429 HA VAL 72 HA VAL 72 1.116 5.239 0.769 430 HB VAL 72 HB VAL 72 -0.733 4.535 -0.227 431 HG11 VAL 72 1HG1 VAL 72 -1.573 4.295 1.981 432 HG12 VAL 72 2HG1 VAL 72 -2.901 4.809 0.939 433 HG13 VAL 72 3HG1 VAL 72 -2.123 5.971 2.013 434 HG21 VAL 72 1HG2 VAL 72 -1.892 7.315 -0.226 435 HG22 VAL 72 2HG2 VAL 72 -2.437 5.940 -1.194 436 HG23 VAL 72 3HG2 VAL 72 -0.841 6.649 -1.480 437 H TYR 73 H TYR 73 1.509 6.096 -1.354 438 HA TYR 73 HA TYR 73 1.842 9.023 -1.273 439 HB2 TYR 73 2HB TYR 73 3.748 6.927 -2.317 440 HB3 TYR 73 1HB TYR 73 4.034 8.669 -2.339 441 HD1 TYR 73 1HD TYR 73 4.690 9.838 -0.329 442 HD2 TYR 73 2HD TYR 73 3.771 5.685 -0.188 443 HE1 TYR 73 1HE TYR 73 5.621 9.708 1.941 444 HE2 TYR 73 2HE TYR 73 4.703 5.545 2.082 445 HH TYR 73 HH TYR 73 5.504 8.354 3.902 446 H THR 74 H THR 74 2.230 9.946 -3.496 447 HA THR 74 HA THR 74 -0.163 9.320 -4.897 448 HB THR 74 HB THR 74 0.574 11.202 -6.421 449 HG1 THR 74 1HG THR 74 2.527 11.879 -4.531 450 HG21 THR 74 1HG2 THR 74 -0.889 11.579 -4.498 451 HG22 THR 74 2HG2 THR 74 0.224 12.930 -4.713 452 HG23 THR 74 3HG2 THR 74 0.519 11.736 -3.449 453 H ASN 75 H ASN 75 3.077 8.288 -5.370 454 HA ASN 75 HA ASN 75 2.826 7.576 -8.128 455 HB2 ASN 75 1HB ASN 75 4.739 6.110 -7.749 456 HB3 ASN 75 2HB ASN 75 5.029 7.661 -6.973 457 HD21 ASN 75 1HD2 ASN 75 5.852 4.729 -4.761 458 HD22 ASN 75 2HD2 ASN 75 6.181 5.037 -6.430 459 H GLY 76 H GLY 76 1.552 6.460 -5.219 460 HA2 GLY 76 1HA GLY 76 -0.356 5.050 -5.228 461 HA3 GLY 76 2HA GLY 76 0.334 4.176 -6.593 462 H LEU 77 H LEU 77 2.574 4.961 -4.084 463 HA LEU 77 HA LEU 77 2.669 2.114 -3.402 464 HB2 LEU 77 1HB LEU 77 4.717 3.286 -4.126 465 HB3 LEU 77 2HB LEU 77 4.564 4.375 -2.774 466 HG LEU 77 HG LEU 77 6.298 2.503 -2.617 467 HD11 LEU 77 1HD1 LEU 77 4.282 2.788 -0.404 468 HD12 LEU 77 2HD1 LEU 77 5.660 3.847 -0.702 469 HD13 LEU 77 3HD1 LEU 77 5.926 2.164 -0.236 470 HD21 LEU 77 1HD2 LEU 77 3.844 0.876 -1.995 471 HD22 LEU 77 2HD2 LEU 77 5.525 0.358 -1.836 472 HD23 LEU 77 3HD2 LEU 77 4.858 0.705 -3.430 473 H GLY 78 H GLY 78 1.936 1.358 -1.525 474 HA2 GLY 78 1HA GLY 78 1.377 3.320 0.610 475 HA3 GLY 78 2HA GLY 78 0.394 1.896 0.316 476 H VAL 79 H VAL 79 1.863 2.803 2.721 477 HA VAL 79 HA VAL 79 3.639 0.471 3.061 478 HB VAL 79 HB VAL 79 4.692 2.759 3.308 479 HG11 VAL 79 1HG1 VAL 79 4.343 4.003 5.356 480 HG12 VAL 79 2HG1 VAL 79 3.066 2.882 5.828 481 HG13 VAL 79 3HG1 VAL 79 2.859 3.903 4.408 482 HG21 VAL 79 1HG2 VAL 79 5.748 0.798 4.245 483 HG22 VAL 79 2HG2 VAL 79 4.755 0.929 5.697 484 HG23 VAL 79 3HG2 VAL 79 5.953 2.171 5.331 485 H GLN 80 H GLN 80 3.105 -1.004 4.507 486 HA GLN 80 HA GLN 80 2.029 -2.154 6.115 487 HB2 GLN 80 1HB GLN 80 1.610 0.637 7.147 488 HB3 GLN 80 2HB GLN 80 0.925 -0.747 7.983 489 HG2 GLN 80 1HG GLN 80 3.820 -0.556 7.285 490 HG3 GLN 80 2HG GLN 80 3.174 0.104 8.787 491 HE21 GLN 80 1HE2 GLN 80 4.457 -3.416 9.179 492 HE22 GLN 80 2HE2 GLN 80 5.113 -1.994 8.446 493 H CYS 81 H CYS 81 0.781 -2.141 3.874 494 HA CYS 81 HA CYS 81 -1.999 -1.347 4.187 495 HB2 CYS 81 2HB CYS 81 -0.437 -2.561 1.929 496 HB3 CYS 81 1HB CYS 81 -2.187 -2.627 1.922 497 H ASN 82 H ASN 82 -3.303 -2.576 5.346 498 HA ASN 82 HA ASN 82 -2.947 -5.487 5.190 499 HB2 ASN 82 1HB ASN 82 -4.465 -5.619 7.155 500 HB3 ASN 82 2HB ASN 82 -2.982 -4.738 7.466 501 HD21 ASN 82 1HD2 ASN 82 -6.600 -2.937 7.756 502 HD22 ASN 82 2HD2 ASN 82 -6.422 -4.533 7.115 503 HA PRO 83 HA PRO 83 -6.240 -5.769 2.333 504 HB2 PRO 83 2HB PRO 83 -6.717 -8.483 3.362 505 HB3 PRO 83 1HB PRO 83 -6.197 -7.967 1.757 506 HG2 PRO 83 2HG PRO 83 -4.527 -9.194 3.469 507 HG3 PRO 83 1HG PRO 83 -3.971 -7.950 2.336 508 HD2 PRO 83 2HD PRO 83 -4.518 -7.735 5.270 509 HD3 PRO 83 1HD PRO 83 -3.225 -7.000 4.302 510 H ILE 84 H ILE 84 -8.242 -5.044 2.445 511 HA ILE 84 HA ILE 84 -9.760 -5.157 4.904 512 HB ILE 84 HB ILE 84 -10.550 -4.087 2.200 513 HG12 ILE 84 1HG1 ILE 84 -8.644 -2.870 3.048 514 HG13 ILE 84 2HG1 ILE 84 -10.082 -1.871 3.191 515 HG21 ILE 84 1HG2 ILE 84 -12.275 -2.830 3.416 516 HG22 ILE 84 2HG2 ILE 84 -11.831 -3.688 4.890 517 HG23 ILE 84 3HG2 ILE 84 -12.506 -4.575 3.521 518 HD11 ILE 84 1HD1 ILE 84 -8.732 -1.651 5.161 519 HD12 ILE 84 2HD1 ILE 84 -8.745 -3.396 5.401 520 HD13 ILE 84 3HD1 ILE 84 -10.239 -2.471 5.563 521 H ASN 85 H ASN 85 -11.699 -6.166 5.198 522 HA ASN 85 HA ASN 85 -12.119 -8.596 3.703 523 HB2 ASN 85 1HB ASN 85 -12.362 -8.628 6.124 524 HB3 ASN 85 2HB ASN 85 -13.585 -7.367 6.047 525 HD21 ASN 85 1HD2 ASN 85 -14.524 -11.248 5.388 526 HD22 ASN 85 2HD2 ASN 85 -12.885 -10.719 5.571 527 H VAL 86 H VAL 86 -13.002 -8.306 1.755 528 HA VAL 86 HA VAL 86 -15.552 -6.862 1.622 529 HB VAL 86 HB VAL 86 -14.979 -6.299 -0.778 530 HG11 VAL 86 1HG1 VAL 86 -14.928 -4.599 0.939 531 HG12 VAL 86 2HG1 VAL 86 -13.597 -4.351 -0.190 532 HG13 VAL 86 3HG1 VAL 86 -13.289 -5.069 1.391 533 HG21 VAL 86 1HG2 VAL 86 -12.688 -6.297 -1.487 534 HG22 VAL 86 2HG2 VAL 86 -13.111 -7.929 -0.969 535 HG23 VAL 86 3HG2 VAL 86 -12.155 -6.889 0.087 536 H ASN 87 H ASN 87 -16.664 -8.737 1.880 537 HA ASN 87 HA ASN 87 -17.844 -10.570 1.227 538 HB2 ASN 87 1HB ASN 87 -17.853 -9.613 -1.062 539 HB3 ASN 87 2HB ASN 87 -16.319 -10.407 -1.384 540 HD21 ASN 87 1HD2 ASN 87 -19.392 -13.005 -0.728 541 HD22 ASN 87 2HD2 ASN 87 -19.072 -11.724 0.386 542 H LEU 88 H LEU 88 -14.403 -10.481 0.808 543 HA LEU 88 HA LEU 88 -12.726 -11.867 1.333 544 HB2 LEU 88 1HB LEU 88 -13.907 -11.926 3.504 545 HB3 LEU 88 2HB LEU 88 -14.804 -13.330 2.956 546 HG LEU 88 HG LEU 88 -12.631 -14.529 2.700 547 HD11 LEU 88 1HD1 LEU 88 -11.151 -12.627 2.504 548 HD12 LEU 88 2HD1 LEU 88 -10.677 -13.626 3.877 549 HD13 LEU 88 3HD1 LEU 88 -11.551 -12.118 4.144 550 HD21 LEU 88 1HD2 LEU 88 -12.330 -14.923 5.110 551 HD22 LEU 88 2HD2 LEU 88 -14.029 -14.909 4.640 552 HD23 LEU 88 3HD2 LEU 88 -13.327 -13.508 5.449 Start of MODEL 11 1 H1 GLY 1 1H GLY 1 -20.085 6.010 9.052 2 H2 GLY 1 2H GLY 1 -21.458 6.680 8.324 3 H3 GLY 1 3H GLY 1 -20.797 7.393 9.707 4 HA2 GLY 1 1HA GLY 1 -20.251 8.633 7.688 5 HA3 GLY 1 2HA GLY 1 -18.834 8.041 8.543 6 H SER 2 H SER 2 -20.611 8.000 5.627 7 HA SER 2 HA SER 2 -19.589 5.627 4.479 8 HB2 SER 2 1HB SER 2 -20.536 8.131 3.066 9 HB3 SER 2 2HB SER 2 -20.442 6.506 2.385 10 HG SER 2 HG SER 2 -22.013 5.849 3.906 11 H GLY 3 H GLY 3 -18.214 5.706 2.427 12 HA2 GLY 3 1HA GLY 3 -16.334 6.482 1.261 13 HA3 GLY 3 2HA GLY 3 -16.134 7.748 2.467 14 H SER 4 H SER 4 -14.658 7.473 4.017 15 HA SER 4 HA SER 4 -13.119 5.025 4.015 16 HB2 SER 4 1HB SER 4 -12.788 7.554 5.645 17 HB3 SER 4 2HB SER 4 -11.633 6.224 5.567 18 HG SER 4 HG SER 4 -12.492 7.483 3.198 19 H SER 5 H SER 5 -15.358 4.065 4.766 20 HA SER 5 HA SER 5 -15.922 4.258 7.560 21 HB2 SER 5 1HB SER 5 -16.730 2.096 5.603 22 HB3 SER 5 2HB SER 5 -17.466 2.414 7.172 23 HG SER 5 HG SER 5 -17.880 4.605 6.251 24 H GLN 6 H GLN 6 -14.110 2.012 5.523 25 HA GLN 6 HA GLN 6 -13.344 0.378 7.783 26 HB2 GLN 6 1HB GLN 6 -12.562 0.314 4.872 27 HB3 GLN 6 2HB GLN 6 -11.871 -0.763 6.064 28 HG2 GLN 6 1HG GLN 6 -13.542 -1.942 4.904 29 HG3 GLN 6 2HG GLN 6 -14.170 -1.612 6.513 30 HE21 GLN 6 1HE2 GLN 6 -16.892 0.229 5.392 31 HE22 GLN 6 2HE2 GLN 6 -15.948 -0.312 6.735 32 H CYS 7 H CYS 7 -10.958 -0.113 8.012 33 HA CYS 7 HA CYS 7 -8.765 0.365 8.198 34 HB2 CYS 7 2HB CYS 7 -8.815 1.174 5.915 35 HB3 CYS 7 1HB CYS 7 -9.414 2.730 6.466 36 H ASN 8 H ASN 8 -8.043 0.887 10.106 37 HA ASN 8 HA ASN 8 -9.064 3.237 11.491 38 HB2 ASN 8 1HB ASN 8 -7.321 0.936 12.370 39 HB3 ASN 8 2HB ASN 8 -7.607 2.341 13.386 40 HD21 ASN 8 1HD2 ASN 8 -10.194 0.445 14.751 41 HD22 ASN 8 2HD2 ASN 8 -8.605 1.103 14.958 42 H ALA 9 H ALA 9 -6.375 2.342 9.601 43 HA ALA 9 HA ALA 9 -4.551 4.184 10.934 44 HB1 ALA 9 1HB ALA 9 -2.841 3.270 9.467 45 HB2 ALA 9 2HB ALA 9 -4.066 2.348 8.594 46 HB3 ALA 9 3HB ALA 9 -3.722 1.980 10.284 47 H GLY 10 H GLY 10 -6.912 4.542 8.715 48 HA2 GLY 10 1HA GLY 10 -6.459 7.108 7.994 49 HA3 GLY 10 2HA GLY 10 -5.521 6.206 6.813 50 HA PRO 11 HA PRO 11 -9.669 6.193 4.984 51 HB2 PRO 11 2HB PRO 11 -8.991 6.891 2.510 52 HB3 PRO 11 1HB PRO 11 -8.958 8.086 3.816 53 HG2 PRO 11 2HG PRO 11 -6.700 6.646 2.512 54 HG3 PRO 11 1HG PRO 11 -6.771 8.308 3.116 55 HD2 PRO 11 2HD PRO 11 -5.689 6.076 4.452 56 HD3 PRO 11 1HD PRO 11 -6.027 7.667 5.164 57 H VAL 12 H VAL 12 -10.532 4.962 3.094 58 HA VAL 12 HA VAL 12 -9.378 2.342 3.004 59 HB VAL 12 HB VAL 12 -11.245 1.898 1.331 60 HG11 VAL 12 1HG1 VAL 12 -11.344 1.314 3.692 61 HG12 VAL 12 2HG1 VAL 12 -12.929 1.816 3.095 62 HG13 VAL 12 3HG1 VAL 12 -11.960 2.924 4.073 63 HG21 VAL 12 1HG2 VAL 12 -13.074 3.520 1.263 64 HG22 VAL 12 2HG2 VAL 12 -11.596 4.222 0.605 65 HG23 VAL 12 3HG2 VAL 12 -12.127 4.647 2.232 66 H GLN 13 H GLN 13 -7.913 1.636 1.627 67 HA GLN 13 HA GLN 13 -7.432 3.258 -0.787 68 HB2 GLN 13 1HB GLN 13 -5.385 1.301 0.119 69 HB3 GLN 13 2HB GLN 13 -5.181 2.865 -0.644 70 HG2 GLN 13 1HG GLN 13 -6.107 2.627 2.193 71 HG3 GLN 13 2HG GLN 13 -4.408 2.561 1.762 72 HE21 GLN 13 1HE2 GLN 13 -6.129 6.110 0.728 73 HE22 GLN 13 2HE2 GLN 13 -6.815 4.616 0.204 74 H CYS 14 H CYS 14 -7.036 2.223 -2.728 75 HA CYS 14 HA CYS 14 -7.762 -0.624 -2.860 76 HB2 CYS 14 2HB CYS 14 -9.600 0.599 -3.795 77 HB3 CYS 14 1HB CYS 14 -8.527 1.612 -4.752 78 H CYS 15 H CYS 15 -6.176 -1.827 -3.573 79 HA CYS 15 HA CYS 15 -3.991 -0.527 -5.058 80 HB2 CYS 15 2HB CYS 15 -3.760 -2.750 -3.017 81 HB3 CYS 15 1HB CYS 15 -2.435 -1.870 -3.784 82 H ASN 16 H ASN 16 -3.048 -1.636 -6.693 83 HA ASN 16 HA ASN 16 -4.534 -3.666 -8.007 84 HB2 ASN 16 1HB ASN 16 -2.935 -1.954 -9.034 85 HB3 ASN 16 2HB ASN 16 -1.649 -3.030 -8.521 86 HD21 ASN 16 1HD2 ASN 16 -2.771 -3.683 -12.057 87 HD22 ASN 16 2HD2 ASN 16 -2.397 -2.232 -11.197 88 H THR 17 H THR 17 -1.521 -3.677 -6.165 89 HA THR 17 HA THR 17 -1.820 -6.574 -5.798 90 HB THR 17 HB THR 17 0.770 -5.155 -6.485 91 HG1 THR 17 1HG THR 17 -0.897 -6.978 -7.906 92 HG21 THR 17 1HG2 THR 17 1.709 -7.472 -6.527 93 HG22 THR 17 2HG2 THR 17 0.217 -8.032 -5.768 94 HG23 THR 17 3HG2 THR 17 1.269 -6.894 -4.919 95 H LEU 18 H LEU 18 -1.889 -7.039 -3.687 96 HA LEU 18 HA LEU 18 -0.543 -5.229 -1.808 97 HB2 LEU 18 1HB LEU 18 -2.583 -7.406 -1.372 98 HB3 LEU 18 2HB LEU 18 -1.756 -6.586 -0.062 99 HG LEU 18 HG LEU 18 -3.563 -5.286 -2.088 100 HD11 LEU 18 1HD1 LEU 18 -5.116 -5.014 -0.269 101 HD12 LEU 18 2HD1 LEU 18 -3.970 -5.728 0.865 102 HD13 LEU 18 3HD1 LEU 18 -4.695 -6.722 -0.400 103 HD21 LEU 18 1HD2 LEU 18 -2.117 -4.138 0.292 104 HD22 LEU 18 2HD2 LEU 18 -3.328 -3.291 -0.671 105 HD23 LEU 18 3HD2 LEU 18 -1.802 -3.775 -1.405 106 H THR 19 H THR 19 1.479 -5.748 -1.668 107 HA THR 19 HA THR 19 2.210 -8.506 -1.051 108 HB THR 19 HB THR 19 2.622 -8.315 -3.427 109 HG1 THR 19 1HG THR 19 4.301 -9.467 -2.908 110 HG21 THR 19 1HG2 THR 19 2.761 -5.979 -3.819 111 HG22 THR 19 2HG2 THR 19 4.325 -6.653 -4.276 112 HG23 THR 19 3HG2 THR 19 4.147 -5.811 -2.739 113 H SER 20 H SER 20 4.894 -8.237 -0.714 114 HA SER 20 HA SER 20 4.979 -6.368 1.546 115 HB2 SER 20 1HB SER 20 6.809 -8.699 0.918 116 HB3 SER 20 2HB SER 20 6.774 -7.766 2.414 117 HG SER 20 HG SER 20 4.350 -8.529 2.189 118 H ALA 21 H ALA 21 7.200 -5.427 1.987 119 HA ALA 21 HA ALA 21 7.869 -3.802 -0.243 120 HB1 ALA 21 1HB ALA 21 7.921 -2.984 2.046 121 HB2 ALA 21 2HB ALA 21 9.488 -2.773 1.262 122 HB3 ALA 21 3HB ALA 21 9.249 -4.083 2.420 123 H SER 22 H SER 22 8.780 -6.899 0.315 124 HA SER 22 HA SER 22 11.511 -6.672 -0.592 125 HB2 SER 22 1HB SER 22 10.897 -8.438 0.996 126 HB3 SER 22 2HB SER 22 9.771 -9.104 -0.173 127 HG SER 22 HG SER 22 11.389 -10.208 -0.897 128 H ASN 23 H ASN 23 8.388 -6.852 -1.947 129 HA ASN 23 HA ASN 23 9.004 -8.173 -4.391 130 HB2 ASN 23 1HB ASN 23 6.676 -7.720 -3.354 131 HB3 ASN 23 2HB ASN 23 6.810 -6.119 -4.077 132 HD21 ASN 23 1HD2 ASN 23 5.948 -9.355 -6.334 133 HD22 ASN 23 2HD2 ASN 23 6.331 -9.487 -4.653 134 H SER 24 H SER 24 9.583 -7.367 -6.349 135 HA SER 24 HA SER 24 11.181 -5.060 -6.432 136 HB2 SER 24 1HB SER 24 11.494 -6.990 -7.936 137 HB3 SER 24 2HB SER 24 9.967 -6.614 -8.731 138 HG SER 24 HG SER 24 12.172 -4.826 -8.588 139 H GLN 25 H GLN 25 7.796 -5.602 -7.162 140 HA GLN 25 HA GLN 25 7.306 -3.212 -8.572 141 HB2 GLN 25 1HB GLN 25 5.785 -5.239 -8.392 142 HB3 GLN 25 2HB GLN 25 5.364 -4.676 -6.776 143 HG2 GLN 25 1HG GLN 25 3.665 -3.924 -8.192 144 HG3 GLN 25 2HG GLN 25 4.671 -2.527 -7.821 145 HE21 GLN 25 1HE2 GLN 25 4.505 -1.836 -11.235 146 HE22 GLN 25 2HE2 GLN 25 3.980 -1.411 -9.644 147 H ALA 26 H ALA 26 7.261 -4.089 -5.160 148 HA ALA 26 HA ALA 26 6.263 -1.554 -4.271 149 HB1 ALA 26 1HB ALA 26 5.872 -3.577 -2.985 150 HB2 ALA 26 2HB ALA 26 6.792 -2.411 -2.034 151 HB3 ALA 26 3HB ALA 26 7.606 -3.794 -2.763 152 H ALA 27 H ALA 27 9.456 -3.155 -4.042 153 HA ALA 27 HA ALA 27 10.721 -1.020 -2.732 154 HB1 ALA 27 1HB ALA 27 12.827 -2.084 -3.369 155 HB2 ALA 27 2HB ALA 27 11.968 -3.115 -4.514 156 HB3 ALA 27 3HB ALA 27 11.662 -3.272 -2.784 157 H GLY 28 H GLY 28 10.301 -1.661 -6.189 158 HA2 GLY 28 1HA GLY 28 11.928 0.363 -7.207 159 HA3 GLY 28 2HA GLY 28 10.428 -0.181 -7.952 160 H LEU 29 H LEU 29 8.560 0.521 -6.167 161 HA LEU 29 HA LEU 29 8.213 3.314 -6.533 162 HB2 LEU 29 1HB LEU 29 6.812 1.370 -4.742 163 HB3 LEU 29 2HB LEU 29 6.239 2.966 -5.100 164 HG LEU 29 HG LEU 29 6.516 0.717 -7.085 165 HD11 LEU 29 1HD1 LEU 29 4.118 2.012 -5.807 166 HD12 LEU 29 2HD1 LEU 29 4.667 0.348 -5.599 167 HD13 LEU 29 3HD1 LEU 29 4.047 0.884 -7.160 168 HD21 LEU 29 1HD2 LEU 29 5.475 3.529 -7.443 169 HD22 LEU 29 2HD2 LEU 29 5.379 2.237 -8.642 170 HD23 LEU 29 3HD2 LEU 29 6.950 2.861 -8.144 171 H ILE 30 H ILE 30 8.845 1.324 -3.666 172 HA ILE 30 HA ILE 30 8.952 3.237 -1.685 173 HB ILE 30 HB ILE 30 10.580 0.732 -2.035 174 HG12 ILE 30 1HG1 ILE 30 8.134 1.342 -0.377 175 HG13 ILE 30 2HG1 ILE 30 8.107 0.527 -1.933 176 HG21 ILE 30 1HG2 ILE 30 10.158 2.152 0.576 177 HG22 ILE 30 2HG2 ILE 30 11.570 2.460 -0.435 178 HG23 ILE 30 3HG2 ILE 30 11.276 0.841 0.206 179 HD11 ILE 30 1HD1 ILE 30 7.902 -1.004 -0.051 180 HD12 ILE 30 2HD1 ILE 30 9.486 -0.488 0.533 181 HD13 ILE 30 3HD1 ILE 30 9.343 -1.319 -1.018 182 H GLN 31 H GLN 31 11.566 2.118 -3.768 183 HA GLN 31 HA GLN 31 13.469 3.877 -2.703 184 HB2 GLN 31 1HB GLN 31 13.327 2.170 -5.149 185 HB3 GLN 31 2HB GLN 31 14.703 3.242 -4.883 186 HG2 GLN 31 1HG GLN 31 14.992 2.080 -2.672 187 HG3 GLN 31 2HG GLN 31 13.770 0.934 -3.219 188 HE21 GLN 31 1HE2 GLN 31 17.271 -0.214 -3.993 189 HE22 GLN 31 2HE2 GLN 31 16.552 0.459 -2.569 190 H GLN 32 H GLN 32 10.946 4.326 -5.017 191 HA GLN 32 HA GLN 32 12.166 6.620 -6.268 192 HB2 GLN 32 1HB GLN 32 9.323 5.619 -6.215 193 HB3 GLN 32 2HB GLN 32 9.808 7.076 -7.064 194 HG2 GLN 32 1HG GLN 32 10.822 4.302 -7.605 195 HG3 GLN 32 2HG GLN 32 9.601 5.166 -8.535 196 HE21 GLN 32 1HE2 GLN 32 11.872 7.152 -10.291 197 HE22 GLN 32 2HE2 GLN 32 10.225 6.896 -9.834 198 H LEU 33 H LEU 33 10.094 5.995 -3.549 199 HA LEU 33 HA LEU 33 9.567 8.810 -3.078 200 HB2 LEU 33 1HB LEU 33 8.977 6.672 -1.084 201 HB3 LEU 33 2HB LEU 33 8.061 8.116 -1.464 202 HG LEU 33 HG LEU 33 8.242 5.711 -3.275 203 HD11 LEU 33 1HD1 LEU 33 7.150 5.247 -1.091 204 HD12 LEU 33 2HD1 LEU 33 6.108 5.054 -2.494 205 HD13 LEU 33 3HD1 LEU 33 5.962 6.491 -1.484 206 HD21 LEU 33 1HD2 LEU 33 7.686 7.588 -4.579 207 HD22 LEU 33 2HD2 LEU 33 6.611 8.233 -3.335 208 HD23 LEU 33 3HD2 LEU 33 6.151 6.777 -4.230 209 H GLY 34 H GLY 34 11.787 6.376 -2.156 210 HA2 GLY 34 1HA GLY 34 13.792 6.598 -1.018 211 HA3 GLY 34 2HA GLY 34 13.336 8.240 -0.582 212 H LEU 35 H LEU 35 11.246 5.530 -0.048 213 HA LEU 35 HA LEU 35 10.905 6.171 2.689 214 HB2 LEU 35 1HB LEU 35 9.992 3.950 0.929 215 HB3 LEU 35 2HB LEU 35 9.680 3.888 2.643 216 HG LEU 35 HG LEU 35 8.710 6.000 0.725 217 HD11 LEU 35 1HD1 LEU 35 6.511 5.071 1.190 218 HD12 LEU 35 2HD1 LEU 35 7.241 3.841 2.222 219 HD13 LEU 35 3HD1 LEU 35 7.583 3.857 0.492 220 HD21 LEU 35 1HD2 LEU 35 9.129 7.012 2.874 221 HD22 LEU 35 2HD2 LEU 35 8.288 5.699 3.696 222 HD23 LEU 35 3HD2 LEU 35 7.391 6.808 2.660 223 H SER 36 H SER 36 12.619 5.934 3.995 224 HA SER 36 HA SER 36 14.125 3.430 3.940 225 HB2 SER 36 1HB SER 36 15.341 5.613 4.071 226 HB3 SER 36 2HB SER 36 14.580 5.901 5.634 227 HG SER 36 HG SER 36 16.394 3.837 4.931 228 H GLY 37 H GLY 37 14.118 1.972 5.622 229 HA2 GLY 37 1HA GLY 37 13.642 1.399 7.920 230 HA3 GLY 37 2HA GLY 37 12.328 2.567 7.891 231 H VAL 38 H VAL 38 11.620 1.557 5.144 232 HA VAL 38 HA VAL 38 9.757 -0.477 5.949 233 HB VAL 38 HB VAL 38 10.477 0.397 3.140 234 HG11 VAL 38 1HG1 VAL 38 9.178 -1.645 3.244 235 HG12 VAL 38 2HG1 VAL 38 8.194 -0.324 2.615 236 HG13 VAL 38 3HG1 VAL 38 7.991 -0.861 4.282 237 HG21 VAL 38 1HG2 VAL 38 8.429 1.569 5.018 238 HG22 VAL 38 2HG2 VAL 38 8.608 1.981 3.313 239 HG23 VAL 38 3HG2 VAL 38 9.900 2.359 4.452 240 H GLY 39 H GLY 39 10.575 -2.440 6.406 241 HA2 GLY 39 1HA GLY 39 12.783 -3.510 4.811 242 HA3 GLY 39 2HA GLY 39 12.218 -4.143 6.353 243 H ALA 40 H ALA 40 12.458 -6.161 4.938 244 HA ALA 40 HA ALA 40 10.557 -6.535 2.845 245 HB1 ALA 40 1HB ALA 40 11.329 -8.866 2.832 246 HB2 ALA 40 2HB ALA 40 12.247 -8.559 4.307 247 HB3 ALA 40 3HB ALA 40 12.671 -7.722 2.812 248 H ASN 41 H ASN 41 10.410 -6.856 6.252 249 HA ASN 41 HA ASN 41 8.145 -8.673 6.198 250 HB2 ASN 41 1HB ASN 41 9.609 -7.287 8.446 251 HB3 ASN 41 2HB ASN 41 8.183 -8.284 8.697 252 HD21 ASN 41 1HD2 ASN 41 11.407 -10.196 9.092 253 HD22 ASN 41 2HD2 ASN 41 10.894 -8.652 9.674 254 H VAL 42 H VAL 42 8.303 -5.717 5.219 255 HA VAL 42 HA VAL 42 6.081 -4.631 6.785 256 HB VAL 42 HB VAL 42 7.789 -3.241 4.723 257 HG11 VAL 42 1HG1 VAL 42 5.752 -2.198 6.688 258 HG12 VAL 42 2HG1 VAL 42 5.713 -2.065 4.928 259 HG13 VAL 42 3HG1 VAL 42 6.934 -1.180 5.858 260 HG21 VAL 42 1HG2 VAL 42 9.179 -3.851 6.501 261 HG22 VAL 42 2HG2 VAL 42 7.952 -3.419 7.700 262 HG23 VAL 42 3HG2 VAL 42 8.757 -2.155 6.763 263 HA PRO 43 HA PRO 43 3.348 -5.591 3.420 264 HB2 PRO 43 2HB PRO 43 1.260 -4.111 4.543 265 HB3 PRO 43 1HB PRO 43 1.550 -5.824 4.771 266 HG2 PRO 43 2HG PRO 43 1.816 -3.719 6.670 267 HG3 PRO 43 1HG PRO 43 2.052 -5.453 6.918 268 HD2 PRO 43 2HD PRO 43 4.025 -3.355 6.658 269 HD3 PRO 43 1HD PRO 43 4.263 -5.044 7.117 270 H VAL 44 H VAL 44 2.755 -4.482 1.585 271 HA VAL 44 HA VAL 44 2.576 -1.566 1.759 272 HB VAL 44 HB VAL 44 3.920 -1.226 -0.238 273 HG11 VAL 44 1HG1 VAL 44 6.151 -1.827 0.666 274 HG12 VAL 44 2HG1 VAL 44 5.342 -2.789 1.907 275 HG13 VAL 44 3HG1 VAL 44 5.096 -1.043 1.841 276 HG21 VAL 44 1HG2 VAL 44 3.607 -3.215 -1.465 277 HG22 VAL 44 2HG2 VAL 44 4.256 -4.206 -0.157 278 HG23 VAL 44 3HG2 VAL 44 5.324 -3.144 -1.069 279 H GLY 45 H GLY 45 1.746 -0.673 -0.353 280 HA2 GLY 45 1HA GLY 45 -0.014 -2.629 -1.675 281 HA3 GLY 45 2HA GLY 45 -0.593 -1.037 -1.221 282 H ILE 46 H ILE 46 0.138 -2.695 -3.762 283 HA ILE 46 HA ILE 46 1.816 -0.768 -5.158 284 HB ILE 46 HB ILE 46 0.665 -3.457 -5.894 285 HG12 ILE 46 1HG1 ILE 46 2.901 -4.272 -5.945 286 HG13 ILE 46 2HG1 ILE 46 3.567 -2.666 -5.987 287 HG21 ILE 46 1HG2 ILE 46 1.684 -3.265 -8.086 288 HG22 ILE 46 2HG2 ILE 46 2.245 -1.639 -7.702 289 HG23 ILE 46 3HG2 ILE 46 0.516 -1.964 -7.835 290 HD11 ILE 46 1HD1 ILE 46 3.963 -3.810 -3.887 291 HD12 ILE 46 2HD1 ILE 46 2.221 -3.887 -3.616 292 HD13 ILE 46 3HD1 ILE 46 3.037 -2.323 -3.679 293 H ASN 47 H ASN 47 0.880 0.873 -6.248 294 HA ASN 47 HA ASN 47 -0.555 2.036 -7.592 295 HB2 ASN 47 1HB ASN 47 -0.397 -0.074 -8.963 296 HB3 ASN 47 2HB ASN 47 -1.835 -0.651 -8.142 297 HD21 ASN 47 1HD2 ASN 47 -2.458 2.660 -10.414 298 HD22 ASN 47 2HD2 ASN 47 -1.188 2.633 -9.251 299 H CYS 48 H CYS 48 -1.161 2.376 -5.065 300 HA CYS 48 HA CYS 48 -3.895 1.521 -4.576 301 HB2 CYS 48 2HB CYS 48 -1.984 3.016 -2.781 302 HB3 CYS 48 1HB CYS 48 -3.550 2.383 -2.325 303 H ASN 49 H ASN 49 -5.587 2.809 -4.531 304 HA ASN 49 HA ASN 49 -5.241 5.693 -4.284 305 HB2 ASN 49 1HB ASN 49 -7.109 5.963 -6.031 306 HB3 ASN 49 2HB ASN 49 -5.495 5.604 -6.625 307 HD21 ASN 49 1HD2 ASN 49 -6.343 2.531 -8.027 308 HD22 ASN 49 2HD2 ASN 49 -5.088 3.636 -7.582 309 HA PRO 50 HA PRO 50 -8.295 5.199 -1.255 310 HB2 PRO 50 2HB PRO 50 -9.344 7.873 -1.846 311 HB3 PRO 50 1HB PRO 50 -8.480 7.303 -0.416 312 HG2 PRO 50 2HG PRO 50 -7.352 8.986 -2.194 313 HG3 PRO 50 1HG PRO 50 -6.414 7.772 -1.312 314 HD2 PRO 50 2HD PRO 50 -7.433 7.704 -4.124 315 HD3 PRO 50 1HD PRO 50 -5.857 7.200 -3.487 316 H ILE 51 H ILE 51 -10.182 4.171 -1.273 317 HA ILE 51 HA ILE 51 -11.796 4.161 -3.658 318 HB ILE 51 HB ILE 51 -12.701 2.925 -1.088 319 HG12 ILE 51 1HG1 ILE 51 -10.534 1.852 -2.898 320 HG13 ILE 51 2HG1 ILE 51 -10.340 2.332 -1.219 321 HG21 ILE 51 1HG2 ILE 51 -13.598 1.229 -2.587 322 HG22 ILE 51 2HG2 ILE 51 -12.829 2.020 -3.963 323 HG23 ILE 51 3HG2 ILE 51 -14.127 2.836 -3.088 324 HD11 ILE 51 1HD1 ILE 51 -10.434 -0.083 -1.448 325 HD12 ILE 51 2HD1 ILE 51 -12.019 0.044 -2.209 326 HD13 ILE 51 3HD1 ILE 51 -11.809 0.522 -0.526 327 H THR 52 H THR 52 -12.512 6.338 -3.733 328 HA THR 52 HA THR 52 -14.536 6.940 -1.687 329 HB THR 52 HB THR 52 -14.071 9.358 -2.128 330 HG1 THR 52 1HG THR 52 -12.740 8.503 -4.179 331 HG21 THR 52 1HG2 THR 52 -13.119 8.222 -0.187 332 HG22 THR 52 2HG2 THR 52 -11.981 9.406 -0.826 333 HG23 THR 52 3HG2 THR 52 -11.745 7.689 -1.153 334 H GLY 53 H GLY 53 -14.408 5.779 -4.597 335 HA2 GLY 53 1HA GLY 53 -16.239 7.557 -5.978 336 HA3 GLY 53 2HA GLY 53 -15.620 6.023 -6.572 337 H ILE 54 H ILE 54 -17.650 7.245 -3.942 338 HA ILE 54 HA ILE 54 -19.101 4.848 -3.594 339 HB ILE 54 HB ILE 54 -19.939 7.644 -2.823 340 HG12 ILE 54 1HG1 ILE 54 -18.421 5.583 -1.206 341 HG13 ILE 54 2HG1 ILE 54 -17.701 7.014 -1.938 342 HG21 ILE 54 1HG2 ILE 54 -21.752 6.007 -2.781 343 HG22 ILE 54 2HG2 ILE 54 -21.318 6.527 -1.150 344 HG23 ILE 54 3HG2 ILE 54 -20.783 4.956 -1.746 345 HD11 ILE 54 1HD1 ILE 54 -19.828 7.000 0.191 346 HD12 ILE 54 2HD1 ILE 54 -19.103 8.434 -0.538 347 HD13 ILE 54 3HD1 ILE 54 -18.115 7.342 0.429 348 H GLY 55 H GLY 55 -20.284 4.023 -5.214 349 HA2 GLY 55 1HA GLY 55 -22.788 4.486 -5.739 350 HA3 GLY 55 2HA GLY 55 -22.098 5.800 -6.678 351 H ALA 56 H ALA 56 -22.958 4.913 -8.584 352 HA ALA 56 HA ALA 56 -22.778 3.835 -10.565 353 HB1 ALA 56 1HB ALA 56 -20.426 4.490 -10.370 354 HB2 ALA 56 2HB ALA 56 -20.619 2.961 -11.229 355 HB3 ALA 56 3HB ALA 56 -20.078 2.969 -9.550 356 H GLY 57 H GLY 57 -23.744 2.372 -8.066 357 HA2 GLY 57 1HA GLY 57 -25.046 0.338 -8.553 358 HA3 GLY 57 2HA GLY 57 -23.594 -0.314 -9.288 359 H SER 58 H SER 58 -21.679 -0.501 -7.761 360 HA SER 58 HA SER 58 -22.634 -2.120 -5.570 361 HB2 SER 58 1HB SER 58 -19.792 -1.602 -6.466 362 HB3 SER 58 2HB SER 58 -20.340 -2.903 -5.412 363 HG SER 58 HG SER 58 -21.074 -2.520 -8.136 364 H GLY 59 H GLY 59 -22.003 1.085 -5.792 365 HA2 GLY 59 1HA GLY 59 -21.845 2.652 -4.070 366 HA3 GLY 59 2HA GLY 59 -21.541 1.336 -2.939 367 H SER 60 H SER 60 -19.535 1.245 -2.145 368 HA SER 60 HA SER 60 -17.383 2.476 -3.726 369 HB2 SER 60 1HB SER 60 -17.159 1.727 -0.814 370 HB3 SER 60 2HB SER 60 -16.245 2.937 -1.720 371 HG SER 60 HG SER 60 -17.866 3.837 -0.328 372 H SER 61 H SER 61 -16.075 1.089 -4.756 373 HA SER 61 HA SER 61 -15.482 -1.492 -3.526 374 HB2 SER 61 1HB SER 61 -15.940 -2.651 -5.702 375 HB3 SER 61 2HB SER 61 -17.383 -2.016 -4.916 376 HG SER 61 HG SER 61 -16.737 -0.063 -6.372 377 H CYS 62 H CYS 62 -13.550 -2.405 -4.184 378 HA CYS 62 HA CYS 62 -11.708 -0.578 -5.518 379 HB2 CYS 62 2HB CYS 62 -10.944 -1.451 -3.405 380 HB3 CYS 62 1HB CYS 62 -11.290 -3.103 -3.902 381 H ASN 63 H ASN 63 -10.592 -1.085 -7.358 382 HA ASN 63 HA ASN 63 -11.808 -2.913 -9.170 383 HB2 ASN 63 1HB ASN 63 -9.759 -2.317 -10.611 384 HB3 ASN 63 2HB ASN 63 -10.894 -1.027 -10.217 385 HD21 ASN 63 1HD2 ASN 63 -7.060 -0.923 -8.902 386 HD22 ASN 63 2HD2 ASN 63 -7.712 -2.322 -9.685 387 H ALA 64 H ALA 64 -9.229 -3.196 -6.904 388 HA ALA 64 HA ALA 64 -8.705 -5.888 -7.926 389 HB1 ALA 64 1HB ALA 64 -6.974 -4.393 -8.818 390 HB2 ALA 64 2HB ALA 64 -6.314 -5.616 -7.728 391 HB3 ALA 64 3HB ALA 64 -6.522 -3.955 -7.169 392 H ASN 65 H ASN 65 -6.799 -4.318 -5.430 393 HA ASN 65 HA ASN 65 -8.104 -6.051 -3.428 394 HB2 ASN 65 1HB ASN 65 -5.198 -5.326 -3.655 395 HB3 ASN 65 2HB ASN 65 -5.886 -6.243 -2.338 396 HD21 ASN 65 1HD2 ASN 65 -5.105 -7.961 -5.925 397 HD22 ASN 65 2HD2 ASN 65 -5.012 -6.254 -5.694 398 HA PRO 66 HA PRO 66 -8.522 -2.070 -1.405 399 HB2 PRO 66 2HB PRO 66 -10.370 -2.880 0.374 400 HB3 PRO 66 1HB PRO 66 -10.773 -2.563 -1.318 401 HG2 PRO 66 2HG PRO 66 -10.357 -5.162 0.074 402 HG3 PRO 66 1HG PRO 66 -11.516 -4.743 -1.196 403 HD2 PRO 66 2HD PRO 66 -9.109 -6.084 -1.595 404 HD3 PRO 66 1HD PRO 66 -10.016 -5.227 -2.854 405 H ALA 67 H ALA 67 -7.422 -1.276 0.320 406 HA ALA 67 HA ALA 67 -6.573 -3.114 2.428 407 HB1 ALA 67 1HB ALA 67 -4.223 -2.501 2.182 408 HB2 ALA 67 2HB ALA 67 -4.620 -1.532 0.763 409 HB3 ALA 67 3HB ALA 67 -4.835 -3.281 0.726 410 H CYS 68 H CYS 68 -5.750 -2.115 4.276 411 HA CYS 68 HA CYS 68 -6.199 0.787 4.475 412 HB2 CYS 68 2HB CYS 68 -7.501 -0.437 6.105 413 HB3 CYS 68 1HB CYS 68 -6.090 -1.361 6.607 414 H CYS 69 H CYS 69 -4.418 2.010 4.536 415 HA CYS 69 HA CYS 69 -1.892 0.667 5.233 416 HB2 CYS 69 2HB CYS 69 -2.591 1.953 2.825 417 HB3 CYS 69 1HB CYS 69 -1.431 2.992 3.623 418 H ASP 70 H ASP 70 -0.232 2.033 6.100 419 HA ASP 70 HA ASP 70 -1.258 3.888 8.038 420 HB2 ASP 70 1HB ASP 70 0.663 2.328 8.466 421 HB3 ASP 70 2HB ASP 70 1.626 3.276 7.346 422 H ASN 71 H ASN 71 0.616 4.001 5.071 423 HA ASN 71 HA ASN 71 -0.220 6.726 4.563 424 HB2 ASN 71 1HB ASN 71 2.737 6.073 4.772 425 HB3 ASN 71 2HB ASN 71 2.073 7.564 4.135 426 HD21 ASN 71 1HD2 ASN 71 2.578 7.017 8.086 427 HD22 ASN 71 2HD2 ASN 71 2.943 5.794 6.921 428 H VAL 72 H VAL 72 -0.627 6.830 2.359 429 HA VAL 72 HA VAL 72 1.170 5.207 0.693 430 HB VAL 72 HB VAL 72 -0.433 4.653 -0.811 431 HG11 VAL 72 1HG1 VAL 72 -2.081 5.005 1.673 432 HG12 VAL 72 2HG1 VAL 72 -1.092 3.608 1.247 433 HG13 VAL 72 3HG1 VAL 72 -2.519 4.006 0.288 434 HG21 VAL 72 1HG2 VAL 72 -2.462 5.883 -1.306 435 HG22 VAL 72 2HG2 VAL 72 -1.034 6.922 -1.405 436 HG23 VAL 72 3HG2 VAL 72 -2.105 7.015 0.000 437 H TYR 73 H TYR 73 1.403 6.129 -1.544 438 HA TYR 73 HA TYR 73 1.609 9.062 -1.409 439 HB2 TYR 73 2HB TYR 73 3.655 7.049 -2.309 440 HB3 TYR 73 1HB TYR 73 3.819 8.783 -2.578 441 HD1 TYR 73 1HD TYR 73 4.168 10.297 -0.664 442 HD2 TYR 73 2HD TYR 73 4.027 6.078 -0.136 443 HE1 TYR 73 1HE TYR 73 5.147 10.550 1.576 444 HE2 TYR 73 2HE TYR 73 5.009 6.315 2.109 445 HH TYR 73 HH TYR 73 5.149 9.221 3.739 446 H THR 74 H THR 74 1.969 10.013 -3.601 447 HA THR 74 HA THR 74 -0.336 9.321 -5.073 448 HB THR 74 HB THR 74 1.823 11.236 -5.950 449 HG1 THR 74 1HG THR 74 -0.185 11.445 -3.959 450 HG21 THR 74 1HG2 THR 74 -0.047 12.451 -6.975 451 HG22 THR 74 2HG2 THR 74 -1.166 11.213 -6.405 452 HG23 THR 74 3HG2 THR 74 0.060 10.807 -7.605 453 H ASN 75 H ASN 75 2.975 8.371 -5.493 454 HA ASN 75 HA ASN 75 2.775 7.557 -8.210 455 HB2 ASN 75 1HB ASN 75 4.704 6.160 -7.793 456 HB3 ASN 75 2HB ASN 75 4.944 7.701 -6.983 457 HD21 ASN 75 1HD2 ASN 75 5.797 4.744 -4.812 458 HD22 ASN 75 2HD2 ASN 75 6.151 5.090 -6.466 459 H GLY 76 H GLY 76 1.457 6.460 -5.304 460 HA2 GLY 76 1HA GLY 76 -0.443 5.043 -5.336 461 HA3 GLY 76 2HA GLY 76 0.265 4.170 -6.691 462 H LEU 77 H LEU 77 2.494 4.942 -4.184 463 HA LEU 77 HA LEU 77 2.555 2.100 -3.489 464 HB2 LEU 77 1HB LEU 77 4.612 3.248 -4.215 465 HB3 LEU 77 2HB LEU 77 4.474 4.333 -2.860 466 HG LEU 77 HG LEU 77 6.182 2.435 -2.696 467 HD11 LEU 77 1HD1 LEU 77 5.783 2.073 -0.322 468 HD12 LEU 77 2HD1 LEU 77 4.146 2.717 -0.500 469 HD13 LEU 77 3HD1 LEU 77 5.536 3.765 -0.768 470 HD21 LEU 77 1HD2 LEU 77 4.719 0.665 -3.541 471 HD22 LEU 77 2HD2 LEU 77 3.702 0.836 -2.105 472 HD23 LEU 77 3HD2 LEU 77 5.375 0.294 -1.948 473 H GLY 78 H GLY 78 1.710 1.379 -1.669 474 HA2 GLY 78 1HA GLY 78 1.161 3.320 0.474 475 HA3 GLY 78 2HA GLY 78 0.279 1.824 0.226 476 H VAL 79 H VAL 79 1.753 2.912 2.578 477 HA VAL 79 HA VAL 79 3.645 0.680 2.943 478 HB VAL 79 HB VAL 79 4.544 3.085 3.054 479 HG11 VAL 79 1HG1 VAL 79 3.193 3.050 5.735 480 HG12 VAL 79 2HG1 VAL 79 2.766 4.078 4.368 481 HG13 VAL 79 3HG1 VAL 79 4.332 4.266 5.157 482 HG21 VAL 79 1HG2 VAL 79 5.789 1.144 3.840 483 HG22 VAL 79 2HG2 VAL 79 5.008 1.284 5.418 484 HG23 VAL 79 3HG2 VAL 79 6.087 2.560 4.848 485 H GLN 80 H GLN 80 3.186 -0.773 4.430 486 HA GLN 80 HA GLN 80 2.146 -1.930 6.061 487 HB2 GLN 80 1HB GLN 80 1.679 0.868 7.053 488 HB3 GLN 80 2HB GLN 80 0.984 -0.506 7.899 489 HG2 GLN 80 1HG GLN 80 3.887 -0.353 7.248 490 HG3 GLN 80 2HG GLN 80 3.229 0.392 8.706 491 HE21 GLN 80 1HE2 GLN 80 4.444 -3.129 9.299 492 HE22 GLN 80 2HE2 GLN 80 5.140 -1.761 8.498 493 H CYS 81 H CYS 81 0.862 -1.950 3.805 494 HA CYS 81 HA CYS 81 -1.937 -1.252 4.197 495 HB2 CYS 81 2HB CYS 81 -0.445 -2.430 1.863 496 HB3 CYS 81 1HB CYS 81 -2.194 -2.436 1.923 497 H ASN 82 H ASN 82 -3.212 -2.543 5.296 498 HA ASN 82 HA ASN 82 -2.814 -5.447 5.061 499 HB2 ASN 82 1HB ASN 82 -4.403 -5.560 7.039 500 HB3 ASN 82 2HB ASN 82 -2.814 -4.883 7.355 501 HD21 ASN 82 1HD2 ASN 82 -3.985 -1.741 8.274 502 HD22 ASN 82 2HD2 ASN 82 -2.625 -2.735 7.887 503 HA PRO 83 HA PRO 83 -6.192 -5.630 2.287 504 HB2 PRO 83 2HB PRO 83 -6.725 -8.340 3.312 505 HB3 PRO 83 1HB PRO 83 -6.254 -7.824 1.692 506 HG2 PRO 83 2HG PRO 83 -4.550 -9.115 3.319 507 HG3 PRO 83 1HG PRO 83 -4.005 -7.866 2.185 508 HD2 PRO 83 2HD PRO 83 -4.437 -7.687 5.140 509 HD3 PRO 83 1HD PRO 83 -3.164 -6.965 4.136 510 H ILE 84 H ILE 84 -8.270 -5.083 2.326 511 HA ILE 84 HA ILE 84 -9.721 -5.027 4.834 512 HB ILE 84 HB ILE 84 -10.544 -4.173 2.063 513 HG12 ILE 84 1HG1 ILE 84 -8.706 -2.835 2.901 514 HG13 ILE 84 2HG1 ILE 84 -10.186 -1.888 2.922 515 HG21 ILE 84 1HG2 ILE 84 -12.359 -2.937 3.159 516 HG22 ILE 84 2HG2 ILE 84 -11.909 -3.673 4.697 517 HG23 ILE 84 3HG2 ILE 84 -12.509 -4.682 3.378 518 HD11 ILE 84 1HD1 ILE 84 -10.410 -2.350 5.326 519 HD12 ILE 84 2HD1 ILE 84 -8.932 -1.476 4.920 520 HD13 ILE 84 3HD1 ILE 84 -8.867 -3.203 5.276 521 H ASN 85 H ASN 85 -11.624 -6.036 5.243 522 HA ASN 85 HA ASN 85 -11.945 -8.663 4.108 523 HB2 ASN 85 1HB ASN 85 -12.183 -8.232 6.529 524 HB3 ASN 85 2HB ASN 85 -13.548 -7.177 6.202 525 HD21 ASN 85 1HD2 ASN 85 -14.589 -10.647 7.220 526 HD22 ASN 85 2HD2 ASN 85 -13.436 -9.526 7.858 527 H VAL 86 H VAL 86 -12.673 -8.481 2.058 528 HA VAL 86 HA VAL 86 -15.354 -7.349 1.694 529 HB VAL 86 HB VAL 86 -14.614 -6.851 -0.707 530 HG11 VAL 86 1HG1 VAL 86 -13.627 -4.690 -0.101 531 HG12 VAL 86 2HG1 VAL 86 -13.364 -5.276 1.540 532 HG13 VAL 86 3HG1 VAL 86 -15.005 -5.087 0.924 533 HG21 VAL 86 1HG2 VAL 86 -12.253 -6.532 -1.109 534 HG22 VAL 86 2HG2 VAL 86 -12.542 -8.195 -0.602 535 HG23 VAL 86 3HG2 VAL 86 -11.875 -7.029 0.539 536 H ASN 87 H ASN 87 -16.262 -9.361 1.940 537 HA ASN 87 HA ASN 87 -16.827 -11.534 1.559 538 HB2 ASN 87 1HB ASN 87 -17.391 -10.600 -0.709 539 HB3 ASN 87 2HB ASN 87 -15.778 -11.050 -1.247 540 HD21 ASN 87 1HD2 ASN 87 -18.717 -13.822 -0.887 541 HD22 ASN 87 2HD2 ASN 87 -18.916 -12.207 -0.305 542 H LEU 88 H LEU 88 -14.865 -11.636 3.038 543 HA LEU 88 HA LEU 88 -12.311 -12.253 2.149 544 HB2 LEU 88 1HB LEU 88 -11.790 -12.964 4.347 545 HB3 LEU 88 2HB LEU 88 -12.922 -11.639 4.489 546 HG LEU 88 HG LEU 88 -13.746 -14.532 4.734 547 HD11 LEU 88 1HD1 LEU 88 -12.106 -14.039 6.453 548 HD12 LEU 88 2HD1 LEU 88 -13.716 -14.179 7.156 549 HD13 LEU 88 3HD1 LEU 88 -12.996 -12.588 6.912 550 HD21 LEU 88 1HD2 LEU 88 -15.081 -11.936 5.493 551 HD22 LEU 88 2HD2 LEU 88 -15.669 -13.535 5.948 552 HD23 LEU 88 3HD2 LEU 88 -15.597 -13.076 4.248 Start of MODEL 12 1 H1 GLY 1 1H GLY 1 -20.481 10.818 7.167 2 H2 GLY 1 2H GLY 1 -18.994 10.021 7.151 3 H3 GLY 1 3H GLY 1 -20.025 9.855 8.481 4 HA2 GLY 1 1HA GLY 1 -20.125 7.877 7.143 5 HA3 GLY 1 2HA GLY 1 -21.659 8.733 7.096 6 H SER 2 H SER 2 -20.875 6.873 5.172 7 HA SER 2 HA SER 2 -20.737 6.529 2.947 8 HB2 SER 2 1HB SER 2 -21.592 9.427 2.791 9 HB3 SER 2 2HB SER 2 -21.617 8.283 1.449 10 HG SER 2 HG SER 2 -23.585 8.690 2.975 11 H GLY 3 H GLY 3 -18.368 6.581 3.821 12 HA2 GLY 3 1HA GLY 3 -16.842 7.701 1.658 13 HA3 GLY 3 2HA GLY 3 -16.474 8.429 3.217 14 H SER 4 H SER 4 -14.693 7.575 4.063 15 HA SER 4 HA SER 4 -13.841 4.911 3.393 16 HB2 SER 4 1HB SER 4 -12.226 6.764 3.722 17 HB3 SER 4 2HB SER 4 -12.686 6.844 5.421 18 HG SER 4 HG SER 4 -11.795 4.851 5.753 19 H SER 5 H SER 5 -15.789 3.891 4.182 20 HA SER 5 HA SER 5 -16.603 3.844 6.859 21 HB2 SER 5 1HB SER 5 -16.809 1.617 4.818 22 HB3 SER 5 2HB SER 5 -17.815 1.822 6.251 23 HG SER 5 HG SER 5 -17.937 4.086 4.909 24 H GLN 6 H GLN 6 -14.168 2.033 5.132 25 HA GLN 6 HA GLN 6 -13.566 0.434 7.509 26 HB2 GLN 6 1HB GLN 6 -12.524 0.119 4.694 27 HB3 GLN 6 2HB GLN 6 -12.316 -1.015 6.017 28 HG2 GLN 6 1HG GLN 6 -14.955 -0.272 4.788 29 HG3 GLN 6 2HG GLN 6 -14.014 -1.708 4.396 30 HE21 GLN 6 1HE2 GLN 6 -14.973 -3.505 7.234 31 HE22 GLN 6 2HE2 GLN 6 -13.894 -3.386 5.889 32 H CYS 7 H CYS 7 -11.157 -0.026 7.754 33 HA CYS 7 HA CYS 7 -8.987 0.528 7.994 34 HB2 CYS 7 2HB CYS 7 -8.933 1.152 5.663 35 HB3 CYS 7 1HB CYS 7 -9.638 2.715 6.038 36 H ASN 8 H ASN 8 -8.497 1.156 9.944 37 HA ASN 8 HA ASN 8 -9.531 3.660 11.007 38 HB2 ASN 8 1HB ASN 8 -8.085 1.325 12.231 39 HB3 ASN 8 2HB ASN 8 -8.288 2.837 13.108 40 HD21 ASN 8 1HD2 ASN 8 -11.175 1.336 14.363 41 HD22 ASN 8 2HD2 ASN 8 -9.534 1.788 14.667 42 H ALA 9 H ALA 9 -6.724 2.555 9.450 43 HA ALA 9 HA ALA 9 -4.923 4.357 10.845 44 HB1 ALA 9 1HB ALA 9 -3.177 3.431 9.414 45 HB2 ALA 9 2HB ALA 9 -4.395 2.548 8.492 46 HB3 ALA 9 3HB ALA 9 -4.112 2.149 10.185 47 H GLY 10 H GLY 10 -7.129 4.664 8.416 48 HA2 GLY 10 1HA GLY 10 -6.708 7.279 7.802 49 HA3 GLY 10 2HA GLY 10 -5.670 6.422 6.670 50 HA PRO 11 HA PRO 11 -9.780 6.376 4.649 51 HB2 PRO 11 2HB PRO 11 -9.023 7.231 2.239 52 HB3 PRO 11 1HB PRO 11 -9.230 8.371 3.577 53 HG2 PRO 11 2HG PRO 11 -6.723 7.155 2.496 54 HG3 PRO 11 1HG PRO 11 -7.032 8.842 2.949 55 HD2 PRO 11 2HD PRO 11 -5.753 7.031 4.571 56 HD3 PRO 11 1HD PRO 11 -6.656 8.432 5.179 57 H VAL 12 H VAL 12 -10.517 5.023 2.955 58 HA VAL 12 HA VAL 12 -9.220 2.507 2.865 59 HB VAL 12 HB VAL 12 -11.057 1.940 1.193 60 HG11 VAL 12 1HG1 VAL 12 -11.185 1.488 3.614 61 HG12 VAL 12 2HG1 VAL 12 -12.762 1.840 2.908 62 HG13 VAL 12 3HG1 VAL 12 -11.921 3.075 3.851 63 HG21 VAL 12 1HG2 VAL 12 -11.436 4.239 0.378 64 HG22 VAL 12 2HG2 VAL 12 -12.042 4.690 1.972 65 HG23 VAL 12 3HG2 VAL 12 -12.913 3.504 1.002 66 H GLN 13 H GLN 13 -7.951 1.590 1.364 67 HA GLN 13 HA GLN 13 -7.394 3.168 -1.063 68 HB2 GLN 13 1HB GLN 13 -5.477 1.283 0.320 69 HB3 GLN 13 2HB GLN 13 -5.125 2.368 -1.014 70 HG2 GLN 13 1HG GLN 13 -5.901 3.226 1.758 71 HG3 GLN 13 2HG GLN 13 -4.262 3.188 1.115 72 HE21 GLN 13 1HE2 GLN 13 -5.936 6.577 0.837 73 HE22 GLN 13 2HE2 GLN 13 -5.927 5.408 2.112 74 H CYS 14 H CYS 14 -7.106 2.088 -2.988 75 HA CYS 14 HA CYS 14 -7.859 -0.760 -3.030 76 HB2 CYS 14 2HB CYS 14 -9.640 0.627 -3.963 77 HB3 CYS 14 1HB CYS 14 -8.499 1.397 -5.057 78 H CYS 15 H CYS 15 -5.968 -1.754 -3.229 79 HA CYS 15 HA CYS 15 -3.872 -0.610 -4.905 80 HB2 CYS 15 2HB CYS 15 -3.840 -3.007 -3.056 81 HB3 CYS 15 1HB CYS 15 -2.446 -2.370 -3.907 82 H ASN 16 H ASN 16 -2.890 -1.734 -6.589 83 HA ASN 16 HA ASN 16 -4.491 -3.640 -8.009 84 HB2 ASN 16 1HB ASN 16 -2.878 -1.917 -8.982 85 HB3 ASN 16 2HB ASN 16 -1.600 -3.019 -8.502 86 HD21 ASN 16 1HD2 ASN 16 -1.869 -4.347 -11.705 87 HD22 ASN 16 2HD2 ASN 16 -0.943 -3.389 -10.606 88 H THR 17 H THR 17 -1.577 -3.701 -6.059 89 HA THR 17 HA THR 17 -1.852 -6.599 -5.750 90 HB THR 17 HB THR 17 0.743 -5.193 -6.452 91 HG1 THR 17 1HG THR 17 -0.926 -7.018 -7.858 92 HG21 THR 17 1HG2 THR 17 0.190 -8.064 -5.714 93 HG22 THR 17 2HG2 THR 17 1.241 -6.920 -4.872 94 HG23 THR 17 3HG2 THR 17 1.680 -7.508 -6.476 95 H LEU 18 H LEU 18 -1.951 -7.031 -3.629 96 HA LEU 18 HA LEU 18 -0.520 -5.276 -1.763 97 HB2 LEU 18 1HB LEU 18 -2.570 -7.443 -1.307 98 HB3 LEU 18 2HB LEU 18 -1.683 -6.679 -0.004 99 HG LEU 18 HG LEU 18 -3.520 -5.257 -1.916 100 HD11 LEU 18 1HD1 LEU 18 -4.666 -6.768 -0.315 101 HD12 LEU 18 2HD1 LEU 18 -5.037 -5.065 -0.051 102 HD13 LEU 18 3HD1 LEU 18 -3.893 -5.892 1.008 103 HD21 LEU 18 1HD2 LEU 18 -3.215 -3.339 -0.480 104 HD22 LEU 18 2HD2 LEU 18 -1.656 -3.877 -1.095 105 HD23 LEU 18 3HD2 LEU 18 -2.128 -4.256 0.562 106 H THR 19 H THR 19 1.495 -5.807 -1.506 107 HA THR 19 HA THR 19 2.217 -8.597 -1.082 108 HB THR 19 HB THR 19 2.555 -8.334 -3.461 109 HG1 THR 19 1HG THR 19 4.368 -9.376 -3.315 110 HG21 THR 19 1HG2 THR 19 4.147 -5.878 -2.748 111 HG22 THR 19 2HG2 THR 19 2.716 -5.986 -3.779 112 HG23 THR 19 3HG2 THR 19 4.248 -6.670 -4.319 113 H SER 20 H SER 20 4.919 -8.368 -0.861 114 HA SER 20 HA SER 20 5.130 -6.638 1.495 115 HB2 SER 20 1HB SER 20 6.941 -8.890 0.585 116 HB3 SER 20 2HB SER 20 7.023 -8.045 2.129 117 HG SER 20 HG SER 20 4.739 -8.802 2.356 118 H ALA 21 H ALA 21 7.181 -5.507 1.852 119 HA ALA 21 HA ALA 21 7.780 -3.885 -0.396 120 HB1 ALA 21 1HB ALA 21 9.134 -4.024 2.289 121 HB2 ALA 21 2HB ALA 21 7.735 -3.030 1.880 122 HB3 ALA 21 3HB ALA 21 9.293 -2.721 1.111 123 H SER 22 H SER 22 8.809 -6.910 0.069 124 HA SER 22 HA SER 22 11.552 -6.511 -0.798 125 HB2 SER 22 1HB SER 22 10.950 -8.328 0.810 126 HB3 SER 22 2HB SER 22 10.030 -9.095 -0.476 127 HG SER 22 HG SER 22 12.242 -8.790 -1.623 128 H ASN 23 H ASN 23 8.464 -6.765 -2.125 129 HA ASN 23 HA ASN 23 9.091 -8.081 -4.577 130 HB2 ASN 23 1HB ASN 23 6.767 -7.751 -3.558 131 HB3 ASN 23 2HB ASN 23 6.847 -6.099 -4.149 132 HD21 ASN 23 1HD2 ASN 23 6.122 -9.174 -6.674 133 HD22 ASN 23 2HD2 ASN 23 6.550 -9.439 -5.020 134 H SER 24 H SER 24 9.722 -7.247 -6.501 135 HA SER 24 HA SER 24 11.259 -4.901 -6.495 136 HB2 SER 24 1HB SER 24 10.203 -6.414 -8.891 137 HB3 SER 24 2HB SER 24 11.595 -5.331 -8.859 138 HG SER 24 HG SER 24 12.253 -7.499 -8.704 139 H GLN 25 H GLN 25 7.905 -5.464 -7.274 140 HA GLN 25 HA GLN 25 7.395 -3.057 -8.657 141 HB2 GLN 25 1HB GLN 25 5.852 -5.057 -8.482 142 HB3 GLN 25 2HB GLN 25 5.503 -4.553 -6.827 143 HG2 GLN 25 1HG GLN 25 3.754 -3.755 -8.165 144 HG3 GLN 25 2HG GLN 25 4.763 -2.374 -7.743 145 HE21 GLN 25 1HE2 GLN 25 3.821 -2.437 -11.398 146 HE22 GLN 25 2HE2 GLN 25 2.899 -2.716 -9.965 147 H ALA 26 H ALA 26 7.102 -4.020 -5.275 148 HA ALA 26 HA ALA 26 6.251 -1.515 -4.287 149 HB1 ALA 26 1HB ALA 26 6.872 -2.446 -2.090 150 HB2 ALA 26 2HB ALA 26 7.636 -3.812 -2.903 151 HB3 ALA 26 3HB ALA 26 5.896 -3.562 -3.045 152 H ALA 27 H ALA 27 9.452 -3.102 -4.191 153 HA ALA 27 HA ALA 27 10.730 -0.999 -2.835 154 HB1 ALA 27 1HB ALA 27 12.829 -2.047 -3.519 155 HB2 ALA 27 2HB ALA 27 11.958 -3.050 -4.681 156 HB3 ALA 27 3HB ALA 27 11.669 -3.250 -2.952 157 H GLY 28 H GLY 28 10.193 -1.510 -6.292 158 HA2 GLY 28 1HA GLY 28 11.867 0.519 -7.264 159 HA3 GLY 28 2HA GLY 28 10.364 0.003 -8.022 160 H LEU 29 H LEU 29 8.500 0.643 -6.240 161 HA LEU 29 HA LEU 29 8.118 3.432 -6.470 162 HB2 LEU 29 1HB LEU 29 6.818 1.418 -4.679 163 HB3 LEU 29 2HB LEU 29 6.193 3.004 -4.997 164 HG LEU 29 HG LEU 29 6.474 0.788 -7.020 165 HD11 LEU 29 1HD1 LEU 29 4.004 0.891 -7.037 166 HD12 LEU 29 2HD1 LEU 29 4.074 2.016 -5.679 167 HD13 LEU 29 3HD1 LEU 29 4.670 0.365 -5.491 168 HD21 LEU 29 1HD2 LEU 29 5.255 2.307 -8.525 169 HD22 LEU 29 2HD2 LEU 29 6.835 2.944 -8.069 170 HD23 LEU 29 3HD2 LEU 29 5.375 3.585 -7.313 171 H ILE 30 H ILE 30 8.802 1.375 -3.661 172 HA ILE 30 HA ILE 30 8.966 3.230 -1.635 173 HB ILE 30 HB ILE 30 10.595 0.741 -2.075 174 HG12 ILE 30 1HG1 ILE 30 8.146 1.272 -0.395 175 HG13 ILE 30 2HG1 ILE 30 8.124 0.511 -1.977 176 HG21 ILE 30 1HG2 ILE 30 11.553 2.444 -0.414 177 HG22 ILE 30 2HG2 ILE 30 11.308 0.792 0.154 178 HG23 ILE 30 3HG2 ILE 30 10.154 2.049 0.588 179 HD11 ILE 30 1HD1 ILE 30 9.528 -0.572 0.441 180 HD12 ILE 30 2HD1 ILE 30 9.373 -1.354 -1.135 181 HD13 ILE 30 3HD1 ILE 30 7.943 -1.080 -0.139 182 H GLN 31 H GLN 31 11.528 2.148 -3.795 183 HA GLN 31 HA GLN 31 13.484 3.816 -2.698 184 HB2 GLN 31 1HB GLN 31 13.260 2.243 -5.230 185 HB3 GLN 31 2HB GLN 31 14.668 3.257 -4.919 186 HG2 GLN 31 1HG GLN 31 14.992 1.969 -2.809 187 HG3 GLN 31 2HG GLN 31 13.677 0.920 -3.329 188 HE21 GLN 31 1HE2 GLN 31 15.555 -0.854 -5.670 189 HE22 GLN 31 2HE2 GLN 31 13.981 -0.459 -5.074 190 H GLN 32 H GLN 32 10.970 4.398 -5.033 191 HA GLN 32 HA GLN 32 12.218 6.734 -6.160 192 HB2 GLN 32 1HB GLN 32 9.350 5.797 -6.125 193 HB3 GLN 32 2HB GLN 32 9.863 7.284 -6.908 194 HG2 GLN 32 1HG GLN 32 10.756 4.498 -7.580 195 HG3 GLN 32 2HG GLN 32 9.637 5.507 -8.493 196 HE21 GLN 32 1HE2 GLN 32 13.200 5.600 -9.793 197 HE22 GLN 32 2HE2 GLN 32 12.203 4.296 -9.248 198 H LEU 33 H LEU 33 10.024 6.061 -3.536 199 HA LEU 33 HA LEU 33 9.556 8.828 -2.909 200 HB2 LEU 33 1HB LEU 33 9.063 6.599 -0.985 201 HB3 LEU 33 2HB LEU 33 8.124 8.053 -1.255 202 HG LEU 33 HG LEU 33 8.249 5.732 -3.180 203 HD11 LEU 33 1HD1 LEU 33 6.041 6.445 -1.272 204 HD12 LEU 33 2HD1 LEU 33 7.220 5.162 -1.004 205 HD13 LEU 33 3HD1 LEU 33 6.115 5.068 -2.371 206 HD21 LEU 33 1HD2 LEU 33 6.104 6.852 -3.994 207 HD22 LEU 33 2HD2 LEU 33 7.645 7.609 -4.424 208 HD23 LEU 33 3HD2 LEU 33 6.668 8.280 -3.113 209 H GLY 34 H GLY 34 11.808 6.370 -2.089 210 HA2 GLY 34 1HA GLY 34 13.835 6.557 -0.992 211 HA3 GLY 34 2HA GLY 34 13.417 8.209 -0.553 212 H LEU 35 H LEU 35 11.450 5.387 0.011 213 HA LEU 35 HA LEU 35 11.018 6.106 2.724 214 HB2 LEU 35 1HB LEU 35 10.185 3.862 0.968 215 HB3 LEU 35 2HB LEU 35 9.888 3.754 2.684 216 HG LEU 35 HG LEU 35 8.829 5.867 0.815 217 HD11 LEU 35 1HD1 LEU 35 6.666 4.863 1.294 218 HD12 LEU 35 2HD1 LEU 35 7.447 3.642 2.299 219 HD13 LEU 35 3HD1 LEU 35 7.763 3.690 0.564 220 HD21 LEU 35 1HD2 LEU 35 8.448 5.498 3.783 221 HD22 LEU 35 2HD2 LEU 35 7.515 6.604 2.776 222 HD23 LEU 35 3HD2 LEU 35 9.247 6.850 2.980 223 H SER 36 H SER 36 12.660 5.940 4.100 224 HA SER 36 HA SER 36 14.216 3.468 4.183 225 HB2 SER 36 1HB SER 36 15.521 4.843 5.945 226 HB3 SER 36 2HB SER 36 15.652 5.334 4.256 227 HG SER 36 HG SER 36 14.341 6.580 6.391 228 H GLY 37 H GLY 37 13.984 2.002 5.786 229 HA2 GLY 37 1HA GLY 37 13.419 1.469 8.096 230 HA3 GLY 37 2HA GLY 37 12.161 2.697 8.003 231 H VAL 38 H VAL 38 11.989 1.388 5.108 232 HA VAL 38 HA VAL 38 9.902 -0.525 5.846 233 HB VAL 38 HB VAL 38 10.655 0.579 3.128 234 HG11 VAL 38 1HG1 VAL 38 9.502 -1.527 2.957 235 HG12 VAL 38 2HG1 VAL 38 8.416 -0.224 2.477 236 HG13 VAL 38 3HG1 VAL 38 8.250 -0.970 4.065 237 HG21 VAL 38 1HG2 VAL 38 8.473 1.439 5.025 238 HG22 VAL 38 2HG2 VAL 38 8.677 2.016 3.370 239 HG23 VAL 38 3HG2 VAL 38 9.905 2.370 4.586 240 H GLY 39 H GLY 39 10.718 -2.508 6.201 241 HA2 GLY 39 1HA GLY 39 12.911 -3.493 4.531 242 HA3 GLY 39 2HA GLY 39 12.384 -4.189 6.052 243 H ALA 40 H ALA 40 12.541 -6.190 4.722 244 HA ALA 40 HA ALA 40 10.722 -6.513 2.539 245 HB1 ALA 40 1HB ALA 40 12.435 -8.510 4.005 246 HB2 ALA 40 2HB ALA 40 12.823 -7.681 2.496 247 HB3 ALA 40 3HB ALA 40 11.513 -8.861 2.544 248 H ASN 41 H ASN 41 10.510 -7.008 5.939 249 HA ASN 41 HA ASN 41 8.324 -8.878 5.829 250 HB2 ASN 41 1HB ASN 41 8.188 -8.478 8.265 251 HB3 ASN 41 2HB ASN 41 9.820 -8.878 7.756 252 HD21 ASN 41 1HD2 ASN 41 8.974 -5.282 9.423 253 HD22 ASN 41 2HD2 ASN 41 7.728 -6.412 9.011 254 H VAL 42 H VAL 42 8.601 -5.664 5.171 255 HA VAL 42 HA VAL 42 6.268 -4.686 6.530 256 HB VAL 42 HB VAL 42 8.016 -3.366 4.460 257 HG11 VAL 42 1HG1 VAL 42 5.857 -2.283 6.247 258 HG12 VAL 42 2HG1 VAL 42 6.027 -2.104 4.500 259 HG13 VAL 42 3HG1 VAL 42 7.142 -1.266 5.590 260 HG21 VAL 42 1HG2 VAL 42 8.076 -3.438 7.449 261 HG22 VAL 42 2HG2 VAL 42 8.928 -2.224 6.494 262 HG23 VAL 42 3HG2 VAL 42 9.335 -3.935 6.313 263 HA PRO 43 HA PRO 43 3.471 -5.703 3.226 264 HB2 PRO 43 2HB PRO 43 1.370 -4.288 4.434 265 HB3 PRO 43 1HB PRO 43 1.718 -5.995 4.620 266 HG2 PRO 43 2HG PRO 43 1.975 -3.933 6.562 267 HG3 PRO 43 1HG PRO 43 2.302 -5.659 6.753 268 HD2 PRO 43 2HD PRO 43 4.164 -3.459 6.452 269 HD3 PRO 43 1HD PRO 43 4.486 -5.136 6.907 270 H VAL 44 H VAL 44 2.803 -4.598 1.404 271 HA VAL 44 HA VAL 44 2.592 -1.686 1.579 272 HB VAL 44 HB VAL 44 3.947 -1.373 -0.461 273 HG11 VAL 44 1HG1 VAL 44 5.003 -0.948 1.653 274 HG12 VAL 44 2HG1 VAL 44 6.166 -1.746 0.592 275 HG13 VAL 44 3HG1 VAL 44 5.360 -2.661 1.868 276 HG21 VAL 44 1HG2 VAL 44 5.513 -3.255 -1.055 277 HG22 VAL 44 2HG2 VAL 44 3.830 -3.470 -1.527 278 HG23 VAL 44 3HG2 VAL 44 4.466 -4.308 -0.107 279 H GLY 45 H GLY 45 1.498 -0.725 -0.192 280 HA2 GLY 45 1HA GLY 45 -0.140 -2.660 -1.690 281 HA3 GLY 45 2HA GLY 45 -0.719 -1.089 -1.182 282 H ILE 46 H ILE 46 0.248 -2.789 -3.698 283 HA ILE 46 HA ILE 46 1.838 -0.834 -5.123 284 HB ILE 46 HB ILE 46 0.680 -3.529 -5.814 285 HG12 ILE 46 1HG1 ILE 46 2.904 -4.340 -5.897 286 HG13 ILE 46 2HG1 ILE 46 3.576 -2.737 -5.990 287 HG21 ILE 46 1HG2 ILE 46 2.193 -1.728 -7.691 288 HG22 ILE 46 2HG2 ILE 46 0.481 -2.140 -7.796 289 HG23 ILE 46 3HG2 ILE 46 1.705 -3.390 -8.017 290 HD11 ILE 46 1HD1 ILE 46 4.030 -3.803 -3.877 291 HD12 ILE 46 2HD1 ILE 46 2.295 -3.936 -3.569 292 HD13 ILE 46 3HD1 ILE 46 3.056 -2.346 -3.672 293 H ASN 47 H ASN 47 0.938 0.790 -6.283 294 HA ASN 47 HA ASN 47 -0.530 2.009 -7.539 295 HB2 ASN 47 1HB ASN 47 -0.288 -0.081 -8.979 296 HB3 ASN 47 2HB ASN 47 -1.790 -0.631 -8.270 297 HD21 ASN 47 1HD2 ASN 47 -1.775 2.250 -11.121 298 HD22 ASN 47 2HD2 ASN 47 -0.317 1.711 -10.367 299 H CYS 48 H CYS 48 -1.233 2.235 -5.049 300 HA CYS 48 HA CYS 48 -4.014 1.356 -4.809 301 HB2 CYS 48 2HB CYS 48 -1.941 1.385 -2.954 302 HB3 CYS 48 1HB CYS 48 -2.973 2.729 -2.494 303 H ASN 49 H ASN 49 -5.651 2.676 -4.858 304 HA ASN 49 HA ASN 49 -5.185 5.566 -4.551 305 HB2 ASN 49 1HB ASN 49 -7.046 5.934 -6.181 306 HB3 ASN 49 2HB ASN 49 -5.614 5.207 -6.894 307 HD21 ASN 49 1HD2 ASN 49 -7.201 2.261 -7.852 308 HD22 ASN 49 2HD2 ASN 49 -5.717 3.128 -7.681 309 HA PRO 50 HA PRO 50 -8.175 5.358 -1.394 310 HB2 PRO 50 2HB PRO 50 -9.110 8.043 -2.072 311 HB3 PRO 50 1HB PRO 50 -8.189 7.510 -0.664 312 HG2 PRO 50 2HG PRO 50 -7.102 9.050 -2.601 313 HG3 PRO 50 1HG PRO 50 -6.159 7.859 -1.692 314 HD2 PRO 50 2HD PRO 50 -7.345 7.645 -4.434 315 HD3 PRO 50 1HD PRO 50 -5.745 7.138 -3.864 316 H ILE 51 H ILE 51 -10.054 4.326 -1.423 317 HA ILE 51 HA ILE 51 -11.718 4.396 -3.777 318 HB ILE 51 HB ILE 51 -12.599 3.065 -1.255 319 HG12 ILE 51 1HG1 ILE 51 -10.414 2.035 -3.075 320 HG13 ILE 51 2HG1 ILE 51 -10.206 2.529 -1.401 321 HG21 ILE 51 1HG2 ILE 51 -12.628 2.129 -4.118 322 HG22 ILE 51 2HG2 ILE 51 -13.917 3.068 -3.377 323 HG23 ILE 51 3HG2 ILE 51 -13.536 1.462 -2.760 324 HD11 ILE 51 1HD1 ILE 51 -11.911 0.240 -2.336 325 HD12 ILE 51 2HD1 ILE 51 -11.629 0.718 -0.663 326 HD13 ILE 51 3HD1 ILE 51 -10.297 0.103 -1.641 327 H THR 52 H THR 52 -12.448 6.568 -3.755 328 HA THR 52 HA THR 52 -14.347 7.156 -1.581 329 HB THR 52 HB THR 52 -13.907 9.575 -2.090 330 HG1 THR 52 1HG THR 52 -11.515 9.412 -3.168 331 HG21 THR 52 1HG2 THR 52 -11.519 7.921 -1.250 332 HG22 THR 52 2HG2 THR 52 -12.835 8.441 -0.199 333 HG23 THR 52 3HG2 THR 52 -11.754 9.637 -0.913 334 H GLY 53 H GLY 53 -14.644 5.832 -4.286 335 HA2 GLY 53 1HA GLY 53 -16.283 7.642 -5.811 336 HA3 GLY 53 2HA GLY 53 -16.037 5.931 -6.131 337 H ILE 54 H ILE 54 -17.584 8.070 -3.768 338 HA ILE 54 HA ILE 54 -19.542 6.066 -3.075 339 HB ILE 54 HB ILE 54 -19.292 8.966 -2.263 340 HG12 ILE 54 1HG1 ILE 54 -17.490 7.531 -1.411 341 HG13 ILE 54 2HG1 ILE 54 -18.546 8.060 -0.105 342 HG21 ILE 54 1HG2 ILE 54 -21.137 6.867 -1.133 343 HG22 ILE 54 2HG2 ILE 54 -21.627 8.179 -2.206 344 HG23 ILE 54 3HG2 ILE 54 -20.992 8.542 -0.600 345 HD11 ILE 54 1HD1 ILE 54 -19.664 5.878 -0.149 346 HD12 ILE 54 2HD1 ILE 54 -17.936 5.740 0.176 347 HD13 ILE 54 3HD1 ILE 54 -18.565 5.354 -1.425 348 H GLY 55 H GLY 55 -21.550 5.879 -3.850 349 HA2 GLY 55 1HA GLY 55 -23.416 7.553 -4.652 350 HA3 GLY 55 2HA GLY 55 -22.330 7.653 -6.030 351 H ALA 56 H ALA 56 -25.116 6.556 -5.602 352 HA ALA 56 HA ALA 56 -26.416 4.851 -6.337 353 HB1 ALA 56 1HB ALA 56 -25.201 5.175 -8.436 354 HB2 ALA 56 2HB ALA 56 -25.613 3.478 -8.187 355 HB3 ALA 56 3HB ALA 56 -23.965 4.038 -7.900 356 H GLY 57 H GLY 57 -25.133 4.543 -3.871 357 HA2 GLY 57 1HA GLY 57 -25.644 1.909 -3.214 358 HA3 GLY 57 2HA GLY 57 -23.927 1.986 -3.581 359 H SER 58 H SER 58 -23.969 1.274 -1.224 360 HA SER 58 HA SER 58 -24.105 3.631 0.529 361 HB2 SER 58 1HB SER 58 -24.169 1.913 2.388 362 HB3 SER 58 2HB SER 58 -25.578 1.926 1.328 363 HG SER 58 HG SER 58 -23.727 -0.039 1.759 364 H GLY 59 H GLY 59 -22.049 1.113 -0.710 365 HA2 GLY 59 1HA GLY 59 -19.787 2.368 0.699 366 HA3 GLY 59 2HA GLY 59 -19.975 0.620 0.712 367 H SER 60 H SER 60 -17.987 2.638 -0.472 368 HA SER 60 HA SER 60 -18.095 2.159 -3.289 369 HB2 SER 60 1HB SER 60 -15.720 3.129 -3.136 370 HB3 SER 60 2HB SER 60 -17.048 4.177 -2.650 371 HG SER 60 HG SER 60 -15.134 4.018 -1.193 372 H SER 61 H SER 61 -16.563 0.864 -4.497 373 HA SER 61 HA SER 61 -15.564 -1.405 -2.923 374 HB2 SER 61 1HB SER 61 -16.969 -1.471 -5.599 375 HB3 SER 61 2HB SER 61 -16.302 -2.865 -4.758 376 HG SER 61 HG SER 61 -17.818 -1.658 -3.009 377 H CYS 62 H CYS 62 -13.800 -2.567 -3.797 378 HA CYS 62 HA CYS 62 -12.079 -0.945 -5.548 379 HB2 CYS 62 2HB CYS 62 -11.109 -1.312 -3.372 380 HB3 CYS 62 1HB CYS 62 -11.448 -3.035 -3.454 381 H ASN 63 H ASN 63 -11.150 -1.828 -7.354 382 HA ASN 63 HA ASN 63 -12.484 -4.078 -8.520 383 HB2 ASN 63 1HB ASN 63 -10.941 -3.727 -10.435 384 HB3 ASN 63 2HB ASN 63 -11.846 -2.279 -10.005 385 HD21 ASN 63 1HD2 ASN 63 -8.180 -1.682 -10.668 386 HD22 ASN 63 2HD2 ASN 63 -9.380 -2.605 -11.500 387 H ALA 64 H ALA 64 -9.421 -3.533 -6.964 388 HA ALA 64 HA ALA 64 -8.605 -6.237 -7.755 389 HB1 ALA 64 1HB ALA 64 -7.288 -4.377 -8.706 390 HB2 ALA 64 2HB ALA 64 -6.330 -5.504 -7.735 391 HB3 ALA 64 3HB ALA 64 -6.789 -3.934 -7.066 392 H ASN 65 H ASN 65 -6.901 -4.368 -5.324 393 HA ASN 65 HA ASN 65 -8.042 -6.126 -3.249 394 HB2 ASN 65 1HB ASN 65 -5.149 -5.347 -3.490 395 HB3 ASN 65 2HB ASN 65 -5.837 -6.347 -2.227 396 HD21 ASN 65 1HD2 ASN 65 -4.926 -7.877 -5.860 397 HD22 ASN 65 2HD2 ASN 65 -4.841 -6.186 -5.537 398 HA PRO 66 HA PRO 66 -8.500 -2.083 -1.382 399 HB2 PRO 66 2HB PRO 66 -10.325 -2.842 0.439 400 HB3 PRO 66 1HB PRO 66 -10.746 -2.622 -1.263 401 HG2 PRO 66 2HG PRO 66 -10.244 -5.142 0.253 402 HG3 PRO 66 1HG PRO 66 -11.444 -4.811 -1.007 403 HD2 PRO 66 2HD PRO 66 -9.026 -6.113 -1.415 404 HD3 PRO 66 1HD PRO 66 -9.968 -5.313 -2.684 405 H ALA 67 H ALA 67 -7.367 -1.218 0.283 406 HA ALA 67 HA ALA 67 -6.437 -2.997 2.414 407 HB1 ALA 67 1HB ALA 67 -4.127 -2.329 2.110 408 HB2 ALA 67 2HB ALA 67 -4.577 -1.343 0.719 409 HB3 ALA 67 3HB ALA 67 -4.745 -3.098 0.651 410 H CYS 68 H CYS 68 -5.648 -1.978 4.241 411 HA CYS 68 HA CYS 68 -6.064 0.934 4.411 412 HB2 CYS 68 2HB CYS 68 -7.495 -0.329 5.960 413 HB3 CYS 68 1HB CYS 68 -6.082 -1.140 6.619 414 H CYS 69 H CYS 69 -4.256 2.114 4.703 415 HA CYS 69 HA CYS 69 -1.816 0.606 5.361 416 HB2 CYS 69 2HB CYS 69 -2.405 1.993 2.986 417 HB3 CYS 69 1HB CYS 69 -1.206 2.950 3.829 418 H ASP 70 H ASP 70 -0.127 1.749 6.340 419 HA ASP 70 HA ASP 70 -0.938 3.613 8.338 420 HB2 ASP 70 1HB ASP 70 0.934 1.921 8.528 421 HB3 ASP 70 2HB ASP 70 1.880 2.940 7.458 422 H ASN 71 H ASN 71 0.876 3.765 5.310 423 HA ASN 71 HA ASN 71 -0.085 6.469 4.867 424 HB2 ASN 71 1HB ASN 71 2.883 5.830 4.774 425 HB3 ASN 71 2HB ASN 71 2.153 7.301 4.154 426 HD21 ASN 71 1HD2 ASN 71 3.036 6.900 8.058 427 HD22 ASN 71 2HD2 ASN 71 3.315 5.643 6.904 428 H VAL 72 H VAL 72 0.024 7.012 2.581 429 HA VAL 72 HA VAL 72 1.376 5.181 0.826 430 HB VAL 72 HB VAL 72 -0.475 3.894 0.529 431 HG11 VAL 72 1HG1 VAL 72 -2.207 6.271 1.099 432 HG12 VAL 72 2HG1 VAL 72 -1.850 4.911 2.170 433 HG13 VAL 72 3HG1 VAL 72 -2.790 4.653 0.703 434 HG21 VAL 72 1HG2 VAL 72 -1.116 6.199 -1.299 435 HG22 VAL 72 2HG2 VAL 72 -1.776 4.570 -1.441 436 HG23 VAL 72 3HG2 VAL 72 -0.046 4.842 -1.652 437 H TYR 73 H TYR 73 2.099 6.097 -0.956 438 HA TYR 73 HA TYR 73 1.888 9.011 -0.946 439 HB2 TYR 73 2HB TYR 73 3.946 7.102 -2.065 440 HB3 TYR 73 1HB TYR 73 4.029 8.848 -2.261 441 HD1 TYR 73 1HD TYR 73 4.851 10.229 -0.517 442 HD2 TYR 73 2HD TYR 73 4.048 6.123 0.258 443 HE1 TYR 73 1HE TYR 73 5.948 10.432 1.671 444 HE2 TYR 73 2HE TYR 73 5.146 6.310 2.451 445 HH TYR 73 HH TYR 73 5.946 9.335 3.832 446 H THR 74 H THR 74 2.199 10.052 -3.147 447 HA THR 74 HA THR 74 -0.220 9.460 -4.495 448 HB THR 74 HB THR 74 1.829 11.371 -5.568 449 HG1 THR 74 1HG THR 74 0.084 11.907 -3.371 450 HG21 THR 74 1HG2 THR 74 -0.156 12.710 -6.082 451 HG22 THR 74 2HG2 THR 74 -1.181 11.497 -5.314 452 HG23 THR 74 3HG2 THR 74 -0.288 11.098 -6.783 453 H ASN 75 H ASN 75 2.968 8.350 -5.040 454 HA ASN 75 HA ASN 75 2.648 7.734 -7.820 455 HB2 ASN 75 1HB ASN 75 4.561 6.251 -7.548 456 HB3 ASN 75 2HB ASN 75 4.888 7.773 -6.734 457 HD21 ASN 75 1HD2 ASN 75 5.783 4.770 -4.650 458 HD22 ASN 75 2HD2 ASN 75 6.056 5.136 -6.315 459 H GLY 76 H GLY 76 1.357 6.611 -4.946 460 HA2 GLY 76 1HA GLY 76 -0.524 5.199 -4.903 461 HA3 GLY 76 2HA GLY 76 0.078 4.383 -6.343 462 H LEU 77 H LEU 77 2.427 5.019 -3.882 463 HA LEU 77 HA LEU 77 2.494 2.145 -3.309 464 HB2 LEU 77 1HB LEU 77 4.536 3.254 -4.110 465 HB3 LEU 77 2HB LEU 77 4.484 4.339 -2.744 466 HG LEU 77 HG LEU 77 6.161 2.396 -2.675 467 HD11 LEU 77 1HD1 LEU 77 5.658 3.742 -0.716 468 HD12 LEU 77 2HD1 LEU 77 5.884 2.044 -0.282 469 HD13 LEU 77 3HD1 LEU 77 4.257 2.730 -0.371 470 HD21 LEU 77 1HD2 LEU 77 4.599 0.668 -3.434 471 HD22 LEU 77 2HD2 LEU 77 3.681 0.862 -1.937 472 HD23 LEU 77 3HD2 LEU 77 5.349 0.277 -1.886 473 H GLY 78 H GLY 78 1.478 1.476 -1.554 474 HA2 GLY 78 1HA GLY 78 1.250 3.320 0.720 475 HA3 GLY 78 2HA GLY 78 0.254 1.899 0.470 476 H VAL 79 H VAL 79 1.928 2.806 2.736 477 HA VAL 79 HA VAL 79 3.785 0.530 2.926 478 HB VAL 79 HB VAL 79 4.742 2.881 3.041 479 HG11 VAL 79 1HG1 VAL 79 2.989 3.924 4.353 480 HG12 VAL 79 2HG1 VAL 79 4.573 4.122 5.102 481 HG13 VAL 79 3HG1 VAL 79 3.437 2.934 5.741 482 HG21 VAL 79 1HG2 VAL 79 5.198 1.093 5.416 483 HG22 VAL 79 2HG2 VAL 79 6.286 2.365 4.856 484 HG23 VAL 79 3HG2 VAL 79 5.980 0.954 3.841 485 H GLN 80 H GLN 80 3.364 -0.966 4.385 486 HA GLN 80 HA GLN 80 2.409 -2.148 6.050 487 HB2 GLN 80 1HB GLN 80 1.897 0.603 7.192 488 HB3 GLN 80 2HB GLN 80 1.548 -0.887 8.055 489 HG2 GLN 80 1HG GLN 80 4.262 -0.322 6.975 490 HG3 GLN 80 2HG GLN 80 3.748 0.318 8.539 491 HE21 GLN 80 1HE2 GLN 80 5.452 -3.008 8.865 492 HE22 GLN 80 2HE2 GLN 80 5.868 -1.533 8.063 493 H CYS 81 H CYS 81 0.983 -1.995 3.854 494 HA CYS 81 HA CYS 81 -1.754 -1.249 4.413 495 HB2 CYS 81 2HB CYS 81 -0.419 -2.521 2.037 496 HB3 CYS 81 1HB CYS 81 -2.165 -2.462 2.174 497 H ASN 82 H ASN 82 -3.207 -2.483 5.365 498 HA ASN 82 HA ASN 82 -2.828 -5.393 5.235 499 HB2 ASN 82 1HB ASN 82 -4.350 -5.551 7.187 500 HB3 ASN 82 2HB ASN 82 -2.897 -4.632 7.535 501 HD21 ASN 82 1HD2 ASN 82 -6.567 -2.933 7.753 502 HD22 ASN 82 2HD2 ASN 82 -6.330 -4.531 7.144 503 HA PRO 83 HA PRO 83 -6.194 -5.575 2.424 504 HB2 PRO 83 2HB PRO 83 -6.809 -8.246 3.483 505 HB3 PRO 83 1HB PRO 83 -6.253 -7.779 1.877 506 HG2 PRO 83 2HG PRO 83 -4.659 -9.075 3.604 507 HG3 PRO 83 1HG PRO 83 -4.028 -7.862 2.476 508 HD2 PRO 83 2HD PRO 83 -4.633 -7.596 5.399 509 HD3 PRO 83 1HD PRO 83 -3.259 -6.964 4.469 510 H ILE 84 H ILE 84 -8.241 -4.932 2.441 511 HA ILE 84 HA ILE 84 -9.700 -4.730 4.928 512 HB ILE 84 HB ILE 84 -10.541 -4.015 2.130 513 HG12 ILE 84 1HG1 ILE 84 -8.607 -2.716 2.848 514 HG13 ILE 84 2HG1 ILE 84 -10.043 -1.703 2.778 515 HG21 ILE 84 1HG2 ILE 84 -11.781 -3.210 4.745 516 HG22 ILE 84 2HG2 ILE 84 -12.456 -4.364 3.593 517 HG23 ILE 84 3HG2 ILE 84 -12.285 -2.667 3.143 518 HD11 ILE 84 1HD1 ILE 84 -8.786 -1.165 4.733 519 HD12 ILE 84 2HD1 ILE 84 -8.775 -2.853 5.239 520 HD13 ILE 84 3HD1 ILE 84 -10.289 -1.950 5.214 521 H ASN 85 H ASN 85 -11.563 -5.713 5.453 522 HA ASN 85 HA ASN 85 -12.065 -8.315 4.359 523 HB2 ASN 85 1HB ASN 85 -12.259 -7.874 6.767 524 HB3 ASN 85 2HB ASN 85 -13.537 -6.709 6.461 525 HD21 ASN 85 1HD2 ASN 85 -14.851 -10.076 7.516 526 HD22 ASN 85 2HD2 ASN 85 -13.589 -9.060 8.124 527 H VAL 86 H VAL 86 -12.904 -8.284 2.382 528 HA VAL 86 HA VAL 86 -15.414 -6.826 1.946 529 HB VAL 86 HB VAL 86 -14.672 -6.651 -0.500 530 HG11 VAL 86 1HG1 VAL 86 -13.410 -4.584 -0.104 531 HG12 VAL 86 2HG1 VAL 86 -13.187 -5.049 1.582 532 HG13 VAL 86 3HG1 VAL 86 -14.806 -4.711 0.966 533 HG21 VAL 86 1HG2 VAL 86 -11.958 -7.087 0.741 534 HG22 VAL 86 2HG2 VAL 86 -12.282 -6.645 -0.935 535 HG23 VAL 86 3HG2 VAL 86 -12.785 -8.221 -0.325 536 H ASN 87 H ASN 87 -16.579 -8.606 2.385 537 HA ASN 87 HA ASN 87 -17.796 -10.465 1.915 538 HB2 ASN 87 1HB ASN 87 -16.094 -10.579 -0.579 539 HB3 ASN 87 2HB ASN 87 -17.311 -11.791 -0.197 540 HD21 ASN 87 1HD2 ASN 87 -18.594 -8.963 -2.379 541 HD22 ASN 87 2HD2 ASN 87 -17.124 -9.870 -2.418 542 H LEU 88 H LEU 88 -14.372 -10.448 2.024 543 HA LEU 88 HA LEU 88 -12.857 -11.684 3.108 544 HB2 LEU 88 1HB LEU 88 -14.466 -11.466 4.956 545 HB3 LEU 88 2HB LEU 88 -15.244 -12.953 4.440 546 HG LEU 88 HG LEU 88 -13.056 -14.118 4.821 547 HD11 LEU 88 1HD1 LEU 88 -12.353 -11.510 6.155 548 HD12 LEU 88 2HD1 LEU 88 -11.584 -12.197 4.725 549 HD13 LEU 88 3HD1 LEU 88 -11.430 -13.007 6.283 550 HD21 LEU 88 1HD2 LEU 88 -14.883 -14.272 6.419 551 HD22 LEU 88 2HD2 LEU 88 -14.350 -12.779 7.191 552 HD23 LEU 88 3HD2 LEU 88 -13.333 -14.216 7.255 Start of MODEL 13 1 H1 GLY 1 1H GLY 1 -21.242 10.292 6.311 2 H2 GLY 1 2H GLY 1 -19.763 9.554 5.956 3 H3 GLY 1 3H GLY 1 -21.027 8.643 6.606 4 HA2 GLY 1 1HA GLY 1 -22.346 8.985 4.616 5 HA3 GLY 1 2HA GLY 1 -21.032 9.937 3.939 6 H SER 2 H SER 2 -21.218 8.312 2.192 7 HA SER 2 HA SER 2 -19.931 5.765 2.868 8 HB2 SER 2 1HB SER 2 -21.330 6.579 0.312 9 HB3 SER 2 2HB SER 2 -20.758 4.962 0.727 10 HG SER 2 HG SER 2 -22.406 6.043 2.629 11 H GLY 3 H GLY 3 -17.810 6.569 3.046 12 HA2 GLY 3 1HA GLY 3 -16.540 7.049 0.447 13 HA3 GLY 3 2HA GLY 3 -16.259 8.210 1.736 14 H SER 4 H SER 4 -15.623 7.058 3.887 15 HA SER 4 HA SER 4 -13.999 4.686 3.446 16 HB2 SER 4 1HB SER 4 -12.838 7.278 4.501 17 HB3 SER 4 2HB SER 4 -11.999 5.727 4.455 18 HG SER 4 HG SER 4 -13.027 6.318 2.030 19 H SER 5 H SER 5 -15.384 3.603 4.836 20 HA SER 5 HA SER 5 -15.630 4.581 7.574 21 HB2 SER 5 1HB SER 5 -17.116 2.509 7.777 22 HB3 SER 5 2HB SER 5 -17.687 3.803 6.726 23 HG SER 5 HG SER 5 -17.765 2.333 5.238 24 H GLN 6 H GLN 6 -14.160 1.991 5.728 25 HA GLN 6 HA GLN 6 -13.163 0.606 8.041 26 HB2 GLN 6 1HB GLN 6 -12.458 0.358 5.115 27 HB3 GLN 6 2HB GLN 6 -11.785 -0.661 6.371 28 HG2 GLN 6 1HG GLN 6 -13.484 -1.898 5.361 29 HG3 GLN 6 2HG GLN 6 -14.142 -1.363 6.904 30 HE21 GLN 6 1HE2 GLN 6 -15.495 0.826 3.745 31 HE22 GLN 6 2HE2 GLN 6 -13.804 0.613 4.025 32 H CYS 7 H CYS 7 -10.789 0.201 8.244 33 HA CYS 7 HA CYS 7 -8.653 0.819 8.554 34 HB2 CYS 7 2HB CYS 7 -8.654 1.193 6.136 35 HB3 CYS 7 1HB CYS 7 -9.221 2.834 6.396 36 H ASN 8 H ASN 8 -8.067 1.734 10.367 37 HA ASN 8 HA ASN 8 -9.198 4.290 11.185 38 HB2 ASN 8 1HB ASN 8 -7.371 2.353 12.620 39 HB3 ASN 8 2HB ASN 8 -7.981 3.846 13.320 40 HD21 ASN 8 1HD2 ASN 8 -10.052 0.782 14.155 41 HD22 ASN 8 2HD2 ASN 8 -8.340 1.025 14.090 42 H ALA 9 H ALA 9 -6.367 3.021 9.750 43 HA ALA 9 HA ALA 9 -4.578 5.072 10.699 44 HB1 ALA 9 1HB ALA 9 -3.768 2.803 10.263 45 HB2 ALA 9 2HB ALA 9 -2.911 3.999 9.289 46 HB3 ALA 9 3HB ALA 9 -4.161 2.995 8.555 47 H GLY 10 H GLY 10 -6.971 5.041 8.441 48 HA2 GLY 10 1HA GLY 10 -6.706 7.540 7.467 49 HA3 GLY 10 2HA GLY 10 -5.663 6.609 6.403 50 HA PRO 11 HA PRO 11 -9.900 6.251 4.637 51 HB2 PRO 11 2HB PRO 11 -9.294 6.942 2.116 52 HB3 PRO 11 1HB PRO 11 -9.569 8.160 3.368 53 HG2 PRO 11 2HG PRO 11 -6.994 7.117 2.271 54 HG3 PRO 11 1HG PRO 11 -7.448 8.786 2.657 55 HD2 PRO 11 2HD PRO 11 -5.937 7.192 4.301 56 HD3 PRO 11 1HD PRO 11 -6.945 8.533 4.879 57 H VAL 12 H VAL 12 -10.617 4.845 2.855 58 HA VAL 12 HA VAL 12 -9.217 2.352 2.954 59 HB VAL 12 HB VAL 12 -11.042 1.620 1.317 60 HG11 VAL 12 1HG1 VAL 12 -12.743 1.553 3.083 61 HG12 VAL 12 2HG1 VAL 12 -11.824 2.745 4.003 62 HG13 VAL 12 3HG1 VAL 12 -11.140 1.148 3.695 63 HG21 VAL 12 1HG2 VAL 12 -12.197 4.311 2.056 64 HG22 VAL 12 2HG2 VAL 12 -12.979 3.058 1.095 65 HG23 VAL 12 3HG2 VAL 12 -11.555 3.892 0.469 66 H GLN 13 H GLN 13 -7.918 1.428 1.475 67 HA GLN 13 HA GLN 13 -7.419 2.974 -0.983 68 HB2 GLN 13 1HB GLN 13 -5.493 1.087 0.376 69 HB3 GLN 13 2HB GLN 13 -5.152 2.194 -0.941 70 HG2 GLN 13 1HG GLN 13 -5.938 3.021 1.835 71 HG3 GLN 13 2HG GLN 13 -4.292 2.963 1.215 72 HE21 GLN 13 1HE2 GLN 13 -5.861 6.390 0.951 73 HE22 GLN 13 2HE2 GLN 13 -5.882 5.212 2.219 74 H CYS 14 H CYS 14 -7.144 1.894 -2.911 75 HA CYS 14 HA CYS 14 -7.806 -0.974 -2.926 76 HB2 CYS 14 2HB CYS 14 -9.666 0.313 -3.838 77 HB3 CYS 14 1HB CYS 14 -8.588 1.133 -4.957 78 H CYS 15 H CYS 15 -5.892 -1.881 -3.142 79 HA CYS 15 HA CYS 15 -3.856 -0.683 -4.846 80 HB2 CYS 15 2HB CYS 15 -3.747 -3.108 -3.032 81 HB3 CYS 15 1HB CYS 15 -2.374 -2.402 -3.870 82 H ASN 16 H ASN 16 -3.006 -1.663 -6.646 83 HA ASN 16 HA ASN 16 -4.581 -3.579 -8.041 84 HB2 ASN 16 1HB ASN 16 -2.956 -1.811 -8.981 85 HB3 ASN 16 2HB ASN 16 -1.705 -2.992 -8.633 86 HD21 ASN 16 1HD2 ASN 16 -2.212 -4.169 -11.868 87 HD22 ASN 16 2HD2 ASN 16 -1.169 -3.331 -10.770 88 H THR 17 H THR 17 -1.708 -3.684 -6.068 89 HA THR 17 HA THR 17 -1.971 -6.580 -5.860 90 HB THR 17 HB THR 17 0.590 -5.178 -6.666 91 HG1 THR 17 1HG THR 17 -1.319 -6.740 -7.948 92 HG21 THR 17 1HG2 THR 17 1.190 -6.822 -5.023 93 HG22 THR 17 2HG2 THR 17 1.589 -7.463 -6.620 94 HG23 THR 17 3HG2 THR 17 0.145 -8.029 -5.781 95 H LEU 18 H LEU 18 -2.083 -7.033 -3.756 96 HA LEU 18 HA LEU 18 -0.610 -5.357 -1.857 97 HB2 LEU 18 1HB LEU 18 -2.665 -7.528 -1.461 98 HB3 LEU 18 2HB LEU 18 -1.753 -6.835 -0.137 99 HG LEU 18 HG LEU 18 -3.626 -5.333 -1.950 100 HD11 LEU 18 1HD1 LEU 18 -3.884 -6.039 0.970 101 HD12 LEU 18 2HD1 LEU 18 -4.726 -6.863 -0.341 102 HD13 LEU 18 3HD1 LEU 18 -5.059 -5.163 -0.013 103 HD21 LEU 18 1HD2 LEU 18 -2.068 -4.409 0.456 104 HD22 LEU 18 2HD2 LEU 18 -3.253 -3.459 -0.441 105 HD23 LEU 18 3HD2 LEU 18 -1.754 -3.954 -1.218 106 H THR 19 H THR 19 1.391 -5.889 -1.583 107 HA THR 19 HA THR 19 2.137 -8.684 -1.251 108 HB THR 19 HB THR 19 2.448 -8.317 -3.635 109 HG1 THR 19 1HG THR 19 4.394 -9.202 -3.710 110 HG21 THR 19 1HG2 THR 19 4.189 -6.659 -4.411 111 HG22 THR 19 2HG2 THR 19 4.080 -5.929 -2.809 112 HG23 THR 19 3HG2 THR 19 2.662 -5.975 -3.859 113 H SER 20 H SER 20 4.889 -8.331 -1.098 114 HA SER 20 HA SER 20 5.020 -6.676 1.329 115 HB2 SER 20 1HB SER 20 6.859 -8.935 0.508 116 HB3 SER 20 2HB SER 20 6.779 -8.150 2.085 117 HG SER 20 HG SER 20 5.092 -10.044 0.935 118 H ALA 21 H ALA 21 7.056 -5.579 1.768 119 HA ALA 21 HA ALA 21 7.780 -3.921 -0.393 120 HB1 ALA 21 1HB ALA 21 7.764 -3.192 1.947 121 HB2 ALA 21 2HB ALA 21 9.308 -2.867 1.160 122 HB3 ALA 21 3HB ALA 21 9.156 -4.227 2.271 123 H SER 22 H SER 22 8.823 -7.000 0.262 124 HA SER 22 HA SER 22 11.521 -6.735 -0.661 125 HB2 SER 22 1HB SER 22 10.629 -8.567 0.852 126 HB3 SER 22 2HB SER 22 9.864 -9.244 -0.567 127 HG SER 22 HG SER 22 12.647 -8.786 -0.239 128 H ASN 23 H ASN 23 8.470 -6.743 -2.124 129 HA ASN 23 HA ASN 23 9.186 -7.971 -4.616 130 HB2 ASN 23 1HB ASN 23 6.814 -7.621 -3.624 131 HB3 ASN 23 2HB ASN 23 6.935 -5.993 -4.269 132 HD21 ASN 23 1HD2 ASN 23 6.251 -9.144 -6.699 133 HD22 ASN 23 2HD2 ASN 23 6.578 -9.339 -5.011 134 H SER 24 H SER 24 9.905 -7.018 -6.475 135 HA SER 24 HA SER 24 11.331 -4.587 -6.236 136 HB2 SER 24 1HB SER 24 10.623 -6.153 -8.726 137 HB3 SER 24 2HB SER 24 11.855 -4.896 -8.612 138 HG SER 24 HG SER 24 12.644 -6.375 -6.789 139 H GLN 25 H GLN 25 8.098 -5.339 -7.306 140 HA GLN 25 HA GLN 25 7.508 -2.963 -8.681 141 HB2 GLN 25 1HB GLN 25 6.036 -5.005 -8.558 142 HB3 GLN 25 2HB GLN 25 5.646 -4.557 -6.898 143 HG2 GLN 25 1HG GLN 25 3.870 -3.806 -8.210 144 HG3 GLN 25 2HG GLN 25 4.822 -2.389 -7.783 145 HE21 GLN 25 1HE2 GLN 25 3.833 -2.490 -11.430 146 HE22 GLN 25 2HE2 GLN 25 2.948 -2.837 -9.987 147 H ALA 26 H ALA 26 7.309 -3.891 -5.292 148 HA ALA 26 HA ALA 26 6.306 -1.374 -4.386 149 HB1 ALA 26 1HB ALA 26 5.869 -3.448 -3.183 150 HB2 ALA 26 2HB ALA 26 6.713 -2.291 -2.155 151 HB3 ALA 26 3HB ALA 26 7.593 -3.644 -2.870 152 H ALA 27 H ALA 27 9.474 -2.997 -4.104 153 HA ALA 27 HA ALA 27 10.714 -0.919 -2.676 154 HB1 ALA 27 1HB ALA 27 11.617 -3.188 -2.761 155 HB2 ALA 27 2HB ALA 27 12.824 -1.998 -3.254 156 HB3 ALA 27 3HB ALA 27 12.000 -2.975 -4.469 157 H GLY 28 H GLY 28 10.351 -1.421 -6.156 158 HA2 GLY 28 1HA GLY 28 12.058 0.607 -7.046 159 HA3 GLY 28 2HA GLY 28 10.574 0.114 -7.858 160 H LEU 29 H LEU 29 8.674 0.747 -6.091 161 HA LEU 29 HA LEU 29 8.325 3.541 -6.352 162 HB2 LEU 29 1HB LEU 29 6.913 1.551 -4.619 163 HB3 LEU 29 2HB LEU 29 6.334 3.148 -4.969 164 HG LEU 29 HG LEU 29 6.675 0.933 -6.983 165 HD11 LEU 29 1HD1 LEU 29 4.821 0.482 -5.531 166 HD12 LEU 29 2HD1 LEU 29 4.200 1.048 -7.082 167 HD13 LEU 29 3HD1 LEU 29 4.238 2.138 -5.695 168 HD21 LEU 29 1HD2 LEU 29 5.555 3.718 -7.299 169 HD22 LEU 29 2HD2 LEU 29 5.523 2.451 -8.526 170 HD23 LEU 29 3HD2 LEU 29 7.065 3.118 -7.988 171 H ILE 30 H ILE 30 8.894 1.470 -3.522 172 HA ILE 30 HA ILE 30 8.999 3.328 -1.490 173 HB ILE 30 HB ILE 30 10.647 0.836 -1.872 174 HG12 ILE 30 1HG1 ILE 30 8.126 1.353 -0.293 175 HG13 ILE 30 2HG1 ILE 30 8.175 0.589 -1.873 176 HG21 ILE 30 1HG2 ILE 30 11.540 2.537 -0.180 177 HG22 ILE 30 2HG2 ILE 30 11.264 0.887 0.387 178 HG23 ILE 30 3HG2 ILE 30 10.099 2.151 0.769 179 HD11 ILE 30 1HD1 ILE 30 9.397 -1.270 -0.973 180 HD12 ILE 30 2HD1 ILE 30 7.926 -0.999 -0.037 181 HD13 ILE 30 3HD1 ILE 30 9.486 -0.483 0.603 182 H GLN 31 H GLN 31 11.620 2.267 -3.597 183 HA GLN 31 HA GLN 31 13.507 3.997 -2.424 184 HB2 GLN 31 1HB GLN 31 13.485 2.286 -4.884 185 HB3 GLN 31 2HB GLN 31 14.878 3.296 -4.479 186 HG2 GLN 31 1HG GLN 31 14.982 2.103 -2.302 187 HG3 GLN 31 2HG GLN 31 13.676 1.069 -2.870 188 HE21 GLN 31 1HE2 GLN 31 15.668 -0.908 -4.938 189 HE22 GLN 31 2HE2 GLN 31 14.065 -0.411 -4.510 190 H GLN 32 H GLN 32 11.096 4.418 -4.869 191 HA GLN 32 HA GLN 32 12.326 6.713 -6.098 192 HB2 GLN 32 1HB GLN 32 9.484 5.703 -6.065 193 HB3 GLN 32 2HB GLN 32 9.936 7.204 -6.854 194 HG2 GLN 32 1HG GLN 32 11.029 4.486 -7.515 195 HG3 GLN 32 2HG GLN 32 9.755 5.332 -8.390 196 HE21 GLN 32 1HE2 GLN 32 11.914 7.426 -10.154 197 HE22 GLN 32 2HE2 GLN 32 10.285 7.056 -9.710 198 H LEU 33 H LEU 33 10.049 6.150 -3.504 199 HA LEU 33 HA LEU 33 9.599 8.952 -3.006 200 HB2 LEU 33 1HB LEU 33 8.996 6.817 -1.017 201 HB3 LEU 33 2HB LEU 33 8.092 8.269 -1.381 202 HG LEU 33 HG LEU 33 8.251 5.886 -3.222 203 HD11 LEU 33 1HD1 LEU 33 6.091 5.241 -2.438 204 HD12 LEU 33 2HD1 LEU 33 6.017 6.629 -1.352 205 HD13 LEU 33 3HD1 LEU 33 7.186 5.339 -1.063 206 HD21 LEU 33 1HD2 LEU 33 7.645 7.717 -4.527 207 HD22 LEU 33 2HD2 LEU 33 6.671 8.433 -3.239 208 HD23 LEU 33 3HD2 LEU 33 6.097 6.983 -4.077 209 H GLY 34 H GLY 34 11.788 6.505 -2.022 210 HA2 GLY 34 1HA GLY 34 13.755 6.678 -0.822 211 HA3 GLY 34 2HA GLY 34 13.363 8.359 -0.476 212 H LEU 35 H LEU 35 11.482 5.453 0.133 213 HA LEU 35 HA LEU 35 10.858 6.336 2.783 214 HB2 LEU 35 1HB LEU 35 10.171 3.904 1.202 215 HB3 LEU 35 2HB LEU 35 9.634 4.112 2.845 216 HG LEU 35 HG LEU 35 8.893 5.752 0.443 217 HD11 LEU 35 1HD1 LEU 35 7.296 4.065 2.350 218 HD12 LEU 35 2HD1 LEU 35 7.694 3.673 0.677 219 HD13 LEU 35 3HD1 LEU 35 6.628 5.032 1.035 220 HD21 LEU 35 1HD2 LEU 35 7.493 7.082 1.985 221 HD22 LEU 35 2HD2 LEU 35 9.219 7.300 2.263 222 HD23 LEU 35 3HD2 LEU 35 8.274 6.277 3.345 223 H SER 36 H SER 36 12.158 6.075 4.447 224 HA SER 36 HA SER 36 13.895 3.723 4.568 225 HB2 SER 36 1HB SER 36 14.936 4.999 6.506 226 HB3 SER 36 2HB SER 36 15.106 5.751 4.920 227 HG SER 36 HG SER 36 13.656 6.567 7.139 228 H GLY 37 H GLY 37 13.608 2.142 6.074 229 HA2 GLY 37 1HA GLY 37 12.943 1.527 8.336 230 HA3 GLY 37 2HA GLY 37 11.586 2.631 8.173 231 H VAL 38 H VAL 38 11.689 1.284 5.267 232 HA VAL 38 HA VAL 38 9.631 -0.667 5.943 233 HB VAL 38 HB VAL 38 10.544 0.164 3.186 234 HG11 VAL 38 1HG1 VAL 38 9.226 -1.861 3.272 235 HG12 VAL 38 2HG1 VAL 38 8.285 -0.555 2.550 236 HG13 VAL 38 3HG1 VAL 38 7.986 -1.043 4.219 237 HG21 VAL 38 1HG2 VAL 38 9.907 2.169 4.411 238 HG22 VAL 38 2HG2 VAL 38 8.385 1.413 4.883 239 HG23 VAL 38 3HG2 VAL 38 8.698 1.778 3.186 240 H GLY 39 H GLY 39 10.414 -2.609 6.453 241 HA2 GLY 39 1HA GLY 39 12.798 -3.680 5.193 242 HA3 GLY 39 2HA GLY 39 11.869 -4.436 6.480 243 H ALA 40 H ALA 40 12.352 -6.306 4.927 244 HA ALA 40 HA ALA 40 11.043 -6.250 2.383 245 HB1 ALA 40 1HB ALA 40 12.322 -8.565 3.828 246 HB2 ALA 40 2HB ALA 40 13.142 -7.461 2.726 247 HB3 ALA 40 3HB ALA 40 11.872 -8.525 2.124 248 H ASN 41 H ASN 41 10.201 -7.403 5.553 249 HA ASN 41 HA ASN 41 8.039 -9.068 4.554 250 HB2 ASN 41 1HB ASN 41 9.411 -9.764 6.508 251 HB3 ASN 41 2HB ASN 41 8.800 -8.382 7.404 252 HD21 ASN 41 1HD2 ASN 41 6.537 -11.717 6.901 253 HD22 ASN 41 2HD2 ASN 41 7.996 -11.474 6.007 254 H VAL 42 H VAL 42 8.460 -5.851 5.082 255 HA VAL 42 HA VAL 42 6.087 -5.102 6.421 256 HB VAL 42 HB VAL 42 7.794 -3.498 4.516 257 HG11 VAL 42 1HG1 VAL 42 6.919 -1.537 5.770 258 HG12 VAL 42 2HG1 VAL 42 5.734 -2.606 6.535 259 HG13 VAL 42 3HG1 VAL 42 5.696 -2.356 4.787 260 HG21 VAL 42 1HG2 VAL 42 9.139 -4.271 6.275 261 HG22 VAL 42 2HG2 VAL 42 7.882 -3.935 7.473 262 HG23 VAL 42 3HG2 VAL 42 8.709 -2.601 6.666 263 HA PRO 43 HA PRO 43 3.175 -5.806 3.148 264 HB2 PRO 43 2HB PRO 43 1.287 -4.095 4.443 265 HB3 PRO 43 1HB PRO 43 1.305 -5.847 4.406 266 HG2 PRO 43 2HG PRO 43 1.788 -4.223 6.620 267 HG3 PRO 43 1HG PRO 43 2.076 -5.967 6.508 268 HD2 PRO 43 2HD PRO 43 3.980 -3.749 6.462 269 HD3 PRO 43 1HD PRO 43 4.267 -5.465 6.782 270 H VAL 44 H VAL 44 2.771 -4.707 1.287 271 HA VAL 44 HA VAL 44 2.612 -1.788 1.422 272 HB VAL 44 HB VAL 44 4.025 -1.531 -0.574 273 HG11 VAL 44 1HG1 VAL 44 6.207 -1.987 0.511 274 HG12 VAL 44 2HG1 VAL 44 5.353 -2.892 1.763 275 HG13 VAL 44 3HG1 VAL 44 5.057 -1.165 1.566 276 HG21 VAL 44 1HG2 VAL 44 3.846 -3.609 -1.661 277 HG22 VAL 44 2HG2 VAL 44 4.397 -4.487 -0.233 278 HG23 VAL 44 3HG2 VAL 44 5.527 -3.488 -1.140 279 H GLY 45 H GLY 45 1.505 -0.829 -0.295 280 HA2 GLY 45 1HA GLY 45 -0.131 -2.741 -1.825 281 HA3 GLY 45 2HA GLY 45 -0.697 -1.169 -1.305 282 H ILE 46 H ILE 46 0.292 -2.867 -3.824 283 HA ILE 46 HA ILE 46 1.873 -0.897 -5.230 284 HB ILE 46 HB ILE 46 0.697 -3.571 -5.972 285 HG12 ILE 46 1HG1 ILE 46 2.871 -4.445 -5.945 286 HG13 ILE 46 2HG1 ILE 46 3.604 -2.882 -6.158 287 HG21 ILE 46 1HG2 ILE 46 2.249 -1.729 -7.771 288 HG22 ILE 46 2HG2 ILE 46 0.555 -2.188 -7.942 289 HG23 ILE 46 3HG2 ILE 46 1.821 -3.400 -8.143 290 HD11 ILE 46 1HD1 ILE 46 3.142 -2.317 -3.859 291 HD12 ILE 46 2HD1 ILE 46 4.073 -3.811 -3.995 292 HD13 ILE 46 3HD1 ILE 46 2.346 -3.878 -3.638 293 H ASN 47 H ASN 47 0.920 0.803 -6.198 294 HA ASN 47 HA ASN 47 -0.539 2.090 -7.393 295 HB2 ASN 47 1HB ASN 47 -0.307 -0.038 -8.916 296 HB3 ASN 47 2HB ASN 47 -1.933 -0.381 -8.365 297 HD21 ASN 47 1HD2 ASN 47 -1.904 1.616 -11.549 298 HD22 ASN 47 2HD2 ASN 47 -1.026 0.217 -11.039 299 H CYS 48 H CYS 48 -1.326 2.330 -5.018 300 HA CYS 48 HA CYS 48 -4.047 1.262 -4.758 301 HB2 CYS 48 2HB CYS 48 -1.973 1.308 -2.926 302 HB3 CYS 48 1HB CYS 48 -3.011 2.639 -2.433 303 H ASN 49 H ASN 49 -5.697 2.545 -5.073 304 HA ASN 49 HA ASN 49 -5.349 5.417 -4.528 305 HB2 ASN 49 1HB ASN 49 -7.084 5.894 -6.178 306 HB3 ASN 49 2HB ASN 49 -5.759 5.011 -6.914 307 HD21 ASN 49 1HD2 ASN 49 -7.696 2.232 -7.788 308 HD22 ASN 49 2HD2 ASN 49 -6.109 2.900 -7.632 309 HA PRO 50 HA PRO 50 -8.303 5.059 -1.379 310 HB2 PRO 50 2HB PRO 50 -9.334 7.725 -2.020 311 HB3 PRO 50 1HB PRO 50 -8.398 7.201 -0.619 312 HG2 PRO 50 2HG PRO 50 -7.352 8.803 -2.521 313 HG3 PRO 50 1HG PRO 50 -6.375 7.607 -1.652 314 HD2 PRO 50 2HD PRO 50 -7.596 7.425 -4.384 315 HD3 PRO 50 1HD PRO 50 -5.972 6.957 -3.857 316 H ILE 51 H ILE 51 -10.126 3.938 -1.416 317 HA ILE 51 HA ILE 51 -11.834 3.923 -3.723 318 HB ILE 51 HB ILE 51 -12.660 2.689 -1.128 319 HG12 ILE 51 1HG1 ILE 51 -10.492 1.641 -2.953 320 HG13 ILE 51 2HG1 ILE 51 -10.293 2.136 -1.279 321 HG21 ILE 51 1HG2 ILE 51 -12.816 1.780 -4.001 322 HG22 ILE 51 2HG2 ILE 51 -14.119 2.533 -3.081 323 HG23 ILE 51 3HG2 ILE 51 -13.514 0.944 -2.613 324 HD11 ILE 51 1HD1 ILE 51 -10.355 -0.293 -1.526 325 HD12 ILE 51 2HD1 ILE 51 -11.975 -0.170 -2.213 326 HD13 ILE 51 3HD1 ILE 51 -11.689 0.308 -0.542 327 H THR 52 H THR 52 -12.621 6.060 -3.806 328 HA THR 52 HA THR 52 -14.505 6.717 -1.651 329 HB THR 52 HB THR 52 -14.070 9.139 -2.318 330 HG1 THR 52 1HG THR 52 -11.856 7.866 -3.610 331 HG21 THR 52 1HG2 THR 52 -11.970 9.235 -0.996 332 HG22 THR 52 2HG2 THR 52 -11.841 7.478 -1.120 333 HG23 THR 52 3HG2 THR 52 -13.196 8.205 -0.256 334 H GLY 53 H GLY 53 -14.006 6.380 -5.039 335 HA2 GLY 53 1HA GLY 53 -16.866 6.570 -5.457 336 HA3 GLY 53 2HA GLY 53 -15.904 7.762 -6.319 337 H ILE 54 H ILE 54 -15.046 4.407 -5.644 338 HA ILE 54 HA ILE 54 -14.438 3.966 -8.420 339 HB ILE 54 HB ILE 54 -14.396 1.992 -6.136 340 HG12 ILE 54 1HG1 ILE 54 -12.856 3.883 -5.768 341 HG13 ILE 54 2HG1 ILE 54 -11.983 2.383 -6.058 342 HG21 ILE 54 1HG2 ILE 54 -13.005 0.624 -7.571 343 HG22 ILE 54 2HG2 ILE 54 -13.090 1.836 -8.848 344 HG23 ILE 54 3HG2 ILE 54 -14.544 0.961 -8.367 345 HD11 ILE 54 1HD1 ILE 54 -10.926 4.216 -7.209 346 HD12 ILE 54 2HD1 ILE 54 -12.431 4.596 -8.045 347 HD13 ILE 54 3HD1 ILE 54 -11.596 3.078 -8.376 348 H GLY 55 H GLY 55 -15.861 3.296 -9.893 349 HA2 GLY 55 1HA GLY 55 -17.437 1.947 -10.876 350 HA3 GLY 55 2HA GLY 55 -17.513 1.026 -9.388 351 H ALA 56 H ALA 56 -18.951 1.694 -7.732 352 HA ALA 56 HA ALA 56 -21.378 2.829 -8.858 353 HB1 ALA 56 1HB ALA 56 -20.906 1.569 -6.159 354 HB2 ALA 56 2HB ALA 56 -21.484 0.731 -7.599 355 HB3 ALA 56 3HB ALA 56 -22.471 1.989 -6.856 356 H GLY 57 H GLY 57 -18.754 4.022 -7.200 357 HA2 GLY 57 1HA GLY 57 -18.461 6.256 -6.573 358 HA3 GLY 57 2HA GLY 57 -20.205 6.467 -6.600 359 H SER 58 H SER 58 -21.429 5.928 -4.782 360 HA SER 58 HA SER 58 -20.141 6.355 -2.295 361 HB2 SER 58 1HB SER 58 -22.457 5.797 -1.387 362 HB3 SER 58 2HB SER 58 -22.383 7.127 -2.542 363 HG SER 58 HG SER 58 -24.001 5.228 -2.750 364 H GLY 59 H GLY 59 -21.806 3.516 -3.639 365 HA2 GLY 59 1HA GLY 59 -20.603 1.785 -1.631 366 HA3 GLY 59 2HA GLY 59 -21.737 1.299 -2.890 367 H SER 60 H SER 60 -18.520 2.772 -2.721 368 HA SER 60 HA SER 60 -17.793 1.668 -5.249 369 HB2 SER 60 1HB SER 60 -15.534 2.734 -4.610 370 HB3 SER 60 2HB SER 60 -16.921 3.797 -4.834 371 HG SER 60 HG SER 60 -16.829 4.344 -2.812 372 H SER 61 H SER 61 -17.018 -0.256 -5.615 373 HA SER 61 HA SER 61 -15.747 -1.756 -3.442 374 HB2 SER 61 1HB SER 61 -16.836 -2.731 -6.095 375 HB3 SER 61 2HB SER 61 -16.255 -3.739 -4.774 376 HG SER 61 HG SER 61 -17.988 -2.379 -3.573 377 H CYS 62 H CYS 62 -13.657 -2.370 -3.575 378 HA CYS 62 HA CYS 62 -11.895 -1.078 -5.344 379 HB2 CYS 62 2HB CYS 62 -11.143 -1.782 -3.161 380 HB3 CYS 62 1HB CYS 62 -11.487 -3.468 -3.538 381 H ASN 63 H ASN 63 -10.807 -1.736 -7.120 382 HA ASN 63 HA ASN 63 -12.083 -3.713 -8.753 383 HB2 ASN 63 1HB ASN 63 -11.283 -1.601 -9.707 384 HB3 ASN 63 2HB ASN 63 -9.632 -2.011 -9.256 385 HD21 ASN 63 1HD2 ASN 63 -9.037 -4.004 -12.036 386 HD22 ASN 63 2HD2 ASN 63 -8.460 -3.369 -10.533 387 H ALA 64 H ALA 64 -9.135 -3.520 -6.870 388 HA ALA 64 HA ALA 64 -8.505 -6.257 -7.744 389 HB1 ALA 64 1HB ALA 64 -6.876 -4.681 -8.646 390 HB2 ALA 64 2HB ALA 64 -6.135 -5.773 -7.476 391 HB3 ALA 64 3HB ALA 64 -6.514 -4.112 -7.014 392 H ASN 65 H ASN 65 -6.763 -4.506 -5.247 393 HA ASN 65 HA ASN 65 -8.007 -6.256 -3.226 394 HB2 ASN 65 1HB ASN 65 -5.090 -5.557 -3.442 395 HB3 ASN 65 2HB ASN 65 -5.808 -6.521 -2.171 396 HD21 ASN 65 1HD2 ASN 65 -4.969 -8.113 -5.802 397 HD22 ASN 65 2HD2 ASN 65 -4.856 -6.416 -5.504 398 HA PRO 66 HA PRO 66 -8.376 -2.242 -1.279 399 HB2 PRO 66 2HB PRO 66 -10.185 -2.979 0.555 400 HB3 PRO 66 1HB PRO 66 -10.621 -2.776 -1.146 401 HG2 PRO 66 2HG PRO 66 -10.100 -5.283 0.390 402 HG3 PRO 66 1HG PRO 66 -11.330 -4.957 -0.845 403 HD2 PRO 66 2HD PRO 66 -8.926 -6.273 -1.304 404 HD3 PRO 66 1HD PRO 66 -9.888 -5.468 -2.556 405 H ALA 67 H ALA 67 -7.314 -1.363 0.445 406 HA ALA 67 HA ALA 67 -6.403 -3.125 2.588 407 HB1 ALA 67 1HB ALA 67 -4.489 -1.532 0.890 408 HB2 ALA 67 2HB ALA 67 -4.671 -3.288 0.871 409 HB3 ALA 67 3HB ALA 67 -4.072 -2.480 2.319 410 H CYS 68 H CYS 68 -5.754 -2.097 4.444 411 HA CYS 68 HA CYS 68 -6.096 0.818 4.563 412 HB2 CYS 68 2HB CYS 68 -7.371 -0.353 6.261 413 HB3 CYS 68 1HB CYS 68 -5.952 -1.264 6.759 414 H CYS 69 H CYS 69 -4.291 1.935 4.372 415 HA CYS 69 HA CYS 69 -1.766 0.602 5.052 416 HB2 CYS 69 2HB CYS 69 -2.149 2.852 3.082 417 HB3 CYS 69 1HB CYS 69 -0.724 1.866 3.330 418 H ASP 70 H ASP 70 -0.236 1.707 6.208 419 HA ASP 70 HA ASP 70 -1.164 3.684 8.013 420 HB2 ASP 70 1HB ASP 70 0.687 1.991 8.438 421 HB3 ASP 70 2HB ASP 70 1.729 3.009 7.451 422 H ASN 71 H ASN 71 0.970 3.782 5.199 423 HA ASN 71 HA ASN 71 0.137 6.533 4.702 424 HB2 ASN 71 1HB ASN 71 3.059 5.720 4.796 425 HB3 ASN 71 2HB ASN 71 2.461 7.245 4.161 426 HD21 ASN 71 1HD2 ASN 71 2.964 6.676 8.121 427 HD22 ASN 71 2HD2 ASN 71 3.204 5.411 6.968 428 H VAL 72 H VAL 72 -0.382 6.703 2.561 429 HA VAL 72 HA VAL 72 1.223 5.103 0.718 430 HB VAL 72 HB VAL 72 -0.539 3.752 0.393 431 HG11 VAL 72 1HG1 VAL 72 -2.889 4.350 0.802 432 HG12 VAL 72 2HG1 VAL 72 -2.356 5.957 1.300 433 HG13 VAL 72 3HG1 VAL 72 -1.841 4.528 2.206 434 HG21 VAL 72 1HG2 VAL 72 -0.344 4.901 -1.735 435 HG22 VAL 72 2HG2 VAL 72 -1.509 6.112 -1.203 436 HG23 VAL 72 3HG2 VAL 72 -2.019 4.439 -1.429 437 H TYR 73 H TYR 73 1.806 6.007 -1.112 438 HA TYR 73 HA TYR 73 1.577 8.927 -1.054 439 HB2 TYR 73 2HB TYR 73 3.715 7.109 -2.192 440 HB3 TYR 73 1HB TYR 73 3.795 8.870 -2.136 441 HD1 TYR 73 1HD TYR 73 3.760 5.804 -0.056 442 HD2 TYR 73 2HD TYR 73 4.417 10.008 -0.132 443 HE1 TYR 73 1HE TYR 73 4.695 5.686 2.220 444 HE2 TYR 73 2HE TYR 73 5.357 9.900 2.134 445 HH TYR 73 HH TYR 73 6.115 6.932 3.697 446 H THR 74 H THR 74 2.017 9.941 -3.272 447 HA THR 74 HA THR 74 -0.374 9.339 -4.678 448 HB THR 74 HB THR 74 1.723 11.294 -5.596 449 HG1 THR 74 1HG THR 74 -0.301 12.095 -3.815 450 HG21 THR 74 1HG2 THR 74 -0.232 12.585 -6.327 451 HG22 THR 74 2HG2 THR 74 -1.297 11.326 -5.705 452 HG23 THR 74 3HG2 THR 74 -0.220 10.979 -7.058 453 H ASN 75 H ASN 75 2.916 8.418 -5.197 454 HA ASN 75 HA ASN 75 2.649 7.712 -7.951 455 HB2 ASN 75 1HB ASN 75 4.624 6.327 -7.631 456 HB3 ASN 75 2HB ASN 75 4.862 7.864 -6.810 457 HD21 ASN 75 1HD2 ASN 75 5.825 4.886 -4.701 458 HD22 ASN 75 2HD2 ASN 75 6.111 5.240 -6.367 459 H GLY 76 H GLY 76 1.370 6.549 -5.077 460 HA2 GLY 76 1HA GLY 76 -0.481 5.083 -5.098 461 HA3 GLY 76 2HA GLY 76 0.212 4.263 -6.492 462 H LEU 77 H LEU 77 2.468 5.007 -3.995 463 HA LEU 77 HA LEU 77 2.618 2.148 -3.393 464 HB2 LEU 77 1HB LEU 77 4.641 3.370 -4.097 465 HB3 LEU 77 2HB LEU 77 4.480 4.417 -2.710 466 HG LEU 77 HG LEU 77 6.232 2.538 -2.620 467 HD11 LEU 77 1HD1 LEU 77 5.615 3.835 -0.666 468 HD12 LEU 77 2HD1 LEU 77 5.868 2.139 -0.241 469 HD13 LEU 77 3HD1 LEU 77 4.228 2.783 -0.389 470 HD21 LEU 77 1HD2 LEU 77 4.765 0.766 -3.460 471 HD22 LEU 77 2HD2 LEU 77 3.777 0.910 -2.002 472 HD23 LEU 77 3HD2 LEU 77 5.458 0.380 -1.884 473 H GLY 78 H GLY 78 1.610 1.402 -1.667 474 HA2 GLY 78 1HA GLY 78 1.239 3.220 0.621 475 HA3 GLY 78 2HA GLY 78 0.237 1.817 0.285 476 H VAL 79 H VAL 79 1.983 2.737 2.588 477 HA VAL 79 HA VAL 79 3.650 0.323 2.843 478 HB VAL 79 HB VAL 79 4.721 2.627 3.105 479 HG11 VAL 79 1HG1 VAL 79 4.455 3.787 5.212 480 HG12 VAL 79 2HG1 VAL 79 3.221 2.629 5.710 481 HG13 VAL 79 3HG1 VAL 79 2.923 3.703 4.343 482 HG21 VAL 79 1HG2 VAL 79 5.783 0.591 3.926 483 HG22 VAL 79 2HG2 VAL 79 4.917 0.755 5.455 484 HG23 VAL 79 3HG2 VAL 79 6.109 1.965 4.981 485 H GLN 80 H GLN 80 3.342 -1.040 4.536 486 HA GLN 80 HA GLN 80 2.191 -2.217 6.071 487 HB2 GLN 80 1HB GLN 80 1.811 0.589 7.065 488 HB3 GLN 80 2HB GLN 80 1.034 -0.757 7.891 489 HG2 GLN 80 1HG GLN 80 3.956 -0.710 7.292 490 HG3 GLN 80 2HG GLN 80 3.293 -0.011 8.767 491 HE21 GLN 80 1HE2 GLN 80 4.347 -3.619 9.179 492 HE22 GLN 80 2HE2 GLN 80 5.122 -2.256 8.450 493 H CYS 81 H CYS 81 0.976 -2.262 3.837 494 HA CYS 81 HA CYS 81 -1.775 -1.350 4.102 495 HB2 CYS 81 2HB CYS 81 -0.334 -2.696 1.817 496 HB3 CYS 81 1HB CYS 81 -2.042 -2.289 1.794 497 H ASN 82 H ASN 82 -2.924 -2.540 5.399 498 HA ASN 82 HA ASN 82 -2.758 -5.464 5.166 499 HB2 ASN 82 1HB ASN 82 -4.279 -5.419 7.215 500 HB3 ASN 82 2HB ASN 82 -2.622 -4.876 7.434 501 HD21 ASN 82 1HD2 ASN 82 -3.455 -1.607 8.278 502 HD22 ASN 82 2HD2 ASN 82 -2.213 -2.722 7.830 503 HA PRO 83 HA PRO 83 -6.184 -5.551 2.467 504 HB2 PRO 83 2HB PRO 83 -6.793 -8.196 3.631 505 HB3 PRO 83 1HB PRO 83 -6.420 -7.759 1.963 506 HG2 PRO 83 2HG PRO 83 -4.655 -9.060 3.502 507 HG3 PRO 83 1HG PRO 83 -4.141 -7.855 2.308 508 HD2 PRO 83 2HD PRO 83 -4.360 -7.609 5.278 509 HD3 PRO 83 1HD PRO 83 -3.150 -6.932 4.171 510 H ILE 84 H ILE 84 -8.262 -4.996 2.494 511 HA ILE 84 HA ILE 84 -9.670 -4.819 5.039 512 HB ILE 84 HB ILE 84 -10.536 -3.933 2.295 513 HG12 ILE 84 1HG1 ILE 84 -8.549 -2.718 3.023 514 HG13 ILE 84 2HG1 ILE 84 -9.960 -1.671 3.037 515 HG21 ILE 84 1HG2 ILE 84 -12.238 -2.636 3.393 516 HG22 ILE 84 2HG2 ILE 84 -11.673 -3.181 4.972 517 HG23 ILE 84 3HG2 ILE 84 -12.398 -4.335 3.848 518 HD11 ILE 84 1HD1 ILE 84 -10.149 -2.005 5.459 519 HD12 ILE 84 2HD1 ILE 84 -8.626 -1.260 4.979 520 HD13 ILE 84 3HD1 ILE 84 -8.674 -2.967 5.414 521 H ASN 85 H ASN 85 -11.687 -5.801 5.414 522 HA ASN 85 HA ASN 85 -12.069 -8.289 3.966 523 HB2 ASN 85 1HB ASN 85 -12.140 -8.154 6.493 524 HB3 ASN 85 2HB ASN 85 -13.651 -7.277 6.323 525 HD21 ASN 85 1HD2 ASN 85 -15.596 -10.091 5.664 526 HD22 ASN 85 2HD2 ASN 85 -15.502 -8.364 5.682 527 H VAL 86 H VAL 86 -12.589 -6.807 2.098 528 HA VAL 86 HA VAL 86 -15.498 -6.688 1.876 529 HB VAL 86 HB VAL 86 -15.052 -4.764 0.165 530 HG11 VAL 86 1HG1 VAL 86 -16.424 -4.502 2.158 531 HG12 VAL 86 2HG1 VAL 86 -15.402 -3.083 1.932 532 HG13 VAL 86 3HG1 VAL 86 -14.978 -4.291 3.146 533 HG21 VAL 86 1HG2 VAL 86 -12.818 -4.162 2.051 534 HG22 VAL 86 2HG2 VAL 86 -13.209 -3.388 0.517 535 HG23 VAL 86 3HG2 VAL 86 -12.560 -5.026 0.547 536 H ASN 87 H ASN 87 -15.606 -8.551 0.789 537 HA ASN 87 HA ASN 87 -15.353 -10.150 -0.801 538 HB2 ASN 87 1HB ASN 87 -15.878 -8.242 -2.372 539 HB3 ASN 87 2HB ASN 87 -14.147 -7.981 -2.544 540 HD21 ASN 87 1HD2 ASN 87 -13.684 -10.545 -4.846 541 HD22 ASN 87 2HD2 ASN 87 -12.977 -9.305 -3.867 542 H LEU 88 H LEU 88 -13.713 -10.330 1.096 543 HA LEU 88 HA LEU 88 -10.939 -10.007 0.453 544 HB2 LEU 88 1HB LEU 88 -11.888 -9.773 2.756 545 HB3 LEU 88 2HB LEU 88 -12.225 -11.492 2.746 546 HG LEU 88 HG LEU 88 -9.809 -11.961 2.552 547 HD11 LEU 88 1HD1 LEU 88 -8.203 -10.153 2.936 548 HD12 LEU 88 2HD1 LEU 88 -9.515 -8.976 2.869 549 HD13 LEU 88 3HD1 LEU 88 -9.102 -9.920 1.437 550 HD21 LEU 88 1HD2 LEU 88 -9.218 -11.301 4.837 551 HD22 LEU 88 2HD2 LEU 88 -10.859 -11.935 4.738 552 HD23 LEU 88 3HD2 LEU 88 -10.592 -10.196 4.866 Start of MODEL 14 1 H1 GLY 1 1H GLY 1 -12.780 12.995 7.421 2 H2 GLY 1 2H GLY 1 -11.640 13.963 6.643 3 H3 GLY 1 3H GLY 1 -11.133 12.783 7.743 4 HA2 GLY 1 1HA GLY 1 -10.735 12.028 5.509 5 HA3 GLY 1 2HA GLY 1 -11.962 11.039 6.287 6 H SER 2 H SER 2 -12.252 10.632 3.840 7 HA SER 2 HA SER 2 -14.266 12.532 2.838 8 HB2 SER 2 1HB SER 2 -12.237 11.011 1.184 9 HB3 SER 2 2HB SER 2 -13.483 12.086 0.552 10 HG SER 2 HG SER 2 -11.064 12.743 1.281 11 H GLY 3 H GLY 3 -14.432 9.954 4.366 12 HA2 GLY 3 1HA GLY 3 -16.526 8.670 4.088 13 HA3 GLY 3 2HA GLY 3 -16.070 8.477 2.401 14 H SER 4 H SER 4 -14.160 8.112 5.373 15 HA SER 4 HA SER 4 -13.157 5.587 4.371 16 HB2 SER 4 1HB SER 4 -12.495 6.905 7.008 17 HB3 SER 4 2HB SER 4 -11.542 5.711 6.121 18 HG SER 4 HG SER 4 -11.021 8.116 5.989 19 H SER 5 H SER 5 -15.198 4.466 4.493 20 HA SER 5 HA SER 5 -16.470 3.948 6.976 21 HB2 SER 5 1HB SER 5 -17.402 1.959 5.598 22 HB3 SER 5 2HB SER 5 -17.832 3.599 5.119 23 HG SER 5 HG SER 5 -17.171 2.428 3.304 24 H GLN 6 H GLN 6 -14.244 2.019 4.984 25 HA GLN 6 HA GLN 6 -13.638 0.336 7.287 26 HB2 GLN 6 1HB GLN 6 -12.699 0.164 4.423 27 HB3 GLN 6 2HB GLN 6 -12.246 -0.959 5.687 28 HG2 GLN 6 1HG GLN 6 -13.917 -1.999 4.457 29 HG3 GLN 6 2HG GLN 6 -14.699 -1.474 5.940 30 HE21 GLN 6 1HE2 GLN 6 -15.521 0.868 2.702 31 HE22 GLN 6 2HE2 GLN 6 -13.895 0.479 3.125 32 H CYS 7 H CYS 7 -11.225 -0.209 7.493 33 HA CYS 7 HA CYS 7 -9.045 0.309 7.778 34 HB2 CYS 7 2HB CYS 7 -8.942 1.228 5.564 35 HB3 CYS 7 1HB CYS 7 -9.727 2.705 6.096 36 H ASN 8 H ASN 8 -8.268 0.850 9.660 37 HA ASN 8 HA ASN 8 -9.545 2.949 11.225 38 HB2 ASN 8 1HB ASN 8 -7.533 0.810 11.928 39 HB3 ASN 8 2HB ASN 8 -8.060 2.044 13.064 40 HD21 ASN 8 1HD2 ASN 8 -11.122 0.559 13.766 41 HD22 ASN 8 2HD2 ASN 8 -10.107 1.951 13.921 42 H ALA 9 H ALA 9 -6.661 2.416 9.416 43 HA ALA 9 HA ALA 9 -5.108 4.364 10.894 44 HB1 ALA 9 1HB ALA 9 -4.398 2.847 8.388 45 HB2 ALA 9 2HB ALA 9 -4.029 2.339 10.036 46 HB3 ALA 9 3HB ALA 9 -3.294 3.801 9.378 47 H GLY 10 H GLY 10 -7.404 4.541 8.516 48 HA2 GLY 10 1HA GLY 10 -7.467 7.203 8.164 49 HA3 GLY 10 2HA GLY 10 -6.211 6.722 7.032 50 HA PRO 11 HA PRO 11 -9.943 6.279 4.538 51 HB2 PRO 11 2HB PRO 11 -8.855 6.909 2.186 52 HB3 PRO 11 1HB PRO 11 -9.168 8.147 3.406 53 HG2 PRO 11 2HG PRO 11 -6.605 6.803 2.686 54 HG3 PRO 11 1HG PRO 11 -6.903 8.507 3.071 55 HD2 PRO 11 2HD PRO 11 -5.905 6.632 4.851 56 HD3 PRO 11 1HD PRO 11 -6.707 8.144 5.316 57 H VAL 12 H VAL 12 -10.507 4.934 2.715 58 HA VAL 12 HA VAL 12 -9.240 2.353 2.869 59 HB VAL 12 HB VAL 12 -11.056 1.749 1.159 60 HG11 VAL 12 1HG1 VAL 12 -12.786 1.688 2.896 61 HG12 VAL 12 2HG1 VAL 12 -11.830 2.806 3.875 62 HG13 VAL 12 3HG1 VAL 12 -11.209 1.192 3.512 63 HG21 VAL 12 1HG2 VAL 12 -12.129 4.447 2.000 64 HG22 VAL 12 2HG2 VAL 12 -12.932 3.267 0.965 65 HG23 VAL 12 3HG2 VAL 12 -11.468 4.080 0.409 66 H GLN 13 H GLN 13 -7.878 1.466 1.420 67 HA GLN 13 HA GLN 13 -7.306 3.088 -0.966 68 HB2 GLN 13 1HB GLN 13 -5.485 1.107 0.408 69 HB3 GLN 13 2HB GLN 13 -5.085 2.094 -0.980 70 HG2 GLN 13 1HG GLN 13 -5.741 3.108 1.769 71 HG3 GLN 13 2HG GLN 13 -4.140 3.011 1.041 72 HE21 GLN 13 1HE2 GLN 13 -5.719 6.429 0.733 73 HE22 GLN 13 2HE2 GLN 13 -5.627 5.312 2.051 74 H CYS 14 H CYS 14 -7.348 2.257 -2.917 75 HA CYS 14 HA CYS 14 -8.018 -0.587 -3.229 76 HB2 CYS 14 2HB CYS 14 -9.722 0.887 -4.152 77 HB3 CYS 14 1HB CYS 14 -8.519 1.761 -5.085 78 H CYS 15 H CYS 15 -6.265 -1.725 -3.598 79 HA CYS 15 HA CYS 15 -4.015 -0.452 -5.006 80 HB2 CYS 15 2HB CYS 15 -3.933 -2.720 -3.009 81 HB3 CYS 15 1HB CYS 15 -2.557 -1.836 -3.667 82 H ASN 16 H ASN 16 -3.033 -1.463 -6.650 83 HA ASN 16 HA ASN 16 -4.423 -3.440 -8.121 84 HB2 ASN 16 1HB ASN 16 -2.780 -1.677 -8.969 85 HB3 ASN 16 2HB ASN 16 -1.519 -2.772 -8.435 86 HD21 ASN 16 1HD2 ASN 16 -1.594 -4.041 -11.674 87 HD22 ASN 16 2HD2 ASN 16 -0.739 -3.094 -10.506 88 H THR 17 H THR 17 -1.739 -3.525 -5.899 89 HA THR 17 HA THR 17 -2.029 -6.409 -5.652 90 HB THR 17 HB THR 17 0.586 -5.088 -6.422 91 HG1 THR 17 1HG THR 17 -1.326 -6.281 -7.847 92 HG21 THR 17 1HG2 THR 17 1.535 -7.387 -6.262 93 HG22 THR 17 2HG2 THR 17 0.051 -7.894 -5.456 94 HG23 THR 17 3HG2 THR 17 1.092 -6.682 -4.708 95 H LEU 18 H LEU 18 -1.971 -6.952 -3.552 96 HA LEU 18 HA LEU 18 -0.587 -5.147 -1.683 97 HB2 LEU 18 1HB LEU 18 -2.635 -7.316 -1.211 98 HB3 LEU 18 2HB LEU 18 -1.776 -6.497 0.078 99 HG LEU 18 HG LEU 18 -3.597 -5.164 -1.913 100 HD11 LEU 18 1HD1 LEU 18 -4.741 -6.650 -0.277 101 HD12 LEU 18 2HD1 LEU 18 -5.164 -4.948 -0.105 102 HD13 LEU 18 3HD1 LEU 18 -4.029 -5.691 1.023 103 HD21 LEU 18 1HD2 LEU 18 -3.346 -3.197 -0.523 104 HD22 LEU 18 2HD2 LEU 18 -1.775 -3.725 -1.116 105 HD23 LEU 18 3HD2 LEU 18 -2.249 -4.066 0.549 106 H THR 19 H THR 19 1.425 -5.707 -1.454 107 HA THR 19 HA THR 19 2.105 -8.496 -0.963 108 HB THR 19 HB THR 19 2.415 -8.261 -3.364 109 HG1 THR 19 1HG THR 19 4.151 -9.416 -3.193 110 HG21 THR 19 1HG2 THR 19 2.697 -5.912 -3.671 111 HG22 THR 19 2HG2 THR 19 4.166 -6.692 -4.256 112 HG23 THR 19 3HG2 THR 19 4.158 -5.897 -2.681 113 H SER 20 H SER 20 4.757 -8.379 -0.677 114 HA SER 20 HA SER 20 5.025 -6.547 1.584 115 HB2 SER 20 1HB SER 20 6.814 -8.856 0.786 116 HB3 SER 20 2HB SER 20 6.805 -8.005 2.330 117 HG SER 20 HG SER 20 4.362 -8.782 2.049 118 H ALA 21 H ALA 21 7.131 -5.498 1.911 119 HA ALA 21 HA ALA 21 7.767 -3.911 -0.331 120 HB1 ALA 21 1HB ALA 21 9.420 -2.865 1.119 121 HB2 ALA 21 2HB ALA 21 9.226 -4.170 2.291 122 HB3 ALA 21 3HB ALA 21 7.881 -3.083 1.949 123 H SER 22 H SER 22 8.795 -6.997 0.334 124 HA SER 22 HA SER 22 11.459 -6.772 -0.715 125 HB2 SER 22 1HB SER 22 10.660 -8.574 0.882 126 HB3 SER 22 2HB SER 22 9.809 -9.277 -0.472 127 HG SER 22 HG SER 22 11.650 -9.891 -1.371 128 H ASN 23 H ASN 23 8.309 -6.919 -2.008 129 HA ASN 23 HA ASN 23 8.851 -8.220 -4.477 130 HB2 ASN 23 1HB ASN 23 6.558 -7.787 -3.452 131 HB3 ASN 23 2HB ASN 23 6.714 -6.128 -4.001 132 HD21 ASN 23 1HD2 ASN 23 5.832 -9.104 -6.596 133 HD22 ASN 23 2HD2 ASN 23 6.257 -9.427 -4.950 134 H SER 24 H SER 24 9.438 -7.410 -6.438 135 HA SER 24 HA SER 24 11.147 -5.175 -6.462 136 HB2 SER 24 1HB SER 24 11.335 -7.154 -7.976 137 HB3 SER 24 2HB SER 24 9.914 -6.578 -8.845 138 HG SER 24 HG SER 24 11.329 -4.521 -8.948 139 H GLN 25 H GLN 25 7.748 -5.537 -7.191 140 HA GLN 25 HA GLN 25 7.366 -3.097 -8.552 141 HB2 GLN 25 1HB GLN 25 5.702 -4.970 -8.429 142 HB3 GLN 25 2HB GLN 25 5.417 -4.545 -6.740 143 HG2 GLN 25 1HG GLN 25 3.690 -3.606 -8.053 144 HG3 GLN 25 2HG GLN 25 4.733 -2.312 -7.466 145 HE21 GLN 25 1HE2 GLN 25 4.382 -3.029 -11.439 146 HE22 GLN 25 2HE2 GLN 25 3.707 -4.101 -10.259 147 H ALA 26 H ALA 26 7.011 -4.061 -5.175 148 HA ALA 26 HA ALA 26 6.275 -1.543 -4.157 149 HB1 ALA 26 1HB ALA 26 5.887 -3.592 -2.925 150 HB2 ALA 26 2HB ALA 26 6.896 -2.501 -1.972 151 HB3 ALA 26 3HB ALA 26 7.622 -3.878 -2.803 152 H ALA 27 H ALA 27 9.438 -3.208 -4.046 153 HA ALA 27 HA ALA 27 10.768 -1.094 -2.753 154 HB1 ALA 27 1HB ALA 27 11.943 -3.233 -4.532 155 HB2 ALA 27 2HB ALA 27 11.657 -3.370 -2.797 156 HB3 ALA 27 3HB ALA 27 12.840 -2.213 -3.407 157 H GLY 28 H GLY 28 10.286 -1.759 -6.200 158 HA2 GLY 28 1HA GLY 28 11.934 0.224 -7.256 159 HA3 GLY 28 2HA GLY 28 10.412 -0.292 -7.973 160 H LEU 29 H LEU 29 8.593 0.455 -6.149 161 HA LEU 29 HA LEU 29 8.278 3.242 -6.532 162 HB2 LEU 29 1HB LEU 29 6.914 1.356 -4.653 163 HB3 LEU 29 2HB LEU 29 6.344 2.949 -5.037 164 HG LEU 29 HG LEU 29 6.549 0.648 -6.974 165 HD11 LEU 29 1HD1 LEU 29 4.078 0.819 -6.977 166 HD12 LEU 29 2HD1 LEU 29 4.195 1.971 -5.645 167 HD13 LEU 29 3HD1 LEU 29 4.749 0.311 -5.427 168 HD21 LEU 29 1HD2 LEU 29 5.345 2.141 -8.519 169 HD22 LEU 29 2HD2 LEU 29 6.948 2.750 -8.109 170 HD23 LEU 29 3HD2 LEU 29 5.516 3.459 -7.358 171 H ILE 30 H ILE 30 8.918 1.297 -3.634 172 HA ILE 30 HA ILE 30 9.144 3.227 -1.690 173 HB ILE 30 HB ILE 30 10.711 0.682 -2.041 174 HG12 ILE 30 1HG1 ILE 30 8.295 1.345 -0.361 175 HG13 ILE 30 2HG1 ILE 30 8.237 0.519 -1.910 176 HG21 ILE 30 1HG2 ILE 30 11.745 2.410 -0.466 177 HG22 ILE 30 2HG2 ILE 30 11.434 0.800 0.187 178 HG23 ILE 30 3HG2 ILE 30 10.338 2.127 0.563 179 HD11 ILE 30 1HD1 ILE 30 9.627 -0.501 0.548 180 HD12 ILE 30 2HD1 ILE 30 9.455 -1.341 -0.995 181 HD13 ILE 30 3HD1 ILE 30 8.030 -0.996 -0.013 182 H GLN 31 H GLN 31 11.650 2.022 -3.845 183 HA GLN 31 HA GLN 31 13.660 3.689 -2.818 184 HB2 GLN 31 1HB GLN 31 13.411 1.992 -5.271 185 HB3 GLN 31 2HB GLN 31 14.861 2.952 -4.967 186 HG2 GLN 31 1HG GLN 31 15.057 1.743 -2.789 187 HG3 GLN 31 2HG GLN 31 13.718 0.726 -3.316 188 HE21 GLN 31 1HE2 GLN 31 15.600 -1.166 -5.573 189 HE22 GLN 31 2HE2 GLN 31 14.020 -0.689 -5.058 190 H GLN 32 H GLN 32 11.117 4.239 -5.081 191 HA GLN 32 HA GLN 32 12.422 6.492 -6.346 192 HB2 GLN 32 1HB GLN 32 9.566 5.535 -6.323 193 HB3 GLN 32 2HB GLN 32 10.054 7.027 -7.111 194 HG2 GLN 32 1HG GLN 32 11.085 4.283 -7.763 195 HG3 GLN 32 2HG GLN 32 9.857 5.175 -8.654 196 HE21 GLN 32 1HE2 GLN 32 13.802 6.016 -9.112 197 HE22 GLN 32 2HE2 GLN 32 13.235 4.935 -7.889 198 H LEU 33 H LEU 33 10.186 5.934 -3.722 199 HA LEU 33 HA LEU 33 9.710 8.726 -3.222 200 HB2 LEU 33 1HB LEU 33 9.201 6.578 -1.209 201 HB3 LEU 33 2HB LEU 33 8.269 8.024 -1.540 202 HG LEU 33 HG LEU 33 8.395 5.629 -3.373 203 HD11 LEU 33 1HD1 LEU 33 7.357 5.164 -1.168 204 HD12 LEU 33 2HD1 LEU 33 6.274 4.989 -2.544 205 HD13 LEU 33 3HD1 LEU 33 6.170 6.421 -1.519 206 HD21 LEU 33 1HD2 LEU 33 6.256 6.720 -4.235 207 HD22 LEU 33 2HD2 LEU 33 7.796 7.463 -4.689 208 HD23 LEU 33 3HD2 LEU 33 6.815 8.179 -3.405 209 H GLY 34 H GLY 34 11.981 6.336 -2.284 210 HA2 GLY 34 1HA GLY 34 13.962 6.552 -1.122 211 HA3 GLY 34 2HA GLY 34 13.552 8.233 -0.793 212 H LEU 35 H LEU 35 11.751 5.290 -0.097 213 HA LEU 35 HA LEU 35 11.226 6.211 2.577 214 HB2 LEU 35 1HB LEU 35 10.320 3.942 0.890 215 HB3 LEU 35 2HB LEU 35 10.026 3.888 2.609 216 HG LEU 35 HG LEU 35 9.027 5.986 0.690 217 HD11 LEU 35 1HD1 LEU 35 6.835 5.059 1.200 218 HD12 LEU 35 2HD1 LEU 35 7.583 3.838 2.229 219 HD13 LEU 35 3HD1 LEU 35 7.893 3.839 0.493 220 HD21 LEU 35 1HD2 LEU 35 7.738 6.800 2.646 221 HD22 LEU 35 2HD2 LEU 35 9.479 7.016 2.819 222 HD23 LEU 35 3HD2 LEU 35 8.665 5.703 3.671 223 H SER 36 H SER 36 13.020 6.083 3.835 224 HA SER 36 HA SER 36 14.417 3.535 4.066 225 HB2 SER 36 1HB SER 36 15.722 5.654 4.038 226 HB3 SER 36 2HB SER 36 14.903 6.154 5.516 227 HG SER 36 HG SER 36 16.988 5.172 5.848 228 H GLY 37 H GLY 37 13.787 2.063 5.499 229 HA2 GLY 37 1HA GLY 37 13.316 1.823 7.986 230 HA3 GLY 37 2HA GLY 37 11.984 2.928 7.672 231 H VAL 38 H VAL 38 11.489 1.735 5.041 232 HA VAL 38 HA VAL 38 9.734 -0.398 5.841 233 HB VAL 38 HB VAL 38 10.446 0.444 3.024 234 HG11 VAL 38 1HG1 VAL 38 8.012 -0.898 4.187 235 HG12 VAL 38 2HG1 VAL 38 9.251 -1.662 3.195 236 HG13 VAL 38 3HG1 VAL 38 8.211 -0.417 2.502 237 HG21 VAL 38 1HG2 VAL 38 8.302 1.566 4.827 238 HG22 VAL 38 2HG2 VAL 38 8.520 1.952 3.120 239 HG23 VAL 38 3HG2 VAL 38 9.755 2.411 4.293 240 H GLY 39 H GLY 39 10.617 -2.312 6.316 241 HA2 GLY 39 1HA GLY 39 12.945 -3.298 4.866 242 HA3 GLY 39 2HA GLY 39 12.211 -4.031 6.286 243 H ALA 40 H ALA 40 12.672 -5.916 4.672 244 HA ALA 40 HA ALA 40 11.027 -6.058 2.354 245 HB1 ALA 40 1HB ALA 40 11.906 -8.317 2.100 246 HB2 ALA 40 2HB ALA 40 12.584 -8.240 3.725 247 HB3 ALA 40 3HB ALA 40 13.194 -7.170 2.464 248 H ASN 41 H ASN 41 10.544 -6.980 5.657 249 HA ASN 41 HA ASN 41 8.350 -8.767 4.955 250 HB2 ASN 41 1HB ASN 41 9.688 -8.080 7.568 251 HB3 ASN 41 2HB ASN 41 8.226 -9.050 7.483 252 HD21 ASN 41 1HD2 ASN 41 11.410 -11.102 7.462 253 HD22 ASN 41 2HD2 ASN 41 10.949 -9.717 8.388 254 H VAL 42 H VAL 42 8.561 -5.633 4.917 255 HA VAL 42 HA VAL 42 6.316 -4.896 6.586 256 HB VAL 42 HB VAL 42 7.879 -3.276 4.572 257 HG11 VAL 42 1HG1 VAL 42 6.988 -1.312 5.806 258 HG12 VAL 42 2HG1 VAL 42 5.880 -2.395 6.658 259 HG13 VAL 42 3HG1 VAL 42 5.750 -2.202 4.909 260 HG21 VAL 42 1HG2 VAL 42 8.867 -2.295 6.645 261 HG22 VAL 42 2HG2 VAL 42 9.327 -3.962 6.286 262 HG23 VAL 42 3HG2 VAL 42 8.118 -3.624 7.534 263 HA PRO 43 HA PRO 43 3.341 -5.630 3.370 264 HB2 PRO 43 2HB PRO 43 1.338 -4.138 4.651 265 HB3 PRO 43 1HB PRO 43 1.600 -5.863 4.787 266 HG2 PRO 43 2HG PRO 43 1.992 -3.870 6.766 267 HG3 PRO 43 1HG PRO 43 2.251 -5.613 6.910 268 HD2 PRO 43 2HD PRO 43 4.191 -3.481 6.624 269 HD3 PRO 43 1HD PRO 43 4.465 -5.182 7.025 270 H VAL 44 H VAL 44 2.793 -4.498 1.557 271 HA VAL 44 HA VAL 44 2.604 -1.585 1.757 272 HB VAL 44 HB VAL 44 3.987 -1.242 -0.230 273 HG11 VAL 44 1HG1 VAL 44 5.110 -0.986 1.863 274 HG12 VAL 44 2HG1 VAL 44 6.205 -1.813 0.753 275 HG13 VAL 44 3HG1 VAL 44 5.356 -2.726 2.003 276 HG21 VAL 44 1HG2 VAL 44 3.752 -3.258 -1.422 277 HG22 VAL 44 2HG2 VAL 44 4.367 -4.211 -0.070 278 HG23 VAL 44 3HG2 VAL 44 5.452 -3.155 -0.966 279 H GLY 45 H GLY 45 1.567 -0.616 -0.081 280 HA2 GLY 45 1HA GLY 45 -0.102 -2.551 -1.546 281 HA3 GLY 45 2HA GLY 45 -0.641 -0.942 -1.102 282 H ILE 46 H ILE 46 0.088 -2.645 -3.623 283 HA ILE 46 HA ILE 46 1.840 -0.802 -5.028 284 HB ILE 46 HB ILE 46 0.576 -3.451 -5.697 285 HG12 ILE 46 1HG1 ILE 46 2.782 -4.328 -5.797 286 HG13 ILE 46 2HG1 ILE 46 3.489 -2.740 -5.903 287 HG21 ILE 46 1HG2 ILE 46 1.566 -3.359 -7.916 288 HG22 ILE 46 2HG2 ILE 46 2.138 -1.721 -7.601 289 HG23 ILE 46 3HG2 ILE 46 0.406 -2.049 -7.685 290 HD11 ILE 46 1HD1 ILE 46 3.010 -2.324 -3.585 291 HD12 ILE 46 2HD1 ILE 46 3.933 -3.815 -3.790 292 HD13 ILE 46 3HD1 ILE 46 2.200 -3.886 -3.463 293 H ASN 47 H ASN 47 0.969 0.915 -5.989 294 HA ASN 47 HA ASN 47 -0.413 2.264 -7.186 295 HB2 ASN 47 1HB ASN 47 -0.247 0.226 -8.752 296 HB3 ASN 47 2HB ASN 47 -1.839 -0.201 -8.154 297 HD21 ASN 47 1HD2 ASN 47 -2.984 1.598 -10.907 298 HD22 ASN 47 2HD2 ASN 47 -2.689 0.038 -10.235 299 H CYS 48 H CYS 48 -1.172 2.451 -4.757 300 HA CYS 48 HA CYS 48 -3.928 1.576 -4.457 301 HB2 CYS 48 2HB CYS 48 -2.115 3.009 -2.513 302 HB3 CYS 48 1HB CYS 48 -3.710 2.390 -2.168 303 H ASN 49 H ASN 49 -5.630 2.876 -4.465 304 HA ASN 49 HA ASN 49 -5.233 5.754 -4.202 305 HB2 ASN 49 1HB ASN 49 -7.019 6.123 -5.946 306 HB3 ASN 49 2HB ASN 49 -5.484 5.538 -6.567 307 HD21 ASN 49 1HD2 ASN 49 -6.773 2.555 -7.823 308 HD22 ASN 49 2HD2 ASN 49 -5.373 3.507 -7.472 309 HA PRO 50 HA PRO 50 -8.290 5.338 -1.172 310 HB2 PRO 50 2HB PRO 50 -9.192 8.077 -1.702 311 HB3 PRO 50 1HB PRO 50 -8.343 7.437 -0.292 312 HG2 PRO 50 2HG PRO 50 -7.145 9.092 -2.047 313 HG3 PRO 50 1HG PRO 50 -6.260 7.802 -1.213 314 HD2 PRO 50 2HD PRO 50 -7.365 7.843 -4.000 315 HD3 PRO 50 1HD PRO 50 -5.786 7.269 -3.432 316 H ILE 51 H ILE 51 -10.167 4.303 -1.321 317 HA ILE 51 HA ILE 51 -11.835 4.613 -3.653 318 HB ILE 51 HB ILE 51 -12.752 3.078 -1.261 319 HG12 ILE 51 1HG1 ILE 51 -10.552 2.197 -3.144 320 HG13 ILE 51 2HG1 ILE 51 -10.382 2.490 -1.419 321 HG21 ILE 51 1HG2 ILE 51 -14.118 3.239 -3.313 322 HG22 ILE 51 2HG2 ILE 51 -13.627 1.581 -2.966 323 HG23 ILE 51 3HG2 ILE 51 -12.800 2.498 -4.226 324 HD11 ILE 51 1HD1 ILE 51 -11.911 0.635 -0.967 325 HD12 ILE 51 2HD1 ILE 51 -10.484 0.125 -1.869 326 HD13 ILE 51 3HD1 ILE 51 -12.027 0.328 -2.700 327 H THR 52 H THR 52 -12.487 6.785 -3.437 328 HA THR 52 HA THR 52 -14.367 7.253 -1.222 329 HB THR 52 HB THR 52 -13.845 9.699 -1.576 330 HG1 THR 52 1HG THR 52 -12.847 9.825 -3.522 331 HG21 THR 52 1HG2 THR 52 -12.882 8.469 0.286 332 HG22 THR 52 2HG2 THR 52 -11.679 9.576 -0.378 333 HG23 THR 52 3HG2 THR 52 -11.596 7.853 -0.753 334 H GLY 53 H GLY 53 -14.412 6.384 -4.262 335 HA2 GLY 53 1HA GLY 53 -16.454 8.265 -5.191 336 HA3 GLY 53 2HA GLY 53 -15.680 7.014 -6.155 337 H ILE 54 H ILE 54 -17.284 6.820 -3.002 338 HA ILE 54 HA ILE 54 -18.672 4.456 -3.557 339 HB ILE 54 HB ILE 54 -19.388 6.612 -1.563 340 HG12 ILE 54 1HG1 ILE 54 -17.809 4.048 -1.221 341 HG13 ILE 54 2HG1 ILE 54 -17.121 5.667 -1.254 342 HG21 ILE 54 1HG2 ILE 54 -20.204 3.717 -1.516 343 HG22 ILE 54 2HG2 ILE 54 -21.205 4.985 -2.226 344 HG23 ILE 54 3HG2 ILE 54 -20.802 5.034 -0.503 345 HD11 ILE 54 1HD1 ILE 54 -18.353 6.230 0.776 346 HD12 ILE 54 2HD1 ILE 54 -17.303 4.834 1.015 347 HD13 ILE 54 3HD1 ILE 54 -19.038 4.607 0.808 348 H GLY 55 H GLY 55 -20.662 4.018 -4.326 349 HA2 GLY 55 1HA GLY 55 -22.351 6.298 -5.118 350 HA3 GLY 55 2HA GLY 55 -22.027 4.973 -6.216 351 H ALA 56 H ALA 56 -22.220 2.825 -4.434 352 HA ALA 56 HA ALA 56 -24.895 3.011 -3.284 353 HB1 ALA 56 1HB ALA 56 -25.669 1.016 -4.461 354 HB2 ALA 56 2HB ALA 56 -24.151 0.945 -5.355 355 HB3 ALA 56 3HB ALA 56 -25.255 2.298 -5.597 356 H GLY 57 H GLY 57 -23.891 2.749 -1.267 357 HA2 GLY 57 1HA GLY 57 -23.817 0.957 0.382 358 HA3 GLY 57 2HA GLY 57 -22.929 -0.000 -0.795 359 H SER 58 H SER 58 -22.597 1.641 1.973 360 HA SER 58 HA SER 58 -20.336 3.256 1.631 361 HB2 SER 58 1HB SER 58 -21.208 1.734 4.097 362 HB3 SER 58 2HB SER 58 -20.093 3.101 4.067 363 HG SER 58 HG SER 58 -22.870 3.039 3.706 364 H GLY 59 H GLY 59 -20.662 -0.186 1.892 365 HA2 GLY 59 1HA GLY 59 -17.843 -0.614 2.427 366 HA3 GLY 59 2HA GLY 59 -19.055 -1.854 2.138 367 H SER 60 H SER 60 -17.871 0.921 0.255 368 HA SER 60 HA SER 60 -18.045 -0.458 -2.200 369 HB2 SER 60 1HB SER 60 -16.549 2.058 -1.497 370 HB3 SER 60 2HB SER 60 -16.845 1.485 -3.136 371 HG SER 60 HG SER 60 -19.060 1.711 -1.454 372 H SER 61 H SER 61 -16.700 -1.806 -3.148 373 HA SER 61 HA SER 61 -14.275 -2.512 -1.692 374 HB2 SER 61 1HB SER 61 -15.714 -3.993 -3.905 375 HB3 SER 61 2HB SER 61 -14.437 -4.630 -2.868 376 HG SER 61 HG SER 61 -16.657 -3.549 -1.588 377 H CYS 62 H CYS 62 -12.428 -3.318 -3.074 378 HA CYS 62 HA CYS 62 -11.814 -1.247 -5.034 379 HB2 CYS 62 2HB CYS 62 -10.137 -1.477 -3.366 380 HB3 CYS 62 1HB CYS 62 -10.116 -3.229 -3.526 381 H ASN 63 H ASN 63 -11.260 -1.657 -7.136 382 HA ASN 63 HA ASN 63 -12.317 -3.819 -8.505 383 HB2 ASN 63 1HB ASN 63 -11.701 -1.760 -9.643 384 HB3 ASN 63 2HB ASN 63 -10.001 -2.033 -9.276 385 HD21 ASN 63 1HD2 ASN 63 -9.432 -4.139 -11.976 386 HD22 ASN 63 2HD2 ASN 63 -8.817 -3.398 -10.541 387 H ALA 64 H ALA 64 -9.039 -3.349 -7.275 388 HA ALA 64 HA ALA 64 -8.417 -6.119 -8.003 389 HB1 ALA 64 1HB ALA 64 -6.546 -3.906 -7.164 390 HB2 ALA 64 2HB ALA 64 -6.865 -4.413 -8.822 391 HB3 ALA 64 3HB ALA 64 -6.079 -5.522 -7.698 392 H ASN 65 H ASN 65 -6.817 -4.339 -5.428 393 HA ASN 65 HA ASN 65 -7.993 -6.194 -3.456 394 HB2 ASN 65 1HB ASN 65 -5.118 -5.294 -3.615 395 HB3 ASN 65 2HB ASN 65 -5.788 -6.311 -2.356 396 HD21 ASN 65 1HD2 ASN 65 -4.815 -7.821 -5.997 397 HD22 ASN 65 2HD2 ASN 65 -4.809 -6.124 -5.679 398 HA PRO 66 HA PRO 66 -8.585 -2.287 -1.330 399 HB2 PRO 66 2HB PRO 66 -10.308 -3.166 0.504 400 HB3 PRO 66 1HB PRO 66 -10.782 -3.032 -1.194 401 HG2 PRO 66 2HG PRO 66 -10.021 -5.457 0.375 402 HG3 PRO 66 1HG PRO 66 -11.281 -5.271 -0.858 403 HD2 PRO 66 2HD PRO 66 -8.731 -6.338 -1.289 404 HD3 PRO 66 1HD PRO 66 -9.813 -5.729 -2.553 405 H ALA 67 H ALA 67 -7.476 -1.373 0.344 406 HA ALA 67 HA ALA 67 -6.519 -3.081 2.511 407 HB1 ALA 67 1HB ALA 67 -4.773 -3.220 0.821 408 HB2 ALA 67 2HB ALA 67 -4.207 -2.356 2.249 409 HB3 ALA 67 3HB ALA 67 -4.647 -1.463 0.793 410 H CYS 68 H CYS 68 -5.619 -1.953 4.274 411 HA CYS 68 HA CYS 68 -6.155 0.945 4.364 412 HB2 CYS 68 2HB CYS 68 -7.566 -0.253 5.957 413 HB3 CYS 68 1HB CYS 68 -6.168 -1.104 6.602 414 H CYS 69 H CYS 69 -4.358 2.205 4.711 415 HA CYS 69 HA CYS 69 -1.910 0.731 5.418 416 HB2 CYS 69 2HB CYS 69 -2.461 1.950 2.963 417 HB3 CYS 69 1HB CYS 69 -1.321 3.010 3.762 418 H ASP 70 H ASP 70 -0.233 1.925 6.367 419 HA ASP 70 HA ASP 70 -1.029 3.890 8.247 420 HB2 ASP 70 1HB ASP 70 0.893 2.418 8.651 421 HB3 ASP 70 2HB ASP 70 1.730 3.102 7.271 422 H ASN 71 H ASN 71 0.782 3.969 5.224 423 HA ASN 71 HA ASN 71 -0.092 6.709 4.722 424 HB2 ASN 71 1HB ASN 71 2.822 5.894 4.831 425 HB3 ASN 71 2HB ASN 71 2.263 7.314 3.970 426 HD21 ASN 71 1HD2 ASN 71 3.464 7.999 7.477 427 HD22 ASN 71 2HD2 ASN 71 4.089 6.991 6.215 428 H VAL 72 H VAL 72 -0.289 7.103 2.509 429 HA VAL 72 HA VAL 72 1.073 5.226 0.736 430 HB VAL 72 HB VAL 72 -0.744 4.488 -0.286 431 HG11 VAL 72 1HG1 VAL 72 -2.227 5.984 1.847 432 HG12 VAL 72 2HG1 VAL 72 -1.677 4.310 1.892 433 HG13 VAL 72 3HG1 VAL 72 -2.957 4.789 0.777 434 HG21 VAL 72 1HG2 VAL 72 -0.794 6.558 -1.602 435 HG22 VAL 72 2HG2 VAL 72 -1.886 7.271 -0.410 436 HG23 VAL 72 3HG2 VAL 72 -2.404 5.873 -1.354 437 H TYR 73 H TYR 73 1.723 6.083 -1.232 438 HA TYR 73 HA TYR 73 1.916 9.020 -1.185 439 HB2 TYR 73 2HB TYR 73 3.807 6.919 -2.244 440 HB3 TYR 73 1HB TYR 73 4.066 8.656 -2.402 441 HD1 TYR 73 1HD TYR 73 4.918 9.937 -0.578 442 HD2 TYR 73 2HD TYR 73 3.821 5.872 0.024 443 HE1 TYR 73 1HE TYR 73 5.966 9.989 1.646 444 HE2 TYR 73 2HE TYR 73 4.868 5.908 2.249 445 HH TYR 73 HH TYR 73 5.867 8.827 3.752 446 H THR 74 H THR 74 2.128 10.024 -3.379 447 HA THR 74 HA THR 74 -0.236 9.230 -4.751 448 HB THR 74 HB THR 74 0.362 11.221 -6.252 449 HG1 THR 74 1HG THR 74 2.343 11.905 -5.965 450 HG21 THR 74 1HG2 THR 74 -1.268 11.342 -4.432 451 HG22 THR 74 2HG2 THR 74 -0.323 12.827 -4.529 452 HG23 THR 74 3HG2 THR 74 0.032 11.637 -3.278 453 H ASN 75 H ASN 75 2.905 8.175 -5.166 454 HA ASN 75 HA ASN 75 2.676 7.598 -7.983 455 HB2 ASN 75 1HB ASN 75 4.588 6.113 -7.663 456 HB3 ASN 75 2HB ASN 75 4.902 7.648 -6.867 457 HD21 ASN 75 1HD2 ASN 75 5.746 4.668 -4.722 458 HD22 ASN 75 2HD2 ASN 75 6.049 5.001 -6.390 459 H GLY 76 H GLY 76 1.468 6.426 -5.063 460 HA2 GLY 76 1HA GLY 76 -0.454 5.003 -5.092 461 HA3 GLY 76 2HA GLY 76 0.268 4.124 -6.435 462 H LEU 77 H LEU 77 2.560 4.928 -4.013 463 HA LEU 77 HA LEU 77 2.625 2.097 -3.278 464 HB2 LEU 77 1HB LEU 77 4.666 3.226 -4.086 465 HB3 LEU 77 2HB LEU 77 4.577 4.327 -2.738 466 HG LEU 77 HG LEU 77 6.280 2.420 -2.616 467 HD11 LEU 77 1HD1 LEU 77 5.739 3.783 -0.692 468 HD12 LEU 77 2HD1 LEU 77 5.956 2.094 -0.219 469 HD13 LEU 77 3HD1 LEU 77 4.330 2.779 -0.354 470 HD21 LEU 77 1HD2 LEU 77 3.825 0.844 -1.880 471 HD22 LEU 77 2HD2 LEU 77 5.504 0.294 -1.825 472 HD23 LEU 77 3HD2 LEU 77 4.746 0.657 -3.375 473 H GLY 78 H GLY 78 1.810 1.403 -1.441 474 HA2 GLY 78 1HA GLY 78 1.361 3.363 0.714 475 HA3 GLY 78 2HA GLY 78 0.419 1.901 0.477 476 H VAL 79 H VAL 79 1.879 2.849 2.839 477 HA VAL 79 HA VAL 79 3.766 0.599 3.136 478 HB VAL 79 HB VAL 79 4.744 2.948 3.296 479 HG11 VAL 79 1HG1 VAL 79 3.332 3.004 5.943 480 HG12 VAL 79 2HG1 VAL 79 2.904 3.974 4.535 481 HG13 VAL 79 3HG1 VAL 79 4.466 4.204 5.321 482 HG21 VAL 79 1HG2 VAL 79 5.910 0.998 4.157 483 HG22 VAL 79 2HG2 VAL 79 5.045 1.142 5.687 484 HG23 VAL 79 3HG2 VAL 79 6.180 2.399 5.192 485 H GLN 80 H GLN 80 3.291 -0.874 4.596 486 HA GLN 80 HA GLN 80 2.284 -2.032 6.246 487 HB2 GLN 80 1HB GLN 80 1.789 0.749 7.303 488 HB3 GLN 80 2HB GLN 80 1.304 -0.691 8.179 489 HG2 GLN 80 1HG GLN 80 4.097 -0.227 7.267 490 HG3 GLN 80 2HG GLN 80 3.506 0.351 8.824 491 HE21 GLN 80 1HE2 GLN 80 5.100 -3.019 9.113 492 HE22 GLN 80 2HE2 GLN 80 5.601 -1.522 8.406 493 H CYS 81 H CYS 81 0.939 -1.961 4.018 494 HA CYS 81 HA CYS 81 -1.833 -1.210 4.469 495 HB2 CYS 81 2HB CYS 81 -0.445 -2.517 2.131 496 HB3 CYS 81 1HB CYS 81 -2.185 -2.372 2.221 497 H ASN 82 H ASN 82 -3.246 -2.494 5.469 498 HA ASN 82 HA ASN 82 -2.808 -5.388 5.229 499 HB2 ASN 82 1HB ASN 82 -4.244 -5.692 7.199 500 HB3 ASN 82 2HB ASN 82 -2.838 -4.713 7.555 501 HD21 ASN 82 1HD2 ASN 82 -6.067 -3.355 8.980 502 HD22 ASN 82 2HD2 ASN 82 -5.427 -4.958 8.901 503 HA PRO 83 HA PRO 83 -6.145 -5.573 2.441 504 HB2 PRO 83 2HB PRO 83 -6.662 -8.304 3.385 505 HB3 PRO 83 1HB PRO 83 -6.115 -7.751 1.803 506 HG2 PRO 83 2HG PRO 83 -4.488 -9.054 3.498 507 HG3 PRO 83 1HG PRO 83 -3.896 -7.782 2.414 508 HD2 PRO 83 2HD PRO 83 -4.511 -7.646 5.341 509 HD3 PRO 83 1HD PRO 83 -3.170 -6.926 4.431 510 H ILE 84 H ILE 84 -8.258 -5.165 2.396 511 HA ILE 84 HA ILE 84 -9.755 -5.161 4.901 512 HB ILE 84 HB ILE 84 -10.537 -4.135 2.187 513 HG12 ILE 84 1HG1 ILE 84 -8.609 -2.924 3.047 514 HG13 ILE 84 2HG1 ILE 84 -10.041 -1.907 3.088 515 HG21 ILE 84 1HG2 ILE 84 -12.462 -4.636 3.586 516 HG22 ILE 84 2HG2 ILE 84 -12.289 -2.902 3.314 517 HG23 ILE 84 3HG2 ILE 84 -11.801 -3.606 4.857 518 HD11 ILE 84 1HD1 ILE 84 -10.293 -2.349 5.468 519 HD12 ILE 84 2HD1 ILE 84 -8.729 -1.627 5.094 520 HD13 ILE 84 3HD1 ILE 84 -8.845 -3.353 5.429 521 H ASN 85 H ASN 85 -11.614 -6.279 5.237 522 HA ASN 85 HA ASN 85 -12.088 -8.649 3.656 523 HB2 ASN 85 1HB ASN 85 -12.319 -8.900 6.026 524 HB3 ASN 85 2HB ASN 85 -13.396 -7.513 6.136 525 HD21 ASN 85 1HD2 ASN 85 -16.285 -9.312 5.388 526 HD22 ASN 85 2HD2 ASN 85 -15.553 -7.763 5.639 527 H VAL 86 H VAL 86 -13.169 -8.500 1.821 528 HA VAL 86 HA VAL 86 -15.504 -6.722 1.696 529 HB VAL 86 HB VAL 86 -14.917 -6.369 -0.758 530 HG11 VAL 86 1HG1 VAL 86 -13.036 -5.245 1.313 531 HG12 VAL 86 2HG1 VAL 86 -14.640 -4.622 0.923 532 HG13 VAL 86 3HG1 VAL 86 -13.352 -4.554 -0.279 533 HG21 VAL 86 1HG2 VAL 86 -12.208 -7.318 0.162 534 HG22 VAL 86 2HG2 VAL 86 -12.602 -6.647 -1.420 535 HG23 VAL 86 3HG2 VAL 86 -13.278 -8.198 -0.927 536 H ASN 87 H ASN 87 -16.835 -8.392 2.095 537 HA ASN 87 HA ASN 87 -18.327 -10.019 1.581 538 HB2 ASN 87 1HB ASN 87 -18.354 -9.179 -0.739 539 HB3 ASN 87 2HB ASN 87 -16.960 -10.183 -1.117 540 HD21 ASN 87 1HD2 ASN 87 -18.793 -13.094 -1.605 541 HD22 ASN 87 2HD2 ASN 87 -17.242 -12.336 -1.517 542 H LEU 88 H LEU 88 -14.963 -10.436 1.369 543 HA LEU 88 HA LEU 88 -13.537 -12.071 1.922 544 HB2 LEU 88 1HB LEU 88 -14.925 -12.098 3.972 545 HB3 LEU 88 2HB LEU 88 -15.938 -13.337 3.246 546 HG LEU 88 HG LEU 88 -13.884 -14.780 3.094 547 HD11 LEU 88 1HD1 LEU 88 -12.192 -13.058 3.263 548 HD12 LEU 88 2HD1 LEU 88 -12.015 -14.213 4.584 549 HD13 LEU 88 3HD1 LEU 88 -12.751 -12.638 4.882 550 HD21 LEU 88 1HD2 LEU 88 -13.958 -15.421 5.458 551 HD22 LEU 88 2HD2 LEU 88 -15.571 -15.114 4.815 552 HD23 LEU 88 3HD2 LEU 88 -14.785 -13.911 5.836 Start of MODEL 15 1 H1 GLY 1 1H GLY 1 -12.462 8.722 7.612 2 H2 GLY 1 2H GLY 1 -13.566 9.376 8.716 3 H3 GLY 1 3H GLY 1 -11.904 9.563 8.971 4 HA2 GLY 1 1HA GLY 1 -12.884 11.607 8.148 5 HA3 GLY 1 2HA GLY 1 -11.705 10.944 7.025 6 H SER 2 H SER 2 -12.778 12.206 5.385 7 HA SER 2 HA SER 2 -15.534 11.662 4.771 8 HB2 SER 2 1HB SER 2 -13.462 13.202 3.190 9 HB3 SER 2 2HB SER 2 -15.209 13.237 2.933 10 HG SER 2 HG SER 2 -14.748 13.765 5.494 11 H GLY 3 H GLY 3 -15.679 9.480 4.275 12 HA2 GLY 3 1HA GLY 3 -16.082 8.135 2.328 13 HA3 GLY 3 2HA GLY 3 -14.654 8.841 1.593 14 H SER 4 H SER 4 -14.601 7.728 4.903 15 HA SER 4 HA SER 4 -13.147 5.334 4.032 16 HB2 SER 4 1HB SER 4 -11.624 5.808 6.079 17 HB3 SER 4 2HB SER 4 -11.359 6.727 4.598 18 HG SER 4 HG SER 4 -11.888 8.485 5.603 19 H SER 5 H SER 5 -15.269 4.374 4.504 20 HA SER 5 HA SER 5 -16.311 4.220 7.116 21 HB2 SER 5 1HB SER 5 -16.479 2.169 4.892 22 HB3 SER 5 2HB SER 5 -17.530 2.253 6.305 23 HG SER 5 HG SER 5 -17.814 4.576 5.399 24 H GLN 6 H GLN 6 -14.096 2.102 5.344 25 HA GLN 6 HA GLN 6 -13.432 0.665 7.784 26 HB2 GLN 6 1HB GLN 6 -12.623 0.322 4.901 27 HB3 GLN 6 2HB GLN 6 -11.847 -0.569 6.195 28 HG2 GLN 6 1HG GLN 6 -14.798 -0.641 5.666 29 HG3 GLN 6 2HG GLN 6 -13.636 -1.778 4.986 30 HE21 GLN 6 1HE2 GLN 6 -14.805 -2.068 8.861 31 HE22 GLN 6 2HE2 GLN 6 -15.238 -0.710 7.880 32 H CYS 7 H CYS 7 -11.024 0.289 8.122 33 HA CYS 7 HA CYS 7 -8.878 0.875 8.352 34 HB2 CYS 7 2HB CYS 7 -9.486 3.070 6.405 35 HB3 CYS 7 1HB CYS 7 -7.888 2.465 6.848 36 H ASN 8 H ASN 8 -8.548 1.514 10.338 37 HA ASN 8 HA ASN 8 -9.470 4.120 11.252 38 HB2 ASN 8 1HB ASN 8 -8.007 1.915 12.724 39 HB3 ASN 8 2HB ASN 8 -8.614 3.393 13.460 40 HD21 ASN 8 1HD2 ASN 8 -11.933 2.317 13.645 41 HD22 ASN 8 2HD2 ASN 8 -10.837 3.654 13.738 42 H ALA 9 H ALA 9 -6.614 2.602 10.066 43 HA ALA 9 HA ALA 9 -4.801 4.539 11.243 44 HB1 ALA 9 1HB ALA 9 -4.273 2.312 9.279 45 HB2 ALA 9 2HB ALA 9 -4.074 2.223 11.028 46 HB3 ALA 9 3HB ALA 9 -3.042 3.290 10.076 47 H GLY 10 H GLY 10 -6.848 4.586 8.667 48 HA2 GLY 10 1HA GLY 10 -6.040 6.990 7.608 49 HA3 GLY 10 2HA GLY 10 -5.195 5.769 6.666 50 HA PRO 11 HA PRO 11 -9.396 6.125 4.801 51 HB2 PRO 11 2HB PRO 11 -8.707 6.904 2.341 52 HB3 PRO 11 1HB PRO 11 -8.796 8.065 3.671 53 HG2 PRO 11 2HG PRO 11 -6.402 6.748 2.460 54 HG3 PRO 11 1HG PRO 11 -6.609 8.433 2.972 55 HD2 PRO 11 2HD PRO 11 -5.350 6.480 4.467 56 HD3 PRO 11 1HD PRO 11 -6.077 7.952 5.142 57 H VAL 12 H VAL 12 -10.264 4.891 2.987 58 HA VAL 12 HA VAL 12 -9.130 2.270 2.870 59 HB VAL 12 HB VAL 12 -11.062 1.878 1.221 60 HG11 VAL 12 1HG1 VAL 12 -11.119 1.206 3.559 61 HG12 VAL 12 2HG1 VAL 12 -12.699 1.793 3.036 62 HG13 VAL 12 3HG1 VAL 12 -11.656 2.822 4.021 63 HG21 VAL 12 1HG2 VAL 12 -11.344 4.289 0.636 64 HG22 VAL 12 2HG2 VAL 12 -11.942 4.572 2.272 65 HG23 VAL 12 3HG2 VAL 12 -12.831 3.512 1.180 66 H GLN 13 H GLN 13 -7.787 1.456 1.388 67 HA GLN 13 HA GLN 13 -7.364 3.040 -1.066 68 HB2 GLN 13 1HB GLN 13 -5.389 1.132 0.198 69 HB3 GLN 13 2HB GLN 13 -5.099 2.222 -1.143 70 HG2 GLN 13 1HG GLN 13 -5.639 3.016 1.705 71 HG3 GLN 13 2HG GLN 13 -4.083 3.041 0.886 72 HE21 GLN 13 1HE2 GLN 13 -6.696 6.082 0.475 73 HE22 GLN 13 2HE2 GLN 13 -7.066 4.658 1.381 74 H CYS 14 H CYS 14 -7.147 1.973 -3.035 75 HA CYS 14 HA CYS 14 -7.830 -0.893 -3.047 76 HB2 CYS 14 2HB CYS 14 -9.712 0.459 -3.865 77 HB3 CYS 14 1HB CYS 14 -8.666 1.222 -5.052 78 H CYS 15 H CYS 15 -5.936 -1.834 -3.371 79 HA CYS 15 HA CYS 15 -3.914 -0.556 -5.056 80 HB2 CYS 15 2HB CYS 15 -3.700 -2.996 -3.279 81 HB3 CYS 15 1HB CYS 15 -2.366 -2.161 -4.056 82 H ASN 16 H ASN 16 -2.874 -1.609 -6.737 83 HA ASN 16 HA ASN 16 -4.339 -3.503 -8.272 84 HB2 ASN 16 1HB ASN 16 -2.692 -1.812 -9.130 85 HB3 ASN 16 2HB ASN 16 -1.423 -2.819 -8.465 86 HD21 ASN 16 1HD2 ASN 16 -3.224 -3.830 -11.940 87 HD22 ASN 16 2HD2 ASN 16 -3.803 -2.527 -10.962 88 H THR 17 H THR 17 -1.629 -3.652 -6.076 89 HA THR 17 HA THR 17 -1.961 -6.537 -5.815 90 HB THR 17 HB THR 17 0.660 -5.226 -6.587 91 HG1 THR 17 1HG THR 17 -1.275 -6.278 -8.032 92 HG21 THR 17 1HG2 THR 17 1.556 -7.568 -6.515 93 HG22 THR 17 2HG2 THR 17 0.085 -8.040 -5.664 94 HG23 THR 17 3HG2 THR 17 1.190 -6.868 -4.936 95 H LEU 18 H LEU 18 -1.901 -7.087 -3.717 96 HA LEU 18 HA LEU 18 -0.533 -5.281 -1.842 97 HB2 LEU 18 1HB LEU 18 -2.521 -7.506 -1.372 98 HB3 LEU 18 2HB LEU 18 -1.691 -6.654 -0.085 99 HG LEU 18 HG LEU 18 -3.546 -5.387 -2.089 100 HD11 LEU 18 1HD1 LEU 18 -5.120 -5.193 -0.274 101 HD12 LEU 18 2HD1 LEU 18 -3.972 -5.923 0.848 102 HD13 LEU 18 3HD1 LEU 18 -4.666 -6.887 -0.457 103 HD21 LEU 18 1HD2 LEU 18 -1.819 -3.858 -1.336 104 HD22 LEU 18 2HD2 LEU 18 -2.180 -4.252 0.344 105 HD23 LEU 18 3HD2 LEU 18 -3.379 -3.419 -0.645 106 H THR 19 H THR 19 1.498 -5.794 -1.608 107 HA THR 19 HA THR 19 2.234 -8.575 -1.140 108 HB THR 19 HB THR 19 2.578 -8.351 -3.519 109 HG1 THR 19 1HG THR 19 4.225 -9.557 -2.919 110 HG21 THR 19 1HG2 THR 19 4.157 -5.873 -2.857 111 HG22 THR 19 2HG2 THR 19 2.709 -6.001 -3.860 112 HG23 THR 19 3HG2 THR 19 4.233 -6.685 -4.421 113 H SER 20 H SER 20 4.960 -8.291 -0.950 114 HA SER 20 HA SER 20 5.124 -6.587 1.425 115 HB2 SER 20 1HB SER 20 7.126 -7.946 1.967 116 HB3 SER 20 2HB SER 20 5.690 -8.943 1.740 117 HG SER 20 HG SER 20 7.521 -9.796 0.659 118 H ALA 21 H ALA 21 7.251 -5.533 1.823 119 HA ALA 21 HA ALA 21 7.940 -3.866 -0.374 120 HB1 ALA 21 1HB ALA 21 9.528 -2.846 1.168 121 HB2 ALA 21 2HB ALA 21 9.272 -4.165 2.312 122 HB3 ALA 21 3HB ALA 21 7.949 -3.064 1.923 123 H SER 22 H SER 22 8.854 -6.962 0.300 124 HA SER 22 HA SER 22 11.525 -6.789 -0.792 125 HB2 SER 22 1HB SER 22 11.015 -8.466 0.917 126 HB3 SER 22 2HB SER 22 9.806 -9.181 -0.131 127 HG SER 22 HG SER 22 11.631 -9.461 -1.658 128 H ASN 23 H ASN 23 8.481 -6.597 -2.034 129 HA ASN 23 HA ASN 23 8.863 -8.136 -4.439 130 HB2 ASN 23 1HB ASN 23 6.612 -7.559 -3.365 131 HB3 ASN 23 2HB ASN 23 6.832 -5.939 -4.015 132 HD21 ASN 23 1HD2 ASN 23 5.634 -8.976 -6.375 133 HD22 ASN 23 2HD2 ASN 23 6.049 -9.205 -4.710 134 H SER 24 H SER 24 9.444 -7.403 -6.421 135 HA SER 24 HA SER 24 11.236 -5.238 -6.537 136 HB2 SER 24 1HB SER 24 11.349 -7.248 -7.994 137 HB3 SER 24 2HB SER 24 9.909 -6.689 -8.842 138 HG SER 24 HG SER 24 12.520 -5.660 -8.866 139 H GLN 25 H GLN 25 7.823 -5.483 -7.170 140 HA GLN 25 HA GLN 25 7.525 -3.060 -8.614 141 HB2 GLN 25 1HB GLN 25 5.842 -4.899 -8.532 142 HB3 GLN 25 2HB GLN 25 5.536 -4.502 -6.843 143 HG2 GLN 25 1HG GLN 25 3.827 -3.553 -8.188 144 HG3 GLN 25 2HG GLN 25 4.838 -2.268 -7.529 145 HE21 GLN 25 1HE2 GLN 25 4.656 -2.909 -11.531 146 HE22 GLN 25 2HE2 GLN 25 3.992 -4.038 -10.405 147 H ALA 26 H ALA 26 7.208 -3.983 -5.229 148 HA ALA 26 HA ALA 26 6.346 -1.466 -4.283 149 HB1 ALA 26 1HB ALA 26 7.691 -3.734 -2.819 150 HB2 ALA 26 2HB ALA 26 5.955 -3.522 -3.049 151 HB3 ALA 26 3HB ALA 26 6.862 -2.371 -2.068 152 H ALA 27 H ALA 27 9.546 -3.062 -4.081 153 HA ALA 27 HA ALA 27 10.784 -0.941 -2.707 154 HB1 ALA 27 1HB ALA 27 12.037 -3.040 -4.478 155 HB2 ALA 27 2HB ALA 27 11.746 -3.170 -2.742 156 HB3 ALA 27 3HB ALA 27 12.909 -1.992 -3.357 157 H GLY 28 H GLY 28 10.305 -1.485 -6.153 158 HA2 GLY 28 1HA GLY 28 11.989 0.528 -7.135 159 HA3 GLY 28 2HA GLY 28 10.484 0.017 -7.893 160 H LEU 29 H LEU 29 8.609 0.670 -6.152 161 HA LEU 29 HA LEU 29 8.258 3.461 -6.399 162 HB2 LEU 29 1HB LEU 29 6.879 1.454 -4.663 163 HB3 LEU 29 2HB LEU 29 6.290 3.055 -4.977 164 HG LEU 29 HG LEU 29 6.602 0.871 -7.030 165 HD11 LEU 29 1HD1 LEU 29 4.126 1.000 -7.096 166 HD12 LEU 29 2HD1 LEU 29 4.184 2.077 -5.700 167 HD13 LEU 29 3HD1 LEU 29 4.760 0.415 -5.558 168 HD21 LEU 29 1HD2 LEU 29 5.431 2.431 -8.528 169 HD22 LEU 29 2HD2 LEU 29 6.998 3.052 -8.016 170 HD23 LEU 29 3HD2 LEU 29 5.520 3.678 -7.283 171 H ILE 30 H ILE 30 8.881 1.401 -3.576 172 HA ILE 30 HA ILE 30 8.941 3.259 -1.547 173 HB ILE 30 HB ILE 30 10.623 0.792 -1.930 174 HG12 ILE 30 1HG1 ILE 30 8.123 1.305 -0.324 175 HG13 ILE 30 2HG1 ILE 30 8.154 0.533 -1.900 176 HG21 ILE 30 1HG2 ILE 30 11.547 2.479 -0.261 177 HG22 ILE 30 2HG2 ILE 30 11.237 0.851 0.342 178 HG23 ILE 30 3HG2 ILE 30 10.102 2.150 0.699 179 HD11 ILE 30 1HD1 ILE 30 9.386 -1.317 -1.011 180 HD12 ILE 30 2HD1 ILE 30 7.935 -1.041 -0.044 181 HD13 ILE 30 3HD1 ILE 30 9.509 -0.522 0.559 182 H GLN 31 H GLN 31 11.598 2.253 -3.643 183 HA GLN 31 HA GLN 31 13.428 4.033 -2.455 184 HB2 GLN 31 1HB GLN 31 13.472 2.324 -4.908 185 HB3 GLN 31 2HB GLN 31 14.806 3.425 -4.547 186 HG2 GLN 31 1HG GLN 31 14.889 2.251 -2.282 187 HG3 GLN 31 2HG GLN 31 13.838 1.044 -3.015 188 HE21 GLN 31 1HE2 GLN 31 16.320 -0.419 -4.973 189 HE22 GLN 31 2HE2 GLN 31 14.625 -0.233 -4.690 190 H GLN 32 H GLN 32 11.022 4.394 -4.905 191 HA GLN 32 HA GLN 32 12.180 6.738 -6.107 192 HB2 GLN 32 1HB GLN 32 9.385 5.620 -6.085 193 HB3 GLN 32 2HB GLN 32 9.780 7.137 -6.875 194 HG2 GLN 32 1HG GLN 32 11.079 4.510 -7.523 195 HG3 GLN 32 2HG GLN 32 9.677 5.171 -8.362 196 HE21 GLN 32 1HE2 GLN 32 11.478 7.468 -10.254 197 HE22 GLN 32 2HE2 GLN 32 9.931 6.920 -9.717 198 H LEU 33 H LEU 33 10.189 6.060 -3.358 199 HA LEU 33 HA LEU 33 9.595 8.873 -2.901 200 HB2 LEU 33 1HB LEU 33 9.014 6.709 -0.929 201 HB3 LEU 33 2HB LEU 33 8.092 8.155 -1.286 202 HG LEU 33 HG LEU 33 8.285 5.781 -3.136 203 HD11 LEU 33 1HD1 LEU 33 7.199 5.241 -0.983 204 HD12 LEU 33 2HD1 LEU 33 6.133 5.115 -2.377 205 HD13 LEU 33 3HD1 LEU 33 6.018 6.511 -1.305 206 HD21 LEU 33 1HD2 LEU 33 7.691 7.613 -4.445 207 HD22 LEU 33 2HD2 LEU 33 6.695 8.320 -3.169 208 HD23 LEU 33 3HD2 LEU 33 6.141 6.871 -4.018 209 H GLY 34 H GLY 34 11.831 6.447 -1.990 210 HA2 GLY 34 1HA GLY 34 13.791 6.608 -0.780 211 HA3 GLY 34 2HA GLY 34 13.394 8.283 -0.416 212 H LEU 35 H LEU 35 11.514 5.370 0.166 213 HA LEU 35 HA LEU 35 10.844 6.271 2.797 214 HB2 LEU 35 1HB LEU 35 10.103 3.960 1.092 215 HB3 LEU 35 2HB LEU 35 9.702 3.921 2.788 216 HG LEU 35 HG LEU 35 8.767 5.939 0.760 217 HD11 LEU 35 1HD1 LEU 35 7.687 3.769 0.592 218 HD12 LEU 35 2HD1 LEU 35 6.569 4.985 1.213 219 HD13 LEU 35 3HD1 LEU 35 7.303 3.817 2.312 220 HD21 LEU 35 1HD2 LEU 35 9.096 7.064 2.871 221 HD22 LEU 35 2HD2 LEU 35 8.246 5.776 3.725 222 HD23 LEU 35 3HD2 LEU 35 7.371 6.816 2.603 223 H SER 36 H SER 36 12.509 6.194 4.199 224 HA SER 36 HA SER 36 14.089 3.806 4.525 225 HB2 SER 36 1HB SER 36 14.004 6.325 6.200 226 HB3 SER 36 2HB SER 36 15.276 5.113 6.174 227 HG SER 36 HG SER 36 14.904 5.931 3.684 228 H GLY 37 H GLY 37 13.663 2.216 5.972 229 HA2 GLY 37 1HA GLY 37 13.022 1.714 8.299 230 HA3 GLY 37 2HA GLY 37 11.649 2.784 8.062 231 H VAL 38 H VAL 38 11.590 1.517 5.232 232 HA VAL 38 HA VAL 38 9.629 -0.500 5.925 233 HB VAL 38 HB VAL 38 10.575 0.321 3.172 234 HG11 VAL 38 1HG1 VAL 38 8.359 -0.465 2.481 235 HG12 VAL 38 2HG1 VAL 38 8.023 -0.951 4.142 236 HG13 VAL 38 3HG1 VAL 38 9.309 -1.744 3.236 237 HG21 VAL 38 1HG2 VAL 38 8.681 1.879 3.133 238 HG22 VAL 38 2HG2 VAL 38 9.852 2.308 4.379 239 HG23 VAL 38 3HG2 VAL 38 8.346 1.507 4.824 240 H GLY 39 H GLY 39 10.411 -2.444 6.466 241 HA2 GLY 39 1HA GLY 39 12.819 -3.508 5.222 242 HA3 GLY 39 2HA GLY 39 11.929 -4.227 6.556 243 H ALA 40 H ALA 40 12.411 -6.155 5.080 244 HA ALA 40 HA ALA 40 10.983 -6.261 2.591 245 HB1 ALA 40 1HB ALA 40 11.806 -8.618 2.539 246 HB2 ALA 40 2HB ALA 40 12.539 -8.338 4.116 247 HB3 ALA 40 3HB ALA 40 13.072 -7.406 2.719 248 H ASN 41 H ASN 41 10.242 -7.073 5.860 249 HA ASN 41 HA ASN 41 8.082 -8.868 5.030 250 HB2 ASN 41 1HB ASN 41 9.625 -9.423 6.967 251 HB3 ASN 41 2HB ASN 41 8.860 -8.111 7.853 252 HD21 ASN 41 1HD2 ASN 41 6.214 -11.038 6.847 253 HD22 ASN 41 2HD2 ASN 41 7.165 -10.248 5.640 254 H VAL 42 H VAL 42 8.379 -5.762 4.931 255 HA VAL 42 HA VAL 42 6.090 -4.893 6.462 256 HB VAL 42 HB VAL 42 7.823 -3.397 4.493 257 HG11 VAL 42 1HG1 VAL 42 6.893 -1.371 5.662 258 HG12 VAL 42 2HG1 VAL 42 5.644 -2.428 6.338 259 HG13 VAL 42 3HG1 VAL 42 5.764 -2.211 4.591 260 HG21 VAL 42 1HG2 VAL 42 9.125 -4.031 6.336 261 HG22 VAL 42 2HG2 VAL 42 7.827 -3.647 7.474 262 HG23 VAL 42 3HG2 VAL 42 8.660 -2.350 6.616 263 HA PRO 43 HA PRO 43 3.216 -5.736 3.183 264 HB2 PRO 43 2HB PRO 43 1.217 -4.174 4.432 265 HB3 PRO 43 1HB PRO 43 1.413 -5.915 4.526 266 HG2 PRO 43 2HG PRO 43 1.820 -4.008 6.580 267 HG3 PRO 43 1HG PRO 43 2.066 -5.756 6.661 268 HD2 PRO 43 2HD PRO 43 4.012 -3.625 6.483 269 HD3 PRO 43 1HD PRO 43 4.273 -5.338 6.827 270 H VAL 44 H VAL 44 2.762 -4.631 1.322 271 HA VAL 44 HA VAL 44 2.514 -1.718 1.494 272 HB VAL 44 HB VAL 44 3.947 -1.383 -0.472 273 HG11 VAL 44 1HG1 VAL 44 5.301 -2.773 1.834 274 HG12 VAL 44 2HG1 VAL 44 4.931 -1.054 1.709 275 HG13 VAL 44 3HG1 VAL 44 6.122 -1.780 0.629 276 HG21 VAL 44 1HG2 VAL 44 4.400 -4.335 -0.192 277 HG22 VAL 44 2HG2 VAL 44 5.512 -3.281 -1.058 278 HG23 VAL 44 3HG2 VAL 44 3.844 -3.440 -1.609 279 H GLY 45 H GLY 45 1.411 -0.758 -0.231 280 HA2 GLY 45 1HA GLY 45 -0.187 -2.676 -1.795 281 HA3 GLY 45 2HA GLY 45 -0.755 -1.094 -1.300 282 H ILE 46 H ILE 46 0.182 -2.785 -3.814 283 HA ILE 46 HA ILE 46 1.913 -0.909 -5.164 284 HB ILE 46 HB ILE 46 0.670 -3.555 -5.861 285 HG12 ILE 46 1HG1 ILE 46 2.864 -4.417 -5.901 286 HG13 ILE 46 2HG1 ILE 46 3.573 -2.834 -6.075 287 HG21 ILE 46 1HG2 ILE 46 0.497 -2.200 -7.869 288 HG22 ILE 46 2HG2 ILE 46 1.702 -3.471 -8.066 289 HG23 ILE 46 3HG2 ILE 46 2.213 -1.810 -7.767 290 HD11 ILE 46 1HD1 ILE 46 4.033 -3.793 -3.918 291 HD12 ILE 46 2HD1 ILE 46 2.301 -3.900 -3.588 292 HD13 ILE 46 3HD1 ILE 46 3.072 -2.321 -3.771 293 H ASN 47 H ASN 47 1.166 0.777 -6.286 294 HA ASN 47 HA ASN 47 -0.141 2.131 -7.574 295 HB2 ASN 47 1HB ASN 47 0.009 -0.178 -8.922 296 HB3 ASN 47 2HB ASN 47 -1.716 -0.177 -8.604 297 HD21 ASN 47 1HD2 ASN 47 -0.810 1.561 -11.830 298 HD22 ASN 47 2HD2 ASN 47 -0.293 0.065 -11.127 299 H CYS 48 H CYS 48 -1.027 2.277 -5.126 300 HA CYS 48 HA CYS 48 -3.832 1.448 -5.070 301 HB2 CYS 48 2HB CYS 48 -1.880 1.307 -3.126 302 HB3 CYS 48 1HB CYS 48 -2.812 2.717 -2.663 303 H ASN 49 H ASN 49 -5.462 2.793 -5.127 304 HA ASN 49 HA ASN 49 -4.999 5.643 -4.561 305 HB2 ASN 49 1HB ASN 49 -6.852 6.164 -6.142 306 HB3 ASN 49 2HB ASN 49 -5.448 5.467 -6.932 307 HD21 ASN 49 1HD2 ASN 49 -7.115 2.657 -8.119 308 HD22 ASN 49 2HD2 ASN 49 -5.609 3.474 -7.896 309 HA PRO 50 HA PRO 50 -7.960 5.176 -1.402 310 HB2 PRO 50 2HB PRO 50 -8.887 7.915 -1.845 311 HB3 PRO 50 1HB PRO 50 -7.949 7.262 -0.499 312 HG2 PRO 50 2HG PRO 50 -6.881 8.953 -2.317 313 HG3 PRO 50 1HG PRO 50 -5.933 7.683 -1.526 314 HD2 PRO 50 2HD PRO 50 -7.165 7.701 -4.259 315 HD3 PRO 50 1HD PRO 50 -5.557 7.146 -3.759 316 H ILE 51 H ILE 51 -9.908 4.272 -1.363 317 HA ILE 51 HA ILE 51 -11.671 4.535 -3.642 318 HB ILE 51 HB ILE 51 -12.477 3.109 -1.142 319 HG12 ILE 51 1HG1 ILE 51 -10.478 2.071 -3.163 320 HG13 ILE 51 2HG1 ILE 51 -10.143 2.440 -1.476 321 HG21 ILE 51 1HG2 ILE 51 -13.522 1.593 -2.742 322 HG22 ILE 51 2HG2 ILE 51 -12.789 2.480 -4.078 323 HG23 ILE 51 3HG2 ILE 51 -14.002 3.260 -3.061 324 HD11 ILE 51 1HD1 ILE 51 -12.002 0.303 -2.473 325 HD12 ILE 51 2HD1 ILE 51 -11.676 0.679 -0.782 326 HD13 ILE 51 3HD1 ILE 51 -10.387 0.056 -1.811 327 H THR 52 H THR 52 -12.269 6.743 -3.453 328 HA THR 52 HA THR 52 -13.983 7.301 -1.130 329 HB THR 52 HB THR 52 -13.570 9.734 -1.718 330 HG1 THR 52 1HG THR 52 -12.730 9.253 -3.872 331 HG21 THR 52 1HG2 THR 52 -11.313 9.728 -0.666 332 HG22 THR 52 2HG2 THR 52 -11.254 7.976 -0.885 333 HG23 THR 52 3HG2 THR 52 -12.472 8.692 0.171 334 H GLY 53 H GLY 53 -14.548 5.992 -3.768 335 HA2 GLY 53 1HA GLY 53 -16.515 7.815 -4.915 336 HA3 GLY 53 2HA GLY 53 -16.077 6.229 -5.536 337 H ILE 54 H ILE 54 -17.451 7.643 -2.595 338 HA ILE 54 HA ILE 54 -18.900 5.472 -1.684 339 HB ILE 54 HB ILE 54 -19.711 8.381 -1.496 340 HG12 ILE 54 1HG1 ILE 54 -17.418 7.957 -0.658 341 HG13 ILE 54 2HG1 ILE 54 -18.525 8.430 0.626 342 HG21 ILE 54 1HG2 ILE 54 -21.525 6.862 -0.927 343 HG22 ILE 54 2HG2 ILE 54 -20.937 7.704 0.508 344 HG23 ILE 54 3HG2 ILE 54 -20.480 6.025 0.220 345 HD11 ILE 54 1HD1 ILE 54 -17.609 5.629 0.023 346 HD12 ILE 54 2HD1 ILE 54 -18.724 6.096 1.307 347 HD13 ILE 54 3HD1 ILE 54 -17.051 6.649 1.347 348 H GLY 55 H GLY 55 -20.391 4.318 -2.715 349 HA2 GLY 55 1HA GLY 55 -22.760 4.450 -3.473 350 HA3 GLY 55 2HA GLY 55 -22.225 5.739 -4.542 351 H ALA 56 H ALA 56 -21.319 2.416 -3.720 352 HA ALA 56 HA ALA 56 -21.350 1.744 -6.573 353 HB1 ALA 56 1HB ALA 56 -19.266 0.474 -6.311 354 HB2 ALA 56 2HB ALA 56 -19.134 1.040 -4.645 355 HB3 ALA 56 3HB ALA 56 -19.024 2.189 -5.978 356 H GLY 57 H GLY 57 -23.484 1.074 -5.434 357 HA2 GLY 57 1HA GLY 57 -24.650 -1.007 -5.298 358 HA3 GLY 57 2HA GLY 57 -23.192 -1.742 -4.639 359 H SER 58 H SER 58 -23.058 -1.978 -2.498 360 HA SER 58 HA SER 58 -25.137 -0.784 -0.843 361 HB2 SER 58 1HB SER 58 -22.967 -2.748 -0.064 362 HB3 SER 58 2HB SER 58 -24.401 -2.333 0.875 363 HG SER 58 HG SER 58 -25.279 -3.078 -1.478 364 H GLY 59 H GLY 59 -21.670 -0.662 -1.340 365 HA2 GLY 59 1HA GLY 59 -21.541 1.793 0.230 366 HA3 GLY 59 2HA GLY 59 -20.521 0.463 0.761 367 H SER 60 H SER 60 -18.496 0.939 0.201 368 HA SER 60 HA SER 60 -18.010 1.894 -2.546 369 HB2 SER 60 1HB SER 60 -16.057 2.024 -0.238 370 HB3 SER 60 2HB SER 60 -15.984 2.896 -1.772 371 HG SER 60 HG SER 60 -17.872 3.263 0.315 372 H SER 61 H SER 61 -16.669 0.686 -3.887 373 HA SER 61 HA SER 61 -15.753 -1.873 -2.749 374 HB2 SER 61 1HB SER 61 -16.340 -2.896 -4.973 375 HB3 SER 61 2HB SER 61 -17.723 -2.346 -4.029 376 HG SER 61 HG SER 61 -16.590 -1.238 -6.353 377 H CYS 62 H CYS 62 -13.930 -2.832 -3.662 378 HA CYS 62 HA CYS 62 -12.217 -1.008 -5.207 379 HB2 CYS 62 2HB CYS 62 -11.197 -1.531 -3.109 380 HB3 CYS 62 1HB CYS 62 -11.565 -3.243 -3.285 381 H ASN 63 H ASN 63 -11.447 -1.614 -7.133 382 HA ASN 63 HA ASN 63 -12.710 -3.813 -8.454 383 HB2 ASN 63 1HB ASN 63 -12.368 -1.736 -9.648 384 HB3 ASN 63 2HB ASN 63 -10.631 -1.822 -9.375 385 HD21 ASN 63 1HD2 ASN 63 -9.978 -3.811 -12.124 386 HD22 ASN 63 2HD2 ASN 63 -9.385 -2.948 -10.747 387 H ALA 64 H ALA 64 -9.659 -3.324 -6.904 388 HA ALA 64 HA ALA 64 -8.749 -5.898 -7.993 389 HB1 ALA 64 1HB ALA 64 -6.982 -3.606 -7.159 390 HB2 ALA 64 2HB ALA 64 -7.414 -4.006 -8.821 391 HB3 ALA 64 3HB ALA 64 -6.464 -5.141 -7.859 392 H ASN 65 H ASN 65 -6.998 -4.221 -5.471 393 HA ASN 65 HA ASN 65 -8.017 -6.189 -3.525 394 HB2 ASN 65 1HB ASN 65 -5.160 -5.265 -3.776 395 HB3 ASN 65 2HB ASN 65 -5.771 -6.416 -2.603 396 HD21 ASN 65 1HD2 ASN 65 -4.931 -7.542 -6.404 397 HD22 ASN 65 2HD2 ASN 65 -4.929 -5.883 -5.928 398 HA PRO 66 HA PRO 66 -8.638 -2.341 -1.333 399 HB2 PRO 66 2HB PRO 66 -10.340 -3.309 0.490 400 HB3 PRO 66 1HB PRO 66 -10.822 -3.107 -1.196 401 HG2 PRO 66 2HG PRO 66 -10.019 -5.590 0.261 402 HG3 PRO 66 1HG PRO 66 -11.302 -5.368 -0.942 403 HD2 PRO 66 2HD PRO 66 -8.779 -6.404 -1.472 404 HD3 PRO 66 1HD PRO 66 -9.855 -5.688 -2.685 405 H ALA 67 H ALA 67 -7.511 -1.430 0.340 406 HA ALA 67 HA ALA 67 -6.579 -3.099 2.537 407 HB1 ALA 67 1HB ALA 67 -4.874 -3.396 0.795 408 HB2 ALA 67 2HB ALA 67 -4.238 -2.573 2.218 409 HB3 ALA 67 3HB ALA 67 -4.623 -1.651 0.765 410 H CYS 68 H CYS 68 -6.063 -1.992 4.375 411 HA CYS 68 HA CYS 68 -6.232 0.936 4.346 412 HB2 CYS 68 2HB CYS 68 -5.817 -0.864 6.739 413 HB3 CYS 68 1HB CYS 68 -6.299 0.823 6.744 414 H CYS 69 H CYS 69 -4.382 2.082 4.184 415 HA CYS 69 HA CYS 69 -1.903 0.695 4.915 416 HB2 CYS 69 2HB CYS 69 -2.182 2.989 2.982 417 HB3 CYS 69 1HB CYS 69 -0.779 1.983 3.267 418 H ASP 70 H ASP 70 -0.343 1.786 6.059 419 HA ASP 70 HA ASP 70 -1.213 3.711 7.944 420 HB2 ASP 70 1HB ASP 70 0.614 2.071 8.354 421 HB3 ASP 70 2HB ASP 70 1.607 2.921 7.183 422 H ASN 71 H ASN 71 0.931 3.909 5.134 423 HA ASN 71 HA ASN 71 0.039 6.634 4.630 424 HB2 ASN 71 1HB ASN 71 2.977 5.919 4.858 425 HB3 ASN 71 2HB ASN 71 2.363 7.424 4.187 426 HD21 ASN 71 1HD2 ASN 71 2.744 6.905 8.155 427 HD22 ASN 71 2HD2 ASN 71 3.117 5.663 7.013 428 H VAL 72 H VAL 72 -0.321 6.884 2.478 429 HA VAL 72 HA VAL 72 1.229 5.196 0.669 430 HB VAL 72 HB VAL 72 -0.566 3.887 0.367 431 HG11 VAL 72 1HG1 VAL 72 -2.281 6.140 1.348 432 HG12 VAL 72 2HG1 VAL 72 -1.794 4.680 2.214 433 HG13 VAL 72 3HG1 VAL 72 -2.895 4.566 0.843 434 HG21 VAL 72 1HG2 VAL 72 -1.654 6.230 -1.184 435 HG22 VAL 72 2HG2 VAL 72 -2.020 4.521 -1.442 436 HG23 VAL 72 3HG2 VAL 72 -0.396 5.136 -1.759 437 H TYR 73 H TYR 73 1.785 6.047 -1.220 438 HA TYR 73 HA TYR 73 1.603 8.973 -1.221 439 HB2 TYR 73 2HB TYR 73 3.726 7.092 -2.274 440 HB3 TYR 73 1HB TYR 73 3.821 8.850 -2.325 441 HD1 TYR 73 1HD TYR 73 3.818 5.906 -0.091 442 HD2 TYR 73 2HD TYR 73 4.373 10.115 -0.366 443 HE1 TYR 73 1HE TYR 73 4.736 5.921 2.195 444 HE2 TYR 73 2HE TYR 73 5.291 10.145 1.912 445 HH TYR 73 HH TYR 73 6.052 7.244 3.644 446 H THR 74 H THR 74 1.925 9.986 -3.419 447 HA THR 74 HA THR 74 -0.374 9.170 -4.889 448 HB THR 74 HB THR 74 0.329 11.170 -6.371 449 HG1 THR 74 1HG THR 74 2.409 11.556 -5.834 450 HG21 THR 74 1HG2 THR 74 -0.536 12.756 -4.703 451 HG22 THR 74 2HG2 THR 74 -0.292 11.551 -3.438 452 HG23 THR 74 3HG2 THR 74 -1.469 11.260 -4.719 453 H ASN 75 H ASN 75 2.875 8.295 -5.208 454 HA ASN 75 HA ASN 75 2.792 7.695 -8.016 455 HB2 ASN 75 1HB ASN 75 4.754 6.320 -7.610 456 HB3 ASN 75 2HB ASN 75 4.935 7.837 -6.739 457 HD21 ASN 75 1HD2 ASN 75 5.787 4.809 -4.656 458 HD22 ASN 75 2HD2 ASN 75 6.164 5.210 -6.294 459 H GLY 76 H GLY 76 1.457 6.445 -5.186 460 HA2 GLY 76 1HA GLY 76 -0.401 4.957 -5.332 461 HA3 GLY 76 2HA GLY 76 0.407 4.136 -6.661 462 H LEU 77 H LEU 77 2.510 4.964 -4.057 463 HA LEU 77 HA LEU 77 2.612 2.114 -3.382 464 HB2 LEU 77 1HB LEU 77 4.662 3.298 -4.095 465 HB3 LEU 77 2HB LEU 77 4.507 4.359 -2.719 466 HG LEU 77 HG LEU 77 6.216 2.439 -2.591 467 HD11 LEU 77 1HD1 LEU 77 5.807 2.062 -0.215 468 HD12 LEU 77 2HD1 LEU 77 4.187 2.751 -0.390 469 HD13 LEU 77 3HD1 LEU 77 5.608 3.762 -0.652 470 HD21 LEU 77 1HD2 LEU 77 3.716 0.874 -1.989 471 HD22 LEU 77 2HD2 LEU 77 5.384 0.303 -1.859 472 HD23 LEU 77 3HD2 LEU 77 4.708 0.699 -3.439 473 H GLY 78 H GLY 78 1.561 1.444 -1.654 474 HA2 GLY 78 1HA GLY 78 1.212 3.329 0.581 475 HA3 GLY 78 2HA GLY 78 0.189 1.937 0.279 476 H VAL 79 H VAL 79 1.963 2.893 2.561 477 HA VAL 79 HA VAL 79 3.627 0.487 2.848 478 HB VAL 79 HB VAL 79 4.615 2.852 3.135 479 HG11 VAL 79 1HG1 VAL 79 2.846 3.812 4.489 480 HG12 VAL 79 2HG1 VAL 79 4.396 3.874 5.329 481 HG13 VAL 79 3HG1 VAL 79 3.196 2.661 5.779 482 HG21 VAL 79 1HG2 VAL 79 6.091 2.146 4.935 483 HG22 VAL 79 2HG2 VAL 79 5.794 0.838 3.789 484 HG23 VAL 79 3HG2 VAL 79 4.972 0.848 5.350 485 H GLN 80 H GLN 80 3.303 -0.910 4.493 486 HA GLN 80 HA GLN 80 2.148 -2.136 5.986 487 HB2 GLN 80 1HB GLN 80 1.696 0.631 7.083 488 HB3 GLN 80 2HB GLN 80 1.080 -0.802 7.897 489 HG2 GLN 80 1HG GLN 80 3.948 -0.510 7.141 490 HG3 GLN 80 2HG GLN 80 3.323 0.119 8.665 491 HE21 GLN 80 1HE2 GLN 80 4.669 -3.399 8.962 492 HE22 GLN 80 2HE2 GLN 80 5.286 -1.977 8.198 493 H CYS 81 H CYS 81 0.886 -2.155 3.791 494 HA CYS 81 HA CYS 81 -1.846 -1.200 4.094 495 HB2 CYS 81 2HB CYS 81 -0.485 -2.615 1.800 496 HB3 CYS 81 1HB CYS 81 -2.170 -2.120 1.799 497 H ASN 82 H ASN 82 -3.201 -2.355 5.197 498 HA ASN 82 HA ASN 82 -2.934 -5.286 5.097 499 HB2 ASN 82 1HB ASN 82 -4.433 -5.267 7.141 500 HB3 ASN 82 2HB ASN 82 -2.806 -4.647 7.352 501 HD21 ASN 82 1HD2 ASN 82 -3.817 -1.427 8.234 502 HD22 ASN 82 2HD2 ASN 82 -2.510 -2.468 7.791 503 HA PRO 83 HA PRO 83 -6.290 -5.538 2.283 504 HB2 PRO 83 2HB PRO 83 -6.617 -8.198 3.562 505 HB3 PRO 83 1HB PRO 83 -6.432 -7.783 1.857 506 HG2 PRO 83 2HG PRO 83 -4.422 -8.852 3.261 507 HG3 PRO 83 1HG PRO 83 -4.136 -7.641 2.001 508 HD2 PRO 83 2HD PRO 83 -4.038 -7.357 4.962 509 HD3 PRO 83 1HD PRO 83 -3.109 -6.516 3.708 510 H ILE 84 H ILE 84 -8.406 -5.151 2.309 511 HA ILE 84 HA ILE 84 -9.767 -4.768 4.817 512 HB ILE 84 HB ILE 84 -10.802 -4.511 1.999 513 HG12 ILE 84 1HG1 ILE 84 -8.849 -3.047 2.650 514 HG13 ILE 84 2HG1 ILE 84 -10.291 -2.194 2.134 515 HG21 ILE 84 1HG2 ILE 84 -12.616 -4.759 3.607 516 HG22 ILE 84 2HG2 ILE 84 -12.566 -3.117 2.961 517 HG23 ILE 84 3HG2 ILE 84 -11.941 -3.447 4.576 518 HD11 ILE 84 1HD1 ILE 84 -10.891 -1.791 4.445 519 HD12 ILE 84 2HD1 ILE 84 -9.299 -1.140 4.054 520 HD13 ILE 84 3HD1 ILE 84 -9.439 -2.645 4.962 521 H ASN 85 H ASN 85 -11.595 -5.834 5.519 522 HA ASN 85 HA ASN 85 -11.887 -8.592 4.788 523 HB2 ASN 85 1HB ASN 85 -12.237 -7.715 7.114 524 HB3 ASN 85 2HB ASN 85 -13.681 -6.898 6.542 525 HD21 ASN 85 1HD2 ASN 85 -14.425 -10.225 8.124 526 HD22 ASN 85 2HD2 ASN 85 -13.414 -8.900 8.592 527 H VAL 86 H VAL 86 -12.597 -8.832 2.764 528 HA VAL 86 HA VAL 86 -15.196 -7.664 2.064 529 HB VAL 86 HB VAL 86 -14.288 -7.662 -0.355 530 HG11 VAL 86 1HG1 VAL 86 -14.772 -5.625 0.891 531 HG12 VAL 86 2HG1 VAL 86 -13.315 -5.429 -0.081 532 HG13 VAL 86 3HG1 VAL 86 -13.185 -5.703 1.655 533 HG21 VAL 86 1HG2 VAL 86 -11.871 -7.363 -0.577 534 HG22 VAL 86 2HG2 VAL 86 -12.253 -8.953 0.085 535 HG23 VAL 86 3HG2 VAL 86 -11.670 -7.671 1.150 536 H ASN 87 H ASN 87 -16.239 -9.510 2.615 537 HA ASN 87 HA ASN 87 -16.952 -11.672 2.615 538 HB2 ASN 87 1HB ASN 87 -17.311 -11.099 0.165 539 HB3 ASN 87 2HB ASN 87 -15.757 -11.855 -0.165 540 HD21 ASN 87 1HD2 ASN 87 -17.526 -14.776 -0.789 541 HD22 ASN 87 2HD2 ASN 87 -16.540 -13.499 -1.406 542 H LEU 88 H LEU 88 -15.025 -11.619 4.170 543 HA LEU 88 HA LEU 88 -12.468 -12.402 3.505 544 HB2 LEU 88 1HB LEU 88 -12.032 -12.733 5.795 545 HB3 LEU 88 2HB LEU 88 -13.214 -11.442 5.705 546 HG LEU 88 HG LEU 88 -13.989 -14.298 6.303 547 HD11 LEU 88 1HD1 LEU 88 -12.365 -13.583 7.972 548 HD12 LEU 88 2HD1 LEU 88 -13.982 -13.680 8.666 549 HD13 LEU 88 3HD1 LEU 88 -13.293 -12.112 8.256 550 HD21 LEU 88 1HD2 LEU 88 -15.345 -11.650 6.807 551 HD22 LEU 88 2HD2 LEU 88 -15.951 -13.226 7.317 552 HD23 LEU 88 3HD2 LEU 88 -15.807 -12.850 5.601 Start of MODEL 16 1 H1 GLY 1 1H GLY 1 -19.864 5.544 7.768 2 H2 GLY 1 2H GLY 1 -18.779 5.642 6.475 3 H3 GLY 1 3H GLY 1 -20.435 5.468 6.179 4 HA2 GLY 1 1HA GLY 1 -20.867 7.634 7.159 5 HA3 GLY 1 2HA GLY 1 -19.141 7.820 7.437 6 H SER 2 H SER 2 -17.758 8.176 5.662 7 HA SER 2 HA SER 2 -19.112 8.703 3.111 8 HB2 SER 2 1HB SER 2 -18.771 10.832 4.357 9 HB3 SER 2 2HB SER 2 -17.039 10.514 4.368 10 HG SER 2 HG SER 2 -18.394 11.747 2.511 11 H GLY 3 H GLY 3 -18.251 6.645 2.492 12 HA2 GLY 3 1HA GLY 3 -16.795 5.654 0.975 13 HA3 GLY 3 2HA GLY 3 -15.681 6.990 1.209 14 H SER 4 H SER 4 -14.671 7.031 3.463 15 HA SER 4 HA SER 4 -13.380 4.452 3.713 16 HB2 SER 4 1HB SER 4 -12.743 7.120 4.985 17 HB3 SER 4 2HB SER 4 -11.749 5.669 5.118 18 HG SER 4 HG SER 4 -12.104 7.398 2.973 19 H SER 5 H SER 5 -15.615 3.739 4.624 20 HA SER 5 HA SER 5 -16.006 4.170 7.427 21 HB2 SER 5 1HB SER 5 -16.961 1.906 5.656 22 HB3 SER 5 2HB SER 5 -17.560 2.271 7.274 23 HG SER 5 HG SER 5 -18.967 3.216 5.870 24 H GLN 6 H GLN 6 -14.010 2.195 5.483 25 HA GLN 6 HA GLN 6 -13.260 0.497 7.736 26 HB2 GLN 6 1HB GLN 6 -12.604 0.301 4.798 27 HB3 GLN 6 2HB GLN 6 -12.014 -0.811 6.020 28 HG2 GLN 6 1HG GLN 6 -14.904 -0.352 5.334 29 HG3 GLN 6 2HG GLN 6 -13.914 -1.702 4.784 30 HE21 GLN 6 1HE2 GLN 6 -15.959 -2.503 7.862 31 HE22 GLN 6 2HE2 GLN 6 -16.356 -1.684 6.391 32 H CYS 7 H CYS 7 -10.845 -0.016 7.758 33 HA CYS 7 HA CYS 7 -8.674 0.531 7.940 34 HB2 CYS 7 2HB CYS 7 -8.745 1.347 5.656 35 HB3 CYS 7 1HB CYS 7 -9.393 2.885 6.211 36 H ASN 8 H ASN 8 -8.107 1.011 9.904 37 HA ASN 8 HA ASN 8 -9.240 3.314 11.271 38 HB2 ASN 8 1HB ASN 8 -9.094 1.092 12.377 39 HB3 ASN 8 2HB ASN 8 -7.341 1.185 12.284 40 HD21 ASN 8 1HD2 ASN 8 -7.479 2.393 15.531 41 HD22 ASN 8 2HD2 ASN 8 -7.064 1.091 14.472 42 H ALA 9 H ALA 9 -6.498 2.599 9.441 43 HA ALA 9 HA ALA 9 -4.761 4.475 10.850 44 HB1 ALA 9 1HB ALA 9 -4.193 2.746 8.446 45 HB2 ALA 9 2HB ALA 9 -3.798 2.354 10.119 46 HB3 ALA 9 3HB ALA 9 -3.015 3.719 9.324 47 H GLY 10 H GLY 10 -7.156 4.759 8.647 48 HA2 GLY 10 1HA GLY 10 -6.980 7.363 8.077 49 HA3 GLY 10 2HA GLY 10 -5.854 6.686 6.909 50 HA PRO 11 HA PRO 11 -9.805 6.331 4.736 51 HB2 PRO 11 2HB PRO 11 -8.951 7.083 2.326 52 HB3 PRO 11 1HB PRO 11 -9.184 8.269 3.616 53 HG2 PRO 11 2HG PRO 11 -6.671 7.069 2.571 54 HG3 PRO 11 1HG PRO 11 -6.974 8.720 3.139 55 HD2 PRO 11 2HD PRO 11 -5.783 6.661 4.624 56 HD3 PRO 11 1HD PRO 11 -6.433 8.174 5.280 57 H VAL 12 H VAL 12 -10.471 5.013 2.903 58 HA VAL 12 HA VAL 12 -9.161 2.455 2.958 59 HB VAL 12 HB VAL 12 -10.997 1.833 1.291 60 HG11 VAL 12 1HG1 VAL 12 -11.781 2.885 4.005 61 HG12 VAL 12 2HG1 VAL 12 -11.109 1.291 3.659 62 HG13 VAL 12 3HG1 VAL 12 -12.702 1.730 3.041 63 HG21 VAL 12 1HG2 VAL 12 -11.457 4.123 0.506 64 HG22 VAL 12 2HG2 VAL 12 -12.057 4.540 2.109 65 HG23 VAL 12 3HG2 VAL 12 -12.901 3.335 1.139 66 H GLN 13 H GLN 13 -7.874 1.557 1.463 67 HA GLN 13 HA GLN 13 -7.357 3.136 -0.971 68 HB2 GLN 13 1HB GLN 13 -5.446 1.218 0.370 69 HB3 GLN 13 2HB GLN 13 -5.098 2.328 -0.944 70 HG2 GLN 13 1HG GLN 13 -5.869 3.143 1.840 71 HG3 GLN 13 2HG GLN 13 -4.225 3.091 1.208 72 HE21 GLN 13 1HE2 GLN 13 -5.832 6.513 0.946 73 HE22 GLN 13 2HE2 GLN 13 -5.844 5.336 2.215 74 H CYS 14 H CYS 14 -7.031 2.030 -2.914 75 HA CYS 14 HA CYS 14 -7.685 -0.835 -2.897 76 HB2 CYS 14 2HB CYS 14 -9.556 0.420 -3.845 77 HB3 CYS 14 1HB CYS 14 -8.476 1.208 -4.988 78 H CYS 15 H CYS 15 -5.798 -1.755 -3.114 79 HA CYS 15 HA CYS 15 -3.748 -0.587 -4.829 80 HB2 CYS 15 2HB CYS 15 -3.694 -2.939 -2.917 81 HB3 CYS 15 1HB CYS 15 -2.307 -2.370 -3.834 82 H ASN 16 H ASN 16 -2.844 -1.660 -6.563 83 HA ASN 16 HA ASN 16 -4.431 -3.545 -7.977 84 HB2 ASN 16 1HB ASN 16 -2.778 -1.872 -8.936 85 HB3 ASN 16 2HB ASN 16 -1.517 -2.978 -8.412 86 HD21 ASN 16 1HD2 ASN 16 -2.002 -5.296 -10.967 87 HD22 ASN 16 2HD2 ASN 16 -1.272 -4.961 -9.437 88 H THR 17 H THR 17 -1.522 -3.736 -6.022 89 HA THR 17 HA THR 17 -1.901 -6.628 -5.744 90 HB THR 17 HB THR 17 0.763 -5.325 -6.385 91 HG1 THR 17 1HG THR 17 -0.876 -7.080 -7.935 92 HG21 THR 17 1HG2 THR 17 1.167 -7.161 -4.929 93 HG22 THR 17 2HG2 THR 17 1.525 -7.713 -6.569 94 HG23 THR 17 3HG2 THR 17 0.011 -8.180 -5.793 95 H LEU 18 H LEU 18 -1.970 -7.107 -3.621 96 HA LEU 18 HA LEU 18 -0.552 -5.361 -1.732 97 HB2 LEU 18 1HB LEU 18 -2.637 -7.500 -1.307 98 HB3 LEU 18 2HB LEU 18 -1.766 -6.738 0.009 99 HG LEU 18 HG LEU 18 -3.572 -5.327 -1.942 100 HD11 LEU 18 1HD1 LEU 18 -5.090 -5.090 -0.078 101 HD12 LEU 18 2HD1 LEU 18 -3.955 -5.909 0.994 102 HD13 LEU 18 3HD1 LEU 18 -4.732 -6.800 -0.318 103 HD21 LEU 18 1HD2 LEU 18 -3.276 -3.393 -0.484 104 HD22 LEU 18 2HD2 LEU 18 -1.744 -3.907 -1.186 105 HD23 LEU 18 3HD2 LEU 18 -2.120 -4.301 0.492 106 H THR 19 H THR 19 1.423 -5.924 -1.274 107 HA THR 19 HA THR 19 2.096 -8.696 -0.780 108 HB THR 19 HB THR 19 2.436 -8.604 -3.164 109 HG1 THR 19 1HG THR 19 4.175 -9.727 -2.868 110 HG21 THR 19 1HG2 THR 19 2.648 -6.329 -3.709 111 HG22 THR 19 2HG2 THR 19 4.220 -7.030 -4.093 112 HG23 THR 19 3HG2 THR 19 4.010 -6.103 -2.609 113 H SER 20 H SER 20 4.845 -8.476 -0.643 114 HA SER 20 HA SER 20 5.066 -6.739 1.705 115 HB2 SER 20 1HB SER 20 6.884 -8.972 0.761 116 HB3 SER 20 2HB SER 20 6.986 -8.130 2.307 117 HG SER 20 HG SER 20 4.507 -9.006 2.067 118 H ALA 21 H ALA 21 7.125 -5.594 2.051 119 HA ALA 21 HA ALA 21 7.669 -3.954 -0.213 120 HB1 ALA 21 1HB ALA 21 7.571 -3.114 2.091 121 HB2 ALA 21 2HB ALA 21 9.074 -2.687 1.275 122 HB3 ALA 21 3HB ALA 21 9.053 -3.996 2.457 123 H SER 22 H SER 22 8.764 -6.924 0.251 124 HA SER 22 HA SER 22 11.492 -6.450 -0.642 125 HB2 SER 22 1HB SER 22 10.911 -8.251 1.025 126 HB3 SER 22 2HB SER 22 10.070 -9.083 -0.272 127 HG SER 22 HG SER 22 12.780 -8.312 -0.502 128 H ASN 23 H ASN 23 8.411 -6.719 -1.915 129 HA ASN 23 HA ASN 23 8.933 -8.218 -4.279 130 HB2 ASN 23 1HB ASN 23 6.655 -7.774 -3.225 131 HB3 ASN 23 2HB ASN 23 6.745 -6.164 -3.921 132 HD21 ASN 23 1HD2 ASN 23 5.784 -9.347 -6.192 133 HD22 ASN 23 2HD2 ASN 23 6.218 -9.505 -4.527 134 H SER 24 H SER 24 9.292 -7.519 -6.355 135 HA SER 24 HA SER 24 10.970 -5.317 -6.727 136 HB2 SER 24 1HB SER 24 9.374 -6.779 -8.842 137 HB3 SER 24 2HB SER 24 10.851 -5.848 -9.092 138 HG SER 24 HG SER 24 10.718 -8.383 -8.621 139 H GLN 25 H GLN 25 7.473 -5.644 -7.116 140 HA GLN 25 HA GLN 25 7.013 -3.200 -8.473 141 HB2 GLN 25 1HB GLN 25 5.176 -4.439 -6.422 142 HB3 GLN 25 2HB GLN 25 4.733 -3.355 -7.729 143 HG2 GLN 25 1HG GLN 25 5.748 -6.158 -8.048 144 HG3 GLN 25 2HG GLN 25 4.063 -5.651 -8.132 145 HE21 GLN 25 1HE2 GLN 25 4.240 -4.486 -11.406 146 HE22 GLN 25 2HE2 GLN 25 3.318 -4.622 -9.951 147 H ALA 26 H ALA 26 6.976 -4.095 -5.069 148 HA ALA 26 HA ALA 26 6.251 -1.573 -4.051 149 HB1 ALA 26 1HB ALA 26 5.983 -3.656 -2.806 150 HB2 ALA 26 2HB ALA 26 6.942 -2.486 -1.895 151 HB3 ALA 26 3HB ALA 26 7.734 -3.833 -2.712 152 H ALA 27 H ALA 27 9.445 -3.186 -4.105 153 HA ALA 27 HA ALA 27 10.789 -1.070 -2.842 154 HB1 ALA 27 1HB ALA 27 11.916 -3.146 -4.727 155 HB2 ALA 27 2HB ALA 27 11.732 -3.317 -2.980 156 HB3 ALA 27 3HB ALA 27 12.856 -2.124 -3.638 157 H GLY 28 H GLY 28 10.120 -1.621 -6.277 158 HA2 GLY 28 1HA GLY 28 11.695 0.425 -7.345 159 HA3 GLY 28 2HA GLY 28 10.144 -0.088 -8.001 160 H LEU 29 H LEU 29 8.346 0.571 -6.237 161 HA LEU 29 HA LEU 29 7.966 3.349 -6.420 162 HB2 LEU 29 1HB LEU 29 6.743 1.358 -4.552 163 HB3 LEU 29 2HB LEU 29 6.102 2.933 -4.886 164 HG LEU 29 HG LEU 29 6.337 0.695 -6.889 165 HD11 LEU 29 1HD1 LEU 29 3.851 0.748 -6.776 166 HD12 LEU 29 2HD1 LEU 29 3.988 1.832 -5.389 167 HD13 LEU 29 3HD1 LEU 29 4.628 0.189 -5.295 168 HD21 LEU 29 1HD2 LEU 29 6.569 2.856 -7.965 169 HD22 LEU 29 2HD2 LEU 29 5.136 3.455 -7.130 170 HD23 LEU 29 3HD2 LEU 29 4.986 2.170 -8.330 171 H ILE 30 H ILE 30 8.791 1.306 -3.633 172 HA ILE 30 HA ILE 30 9.009 3.188 -1.632 173 HB ILE 30 HB ILE 30 10.642 0.703 -2.088 174 HG12 ILE 30 1HG1 ILE 30 8.192 1.245 -0.412 175 HG13 ILE 30 2HG1 ILE 30 8.194 0.415 -1.957 176 HG21 ILE 30 1HG2 ILE 30 11.357 0.775 0.158 177 HG22 ILE 30 2HG2 ILE 30 10.240 2.075 0.553 178 HG23 ILE 30 3HG2 ILE 30 11.641 2.402 -0.472 179 HD11 ILE 30 1HD1 ILE 30 8.017 -1.089 -0.050 180 HD12 ILE 30 2HD1 ILE 30 9.594 -0.539 0.518 181 HD13 ILE 30 3HD1 ILE 30 9.456 -1.393 -1.021 182 H GLN 31 H GLN 31 11.492 2.111 -3.892 183 HA GLN 31 HA GLN 31 13.458 3.829 -2.846 184 HB2 GLN 31 1HB GLN 31 13.254 2.161 -5.325 185 HB3 GLN 31 2HB GLN 31 14.667 3.174 -5.017 186 HG2 GLN 31 1HG GLN 31 14.892 1.939 -2.838 187 HG3 GLN 31 2HG GLN 31 13.633 0.856 -3.423 188 HE21 GLN 31 1HE2 GLN 31 15.683 -0.871 -5.656 189 HE22 GLN 31 2HE2 GLN 31 14.066 -0.507 -5.161 190 H GLN 32 H GLN 32 10.870 4.295 -5.084 191 HA GLN 32 HA GLN 32 12.027 6.589 -6.386 192 HB2 GLN 32 1HB GLN 32 9.175 5.637 -6.118 193 HB3 GLN 32 2HB GLN 32 9.617 7.094 -6.991 194 HG2 GLN 32 1HG GLN 32 10.670 4.363 -7.648 195 HG3 GLN 32 2HG GLN 32 9.242 5.077 -8.386 196 HE21 GLN 32 1HE2 GLN 32 11.382 6.132 -10.914 197 HE22 GLN 32 2HE2 GLN 32 10.107 5.072 -10.426 198 H LEU 33 H LEU 33 9.863 6.033 -3.681 199 HA LEU 33 HA LEU 33 9.471 8.820 -3.124 200 HB2 LEU 33 1HB LEU 33 8.987 6.673 -1.112 201 HB3 LEU 33 2HB LEU 33 8.057 8.123 -1.424 202 HG LEU 33 HG LEU 33 8.130 5.750 -3.284 203 HD11 LEU 33 1HD1 LEU 33 7.194 5.207 -1.054 204 HD12 LEU 33 2HD1 LEU 33 6.047 5.064 -2.380 205 HD13 LEU 33 3HD1 LEU 33 5.981 6.463 -1.309 206 HD21 LEU 33 1HD2 LEU 33 6.452 8.242 -3.165 207 HD22 LEU 33 2HD2 LEU 33 5.976 6.804 -4.077 208 HD23 LEU 33 3HD2 LEU 33 7.466 7.663 -4.492 209 H GLY 34 H GLY 34 11.749 6.400 -2.298 210 HA2 GLY 34 1HA GLY 34 13.769 6.580 -1.196 211 HA3 GLY 34 2HA GLY 34 13.385 8.257 -0.825 212 H LEU 35 H LEU 35 11.480 5.394 -0.125 213 HA LEU 35 HA LEU 35 11.073 6.235 2.575 214 HB2 LEU 35 1HB LEU 35 10.220 3.883 0.958 215 HB3 LEU 35 2HB LEU 35 9.897 3.940 2.670 216 HG LEU 35 HG LEU 35 8.886 5.871 0.592 217 HD11 LEU 35 1HD1 LEU 35 6.704 4.940 1.149 218 HD12 LEU 35 2HD1 LEU 35 7.470 3.808 2.264 219 HD13 LEU 35 3HD1 LEU 35 7.797 3.699 0.534 220 HD21 LEU 35 1HD2 LEU 35 7.545 6.805 2.453 221 HD22 LEU 35 2HD2 LEU 35 9.276 7.074 2.639 222 HD23 LEU 35 3HD2 LEU 35 8.474 5.813 3.577 223 H SER 36 H SER 36 12.885 6.152 3.785 224 HA SER 36 HA SER 36 14.495 3.736 3.835 225 HB2 SER 36 1HB SER 36 15.860 5.113 5.488 226 HB3 SER 36 2HB SER 36 15.757 5.764 3.852 227 HG SER 36 HG SER 36 14.068 6.548 6.001 228 H GLY 37 H GLY 37 13.883 2.107 5.108 229 HA2 GLY 37 1HA GLY 37 13.780 1.648 7.613 230 HA3 GLY 37 2HA GLY 37 12.412 2.751 7.585 231 H VAL 38 H VAL 38 11.564 1.723 4.938 232 HA VAL 38 HA VAL 38 9.824 -0.362 5.833 233 HB VAL 38 HB VAL 38 10.409 0.480 2.985 234 HG11 VAL 38 1HG1 VAL 38 8.122 -0.301 2.567 235 HG12 VAL 38 2HG1 VAL 38 8.007 -0.824 4.247 236 HG13 VAL 38 3HG1 VAL 38 9.166 -1.592 3.165 237 HG21 VAL 38 1HG2 VAL 38 8.534 2.035 3.208 238 HG22 VAL 38 2HG2 VAL 38 9.840 2.437 4.324 239 HG23 VAL 38 3HG2 VAL 38 8.393 1.622 4.916 240 H GLY 39 H GLY 39 10.675 -2.313 6.286 241 HA2 GLY 39 1HA GLY 39 12.879 -3.360 4.683 242 HA3 GLY 39 2HA GLY 39 12.308 -4.010 6.213 243 H ALA 40 H ALA 40 12.607 -6.014 4.813 244 HA ALA 40 HA ALA 40 10.721 -6.451 2.703 245 HB1 ALA 40 1HB ALA 40 11.603 -8.763 2.720 246 HB2 ALA 40 2HB ALA 40 12.548 -8.364 4.154 247 HB3 ALA 40 3HB ALA 40 12.872 -7.544 2.627 248 H ASN 41 H ASN 41 10.584 -6.701 6.079 249 HA ASN 41 HA ASN 41 8.457 -8.677 6.123 250 HB2 ASN 41 1HB ASN 41 8.541 -8.325 8.567 251 HB3 ASN 41 2HB ASN 41 10.125 -8.709 7.907 252 HD21 ASN 41 1HD2 ASN 41 9.416 -5.146 9.693 253 HD22 ASN 41 2HD2 ASN 41 8.149 -6.282 9.394 254 H VAL 42 H VAL 42 8.428 -5.705 5.081 255 HA VAL 42 HA VAL 42 6.227 -4.699 6.719 256 HB VAL 42 HB VAL 42 7.874 -3.249 4.650 257 HG11 VAL 42 1HG1 VAL 42 7.016 -1.216 5.828 258 HG12 VAL 42 2HG1 VAL 42 5.850 -2.262 6.655 259 HG13 VAL 42 3HG1 VAL 42 5.795 -2.097 4.898 260 HG21 VAL 42 1HG2 VAL 42 8.879 -2.186 6.669 261 HG22 VAL 42 2HG2 VAL 42 9.283 -3.889 6.425 262 HG23 VAL 42 3HG2 VAL 42 8.072 -3.429 7.630 263 HA PRO 43 HA PRO 43 3.397 -5.700 3.442 264 HB2 PRO 43 2HB PRO 43 1.338 -4.198 4.644 265 HB3 PRO 43 1HB PRO 43 1.614 -5.920 4.807 266 HG2 PRO 43 2HG PRO 43 1.924 -3.920 6.785 267 HG3 PRO 43 1HG PRO 43 2.251 -5.652 6.935 268 HD2 PRO 43 2HD PRO 43 4.112 -3.437 6.648 269 HD3 PRO 43 1HD PRO 43 4.438 -5.114 7.103 270 H VAL 44 H VAL 44 2.817 -4.630 1.581 271 HA VAL 44 HA VAL 44 2.554 -1.719 1.701 272 HB VAL 44 HB VAL 44 3.943 -1.381 -0.278 273 HG11 VAL 44 1HG1 VAL 44 6.155 -1.785 0.751 274 HG12 VAL 44 2HG1 VAL 44 5.365 -2.768 1.987 275 HG13 VAL 44 3HG1 VAL 44 4.996 -1.048 1.859 276 HG21 VAL 44 1HG2 VAL 44 3.831 -3.403 -1.448 277 HG22 VAL 44 2HG2 VAL 44 4.376 -4.336 -0.050 278 HG23 VAL 44 3HG2 VAL 44 5.505 -3.289 -0.901 279 H GLY 45 H GLY 45 1.610 -0.812 -0.228 280 HA2 GLY 45 1HA GLY 45 -0.007 -2.788 -1.699 281 HA3 GLY 45 2HA GLY 45 -0.604 -1.201 -1.250 282 H ILE 46 H ILE 46 0.320 -2.909 -3.738 283 HA ILE 46 HA ILE 46 1.993 -0.996 -5.142 284 HB ILE 46 HB ILE 46 0.731 -3.626 -5.909 285 HG12 ILE 46 1HG1 ILE 46 2.933 -4.531 -6.029 286 HG13 ILE 46 2HG1 ILE 46 3.667 -2.956 -5.933 287 HG21 ILE 46 1HG2 ILE 46 1.883 -3.466 -8.075 288 HG22 ILE 46 2HG2 ILE 46 2.355 -1.815 -7.678 289 HG23 ILE 46 3HG2 ILE 46 0.650 -2.223 -7.867 290 HD11 ILE 46 1HD1 ILE 46 3.155 -2.772 -3.630 291 HD12 ILE 46 2HD1 ILE 46 3.923 -4.333 -3.939 292 HD13 ILE 46 3HD1 ILE 46 2.178 -4.241 -3.694 293 H ASN 47 H ASN 47 1.072 0.740 -6.100 294 HA ASN 47 HA ASN 47 -0.350 2.053 -7.311 295 HB2 ASN 47 1HB ASN 47 -0.134 -0.064 -8.839 296 HB3 ASN 47 2HB ASN 47 -1.769 -0.397 -8.303 297 HD21 ASN 47 1HD2 ASN 47 -1.710 1.612 -11.472 298 HD22 ASN 47 2HD2 ASN 47 -0.862 0.193 -10.962 299 H CYS 48 H CYS 48 -1.213 2.404 -5.008 300 HA CYS 48 HA CYS 48 -3.946 1.368 -4.770 301 HB2 CYS 48 2HB CYS 48 -1.892 1.586 -2.883 302 HB3 CYS 48 1HB CYS 48 -3.042 2.845 -2.472 303 H ASN 49 H ASN 49 -5.658 2.627 -4.871 304 HA ASN 49 HA ASN 49 -5.328 5.542 -4.572 305 HB2 ASN 49 1HB ASN 49 -7.138 5.869 -6.227 306 HB3 ASN 49 2HB ASN 49 -5.720 5.114 -6.930 307 HD21 ASN 49 1HD2 ASN 49 -7.356 2.164 -7.834 308 HD22 ASN 49 2HD2 ASN 49 -5.851 3.001 -7.668 309 HA PRO 50 HA PRO 50 -8.246 5.160 -1.390 310 HB2 PRO 50 2HB PRO 50 -9.274 7.834 -1.907 311 HB3 PRO 50 1HB PRO 50 -8.231 7.283 -0.591 312 HG2 PRO 50 2HG PRO 50 -7.367 8.929 -2.577 313 HG3 PRO 50 1HG PRO 50 -6.308 7.788 -1.732 314 HD2 PRO 50 2HD PRO 50 -7.621 7.527 -4.409 315 HD3 PRO 50 1HD PRO 50 -5.974 7.090 -3.926 316 H ILE 51 H ILE 51 -10.139 4.156 -1.321 317 HA ILE 51 HA ILE 51 -11.877 4.258 -3.640 318 HB ILE 51 HB ILE 51 -12.614 2.737 -1.185 319 HG12 ILE 51 1HG1 ILE 51 -10.482 1.861 -3.142 320 HG13 ILE 51 2HG1 ILE 51 -10.187 2.337 -1.477 321 HG21 ILE 51 1HG2 ILE 51 -13.474 1.166 -2.803 322 HG22 ILE 51 2HG2 ILE 51 -12.700 2.050 -4.119 323 HG23 ILE 51 3HG2 ILE 51 -14.026 2.790 -3.220 324 HD11 ILE 51 1HD1 ILE 51 -10.242 -0.106 -1.830 325 HD12 ILE 51 2HD1 ILE 51 -11.941 0.044 -2.277 326 HD13 ILE 51 3HD1 ILE 51 -11.417 0.474 -0.652 327 H THR 52 H THR 52 -12.696 6.402 -3.441 328 HA THR 52 HA THR 52 -14.417 6.792 -1.096 329 HB THR 52 HB THR 52 -14.353 9.226 -1.741 330 HG1 THR 52 1HG THR 52 -13.676 8.956 -3.931 331 HG21 THR 52 1HG2 THR 52 -12.089 9.563 -0.840 332 HG22 THR 52 2HG2 THR 52 -11.717 7.865 -1.147 333 HG23 THR 52 3HG2 THR 52 -12.948 8.296 0.040 334 H GLY 53 H GLY 53 -14.999 5.279 -3.608 335 HA2 GLY 53 1HA GLY 53 -17.420 6.773 -4.398 336 HA3 GLY 53 2HA GLY 53 -16.592 5.619 -5.433 337 H ILE 54 H ILE 54 -18.836 6.053 -2.853 338 HA ILE 54 HA ILE 54 -19.155 3.207 -2.375 339 HB ILE 54 HB ILE 54 -20.757 5.547 -1.318 340 HG12 ILE 54 1HG1 ILE 54 -18.421 5.585 -0.562 341 HG13 ILE 54 2HG1 ILE 54 -19.511 5.204 0.769 342 HG21 ILE 54 1HG2 ILE 54 -20.736 2.665 -0.437 343 HG22 ILE 54 2HG2 ILE 54 -22.042 3.476 -1.300 344 HG23 ILE 54 3HG2 ILE 54 -21.625 3.976 0.338 345 HD11 ILE 54 1HD1 ILE 54 -17.556 3.816 0.898 346 HD12 ILE 54 2HD1 ILE 54 -17.791 3.272 -0.761 347 HD13 ILE 54 3HD1 ILE 54 -18.949 2.816 0.487 348 H GLY 55 H GLY 55 -20.765 1.936 -3.171 349 HA2 GLY 55 1HA GLY 55 -23.097 1.820 -3.976 350 HA3 GLY 55 2HA GLY 55 -22.743 3.251 -4.933 351 H ALA 56 H ALA 56 -20.760 0.355 -4.477 352 HA ALA 56 HA ALA 56 -21.247 -0.383 -7.268 353 HB1 ALA 56 1HB ALA 56 -19.251 1.049 -7.249 354 HB2 ALA 56 2HB ALA 56 -18.878 -0.606 -7.733 355 HB3 ALA 56 3HB ALA 56 -18.485 -0.054 -6.106 356 H GLY 57 H GLY 57 -22.128 -2.322 -6.982 357 HA2 GLY 57 1HA GLY 57 -22.224 -4.576 -6.540 358 HA3 GLY 57 2HA GLY 57 -20.551 -4.489 -6.010 359 H SER 58 H SER 58 -20.247 -5.002 -3.964 360 HA SER 58 HA SER 58 -22.452 -5.170 -2.142 361 HB2 SER 58 1HB SER 58 -19.496 -5.556 -1.618 362 HB3 SER 58 2HB SER 58 -20.818 -6.072 -0.572 363 HG SER 58 HG SER 58 -20.908 -6.951 -3.206 364 H GLY 59 H GLY 59 -19.680 -3.029 -2.597 365 HA2 GLY 59 1HA GLY 59 -20.954 -1.087 -0.835 366 HA3 GLY 59 2HA GLY 59 -19.371 -1.663 -0.339 367 H SER 60 H SER 60 -17.549 -1.165 -1.637 368 HA SER 60 HA SER 60 -17.971 1.289 -3.198 369 HB2 SER 60 1HB SER 60 -15.558 1.752 -2.537 370 HB3 SER 60 2HB SER 60 -16.740 1.795 -1.232 371 HG SER 60 HG SER 60 -15.437 0.419 -0.326 372 H SER 61 H SER 61 -16.224 1.723 -4.841 373 HA SER 61 HA SER 61 -15.945 -0.672 -6.468 374 HB2 SER 61 1HB SER 61 -15.251 1.070 -8.221 375 HB3 SER 61 2HB SER 61 -16.922 1.118 -7.656 376 HG SER 61 HG SER 61 -14.833 2.718 -6.578 377 H CYS 62 H CYS 62 -14.168 -1.752 -5.566 378 HA CYS 62 HA CYS 62 -11.605 -0.368 -5.959 379 HB2 CYS 62 2HB CYS 62 -11.749 -1.201 -3.707 380 HB3 CYS 62 1HB CYS 62 -12.244 -2.801 -4.257 381 H ASN 63 H ASN 63 -10.457 -0.874 -7.671 382 HA ASN 63 HA ASN 63 -11.402 -2.742 -9.580 383 HB2 ASN 63 1HB ASN 63 -9.345 -2.164 -10.842 384 HB3 ASN 63 2HB ASN 63 -10.264 -0.748 -10.332 385 HD21 ASN 63 1HD2 ASN 63 -6.469 -1.360 -9.085 386 HD22 ASN 63 2HD2 ASN 63 -7.316 -2.512 -10.063 387 H ALA 64 H ALA 64 -9.254 -3.107 -6.914 388 HA ALA 64 HA ALA 64 -8.629 -5.786 -7.854 389 HB1 ALA 64 1HB ALA 64 -6.430 -3.892 -7.056 390 HB2 ALA 64 2HB ALA 64 -6.845 -4.319 -8.718 391 HB3 ALA 64 3HB ALA 64 -6.255 -5.560 -7.607 392 H ASN 65 H ASN 65 -6.715 -4.273 -5.362 393 HA ASN 65 HA ASN 65 -8.147 -5.924 -3.380 394 HB2 ASN 65 1HB ASN 65 -5.201 -5.365 -3.535 395 HB3 ASN 65 2HB ASN 65 -5.977 -6.287 -2.270 396 HD21 ASN 65 1HD2 ASN 65 -5.129 -7.944 -5.865 397 HD22 ASN 65 2HD2 ASN 65 -4.921 -6.257 -5.563 398 HA PRO 66 HA PRO 66 -8.420 -1.915 -1.427 399 HB2 PRO 66 2HB PRO 66 -10.362 -2.735 0.322 400 HB3 PRO 66 1HB PRO 66 -10.678 -2.132 -1.303 401 HG2 PRO 66 2HG PRO 66 -10.776 -4.881 -0.277 402 HG3 PRO 66 1HG PRO 66 -11.620 -4.172 -1.649 403 HD2 PRO 66 2HD PRO 66 -9.349 -5.836 -1.750 404 HD3 PRO 66 1HD PRO 66 -10.011 -4.877 -3.084 405 H ALA 67 H ALA 67 -7.346 -1.191 0.306 406 HA ALA 67 HA ALA 67 -6.603 -3.050 2.443 407 HB1 ALA 67 1HB ALA 67 -4.241 -2.515 2.239 408 HB2 ALA 67 2HB ALA 67 -4.577 -1.471 0.857 409 HB3 ALA 67 3HB ALA 67 -4.836 -3.212 0.731 410 H CYS 68 H CYS 68 -5.718 -2.010 4.294 411 HA CYS 68 HA CYS 68 -6.123 0.902 4.406 412 HB2 CYS 68 2HB CYS 68 -7.461 -0.267 6.065 413 HB3 CYS 68 1HB CYS 68 -6.049 -1.145 6.635 414 H CYS 69 H CYS 69 -4.311 2.065 4.414 415 HA CYS 69 HA CYS 69 -1.825 0.680 5.135 416 HB2 CYS 69 2HB CYS 69 -2.095 2.950 3.174 417 HB3 CYS 69 1HB CYS 69 -0.703 1.933 3.463 418 H ASP 70 H ASP 70 -0.292 1.778 6.298 419 HA ASP 70 HA ASP 70 -1.231 3.684 8.170 420 HB2 ASP 70 1HB ASP 70 0.640 1.952 8.453 421 HB3 ASP 70 2HB ASP 70 1.675 3.086 7.595 422 H ASN 71 H ASN 71 0.945 3.899 5.392 423 HA ASN 71 HA ASN 71 0.067 6.640 4.932 424 HB2 ASN 71 1HB ASN 71 3.000 5.884 5.115 425 HB3 ASN 71 2HB ASN 71 2.403 7.392 4.442 426 HD21 ASN 71 1HD2 ASN 71 2.795 6.876 8.418 427 HD22 ASN 71 2HD2 ASN 71 3.129 5.621 7.274 428 H VAL 72 H VAL 72 -0.394 6.848 2.778 429 HA VAL 72 HA VAL 72 1.180 5.194 0.940 430 HB VAL 72 HB VAL 72 -0.622 3.946 0.522 431 HG11 VAL 72 1HG1 VAL 72 -2.333 6.122 1.683 432 HG12 VAL 72 2HG1 VAL 72 -1.785 4.637 2.470 433 HG13 VAL 72 3HG1 VAL 72 -2.925 4.556 1.129 434 HG21 VAL 72 1HG2 VAL 72 -2.185 4.777 -1.156 435 HG22 VAL 72 2HG2 VAL 72 -0.531 5.264 -1.528 436 HG23 VAL 72 3HG2 VAL 72 -1.658 6.429 -0.836 437 H TYR 73 H TYR 73 1.677 6.026 -1.009 438 HA TYR 73 HA TYR 73 1.550 8.963 -1.048 439 HB2 TYR 73 2HB TYR 73 3.647 7.059 -2.126 440 HB3 TYR 73 1HB TYR 73 3.747 8.816 -2.169 441 HD1 TYR 73 1HD TYR 73 3.956 5.842 -0.034 442 HD2 TYR 73 2HD TYR 73 4.170 10.091 -0.135 443 HE1 TYR 73 1HE TYR 73 4.924 5.835 2.230 444 HE2 TYR 73 2HE TYR 73 5.147 10.098 2.120 445 HH TYR 73 HH TYR 73 5.127 8.596 4.127 446 H THR 74 H THR 74 1.722 9.938 -3.256 447 HA THR 74 HA THR 74 -0.605 9.041 -4.599 448 HB THR 74 HB THR 74 -0.123 10.947 -6.181 449 HG1 THR 74 1HG THR 74 2.267 10.816 -4.878 450 HG21 THR 74 1HG2 THR 74 -0.617 12.668 -4.501 451 HG22 THR 74 2HG2 THR 74 -0.161 11.544 -3.221 452 HG23 THR 74 3HG2 THR 74 -1.567 11.208 -4.230 453 H ASN 75 H ASN 75 2.666 8.211 -5.117 454 HA ASN 75 HA ASN 75 2.415 7.504 -7.878 455 HB2 ASN 75 1HB ASN 75 4.394 6.132 -7.550 456 HB3 ASN 75 2HB ASN 75 4.628 7.671 -6.735 457 HD21 ASN 75 1HD2 ASN 75 5.602 4.698 -4.624 458 HD22 ASN 75 2HD2 ASN 75 5.879 5.047 -6.293 459 H GLY 76 H GLY 76 1.211 6.324 -4.961 460 HA2 GLY 76 1HA GLY 76 -0.618 4.809 -4.957 461 HA3 GLY 76 2HA GLY 76 0.107 3.977 -6.328 462 H LEU 77 H LEU 77 2.356 4.859 -3.862 463 HA LEU 77 HA LEU 77 2.522 2.028 -3.141 464 HB2 LEU 77 1HB LEU 77 4.521 3.243 -3.956 465 HB3 LEU 77 2HB LEU 77 4.406 4.308 -2.580 466 HG LEU 77 HG LEU 77 6.143 2.398 -2.524 467 HD11 LEU 77 1HD1 LEU 77 4.236 2.729 -0.222 468 HD12 LEU 77 2HD1 LEU 77 5.621 3.758 -0.582 469 HD13 LEU 77 3HD1 LEU 77 5.874 2.068 -0.127 470 HD21 LEU 77 1HD2 LEU 77 3.689 0.836 -1.753 471 HD22 LEU 77 2HD2 LEU 77 5.367 0.276 -1.711 472 HD23 LEU 77 3HD2 LEU 77 4.598 0.639 -3.256 473 H GLY 78 H GLY 78 1.502 1.402 -1.392 474 HA2 GLY 78 1HA GLY 78 1.205 3.321 0.818 475 HA3 GLY 78 2HA GLY 78 0.185 1.917 0.563 476 H VAL 79 H VAL 79 2.066 2.945 2.759 477 HA VAL 79 HA VAL 79 3.709 0.531 3.054 478 HB VAL 79 HB VAL 79 4.708 2.875 3.367 479 HG11 VAL 79 1HG1 VAL 79 4.420 3.944 5.527 480 HG12 VAL 79 2HG1 VAL 79 3.208 2.743 5.970 481 HG13 VAL 79 3HG1 VAL 79 2.893 3.865 4.647 482 HG21 VAL 79 1HG2 VAL 79 4.966 0.929 5.649 483 HG22 VAL 79 2HG2 VAL 79 6.122 2.190 5.215 484 HG23 VAL 79 3HG2 VAL 79 5.830 0.846 4.113 485 H GLN 80 H GLN 80 3.387 -0.877 4.691 486 HA GLN 80 HA GLN 80 2.258 -2.096 6.210 487 HB2 GLN 80 1HB GLN 80 1.796 0.689 7.243 488 HB3 GLN 80 2HB GLN 80 1.113 -0.704 8.071 489 HG2 GLN 80 1HG GLN 80 4.013 -0.546 7.399 490 HG3 GLN 80 2HG GLN 80 3.370 0.193 8.868 491 HE21 GLN 80 1HE2 GLN 80 4.560 -3.340 9.423 492 HE22 GLN 80 2HE2 GLN 80 5.265 -1.980 8.620 493 H CYS 81 H CYS 81 0.998 -2.107 3.963 494 HA CYS 81 HA CYS 81 -1.757 -1.244 4.296 495 HB2 CYS 81 2HB CYS 81 -0.418 -2.654 1.985 496 HB3 CYS 81 1HB CYS 81 -2.099 -2.163 2.018 497 H ASN 82 H ASN 82 -3.123 -2.414 5.334 498 HA ASN 82 HA ASN 82 -2.834 -5.340 5.254 499 HB2 ASN 82 1HB ASN 82 -4.435 -5.327 7.210 500 HB3 ASN 82 2HB ASN 82 -2.853 -4.631 7.519 501 HD21 ASN 82 1HD2 ASN 82 -4.045 -1.451 8.269 502 HD22 ASN 82 2HD2 ASN 82 -2.677 -2.461 7.965 503 HA PRO 83 HA PRO 83 -6.137 -5.590 2.416 504 HB2 PRO 83 2HB PRO 83 -6.757 -8.232 3.563 505 HB3 PRO 83 1HB PRO 83 -6.229 -7.810 1.934 506 HG2 PRO 83 2HG PRO 83 -4.594 -9.045 3.660 507 HG3 PRO 83 1HG PRO 83 -3.993 -7.844 2.503 508 HD2 PRO 83 2HD PRO 83 -4.559 -7.542 5.429 509 HD3 PRO 83 1HD PRO 83 -3.212 -6.903 4.466 510 H ILE 84 H ILE 84 -8.146 -4.884 2.398 511 HA ILE 84 HA ILE 84 -9.784 -4.829 4.778 512 HB ILE 84 HB ILE 84 -10.379 -4.009 1.942 513 HG12 ILE 84 1HG1 ILE 84 -8.661 -2.614 2.875 514 HG13 ILE 84 2HG1 ILE 84 -10.164 -1.702 2.845 515 HG21 ILE 84 1HG2 ILE 84 -12.443 -4.540 3.098 516 HG22 ILE 84 2HG2 ILE 84 -12.308 -2.806 2.806 517 HG23 ILE 84 3HG2 ILE 84 -11.991 -3.456 4.415 518 HD11 ILE 84 1HD1 ILE 84 -9.025 -1.289 4.905 519 HD12 ILE 84 2HD1 ILE 84 -8.909 -3.018 5.231 520 HD13 ILE 84 3HD1 ILE 84 -10.484 -2.226 5.231 521 H ASN 85 H ASN 85 -11.743 -5.852 5.033 522 HA ASN 85 HA ASN 85 -11.918 -8.473 3.840 523 HB2 ASN 85 1HB ASN 85 -12.325 -8.273 6.212 524 HB3 ASN 85 2HB ASN 85 -13.571 -7.062 5.940 525 HD21 ASN 85 1HD2 ASN 85 -15.819 -9.687 6.353 526 HD22 ASN 85 2HD2 ASN 85 -15.138 -8.235 6.999 527 H VAL 86 H VAL 86 -12.595 -8.372 1.783 528 HA VAL 86 HA VAL 86 -15.234 -7.191 1.295 529 HB VAL 86 HB VAL 86 -14.409 -6.699 -1.076 530 HG11 VAL 86 1HG1 VAL 86 -14.838 -4.944 0.559 531 HG12 VAL 86 2HG1 VAL 86 -13.436 -4.550 -0.435 532 HG13 VAL 86 3HG1 VAL 86 -13.212 -5.142 1.211 533 HG21 VAL 86 1HG2 VAL 86 -12.011 -6.351 -1.351 534 HG22 VAL 86 2HG2 VAL 86 -12.367 -8.037 -0.977 535 HG23 VAL 86 3HG2 VAL 86 -11.727 -6.972 0.274 536 H ASN 87 H ASN 87 -16.190 -9.140 1.520 537 HA ASN 87 HA ASN 87 -17.166 -11.068 0.797 538 HB2 ASN 87 1HB ASN 87 -16.907 -10.290 -1.531 539 HB3 ASN 87 2HB ASN 87 -15.273 -10.941 -1.566 540 HD21 ASN 87 1HD2 ASN 87 -18.495 -13.338 -2.068 541 HD22 ASN 87 2HD2 ASN 87 -18.657 -11.682 -1.600 542 H LEU 88 H LEU 88 -13.708 -10.776 0.864 543 HA LEU 88 HA LEU 88 -12.072 -11.966 1.823 544 HB2 LEU 88 1HB LEU 88 -13.667 -11.885 3.743 545 HB3 LEU 88 2HB LEU 88 -14.270 -13.457 3.246 546 HG LEU 88 HG LEU 88 -11.917 -14.320 3.519 547 HD11 LEU 88 1HD1 LEU 88 -10.432 -13.020 4.981 548 HD12 LEU 88 2HD1 LEU 88 -11.557 -11.666 4.896 549 HD13 LEU 88 3HD1 LEU 88 -10.728 -12.216 3.441 550 HD21 LEU 88 1HD2 LEU 88 -13.679 -14.746 5.152 551 HD22 LEU 88 2HD2 LEU 88 -13.297 -13.229 5.965 552 HD23 LEU 88 3HD2 LEU 88 -12.115 -14.538 5.939 Start of MODEL 17 1 H1 GLY 1 1H GLY 1 -9.989 12.443 4.663 2 H2 GLY 1 2H GLY 1 -11.049 11.584 5.656 3 H3 GLY 1 3H GLY 1 -11.491 13.105 5.068 4 HA2 GLY 1 1HA GLY 1 -11.516 12.261 2.812 5 HA3 GLY 1 2HA GLY 1 -11.049 10.680 3.422 6 H SER 2 H SER 2 -13.397 11.310 1.907 7 HA SER 2 HA SER 2 -15.475 10.690 3.892 8 HB2 SER 2 1HB SER 2 -17.036 11.572 2.036 9 HB3 SER 2 2HB SER 2 -16.092 12.755 2.939 10 HG SER 2 HG SER 2 -15.800 11.870 0.298 11 H GLY 3 H GLY 3 -16.447 8.770 3.717 12 HA2 GLY 3 1HA GLY 3 -17.440 7.001 2.435 13 HA3 GLY 3 2HA GLY 3 -16.285 7.334 1.152 14 H SER 4 H SER 4 -14.444 7.588 3.749 15 HA SER 4 HA SER 4 -13.449 4.882 3.490 16 HB2 SER 4 1HB SER 4 -11.723 5.989 5.203 17 HB3 SER 4 2HB SER 4 -11.634 6.280 3.465 18 HG SER 4 HG SER 4 -12.774 7.944 5.465 19 H SER 5 H SER 5 -15.478 4.094 4.519 20 HA SER 5 HA SER 5 -15.908 4.477 7.303 21 HB2 SER 5 1HB SER 5 -17.379 2.433 7.020 22 HB3 SER 5 2HB SER 5 -17.762 3.794 5.965 23 HG SER 5 HG SER 5 -17.238 1.328 5.238 24 H GLN 6 H GLN 6 -14.193 2.097 5.376 25 HA GLN 6 HA GLN 6 -13.438 0.551 7.710 26 HB2 GLN 6 1HB GLN 6 -12.596 0.224 4.830 27 HB3 GLN 6 2HB GLN 6 -12.306 -0.923 6.126 28 HG2 GLN 6 1HG GLN 6 -14.983 -0.137 5.005 29 HG3 GLN 6 2HG GLN 6 -14.130 -1.655 4.734 30 HE21 GLN 6 1HE2 GLN 6 -15.038 -3.089 7.794 31 HE22 GLN 6 2HE2 GLN 6 -13.968 -3.147 6.440 32 H CYS 7 H CYS 7 -11.064 -0.095 7.801 33 HA CYS 7 HA CYS 7 -8.861 0.322 7.983 34 HB2 CYS 7 2HB CYS 7 -8.815 1.119 5.713 35 HB3 CYS 7 1HB CYS 7 -9.464 2.675 6.211 36 H ASN 8 H ASN 8 -8.086 0.859 9.857 37 HA ASN 8 HA ASN 8 -9.157 3.148 11.303 38 HB2 ASN 8 1HB ASN 8 -8.944 0.951 12.419 39 HB3 ASN 8 2HB ASN 8 -7.203 1.008 12.175 40 HD21 ASN 8 1HD2 ASN 8 -7.058 2.226 15.427 41 HD22 ASN 8 2HD2 ASN 8 -6.771 0.900 14.350 42 H ALA 9 H ALA 9 -6.380 2.279 9.479 43 HA ALA 9 HA ALA 9 -4.588 4.135 10.780 44 HB1 ALA 9 1HB ALA 9 -3.723 2.040 9.892 45 HB2 ALA 9 2HB ALA 9 -2.963 3.420 9.099 46 HB3 ALA 9 3HB ALA 9 -4.225 2.510 8.268 47 H GLY 10 H GLY 10 -7.046 4.482 8.606 48 HA2 GLY 10 1HA GLY 10 -6.980 7.098 8.123 49 HA3 GLY 10 2HA GLY 10 -5.783 6.526 6.968 50 HA PRO 11 HA PRO 11 -9.660 6.113 4.669 51 HB2 PRO 11 2HB PRO 11 -8.751 6.887 2.290 52 HB3 PRO 11 1HB PRO 11 -9.015 8.065 3.583 53 HG2 PRO 11 2HG PRO 11 -6.469 6.816 2.647 54 HG3 PRO 11 1HG PRO 11 -6.784 8.501 3.097 55 HD2 PRO 11 2HD PRO 11 -5.625 6.612 4.758 56 HD3 PRO 11 1HD PRO 11 -6.445 8.082 5.319 57 H VAL 12 H VAL 12 -10.291 4.774 2.885 58 HA VAL 12 HA VAL 12 -8.944 2.242 2.882 59 HB VAL 12 HB VAL 12 -10.802 1.650 1.208 60 HG11 VAL 12 1HG1 VAL 12 -11.547 2.601 3.970 61 HG12 VAL 12 2HG1 VAL 12 -10.869 1.025 3.561 62 HG13 VAL 12 3HG1 VAL 12 -12.475 1.470 2.984 63 HG21 VAL 12 1HG2 VAL 12 -12.712 3.132 1.114 64 HG22 VAL 12 2HG2 VAL 12 -11.282 3.996 0.542 65 HG23 VAL 12 3HG2 VAL 12 -11.906 4.295 2.163 66 H GLN 13 H GLN 13 -7.701 1.359 1.298 67 HA GLN 13 HA GLN 13 -7.210 3.070 -1.049 68 HB2 GLN 13 1HB GLN 13 -5.293 1.105 0.210 69 HB3 GLN 13 2HB GLN 13 -4.959 2.189 -1.127 70 HG2 GLN 13 1HG GLN 13 -5.633 3.032 1.673 71 HG3 GLN 13 2HG GLN 13 -4.025 3.000 0.958 72 HE21 GLN 13 1HE2 GLN 13 -5.693 6.395 0.794 73 HE22 GLN 13 2HE2 GLN 13 -5.629 5.212 2.052 74 H CYS 14 H CYS 14 -7.210 2.237 -3.022 75 HA CYS 14 HA CYS 14 -7.927 -0.595 -3.332 76 HB2 CYS 14 2HB CYS 14 -9.583 0.918 -4.285 77 HB3 CYS 14 1HB CYS 14 -8.343 1.746 -5.213 78 H CYS 15 H CYS 15 -6.146 -1.707 -3.566 79 HA CYS 15 HA CYS 15 -3.910 -0.550 -5.078 80 HB2 CYS 15 2HB CYS 15 -3.887 -2.785 -3.032 81 HB3 CYS 15 1HB CYS 15 -2.479 -1.990 -3.742 82 H ASN 16 H ASN 16 -2.992 -1.641 -6.724 83 HA ASN 16 HA ASN 16 -4.496 -3.605 -8.105 84 HB2 ASN 16 1HB ASN 16 -2.839 -1.914 -9.068 85 HB3 ASN 16 2HB ASN 16 -1.588 -3.027 -8.543 86 HD21 ASN 16 1HD2 ASN 16 -1.807 -4.451 -11.704 87 HD22 ASN 16 2HD2 ASN 16 -0.869 -3.539 -10.576 88 H THR 17 H THR 17 -1.621 -3.705 -6.095 89 HA THR 17 HA THR 17 -1.953 -6.594 -5.815 90 HB THR 17 HB THR 17 0.670 -5.257 -6.533 91 HG1 THR 17 1HG THR 17 -1.200 -6.830 -7.918 92 HG21 THR 17 1HG2 THR 17 1.132 -6.974 -4.928 93 HG22 THR 17 2HG2 THR 17 1.559 -7.587 -6.527 94 HG23 THR 17 3HG2 THR 17 0.060 -8.105 -5.757 95 H LEU 18 H LEU 18 -2.069 -7.053 -3.713 96 HA LEU 18 HA LEU 18 -0.604 -5.369 -1.817 97 HB2 LEU 18 1HB LEU 18 -2.637 -7.561 -1.395 98 HB3 LEU 18 2HB LEU 18 -1.764 -6.786 -0.088 99 HG LEU 18 HG LEU 18 -3.651 -5.425 -1.995 100 HD11 LEU 18 1HD1 LEU 18 -5.115 -5.195 -0.076 101 HD12 LEU 18 2HD1 LEU 18 -3.936 -6.007 0.954 102 HD13 LEU 18 3HD1 LEU 18 -4.744 -6.899 -0.337 103 HD21 LEU 18 1HD2 LEU 18 -1.834 -3.953 -1.316 104 HD22 LEU 18 2HD2 LEU 18 -2.150 -4.328 0.377 105 HD23 LEU 18 3HD2 LEU 18 -3.354 -3.462 -0.576 106 H THR 19 H THR 19 1.390 -5.918 -1.477 107 HA THR 19 HA THR 19 2.103 -8.710 -1.125 108 HB THR 19 HB THR 19 2.400 -8.433 -3.517 109 HG1 THR 19 1HG THR 19 4.265 -9.431 -3.510 110 HG21 THR 19 1HG2 THR 19 4.153 -6.826 -4.373 111 HG22 THR 19 2HG2 THR 19 4.076 -6.036 -2.797 112 HG23 THR 19 3HG2 THR 19 2.643 -6.097 -3.827 113 H SER 20 H SER 20 4.823 -8.482 -0.962 114 HA SER 20 HA SER 20 5.041 -6.818 1.438 115 HB2 SER 20 1HB SER 20 6.874 -9.012 0.437 116 HB3 SER 20 2HB SER 20 6.934 -8.237 2.021 117 HG SER 20 HG SER 20 4.781 -9.790 0.989 118 H ALA 21 H ALA 21 6.998 -5.625 1.827 119 HA ALA 21 HA ALA 21 7.667 -3.898 -0.288 120 HB1 ALA 21 1HB ALA 21 9.120 -4.308 2.322 121 HB2 ALA 21 2HB ALA 21 7.718 -3.265 2.081 122 HB3 ALA 21 3HB ALA 21 9.239 -2.901 1.268 123 H SER 22 H SER 22 8.877 -6.957 0.484 124 HA SER 22 HA SER 22 11.495 -6.657 -0.605 125 HB2 SER 22 1HB SER 22 10.889 -8.415 1.030 126 HB3 SER 22 2HB SER 22 9.870 -9.160 -0.177 127 HG SER 22 HG SER 22 11.743 -10.237 -0.351 128 H ASN 23 H ASN 23 8.392 -6.846 -1.966 129 HA ASN 23 HA ASN 23 9.015 -8.244 -4.370 130 HB2 ASN 23 1HB ASN 23 6.676 -7.754 -3.420 131 HB3 ASN 23 2HB ASN 23 6.858 -6.143 -4.100 132 HD21 ASN 23 1HD2 ASN 23 6.078 -9.322 -6.480 133 HD22 ASN 23 2HD2 ASN 23 6.454 -9.516 -4.802 134 H SER 24 H SER 24 9.660 -7.503 -6.321 135 HA SER 24 HA SER 24 11.354 -5.274 -6.422 136 HB2 SER 24 1HB SER 24 11.591 -7.241 -7.891 137 HB3 SER 24 2HB SER 24 10.096 -6.806 -8.714 138 HG SER 24 HG SER 24 12.428 -5.185 -8.591 139 H GLN 25 H GLN 25 7.958 -5.651 -7.181 140 HA GLN 25 HA GLN 25 7.566 -3.259 -8.610 141 HB2 GLN 25 1HB GLN 25 5.939 -5.185 -8.409 142 HB3 GLN 25 2HB GLN 25 5.587 -4.631 -6.774 143 HG2 GLN 25 1HG GLN 25 3.893 -3.772 -8.124 144 HG3 GLN 25 2HG GLN 25 4.979 -2.431 -7.769 145 HE21 GLN 25 1HE2 GLN 25 5.559 -3.940 -11.503 146 HE22 GLN 25 2HE2 GLN 25 5.641 -4.952 -10.104 147 H ALA 26 H ALA 26 7.259 -4.100 -5.196 148 HA ALA 26 HA ALA 26 6.354 -1.552 -4.344 149 HB1 ALA 26 1HB ALA 26 5.919 -3.579 -3.072 150 HB2 ALA 26 2HB ALA 26 6.800 -2.404 -2.091 151 HB3 ALA 26 3HB ALA 26 7.646 -3.787 -2.785 152 H ALA 27 H ALA 27 9.539 -3.153 -4.065 153 HA ALA 27 HA ALA 27 10.766 -1.064 -2.656 154 HB1 ALA 27 1HB ALA 27 12.889 -2.108 -3.265 155 HB2 ALA 27 2HB ALA 27 12.070 -3.087 -4.483 156 HB3 ALA 27 3HB ALA 27 11.704 -3.320 -2.773 157 H GLY 28 H GLY 28 10.345 -1.520 -6.134 158 HA2 GLY 28 1HA GLY 28 12.045 0.523 -7.026 159 HA3 GLY 28 2HA GLY 28 10.562 0.025 -7.834 160 H LEU 29 H LEU 29 8.632 0.652 -6.162 161 HA LEU 29 HA LEU 29 8.257 3.437 -6.336 162 HB2 LEU 29 1HB LEU 29 6.915 1.405 -4.600 163 HB3 LEU 29 2HB LEU 29 6.292 2.987 -4.938 164 HG LEU 29 HG LEU 29 6.655 0.783 -6.963 165 HD11 LEU 29 1HD1 LEU 29 4.178 0.844 -7.026 166 HD12 LEU 29 2HD1 LEU 29 4.211 1.935 -5.638 167 HD13 LEU 29 3HD1 LEU 29 4.834 0.290 -5.487 168 HD21 LEU 29 1HD2 LEU 29 5.426 2.288 -8.475 169 HD22 LEU 29 2HD2 LEU 29 6.981 2.958 -7.985 170 HD23 LEU 29 3HD2 LEU 29 5.493 3.555 -7.250 171 H ILE 30 H ILE 30 8.856 1.338 -3.543 172 HA ILE 30 HA ILE 30 8.953 3.167 -1.479 173 HB ILE 30 HB ILE 30 10.575 0.665 -1.908 174 HG12 ILE 30 1HG1 ILE 30 8.040 1.191 -0.361 175 HG13 ILE 30 2HG1 ILE 30 8.117 0.429 -1.940 176 HG21 ILE 30 1HG2 ILE 30 11.205 0.657 0.337 177 HG22 ILE 30 2HG2 ILE 30 10.017 1.880 0.771 178 HG23 ILE 30 3HG2 ILE 30 11.452 2.336 -0.154 179 HD11 ILE 30 1HD1 ILE 30 7.813 -1.162 -0.124 180 HD12 ILE 30 2HD1 ILE 30 9.353 -0.652 0.570 181 HD13 ILE 30 3HD1 ILE 30 9.312 -1.435 -1.010 182 H GLN 31 H GLN 31 11.638 2.077 -3.515 183 HA GLN 31 HA GLN 31 13.498 3.798 -2.302 184 HB2 GLN 31 1HB GLN 31 13.502 2.176 -4.819 185 HB3 GLN 31 2HB GLN 31 14.875 3.197 -4.388 186 HG2 GLN 31 1HG GLN 31 14.963 1.920 -2.223 187 HG3 GLN 31 2HG GLN 31 13.760 0.837 -2.918 188 HE21 GLN 31 1HE2 GLN 31 17.301 -0.350 -3.473 189 HE22 GLN 31 2HE2 GLN 31 16.486 0.269 -2.078 190 H GLN 32 H GLN 32 11.164 4.232 -4.838 191 HA GLN 32 HA GLN 32 12.406 6.540 -6.003 192 HB2 GLN 32 1HB GLN 32 9.610 5.443 -6.057 193 HB3 GLN 32 2HB GLN 32 9.972 7.016 -6.744 194 HG2 GLN 32 1HG GLN 32 11.285 4.444 -7.563 195 HG3 GLN 32 2HG GLN 32 9.919 5.197 -8.381 196 HE21 GLN 32 1HE2 GLN 32 11.815 7.641 -10.005 197 HE22 GLN 32 2HE2 GLN 32 10.238 7.118 -9.525 198 H LEU 33 H LEU 33 9.827 6.060 -3.656 199 HA LEU 33 HA LEU 33 9.477 8.845 -3.132 200 HB2 LEU 33 1HB LEU 33 8.671 6.673 -1.234 201 HB3 LEU 33 2HB LEU 33 7.862 8.180 -1.582 202 HG LEU 33 HG LEU 33 8.016 5.869 -3.505 203 HD11 LEU 33 1HD1 LEU 33 5.967 6.622 -1.464 204 HD12 LEU 33 2HD1 LEU 33 6.694 5.045 -1.789 205 HD13 LEU 33 3HD1 LEU 33 5.539 5.739 -2.924 206 HD21 LEU 33 1HD2 LEU 33 7.630 7.756 -4.797 207 HD22 LEU 33 2HD2 LEU 33 6.627 8.518 -3.559 208 HD23 LEU 33 3HD2 LEU 33 6.006 7.131 -4.469 209 H GLY 34 H GLY 34 11.499 6.325 -1.957 210 HA2 GLY 34 1HA GLY 34 13.470 6.556 -0.767 211 HA3 GLY 34 2HA GLY 34 13.033 8.212 -0.396 212 H LEU 35 H LEU 35 10.894 5.501 0.223 213 HA LEU 35 HA LEU 35 10.325 6.099 2.838 214 HB2 LEU 35 1HB LEU 35 10.250 3.633 1.201 215 HB3 LEU 35 2HB LEU 35 9.857 3.523 2.894 216 HG LEU 35 HG LEU 35 7.882 3.705 1.504 217 HD11 LEU 35 1HD1 LEU 35 6.773 5.515 2.678 218 HD12 LEU 35 2HD1 LEU 35 8.334 6.190 3.132 219 HD13 LEU 35 3HD1 LEU 35 7.830 4.626 3.775 220 HD21 LEU 35 1HD2 LEU 35 8.793 4.957 -0.333 221 HD22 LEU 35 2HD2 LEU 35 8.962 6.374 0.704 222 HD23 LEU 35 3HD2 LEU 35 7.359 5.751 0.315 223 H SER 36 H SER 36 11.715 6.303 4.471 224 HA SER 36 HA SER 36 13.819 4.297 4.815 225 HB2 SER 36 1HB SER 36 14.605 5.876 6.629 226 HB3 SER 36 2HB SER 36 14.641 6.546 4.998 227 HG SER 36 HG SER 36 12.827 7.068 7.099 228 H GLY 37 H GLY 37 13.212 2.554 5.948 229 HA2 GLY 37 1HA GLY 37 12.716 1.937 8.332 230 HA3 GLY 37 2HA GLY 37 11.297 2.960 8.163 231 H VAL 38 H VAL 38 11.544 1.637 5.240 232 HA VAL 38 HA VAL 38 9.695 -0.538 5.904 233 HB VAL 38 HB VAL 38 10.289 0.709 3.211 234 HG11 VAL 38 1HG1 VAL 38 8.106 -1.160 4.117 235 HG12 VAL 38 2HG1 VAL 38 9.440 -1.549 3.032 236 HG13 VAL 38 3HG1 VAL 38 8.202 -0.398 2.530 237 HG21 VAL 38 1HG2 VAL 38 9.294 2.349 4.706 238 HG22 VAL 38 2HG2 VAL 38 8.001 1.219 5.109 239 HG23 VAL 38 3HG2 VAL 38 8.136 1.857 3.470 240 H GLY 39 H GLY 39 10.728 -2.420 6.192 241 HA2 GLY 39 1HA GLY 39 13.175 -3.037 4.779 242 HA3 GLY 39 2HA GLY 39 12.400 -4.026 5.999 243 H ALA 40 H ALA 40 12.225 -5.935 5.064 244 HA ALA 40 HA ALA 40 11.296 -6.091 2.293 245 HB1 ALA 40 1HB ALA 40 12.093 -8.406 2.342 246 HB2 ALA 40 2HB ALA 40 12.514 -8.223 4.044 247 HB3 ALA 40 3HB ALA 40 13.361 -7.280 2.821 248 H ASN 41 H ASN 41 10.547 -7.315 5.522 249 HA ASN 41 HA ASN 41 8.269 -8.809 4.527 250 HB2 ASN 41 1HB ASN 41 9.405 -8.471 7.305 251 HB3 ASN 41 2HB ASN 41 8.036 -9.497 6.909 252 HD21 ASN 41 1HD2 ASN 41 11.322 -11.348 6.962 253 HD22 ASN 41 2HD2 ASN 41 10.633 -10.182 8.034 254 H VAL 42 H VAL 42 8.503 -5.774 4.672 255 HA VAL 42 HA VAL 42 6.328 -5.053 6.440 256 HB VAL 42 HB VAL 42 7.872 -3.379 4.452 257 HG11 VAL 42 1HG1 VAL 42 5.750 -2.314 4.915 258 HG12 VAL 42 2HG1 VAL 42 7.038 -1.456 5.774 259 HG13 VAL 42 3HG1 VAL 42 5.973 -2.559 6.648 260 HG21 VAL 42 1HG2 VAL 42 8.179 -3.834 7.396 261 HG22 VAL 42 2HG2 VAL 42 8.948 -2.505 6.527 262 HG23 VAL 42 3HG2 VAL 42 9.350 -4.176 6.117 263 HA PRO 43 HA PRO 43 3.292 -5.770 3.298 264 HB2 PRO 43 2HB PRO 43 1.320 -4.237 4.594 265 HB3 PRO 43 1HB PRO 43 1.563 -5.967 4.730 266 HG2 PRO 43 2HG PRO 43 2.025 -3.970 6.698 267 HG3 PRO 43 1HG PRO 43 2.244 -5.717 6.842 268 HD2 PRO 43 2HD PRO 43 4.231 -3.643 6.554 269 HD3 PRO 43 1HD PRO 43 4.471 -5.358 6.900 270 H VAL 44 H VAL 44 2.766 -4.682 1.459 271 HA VAL 44 HA VAL 44 2.512 -1.775 1.602 272 HB VAL 44 HB VAL 44 3.916 -1.420 -0.367 273 HG11 VAL 44 1HG1 VAL 44 6.125 -1.872 0.662 274 HG12 VAL 44 2HG1 VAL 44 5.311 -2.843 1.893 275 HG13 VAL 44 3HG1 VAL 44 4.976 -1.116 1.766 276 HG21 VAL 44 1HG2 VAL 44 4.382 -4.377 -0.159 277 HG22 VAL 44 2HG2 VAL 44 5.455 -3.299 -1.044 278 HG23 VAL 44 3HG2 VAL 44 3.769 -3.458 -1.537 279 H GLY 45 H GLY 45 1.515 -0.846 -0.260 280 HA2 GLY 45 1HA GLY 45 -0.099 -2.797 -1.767 281 HA3 GLY 45 2HA GLY 45 -0.677 -1.205 -1.309 282 H ILE 46 H ILE 46 0.158 -2.866 -3.834 283 HA ILE 46 HA ILE 46 1.885 -0.959 -5.184 284 HB ILE 46 HB ILE 46 0.693 -3.619 -5.931 285 HG12 ILE 46 1HG1 ILE 46 2.888 -4.490 -5.926 286 HG13 ILE 46 2HG1 ILE 46 3.603 -2.908 -6.048 287 HG21 ILE 46 1HG2 ILE 46 1.803 -3.472 -8.105 288 HG22 ILE 46 2HG2 ILE 46 2.286 -1.815 -7.739 289 HG23 ILE 46 3HG2 ILE 46 0.576 -2.218 -7.910 290 HD11 ILE 46 1HD1 ILE 46 3.064 -2.444 -3.746 291 HD12 ILE 46 2HD1 ILE 46 4.008 -3.928 -3.904 292 HD13 ILE 46 3HD1 ILE 46 2.268 -4.015 -3.614 293 H ASN 47 H ASN 47 1.000 0.734 -6.203 294 HA ASN 47 HA ASN 47 -0.377 2.018 -7.479 295 HB2 ASN 47 1HB ASN 47 -0.232 -0.080 -8.960 296 HB3 ASN 47 2HB ASN 47 -1.808 -0.497 -8.316 297 HD21 ASN 47 1HD2 ASN 47 -2.996 1.155 -11.151 298 HD22 ASN 47 2HD2 ASN 47 -2.656 -0.371 -10.424 299 H CYS 48 H CYS 48 -1.098 2.302 -5.045 300 HA CYS 48 HA CYS 48 -3.866 1.478 -4.668 301 HB2 CYS 48 2HB CYS 48 -2.006 2.950 -2.799 302 HB3 CYS 48 1HB CYS 48 -3.586 2.317 -2.403 303 H ASN 49 H ASN 49 -5.556 2.834 -4.631 304 HA ASN 49 HA ASN 49 -5.075 5.706 -4.374 305 HB2 ASN 49 1HB ASN 49 -6.758 6.244 -6.061 306 HB3 ASN 49 2HB ASN 49 -5.445 5.328 -6.773 307 HD21 ASN 49 1HD2 ASN 49 -7.437 2.602 -7.689 308 HD22 ASN 49 2HD2 ASN 49 -5.833 3.219 -7.482 309 HA PRO 50 HA PRO 50 -8.016 5.391 -1.240 310 HB2 PRO 50 2HB PRO 50 -8.986 8.096 -1.800 311 HB3 PRO 50 1HB PRO 50 -8.031 7.518 -0.432 312 HG2 PRO 50 2HG PRO 50 -6.995 9.134 -2.336 313 HG3 PRO 50 1HG PRO 50 -6.024 7.914 -1.493 314 HD2 PRO 50 2HD PRO 50 -7.279 7.789 -4.212 315 HD3 PRO 50 1HD PRO 50 -5.661 7.271 -3.706 316 H ILE 51 H ILE 51 -9.841 4.286 -1.311 317 HA ILE 51 HA ILE 51 -11.576 4.437 -3.603 318 HB ILE 51 HB ILE 51 -12.343 2.951 -1.127 319 HG12 ILE 51 1HG1 ILE 51 -10.201 2.097 -3.081 320 HG13 ILE 51 2HG1 ILE 51 -9.959 2.461 -1.381 321 HG21 ILE 51 1HG2 ILE 51 -13.821 2.966 -3.079 322 HG22 ILE 51 2HG2 ILE 51 -13.194 1.347 -2.766 323 HG23 ILE 51 3HG2 ILE 51 -12.516 2.318 -4.074 324 HD11 ILE 51 1HD1 ILE 51 -10.001 0.065 -1.791 325 HD12 ILE 51 2HD1 ILE 51 -11.623 0.208 -2.467 326 HD13 ILE 51 3HD1 ILE 51 -11.343 0.566 -0.763 327 H THR 52 H THR 52 -12.356 6.568 -3.463 328 HA THR 52 HA THR 52 -14.300 6.957 -1.291 329 HB THR 52 HB THR 52 -13.943 9.404 -1.592 330 HG1 THR 52 1HG THR 52 -12.949 9.918 -3.394 331 HG21 THR 52 1HG2 THR 52 -11.434 7.828 -0.971 332 HG22 THR 52 2HG2 THR 52 -12.748 8.146 0.161 333 HG23 THR 52 3HG2 THR 52 -11.774 9.482 -0.456 334 H GLY 53 H GLY 53 -14.624 5.653 -3.886 335 HA2 GLY 53 1HA GLY 53 -16.186 7.517 -5.478 336 HA3 GLY 53 2HA GLY 53 -15.809 5.852 -5.892 337 H ILE 54 H ILE 54 -17.714 4.912 -6.241 338 HA ILE 54 HA ILE 54 -20.008 5.638 -4.607 339 HB ILE 54 HB ILE 54 -19.817 3.871 -7.049 340 HG12 ILE 54 1HG1 ILE 54 -20.982 6.644 -6.717 341 HG13 ILE 54 2HG1 ILE 54 -19.414 6.294 -7.436 342 HG21 ILE 54 1HG2 ILE 54 -22.307 4.877 -5.677 343 HG22 ILE 54 2HG2 ILE 54 -21.646 3.254 -5.468 344 HG23 ILE 54 3HG2 ILE 54 -22.213 3.780 -7.059 345 HD11 ILE 54 1HD1 ILE 54 -20.509 5.038 -9.213 346 HD12 ILE 54 2HD1 ILE 54 -21.095 6.700 -9.135 347 HD13 ILE 54 3HD1 ILE 54 -22.081 5.386 -8.492 348 H GLY 55 H GLY 55 -21.003 4.366 -3.185 349 HA2 GLY 55 1HA GLY 55 -19.704 1.946 -2.341 350 HA3 GLY 55 2HA GLY 55 -21.124 2.676 -1.618 351 H ALA 56 H ALA 56 -20.155 -0.050 -2.943 352 HA ALA 56 HA ALA 56 -22.259 -0.539 -4.848 353 HB1 ALA 56 1HB ALA 56 -20.083 -1.648 -5.055 354 HB2 ALA 56 2HB ALA 56 -21.392 -2.821 -4.905 355 HB3 ALA 56 3HB ALA 56 -20.356 -2.472 -3.520 356 H GLY 57 H GLY 57 -21.453 -1.897 -1.652 357 HA2 GLY 57 1HA GLY 57 -24.350 -2.169 -1.159 358 HA3 GLY 57 2HA GLY 57 -23.227 -3.458 -0.741 359 H SER 58 H SER 58 -21.592 -3.006 0.865 360 HA SER 58 HA SER 58 -22.633 -1.359 3.000 361 HB2 SER 58 1HB SER 58 -20.094 -3.009 2.894 362 HB3 SER 58 2HB SER 58 -20.848 -2.342 4.343 363 HG SER 58 HG SER 58 -22.525 -3.880 2.786 364 H GLY 59 H GLY 59 -20.111 -1.233 0.611 365 HA2 GLY 59 1HA GLY 59 -19.724 1.569 1.047 366 HA3 GLY 59 2HA GLY 59 -18.345 0.619 1.587 367 H SER 60 H SER 60 -17.448 2.109 -0.200 368 HA SER 60 HA SER 60 -17.952 1.289 -2.898 369 HB2 SER 60 1HB SER 60 -17.214 3.588 -2.332 370 HB3 SER 60 2HB SER 60 -15.669 2.942 -1.775 371 HG SER 60 HG SER 60 -16.725 2.782 -4.410 372 H SER 61 H SER 61 -16.761 -0.084 -4.165 373 HA SER 61 HA SER 61 -14.979 -1.872 -2.681 374 HB2 SER 61 1HB SER 61 -16.565 -2.340 -5.213 375 HB3 SER 61 2HB SER 61 -15.559 -3.536 -4.403 376 HG SER 61 HG SER 61 -17.203 -2.521 -2.593 377 H CYS 62 H CYS 62 -13.083 -2.638 -3.631 378 HA CYS 62 HA CYS 62 -11.870 -0.839 -5.586 379 HB2 CYS 62 2HB CYS 62 -10.536 -1.217 -3.624 380 HB3 CYS 62 1HB CYS 62 -10.739 -2.962 -3.748 381 H ASN 63 H ASN 63 -11.209 -1.479 -7.571 382 HA ASN 63 HA ASN 63 -12.401 -3.713 -8.800 383 HB2 ASN 63 1HB ASN 63 -11.785 -1.741 -10.086 384 HB3 ASN 63 2HB ASN 63 -10.083 -1.993 -9.708 385 HD21 ASN 63 1HD2 ASN 63 -9.535 -4.317 -12.222 386 HD22 ASN 63 2HD2 ASN 63 -8.917 -3.458 -10.858 387 H ALA 64 H ALA 64 -9.297 -3.256 -7.266 388 HA ALA 64 HA ALA 64 -8.578 -6.005 -8.022 389 HB1 ALA 64 1HB ALA 64 -6.728 -3.780 -7.178 390 HB2 ALA 64 2HB ALA 64 -7.021 -4.297 -8.838 391 HB3 ALA 64 3HB ALA 64 -6.255 -5.400 -7.693 392 H ASN 65 H ASN 65 -6.970 -4.238 -5.465 393 HA ASN 65 HA ASN 65 -8.234 -6.017 -3.482 394 HB2 ASN 65 1HB ASN 65 -5.327 -5.234 -3.602 395 HB3 ASN 65 2HB ASN 65 -6.058 -6.233 -2.364 396 HD21 ASN 65 1HD2 ASN 65 -5.025 -7.751 -5.972 397 HD22 ASN 65 2HD2 ASN 65 -4.954 -6.062 -5.634 398 HA PRO 66 HA PRO 66 -8.632 -2.074 -1.377 399 HB2 PRO 66 2HB PRO 66 -10.433 -2.871 0.431 400 HB3 PRO 66 1HB PRO 66 -10.877 -2.664 -1.267 401 HG2 PRO 66 2HG PRO 66 -10.289 -5.170 0.244 402 HG3 PRO 66 1HG PRO 66 -11.538 -4.874 -0.976 403 HD2 PRO 66 2HD PRO 66 -9.084 -6.109 -1.449 404 HD3 PRO 66 1HD PRO 66 -10.098 -5.358 -2.694 405 H ALA 67 H ALA 67 -7.339 -1.299 0.217 406 HA ALA 67 HA ALA 67 -6.543 -3.106 2.387 407 HB1 ALA 67 1HB ALA 67 -4.193 -2.528 2.129 408 HB2 ALA 67 2HB ALA 67 -4.578 -1.557 0.707 409 HB3 ALA 67 3HB ALA 67 -4.819 -3.304 0.675 410 H CYS 68 H CYS 68 -5.715 -2.102 4.223 411 HA CYS 68 HA CYS 68 -6.142 0.801 4.426 412 HB2 CYS 68 2HB CYS 68 -7.474 -0.468 6.020 413 HB3 CYS 68 1HB CYS 68 -6.050 -1.333 6.575 414 H CYS 69 H CYS 69 -4.329 1.972 4.448 415 HA CYS 69 HA CYS 69 -1.840 0.575 5.127 416 HB2 CYS 69 2HB CYS 69 -2.107 2.842 3.166 417 HB3 CYS 69 1HB CYS 69 -0.727 1.794 3.433 418 H ASP 70 H ASP 70 -0.174 1.776 6.079 419 HA ASP 70 HA ASP 70 -0.995 3.677 8.025 420 HB2 ASP 70 1HB ASP 70 0.890 2.106 8.355 421 HB3 ASP 70 2HB ASP 70 1.786 2.929 7.081 422 H ASN 71 H ASN 71 1.060 3.906 5.152 423 HA ASN 71 HA ASN 71 0.204 6.682 4.735 424 HB2 ASN 71 1HB ASN 71 3.078 5.724 4.718 425 HB3 ASN 71 2HB ASN 71 2.556 7.260 4.049 426 HD21 ASN 71 1HD2 ASN 71 3.908 7.494 7.553 427 HD22 ASN 71 2HD2 ASN 71 4.447 6.637 6.147 428 H VAL 72 H VAL 72 -0.415 6.902 2.603 429 HA VAL 72 HA VAL 72 1.015 5.178 0.700 430 HB VAL 72 HB VAL 72 -0.839 4.461 -0.271 431 HG11 VAL 72 1HG1 VAL 72 -2.992 4.713 0.926 432 HG12 VAL 72 2HG1 VAL 72 -2.206 5.876 1.996 433 HG13 VAL 72 3HG1 VAL 72 -1.644 4.204 1.942 434 HG21 VAL 72 1HG2 VAL 72 -2.559 5.858 -1.211 435 HG22 VAL 72 2HG2 VAL 72 -0.973 6.585 -1.505 436 HG23 VAL 72 3HG2 VAL 72 -2.021 7.230 -0.239 437 H TYR 73 H TYR 73 1.385 6.080 -1.397 438 HA TYR 73 HA TYR 73 1.627 9.011 -1.283 439 HB2 TYR 73 2HB TYR 73 3.635 6.984 -2.268 440 HB3 TYR 73 1HB TYR 73 3.844 8.733 -2.353 441 HD1 TYR 73 1HD TYR 73 3.612 5.844 -0.049 442 HD2 TYR 73 2HD TYR 73 4.524 9.984 -0.430 443 HE1 TYR 73 1HE TYR 73 4.542 5.835 2.231 444 HE2 TYR 73 2HE TYR 73 5.465 9.988 1.841 445 HH TYR 73 HH TYR 73 6.236 7.223 3.534 446 H THR 74 H THR 74 1.912 9.992 -3.462 447 HA THR 74 HA THR 74 -0.397 9.205 -4.909 448 HB THR 74 HB THR 74 1.575 11.301 -5.787 449 HG1 THR 74 1HG THR 74 0.596 12.684 -4.314 450 HG21 THR 74 1HG2 THR 74 -1.434 11.105 -6.009 451 HG22 THR 74 2HG2 THR 74 -0.287 10.831 -7.320 452 HG23 THR 74 3HG2 THR 74 -0.440 12.436 -6.604 453 H ASN 75 H ASN 75 2.893 8.346 -5.318 454 HA ASN 75 HA ASN 75 2.771 7.662 -8.088 455 HB2 ASN 75 1HB ASN 75 4.691 6.241 -7.664 456 HB3 ASN 75 2HB ASN 75 4.911 7.753 -6.796 457 HD21 ASN 75 1HD2 ASN 75 5.652 4.698 -4.711 458 HD22 ASN 75 2HD2 ASN 75 6.045 5.078 -6.348 459 H GLY 76 H GLY 76 1.454 6.424 -5.218 460 HA2 GLY 76 1HA GLY 76 -0.429 4.966 -5.331 461 HA3 GLY 76 2HA GLY 76 0.332 4.144 -6.687 462 H LEU 77 H LEU 77 2.489 4.926 -4.097 463 HA LEU 77 HA LEU 77 2.576 2.067 -3.448 464 HB2 LEU 77 1HB LEU 77 4.638 3.266 -4.105 465 HB3 LEU 77 2HB LEU 77 4.451 4.304 -2.722 466 HG LEU 77 HG LEU 77 6.179 2.413 -2.595 467 HD11 LEU 77 1HD1 LEU 77 5.539 3.734 -0.664 468 HD12 LEU 77 2HD1 LEU 77 5.767 2.037 -0.222 469 HD13 LEU 77 3HD1 LEU 77 4.137 2.698 -0.404 470 HD21 LEU 77 1HD2 LEU 77 3.692 0.818 -2.025 471 HD22 LEU 77 2HD2 LEU 77 5.364 0.268 -1.861 472 HD23 LEU 77 3HD2 LEU 77 4.714 0.654 -3.454 473 H GLY 78 H GLY 78 1.601 1.330 -1.703 474 HA2 GLY 78 1HA GLY 78 1.053 3.206 0.501 475 HA3 GLY 78 2HA GLY 78 0.159 1.727 0.188 476 H VAL 79 H VAL 79 1.900 2.911 2.456 477 HA VAL 79 HA VAL 79 3.722 0.636 2.857 478 HB VAL 79 HB VAL 79 3.468 3.130 4.563 479 HG11 VAL 79 1HG1 VAL 79 5.668 1.085 4.294 480 HG12 VAL 79 2HG1 VAL 79 4.560 1.258 5.655 481 HG13 VAL 79 3HG1 VAL 79 5.730 2.530 5.303 482 HG21 VAL 79 1HG2 VAL 79 5.471 2.690 2.364 483 HG22 VAL 79 2HG2 VAL 79 5.300 4.112 3.400 484 HG23 VAL 79 3HG2 VAL 79 4.040 3.713 2.231 485 H GLN 80 H GLN 80 3.366 -0.833 4.407 486 HA GLN 80 HA GLN 80 2.303 -2.093 5.941 487 HB2 GLN 80 1HB GLN 80 1.880 0.668 7.043 488 HB3 GLN 80 2HB GLN 80 1.190 -0.731 7.855 489 HG2 GLN 80 1HG GLN 80 4.084 -0.580 7.153 490 HG3 GLN 80 2HG GLN 80 3.459 0.122 8.648 491 HE21 GLN 80 1HE2 GLN 80 4.655 -3.405 9.145 492 HE22 GLN 80 2HE2 GLN 80 5.357 -1.996 8.425 493 H CYS 81 H CYS 81 0.971 -2.268 3.859 494 HA CYS 81 HA CYS 81 -1.769 -1.336 4.209 495 HB2 CYS 81 2HB CYS 81 -0.432 -2.726 1.889 496 HB3 CYS 81 1HB CYS 81 -2.129 -2.279 1.928 497 H ASN 82 H ASN 82 -3.038 -2.519 5.402 498 HA ASN 82 HA ASN 82 -2.825 -5.445 5.192 499 HB2 ASN 82 1HB ASN 82 -4.305 -5.509 7.211 500 HB3 ASN 82 2HB ASN 82 -2.738 -4.769 7.483 501 HD21 ASN 82 1HD2 ASN 82 -4.019 -1.652 8.375 502 HD22 ASN 82 2HD2 ASN 82 -2.623 -2.592 7.977 503 HA PRO 83 HA PRO 83 -6.234 -5.535 2.453 504 HB2 PRO 83 2HB PRO 83 -6.883 -8.157 3.654 505 HB3 PRO 83 1HB PRO 83 -6.490 -7.753 1.983 506 HG2 PRO 83 2HG PRO 83 -4.747 -9.045 3.551 507 HG3 PRO 83 1HG PRO 83 -4.214 -7.853 2.352 508 HD2 PRO 83 2HD PRO 83 -4.474 -7.573 5.318 509 HD3 PRO 83 1HD PRO 83 -3.235 -6.929 4.225 510 H ILE 84 H ILE 84 -8.310 -4.934 2.466 511 HA ILE 84 HA ILE 84 -9.611 -4.438 4.995 512 HB ILE 84 HB ILE 84 -10.519 -3.938 2.171 513 HG12 ILE 84 1HG1 ILE 84 -8.591 -2.593 2.822 514 HG13 ILE 84 2HG1 ILE 84 -10.028 -1.592 2.661 515 HG21 ILE 84 1HG2 ILE 84 -12.445 -4.188 3.646 516 HG22 ILE 84 2HG2 ILE 84 -12.270 -2.530 3.073 517 HG23 ILE 84 3HG2 ILE 84 -11.779 -2.952 4.713 518 HD11 ILE 84 1HD1 ILE 84 -8.774 -2.555 5.211 519 HD12 ILE 84 2HD1 ILE 84 -10.306 -1.688 5.113 520 HD13 ILE 84 3HD1 ILE 84 -8.814 -0.904 4.593 521 H ASN 85 H ASN 85 -11.531 -5.244 5.668 522 HA ASN 85 HA ASN 85 -12.170 -7.948 4.970 523 HB2 ASN 85 1HB ASN 85 -12.390 -7.258 7.271 524 HB3 ASN 85 2HB ASN 85 -13.453 -5.931 6.825 525 HD21 ASN 85 1HD2 ASN 85 -16.039 -8.008 7.859 526 HD22 ASN 85 2HD2 ASN 85 -15.080 -6.603 8.171 527 H VAL 86 H VAL 86 -12.862 -8.007 2.891 528 HA VAL 86 HA VAL 86 -15.474 -6.782 2.357 529 HB VAL 86 HB VAL 86 -14.749 -6.744 -0.100 530 HG11 VAL 86 1HG1 VAL 86 -14.976 -4.702 1.188 531 HG12 VAL 86 2HG1 VAL 86 -13.570 -4.597 0.128 532 HG13 VAL 86 3HG1 VAL 86 -13.354 -4.915 1.848 533 HG21 VAL 86 1HG2 VAL 86 -12.780 -8.200 0.183 534 HG22 VAL 86 2HG2 VAL 86 -12.000 -6.932 1.129 535 HG23 VAL 86 3HG2 VAL 86 -12.374 -6.660 -0.573 536 H ASN 87 H ASN 87 -16.498 -8.625 2.975 537 HA ASN 87 HA ASN 87 -17.124 -10.806 3.119 538 HB2 ASN 87 1HB ASN 87 -17.821 -10.306 0.737 539 HB3 ASN 87 2HB ASN 87 -16.292 -11.006 0.212 540 HD21 ASN 87 1HD2 ASN 87 -17.273 -14.328 0.693 541 HD22 ASN 87 2HD2 ASN 87 -15.961 -13.227 0.442 542 H LEU 88 H LEU 88 -15.197 -10.887 4.495 543 HA LEU 88 HA LEU 88 -12.688 -11.766 3.574 544 HB2 LEU 88 1HB LEU 88 -13.142 -10.594 5.728 545 HB3 LEU 88 2HB LEU 88 -13.868 -12.067 6.334 546 HG LEU 88 HG LEU 88 -11.694 -13.219 6.095 547 HD11 LEU 88 1HD1 LEU 88 -9.677 -11.894 5.691 548 HD12 LEU 88 2HD1 LEU 88 -10.674 -10.478 5.358 549 HD13 LEU 88 3HD1 LEU 88 -10.751 -11.881 4.294 550 HD21 LEU 88 1HD2 LEU 88 -11.656 -10.688 7.732 551 HD22 LEU 88 2HD2 LEU 88 -10.575 -12.062 7.953 552 HD23 LEU 88 3HD2 LEU 88 -12.307 -12.250 8.228 Start of MODEL 18 1 H1 GLY 1 1H GLY 1 -13.752 12.231 8.797 2 H2 GLY 1 2H GLY 1 -14.027 10.813 9.675 3 H3 GLY 1 3H GLY 1 -14.970 11.161 8.319 4 HA2 GLY 1 1HA GLY 1 -12.073 10.539 8.327 5 HA3 GLY 1 2HA GLY 1 -13.359 9.481 7.763 6 H SER 2 H SER 2 -12.539 9.359 5.657 7 HA SER 2 HA SER 2 -12.791 11.866 4.131 8 HB2 SER 2 1HB SER 2 -10.921 9.553 3.565 9 HB3 SER 2 2HB SER 2 -11.053 11.034 2.614 10 HG SER 2 HG SER 2 -10.631 11.977 4.914 11 H GLY 3 H GLY 3 -14.748 9.686 4.759 12 HA2 GLY 3 1HA GLY 3 -16.611 9.124 3.390 13 HA3 GLY 3 2HA GLY 3 -15.560 9.183 1.983 14 H SER 4 H SER 4 -14.785 7.512 4.967 15 HA SER 4 HA SER 4 -15.493 4.940 3.859 16 HB2 SER 4 1HB SER 4 -13.118 4.095 4.177 17 HB3 SER 4 2HB SER 4 -13.384 5.157 2.796 18 HG SER 4 HG SER 4 -12.567 6.254 5.251 19 H SER 5 H SER 5 -15.787 3.395 5.402 20 HA SER 5 HA SER 5 -15.676 4.375 8.156 21 HB2 SER 5 1HB SER 5 -17.130 1.963 7.051 22 HB3 SER 5 2HB SER 5 -17.340 2.683 8.646 23 HG SER 5 HG SER 5 -18.058 3.740 6.119 24 H GLN 6 H GLN 6 -14.229 2.028 6.065 25 HA GLN 6 HA GLN 6 -13.434 0.255 8.175 26 HB2 GLN 6 1HB GLN 6 -12.932 0.365 5.251 27 HB3 GLN 6 2HB GLN 6 -11.946 -0.677 6.255 28 HG2 GLN 6 1HG GLN 6 -13.750 -1.911 5.264 29 HG3 GLN 6 2HG GLN 6 -13.956 -1.838 7.009 30 HE21 GLN 6 1HE2 GLN 6 -17.003 -0.159 6.888 31 HE22 GLN 6 2HE2 GLN 6 -15.683 -0.710 7.865 32 H CYS 7 H CYS 7 -11.538 0.045 9.155 33 HA CYS 7 HA CYS 7 -9.375 0.266 9.741 34 HB2 CYS 7 2HB CYS 7 -8.775 0.048 7.417 35 HB3 CYS 7 1HB CYS 7 -9.108 1.754 7.135 36 H ASN 8 H ASN 8 -8.361 1.493 11.149 37 HA ASN 8 HA ASN 8 -9.294 4.220 11.566 38 HB2 ASN 8 1HB ASN 8 -7.659 2.322 13.240 39 HB3 ASN 8 2HB ASN 8 -7.889 4.011 13.679 40 HD21 ASN 8 1HD2 ASN 8 -11.156 3.627 14.795 41 HD22 ASN 8 2HD2 ASN 8 -9.901 4.719 14.327 42 H ALA 9 H ALA 9 -6.485 2.489 10.498 43 HA ALA 9 HA ALA 9 -4.517 4.413 11.060 44 HB1 ALA 9 1HB ALA 9 -3.969 2.092 10.573 45 HB2 ALA 9 2HB ALA 9 -3.108 3.183 9.485 46 HB3 ALA 9 3HB ALA 9 -4.527 2.304 8.913 47 H GLY 10 H GLY 10 -6.792 4.143 8.510 48 HA2 GLY 10 1HA GLY 10 -6.424 6.807 7.660 49 HA3 GLY 10 2HA GLY 10 -5.610 5.724 6.538 50 HA PRO 11 HA PRO 11 -9.937 5.563 5.105 51 HB2 PRO 11 2HB PRO 11 -9.573 6.394 2.608 52 HB3 PRO 11 1HB PRO 11 -9.579 7.563 3.937 53 HG2 PRO 11 2HG PRO 11 -7.276 6.413 2.430 54 HG3 PRO 11 1HG PRO 11 -7.508 8.062 3.023 55 HD2 PRO 11 2HD PRO 11 -6.016 6.053 4.278 56 HD3 PRO 11 1HD PRO 11 -6.576 7.555 5.040 57 H VAL 12 H VAL 12 -10.747 4.273 3.168 58 HA VAL 12 HA VAL 12 -9.224 1.853 2.927 59 HB VAL 12 HB VAL 12 -11.056 1.143 1.359 60 HG11 VAL 12 1HG1 VAL 12 -11.099 0.582 3.717 61 HG12 VAL 12 2HG1 VAL 12 -12.729 0.920 3.132 62 HG13 VAL 12 3HG1 VAL 12 -11.868 2.125 4.090 63 HG21 VAL 12 1HG2 VAL 12 -12.257 3.783 2.181 64 HG22 VAL 12 2HG2 VAL 12 -13.087 2.510 1.286 65 HG23 VAL 12 3HG2 VAL 12 -11.716 3.353 0.561 66 H GLN 13 H GLN 13 -7.925 1.257 1.353 67 HA GLN 13 HA GLN 13 -7.672 3.041 -0.979 68 HB2 GLN 13 1HB GLN 13 -5.435 1.216 -0.322 69 HB3 GLN 13 2HB GLN 13 -5.392 2.870 -0.909 70 HG2 GLN 13 1HG GLN 13 -6.151 2.223 1.917 71 HG3 GLN 13 2HG GLN 13 -4.475 2.368 1.412 72 HE21 GLN 13 1HE2 GLN 13 -6.479 5.853 0.828 73 HE22 GLN 13 2HE2 GLN 13 -7.034 4.387 0.112 74 H CYS 14 H CYS 14 -7.200 2.028 -2.983 75 HA CYS 14 HA CYS 14 -7.790 -0.850 -3.087 76 HB2 CYS 14 2HB CYS 14 -9.726 0.423 -3.908 77 HB3 CYS 14 1HB CYS 14 -8.707 1.259 -5.068 78 H CYS 15 H CYS 15 -6.142 -1.934 -3.797 79 HA CYS 15 HA CYS 15 -4.036 -0.510 -5.287 80 HB2 CYS 15 2HB CYS 15 -3.710 -2.776 -3.309 81 HB3 CYS 15 1HB CYS 15 -2.428 -1.802 -4.033 82 H ASN 16 H ASN 16 -2.992 -1.559 -6.914 83 HA ASN 16 HA ASN 16 -4.380 -3.566 -8.349 84 HB2 ASN 16 1HB ASN 16 -2.742 -1.803 -9.226 85 HB3 ASN 16 2HB ASN 16 -1.477 -2.886 -8.679 86 HD21 ASN 16 1HD2 ASN 16 -2.438 -3.396 -12.302 87 HD22 ASN 16 2HD2 ASN 16 -2.181 -1.963 -11.371 88 H THR 17 H THR 17 -1.490 -3.601 -6.329 89 HA THR 17 HA THR 17 -1.775 -6.503 -6.039 90 HB THR 17 HB THR 17 0.830 -5.067 -6.630 91 HG1 THR 17 1HG THR 17 -0.782 -6.878 -8.129 92 HG21 THR 17 1HG2 THR 17 0.271 -7.965 -6.014 93 HG22 THR 17 2HG2 THR 17 1.251 -6.844 -5.063 94 HG23 THR 17 3HG2 THR 17 1.793 -7.356 -6.663 95 H LEU 18 H LEU 18 -1.933 -6.972 -3.926 96 HA LEU 18 HA LEU 18 -0.551 -5.250 -1.991 97 HB2 LEU 18 1HB LEU 18 -2.584 -7.456 -1.650 98 HB3 LEU 18 2HB LEU 18 -1.687 -6.791 -0.300 99 HG LEU 18 HG LEU 18 -3.584 -5.277 -2.081 100 HD11 LEU 18 1HD1 LEU 18 -4.585 -6.879 -0.431 101 HD12 LEU 18 2HD1 LEU 18 -5.029 -5.194 -0.178 102 HD13 LEU 18 3HD1 LEU 18 -3.809 -5.946 0.853 103 HD21 LEU 18 1HD2 LEU 18 -3.226 -3.411 -0.545 104 HD22 LEU 18 2HD2 LEU 18 -1.731 -3.865 -1.357 105 HD23 LEU 18 3HD2 LEU 18 -2.006 -4.348 0.318 106 H THR 19 H THR 19 1.412 -5.788 -1.418 107 HA THR 19 HA THR 19 2.173 -8.558 -1.128 108 HB THR 19 HB THR 19 2.584 -8.328 -3.481 109 HG1 THR 19 1HG THR 19 4.312 -9.426 -3.006 110 HG21 THR 19 1HG2 THR 19 2.636 -5.967 -3.812 111 HG22 THR 19 2HG2 THR 19 4.188 -6.602 -4.357 112 HG23 THR 19 3HG2 THR 19 4.066 -5.794 -2.793 113 H SER 20 H SER 20 4.796 -8.422 -0.722 114 HA SER 20 HA SER 20 4.956 -6.687 1.614 115 HB2 SER 20 1HB SER 20 6.945 -8.033 2.187 116 HB3 SER 20 2HB SER 20 5.546 -9.061 1.878 117 HG SER 20 HG SER 20 6.386 -9.598 -0.107 118 H ALA 21 H ALA 21 7.027 -5.545 2.030 119 HA ALA 21 HA ALA 21 7.669 -3.873 -0.178 120 HB1 ALA 21 1HB ALA 21 9.152 -2.743 1.351 121 HB2 ALA 21 2HB ALA 21 9.069 -4.092 2.484 122 HB3 ALA 21 3HB ALA 21 7.633 -3.116 2.165 123 H SER 22 H SER 22 8.702 -6.928 0.517 124 HA SER 22 HA SER 22 11.385 -6.621 -0.518 125 HB2 SER 22 1HB SER 22 10.927 -8.303 1.210 126 HB3 SER 22 2HB SER 22 9.812 -9.114 0.124 127 HG SER 22 HG SER 22 11.859 -9.048 -1.318 128 H ASN 23 H ASN 23 8.354 -6.637 -1.833 129 HA ASN 23 HA ASN 23 8.873 -8.210 -4.186 130 HB2 ASN 23 1HB ASN 23 6.563 -7.666 -3.216 131 HB3 ASN 23 2HB ASN 23 6.761 -6.060 -3.907 132 HD21 ASN 23 1HD2 ASN 23 5.792 -9.224 -6.226 133 HD22 ASN 23 2HD2 ASN 23 6.166 -9.395 -4.546 134 H SER 24 H SER 24 9.618 -7.531 -6.121 135 HA SER 24 HA SER 24 11.290 -5.300 -6.245 136 HB2 SER 24 1HB SER 24 10.089 -6.885 -8.527 137 HB3 SER 24 2HB SER 24 11.492 -5.821 -8.637 138 HG SER 24 HG SER 24 11.949 -8.119 -8.350 139 H GLN 25 H GLN 25 7.895 -5.646 -7.004 140 HA GLN 25 HA GLN 25 7.609 -3.267 -8.511 141 HB2 GLN 25 1HB GLN 25 5.924 -5.124 -8.409 142 HB3 GLN 25 2HB GLN 25 5.544 -4.622 -6.759 143 HG2 GLN 25 1HG GLN 25 3.905 -3.698 -8.169 144 HG3 GLN 25 2HG GLN 25 4.968 -2.394 -7.649 145 HE21 GLN 25 1HE2 GLN 25 6.128 -1.603 -10.848 146 HE22 GLN 25 2HE2 GLN 25 6.344 -1.410 -9.143 147 H ALA 26 H ALA 26 7.114 -4.081 -5.104 148 HA ALA 26 HA ALA 26 6.318 -1.499 -4.282 149 HB1 ALA 26 1HB ALA 26 5.804 -3.477 -2.977 150 HB2 ALA 26 2HB ALA 26 6.748 -2.338 -2.014 151 HB3 ALA 26 3HB ALA 26 7.521 -3.767 -2.700 152 H ALA 27 H ALA 27 9.434 -3.214 -4.007 153 HA ALA 27 HA ALA 27 10.760 -1.122 -2.672 154 HB1 ALA 27 1HB ALA 27 11.961 -3.275 -4.417 155 HB2 ALA 27 2HB ALA 27 11.591 -3.426 -2.699 156 HB3 ALA 27 3HB ALA 27 12.826 -2.287 -3.239 157 H GLY 28 H GLY 28 10.251 -1.711 -6.113 158 HA2 GLY 28 1HA GLY 28 12.046 0.212 -7.112 159 HA3 GLY 28 2HA GLY 28 10.551 -0.283 -7.897 160 H LEU 29 H LEU 29 8.710 0.475 -6.049 161 HA LEU 29 HA LEU 29 8.420 3.277 -6.464 162 HB2 LEU 29 1HB LEU 29 6.966 1.386 -4.655 163 HB3 LEU 29 2HB LEU 29 6.424 2.983 -5.064 164 HG LEU 29 HG LEU 29 6.716 0.696 -7.006 165 HD11 LEU 29 1HD1 LEU 29 4.239 0.851 -7.096 166 HD12 LEU 29 2HD1 LEU 29 4.305 1.967 -5.732 167 HD13 LEU 29 3HD1 LEU 29 4.865 0.304 -5.540 168 HD21 LEU 29 1HD2 LEU 29 5.565 2.189 -8.581 169 HD22 LEU 29 2HD2 LEU 29 7.127 2.835 -8.083 170 HD23 LEU 29 3HD2 LEU 29 5.642 3.491 -7.393 171 H ILE 30 H ILE 30 8.967 1.291 -3.575 172 HA ILE 30 HA ILE 30 9.151 3.209 -1.605 173 HB ILE 30 HB ILE 30 10.711 0.654 -1.927 174 HG12 ILE 30 1HG1 ILE 30 8.229 1.308 -0.340 175 HG13 ILE 30 2HG1 ILE 30 8.237 0.488 -1.891 176 HG21 ILE 30 1HG2 ILE 30 11.398 0.768 0.300 177 HG22 ILE 30 2HG2 ILE 30 10.237 2.030 0.691 178 HG23 ILE 30 3HG2 ILE 30 11.654 2.415 -0.292 179 HD11 ILE 30 1HD1 ILE 30 9.518 -0.536 0.620 180 HD12 ILE 30 2HD1 ILE 30 9.414 -1.372 -0.931 181 HD13 ILE 30 3HD1 ILE 30 7.948 -1.029 -0.010 182 H GLN 31 H GLN 31 11.744 1.951 -3.645 183 HA GLN 31 HA GLN 31 13.689 3.670 -2.582 184 HB2 GLN 31 1HB GLN 31 13.579 1.899 -4.996 185 HB3 GLN 31 2HB GLN 31 15.004 2.874 -4.635 186 HG2 GLN 31 1HG GLN 31 15.143 1.741 -2.450 187 HG3 GLN 31 2HG GLN 31 13.760 0.756 -2.917 188 HE21 GLN 31 1HE2 GLN 31 15.551 -1.436 -4.934 189 HE22 GLN 31 2HE2 GLN 31 14.001 -0.840 -4.450 190 H GLN 32 H GLN 32 11.247 4.108 -4.976 191 HA GLN 32 HA GLN 32 12.510 6.330 -6.290 192 HB2 GLN 32 1HB GLN 32 9.705 5.280 -6.180 193 HB3 GLN 32 2HB GLN 32 10.005 6.887 -6.823 194 HG2 GLN 32 1HG GLN 32 11.241 4.344 -7.837 195 HG3 GLN 32 2HG GLN 32 9.863 5.182 -8.548 196 HE21 GLN 32 1HE2 GLN 32 13.647 6.494 -9.170 197 HE22 GLN 32 2HE2 GLN 32 13.297 5.230 -8.043 198 H LEU 33 H LEU 33 10.132 5.967 -3.725 199 HA LEU 33 HA LEU 33 9.834 8.769 -3.264 200 HB2 LEU 33 1HB LEU 33 9.213 6.713 -1.192 201 HB3 LEU 33 2HB LEU 33 8.337 8.174 -1.591 202 HG LEU 33 HG LEU 33 8.418 5.736 -3.363 203 HD11 LEU 33 1HD1 LEU 33 6.233 5.187 -2.540 204 HD12 LEU 33 2HD1 LEU 33 6.254 6.574 -1.451 205 HD13 LEU 33 3HD1 LEU 33 7.376 5.235 -1.201 206 HD21 LEU 33 1HD2 LEU 33 6.320 6.825 -4.266 207 HD22 LEU 33 2HD2 LEU 33 7.859 7.598 -4.671 208 HD23 LEU 33 3HD2 LEU 33 6.833 8.284 -3.406 209 H GLY 34 H GLY 34 11.988 6.312 -2.211 210 HA2 GLY 34 1HA GLY 34 13.971 6.506 -1.043 211 HA3 GLY 34 2HA GLY 34 13.598 8.198 -0.732 212 H LEU 35 H LEU 35 11.582 5.418 -0.059 213 HA LEU 35 HA LEU 35 11.040 6.295 2.588 214 HB2 LEU 35 1HB LEU 35 10.385 3.811 1.067 215 HB3 LEU 35 2HB LEU 35 9.873 4.038 2.715 216 HG LEU 35 HG LEU 35 9.054 5.659 0.318 217 HD11 LEU 35 1HD1 LEU 35 7.518 3.856 2.173 218 HD12 LEU 35 2HD1 LEU 35 7.959 3.508 0.500 219 HD13 LEU 35 3HD1 LEU 35 6.827 4.812 0.861 220 HD21 LEU 35 1HD2 LEU 35 7.593 6.887 1.870 221 HD22 LEU 35 2HD2 LEU 35 9.302 7.155 2.205 222 HD23 LEU 35 3HD2 LEU 35 8.364 6.061 3.224 223 H SER 36 H SER 36 12.572 6.212 4.083 224 HA SER 36 HA SER 36 14.307 3.857 4.231 225 HB2 SER 36 1HB SER 36 15.318 6.159 4.206 226 HB3 SER 36 2HB SER 36 14.521 6.471 5.746 227 HG SER 36 HG SER 36 15.828 5.055 6.743 228 H GLY 37 H GLY 37 13.488 2.269 5.457 229 HA2 GLY 37 1HA GLY 37 13.187 1.932 7.997 230 HA3 GLY 37 2HA GLY 37 11.815 3.007 7.766 231 H VAL 38 H VAL 38 11.385 1.802 5.063 232 HA VAL 38 HA VAL 38 9.609 -0.314 5.871 233 HB VAL 38 HB VAL 38 10.364 0.477 3.052 234 HG11 VAL 38 1HG1 VAL 38 9.148 -1.603 3.224 235 HG12 VAL 38 2HG1 VAL 38 8.111 -0.357 2.531 236 HG13 VAL 38 3HG1 VAL 38 7.916 -0.831 4.217 237 HG21 VAL 38 1HG2 VAL 38 8.215 1.658 4.808 238 HG22 VAL 38 2HG2 VAL 38 8.451 2.004 3.095 239 HG23 VAL 38 3HG2 VAL 38 9.680 2.476 4.268 240 H GLY 39 H GLY 39 10.482 -2.231 6.391 241 HA2 GLY 39 1HA GLY 39 12.919 -3.192 5.192 242 HA3 GLY 39 2HA GLY 39 11.970 -4.008 6.418 243 H ALA 40 H ALA 40 11.853 -6.000 5.513 244 HA ALA 40 HA ALA 40 10.835 -6.178 2.758 245 HB1 ALA 40 1HB ALA 40 12.374 -8.151 4.429 246 HB2 ALA 40 2HB ALA 40 12.929 -7.288 2.994 247 HB3 ALA 40 3HB ALA 40 11.686 -8.530 2.853 248 H ASN 41 H ASN 41 10.146 -7.089 6.057 249 HA ASN 41 HA ASN 41 7.974 -8.851 5.292 250 HB2 ASN 41 1HB ASN 41 9.355 -9.302 7.309 251 HB3 ASN 41 2HB ASN 41 8.751 -7.817 8.033 252 HD21 ASN 41 1HD2 ASN 41 5.751 -9.196 9.118 253 HD22 ASN 41 2HD2 ASN 41 6.737 -7.787 8.942 254 H VAL 42 H VAL 42 8.430 -5.586 5.546 255 HA VAL 42 HA VAL 42 6.037 -4.677 6.710 256 HB VAL 42 HB VAL 42 7.761 -3.293 4.656 257 HG11 VAL 42 1HG1 VAL 42 5.684 -2.238 6.569 258 HG12 VAL 42 2HG1 VAL 42 5.703 -2.095 4.811 259 HG13 VAL 42 3HG1 VAL 42 6.896 -1.222 5.785 260 HG21 VAL 42 1HG2 VAL 42 8.729 -2.205 6.679 261 HG22 VAL 42 2HG2 VAL 42 9.110 -3.920 6.488 262 HG23 VAL 42 3HG2 VAL 42 7.874 -3.410 7.646 263 HA PRO 43 HA PRO 43 3.226 -5.576 3.392 264 HB2 PRO 43 2HB PRO 43 1.181 -4.051 4.563 265 HB3 PRO 43 1HB PRO 43 1.442 -5.772 4.762 266 HG2 PRO 43 2HG PRO 43 1.781 -3.708 6.694 267 HG3 PRO 43 1HG PRO 43 2.017 -5.449 6.899 268 HD2 PRO 43 2HD PRO 43 3.981 -3.345 6.613 269 HD3 PRO 43 1HD PRO 43 4.225 -5.035 7.069 270 H VAL 44 H VAL 44 2.645 -4.480 1.546 271 HA VAL 44 HA VAL 44 2.476 -1.567 1.659 272 HB VAL 44 HB VAL 44 3.897 -1.259 -0.300 273 HG11 VAL 44 1HG1 VAL 44 4.971 -0.978 1.829 274 HG12 VAL 44 2HG1 VAL 44 6.098 -1.770 0.727 275 HG13 VAL 44 3HG1 VAL 44 5.258 -2.712 1.961 276 HG21 VAL 44 1HG2 VAL 44 4.267 -4.227 -0.095 277 HG22 VAL 44 2HG2 VAL 44 5.390 -3.187 -0.964 278 HG23 VAL 44 3HG2 VAL 44 3.706 -3.282 -1.478 279 H GLY 45 H GLY 45 1.568 -0.660 -0.318 280 HA2 GLY 45 1HA GLY 45 -0.042 -2.641 -1.790 281 HA3 GLY 45 2HA GLY 45 -0.663 -1.063 -1.341 282 H ILE 46 H ILE 46 0.102 -2.645 -3.887 283 HA ILE 46 HA ILE 46 1.864 -0.731 -5.202 284 HB ILE 46 HB ILE 46 0.734 -3.417 -5.969 285 HG12 ILE 46 1HG1 ILE 46 2.971 -4.232 -5.964 286 HG13 ILE 46 2HG1 ILE 46 3.636 -2.626 -5.965 287 HG21 ILE 46 1HG2 ILE 46 1.901 -3.249 -8.110 288 HG22 ILE 46 2HG2 ILE 46 2.343 -1.584 -7.731 289 HG23 ILE 46 3HG2 ILE 46 0.646 -2.020 -7.945 290 HD11 ILE 46 1HD1 ILE 46 3.025 -2.310 -3.673 291 HD12 ILE 46 2HD1 ILE 46 3.966 -3.791 -3.871 292 HD13 ILE 46 3HD1 ILE 46 2.216 -3.879 -3.658 293 H ASN 47 H ASN 47 0.947 0.956 -6.225 294 HA ASN 47 HA ASN 47 -0.440 2.205 -7.534 295 HB2 ASN 47 1HB ASN 47 -0.207 0.085 -8.991 296 HB3 ASN 47 2HB ASN 47 -1.800 -0.344 -8.396 297 HD21 ASN 47 1HD2 ASN 47 -1.337 2.467 -11.254 298 HD22 ASN 47 2HD2 ASN 47 0.014 1.740 -10.453 299 H CYS 48 H CYS 48 -1.203 2.487 -5.121 300 HA CYS 48 HA CYS 48 -3.913 1.493 -4.722 301 HB2 CYS 48 2HB CYS 48 -2.072 3.015 -2.876 302 HB3 CYS 48 1HB CYS 48 -3.644 2.369 -2.446 303 H ASN 49 H ASN 49 -5.663 2.697 -4.888 304 HA ASN 49 HA ASN 49 -5.421 5.585 -4.473 305 HB2 ASN 49 1HB ASN 49 -7.349 5.831 -6.166 306 HB3 ASN 49 2HB ASN 49 -5.730 5.580 -6.790 307 HD21 ASN 49 1HD2 ASN 49 -8.021 2.210 -6.925 308 HD22 ASN 49 2HD2 ASN 49 -7.825 3.082 -5.444 309 HA PRO 50 HA PRO 50 -8.288 4.891 -1.309 310 HB2 PRO 50 2HB PRO 50 -9.356 7.599 -1.712 311 HB3 PRO 50 1HB PRO 50 -8.452 6.943 -0.343 312 HG2 PRO 50 2HG PRO 50 -7.351 8.713 -2.033 313 HG3 PRO 50 1HG PRO 50 -6.402 7.404 -1.308 314 HD2 PRO 50 2HD PRO 50 -7.607 7.570 -4.050 315 HD3 PRO 50 1HD PRO 50 -5.986 7.029 -3.569 316 H ILE 51 H ILE 51 -10.253 3.986 -1.145 317 HA ILE 51 HA ILE 51 -12.049 4.207 -3.429 318 HB ILE 51 HB ILE 51 -12.763 2.602 -1.016 319 HG12 ILE 51 1HG1 ILE 51 -10.663 1.779 -3.034 320 HG13 ILE 51 2HG1 ILE 51 -10.367 2.125 -1.336 321 HG21 ILE 51 1HG2 ILE 51 -13.693 1.112 -2.675 322 HG22 ILE 51 2HG2 ILE 51 -12.917 2.019 -3.973 323 HG23 ILE 51 3HG2 ILE 51 -14.209 2.762 -3.028 324 HD11 ILE 51 1HD1 ILE 51 -11.721 0.241 -0.681 325 HD12 ILE 51 2HD1 ILE 51 -10.460 -0.272 -1.804 326 HD13 ILE 51 3HD1 ILE 51 -12.120 -0.081 -2.366 327 H THR 52 H THR 52 -12.660 6.410 -3.053 328 HA THR 52 HA THR 52 -14.481 6.708 -0.758 329 HB THR 52 HB THR 52 -13.967 9.136 -0.835 330 HG1 THR 52 1HG THR 52 -12.581 9.927 -2.289 331 HG21 THR 52 1HG2 THR 52 -11.539 7.354 -0.556 332 HG22 THR 52 2HG2 THR 52 -12.755 7.625 0.691 333 HG23 THR 52 3HG2 THR 52 -11.735 8.959 0.151 334 H GLY 53 H GLY 53 -14.170 6.759 -4.138 335 HA2 GLY 53 1HA GLY 53 -17.011 7.205 -4.406 336 HA3 GLY 53 2HA GLY 53 -16.009 8.435 -5.165 337 H ILE 54 H ILE 54 -14.918 5.155 -4.958 338 HA ILE 54 HA ILE 54 -14.514 5.079 -7.781 339 HB ILE 54 HB ILE 54 -14.180 2.848 -5.772 340 HG12 ILE 54 1HG1 ILE 54 -12.774 4.805 -5.255 341 HG13 ILE 54 2HG1 ILE 54 -11.801 3.440 -5.788 342 HG21 ILE 54 1HG2 ILE 54 -13.109 3.142 -8.577 343 HG22 ILE 54 2HG2 ILE 54 -14.382 2.035 -8.063 344 HG23 ILE 54 3HG2 ILE 54 -12.736 1.826 -7.463 345 HD11 ILE 54 1HD1 ILE 54 -12.568 5.837 -7.441 346 HD12 ILE 54 2HD1 ILE 54 -11.634 4.456 -8.015 347 HD13 ILE 54 3HD1 ILE 54 -10.982 5.497 -6.750 348 H GLY 55 H GLY 55 -16.088 4.716 -9.165 349 HA2 GLY 55 1HA GLY 55 -17.558 2.989 -10.094 350 HA3 GLY 55 2HA GLY 55 -18.126 2.703 -8.453 351 H ALA 56 H ALA 56 -20.199 3.319 -8.399 352 HA ALA 56 HA ALA 56 -20.823 6.081 -9.066 353 HB1 ALA 56 1HB ALA 56 -22.707 5.511 -10.472 354 HB2 ALA 56 2HB ALA 56 -22.365 3.793 -10.278 355 HB3 ALA 56 3HB ALA 56 -21.227 4.826 -11.142 356 H GLY 57 H GLY 57 -20.666 5.312 -6.553 357 HA2 GLY 57 1HA GLY 57 -23.113 5.915 -5.426 358 HA3 GLY 57 2HA GLY 57 -23.038 4.161 -5.473 359 H SER 58 H SER 58 -23.283 5.127 -3.067 360 HA SER 58 HA SER 58 -20.910 5.917 -1.743 361 HB2 SER 58 1HB SER 58 -23.146 6.360 -0.823 362 HB3 SER 58 2HB SER 58 -23.420 4.630 -0.635 363 HG SER 58 HG SER 58 -22.532 4.846 1.240 364 H GLY 59 H GLY 59 -22.289 2.828 -2.579 365 HA2 GLY 59 1HA GLY 59 -20.392 1.333 -0.969 366 HA3 GLY 59 2HA GLY 59 -21.576 0.663 -2.088 367 H SER 60 H SER 60 -18.630 2.633 -2.081 368 HA SER 60 HA SER 60 -18.020 2.157 -4.806 369 HB2 SER 60 1HB SER 60 -16.131 3.020 -2.604 370 HB3 SER 60 2HB SER 60 -15.941 3.296 -4.339 371 HG SER 60 HG SER 60 -18.253 4.319 -3.800 372 H SER 61 H SER 61 -16.930 0.539 -5.755 373 HA SER 61 HA SER 61 -16.056 -1.666 -4.043 374 HB2 SER 61 1HB SER 61 -16.644 -1.614 -7.013 375 HB3 SER 61 2HB SER 61 -16.295 -3.047 -6.049 376 HG SER 61 HG SER 61 -18.195 -2.470 -4.788 377 H CYS 62 H CYS 62 -14.027 -2.640 -4.305 378 HA CYS 62 HA CYS 62 -12.027 -0.987 -5.650 379 HB2 CYS 62 2HB CYS 62 -11.449 -1.646 -3.398 380 HB3 CYS 62 1HB CYS 62 -11.742 -3.343 -3.767 381 H ASN 63 H ASN 63 -11.147 -1.499 -7.512 382 HA ASN 63 HA ASN 63 -12.251 -3.568 -9.091 383 HB2 ASN 63 1HB ASN 63 -11.530 -1.466 -10.086 384 HB3 ASN 63 2HB ASN 63 -9.869 -1.774 -9.591 385 HD21 ASN 63 1HD2 ASN 63 -9.109 -3.833 -12.288 386 HD22 ASN 63 2HD2 ASN 63 -8.612 -3.156 -10.776 387 H ALA 64 H ALA 64 -9.303 -3.317 -7.205 388 HA ALA 64 HA ALA 64 -8.630 -6.038 -8.101 389 HB1 ALA 64 1HB ALA 64 -6.656 -3.885 -7.367 390 HB2 ALA 64 2HB ALA 64 -7.036 -4.425 -9.001 391 HB3 ALA 64 3HB ALA 64 -6.270 -5.532 -7.863 392 H ASN 65 H ASN 65 -6.861 -4.316 -5.614 393 HA ASN 65 HA ASN 65 -7.994 -6.177 -3.622 394 HB2 ASN 65 1HB ASN 65 -5.151 -5.226 -3.836 395 HB3 ASN 65 2HB ASN 65 -5.767 -6.278 -2.583 396 HD21 ASN 65 1HD2 ASN 65 -4.771 -7.710 -6.232 397 HD22 ASN 65 2HD2 ASN 65 -4.779 -6.017 -5.882 398 HA PRO 66 HA PRO 66 -8.624 -2.277 -1.531 399 HB2 PRO 66 2HB PRO 66 -10.371 -3.194 0.283 400 HB3 PRO 66 1HB PRO 66 -10.835 -2.938 -1.403 401 HG2 PRO 66 2HG PRO 66 -10.182 -5.475 0.015 402 HG3 PRO 66 1HG PRO 66 -11.418 -5.168 -1.215 403 HD2 PRO 66 2HD PRO 66 -8.921 -6.321 -1.692 404 HD3 PRO 66 1HD PRO 66 -9.936 -5.554 -2.926 405 H ALA 67 H ALA 67 -7.447 -1.443 0.076 406 HA ALA 67 HA ALA 67 -6.587 -3.117 2.301 407 HB1 ALA 67 1HB ALA 67 -4.836 -3.435 0.630 408 HB2 ALA 67 2HB ALA 67 -4.230 -2.518 2.007 409 HB3 ALA 67 3HB ALA 67 -4.628 -1.690 0.501 410 H CYS 68 H CYS 68 -5.383 -1.772 3.920 411 HA CYS 68 HA CYS 68 -5.807 1.110 3.595 412 HB2 CYS 68 2HB CYS 68 -7.507 0.341 5.172 413 HB3 CYS 68 1HB CYS 68 -6.269 -0.459 6.140 414 H CYS 69 H CYS 69 -4.100 2.353 4.253 415 HA CYS 69 HA CYS 69 -1.731 0.847 5.129 416 HB2 CYS 69 2HB CYS 69 -2.193 2.167 2.662 417 HB3 CYS 69 1HB CYS 69 -0.925 3.029 3.506 418 H ASP 70 H ASP 70 -0.115 2.065 6.172 419 HA ASP 70 HA ASP 70 -1.075 4.014 8.003 420 HB2 ASP 70 1HB ASP 70 0.793 2.458 8.503 421 HB3 ASP 70 2HB ASP 70 1.776 3.268 7.301 422 H ASN 71 H ASN 71 0.898 4.100 5.090 423 HA ASN 71 HA ASN 71 0.026 6.836 4.582 424 HB2 ASN 71 1HB ASN 71 2.958 6.072 4.699 425 HB3 ASN 71 2HB ASN 71 2.357 7.526 3.916 426 HD21 ASN 71 1HD2 ASN 71 2.846 7.348 7.905 427 HD22 ASN 71 2HD2 ASN 71 3.140 5.994 6.871 428 H VAL 72 H VAL 72 -0.333 7.128 2.410 429 HA VAL 72 HA VAL 72 1.120 5.330 0.611 430 HB VAL 72 HB VAL 72 -0.694 4.542 -0.382 431 HG11 VAL 72 1HG1 VAL 72 -2.891 4.787 0.693 432 HG12 VAL 72 2HG1 VAL 72 -2.216 6.053 1.717 433 HG13 VAL 72 3HG1 VAL 72 -1.595 4.406 1.825 434 HG21 VAL 72 1HG2 VAL 72 -0.791 6.586 -1.728 435 HG22 VAL 72 2HG2 VAL 72 -1.871 7.309 -0.528 436 HG23 VAL 72 3HG2 VAL 72 -2.392 5.891 -1.443 437 H TYR 73 H TYR 73 1.670 6.200 -1.405 438 HA TYR 73 HA TYR 73 1.911 9.133 -1.286 439 HB2 TYR 73 2HB TYR 73 3.861 7.060 -2.282 440 HB3 TYR 73 1HB TYR 73 4.138 8.802 -2.313 441 HD1 TYR 73 1HD TYR 73 4.082 5.800 -0.245 442 HD2 TYR 73 2HD TYR 73 4.458 10.037 -0.193 443 HE1 TYR 73 1HE TYR 73 4.947 5.689 2.054 444 HE2 TYR 73 2HE TYR 73 5.329 9.938 2.103 445 HH TYR 73 HH TYR 73 6.304 7.028 3.579 446 H THR 74 H THR 74 2.429 10.084 -3.498 447 HA THR 74 HA THR 74 0.063 9.524 -4.976 448 HB THR 74 HB THR 74 0.837 11.427 -6.425 449 HG1 THR 74 1HG THR 74 3.015 11.448 -6.268 450 HG21 THR 74 1HG2 THR 74 0.532 13.132 -4.698 451 HG22 THR 74 2HG2 THR 74 0.840 11.928 -3.447 452 HG23 THR 74 3HG2 THR 74 -0.593 11.795 -4.465 453 H ASN 75 H ASN 75 3.145 8.209 -5.269 454 HA ASN 75 HA ASN 75 2.919 7.623 -8.096 455 HB2 ASN 75 1HB ASN 75 4.826 6.142 -7.763 456 HB3 ASN 75 2HB ASN 75 5.147 7.688 -6.989 457 HD21 ASN 75 1HD2 ASN 75 5.995 4.741 -4.807 458 HD22 ASN 75 2HD2 ASN 75 6.286 5.047 -6.484 459 H GLY 76 H GLY 76 1.506 6.661 -5.271 460 HA2 GLY 76 1HA GLY 76 -0.345 5.245 -5.181 461 HA3 GLY 76 2HA GLY 76 0.265 4.371 -6.583 462 H LEU 77 H LEU 77 2.603 5.053 -4.129 463 HA LEU 77 HA LEU 77 2.633 2.199 -3.462 464 HB2 LEU 77 1HB LEU 77 4.700 3.299 -4.229 465 HB3 LEU 77 2HB LEU 77 4.608 4.402 -2.885 466 HG LEU 77 HG LEU 77 6.296 2.498 -2.727 467 HD11 LEU 77 1HD1 LEU 77 5.926 2.142 -0.344 468 HD12 LEU 77 2HD1 LEU 77 4.295 2.809 -0.503 469 HD13 LEU 77 3HD1 LEU 77 5.698 3.835 -0.799 470 HD21 LEU 77 1HD2 LEU 77 3.823 0.910 -2.094 471 HD22 LEU 77 2HD2 LEU 77 5.498 0.364 -1.962 472 HD23 LEU 77 3HD2 LEU 77 4.813 0.734 -3.543 473 H GLY 78 H GLY 78 1.949 1.457 -1.560 474 HA2 GLY 78 1HA GLY 78 1.437 3.438 0.566 475 HA3 GLY 78 2HA GLY 78 0.473 1.992 0.317 476 H VAL 79 H VAL 79 2.114 3.053 2.617 477 HA VAL 79 HA VAL 79 3.816 0.684 3.021 478 HB VAL 79 HB VAL 79 4.878 2.967 3.276 479 HG11 VAL 79 1HG1 VAL 79 3.007 4.124 4.305 480 HG12 VAL 79 2HG1 VAL 79 4.475 4.256 5.271 481 HG13 VAL 79 3HG1 VAL 79 3.198 3.141 5.756 482 HG21 VAL 79 1HG2 VAL 79 4.865 1.190 5.707 483 HG22 VAL 79 2HG2 VAL 79 6.094 2.395 5.325 484 HG23 VAL 79 3HG2 VAL 79 5.878 0.994 4.277 485 H GLN 80 H GLN 80 3.201 -0.801 4.418 486 HA GLN 80 HA GLN 80 2.129 -1.924 6.049 487 HB2 GLN 80 1HB GLN 80 1.682 0.879 7.051 488 HB3 GLN 80 2HB GLN 80 1.022 -0.511 7.901 489 HG2 GLN 80 1HG GLN 80 3.910 -0.293 7.193 490 HG3 GLN 80 2HG GLN 80 3.265 0.403 8.679 491 HE21 GLN 80 1HE2 GLN 80 4.582 -3.090 9.172 492 HE22 GLN 80 2HE2 GLN 80 5.221 -1.688 8.386 493 H CYS 81 H CYS 81 0.858 -2.000 3.823 494 HA CYS 81 HA CYS 81 -1.909 -1.173 4.161 495 HB2 CYS 81 2HB CYS 81 -0.455 -2.489 1.883 496 HB3 CYS 81 1HB CYS 81 -2.204 -2.430 1.934 497 H ASN 82 H ASN 82 -3.379 -2.355 5.097 498 HA ASN 82 HA ASN 82 -2.971 -5.267 5.186 499 HB2 ASN 82 1HB ASN 82 -4.630 -5.310 7.026 500 HB3 ASN 82 2HB ASN 82 -3.219 -4.342 7.406 501 HD21 ASN 82 1HD2 ASN 82 -6.913 -2.715 7.309 502 HD22 ASN 82 2HD2 ASN 82 -6.621 -4.359 6.863 503 HA PRO 83 HA PRO 83 -6.167 -5.737 2.210 504 HB2 PRO 83 2HB PRO 83 -6.664 -8.390 3.368 505 HB3 PRO 83 1HB PRO 83 -6.067 -7.964 1.763 506 HG2 PRO 83 2HG PRO 83 -4.484 -9.086 3.628 507 HG3 PRO 83 1HG PRO 83 -3.872 -7.921 2.444 508 HD2 PRO 83 2HD PRO 83 -4.563 -7.504 5.327 509 HD3 PRO 83 1HD PRO 83 -3.217 -6.846 4.380 510 H ILE 84 H ILE 84 -8.171 -5.022 2.260 511 HA ILE 84 HA ILE 84 -9.690 -4.979 4.718 512 HB ILE 84 HB ILE 84 -10.446 -4.060 1.955 513 HG12 ILE 84 1HG1 ILE 84 -8.550 -2.807 2.749 514 HG13 ILE 84 2HG1 ILE 84 -9.979 -1.791 2.838 515 HG21 ILE 84 1HG2 ILE 84 -11.766 -3.474 4.586 516 HG22 ILE 84 2HG2 ILE 84 -12.418 -4.471 3.284 517 HG23 ILE 84 3HG2 ILE 84 -12.188 -2.739 3.039 518 HD11 ILE 84 1HD1 ILE 84 -8.684 -3.227 5.134 519 HD12 ILE 84 2HD1 ILE 84 -10.149 -2.254 5.234 520 HD13 ILE 84 3HD1 ILE 84 -8.616 -1.497 4.802 521 H ASN 85 H ASN 85 -11.621 -5.969 5.079 522 HA ASN 85 HA ASN 85 -12.050 -8.461 3.682 523 HB2 ASN 85 1HB ASN 85 -12.237 -8.461 6.105 524 HB3 ASN 85 2HB ASN 85 -13.456 -7.193 6.043 525 HD21 ASN 85 1HD2 ASN 85 -16.108 -9.368 5.335 526 HD22 ASN 85 2HD2 ASN 85 -15.559 -7.727 5.401 527 H VAL 86 H VAL 86 -13.092 -8.367 1.817 528 HA VAL 86 HA VAL 86 -15.507 -6.706 1.670 529 HB VAL 86 HB VAL 86 -14.995 -6.446 -0.812 530 HG11 VAL 86 1HG1 VAL 86 -13.094 -5.166 1.146 531 HG12 VAL 86 2HG1 VAL 86 -14.728 -4.616 0.775 532 HG13 VAL 86 3HG1 VAL 86 -13.478 -4.563 -0.468 533 HG21 VAL 86 1HG2 VAL 86 -13.309 -8.217 -0.974 534 HG22 VAL 86 2HG2 VAL 86 -12.236 -7.284 0.069 535 HG23 VAL 86 3HG2 VAL 86 -12.680 -6.665 -1.522 536 H ASN 87 H ASN 87 -16.746 -8.384 2.203 537 HA ASN 87 HA ASN 87 -18.110 -10.165 1.933 538 HB2 ASN 87 1HB ASN 87 -16.946 -10.327 -0.849 539 HB3 ASN 87 2HB ASN 87 -18.287 -11.301 -0.266 540 HD21 ASN 87 1HD2 ASN 87 -18.852 -7.502 -1.495 541 HD22 ASN 87 2HD2 ASN 87 -17.282 -8.229 -1.423 542 H LEU 88 H LEU 88 -14.855 -10.238 1.983 543 HA LEU 88 HA LEU 88 -13.209 -11.719 2.346 544 HB2 LEU 88 1HB LEU 88 -14.554 -12.036 4.383 545 HB3 LEU 88 2HB LEU 88 -15.443 -13.322 3.587 546 HG LEU 88 HG LEU 88 -13.265 -14.545 3.336 547 HD11 LEU 88 1HD1 LEU 88 -11.430 -13.890 4.822 548 HD12 LEU 88 2HD1 LEU 88 -12.307 -12.418 5.240 549 HD13 LEU 88 3HD1 LEU 88 -11.748 -12.672 3.587 550 HD21 LEU 88 1HD2 LEU 88 -14.881 -15.141 5.053 551 HD22 LEU 88 2HD2 LEU 88 -14.198 -13.928 6.134 552 HD23 LEU 88 3HD2 LEU 88 -13.235 -15.326 5.657 Start of MODEL 19 1 H1 GLY 1 1H GLY 1 -23.490 8.368 0.995 2 H2 GLY 1 2H GLY 1 -23.728 8.399 -0.677 3 H3 GLY 1 3H GLY 1 -22.240 8.868 -0.027 4 HA2 GLY 1 1HA GLY 1 -23.392 6.139 0.083 5 HA3 GLY 1 2HA GLY 1 -22.097 6.658 -0.985 6 H SER 2 H SER 2 -20.574 5.255 -0.177 7 HA SER 2 HA SER 2 -19.740 5.733 2.608 8 HB2 SER 2 1HB SER 2 -18.774 3.382 2.451 9 HB3 SER 2 2HB SER 2 -20.534 3.487 2.483 10 HG SER 2 HG SER 2 -18.841 3.036 0.247 11 H GLY 3 H GLY 3 -17.405 5.451 2.994 12 HA2 GLY 3 1HA GLY 3 -15.680 5.634 0.657 13 HA3 GLY 3 2HA GLY 3 -15.749 7.071 1.671 14 H SER 4 H SER 4 -14.177 7.198 3.120 15 HA SER 4 HA SER 4 -12.620 4.894 3.835 16 HB2 SER 4 1HB SER 4 -11.559 6.693 5.418 17 HB3 SER 4 2HB SER 4 -11.297 6.787 3.678 18 HG SER 4 HG SER 4 -12.394 8.601 5.272 19 H SER 5 H SER 5 -14.920 4.100 4.561 20 HA SER 5 HA SER 5 -15.624 4.805 7.264 21 HB2 SER 5 1HB SER 5 -16.606 2.496 5.573 22 HB3 SER 5 2HB SER 5 -17.408 3.205 6.975 23 HG SER 5 HG SER 5 -18.177 4.742 5.747 24 H GLN 6 H GLN 6 -13.732 2.413 5.620 25 HA GLN 6 HA GLN 6 -13.628 0.675 7.944 26 HB2 GLN 6 1HB GLN 6 -12.387 0.378 5.212 27 HB3 GLN 6 2HB GLN 6 -12.335 -0.832 6.481 28 HG2 GLN 6 1HG GLN 6 -14.789 0.173 5.065 29 HG3 GLN 6 2HG GLN 6 -14.012 -1.393 4.859 30 HE21 GLN 6 1HE2 GLN 6 -15.402 -2.841 7.714 31 HE22 GLN 6 2HE2 GLN 6 -14.190 -2.938 6.489 32 H CYS 7 H CYS 7 -11.763 0.132 9.009 33 HA CYS 7 HA CYS 7 -9.682 0.264 9.875 34 HB2 CYS 7 2HB CYS 7 -8.878 -0.034 7.599 35 HB3 CYS 7 1HB CYS 7 -9.004 1.698 7.309 36 H ASN 8 H ASN 8 -8.652 1.503 11.310 37 HA ASN 8 HA ASN 8 -9.513 4.275 11.576 38 HB2 ASN 8 1HB ASN 8 -9.637 2.782 13.538 39 HB3 ASN 8 2HB ASN 8 -7.896 2.542 13.456 40 HD21 ASN 8 1HD2 ASN 8 -9.481 5.884 15.101 41 HD22 ASN 8 2HD2 ASN 8 -10.451 4.733 14.252 42 H ALA 9 H ALA 9 -6.668 2.395 10.830 43 HA ALA 9 HA ALA 9 -4.692 4.243 11.551 44 HB1 ALA 9 1HB ALA 9 -4.534 2.095 9.451 45 HB2 ALA 9 2HB ALA 9 -4.210 1.885 11.172 46 HB3 ALA 9 3HB ALA 9 -3.162 2.916 10.197 47 H GLY 10 H GLY 10 -6.611 4.021 8.701 48 HA2 GLY 10 1HA GLY 10 -5.966 6.635 7.860 49 HA3 GLY 10 2HA GLY 10 -5.044 5.479 6.908 50 HA PRO 11 HA PRO 11 -9.304 5.993 5.058 51 HB2 PRO 11 2HB PRO 11 -8.558 6.920 2.638 52 HB3 PRO 11 1HB PRO 11 -8.802 7.995 4.023 53 HG2 PRO 11 2HG PRO 11 -6.262 6.882 2.909 54 HG3 PRO 11 1HG PRO 11 -6.610 8.538 3.442 55 HD2 PRO 11 2HD PRO 11 -5.281 6.744 4.992 56 HD3 PRO 11 1HD PRO 11 -6.317 8.014 5.671 57 H VAL 12 H VAL 12 -10.116 4.888 3.145 58 HA VAL 12 HA VAL 12 -8.938 2.283 2.977 59 HB VAL 12 HB VAL 12 -10.895 1.768 1.507 60 HG11 VAL 12 1HG1 VAL 12 -11.534 3.097 4.139 61 HG12 VAL 12 2HG1 VAL 12 -10.966 1.439 3.927 62 HG13 VAL 12 3HG1 VAL 12 -12.544 1.919 3.299 63 HG21 VAL 12 1HG2 VAL 12 -11.638 4.634 2.110 64 HG22 VAL 12 2HG2 VAL 12 -12.693 3.441 1.353 65 HG23 VAL 12 3HG2 VAL 12 -11.227 3.973 0.529 66 H GLN 13 H GLN 13 -7.922 1.344 1.289 67 HA GLN 13 HA GLN 13 -7.356 3.076 -1.031 68 HB2 GLN 13 1HB GLN 13 -5.431 1.087 0.179 69 HB3 GLN 13 2HB GLN 13 -5.094 2.264 -1.081 70 HG2 GLN 13 1HG GLN 13 -5.805 2.928 1.766 71 HG3 GLN 13 2HG GLN 13 -4.179 2.903 1.090 72 HE21 GLN 13 1HE2 GLN 13 -5.771 6.335 1.092 73 HE22 GLN 13 2HE2 GLN 13 -5.762 5.078 2.280 74 H CYS 14 H CYS 14 -7.142 2.097 -3.017 75 HA CYS 14 HA CYS 14 -7.903 -0.743 -3.161 76 HB2 CYS 14 2HB CYS 14 -9.687 0.625 -4.060 77 HB3 CYS 14 1HB CYS 14 -8.564 1.515 -5.074 78 H CYS 15 H CYS 15 -6.028 -1.745 -3.357 79 HA CYS 15 HA CYS 15 -3.898 -0.603 -5.004 80 HB2 CYS 15 2HB CYS 15 -3.898 -3.018 -3.173 81 HB3 CYS 15 1HB CYS 15 -2.492 -2.371 -4.001 82 H ASN 16 H ASN 16 -2.929 -1.740 -6.695 83 HA ASN 16 HA ASN 16 -4.546 -3.634 -8.102 84 HB2 ASN 16 1HB ASN 16 -2.934 -1.963 -9.112 85 HB3 ASN 16 2HB ASN 16 -1.646 -3.017 -8.559 86 HD21 ASN 16 1HD2 ASN 16 -2.009 -5.378 -11.085 87 HD22 ASN 16 2HD2 ASN 16 -1.252 -4.944 -9.591 88 H THR 17 H THR 17 -1.552 -3.745 -6.253 89 HA THR 17 HA THR 17 -1.897 -6.639 -5.928 90 HB THR 17 HB THR 17 0.702 -5.258 -6.654 91 HG1 THR 17 1HG THR 17 0.413 -6.926 -8.441 92 HG21 THR 17 1HG2 THR 17 1.228 -6.997 -5.110 93 HG22 THR 17 2HG2 THR 17 1.592 -7.605 -6.730 94 HG23 THR 17 3HG2 THR 17 0.119 -8.119 -5.906 95 H LEU 18 H LEU 18 -2.053 -7.041 -3.812 96 HA LEU 18 HA LEU 18 -0.626 -5.331 -1.915 97 HB2 LEU 18 1HB LEU 18 -2.660 -7.524 -1.527 98 HB3 LEU 18 2HB LEU 18 -1.783 -6.799 -0.196 99 HG LEU 18 HG LEU 18 -3.652 -5.364 -2.067 100 HD11 LEU 18 1HD1 LEU 18 -3.936 -5.950 0.876 101 HD12 LEU 18 2HD1 LEU 18 -4.708 -6.891 -0.402 102 HD13 LEU 18 3HD1 LEU 18 -5.127 -5.193 -0.184 103 HD21 LEU 18 1HD2 LEU 18 -2.115 -4.355 0.318 104 HD22 LEU 18 2HD2 LEU 18 -3.338 -3.452 -0.573 105 HD23 LEU 18 3HD2 LEU 18 -1.836 -3.914 -1.367 106 H THR 19 H THR 19 1.362 -5.844 -1.506 107 HA THR 19 HA THR 19 2.101 -8.611 -1.065 108 HB THR 19 HB THR 19 2.487 -8.432 -3.439 109 HG1 THR 19 1HG THR 19 4.383 -9.356 -3.323 110 HG21 THR 19 1HG2 THR 19 2.621 -6.109 -3.860 111 HG22 THR 19 2HG2 THR 19 4.188 -6.776 -4.319 112 HG23 THR 19 3HG2 THR 19 4.010 -5.920 -2.788 113 H SER 20 H SER 20 4.840 -8.272 -0.881 114 HA SER 20 HA SER 20 4.940 -6.511 1.471 115 HB2 SER 20 1HB SER 20 6.722 -8.862 0.778 116 HB3 SER 20 2HB SER 20 6.685 -7.981 2.307 117 HG SER 20 HG SER 20 4.279 -8.659 2.132 118 H ALA 21 H ALA 21 7.045 -5.476 1.907 119 HA ALA 21 HA ALA 21 7.786 -3.924 -0.347 120 HB1 ALA 21 1HB ALA 21 7.703 -3.033 1.925 121 HB2 ALA 21 2HB ALA 21 9.279 -2.773 1.179 122 HB3 ALA 21 3HB ALA 21 9.069 -4.053 2.375 123 H SER 22 H SER 22 8.713 -6.971 0.315 124 HA SER 22 HA SER 22 11.471 -6.742 -0.533 125 HB2 SER 22 1HB SER 22 10.420 -8.516 1.079 126 HB3 SER 22 2HB SER 22 9.940 -9.312 -0.408 127 HG SER 22 HG SER 22 12.073 -9.507 -1.002 128 H ASN 23 H ASN 23 8.514 -6.585 -2.001 129 HA ASN 23 HA ASN 23 9.151 -8.104 -4.379 130 HB2 ASN 23 1HB ASN 23 6.795 -7.676 -3.367 131 HB3 ASN 23 2HB ASN 23 6.898 -6.115 -4.167 132 HD21 ASN 23 1HD2 ASN 23 6.344 -9.514 -6.313 133 HD22 ASN 23 2HD2 ASN 23 6.767 -9.566 -4.636 134 H SER 24 H SER 24 9.915 -7.339 -6.253 135 HA SER 24 HA SER 24 11.397 -4.969 -6.309 136 HB2 SER 24 1HB SER 24 10.425 -6.593 -8.671 137 HB3 SER 24 2HB SER 24 11.806 -5.496 -8.644 138 HG SER 24 HG SER 24 12.408 -7.712 -8.381 139 H GLN 25 H GLN 25 8.083 -5.620 -7.189 140 HA GLN 25 HA GLN 25 7.538 -3.305 -8.679 141 HB2 GLN 25 1HB GLN 25 6.057 -5.363 -8.314 142 HB3 GLN 25 2HB GLN 25 5.632 -4.653 -6.757 143 HG2 GLN 25 1HG GLN 25 3.922 -4.070 -8.242 144 HG3 GLN 25 2HG GLN 25 4.902 -2.626 -7.999 145 HE21 GLN 25 1HE2 GLN 25 4.735 -2.278 -11.467 146 HE22 GLN 25 2HE2 GLN 25 4.187 -1.711 -9.928 147 H ALA 26 H ALA 26 7.304 -4.045 -5.235 148 HA ALA 26 HA ALA 26 6.316 -1.474 -4.485 149 HB1 ALA 26 1HB ALA 26 6.647 -2.280 -2.199 150 HB2 ALA 26 2HB ALA 26 7.522 -3.682 -2.820 151 HB3 ALA 26 3HB ALA 26 5.812 -3.471 -3.195 152 H ALA 27 H ALA 27 9.488 -3.077 -4.096 153 HA ALA 27 HA ALA 27 10.660 -0.953 -2.664 154 HB1 ALA 27 1HB ALA 27 12.018 -3.053 -4.355 155 HB2 ALA 27 2HB ALA 27 11.595 -3.206 -2.650 156 HB3 ALA 27 3HB ALA 27 12.802 -2.024 -3.157 157 H GLY 28 H GLY 28 10.300 -1.491 -6.116 158 HA2 GLY 28 1HA GLY 28 12.045 0.510 -7.032 159 HA3 GLY 28 2HA GLY 28 10.576 -0.003 -7.855 160 H LEU 29 H LEU 29 8.655 0.656 -6.112 161 HA LEU 29 HA LEU 29 8.288 3.444 -6.417 162 HB2 LEU 29 1HB LEU 29 6.898 1.478 -4.642 163 HB3 LEU 29 2HB LEU 29 6.298 3.057 -5.041 164 HG LEU 29 HG LEU 29 6.705 0.833 -7.033 165 HD11 LEU 29 1HD1 LEU 29 4.218 1.879 -5.700 166 HD12 LEU 29 2HD1 LEU 29 4.924 0.272 -5.513 167 HD13 LEU 29 3HD1 LEU 29 4.237 0.760 -7.062 168 HD21 LEU 29 1HD2 LEU 29 5.398 2.287 -8.526 169 HD22 LEU 29 2HD2 LEU 29 6.922 3.030 -8.045 170 HD23 LEU 29 3HD2 LEU 29 5.413 3.551 -7.294 171 H ILE 30 H ILE 30 8.845 1.409 -3.565 172 HA ILE 30 HA ILE 30 8.892 3.279 -1.547 173 HB ILE 30 HB ILE 30 10.549 0.790 -1.886 174 HG12 ILE 30 1HG1 ILE 30 8.032 1.339 -0.315 175 HG13 ILE 30 2HG1 ILE 30 8.073 0.570 -1.895 176 HG21 ILE 30 1HG2 ILE 30 9.999 2.144 0.736 177 HG22 ILE 30 2HG2 ILE 30 11.446 2.501 -0.208 178 HG23 ILE 30 3HG2 ILE 30 11.155 0.862 0.380 179 HD11 ILE 30 1HD1 ILE 30 7.812 -1.021 -0.074 180 HD12 ILE 30 2HD1 ILE 30 9.358 -0.504 0.597 181 HD13 ILE 30 3HD1 ILE 30 9.299 -1.290 -0.981 182 H GLN 31 H GLN 31 11.593 2.218 -3.561 183 HA GLN 31 HA GLN 31 13.400 3.999 -2.329 184 HB2 GLN 31 1HB GLN 31 13.553 2.219 -4.731 185 HB3 GLN 31 2HB GLN 31 14.896 3.277 -4.282 186 HG2 GLN 31 1HG GLN 31 14.800 2.166 -2.012 187 HG3 GLN 31 2HG GLN 31 13.692 1.009 -2.740 188 HE21 GLN 31 1HE2 GLN 31 16.138 -0.771 -4.454 189 HE22 GLN 31 2HE2 GLN 31 14.452 -0.447 -4.263 190 H GLN 32 H GLN 32 11.107 4.340 -4.885 191 HA GLN 32 HA GLN 32 12.324 6.654 -6.080 192 HB2 GLN 32 1HB GLN 32 9.516 5.568 -6.074 193 HB3 GLN 32 2HB GLN 32 9.888 7.126 -6.789 194 HG2 GLN 32 1HG GLN 32 11.142 4.519 -7.589 195 HG3 GLN 32 2HG GLN 32 9.788 5.299 -8.405 196 HE21 GLN 32 1HE2 GLN 32 11.734 7.645 -10.100 197 HE22 GLN 32 2HE2 GLN 32 10.150 7.127 -9.643 198 H LEU 33 H LEU 33 10.008 6.066 -3.517 199 HA LEU 33 HA LEU 33 9.557 8.854 -2.974 200 HB2 LEU 33 1HB LEU 33 8.943 6.686 -1.015 201 HB3 LEU 33 2HB LEU 33 8.036 8.141 -1.376 202 HG LEU 33 HG LEU 33 8.225 5.776 -3.237 203 HD11 LEU 33 1HD1 LEU 33 5.959 6.504 -1.404 204 HD12 LEU 33 2HD1 LEU 33 7.135 5.229 -1.087 205 HD13 LEU 33 3HD1 LEU 33 6.068 5.113 -2.482 206 HD21 LEU 33 1HD2 LEU 33 7.645 7.629 -4.531 207 HD22 LEU 33 2HD2 LEU 33 6.638 8.319 -3.254 208 HD23 LEU 33 3HD2 LEU 33 6.091 6.878 -4.124 209 H GLY 34 H GLY 34 11.780 6.430 -2.034 210 HA2 GLY 34 1HA GLY 34 13.750 6.619 -0.850 211 HA3 GLY 34 2HA GLY 34 13.331 8.288 -0.474 212 H LEU 35 H LEU 35 11.378 5.449 0.105 213 HA LEU 35 HA LEU 35 10.878 6.228 2.804 214 HB2 LEU 35 1HB LEU 35 10.058 3.951 1.074 215 HB3 LEU 35 2HB LEU 35 9.694 3.917 2.780 216 HG LEU 35 HG LEU 35 8.750 5.970 0.787 217 HD11 LEU 35 1HD1 LEU 35 6.550 5.032 1.226 218 HD12 LEU 35 2HD1 LEU 35 7.264 3.842 2.313 219 HD13 LEU 35 3HD1 LEU 35 7.648 3.806 0.591 220 HD21 LEU 35 1HD2 LEU 35 8.277 5.742 3.756 221 HD22 LEU 35 2HD2 LEU 35 7.382 6.809 2.676 222 HD23 LEU 35 3HD2 LEU 35 9.112 7.047 2.912 223 H SER 36 H SER 36 12.600 6.080 4.133 224 HA SER 36 HA SER 36 14.102 3.575 4.226 225 HB2 SER 36 1HB SER 36 15.323 5.767 4.239 226 HB3 SER 36 2HB SER 36 14.568 6.127 5.791 227 HG SER 36 HG SER 36 16.616 5.237 6.119 228 H GLY 37 H GLY 37 13.681 2.066 5.714 229 HA2 GLY 37 1HA GLY 37 13.211 1.685 8.140 230 HA3 GLY 37 2HA GLY 37 11.880 2.819 7.936 231 H VAL 38 H VAL 38 11.367 1.710 5.225 232 HA VAL 38 HA VAL 38 9.536 -0.380 5.969 233 HB VAL 38 HB VAL 38 10.328 0.533 3.193 234 HG11 VAL 38 1HG1 VAL 38 7.865 -0.865 4.221 235 HG12 VAL 38 2HG1 VAL 38 9.134 -1.578 3.227 236 HG13 VAL 38 3HG1 VAL 38 8.109 -0.303 2.567 237 HG21 VAL 38 1HG2 VAL 38 8.135 1.578 4.982 238 HG22 VAL 38 2HG2 VAL 38 8.387 2.026 3.295 239 HG23 VAL 38 3HG2 VAL 38 9.595 2.445 4.509 240 H GLY 39 H GLY 39 10.362 -2.329 6.434 241 HA2 GLY 39 1HA GLY 39 12.713 -3.335 5.037 242 HA3 GLY 39 2HA GLY 39 11.929 -4.073 6.429 243 H ALA 40 H ALA 40 12.425 -5.939 4.825 244 HA ALA 40 HA ALA 40 10.863 -6.097 2.460 245 HB1 ALA 40 1HB ALA 40 12.338 -8.263 3.952 246 HB2 ALA 40 2HB ALA 40 13.000 -7.243 2.676 247 HB3 ALA 40 3HB ALA 40 11.716 -8.391 2.309 248 H ASN 41 H ASN 41 10.291 -7.007 5.750 249 HA ASN 41 HA ASN 41 8.136 -8.821 5.131 250 HB2 ASN 41 1HB ASN 41 7.870 -8.996 7.544 251 HB3 ASN 41 2HB ASN 41 9.563 -9.162 7.113 252 HD21 ASN 41 1HD2 ASN 41 8.892 -6.799 10.021 253 HD22 ASN 41 2HD2 ASN 41 8.184 -8.325 9.610 254 H VAL 42 H VAL 42 8.409 -5.522 5.150 255 HA VAL 42 HA VAL 42 6.019 -4.791 6.530 256 HB VAL 42 HB VAL 42 7.679 -3.196 4.575 257 HG11 VAL 42 1HG1 VAL 42 5.622 -2.314 6.602 258 HG12 VAL 42 2HG1 VAL 42 5.559 -2.095 4.851 259 HG13 VAL 42 3HG1 VAL 42 6.771 -1.232 5.811 260 HG21 VAL 42 1HG2 VAL 42 9.067 -3.902 6.328 261 HG22 VAL 42 2HG2 VAL 42 7.820 -3.573 7.538 262 HG23 VAL 42 3HG2 VAL 42 8.604 -2.235 6.696 263 HA PRO 43 HA PRO 43 3.170 -5.634 3.238 264 HB2 PRO 43 2HB PRO 43 1.175 -4.016 4.437 265 HB3 PRO 43 1HB PRO 43 1.332 -5.757 4.537 266 HG2 PRO 43 2HG PRO 43 1.705 -3.887 6.600 267 HG3 PRO 43 1HG PRO 43 2.007 -5.630 6.665 268 HD2 PRO 43 2HD PRO 43 3.898 -3.424 6.478 269 HD3 PRO 43 1HD PRO 43 4.196 -5.116 6.892 270 H VAL 44 H VAL 44 2.694 -4.584 1.358 271 HA VAL 44 HA VAL 44 2.487 -1.668 1.426 272 HB VAL 44 HB VAL 44 3.925 -1.417 -0.551 273 HG11 VAL 44 1HG1 VAL 44 5.247 -2.712 1.827 274 HG12 VAL 44 2HG1 VAL 44 4.924 -0.994 1.595 275 HG13 VAL 44 3HG1 VAL 44 6.100 -1.816 0.571 276 HG21 VAL 44 1HG2 VAL 44 5.478 -3.349 -1.061 277 HG22 VAL 44 2HG2 VAL 44 3.810 -3.508 -1.613 278 HG23 VAL 44 3HG2 VAL 44 4.349 -4.361 -0.162 279 H GLY 45 H GLY 45 1.435 -0.765 -0.379 280 HA2 GLY 45 1HA GLY 45 -0.153 -2.736 -1.885 281 HA3 GLY 45 2HA GLY 45 -0.754 -1.158 -1.413 282 H ILE 46 H ILE 46 0.237 -2.869 -3.901 283 HA ILE 46 HA ILE 46 1.881 -0.923 -5.287 284 HB ILE 46 HB ILE 46 0.718 -3.601 -6.051 285 HG12 ILE 46 1HG1 ILE 46 2.911 -4.478 -5.988 286 HG13 ILE 46 2HG1 ILE 46 3.637 -2.900 -6.097 287 HG21 ILE 46 1HG2 ILE 46 0.656 -2.196 -8.023 288 HG22 ILE 46 2HG2 ILE 46 1.896 -3.441 -8.189 289 HG23 ILE 46 3HG2 ILE 46 2.357 -1.785 -7.801 290 HD11 ILE 46 1HD1 ILE 46 3.990 -3.917 -3.945 291 HD12 ILE 46 2HD1 ILE 46 2.244 -4.002 -3.694 292 HD13 ILE 46 3HD1 ILE 46 3.047 -2.432 -3.807 293 H ASN 47 H ASN 47 1.004 0.710 -6.444 294 HA ASN 47 HA ASN 47 -0.445 1.951 -7.696 295 HB2 ASN 47 1HB ASN 47 -0.285 -0.180 -9.118 296 HB3 ASN 47 2HB ASN 47 -1.820 -0.633 -8.409 297 HD21 ASN 47 1HD2 ASN 47 -1.633 2.196 -11.296 298 HD22 ASN 47 2HD2 ASN 47 -0.205 1.570 -10.551 299 H CYS 48 H CYS 48 -1.113 2.195 -5.187 300 HA CYS 48 HA CYS 48 -3.924 1.402 -4.944 301 HB2 CYS 48 2HB CYS 48 -1.872 1.275 -3.080 302 HB3 CYS 48 1HB CYS 48 -2.811 2.672 -2.596 303 H ASN 49 H ASN 49 -5.509 2.772 -4.928 304 HA ASN 49 HA ASN 49 -4.977 5.618 -4.436 305 HB2 ASN 49 1HB ASN 49 -6.822 6.137 -6.069 306 HB3 ASN 49 2HB ASN 49 -5.350 5.511 -6.794 307 HD21 ASN 49 1HD2 ASN 49 -6.837 2.635 -8.098 308 HD22 ASN 49 2HD2 ASN 49 -5.371 3.482 -7.750 309 HA PRO 50 HA PRO 50 -7.855 5.136 -1.255 310 HB2 PRO 50 2HB PRO 50 -8.727 7.912 -1.573 311 HB3 PRO 50 1HB PRO 50 -7.774 7.183 -0.274 312 HG2 PRO 50 2HG PRO 50 -6.703 8.909 -2.058 313 HG3 PRO 50 1HG PRO 50 -5.772 7.584 -1.338 314 HD2 PRO 50 2HD PRO 50 -7.066 7.745 -4.036 315 HD3 PRO 50 1HD PRO 50 -5.467 7.118 -3.595 316 H ILE 51 H ILE 51 -9.807 4.257 -1.192 317 HA ILE 51 HA ILE 51 -11.553 4.517 -3.473 318 HB ILE 51 HB ILE 51 -12.343 3.087 -0.959 319 HG12 ILE 51 1HG1 ILE 51 -10.399 2.086 -3.054 320 HG13 ILE 51 2HG1 ILE 51 -10.046 2.361 -1.355 321 HG21 ILE 51 1HG2 ILE 51 -12.746 2.496 -3.889 322 HG22 ILE 51 2HG2 ILE 51 -13.916 3.289 -2.831 323 HG23 ILE 51 3HG2 ILE 51 -13.457 1.610 -2.539 324 HD11 ILE 51 1HD1 ILE 51 -10.321 0.005 -1.799 325 HD12 ILE 51 2HD1 ILE 51 -11.932 0.300 -2.457 326 HD13 ILE 51 3HD1 ILE 51 -11.611 0.589 -0.747 327 H THR 52 H THR 52 -12.177 6.711 -3.329 328 HA THR 52 HA THR 52 -14.021 7.256 -1.107 329 HB THR 52 HB THR 52 -13.488 9.689 -1.504 330 HG1 THR 52 1HG THR 52 -11.978 10.214 -2.939 331 HG21 THR 52 1HG2 THR 52 -11.203 7.875 -0.701 332 HG22 THR 52 2HG2 THR 52 -12.494 8.449 0.356 333 HG23 THR 52 3HG2 THR 52 -11.332 9.593 -0.316 334 H GLY 53 H GLY 53 -13.527 7.263 -4.519 335 HA2 GLY 53 1HA GLY 53 -16.011 8.650 -5.094 336 HA3 GLY 53 2HA GLY 53 -14.911 7.946 -6.272 337 H ILE 54 H ILE 54 -14.849 5.400 -4.774 338 HA ILE 54 HA ILE 54 -17.207 4.198 -5.927 339 HB ILE 54 HB ILE 54 -15.121 2.828 -4.239 340 HG12 ILE 54 1HG1 ILE 54 -14.005 4.005 -6.087 341 HG13 ILE 54 2HG1 ILE 54 -13.948 2.262 -6.316 342 HG21 ILE 54 1HG2 ILE 54 -15.794 0.829 -5.478 343 HG22 ILE 54 2HG2 ILE 54 -16.992 1.780 -6.357 344 HG23 ILE 54 3HG2 ILE 54 -17.155 1.548 -4.616 345 HD11 ILE 54 1HD1 ILE 54 -15.818 4.173 -7.695 346 HD12 ILE 54 2HD1 ILE 54 -15.791 2.424 -7.915 347 HD13 ILE 54 3HD1 ILE 54 -14.403 3.394 -8.403 348 H GLY 55 H GLY 55 -18.784 3.011 -4.746 349 HA2 GLY 55 1HA GLY 55 -19.623 2.210 -2.624 350 HA3 GLY 55 2HA GLY 55 -18.844 3.586 -1.855 351 H ALA 56 H ALA 56 -21.201 2.942 -4.425 352 HA ALA 56 HA ALA 56 -22.694 5.319 -3.572 353 HB1 ALA 56 1HB ALA 56 -23.829 5.164 -5.721 354 HB2 ALA 56 2HB ALA 56 -22.975 3.664 -6.078 355 HB3 ALA 56 3HB ALA 56 -22.080 5.176 -5.941 356 H GLY 57 H GLY 57 -22.793 1.880 -3.625 357 HA2 GLY 57 1HA GLY 57 -25.664 1.823 -3.055 358 HA3 GLY 57 2HA GLY 57 -24.649 0.430 -3.400 359 H SER 58 H SER 58 -23.699 -0.661 -1.743 360 HA SER 58 HA SER 58 -24.608 0.121 0.923 361 HB2 SER 58 1HB SER 58 -23.336 -2.481 0.051 362 HB3 SER 58 2HB SER 58 -24.195 -2.172 1.559 363 HG SER 58 HG SER 58 -25.902 -1.505 -0.251 364 H GLY 59 H GLY 59 -21.631 -0.974 -0.700 365 HA2 GLY 59 1HA GLY 59 -20.067 0.660 1.154 366 HA3 GLY 59 2HA GLY 59 -19.736 -1.069 1.133 367 H SER 60 H SER 60 -17.802 0.876 0.471 368 HA SER 60 HA SER 60 -17.700 0.991 -2.427 369 HB2 SER 60 1HB SER 60 -15.466 1.904 -0.642 370 HB3 SER 60 2HB SER 60 -16.025 2.579 -2.184 371 HG SER 60 HG SER 60 -17.050 3.943 -0.961 372 H SER 61 H SER 61 -16.831 -0.579 -3.592 373 HA SER 61 HA SER 61 -15.010 -2.463 -2.281 374 HB2 SER 61 1HB SER 61 -17.095 -3.324 -3.383 375 HB3 SER 61 2HB SER 61 -16.443 -2.781 -4.928 376 HG SER 61 HG SER 61 -15.857 -5.016 -3.477 377 H CYS 62 H CYS 62 -13.477 -3.494 -4.068 378 HA CYS 62 HA CYS 62 -12.176 -1.319 -5.550 379 HB2 CYS 62 2HB CYS 62 -10.864 -1.431 -3.581 380 HB3 CYS 62 1HB CYS 62 -10.938 -3.191 -3.540 381 H ASN 63 H ASN 63 -11.467 -1.848 -7.495 382 HA ASN 63 HA ASN 63 -12.345 -4.117 -8.835 383 HB2 ASN 63 1HB ASN 63 -10.568 -3.409 -10.572 384 HB3 ASN 63 2HB ASN 63 -11.880 -2.286 -10.213 385 HD21 ASN 63 1HD2 ASN 63 -8.016 -1.363 -9.398 386 HD22 ASN 63 2HD2 ASN 63 -8.484 -2.934 -9.946 387 H ALA 64 H ALA 64 -9.384 -3.605 -7.073 388 HA ALA 64 HA ALA 64 -8.464 -6.228 -8.025 389 HB1 ALA 64 1HB ALA 64 -7.116 -4.330 -8.854 390 HB2 ALA 64 2HB ALA 64 -6.193 -5.480 -7.880 391 HB3 ALA 64 3HB ALA 64 -6.697 -3.938 -7.182 392 H ASN 65 H ASN 65 -6.827 -4.459 -5.491 393 HA ASN 65 HA ASN 65 -8.054 -6.244 -3.498 394 HB2 ASN 65 1HB ASN 65 -5.137 -5.539 -3.698 395 HB3 ASN 65 2HB ASN 65 -5.857 -6.500 -2.421 396 HD21 ASN 65 1HD2 ASN 65 -5.037 -8.104 -6.049 397 HD22 ASN 65 2HD2 ASN 65 -4.910 -6.410 -5.759 398 HA PRO 66 HA PRO 66 -8.501 -2.256 -1.532 399 HB2 PRO 66 2HB PRO 66 -10.337 -3.016 0.258 400 HB3 PRO 66 1HB PRO 66 -10.744 -2.846 -1.453 401 HG2 PRO 66 2HG PRO 66 -10.187 -5.322 0.124 402 HG3 PRO 66 1HG PRO 66 -11.406 -5.047 -1.137 403 HD2 PRO 66 2HD PRO 66 -8.951 -6.296 -1.534 404 HD3 PRO 66 1HD PRO 66 -9.923 -5.545 -2.812 405 H ALA 67 H ALA 67 -7.411 -1.391 0.151 406 HA ALA 67 HA ALA 67 -6.657 -3.070 2.411 407 HB1 ALA 67 1HB ALA 67 -4.599 -1.667 0.706 408 HB2 ALA 67 2HB ALA 67 -4.853 -3.410 0.789 409 HB3 ALA 67 3HB ALA 67 -4.283 -2.536 2.209 410 H CYS 68 H CYS 68 -5.805 -1.855 4.184 411 HA CYS 68 HA CYS 68 -6.144 1.059 3.945 412 HB2 CYS 68 2HB CYS 68 -7.579 0.215 5.688 413 HB3 CYS 68 1HB CYS 68 -6.261 -0.727 6.382 414 H CYS 69 H CYS 69 -4.322 2.178 3.913 415 HA CYS 69 HA CYS 69 -1.884 0.821 4.818 416 HB2 CYS 69 2HB CYS 69 -2.088 3.035 2.787 417 HB3 CYS 69 1HB CYS 69 -0.706 2.018 3.139 418 H ASP 70 H ASP 70 -0.451 1.910 6.086 419 HA ASP 70 HA ASP 70 -1.469 3.893 7.816 420 HB2 ASP 70 1HB ASP 70 0.339 2.211 8.358 421 HB3 ASP 70 2HB ASP 70 1.440 3.180 7.393 422 H ASN 71 H ASN 71 0.807 4.004 5.124 423 HA ASN 71 HA ASN 71 -0.037 6.739 4.560 424 HB2 ASN 71 1HB ASN 71 2.896 5.962 4.686 425 HB3 ASN 71 2HB ASN 71 2.266 7.507 4.134 426 HD21 ASN 71 1HD2 ASN 71 2.811 6.741 8.052 427 HD22 ASN 71 2HD2 ASN 71 3.086 5.556 6.826 428 H VAL 72 H VAL 72 -0.398 6.940 2.381 429 HA VAL 72 HA VAL 72 1.171 5.210 0.624 430 HB VAL 72 HB VAL 72 -0.611 3.907 0.255 431 HG11 VAL 72 1HG1 VAL 72 -1.832 4.744 2.128 432 HG12 VAL 72 2HG1 VAL 72 -2.922 4.486 0.766 433 HG13 VAL 72 3HG1 VAL 72 -2.408 6.121 1.186 434 HG21 VAL 72 1HG2 VAL 72 -0.440 5.170 -1.855 435 HG22 VAL 72 2HG2 VAL 72 -1.689 6.273 -1.272 436 HG23 VAL 72 3HG2 VAL 72 -2.071 4.571 -1.547 437 H TYR 73 H TYR 73 1.786 6.038 -1.259 438 HA TYR 73 HA TYR 73 1.627 8.964 -1.298 439 HB2 TYR 73 2HB TYR 73 3.703 7.042 -2.371 440 HB3 TYR 73 1HB TYR 73 3.810 8.796 -2.472 441 HD1 TYR 73 1HD TYR 73 4.617 10.068 -0.651 442 HD2 TYR 73 2HD TYR 73 3.691 5.954 -0.078 443 HE1 TYR 73 1HE TYR 73 5.637 10.152 1.579 444 HE2 TYR 73 2HE TYR 73 4.719 6.020 2.162 445 HH TYR 73 HH TYR 73 5.590 9.002 3.663 446 H THR 74 H THR 74 1.925 9.953 -3.496 447 HA THR 74 HA THR 74 -0.410 9.205 -4.916 448 HB THR 74 HB THR 74 0.275 11.140 -6.431 449 HG1 THR 74 1HG THR 74 2.029 12.322 -5.843 450 HG21 THR 74 1HG2 THR 74 -0.271 12.826 -4.722 451 HG22 THR 74 2HG2 THR 74 0.011 11.627 -3.460 452 HG23 THR 74 3HG2 THR 74 -1.317 11.411 -4.599 453 H ASN 75 H ASN 75 2.871 8.322 -5.337 454 HA ASN 75 HA ASN 75 2.707 7.626 -8.107 455 HB2 ASN 75 1HB ASN 75 4.671 6.246 -7.716 456 HB3 ASN 75 2HB ASN 75 4.881 7.784 -6.893 457 HD21 ASN 75 1HD2 ASN 75 5.768 4.806 -4.750 458 HD22 ASN 75 2HD2 ASN 75 6.110 5.158 -6.405 459 H GLY 76 H GLY 76 1.351 6.464 -5.267 460 HA2 GLY 76 1HA GLY 76 -0.483 4.970 -5.336 461 HA3 GLY 76 2HA GLY 76 0.274 4.144 -6.692 462 H LEU 77 H LEU 77 2.446 4.945 -4.134 463 HA LEU 77 HA LEU 77 2.539 2.094 -3.459 464 HB2 LEU 77 1HB LEU 77 4.596 3.222 -4.202 465 HB3 LEU 77 2HB LEU 77 4.465 4.333 -2.864 466 HG LEU 77 HG LEU 77 6.163 2.416 -2.677 467 HD11 LEU 77 1HD1 LEU 77 5.561 3.797 -0.774 468 HD12 LEU 77 2HD1 LEU 77 5.770 2.111 -0.288 469 HD13 LEU 77 3HD1 LEU 77 4.148 2.787 -0.473 470 HD21 LEU 77 1HD2 LEU 77 4.662 0.649 -3.467 471 HD22 LEU 77 2HD2 LEU 77 3.666 0.867 -2.024 472 HD23 LEU 77 3HD2 LEU 77 5.334 0.304 -1.874 473 H GLY 78 H GLY 78 1.498 1.441 -1.724 474 HA2 GLY 78 1HA GLY 78 1.162 3.341 0.499 475 HA3 GLY 78 2HA GLY 78 0.146 1.938 0.215 476 H VAL 79 H VAL 79 1.829 2.884 2.516 477 HA VAL 79 HA VAL 79 3.531 0.502 2.830 478 HB VAL 79 HB VAL 79 4.562 2.824 3.062 479 HG11 VAL 79 1HG1 VAL 79 3.025 2.848 5.649 480 HG12 VAL 79 2HG1 VAL 79 2.741 3.902 4.265 481 HG13 VAL 79 3HG1 VAL 79 4.258 4.010 5.158 482 HG21 VAL 79 1HG2 VAL 79 5.637 0.818 3.939 483 HG22 VAL 79 2HG2 VAL 79 4.759 1.015 5.457 484 HG23 VAL 79 3HG2 VAL 79 5.940 2.226 4.956 485 H GLN 80 H GLN 80 3.222 -0.848 4.529 486 HA GLN 80 HA GLN 80 2.099 -2.010 6.099 487 HB2 GLN 80 1HB GLN 80 1.505 0.797 7.027 488 HB3 GLN 80 2HB GLN 80 0.994 -0.624 7.929 489 HG2 GLN 80 1HG GLN 80 3.827 -0.168 7.143 490 HG3 GLN 80 2HG GLN 80 3.155 0.480 8.637 491 HE21 GLN 80 1HE2 GLN 80 4.724 -2.894 9.131 492 HE22 GLN 80 2HE2 GLN 80 5.264 -1.453 8.344 493 H CYS 81 H CYS 81 0.888 -1.979 3.781 494 HA CYS 81 HA CYS 81 -1.870 -1.134 4.026 495 HB2 CYS 81 2HB CYS 81 -0.468 -2.630 1.811 496 HB3 CYS 81 1HB CYS 81 -2.141 -2.105 1.763 497 H ASN 82 H ASN 82 -3.150 -2.253 5.232 498 HA ASN 82 HA ASN 82 -2.944 -5.185 5.172 499 HB2 ASN 82 1HB ASN 82 -4.514 -5.081 7.167 500 HB3 ASN 82 2HB ASN 82 -2.887 -4.473 7.418 501 HD21 ASN 82 1HD2 ASN 82 -3.877 -1.187 8.079 502 HD22 ASN 82 2HD2 ASN 82 -2.571 -2.265 7.727 503 HA PRO 83 HA PRO 83 -6.256 -5.362 2.333 504 HB2 PRO 83 2HB PRO 83 -6.799 -8.034 3.465 505 HB3 PRO 83 1HB PRO 83 -6.369 -7.577 1.816 506 HG2 PRO 83 2HG PRO 83 -4.627 -8.810 3.435 507 HG3 PRO 83 1HG PRO 83 -4.109 -7.593 2.257 508 HD2 PRO 83 2HD PRO 83 -4.453 -7.344 5.215 509 HD3 PRO 83 1HD PRO 83 -3.227 -6.628 4.151 510 H ILE 84 H ILE 84 -8.338 -4.870 2.305 511 HA ILE 84 HA ILE 84 -9.822 -4.705 4.796 512 HB ILE 84 HB ILE 84 -10.610 -3.951 1.995 513 HG12 ILE 84 1HG1 ILE 84 -8.787 -2.568 2.795 514 HG13 ILE 84 2HG1 ILE 84 -10.273 -1.630 2.768 515 HG21 ILE 84 1HG2 ILE 84 -12.440 -2.675 3.034 516 HG22 ILE 84 2HG2 ILE 84 -12.016 -3.393 4.589 517 HG23 ILE 84 3HG2 ILE 84 -12.591 -4.419 3.270 518 HD11 ILE 84 1HD1 ILE 84 -8.990 -2.860 5.186 519 HD12 ILE 84 2HD1 ILE 84 -10.518 -1.981 5.178 520 HD13 ILE 84 3HD1 ILE 84 -9.021 -1.149 4.762 521 H ASN 85 H ASN 85 -11.655 -5.794 5.254 522 HA ASN 85 HA ASN 85 -11.995 -8.385 4.099 523 HB2 ASN 85 1HB ASN 85 -12.423 -8.137 6.454 524 HB3 ASN 85 2HB ASN 85 -13.578 -6.841 6.164 525 HD21 ASN 85 1HD2 ASN 85 -16.015 -9.307 6.592 526 HD22 ASN 85 2HD2 ASN 85 -15.208 -7.934 7.268 527 H VAL 86 H VAL 86 -12.658 -8.330 2.049 528 HA VAL 86 HA VAL 86 -15.346 -7.244 1.594 529 HB VAL 86 HB VAL 86 -14.646 -7.031 -0.854 530 HG11 VAL 86 1HG1 VAL 86 -14.941 -5.084 0.583 531 HG12 VAL 86 2HG1 VAL 86 -13.602 -4.844 -0.541 532 HG13 VAL 86 3HG1 VAL 86 -13.277 -5.241 1.147 533 HG21 VAL 86 1HG2 VAL 86 -12.294 -6.824 -1.361 534 HG22 VAL 86 2HG2 VAL 86 -12.605 -8.413 -0.661 535 HG23 VAL 86 3HG2 VAL 86 -11.872 -7.145 0.322 536 H ASN 87 H ASN 87 -16.219 -9.206 2.149 537 HA ASN 87 HA ASN 87 -16.651 -11.439 2.206 538 HB2 ASN 87 1HB ASN 87 -16.016 -11.265 -0.754 539 HB3 ASN 87 2HB ASN 87 -16.884 -12.578 0.036 540 HD21 ASN 87 1HD2 ASN 87 -18.751 -9.136 -0.970 541 HD22 ASN 87 2HD2 ASN 87 -17.049 -9.355 -1.169 542 H LEU 88 H LEU 88 -14.261 -10.861 3.179 543 HA LEU 88 HA LEU 88 -11.989 -11.829 1.850 544 HB2 LEU 88 1HB LEU 88 -12.322 -10.297 3.974 545 HB3 LEU 88 2HB LEU 88 -12.140 -11.810 4.828 546 HG LEU 88 HG LEU 88 -10.037 -10.555 4.718 547 HD11 LEU 88 1HD1 LEU 88 -8.595 -12.338 3.881 548 HD12 LEU 88 2HD1 LEU 88 -9.983 -13.092 3.098 549 HD13 LEU 88 3HD1 LEU 88 -9.917 -12.974 4.857 550 HD21 LEU 88 1HD2 LEU 88 -10.221 -10.947 1.737 551 HD22 LEU 88 2HD2 LEU 88 -8.874 -10.229 2.619 552 HD23 LEU 88 3HD2 LEU 88 -10.439 -9.418 2.587 Start of MODEL 20 1 H1 GLY 1 1H GLY 1 -13.445 11.076 7.582 2 H2 GLY 1 2H GLY 1 -13.998 10.028 8.787 3 H3 GLY 1 3H GLY 1 -15.004 11.259 8.208 4 HA2 GLY 1 1HA GLY 1 -14.035 8.929 6.658 5 HA3 GLY 1 2HA GLY 1 -15.659 9.131 7.296 6 H SER 2 H SER 2 -13.311 10.382 4.989 7 HA SER 2 HA SER 2 -15.457 11.755 3.537 8 HB2 SER 2 1HB SER 2 -12.485 11.730 2.955 9 HB3 SER 2 2HB SER 2 -13.692 12.805 2.251 10 HG SER 2 HG SER 2 -13.654 12.831 4.994 11 H GLY 3 H GLY 3 -15.524 8.960 3.668 12 HA2 GLY 3 1HA GLY 3 -16.153 7.679 1.592 13 HA3 GLY 3 2HA GLY 3 -14.530 8.073 1.037 14 H SER 4 H SER 4 -13.496 7.844 3.787 15 HA SER 4 HA SER 4 -12.763 5.111 3.730 16 HB2 SER 4 1HB SER 4 -11.689 5.704 5.966 17 HB3 SER 4 2HB SER 4 -11.152 6.634 4.567 18 HG SER 4 HG SER 4 -12.543 7.439 6.803 19 H SER 5 H SER 5 -14.300 3.649 4.094 20 HA SER 5 HA SER 5 -16.146 3.995 6.319 21 HB2 SER 5 1HB SER 5 -15.951 1.683 4.385 22 HB3 SER 5 2HB SER 5 -17.318 2.106 5.415 23 HG SER 5 HG SER 5 -16.562 4.178 3.826 24 H GLN 6 H GLN 6 -13.521 1.910 5.256 25 HA GLN 6 HA GLN 6 -13.664 0.426 7.769 26 HB2 GLN 6 1HB GLN 6 -12.139 -0.201 5.245 27 HB3 GLN 6 2HB GLN 6 -12.220 -1.224 6.667 28 HG2 GLN 6 1HG GLN 6 -14.554 -0.463 4.933 29 HG3 GLN 6 2HG GLN 6 -13.682 -1.990 4.879 30 HE21 GLN 6 1HE2 GLN 6 -14.911 -2.548 8.408 31 HE22 GLN 6 2HE2 GLN 6 -13.356 -2.146 7.766 32 H CYS 7 H CYS 7 -11.794 0.014 8.958 33 HA CYS 7 HA CYS 7 -9.693 0.184 9.776 34 HB2 CYS 7 2HB CYS 7 -8.927 -0.154 7.487 35 HB3 CYS 7 1HB CYS 7 -9.065 1.573 7.175 36 H ASN 8 H ASN 8 -8.817 1.443 11.257 37 HA ASN 8 HA ASN 8 -9.588 4.255 11.358 38 HB2 ASN 8 1HB ASN 8 -8.266 2.473 13.406 39 HB3 ASN 8 2HB ASN 8 -8.617 4.177 13.660 40 HD21 ASN 8 1HD2 ASN 8 -12.257 3.149 13.205 41 HD22 ASN 8 2HD2 ASN 8 -11.159 3.904 12.104 42 H ALA 9 H ALA 9 -6.834 2.292 10.664 43 HA ALA 9 HA ALA 9 -4.799 4.074 11.497 44 HB1 ALA 9 1HB ALA 9 -3.280 2.687 10.167 45 HB2 ALA 9 2HB ALA 9 -4.671 1.880 9.437 46 HB3 ALA 9 3HB ALA 9 -4.360 1.707 11.164 47 H GLY 10 H GLY 10 -6.862 4.101 8.837 48 HA2 GLY 10 1HA GLY 10 -6.016 6.599 7.914 49 HA3 GLY 10 2HA GLY 10 -5.288 5.365 6.891 50 HA PRO 11 HA PRO 11 -9.460 5.772 5.154 51 HB2 PRO 11 2HB PRO 11 -8.797 6.476 2.677 52 HB3 PRO 11 1HB PRO 11 -8.700 7.650 3.995 53 HG2 PRO 11 2HG PRO 11 -6.530 6.188 2.591 54 HG3 PRO 11 1HG PRO 11 -6.512 7.803 3.310 55 HD2 PRO 11 2HD PRO 11 -5.557 5.385 4.460 56 HD3 PRO 11 1HD PRO 11 -5.678 6.973 5.247 57 H VAL 12 H VAL 12 -10.273 4.735 3.004 58 HA VAL 12 HA VAL 12 -9.230 2.032 2.891 59 HB VAL 12 HB VAL 12 -11.131 1.685 1.243 60 HG11 VAL 12 1HG1 VAL 12 -11.264 1.022 3.581 61 HG12 VAL 12 2HG1 VAL 12 -12.822 1.628 3.014 62 HG13 VAL 12 3HG1 VAL 12 -11.793 2.646 4.025 63 HG21 VAL 12 1HG2 VAL 12 -11.927 4.430 2.219 64 HG22 VAL 12 2HG2 VAL 12 -12.909 3.361 1.223 65 HG23 VAL 12 3HG2 VAL 12 -11.410 4.038 0.583 66 H GLN 13 H GLN 13 -7.930 1.278 1.349 67 HA GLN 13 HA GLN 13 -7.381 3.088 -0.913 68 HB2 GLN 13 1HB GLN 13 -5.373 1.045 -0.102 69 HB3 GLN 13 2HB GLN 13 -5.134 2.625 -0.821 70 HG2 GLN 13 1HG GLN 13 -6.012 2.261 2.023 71 HG3 GLN 13 2HG GLN 13 -4.327 2.295 1.533 72 HE21 GLN 13 1HE2 GLN 13 -6.230 5.803 0.738 73 HE22 GLN 13 2HE2 GLN 13 -6.864 4.312 0.156 74 H CYS 14 H CYS 14 -7.076 2.227 -2.904 75 HA CYS 14 HA CYS 14 -7.904 -0.574 -3.273 76 HB2 CYS 14 2HB CYS 14 -9.567 1.011 -4.146 77 HB3 CYS 14 1HB CYS 14 -8.337 1.793 -5.125 78 H CYS 15 H CYS 15 -6.268 -1.796 -3.849 79 HA CYS 15 HA CYS 15 -3.968 -0.514 -5.172 80 HB2 CYS 15 2HB CYS 15 -3.925 -2.787 -3.176 81 HB3 CYS 15 1HB CYS 15 -2.527 -1.957 -3.857 82 H ASN 16 H ASN 16 -3.016 -1.526 -6.830 83 HA ASN 16 HA ASN 16 -4.435 -3.479 -8.305 84 HB2 ASN 16 1HB ASN 16 -2.781 -1.747 -9.170 85 HB3 ASN 16 2HB ASN 16 -1.524 -2.841 -8.619 86 HD21 ASN 16 1HD2 ASN 16 -1.559 -4.196 -11.812 87 HD22 ASN 16 2HD2 ASN 16 -0.704 -3.283 -10.620 88 H THR 17 H THR 17 -1.655 -3.616 -6.177 89 HA THR 17 HA THR 17 -1.983 -6.507 -5.951 90 HB THR 17 HB THR 17 0.636 -5.161 -6.673 91 HG1 THR 17 1HG THR 17 -1.201 -6.826 -7.991 92 HG21 THR 17 1HG2 THR 17 1.583 -7.467 -6.578 93 HG22 THR 17 2HG2 THR 17 0.100 -7.990 -5.779 94 HG23 THR 17 3HG2 THR 17 1.149 -6.799 -5.003 95 H LEU 18 H LEU 18 -2.011 -7.062 -3.863 96 HA LEU 18 HA LEU 18 -0.633 -5.338 -1.930 97 HB2 LEU 18 1HB LEU 18 -2.641 -7.563 -1.583 98 HB3 LEU 18 2HB LEU 18 -1.753 -6.875 -0.240 99 HG LEU 18 HG LEU 18 -3.655 -5.382 -2.035 100 HD11 LEU 18 1HD1 LEU 18 -4.686 -7.005 -0.447 101 HD12 LEU 18 2HD1 LEU 18 -5.130 -5.328 -0.147 102 HD13 LEU 18 3HD1 LEU 18 -3.929 -6.116 0.878 103 HD21 LEU 18 1HD2 LEU 18 -3.347 -3.530 -0.481 104 HD22 LEU 18 2HD2 LEU 18 -1.822 -3.967 -1.246 105 HD23 LEU 18 3HD2 LEU 18 -2.152 -4.467 0.415 106 H THR 19 H THR 19 1.270 -5.901 -1.177 107 HA THR 19 HA THR 19 2.055 -8.631 -0.823 108 HB THR 19 HB THR 19 2.447 -8.497 -3.212 109 HG1 THR 19 1HG THR 19 4.098 -9.683 -2.674 110 HG21 THR 19 1HG2 THR 19 2.652 -6.202 -3.702 111 HG22 THR 19 2HG2 THR 19 4.236 -6.893 -4.062 112 HG23 THR 19 3HG2 THR 19 3.987 -5.999 -2.565 113 H SER 20 H SER 20 4.809 -8.284 -0.621 114 HA SER 20 HA SER 20 4.909 -6.411 1.643 115 HB2 SER 20 1HB SER 20 6.686 -8.775 0.987 116 HB3 SER 20 2HB SER 20 6.806 -7.772 2.433 117 HG SER 20 HG SER 20 4.281 -8.636 2.137 118 H ALA 21 H ALA 21 7.080 -5.399 2.031 119 HA ALA 21 HA ALA 21 7.703 -3.818 -0.246 120 HB1 ALA 21 1HB ALA 21 9.074 -3.935 2.432 121 HB2 ALA 21 2HB ALA 21 7.684 -2.928 2.023 122 HB3 ALA 21 3HB ALA 21 9.237 -2.653 1.232 123 H SER 22 H SER 22 8.681 -6.852 0.327 124 HA SER 22 HA SER 22 11.402 -6.566 -0.625 125 HB2 SER 22 1HB SER 22 10.721 -8.313 1.034 126 HB3 SER 22 2HB SER 22 9.783 -9.080 -0.229 127 HG SER 22 HG SER 22 11.842 -10.029 -0.034 128 H ASN 23 H ASN 23 8.334 -6.591 -1.946 129 HA ASN 23 HA ASN 23 8.828 -8.103 -4.333 130 HB2 ASN 23 1HB ASN 23 6.549 -7.642 -3.294 131 HB3 ASN 23 2HB ASN 23 6.681 -6.010 -3.933 132 HD21 ASN 23 1HD2 ASN 23 5.736 -9.113 -6.339 133 HD22 ASN 23 2HD2 ASN 23 6.150 -9.338 -4.676 134 H SER 24 H SER 24 9.138 -7.328 -6.417 135 HA SER 24 HA SER 24 10.928 -5.158 -6.641 136 HB2 SER 24 1HB SER 24 9.473 -6.650 -8.835 137 HB3 SER 24 2HB SER 24 10.916 -5.658 -9.033 138 HG SER 24 HG SER 24 10.631 -8.203 -7.929 139 H GLN 25 H GLN 25 7.453 -5.433 -7.162 140 HA GLN 25 HA GLN 25 7.081 -2.935 -8.454 141 HB2 GLN 25 1HB GLN 25 5.186 -4.197 -6.468 142 HB3 GLN 25 2HB GLN 25 4.789 -3.027 -7.713 143 HG2 GLN 25 1HG GLN 25 5.663 -5.858 -8.162 144 HG3 GLN 25 2HG GLN 25 4.014 -5.247 -8.256 145 HE21 GLN 25 1HE2 GLN 25 4.353 -3.893 -11.458 146 HE22 GLN 25 2HE2 GLN 25 3.402 -3.985 -10.019 147 H ALA 26 H ALA 26 6.889 -3.947 -5.086 148 HA ALA 26 HA ALA 26 6.223 -1.448 -4.009 149 HB1 ALA 26 1HB ALA 26 7.584 -3.792 -2.693 150 HB2 ALA 26 2HB ALA 26 5.844 -3.555 -2.849 151 HB3 ALA 26 3HB ALA 26 6.801 -2.449 -1.861 152 H ALA 27 H ALA 27 9.359 -3.161 -3.959 153 HA ALA 27 HA ALA 27 10.710 -1.067 -2.634 154 HB1 ALA 27 1HB ALA 27 12.769 -2.250 -3.258 155 HB2 ALA 27 2HB ALA 27 11.851 -3.262 -4.376 156 HB3 ALA 27 3HB ALA 27 11.546 -3.362 -2.642 157 H GLY 28 H GLY 28 10.223 -1.735 -6.075 158 HA2 GLY 28 1HA GLY 28 11.956 0.195 -7.127 159 HA3 GLY 28 2HA GLY 28 10.442 -0.309 -7.871 160 H LEU 29 H LEU 29 8.577 0.474 -6.152 161 HA LEU 29 HA LEU 29 8.275 3.250 -6.502 162 HB2 LEU 29 1HB LEU 29 6.943 1.394 -4.571 163 HB3 LEU 29 2HB LEU 29 6.363 2.972 -4.998 164 HG LEU 29 HG LEU 29 6.584 0.652 -6.907 165 HD11 LEU 29 1HD1 LEU 29 4.087 0.757 -6.826 166 HD12 LEU 29 2HD1 LEU 29 4.242 1.839 -5.440 167 HD13 LEU 29 3HD1 LEU 29 4.850 0.185 -5.342 168 HD21 LEU 29 1HD2 LEU 29 6.842 2.784 -8.034 169 HD22 LEU 29 2HD2 LEU 29 5.397 3.408 -7.239 170 HD23 LEU 29 3HD2 LEU 29 5.265 2.091 -8.405 171 H ILE 30 H ILE 30 8.897 1.342 -3.571 172 HA ILE 30 HA ILE 30 9.120 3.304 -1.657 173 HB ILE 30 HB ILE 30 10.658 0.731 -1.938 174 HG12 ILE 30 1HG1 ILE 30 8.237 1.455 -0.293 175 HG13 ILE 30 2HG1 ILE 30 8.180 0.608 -1.830 176 HG21 ILE 30 1HG2 ILE 30 11.709 2.463 -0.387 177 HG22 ILE 30 2HG2 ILE 30 11.349 0.879 0.304 178 HG23 ILE 30 3HG2 ILE 30 10.282 2.243 0.630 179 HD11 ILE 30 1HD1 ILE 30 9.372 -1.250 -0.878 180 HD12 ILE 30 2HD1 ILE 30 7.938 -0.879 0.081 181 HD13 ILE 30 3HD1 ILE 30 9.534 -0.391 0.655 182 H GLN 31 H GLN 31 11.682 2.013 -3.711 183 HA GLN 31 HA GLN 31 13.648 3.731 -2.670 184 HB2 GLN 31 1HB GLN 31 13.529 1.903 -5.040 185 HB3 GLN 31 2HB GLN 31 14.963 2.870 -4.693 186 HG2 GLN 31 1HG GLN 31 15.033 1.793 -2.455 187 HG3 GLN 31 2HG GLN 31 13.688 0.780 -2.964 188 HE21 GLN 31 1HE2 GLN 31 16.006 -0.562 -5.625 189 HE22 GLN 31 2HE2 GLN 31 14.670 0.533 -5.694 190 H GLN 32 H GLN 32 11.208 4.149 -5.078 191 HA GLN 32 HA GLN 32 12.525 6.361 -6.381 192 HB2 GLN 32 1HB GLN 32 9.657 5.433 -6.340 193 HB3 GLN 32 2HB GLN 32 10.144 6.920 -7.136 194 HG2 GLN 32 1HG GLN 32 11.075 4.142 -7.793 195 HG3 GLN 32 2HG GLN 32 9.945 5.136 -8.707 196 HE21 GLN 32 1HE2 GLN 32 13.449 5.267 -10.096 197 HE22 GLN 32 2HE2 GLN 32 12.443 3.959 -9.580 198 H LEU 33 H LEU 33 10.248 5.931 -3.755 199 HA LEU 33 HA LEU 33 9.850 8.755 -3.346 200 HB2 LEU 33 1HB LEU 33 9.212 6.675 -1.298 201 HB3 LEU 33 2HB LEU 33 8.348 8.151 -1.676 202 HG LEU 33 HG LEU 33 8.418 5.727 -3.469 203 HD11 LEU 33 1HD1 LEU 33 6.198 6.612 -1.650 204 HD12 LEU 33 2HD1 LEU 33 7.328 5.311 -1.281 205 HD13 LEU 33 3HD1 LEU 33 6.253 5.174 -2.667 206 HD21 LEU 33 1HD2 LEU 33 6.316 6.890 -4.360 207 HD22 LEU 33 2HD2 LEU 33 7.895 7.541 -4.826 208 HD23 LEU 33 3HD2 LEU 33 6.950 8.339 -3.561 209 H GLY 34 H GLY 34 12.031 6.335 -2.315 210 HA2 GLY 34 1HA GLY 34 14.002 6.525 -1.134 211 HA3 GLY 34 2HA GLY 34 13.626 8.218 -0.835 212 H LEU 35 H LEU 35 11.671 5.386 -0.113 213 HA LEU 35 HA LEU 35 11.155 6.382 2.528 214 HB2 LEU 35 1HB LEU 35 10.203 4.062 0.928 215 HB3 LEU 35 2HB LEU 35 9.838 4.151 2.632 216 HG LEU 35 HG LEU 35 9.017 6.137 0.520 217 HD11 LEU 35 1HD1 LEU 35 6.766 5.346 0.998 218 HD12 LEU 35 2HD1 LEU 35 7.414 4.181 2.152 219 HD13 LEU 35 3HD1 LEU 35 7.797 4.031 0.436 220 HD21 LEU 35 1HD2 LEU 35 8.493 6.103 3.490 221 HD22 LEU 35 2HD2 LEU 35 7.694 7.168 2.334 222 HD23 LEU 35 3HD2 LEU 35 9.431 7.301 2.598 223 H SER 36 H SER 36 12.940 6.220 3.803 224 HA SER 36 HA SER 36 14.239 3.668 4.175 225 HB2 SER 36 1HB SER 36 14.568 6.275 5.679 226 HB3 SER 36 2HB SER 36 15.650 4.894 5.725 227 HG SER 36 HG SER 36 15.589 6.924 3.975 228 H GLY 37 H GLY 37 13.861 2.290 5.867 229 HA2 GLY 37 1HA GLY 37 13.116 2.004 8.192 230 HA3 GLY 37 2HA GLY 37 11.817 3.133 7.830 231 H VAL 38 H VAL 38 11.294 1.989 5.214 232 HA VAL 38 HA VAL 38 9.542 -0.163 5.958 233 HB VAL 38 HB VAL 38 10.285 0.745 3.169 234 HG11 VAL 38 1HG1 VAL 38 8.065 -0.134 2.590 235 HG12 VAL 38 2HG1 VAL 38 7.864 -0.685 4.253 236 HG13 VAL 38 3HG1 VAL 38 9.128 -1.381 3.241 237 HG21 VAL 38 1HG2 VAL 38 9.540 2.668 4.459 238 HG22 VAL 38 2HG2 VAL 38 8.101 1.785 4.971 239 HG23 VAL 38 3HG2 VAL 38 8.318 2.206 3.273 240 H GLY 39 H GLY 39 10.433 -2.080 6.425 241 HA2 GLY 39 1HA GLY 39 12.731 -3.065 4.913 242 HA3 GLY 39 2HA GLY 39 12.071 -3.774 6.379 243 H ALA 40 H ALA 40 12.420 -5.728 4.899 244 HA ALA 40 HA ALA 40 10.740 -5.988 2.607 245 HB1 ALA 40 1HB ALA 40 12.399 -7.998 4.113 246 HB2 ALA 40 2HB ALA 40 12.830 -7.146 2.631 247 HB3 ALA 40 3HB ALA 40 11.543 -8.351 2.616 248 H ASN 41 H ASN 41 10.368 -6.808 5.974 249 HA ASN 41 HA ASN 41 8.199 -8.648 5.530 250 HB2 ASN 41 1HB ASN 41 8.048 -8.744 7.944 251 HB3 ASN 41 2HB ASN 41 9.739 -8.829 7.473 252 HD21 ASN 41 1HD2 ASN 41 8.349 -5.770 9.728 253 HD22 ASN 41 2HD2 ASN 41 7.295 -6.967 9.059 254 H VAL 42 H VAL 42 8.428 -5.384 5.292 255 HA VAL 42 HA VAL 42 6.080 -4.581 6.719 256 HB VAL 42 HB VAL 42 7.694 -3.079 4.660 257 HG11 VAL 42 1HG1 VAL 42 6.780 -1.066 5.823 258 HG12 VAL 42 2HG1 VAL 42 5.635 -2.129 6.652 259 HG13 VAL 42 3HG1 VAL 42 5.582 -1.976 4.895 260 HG21 VAL 42 1HG2 VAL 42 7.879 -3.296 7.638 261 HG22 VAL 42 2HG2 VAL 42 8.639 -1.999 6.712 262 HG23 VAL 42 3HG2 VAL 42 9.113 -3.679 6.431 263 HA PRO 43 HA PRO 43 3.189 -5.618 3.520 264 HB2 PRO 43 2HB PRO 43 1.179 -4.040 4.741 265 HB3 PRO 43 1HB PRO 43 1.396 -5.773 4.879 266 HG2 PRO 43 2HG PRO 43 1.790 -3.823 6.884 267 HG3 PRO 43 1HG PRO 43 2.097 -5.562 6.994 268 HD2 PRO 43 2HD PRO 43 3.971 -3.365 6.722 269 HD3 PRO 43 1HD PRO 43 4.292 -5.054 7.131 270 H VAL 44 H VAL 44 2.694 -4.591 1.625 271 HA VAL 44 HA VAL 44 2.457 -1.672 1.680 272 HB VAL 44 HB VAL 44 3.884 -1.373 -0.251 273 HG11 VAL 44 1HG1 VAL 44 5.241 -2.883 1.974 274 HG12 VAL 44 2HG1 VAL 44 4.964 -1.144 1.884 275 HG13 VAL 44 3HG1 VAL 44 6.080 -1.918 0.758 276 HG21 VAL 44 1HG2 VAL 44 5.355 -3.337 -0.928 277 HG22 VAL 44 2HG2 VAL 44 3.681 -3.349 -1.482 278 HG23 VAL 44 3HG2 VAL 44 4.169 -4.351 -0.110 279 H GLY 45 H GLY 45 1.632 -0.810 -0.356 280 HA2 GLY 45 1HA GLY 45 -0.018 -2.782 -1.791 281 HA3 GLY 45 2HA GLY 45 -0.622 -1.191 -1.353 282 H ILE 46 H ILE 46 0.111 -2.782 -3.891 283 HA ILE 46 HA ILE 46 1.923 -0.917 -5.207 284 HB ILE 46 HB ILE 46 0.661 -3.528 -6.031 285 HG12 ILE 46 1HG1 ILE 46 2.866 -4.443 -6.095 286 HG13 ILE 46 2HG1 ILE 46 3.598 -2.873 -5.971 287 HG21 ILE 46 1HG2 ILE 46 2.347 -1.712 -7.736 288 HG22 ILE 46 2HG2 ILE 46 0.642 -2.093 -7.970 289 HG23 ILE 46 3HG2 ILE 46 1.862 -3.352 -8.163 290 HD11 ILE 46 1HD1 ILE 46 2.049 -4.152 -3.774 291 HD12 ILE 46 2HD1 ILE 46 3.043 -2.692 -3.688 292 HD13 ILE 46 3HD1 ILE 46 3.797 -4.263 -3.978 293 H ASN 47 H ASN 47 1.080 0.806 -6.210 294 HA ASN 47 HA ASN 47 -0.294 2.167 -7.409 295 HB2 ASN 47 1HB ASN 47 -0.200 0.066 -8.935 296 HB3 ASN 47 2HB ASN 47 -1.823 -0.245 -8.346 297 HD21 ASN 47 1HD2 ASN 47 -1.768 1.786 -11.524 298 HD22 ASN 47 2HD2 ASN 47 -0.881 0.385 -11.031 299 H CYS 48 H CYS 48 -0.969 2.328 -4.946 300 HA CYS 48 HA CYS 48 -3.743 1.535 -4.569 301 HB2 CYS 48 2HB CYS 48 -1.781 2.833 -2.674 302 HB3 CYS 48 1HB CYS 48 -3.407 2.325 -2.265 303 H ASN 49 H ASN 49 -5.398 2.896 -4.531 304 HA ASN 49 HA ASN 49 -4.875 5.759 -4.184 305 HB2 ASN 49 1HB ASN 49 -6.706 6.273 -5.793 306 HB3 ASN 49 2HB ASN 49 -5.310 5.519 -6.545 307 HD21 ASN 49 1HD2 ASN 49 -7.024 2.664 -7.598 308 HD22 ASN 49 2HD2 ASN 49 -5.494 3.427 -7.357 309 HA PRO 50 HA PRO 50 -7.866 5.449 -1.028 310 HB2 PRO 50 2HB PRO 50 -8.647 8.226 -1.459 311 HB3 PRO 50 1HB PRO 50 -7.717 7.531 -0.131 312 HG2 PRO 50 2HG PRO 50 -6.614 9.173 -1.984 313 HG3 PRO 50 1HG PRO 50 -5.703 7.882 -1.183 314 HD2 PRO 50 2HD PRO 50 -6.962 7.902 -3.901 315 HD3 PRO 50 1HD PRO 50 -5.370 7.297 -3.411 316 H ILE 51 H ILE 51 -9.768 4.479 -1.195 317 HA ILE 51 HA ILE 51 -11.486 4.952 -3.461 318 HB ILE 51 HB ILE 51 -12.363 3.306 -1.126 319 HG12 ILE 51 1HG1 ILE 51 -10.256 2.471 -3.133 320 HG13 ILE 51 2HG1 ILE 51 -10.009 2.684 -1.404 321 HG21 ILE 51 1HG2 ILE 51 -13.350 1.948 -2.863 322 HG22 ILE 51 2HG2 ILE 51 -12.499 2.863 -4.107 323 HG23 ILE 51 3HG2 ILE 51 -13.759 3.642 -3.146 324 HD11 ILE 51 1HD1 ILE 51 -11.785 0.631 -2.694 325 HD12 ILE 51 2HD1 ILE 51 -11.555 0.850 -0.960 326 HD13 ILE 51 3HD1 ILE 51 -10.203 0.340 -1.971 327 H THR 52 H THR 52 -12.122 7.123 -3.116 328 HA THR 52 HA THR 52 -13.822 7.498 -0.749 329 HB THR 52 HB THR 52 -13.359 9.955 -1.066 330 HG1 THR 52 1HG THR 52 -11.067 9.291 -2.533 331 HG21 THR 52 1HG2 THR 52 -11.061 8.065 -0.523 332 HG22 THR 52 2HG2 THR 52 -12.214 8.701 0.651 333 HG23 THR 52 3HG2 THR 52 -11.054 9.786 -0.121 334 H GLY 53 H GLY 53 -13.753 7.435 -4.153 335 HA2 GLY 53 1HA GLY 53 -16.246 8.855 -4.510 336 HA3 GLY 53 2HA GLY 53 -15.375 7.941 -5.737 337 H ILE 54 H ILE 54 -15.149 5.491 -4.581 338 HA ILE 54 HA ILE 54 -17.831 4.453 -4.718 339 HB ILE 54 HB ILE 54 -15.272 2.981 -4.085 340 HG12 ILE 54 1HG1 ILE 54 -15.116 4.096 -6.263 341 HG13 ILE 54 2HG1 ILE 54 -15.231 2.352 -6.458 342 HG21 ILE 54 1HG2 ILE 54 -16.476 0.985 -4.804 343 HG22 ILE 54 2HG2 ILE 54 -17.928 1.950 -5.067 344 HG23 ILE 54 3HG2 ILE 54 -17.281 1.758 -3.438 345 HD11 ILE 54 1HD1 ILE 54 -16.572 3.494 -8.111 346 HD12 ILE 54 2HD1 ILE 54 -17.460 4.337 -6.843 347 HD13 ILE 54 3HD1 ILE 54 -17.608 2.587 -7.008 348 H GLY 55 H GLY 55 -18.937 3.369 -3.055 349 HA2 GLY 55 1HA GLY 55 -19.421 2.703 -0.896 350 HA3 GLY 55 2HA GLY 55 -17.792 3.160 -0.422 351 H ALA 56 H ALA 56 -17.421 5.602 -0.445 352 HA ALA 56 HA ALA 56 -17.818 7.599 0.565 353 HB1 ALA 56 1HB ALA 56 -20.617 7.182 -0.469 354 HB2 ALA 56 2HB ALA 56 -19.279 7.886 -1.374 355 HB3 ALA 56 3HB ALA 56 -19.914 8.714 0.046 356 H GLY 57 H GLY 57 -18.126 5.203 2.177 357 HA2 GLY 57 1HA GLY 57 -18.470 5.396 4.581 358 HA3 GLY 57 2HA GLY 57 -19.934 6.304 4.235 359 H SER 58 H SER 58 -20.360 4.234 1.980 360 HA SER 58 HA SER 58 -21.965 2.461 3.607 361 HB2 SER 58 1HB SER 58 -21.661 2.569 0.598 362 HB3 SER 58 2HB SER 58 -22.927 1.729 1.494 363 HG SER 58 HG SER 58 -23.011 4.176 0.626 364 H GLY 59 H GLY 59 -18.808 2.365 2.864 365 HA2 GLY 59 1HA GLY 59 -17.413 0.489 3.277 366 HA3 GLY 59 2HA GLY 59 -18.758 -0.568 2.867 367 H SER 60 H SER 60 -16.362 1.637 1.533 368 HA SER 60 HA SER 60 -17.025 1.177 -1.178 369 HB2 SER 60 1HB SER 60 -14.272 2.031 -0.548 370 HB3 SER 60 2HB SER 60 -15.488 2.783 -1.599 371 HG SER 60 HG SER 60 -15.141 4.090 0.200 372 H SER 61 H SER 61 -16.379 -0.328 -2.569 373 HA SER 61 HA SER 61 -14.449 -2.344 -1.688 374 HB2 SER 61 1HB SER 61 -15.359 -3.561 -3.761 375 HB3 SER 61 2HB SER 61 -16.472 -3.352 -2.408 376 HG SER 61 HG SER 61 -17.632 -1.973 -3.542 377 H CYS 62 H CYS 62 -12.978 -3.196 -3.453 378 HA CYS 62 HA CYS 62 -12.003 -0.951 -5.098 379 HB2 CYS 62 2HB CYS 62 -10.382 -1.239 -3.405 380 HB3 CYS 62 1HB CYS 62 -10.486 -2.992 -3.485 381 H ASN 63 H ASN 63 -11.182 -1.437 -7.153 382 HA ASN 63 HA ASN 63 -12.434 -3.531 -8.545 383 HB2 ASN 63 1HB ASN 63 -11.704 -1.505 -9.679 384 HB3 ASN 63 2HB ASN 63 -10.024 -1.870 -9.302 385 HD21 ASN 63 1HD2 ASN 63 -9.559 -4.040 -11.971 386 HD22 ASN 63 2HD2 ASN 63 -8.918 -3.325 -10.530 387 H ALA 64 H ALA 64 -9.029 -3.165 -7.558 388 HA ALA 64 HA ALA 64 -8.592 -5.981 -8.180 389 HB1 ALA 64 1HB ALA 64 -6.221 -5.507 -7.866 390 HB2 ALA 64 2HB ALA 64 -6.610 -3.859 -7.366 391 HB3 ALA 64 3HB ALA 64 -6.952 -4.385 -9.015 392 H ASN 65 H ASN 65 -6.917 -4.271 -5.604 393 HA ASN 65 HA ASN 65 -8.093 -6.161 -3.669 394 HB2 ASN 65 1HB ASN 65 -5.232 -5.219 -3.763 395 HB3 ASN 65 2HB ASN 65 -5.910 -6.300 -2.562 396 HD21 ASN 65 1HD2 ASN 65 -4.810 -7.648 -6.225 397 HD22 ASN 65 2HD2 ASN 65 -4.848 -5.962 -5.849 398 HA PRO 66 HA PRO 66 -8.754 -2.307 -1.491 399 HB2 PRO 66 2HB PRO 66 -10.515 -3.262 0.283 400 HB3 PRO 66 1HB PRO 66 -10.960 -3.022 -1.411 401 HG2 PRO 66 2HG PRO 66 -10.273 -5.541 0.031 402 HG3 PRO 66 1HG PRO 66 -11.489 -5.266 -1.230 403 HD2 PRO 66 2HD PRO 66 -8.945 -6.351 -1.632 404 HD3 PRO 66 1HD PRO 66 -9.976 -5.658 -2.897 405 H ALA 67 H ALA 67 -7.473 -1.515 0.051 406 HA ALA 67 HA ALA 67 -6.729 -3.190 2.324 407 HB1 ALA 67 1HB ALA 67 -4.347 -2.637 2.076 408 HB2 ALA 67 2HB ALA 67 -4.701 -1.832 0.546 409 HB3 ALA 67 3HB ALA 67 -4.949 -3.570 0.707 410 H CYS 68 H CYS 68 -5.759 -1.947 4.055 411 HA CYS 68 HA CYS 68 -6.100 0.963 3.775 412 HB2 CYS 68 2HB CYS 68 -7.655 0.223 5.445 413 HB3 CYS 68 1HB CYS 68 -6.427 -0.775 6.223 414 H CYS 69 H CYS 69 -4.270 2.086 3.907 415 HA CYS 69 HA CYS 69 -1.932 0.701 5.004 416 HB2 CYS 69 2HB CYS 69 -1.811 2.909 2.974 417 HB3 CYS 69 1HB CYS 69 -0.593 1.717 3.397 418 H ASP 70 H ASP 70 -0.445 1.904 6.184 419 HA ASP 70 HA ASP 70 -1.530 3.875 7.886 420 HB2 ASP 70 1HB ASP 70 0.371 2.298 8.424 421 HB3 ASP 70 2HB ASP 70 1.397 3.299 7.413 422 H ASN 71 H ASN 71 0.763 4.055 5.185 423 HA ASN 71 HA ASN 71 -0.247 6.732 4.565 424 HB2 ASN 71 1HB ASN 71 2.710 6.067 4.721 425 HB3 ASN 71 2HB ASN 71 2.050 7.542 4.029 426 HD21 ASN 71 1HD2 ASN 71 2.618 7.169 7.986 427 HD22 ASN 71 2HD2 ASN 71 2.996 5.913 6.860 428 H VAL 72 H VAL 72 -0.351 7.090 2.314 429 HA VAL 72 HA VAL 72 1.215 5.251 0.664 430 HB VAL 72 HB VAL 72 -0.436 4.655 -0.745 431 HG11 VAL 72 1HG1 VAL 72 -2.029 5.248 1.723 432 HG12 VAL 72 2HG1 VAL 72 -1.160 3.762 1.337 433 HG13 VAL 72 3HG1 VAL 72 -2.573 4.226 0.392 434 HG21 VAL 72 1HG2 VAL 72 -2.415 5.934 -1.325 435 HG22 VAL 72 2HG2 VAL 72 -0.938 6.891 -1.513 436 HG23 VAL 72 3HG2 VAL 72 -1.988 7.147 -0.114 437 H TYR 73 H TYR 73 1.448 6.112 -1.589 438 HA TYR 73 HA TYR 73 1.714 9.041 -1.517 439 HB2 TYR 73 2HB TYR 73 3.728 6.995 -2.425 440 HB3 TYR 73 1HB TYR 73 3.929 8.737 -2.598 441 HD1 TYR 73 1HD TYR 73 4.339 10.138 -0.626 442 HD2 TYR 73 2HD TYR 73 3.983 5.911 -0.274 443 HE1 TYR 73 1HE TYR 73 5.290 10.249 1.637 444 HE2 TYR 73 2HE TYR 73 4.932 6.012 1.995 445 HH TYR 73 HH TYR 73 5.211 8.837 3.744 446 H THR 74 H THR 74 2.136 9.921 -3.756 447 HA THR 74 HA THR 74 -0.185 9.199 -5.220 448 HB THR 74 HB THR 74 0.673 11.046 -6.797 449 HG1 THR 74 1HG THR 74 2.602 11.785 -6.363 450 HG21 THR 74 1HG2 THR 74 0.148 11.659 -3.886 451 HG22 THR 74 2HG2 THR 74 -1.079 11.390 -5.124 452 HG23 THR 74 3HG2 THR 74 -0.019 12.796 -5.224 453 H ASN 75 H ASN 75 3.112 8.269 -5.553 454 HA ASN 75 HA ASN 75 2.957 7.440 -8.283 455 HB2 ASN 75 1HB ASN 75 4.916 6.086 -7.824 456 HB3 ASN 75 2HB ASN 75 5.117 7.649 -7.042 457 HD21 ASN 75 1HD2 ASN 75 5.986 4.743 -4.801 458 HD22 ASN 75 2HD2 ASN 75 6.337 5.036 -6.467 459 H GLY 76 H GLY 76 1.602 6.408 -5.388 460 HA2 GLY 76 1HA GLY 76 -0.261 4.941 -5.409 461 HA3 GLY 76 2HA GLY 76 0.498 4.040 -6.716 462 H LEU 77 H LEU 77 2.661 4.935 -4.184 463 HA LEU 77 HA LEU 77 2.783 2.111 -3.444 464 HB2 LEU 77 1HB LEU 77 4.817 3.356 -4.087 465 HB3 LEU 77 2HB LEU 77 4.583 4.411 -2.722 466 HG LEU 77 HG LEU 77 6.344 2.536 -2.547 467 HD11 LEU 77 1HD1 LEU 77 5.692 3.892 -0.658 468 HD12 LEU 77 2HD1 LEU 77 5.892 2.206 -0.168 469 HD13 LEU 77 3HD1 LEU 77 4.272 2.877 -0.394 470 HD21 LEU 77 1HD2 LEU 77 4.911 0.733 -3.374 471 HD22 LEU 77 2HD2 LEU 77 3.863 0.930 -1.967 472 HD23 LEU 77 3HD2 LEU 77 5.534 0.399 -1.760 473 H GLY 78 H GLY 78 1.754 1.389 -1.733 474 HA2 GLY 78 1HA GLY 78 1.122 3.283 0.432 475 HA3 GLY 78 2HA GLY 78 0.245 1.798 0.099 476 H VAL 79 H VAL 79 1.781 2.923 2.486 477 HA VAL 79 HA VAL 79 3.555 0.612 2.922 478 HB VAL 79 HB VAL 79 4.523 2.974 3.108 479 HG11 VAL 79 1HG1 VAL 79 2.925 3.012 5.653 480 HG12 VAL 79 2HG1 VAL 79 2.679 4.047 4.247 481 HG13 VAL 79 3HG1 VAL 79 4.164 4.178 5.189 482 HG21 VAL 79 1HG2 VAL 79 5.648 1.022 4.028 483 HG22 VAL 79 2HG2 VAL 79 4.727 1.189 5.523 484 HG23 VAL 79 3HG2 VAL 79 5.881 2.437 5.052 485 H GLN 80 H GLN 80 3.206 -0.723 4.603 486 HA GLN 80 HA GLN 80 2.049 -1.900 6.135 487 HB2 GLN 80 1HB GLN 80 1.555 0.909 7.101 488 HB3 GLN 80 2HB GLN 80 0.899 -0.482 7.957 489 HG2 GLN 80 1HG GLN 80 3.792 -0.200 7.291 490 HG3 GLN 80 2HG GLN 80 3.103 0.432 8.786 491 HE21 GLN 80 1HE2 GLN 80 4.501 -3.039 9.196 492 HE22 GLN 80 2HE2 GLN 80 5.119 -1.599 8.465 493 H CYS 81 H CYS 81 0.825 -2.164 4.002 494 HA CYS 81 HA CYS 81 -1.941 -1.234 4.175 495 HB2 CYS 81 2HB CYS 81 -0.556 -2.786 1.984 496 HB3 CYS 81 1HB CYS 81 -2.199 -2.178 1.926 497 H ASN 82 H ASN 82 -3.364 -2.419 5.200 498 HA ASN 82 HA ASN 82 -2.983 -5.338 5.193 499 HB2 ASN 82 1HB ASN 82 -4.630 -5.398 7.069 500 HB3 ASN 82 2HB ASN 82 -3.158 -4.521 7.444 501 HD21 ASN 82 1HD2 ASN 82 -4.735 -1.487 8.036 502 HD22 ASN 82 2HD2 ASN 82 -3.251 -2.354 7.853 503 HA PRO 83 HA PRO 83 -6.273 -5.757 2.322 504 HB2 PRO 83 2HB PRO 83 -6.785 -8.424 3.420 505 HB3 PRO 83 1HB PRO 83 -6.171 -7.971 1.831 506 HG2 PRO 83 2HG PRO 83 -4.617 -9.151 3.687 507 HG3 PRO 83 1HG PRO 83 -3.981 -7.974 2.524 508 HD2 PRO 83 2HD PRO 83 -4.698 -7.590 5.407 509 HD3 PRO 83 1HD PRO 83 -3.319 -6.954 4.490 510 H ILE 84 H ILE 84 -8.340 -5.214 2.315 511 HA ILE 84 HA ILE 84 -9.846 -5.118 4.785 512 HB ILE 84 HB ILE 84 -10.619 -4.347 1.980 513 HG12 ILE 84 1HG1 ILE 84 -8.813 -2.967 2.811 514 HG13 ILE 84 2HG1 ILE 84 -10.301 -2.031 2.791 515 HG21 ILE 84 1HG2 ILE 84 -12.050 -3.797 4.564 516 HG22 ILE 84 2HG2 ILE 84 -12.605 -4.846 3.257 517 HG23 ILE 84 3HG2 ILE 84 -12.472 -3.105 2.998 518 HD11 ILE 84 1HD1 ILE 84 -10.555 -2.419 5.197 519 HD12 ILE 84 2HD1 ILE 84 -9.057 -1.578 4.799 520 HD13 ILE 84 3HD1 ILE 84 -9.026 -3.295 5.198 521 H ASN 85 H ASN 85 -11.766 -6.145 5.172 522 HA ASN 85 HA ASN 85 -11.972 -8.795 4.071 523 HB2 ASN 85 1HB ASN 85 -12.279 -8.474 6.457 524 HB3 ASN 85 2HB ASN 85 -13.585 -7.334 6.164 525 HD21 ASN 85 1HD2 ASN 85 -16.036 -9.775 5.687 526 HD22 ASN 85 2HD2 ASN 85 -15.605 -8.105 5.537 527 H VAL 86 H VAL 86 -12.724 -8.751 2.041 528 HA VAL 86 HA VAL 86 -15.402 -7.631 1.614 529 HB VAL 86 HB VAL 86 -14.645 -7.320 -0.825 530 HG11 VAL 86 1HG1 VAL 86 -13.424 -5.585 1.321 531 HG12 VAL 86 2HG1 VAL 86 -15.054 -5.439 0.666 532 HG13 VAL 86 3HG1 VAL 86 -13.658 -5.118 -0.363 533 HG21 VAL 86 1HG2 VAL 86 -12.290 -7.047 -1.236 534 HG22 VAL 86 2HG2 VAL 86 -12.567 -8.656 -0.568 535 HG23 VAL 86 3HG2 VAL 86 -11.917 -7.376 0.455 536 H ASN 87 H ASN 87 -16.319 -9.598 2.015 537 HA ASN 87 HA ASN 87 -17.181 -11.655 1.573 538 HB2 ASN 87 1HB ASN 87 -17.330 -11.161 -0.781 539 HB3 ASN 87 2HB ASN 87 -15.604 -11.432 -1.000 540 HD21 ASN 87 1HD2 ASN 87 -15.864 -14.888 -1.326 541 HD22 ASN 87 2HD2 ASN 87 -14.832 -13.510 -1.171 542 H LEU 88 H LEU 88 -13.752 -11.201 1.099 543 HA LEU 88 HA LEU 88 -11.950 -12.160 2.017 544 HB2 LEU 88 1HB LEU 88 -13.356 -12.167 4.085 545 HB3 LEU 88 2HB LEU 88 -13.851 -13.800 3.682 546 HG LEU 88 HG LEU 88 -11.436 -14.456 3.758 547 HD11 LEU 88 1HD1 LEU 88 -10.419 -12.289 3.450 548 HD12 LEU 88 2HD1 LEU 88 -9.907 -12.976 4.991 549 HD13 LEU 88 3HD1 LEU 88 -11.135 -11.710 4.954 550 HD21 LEU 88 1HD2 LEU 88 -11.341 -14.515 6.215 551 HD22 LEU 88 2HD2 LEU 88 -12.931 -14.961 5.597 552 HD23 LEU 88 3HD2 LEU 88 -12.668 -13.355 6.279
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