NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
588159 | 2mg3 | 19583 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 LYS 1 1H LYS 1 14.288 -7.308 13.675 2 H2 LYS 1 2H LYS 1 14.354 -7.995 12.204 3 H3 LYS 1 3H LYS 1 15.488 -6.894 12.647 4 HA LYS 1 HA LYS 1 12.608 -6.379 12.248 5 HB2 LYS 1 1HB LYS 1 14.664 -4.191 12.741 6 HB3 LYS 1 2HB LYS 1 12.906 -4.074 12.646 7 HG2 LYS 1 1HG LYS 1 12.962 -5.733 14.716 8 HG3 LYS 1 2HG LYS 1 14.645 -5.190 14.850 9 HD2 LYS 1 1HD LYS 1 13.624 -2.772 14.825 10 HD3 LYS 1 2HD LYS 1 12.079 -3.600 15.120 11 HE2 LYS 1 1HE LYS 1 13.516 -4.844 17.015 12 HE3 LYS 1 2HE LYS 1 14.561 -3.430 16.852 13 HZ1 LYS 1 3HZ LYS 1 12.915 -3.048 18.561 14 HZ2 LYS 1 1HZ LYS 1 11.675 -3.405 17.566 15 HZ3 LYS 1 2HZ LYS 1 12.557 -2.049 17.319 16 H LYS 2 H LYS 2 15.595 -4.844 10.944 17 HA LYS 2 HA LYS 2 14.543 -4.243 8.443 18 HB2 LYS 2 1HB LYS 2 16.634 -3.363 9.557 19 HB3 LYS 2 2HB LYS 2 17.465 -4.835 9.068 20 HG2 LYS 2 1HG LYS 2 18.001 -3.000 7.587 21 HG3 LYS 2 2HG LYS 2 17.130 -4.236 6.680 22 HD2 LYS 2 1HD LYS 2 15.108 -2.909 6.651 23 HD3 LYS 2 2HD LYS 2 15.760 -1.771 7.853 24 HE2 LYS 2 1HE LYS 2 17.453 -0.991 6.289 25 HE3 LYS 2 2HE LYS 2 16.986 -2.210 5.097 26 HZ1 LYS 2 3HZ LYS 2 16.014 -0.013 4.626 27 HZ2 LYS 2 1HZ LYS 2 15.204 -0.024 6.042 28 HZ3 LYS 2 2HZ LYS 2 14.839 -1.117 4.881 29 H LYS 3 H LYS 3 16.044 -7.328 9.312 30 HA LYS 3 HA LYS 3 16.169 -8.435 6.650 31 HB2 LYS 3 1HB LYS 3 15.937 -9.795 9.376 32 HB3 LYS 3 2HB LYS 3 16.104 -10.666 7.845 33 HG2 LYS 3 1HG LYS 3 18.164 -9.191 7.386 34 HG3 LYS 3 2HG LYS 3 18.100 -8.746 9.099 35 HD2 LYS 3 1HD LYS 3 18.443 -11.058 9.771 36 HD3 LYS 3 2HD LYS 3 18.232 -11.632 8.098 37 HE2 LYS 3 1HE LYS 3 20.213 -10.333 7.381 38 HE3 LYS 3 2HE LYS 3 20.433 -9.741 9.031 39 HZ1 LYS 3 3HZ LYS 3 20.749 -12.532 8.078 40 HZ2 LYS 3 1HZ LYS 3 20.670 -12.163 9.670 41 HZ3 LYS 3 2HZ LYS 3 21.887 -11.578 8.753 42 H ASN 4 H ASN 4 13.414 -8.116 8.795 43 HA ASN 4 HA ASN 4 11.725 -9.820 7.060 44 HB2 ASN 4 1HB ASN 4 11.677 -9.833 9.628 45 HB3 ASN 4 2HB ASN 4 10.905 -8.248 9.532 46 HD21 ASN 4 2HD2 ASN 4 10.574 -11.595 8.138 47 HD22 ASN 4 1HD2 ASN 4 8.819 -11.546 8.195 48 H TRP 5 H TRP 5 12.811 -6.675 6.792 49 HA TRP 5 HA TRP 5 10.465 -5.171 6.299 50 HB2 TRP 5 1HB TRP 5 12.935 -4.457 6.600 51 HB3 TRP 5 2HB TRP 5 13.083 -4.704 4.855 52 HD1 TRP 5 HD1 TRP 5 12.556 -2.543 3.522 53 HE1 TRP 5 HE1 TRP 5 11.304 -0.326 3.968 54 HE3 TRP 5 HE3 TRP 5 10.749 -3.552 8.206 55 HZ2 TRP 5 HZ2 TRP 5 9.679 0.817 6.058 56 HZ3 TRP 5 HZ3 TRP 5 9.343 -1.886 9.403 57 HH2 TRP 5 HH2 TRP 5 8.790 0.288 8.335 58 H PHE 6 H PHE 6 11.971 -7.547 4.254 59 HA PHE 6 HA PHE 6 10.823 -6.768 1.748 60 HB2 PHE 6 1HB PHE 6 12.619 -8.706 2.678 61 HB3 PHE 6 2HB PHE 6 11.260 -9.661 2.141 62 HD1 PHE 6 HD2 PHE 6 10.366 -7.982 -0.300 63 HD2 PHE 6 HD1 PHE 6 14.265 -9.151 1.134 64 HE1 PHE 6 HE2 PHE 6 11.228 -7.922 -2.610 65 HE2 PHE 6 HE1 PHE 6 15.125 -9.106 -1.204 66 HZ PHE 6 HZ PHE 6 13.604 -8.494 -3.078 67 H ASP 7 H ASP 7 9.282 -8.115 4.555 68 HA ASP 7 HA ASP 7 7.119 -9.521 3.208 69 HB2 ASP 7 1HB ASP 7 7.533 -8.497 6.029 70 HB3 ASP 7 2HB ASP 7 5.951 -8.998 5.477 71 H ILE 8 H ILE 8 6.378 -8.235 1.575 72 HA ILE 8 HA ILE 8 5.742 -5.545 1.637 73 HB ILE 8 HB ILE 8 4.377 -5.826 -0.287 74 HG12 ILE 8 1HG1 ILE 8 4.354 -8.830 0.250 75 HG13 ILE 8 2HG1 ILE 8 2.975 -7.746 0.445 76 HG21 ILE 8 1HG2 ILE 8 6.926 -6.226 -0.318 77 HG22 ILE 8 2HG2 ILE 8 6.551 -7.941 -0.531 78 HG23 ILE 8 3HG2 ILE 8 6.009 -6.753 -1.736 79 HD11 ILE 8 3HD1 ILE 8 4.344 -8.403 -2.185 80 HD12 ILE 8 1HD1 ILE 8 2.733 -8.901 -1.645 81 HD13 ILE 8 2HD1 ILE 8 3.057 -7.188 -1.979 82 H THR 9 H THR 9 3.955 -8.091 3.124 83 HA THR 9 HA THR 9 1.396 -7.016 3.505 84 HB THR 9 HB THR 9 1.906 -8.459 5.824 85 HG1 THR 9 HG1 THR 9 3.049 -10.280 4.404 86 HG21 THR 9 3HG2 THR 9 0.888 -10.354 4.685 87 HG22 THR 9 1HG2 THR 9 1.207 -9.616 3.097 88 HG23 THR 9 2HG2 THR 9 0.064 -8.857 4.232 89 H ASN 10 H ASN 10 4.395 -6.063 5.077 90 HA ASN 10 HA ASN 10 3.144 -4.771 7.349 91 HB2 ASN 10 1HB ASN 10 5.551 -5.497 7.190 92 HB3 ASN 10 2HB ASN 10 5.840 -4.175 6.054 93 HD21 ASN 10 2HD2 ASN 10 7.400 -3.222 7.570 94 HD22 ASN 10 1HD2 ASN 10 6.793 -2.442 9.022 95 H TRP 11 H TRP 11 4.313 -3.504 4.204 96 HA TRP 11 HA TRP 11 2.928 -0.922 4.663 97 HB2 TRP 11 1HB TRP 11 4.254 -0.160 2.706 98 HB3 TRP 11 2HB TRP 11 5.155 -0.608 4.134 99 HD1 TRP 11 HD1 TRP 11 6.876 -2.502 3.983 100 HE1 TRP 11 HE1 TRP 11 7.987 -3.763 2.023 101 HE3 TRP 11 HE3 TRP 11 3.585 -1.268 0.293 102 HZ2 TRP 11 HZ2 TRP 11 7.543 -4.076 -0.821 103 HZ3 TRP 11 HZ3 TRP 11 3.930 -2.084 -2.049 104 HH2 TRP 11 HH2 TRP 11 5.896 -3.481 -2.605 105 H LEU 12 H LEU 12 2.039 -3.790 3.271 106 HA LEU 12 HA LEU 12 0.672 -3.126 0.943 107 HB2 LEU 12 1HB LEU 12 0.454 -5.207 3.037 108 HB3 LEU 12 2HB LEU 12 -1.090 -4.859 2.319 109 HG LEU 12 HG LEU 12 1.366 -5.786 0.792 110 HD11 LEU 12 1HD1 LEU 12 -0.530 -7.669 0.336 111 HD12 LEU 12 2HD1 LEU 12 -1.030 -7.156 1.953 112 HD13 LEU 12 3HD1 LEU 12 0.618 -7.754 1.656 113 HD21 LEU 12 3HD2 LEU 12 0.026 -4.322 -0.672 114 HD22 LEU 12 1HD2 LEU 12 -1.468 -5.141 -0.162 115 HD23 LEU 12 2HD2 LEU 12 -0.245 -5.993 -1.133 116 H TRP 13 H TRP 13 -0.183 -2.228 4.188 117 HA TRP 13 HA TRP 13 -2.973 -1.650 3.769 118 HB2 TRP 13 1HB TRP 13 -1.878 -1.857 5.989 119 HB3 TRP 13 2HB TRP 13 -1.056 -0.327 5.722 120 HD1 TRP 13 HD1 TRP 13 -4.644 -1.724 6.056 121 HE1 TRP 13 HE1 TRP 13 -6.233 0.163 6.807 122 HE3 TRP 13 HE3 TRP 13 -1.350 2.184 5.968 123 HZ2 TRP 13 HZ2 TRP 13 -6.093 3.009 7.257 124 HZ3 TRP 13 HZ3 TRP 13 -2.108 4.489 6.529 125 HH2 TRP 13 HH2 TRP 13 -4.464 4.914 7.151 126 H TYR 14 H TYR 14 -0.079 0.445 3.492 127 HA TYR 14 HA TYR 14 -1.481 2.809 2.658 128 HB2 TYR 14 1HB TYR 14 1.347 2.042 1.885 129 HB3 TYR 14 2HB TYR 14 0.665 3.655 2.011 130 HD1 TYR 14 HD2 TYR 14 -0.082 4.475 4.382 131 HD2 TYR 14 HD1 TYR 14 2.416 1.044 3.705 132 HE1 TYR 14 HE2 TYR 14 0.651 4.535 6.765 133 HE2 TYR 14 HE1 TYR 14 3.144 1.073 6.090 134 HH TYR 14 HH TYR 14 1.919 3.549 8.390 135 H ILE 15 H ILE 15 -0.394 -0.053 0.928 136 HA ILE 15 HA ILE 15 -0.817 1.038 -1.754 137 HB ILE 15 HB ILE 15 -0.768 -1.902 -0.994 138 HG12 ILE 15 1HG1 ILE 15 1.283 -1.013 -0.157 139 HG13 ILE 15 2HG1 ILE 15 1.614 -1.893 -1.630 140 HG21 ILE 15 1HG2 ILE 15 0.039 -2.126 -3.377 141 HG22 ILE 15 2HG2 ILE 15 -1.635 -1.593 -3.210 142 HG23 ILE 15 3HG2 ILE 15 -0.378 -0.412 -3.618 143 HD11 ILE 15 3HD1 ILE 15 1.810 0.274 -2.869 144 HD12 ILE 15 1HD1 ILE 15 1.490 1.150 -1.348 145 HD13 ILE 15 2HD1 ILE 15 2.944 0.169 -1.510 146 H LYS 16 H LYS 16 -2.784 -1.091 0.367 147 HA LYS 16 HA LYS 16 -5.093 -1.147 -1.362 148 HB2 LYS 16 1HB LYS 16 -4.537 -2.693 0.534 149 HB3 LYS 16 2HB LYS 16 -5.006 -1.445 1.678 150 HG2 LYS 16 1HG LYS 16 -6.870 -2.572 -0.474 151 HG3 LYS 16 2HG LYS 16 -6.667 -3.300 1.119 152 HD2 LYS 16 1HD LYS 16 -7.302 -0.954 2.065 153 HD3 LYS 16 2HD LYS 16 -7.951 -0.635 0.451 154 HE2 LYS 16 1HE LYS 16 -8.711 -2.970 2.267 155 HE3 LYS 16 2HE LYS 16 -9.641 -1.482 2.087 156 HZ1 LYS 16 3HZ LYS 16 -10.537 -3.237 0.691 157 HZ2 LYS 16 1HZ LYS 16 -9.125 -3.434 -0.095 158 HZ3 LYS 16 2HZ LYS 16 -9.973 -2.043 -0.264 159 H LEU 17 H LEU 17 -4.257 1.017 1.353 160 HA LEU 17 HA LEU 17 -6.531 2.726 1.138 161 HB2 LEU 17 1HB LEU 17 -5.137 2.650 3.116 162 HB3 LEU 17 2HB LEU 17 -3.753 3.292 2.241 163 HG LEU 17 HG LEU 17 -6.182 4.993 2.007 164 HD11 LEU 17 1HD1 LEU 17 -6.197 5.907 4.207 165 HD12 LEU 17 2HD1 LEU 17 -4.900 4.810 4.713 166 HD13 LEU 17 3HD1 LEU 17 -6.512 4.164 4.317 167 HD21 LEU 17 3HD2 LEU 17 -3.861 5.697 1.335 168 HD22 LEU 17 1HD2 LEU 17 -3.390 5.615 3.052 169 HD23 LEU 17 2HD2 LEU 17 -4.614 6.784 2.513 170 H PHE 18 H PHE 18 -3.455 2.824 -0.729 171 HA PHE 18 HA PHE 18 -3.710 5.331 -1.865 172 HB2 PHE 18 1HB PHE 18 -1.805 3.967 -2.336 173 HB3 PHE 18 2HB PHE 18 -2.784 2.786 -3.194 174 HD1 PHE 18 HD1 PHE 18 -2.836 6.571 -3.543 175 HD2 PHE 18 HD2 PHE 18 -1.993 2.747 -5.364 176 HE1 PHE 18 HE1 PHE 18 -2.267 7.704 -5.656 177 HE2 PHE 18 HE2 PHE 18 -1.462 3.893 -7.501 178 HZ PHE 18 HZ PHE 18 -1.568 6.387 -7.637 179 H ILE 19 H ILE 19 -5.596 2.445 -2.819 180 HA ILE 19 HA ILE 19 -7.020 3.806 -4.950 181 HB ILE 19 HB ILE 19 -7.747 1.305 -3.381 182 HG12 ILE 19 1HG1 ILE 19 -7.132 0.189 -5.647 183 HG13 ILE 19 2HG1 ILE 19 -6.263 1.673 -6.016 184 HG21 ILE 19 1HG2 ILE 19 -9.006 2.619 -5.793 185 HG22 ILE 19 2HG2 ILE 19 -9.212 0.876 -5.478 186 HG23 ILE 19 3HG2 ILE 19 -9.779 2.055 -4.306 187 HD11 ILE 19 3HD1 ILE 19 -5.719 -0.038 -3.557 188 HD12 ILE 19 1HD1 ILE 19 -4.902 -0.254 -5.116 189 HD13 ILE 19 2HD1 ILE 19 -4.695 1.259 -4.239 190 H MET 20 H MET 20 -7.521 3.563 -1.476 191 HA MET 20 HA MET 20 -10.298 4.461 -1.445 192 HB2 MET 20 1HB MET 20 -8.217 4.352 0.772 193 HB3 MET 20 2HB MET 20 -9.924 4.681 1.001 194 HG2 MET 20 1HG MET 20 -9.036 2.127 -0.380 195 HG3 MET 20 2HG MET 20 -8.980 2.258 1.367 196 HE1 MET 20 3HE MET 20 -11.250 3.500 2.601 197 HE2 MET 20 1HE MET 20 -12.549 2.286 2.593 198 HE3 MET 20 2HE MET 20 -10.876 1.795 2.930 199 H ILE 21 H ILE 21 -7.153 6.070 -0.780 200 HA ILE 21 HA ILE 21 -8.269 8.664 -0.248 201 HB ILE 21 HB ILE 21 -6.082 8.030 0.538 202 HG12 ILE 21 1HG1 ILE 21 -5.912 10.445 -1.320 203 HG13 ILE 21 2HG1 ILE 21 -6.722 10.416 0.248 204 HG21 ILE 21 1HG2 ILE 21 -4.098 7.894 -0.836 205 HG22 ILE 21 2HG2 ILE 21 -5.289 6.760 -1.436 206 HG23 ILE 21 3HG2 ILE 21 -5.013 8.281 -2.307 207 HD11 ILE 21 3HD1 ILE 21 -4.236 9.506 0.978 208 HD12 ILE 21 1HD1 ILE 21 -3.828 10.572 -0.386 209 HD13 ILE 21 2HD1 ILE 21 -4.734 11.206 1.001 210 H VAL 22 H VAL 22 -7.018 7.272 -3.298 211 HA VAL 22 HA VAL 22 -7.523 9.646 -4.882 212 HB VAL 22 HB VAL 22 -7.236 8.201 -6.829 213 HG11 VAL 22 1HG1 VAL 22 -4.969 7.458 -6.450 214 HG12 VAL 22 2HG1 VAL 22 -5.262 9.074 -5.761 215 HG13 VAL 22 3HG1 VAL 22 -5.181 7.637 -4.705 216 HG21 VAL 22 3HG2 VAL 22 -8.292 6.182 -6.380 217 HG22 VAL 22 1HG2 VAL 22 -6.561 5.774 -6.434 218 HG23 VAL 22 2HG2 VAL 22 -7.393 5.948 -4.894 219 H GLY 23 H GLY 23 -9.527 6.839 -4.102 220 HA2 GLY 23 1HA GLY 23 -11.575 6.116 -4.704 221 HA3 GLY 23 2HA GLY 23 -12.091 7.810 -4.730 222 H GLY 24 H GLY 24 -12.115 8.901 -6.718 223 HA2 GLY 24 1HA GLY 24 -12.653 7.299 -9.098 224 HA3 GLY 24 2HA GLY 24 -12.705 9.055 -8.977 225 H LEU 25 H LEU 25 -9.802 9.103 -7.974 226 HA LEU 25 HA LEU 25 -8.625 9.237 -10.652 227 HB2 LEU 25 1HB LEU 25 -6.881 9.657 -8.263 228 HB3 LEU 25 2HB LEU 25 -6.861 10.411 -9.823 229 HG LEU 25 HG LEU 25 -8.852 10.982 -7.601 230 HD11 LEU 25 1HD1 LEU 25 -7.699 13.120 -7.412 231 HD12 LEU 25 2HD1 LEU 25 -6.550 12.635 -8.681 232 HD13 LEU 25 3HD1 LEU 25 -6.588 11.771 -7.126 233 HD21 LEU 25 3HD2 LEU 25 -9.545 12.918 -8.992 234 HD22 LEU 25 1HD2 LEU 25 -9.896 11.393 -9.813 235 HD23 LEU 25 2HD2 LEU 25 -8.485 12.355 -10.305 236 H VAL 26 H VAL 26 -9.062 6.578 -8.824 237 HA VAL 26 HA VAL 26 -6.655 5.210 -8.557 238 HB VAL 26 HB VAL 26 -8.839 4.480 -7.679 239 HG11 VAL 26 1HG1 VAL 26 -10.414 3.194 -8.934 240 HG12 VAL 26 2HG1 VAL 26 -10.233 4.758 -9.731 241 HG13 VAL 26 3HG1 VAL 26 -9.448 3.311 -10.415 242 HG21 VAL 26 3HG2 VAL 26 -6.944 2.964 -7.668 243 HG22 VAL 26 1HG2 VAL 26 -8.471 2.079 -7.883 244 HG23 VAL 26 2HG2 VAL 26 -7.400 2.325 -9.264 245 H LYS 27 H LYS 27 -8.503 5.512 -11.512 246 HA LYS 27 HA LYS 27 -6.975 3.663 -13.138 247 HB2 LYS 27 1HB LYS 27 -8.950 5.883 -13.644 248 HB3 LYS 27 2HB LYS 27 -7.970 5.323 -14.998 249 HG2 LYS 27 1HG LYS 27 -8.720 2.982 -14.596 250 HG3 LYS 27 2HG LYS 27 -9.752 3.563 -13.274 251 HD2 LYS 27 1HD LYS 27 -10.786 5.169 -15.037 252 HD3 LYS 27 2HD LYS 27 -9.940 4.195 -16.255 253 HE2 LYS 27 1HE LYS 27 -11.153 2.178 -15.506 254 HE3 LYS 27 2HE LYS 27 -11.912 3.099 -14.200 255 HZ1 LYS 27 3HZ LYS 27 -12.326 3.590 -17.102 256 HZ2 LYS 27 1HZ LYS 27 -12.984 4.489 -15.907 257 HZ3 LYS 27 2HZ LYS 27 -13.413 2.927 -16.082 258 H LYS 28 H LYS 28 -6.202 6.844 -12.075 259 HA LYS 28 HA LYS 28 -5.031 8.613 -12.911 260 HB2 LYS 28 1HB LYS 28 -2.914 6.433 -13.042 261 HB3 LYS 28 2HB LYS 28 -2.597 8.143 -13.290 262 HG2 LYS 28 1HG LYS 28 -2.081 8.057 -11.097 263 HG3 LYS 28 2HG LYS 28 -3.772 8.507 -10.981 264 HD2 LYS 28 1HD LYS 28 -3.333 6.849 -9.328 265 HD3 LYS 28 2HD LYS 28 -4.323 6.079 -10.551 266 HE2 LYS 28 1HE LYS 28 -1.464 5.790 -11.172 267 HE3 LYS 28 2HE LYS 28 -1.787 5.263 -9.524 268 HZ1 LYS 28 3HZ LYS 28 -3.549 3.797 -10.430 269 HZ2 LYS 28 1HZ LYS 28 -2.069 3.417 -11.025 270 HZ3 LYS 28 2HZ LYS 28 -3.144 4.224 -11.950 Start of MODEL 2 1 H1 LYS 1 1H LYS 1 16.466 -6.036 12.797 2 H2 LYS 1 2H LYS 1 15.206 -4.990 12.868 3 H3 LYS 1 3H LYS 1 15.389 -6.148 14.004 4 HA LYS 1 HA LYS 1 15.046 -7.895 12.366 5 HB2 LYS 1 1HB LYS 1 12.619 -7.654 12.156 6 HB3 LYS 1 2HB LYS 1 13.195 -7.328 13.779 7 HG2 LYS 1 1HG LYS 1 12.858 -4.958 13.559 8 HG3 LYS 1 2HG LYS 1 12.694 -5.070 11.815 9 HD2 LYS 1 1HD LYS 1 10.514 -5.009 12.095 10 HD3 LYS 1 2HD LYS 1 10.579 -6.676 12.630 11 HE2 LYS 1 1HE LYS 1 10.858 -4.269 14.500 12 HE3 LYS 1 2HE LYS 1 9.301 -4.972 14.067 13 HZ1 LYS 1 3HZ LYS 1 11.469 -6.440 15.469 14 HZ2 LYS 1 1HZ LYS 1 10.022 -7.077 15.037 15 HZ3 LYS 1 2HZ LYS 1 10.094 -5.887 16.145 16 H LYS 2 H LYS 2 16.736 -6.459 10.661 17 HA LYS 2 HA LYS 2 15.514 -5.219 8.428 18 HB2 LYS 2 1HB LYS 2 18.165 -6.040 9.249 19 HB3 LYS 2 2HB LYS 2 17.940 -6.562 7.592 20 HG2 LYS 2 1HG LYS 2 17.345 -3.725 8.540 21 HG3 LYS 2 2HG LYS 2 18.931 -4.247 7.969 22 HD2 LYS 2 1HD LYS 2 17.979 -4.853 5.767 23 HD3 LYS 2 2HD LYS 2 16.370 -4.330 6.312 24 HE2 LYS 2 1HE LYS 2 17.330 -2.043 6.768 25 HE3 LYS 2 2HE LYS 2 18.872 -2.590 6.101 26 HZ1 LYS 2 3HZ LYS 2 17.561 -1.431 4.428 27 HZ2 LYS 2 1HZ LYS 2 16.307 -2.460 4.601 28 HZ3 LYS 2 2HZ LYS 2 17.726 -2.990 3.977 29 H LYS 3 H LYS 3 15.943 -8.634 9.010 30 HA LYS 3 HA LYS 3 15.332 -9.672 6.416 31 HB2 LYS 3 1HB LYS 3 14.841 -10.789 9.210 32 HB3 LYS 3 2HB LYS 3 14.574 -11.730 7.745 33 HG2 LYS 3 1HG LYS 3 17.258 -10.436 8.381 34 HG3 LYS 3 2HG LYS 3 16.828 -12.040 8.943 35 HD2 LYS 3 1HD LYS 3 16.434 -11.571 6.004 36 HD3 LYS 3 2HD LYS 3 18.104 -11.527 6.581 37 HE2 LYS 3 1HE LYS 3 17.890 -13.732 7.588 38 HE3 LYS 3 2HE LYS 3 16.170 -13.804 7.185 39 HZ1 LYS 3 3HZ LYS 3 18.355 -13.645 5.173 40 HZ2 LYS 3 1HZ LYS 3 16.763 -13.806 4.840 41 HZ3 LYS 3 2HZ LYS 3 17.568 -15.015 5.578 42 H ASN 4 H ASN 4 13.143 -8.269 8.766 43 HA ASN 4 HA ASN 4 10.770 -9.175 7.236 44 HB2 ASN 4 1HB ASN 4 11.062 -7.662 9.860 45 HB3 ASN 4 2HB ASN 4 9.517 -8.036 9.100 46 HD21 ASN 4 2HD2 ASN 4 9.447 -10.564 8.342 47 HD22 ASN 4 1HD2 ASN 4 9.869 -11.618 9.697 48 H TRP 5 H TRP 5 12.930 -6.701 6.721 49 HA TRP 5 HA TRP 5 11.126 -4.514 6.188 50 HB2 TRP 5 1HB TRP 5 13.678 -4.506 6.476 51 HB3 TRP 5 2HB TRP 5 13.771 -5.018 4.794 52 HD1 TRP 5 HD1 TRP 5 13.367 -3.141 2.981 53 HE1 TRP 5 HE1 TRP 5 13.018 -0.586 3.075 54 HE3 TRP 5 HE3 TRP 5 12.545 -2.613 8.010 55 HZ2 TRP 5 HZ2 TRP 5 12.442 1.413 5.071 56 HZ3 TRP 5 HZ3 TRP 5 12.082 -0.368 8.982 57 HH2 TRP 5 HH2 TRP 5 12.027 1.643 7.527 58 H PHE 6 H PHE 6 12.213 -7.263 4.225 59 HA PHE 6 HA PHE 6 10.931 -6.409 1.778 60 HB2 PHE 6 1HB PHE 6 12.808 -8.369 2.576 61 HB3 PHE 6 2HB PHE 6 11.441 -9.292 2.011 62 HD1 PHE 6 HD1 PHE 6 10.459 -7.542 -0.303 63 HD2 PHE 6 HD2 PHE 6 14.429 -8.681 0.957 64 HE1 PHE 6 HE1 PHE 6 11.267 -7.300 -2.625 65 HE2 PHE 6 HE2 PHE 6 15.229 -8.449 -1.385 66 HZ PHE 6 HZ PHE 6 13.650 -7.756 -3.179 67 H ASP 7 H ASP 7 9.525 -7.666 4.625 68 HA ASP 7 HA ASP 7 7.386 -9.244 3.390 69 HB2 ASP 7 1HB ASP 7 7.798 -8.124 6.178 70 HB3 ASP 7 2HB ASP 7 6.291 -8.857 5.680 71 H ILE 8 H ILE 8 6.627 -7.941 1.755 72 HA ILE 8 HA ILE 8 5.850 -5.302 1.855 73 HB ILE 8 HB ILE 8 4.569 -5.582 -0.104 74 HG12 ILE 8 1HG1 ILE 8 4.523 -8.588 0.393 75 HG13 ILE 8 2HG1 ILE 8 3.143 -7.500 0.555 76 HG21 ILE 8 1HG2 ILE 8 6.213 -6.512 -1.544 77 HG22 ILE 8 2HG2 ILE 8 7.107 -5.957 -0.124 78 HG23 ILE 8 3HG2 ILE 8 6.758 -7.683 -0.325 79 HD11 ILE 8 3HD1 ILE 8 3.328 -6.912 -1.868 80 HD12 ILE 8 1HD1 ILE 8 4.578 -8.170 -2.034 81 HD13 ILE 8 2HD1 ILE 8 2.935 -8.612 -1.548 82 H THR 9 H THR 9 4.103 -7.913 3.268 83 HA THR 9 HA THR 9 1.524 -6.812 3.518 84 HB THR 9 HB THR 9 2.205 -9.158 3.997 85 HG1 THR 9 HG1 THR 9 0.684 -7.875 6.013 86 HG21 THR 9 3HG2 THR 9 4.095 -8.703 5.548 87 HG22 THR 9 1HG2 THR 9 2.897 -9.822 6.214 88 HG23 THR 9 2HG2 THR 9 2.941 -8.138 6.775 89 H ASN 10 H ASN 10 4.399 -5.787 5.191 90 HA ASN 10 HA ASN 10 3.078 -4.461 7.424 91 HB2 ASN 10 1HB ASN 10 5.832 -4.363 6.156 92 HB3 ASN 10 2HB ASN 10 5.330 -3.037 7.196 93 HD21 ASN 10 2HD2 ASN 10 6.116 -6.488 7.168 94 HD22 ASN 10 1HD2 ASN 10 6.136 -6.611 8.929 95 H TRP 11 H TRP 11 4.234 -3.276 4.244 96 HA TRP 11 HA TRP 11 2.762 -0.740 4.631 97 HB2 TRP 11 1HB TRP 11 4.090 0.037 2.679 98 HB3 TRP 11 2HB TRP 11 4.971 -0.342 4.139 99 HD1 TRP 11 HD1 TRP 11 6.779 -2.160 4.075 100 HE1 TRP 11 HE1 TRP 11 8.007 -3.392 2.162 101 HE3 TRP 11 HE3 TRP 11 3.556 -1.111 0.274 102 HZ2 TRP 11 HZ2 TRP 11 7.670 -3.750 -0.688 103 HZ3 TRP 11 HZ3 TRP 11 4.024 -1.904 -2.055 104 HH2 TRP 11 HH2 TRP 11 6.073 -3.216 -2.536 105 H LEU 12 H LEU 12 1.980 -3.657 3.235 106 HA LEU 12 HA LEU 12 0.590 -2.991 0.904 107 HB2 LEU 12 1HB LEU 12 0.368 -5.117 2.979 108 HB3 LEU 12 2HB LEU 12 -1.133 -4.806 2.158 109 HG LEU 12 HG LEU 12 1.447 -5.651 0.801 110 HD11 LEU 12 1HD1 LEU 12 -1.219 -7.058 1.269 111 HD12 LEU 12 2HD1 LEU 12 0.348 -7.511 1.953 112 HD13 LEU 12 3HD1 LEU 12 0.079 -7.673 0.225 113 HD21 LEU 12 3HD2 LEU 12 -0.032 -5.885 -1.237 114 HD22 LEU 12 1HD2 LEU 12 0.158 -4.206 -0.756 115 HD23 LEU 12 2HD2 LEU 12 -1.337 -5.073 -0.345 116 H TRP 13 H TRP 13 -0.279 -2.150 4.158 117 HA TRP 13 HA TRP 13 -3.076 -1.611 3.753 118 HB2 TRP 13 1HB TRP 13 -1.959 -1.799 5.968 119 HB3 TRP 13 2HB TRP 13 -1.173 -0.252 5.695 120 HD1 TRP 13 HD1 TRP 13 -4.719 -1.738 6.055 121 HE1 TRP 13 HE1 TRP 13 -6.352 0.102 6.828 122 HE3 TRP 13 HE3 TRP 13 -1.532 2.263 5.970 123 HZ2 TRP 13 HZ2 TRP 13 -6.290 2.948 7.283 124 HZ3 TRP 13 HZ3 TRP 13 -2.351 4.542 6.551 125 HH2 TRP 13 HH2 TRP 13 -4.717 4.896 7.189 126 H TYR 14 H TYR 14 -0.228 0.557 3.497 127 HA TYR 14 HA TYR 14 -1.680 2.883 2.650 128 HB2 TYR 14 1HB TYR 14 1.176 2.185 1.914 129 HB3 TYR 14 2HB TYR 14 0.450 3.781 2.018 130 HD1 TYR 14 HD2 TYR 14 -0.320 4.625 4.360 131 HD2 TYR 14 HD1 TYR 14 2.217 1.206 3.764 132 HE1 TYR 14 HE2 TYR 14 0.395 4.741 6.742 133 HE2 TYR 14 HE1 TYR 14 2.931 1.294 6.153 134 HH TYR 14 HH TYR 14 1.693 3.822 8.387 135 H ILE 15 H ILE 15 -0.482 0.053 0.921 136 HA ILE 15 HA ILE 15 -0.902 1.155 -1.752 137 HB ILE 15 HB ILE 15 -0.792 -1.788 -1.023 138 HG12 ILE 15 1HG1 ILE 15 1.245 -0.858 -0.184 139 HG13 ILE 15 2HG1 ILE 15 1.593 -1.709 -1.671 140 HG21 ILE 15 1HG2 ILE 15 -0.402 -0.268 -3.634 141 HG22 ILE 15 2HG2 ILE 15 -0.006 -1.989 -3.403 142 HG23 ILE 15 3HG2 ILE 15 -1.675 -1.435 -3.247 143 HD11 ILE 15 3HD1 ILE 15 1.720 0.483 -2.880 144 HD12 ILE 15 1HD1 ILE 15 1.401 1.324 -1.341 145 HD13 ILE 15 2HD1 ILE 15 2.875 0.373 -1.541 146 H LYS 16 H LYS 16 -2.890 -1.019 0.337 147 HA LYS 16 HA LYS 16 -5.146 -1.021 -1.478 148 HB2 LYS 16 1HB LYS 16 -4.586 -2.152 1.120 149 HB3 LYS 16 2HB LYS 16 -6.124 -1.282 1.192 150 HG2 LYS 16 1HG LYS 16 -6.756 -2.459 -1.007 151 HG3 LYS 16 2HG LYS 16 -5.322 -3.480 -0.763 152 HD2 LYS 16 1HD LYS 16 -6.251 -4.189 1.436 153 HD3 LYS 16 2HD LYS 16 -7.666 -3.144 1.146 154 HE2 LYS 16 1HE LYS 16 -8.166 -4.443 -0.934 155 HE3 LYS 16 2HE LYS 16 -6.807 -5.515 -0.578 156 HZ1 LYS 16 3HZ LYS 16 -8.904 -6.459 0.199 157 HZ2 LYS 16 1HZ LYS 16 -9.204 -5.166 1.147 158 HZ3 LYS 16 2HZ LYS 16 -7.948 -6.155 1.486 159 H LEU 17 H LEU 17 -4.373 1.090 1.277 160 HA LEU 17 HA LEU 17 -6.668 2.762 1.054 161 HB2 LEU 17 1HB LEU 17 -5.278 2.672 3.042 162 HB3 LEU 17 2HB LEU 17 -3.919 3.389 2.187 163 HG LEU 17 HG LEU 17 -6.391 5.011 1.950 164 HD11 LEU 17 1HD1 LEU 17 -6.496 5.840 4.202 165 HD12 LEU 17 2HD1 LEU 17 -5.234 4.698 4.705 166 HD13 LEU 17 3HD1 LEU 17 -6.829 4.098 4.186 167 HD21 LEU 17 3HD2 LEU 17 -3.661 5.674 3.119 168 HD22 LEU 17 1HD2 LEU 17 -4.905 6.829 2.596 169 HD23 LEU 17 2HD2 LEU 17 -4.088 5.817 1.393 170 H PHE 18 H PHE 18 -3.591 2.926 -0.784 171 HA PHE 18 HA PHE 18 -3.880 5.435 -1.926 172 HB2 PHE 18 1HB PHE 18 -1.948 4.105 -2.394 173 HB3 PHE 18 2HB PHE 18 -2.903 2.890 -3.227 174 HD1 PHE 18 HD2 PHE 18 -3.039 6.662 -3.646 175 HD2 PHE 18 HD1 PHE 18 -2.091 2.828 -5.395 176 HE1 PHE 18 HE2 PHE 18 -2.563 7.761 -5.805 177 HE2 PHE 18 HE1 PHE 18 -1.657 3.940 -7.574 178 HZ PHE 18 HZ PHE 18 -1.885 6.409 -7.779 179 H ILE 19 H ILE 19 -5.634 2.480 -2.958 180 HA ILE 19 HA ILE 19 -7.128 3.800 -5.049 181 HB ILE 19 HB ILE 19 -7.761 1.261 -3.509 182 HG12 ILE 19 1HG1 ILE 19 -7.103 0.199 -5.788 183 HG13 ILE 19 2HG1 ILE 19 -6.298 1.722 -6.141 184 HG21 ILE 19 1HG2 ILE 19 -9.217 0.785 -5.576 185 HG22 ILE 19 2HG2 ILE 19 -9.817 1.990 -4.449 186 HG23 ILE 19 3HG2 ILE 19 -9.040 2.519 -5.947 187 HD11 ILE 19 3HD1 ILE 19 -5.673 -0.004 -3.711 188 HD12 ILE 19 1HD1 ILE 19 -4.851 -0.155 -5.276 189 HD13 ILE 19 2HD1 ILE 19 -4.704 1.348 -4.368 190 H MET 20 H MET 20 -7.660 3.457 -1.573 191 HA MET 20 HA MET 20 -10.444 4.302 -1.550 192 HB2 MET 20 1HB MET 20 -8.363 4.280 0.670 193 HB3 MET 20 2HB MET 20 -10.071 4.598 0.895 194 HG2 MET 20 1HG MET 20 -9.102 2.024 -0.402 195 HG3 MET 20 2HG MET 20 -9.173 2.204 1.342 196 HE1 MET 20 3HE MET 20 -11.620 3.540 2.297 197 HE2 MET 20 1HE MET 20 -12.839 2.246 2.293 198 HE3 MET 20 2HE MET 20 -11.169 1.896 2.792 199 H ILE 21 H ILE 21 -7.366 6.042 -0.879 200 HA ILE 21 HA ILE 21 -8.649 8.571 -0.385 201 HB ILE 21 HB ILE 21 -6.473 8.018 0.531 202 HG12 ILE 21 1HG1 ILE 21 -6.282 10.488 -1.245 203 HG13 ILE 21 2HG1 ILE 21 -7.265 10.387 0.218 204 HG21 ILE 21 1HG2 ILE 21 -5.496 6.861 -1.443 205 HG22 ILE 21 2HG2 ILE 21 -5.267 8.425 -2.244 206 HG23 ILE 21 3HG2 ILE 21 -4.412 8.034 -0.736 207 HD11 ILE 21 3HD1 ILE 21 -5.177 11.490 0.736 208 HD12 ILE 21 1HD1 ILE 21 -5.207 9.915 1.553 209 HD13 ILE 21 2HD1 ILE 21 -4.231 10.149 0.081 210 H VAL 22 H VAL 22 -7.256 7.217 -3.390 211 HA VAL 22 HA VAL 22 -7.774 9.600 -4.974 212 HB VAL 22 HB VAL 22 -7.450 8.179 -6.930 213 HG11 VAL 22 1HG1 VAL 22 -5.385 7.656 -4.802 214 HG12 VAL 22 2HG1 VAL 22 -5.164 7.495 -6.550 215 HG13 VAL 22 3HG1 VAL 22 -5.504 9.097 -5.852 216 HG21 VAL 22 3HG2 VAL 22 -6.706 5.767 -6.552 217 HG22 VAL 22 1HG2 VAL 22 -7.555 5.905 -5.018 218 HG23 VAL 22 2HG2 VAL 22 -8.448 6.125 -6.509 219 H GLY 23 H GLY 23 -9.732 6.759 -4.226 220 HA2 GLY 23 1HA GLY 23 -11.711 5.944 -4.928 221 HA3 GLY 23 2HA GLY 23 -12.307 7.612 -4.945 222 H GLY 24 H GLY 24 -12.345 8.722 -6.907 223 HA2 GLY 24 1HA GLY 24 -12.755 7.154 -9.320 224 HA3 GLY 24 2HA GLY 24 -12.852 8.906 -9.180 225 H LEU 25 H LEU 25 -9.968 9.018 -8.131 226 HA LEU 25 HA LEU 25 -8.749 9.201 -10.790 227 HB2 LEU 25 1HB LEU 25 -7.073 9.647 -8.355 228 HB3 LEU 25 2HB LEU 25 -7.017 10.402 -9.915 229 HG LEU 25 HG LEU 25 -9.092 10.937 -7.762 230 HD11 LEU 25 1HD1 LEU 25 -6.766 12.615 -8.757 231 HD12 LEU 25 2HD1 LEU 25 -6.858 11.757 -7.201 232 HD13 LEU 25 3HD1 LEU 25 -7.969 13.096 -7.537 233 HD21 LEU 25 3HD2 LEU 25 -9.775 12.854 -9.174 234 HD22 LEU 25 1HD2 LEU 25 -10.039 11.330 -10.032 235 HD23 LEU 25 2HD2 LEU 25 -8.635 12.339 -10.439 236 H VAL 26 H VAL 26 -9.130 6.530 -8.946 237 HA VAL 26 HA VAL 26 -6.703 5.207 -8.660 238 HB VAL 26 HB VAL 26 -8.895 4.405 -7.856 239 HG11 VAL 26 1HG1 VAL 26 -10.399 3.104 -9.208 240 HG12 VAL 26 2HG1 VAL 26 -10.248 4.707 -9.930 241 HG13 VAL 26 3HG1 VAL 26 -9.398 3.319 -10.653 242 HG21 VAL 26 3HG2 VAL 26 -8.465 2.037 -8.062 243 HG22 VAL 26 1HG2 VAL 26 -7.428 2.292 -9.469 244 HG23 VAL 26 2HG2 VAL 26 -6.936 2.929 -7.884 245 H LYS 27 H LYS 27 -8.445 5.643 -11.615 246 HA LYS 27 HA LYS 27 -7.058 3.769 -13.281 247 HB2 LYS 27 1HB LYS 27 -9.247 5.497 -13.491 248 HB3 LYS 27 2HB LYS 27 -8.103 6.208 -14.624 249 HG2 LYS 27 1HG LYS 27 -7.911 4.007 -15.784 250 HG3 LYS 27 2HG LYS 27 -8.971 3.284 -14.557 251 HD2 LYS 27 1HD LYS 27 -10.662 5.188 -15.274 252 HD3 LYS 27 2HD LYS 27 -9.672 5.263 -16.744 253 HE2 LYS 27 1HE LYS 27 -10.074 2.846 -17.131 254 HE3 LYS 27 2HE LYS 27 -10.953 2.737 -15.600 255 HZ1 LYS 27 3HZ LYS 27 -12.595 4.305 -16.512 256 HZ2 LYS 27 1HZ LYS 27 -12.504 2.961 -17.430 257 HZ3 LYS 27 2HZ LYS 27 -11.809 4.346 -17.945 258 H LYS 28 H LYS 28 -5.986 6.793 -12.072 259 HA LYS 28 HA LYS 28 -3.579 6.854 -13.827 260 HB2 LYS 28 1HB LYS 28 -5.389 9.236 -13.229 261 HB3 LYS 28 2HB LYS 28 -3.846 9.320 -14.077 262 HG2 LYS 28 1HG LYS 28 -6.322 7.844 -15.069 263 HG3 LYS 28 2HG LYS 28 -5.800 9.438 -15.592 264 HD2 LYS 28 1HD LYS 28 -3.781 8.555 -16.619 265 HD3 LYS 28 2HD LYS 28 -4.039 6.970 -15.901 266 HE2 LYS 28 1HE LYS 28 -4.706 6.657 -18.090 267 HE3 LYS 28 2HE LYS 28 -6.214 6.791 -17.185 268 HZ1 LYS 28 3HZ LYS 28 -6.233 8.106 -19.244 269 HZ2 LYS 28 1HZ LYS 28 -4.958 8.990 -18.749 270 HZ3 LYS 28 2HZ LYS 28 -6.388 9.101 -17.960 Start of MODEL 3 1 H1 LYS 1 1H LYS 1 18.343 -9.041 12.367 2 H2 LYS 1 2H LYS 1 18.623 -8.724 10.805 3 H3 LYS 1 3H LYS 1 18.017 -7.552 11.792 4 HA LYS 1 HA LYS 1 16.631 -10.014 10.899 5 HB2 LYS 1 1HB LYS 1 15.670 -7.952 12.919 6 HB3 LYS 1 2HB LYS 1 14.703 -9.285 12.287 7 HG2 LYS 1 1HG LYS 1 16.128 -10.950 13.339 8 HG3 LYS 1 2HG LYS 1 17.294 -9.720 13.826 9 HD2 LYS 1 1HD LYS 1 16.171 -10.003 15.811 10 HD3 LYS 1 2HD LYS 1 15.325 -8.624 15.133 11 HE2 LYS 1 1HE LYS 1 13.483 -9.863 15.698 12 HE3 LYS 1 2HE LYS 1 13.757 -10.542 14.092 13 HZ1 LYS 1 3HZ LYS 1 14.388 -11.728 16.721 14 HZ2 LYS 1 1HZ LYS 1 15.211 -12.239 15.408 15 HZ3 LYS 1 2HZ LYS 1 13.588 -12.410 15.478 16 H LYS 2 H LYS 2 17.713 -7.691 9.221 17 HA LYS 2 HA LYS 2 15.725 -5.775 8.689 18 HB2 LYS 2 1HB LYS 2 18.253 -5.810 8.158 19 HB3 LYS 2 2HB LYS 2 17.841 -6.740 6.724 20 HG2 LYS 2 1HG LYS 2 18.161 -4.406 6.187 21 HG3 LYS 2 2HG LYS 2 16.477 -4.831 5.889 22 HD2 LYS 2 1HD LYS 2 15.731 -3.666 7.850 23 HD3 LYS 2 2HD LYS 2 17.381 -3.515 8.491 24 HE2 LYS 2 1HE LYS 2 18.011 -1.906 6.885 25 HE3 LYS 2 2HE LYS 2 16.661 -2.295 5.814 26 HZ1 LYS 2 3HZ LYS 2 15.146 -1.301 7.406 27 HZ2 LYS 2 1HZ LYS 2 16.307 -0.213 7.048 28 HZ3 LYS 2 2HZ LYS 2 16.350 -1.004 8.475 29 H LYS 3 H LYS 3 15.969 -8.979 7.421 30 HA LYS 3 HA LYS 3 14.310 -8.917 5.126 31 HB2 LYS 3 1HB LYS 3 14.562 -11.090 7.251 32 HB3 LYS 3 2HB LYS 3 13.818 -11.302 5.663 33 HG2 LYS 3 1HG LYS 3 15.948 -10.713 4.554 34 HG3 LYS 3 2HG LYS 3 16.744 -10.541 6.121 35 HD2 LYS 3 1HD LYS 3 15.446 -13.115 5.125 36 HD3 LYS 3 2HD LYS 3 17.152 -12.728 4.944 37 HE2 LYS 3 1HE LYS 3 16.393 -12.331 7.722 38 HE3 LYS 3 2HE LYS 3 15.795 -13.904 7.197 39 HZ1 LYS 3 3HZ LYS 3 18.617 -12.997 6.950 40 HZ2 LYS 3 1HZ LYS 3 18.055 -14.457 6.476 41 HZ3 LYS 3 2HZ LYS 3 18.059 -14.059 8.056 42 H ASN 4 H ASN 4 13.318 -8.740 8.513 43 HA ASN 4 HA ASN 4 10.498 -9.175 8.095 44 HB2 ASN 4 1HB ASN 4 12.014 -7.642 10.254 45 HB3 ASN 4 2HB ASN 4 10.280 -7.971 10.291 46 HD21 ASN 4 2HD2 ASN 4 11.774 -8.819 12.408 47 HD22 ASN 4 1HD2 ASN 4 11.842 -10.583 12.336 48 H TRP 5 H TRP 5 12.506 -6.222 7.840 49 HA TRP 5 HA TRP 5 10.248 -4.425 7.477 50 HB2 TRP 5 1HB TRP 5 13.069 -4.174 7.789 51 HB3 TRP 5 2HB TRP 5 12.690 -3.466 6.232 52 HD1 TRP 5 HD1 TRP 5 11.814 -1.047 6.313 53 HE1 TRP 5 HE1 TRP 5 10.916 0.557 8.122 54 HE3 TRP 5 HE3 TRP 5 11.586 -4.306 10.260 55 HZ2 TRP 5 HZ2 TRP 5 10.165 0.430 10.899 56 HZ3 TRP 5 HZ3 TRP 5 10.748 -3.541 12.476 57 HH2 TRP 5 HH2 TRP 5 10.037 -1.184 12.805 58 H PHE 6 H PHE 6 12.023 -6.539 5.348 59 HA PHE 6 HA PHE 6 11.085 -5.453 2.846 60 HB2 PHE 6 1HB PHE 6 12.968 -7.347 3.709 61 HB3 PHE 6 2HB PHE 6 11.776 -8.323 2.887 62 HD1 PHE 6 HD2 PHE 6 10.984 -6.448 0.591 63 HD2 PHE 6 HD1 PHE 6 14.814 -7.386 2.348 64 HE1 PHE 6 HE2 PHE 6 12.090 -5.966 -1.564 65 HE2 PHE 6 HE1 PHE 6 15.919 -6.912 0.171 66 HZ PHE 6 HZ PHE 6 14.557 -6.203 -1.788 67 H ASP 7 H ASP 7 9.425 -7.277 5.270 68 HA ASP 7 HA ASP 7 7.598 -8.746 3.560 69 HB2 ASP 7 1HB ASP 7 7.305 -7.822 6.443 70 HB3 ASP 7 2HB ASP 7 6.137 -8.807 5.582 71 H ILE 8 H ILE 8 6.657 -7.578 1.994 72 HA ILE 8 HA ILE 8 5.856 -4.917 2.119 73 HB ILE 8 HB ILE 8 4.633 -5.209 0.109 74 HG12 ILE 8 1HG1 ILE 8 4.747 -8.225 0.553 75 HG13 ILE 8 2HG1 ILE 8 3.302 -7.219 0.675 76 HG21 ILE 8 1HG2 ILE 8 6.953 -7.173 -0.070 77 HG22 ILE 8 2HG2 ILE 8 6.394 -5.996 -1.278 78 HG23 ILE 8 3HG2 ILE 8 7.192 -5.440 0.200 79 HD11 ILE 8 3HD1 ILE 8 4.886 -7.754 -1.861 80 HD12 ILE 8 1HD1 ILE 8 3.256 -8.315 -1.454 81 HD13 ILE 8 2HD1 ILE 8 3.546 -6.586 -1.731 82 H THR 9 H THR 9 4.194 -7.599 3.514 83 HA THR 9 HA THR 9 1.535 -6.659 3.661 84 HB THR 9 HB THR 9 1.448 -8.154 5.737 85 HG1 THR 9 HG1 THR 9 3.272 -9.466 6.015 86 HG21 THR 9 3HG2 THR 9 1.742 -10.253 4.460 87 HG22 THR 9 1HG2 THR 9 2.550 -9.356 3.158 88 HG23 THR 9 2HG2 THR 9 0.840 -9.046 3.540 89 H ASN 10 H ASN 10 4.341 -5.598 5.485 90 HA ASN 10 HA ASN 10 2.922 -4.341 7.666 91 HB2 ASN 10 1HB ASN 10 5.667 -3.965 6.408 92 HB3 ASN 10 2HB ASN 10 5.076 -2.861 7.644 93 HD21 ASN 10 2HD2 ASN 10 5.948 -3.362 9.613 94 HD22 ASN 10 1HD2 ASN 10 6.146 -5.015 10.181 95 H TRP 11 H TRP 11 4.131 -2.989 4.573 96 HA TRP 11 HA TRP 11 2.524 -0.534 4.975 97 HB2 TRP 11 1HB TRP 11 3.903 0.362 3.110 98 HB3 TRP 11 2HB TRP 11 4.744 -0.041 4.588 99 HD1 TRP 11 HD1 TRP 11 6.613 -1.793 4.526 100 HE1 TRP 11 HE1 TRP 11 7.937 -2.935 2.624 101 HE3 TRP 11 HE3 TRP 11 3.487 -0.736 0.646 102 HZ2 TRP 11 HZ2 TRP 11 7.705 -3.227 -0.243 103 HZ3 TRP 11 HZ3 TRP 11 4.048 -1.467 -1.683 104 HH2 TRP 11 HH2 TRP 11 6.146 -2.707 -2.127 105 H LEU 12 H LEU 12 1.926 -3.436 3.480 106 HA LEU 12 HA LEU 12 0.642 -2.788 1.093 107 HB2 LEU 12 1HB LEU 12 0.440 -4.960 3.101 108 HB3 LEU 12 2HB LEU 12 -1.069 -4.690 2.282 109 HG LEU 12 HG LEU 12 1.552 -5.412 0.934 110 HD11 LEU 12 1HD1 LEU 12 0.187 -7.436 0.246 111 HD12 LEU 12 2HD1 LEU 12 -1.051 -6.912 1.406 112 HD13 LEU 12 3HD1 LEU 12 0.578 -7.350 1.950 113 HD21 LEU 12 3HD2 LEU 12 -1.227 -4.871 -0.243 114 HD22 LEU 12 1HD2 LEU 12 0.110 -5.624 -1.138 115 HD23 LEU 12 2HD2 LEU 12 0.254 -3.958 -0.607 116 H TRP 13 H TRP 13 -0.442 -2.043 4.304 117 HA TRP 13 HA TRP 13 -3.234 -1.622 3.748 118 HB2 TRP 13 1HB TRP 13 -2.236 -1.800 6.023 119 HB3 TRP 13 2HB TRP 13 -1.511 -0.213 5.818 120 HD1 TRP 13 HD1 TRP 13 -5.005 -1.862 5.927 121 HE1 TRP 13 HE1 TRP 13 -6.763 -0.108 6.619 122 HE3 TRP 13 HE3 TRP 13 -1.995 2.270 6.108 123 HZ2 TRP 13 HZ2 TRP 13 -6.852 2.728 7.130 124 HZ3 TRP 13 HZ3 TRP 13 -2.946 4.501 6.670 125 HH2 TRP 13 HH2 TRP 13 -5.360 4.744 7.162 126 H TYR 14 H TYR 14 -0.473 0.669 3.681 127 HA TYR 14 HA TYR 14 -1.980 2.948 2.804 128 HB2 TYR 14 1HB TYR 14 0.935 2.380 2.191 129 HB3 TYR 14 2HB TYR 14 0.142 3.944 2.289 130 HD1 TYR 14 HD1 TYR 14 -0.776 4.705 4.610 131 HD2 TYR 14 HD2 TYR 14 1.935 1.412 4.070 132 HE1 TYR 14 HE1 TYR 14 -0.177 4.800 7.026 133 HE2 TYR 14 HE2 TYR 14 2.532 1.475 6.488 134 HH TYR 14 HH TYR 14 1.096 3.914 8.708 135 H ILE 15 H ILE 15 -0.591 0.203 1.091 136 HA ILE 15 HA ILE 15 -0.941 1.327 -1.584 137 HB ILE 15 HB ILE 15 -0.729 -1.620 -0.897 138 HG12 ILE 15 1HG1 ILE 15 1.211 -0.618 0.073 139 HG13 ILE 15 2HG1 ILE 15 1.680 -1.426 -1.405 140 HG21 ILE 15 1HG2 ILE 15 -0.267 -0.032 -3.454 141 HG22 ILE 15 2HG2 ILE 15 0.198 -1.735 -3.232 142 HG23 ILE 15 3HG2 ILE 15 -1.502 -1.266 -3.159 143 HD11 ILE 15 3HD1 ILE 15 1.790 0.786 -2.571 144 HD12 ILE 15 1HD1 ILE 15 1.328 1.590 -1.049 145 HD13 ILE 15 2HD1 ILE 15 2.854 0.715 -1.156 146 H LYS 16 H LYS 16 -2.901 -0.984 0.383 147 HA LYS 16 HA LYS 16 -5.068 -1.084 -1.526 148 HB2 LYS 16 1HB LYS 16 -4.552 -2.282 1.015 149 HB3 LYS 16 2HB LYS 16 -6.056 -1.368 1.182 150 HG2 LYS 16 1HG LYS 16 -6.705 -2.461 -1.118 151 HG3 LYS 16 2HG LYS 16 -5.386 -3.585 -0.796 152 HD2 LYS 16 1HD LYS 16 -7.245 -3.235 1.491 153 HD3 LYS 16 2HD LYS 16 -8.067 -3.747 0.032 154 HE2 LYS 16 1HE LYS 16 -5.651 -5.193 1.209 155 HE3 LYS 16 2HE LYS 16 -7.328 -5.592 1.591 156 HZ1 LYS 16 3HZ LYS 16 -6.535 -7.010 -0.178 157 HZ2 LYS 16 1HZ LYS 16 -6.135 -5.744 -1.125 158 HZ3 LYS 16 2HZ LYS 16 -7.704 -6.048 -0.777 159 H LEU 17 H LEU 17 -4.542 1.042 1.277 160 HA LEU 17 HA LEU 17 -6.907 2.603 0.960 161 HB2 LEU 17 1HB LEU 17 -5.633 2.558 3.020 162 HB3 LEU 17 2HB LEU 17 -4.251 3.325 2.251 163 HG LEU 17 HG LEU 17 -6.776 4.858 1.902 164 HD11 LEU 17 1HD1 LEU 17 -5.685 4.633 4.690 165 HD12 LEU 17 2HD1 LEU 17 -7.228 3.929 4.140 166 HD13 LEU 17 3HD1 LEU 17 -6.998 5.688 4.133 167 HD21 LEU 17 3HD2 LEU 17 -5.379 6.735 2.583 168 HD22 LEU 17 1HD2 LEU 17 -4.479 5.750 1.417 169 HD23 LEU 17 2HD2 LEU 17 -4.111 5.632 3.156 170 H PHE 18 H PHE 18 -3.741 2.951 -0.699 171 HA PHE 18 HA PHE 18 -4.092 5.467 -1.804 172 HB2 PHE 18 1HB PHE 18 -2.073 4.258 -2.192 173 HB3 PHE 18 2HB PHE 18 -2.913 3.000 -3.082 174 HD1 PHE 18 HD1 PHE 18 -3.187 6.773 -3.446 175 HD2 PHE 18 HD2 PHE 18 -2.072 2.998 -5.235 176 HE1 PHE 18 HE1 PHE 18 -2.683 7.924 -5.569 177 HE2 PHE 18 HE2 PHE 18 -1.619 4.162 -7.382 178 HZ PHE 18 HZ PHE 18 -1.918 6.622 -7.544 179 H ILE 19 H ILE 19 -5.660 2.463 -2.982 180 HA ILE 19 HA ILE 19 -7.080 3.761 -5.137 181 HB ILE 19 HB ILE 19 -7.705 1.180 -3.662 182 HG12 ILE 19 1HG1 ILE 19 -6.878 0.159 -5.904 183 HG13 ILE 19 2HG1 ILE 19 -6.101 1.709 -6.196 184 HG21 ILE 19 1HG2 ILE 19 -9.729 1.806 -4.697 185 HG22 ILE 19 2HG2 ILE 19 -8.909 2.446 -6.128 186 HG23 ILE 19 3HG2 ILE 19 -9.010 0.687 -5.845 187 HD11 ILE 19 3HD1 ILE 19 -4.654 -0.130 -5.250 188 HD12 ILE 19 1HD1 ILE 19 -4.613 1.373 -4.331 189 HD13 ILE 19 2HD1 ILE 19 -5.577 -0.012 -3.741 190 H MET 20 H MET 20 -7.791 3.353 -1.704 191 HA MET 20 HA MET 20 -10.613 4.059 -1.830 192 HB2 MET 20 1HB MET 20 -8.663 4.119 0.505 193 HB3 MET 20 2HB MET 20 -10.396 4.327 0.632 194 HG2 MET 20 1HG MET 20 -9.198 1.833 -0.630 195 HG3 MET 20 2HG MET 20 -9.353 1.994 1.109 196 HE1 MET 20 3HE MET 20 -12.201 3.345 1.700 197 HE2 MET 20 1HE MET 20 -13.036 1.794 1.920 198 HE3 MET 20 2HE MET 20 -11.356 1.986 2.472 199 H ILE 21 H ILE 21 -7.659 5.912 -0.945 200 HA ILE 21 HA ILE 21 -9.065 8.373 -0.461 201 HB ILE 21 HB ILE 21 -6.913 7.878 0.542 202 HG12 ILE 21 1HG1 ILE 21 -6.771 10.408 -1.155 203 HG13 ILE 21 2HG1 ILE 21 -7.777 10.213 0.284 204 HG21 ILE 21 1HG2 ILE 21 -5.797 6.811 -1.403 205 HG22 ILE 21 2HG2 ILE 21 -5.601 8.401 -2.164 206 HG23 ILE 21 3HG2 ILE 21 -4.796 8.016 -0.627 207 HD11 ILE 21 3HD1 ILE 21 -5.769 11.386 0.910 208 HD12 ILE 21 1HD1 ILE 21 -5.702 9.764 1.630 209 HD13 ILE 21 2HD1 ILE 21 -4.734 10.150 0.184 210 H VAL 22 H VAL 22 -7.458 7.163 -3.414 211 HA VAL 22 HA VAL 22 -8.010 9.547 -4.983 212 HB VAL 22 HB VAL 22 -7.493 8.183 -6.936 213 HG11 VAL 22 1HG1 VAL 22 -5.544 7.697 -4.694 214 HG12 VAL 22 2HG1 VAL 22 -5.210 7.592 -6.429 215 HG13 VAL 22 3HG1 VAL 22 -5.661 9.160 -5.713 216 HG21 VAL 22 3HG2 VAL 22 -8.429 6.081 -6.602 217 HG22 VAL 22 1HG2 VAL 22 -6.674 5.798 -6.560 218 HG23 VAL 22 2HG2 VAL 22 -7.606 5.866 -5.071 219 H GLY 23 H GLY 23 -9.853 6.593 -4.387 220 HA2 GLY 23 1HA GLY 23 -11.785 5.724 -5.155 221 HA3 GLY 23 2HA GLY 23 -12.430 7.373 -5.197 222 H GLY 24 H GLY 24 -12.394 8.499 -7.163 223 HA2 GLY 24 1HA GLY 24 -12.630 6.903 -9.596 224 HA3 GLY 24 2HA GLY 24 -12.840 8.645 -9.456 225 H LEU 25 H LEU 25 -10.020 8.913 -8.256 226 HA LEU 25 HA LEU 25 -8.688 9.211 -10.846 227 HB2 LEU 25 1HB LEU 25 -7.143 9.689 -8.332 228 HB3 LEU 25 2HB LEU 25 -7.074 10.490 -9.870 229 HG LEU 25 HG LEU 25 -9.246 10.844 -7.776 230 HD11 LEU 25 1HD1 LEU 25 -8.275 13.056 -7.459 231 HD12 LEU 25 2HD1 LEU 25 -7.015 12.697 -8.662 232 HD13 LEU 25 3HD1 LEU 25 -7.084 11.788 -7.135 233 HD21 LEU 25 3HD2 LEU 25 -8.812 12.327 -10.410 234 HD22 LEU 25 1HD2 LEU 25 -10.004 12.753 -9.161 235 HD23 LEU 25 2HD2 LEU 25 -10.166 11.235 -10.049 236 H VAL 26 H VAL 26 -9.012 6.496 -9.065 237 HA VAL 26 HA VAL 26 -6.540 5.294 -8.682 238 HB VAL 26 HB VAL 26 -8.728 4.386 -7.973 239 HG11 VAL 26 1HG1 VAL 26 -9.989 4.606 -10.112 240 HG12 VAL 26 2HG1 VAL 26 -9.041 3.248 -10.772 241 HG13 VAL 26 3HG1 VAL 26 -10.098 3.007 -9.370 242 HG21 VAL 26 3HG2 VAL 26 -7.033 2.371 -9.486 243 HG22 VAL 26 1HG2 VAL 26 -6.718 3.018 -7.860 244 HG23 VAL 26 2HG2 VAL 26 -8.163 2.031 -8.176 245 H LYS 27 H LYS 27 -8.191 5.608 -11.729 246 HA LYS 27 HA LYS 27 -6.637 3.843 -13.342 247 HB2 LYS 27 1HB LYS 27 -8.595 6.018 -13.747 248 HB3 LYS 27 2HB LYS 27 -7.370 5.992 -15.013 249 HG2 LYS 27 1HG LYS 27 -7.806 3.604 -15.440 250 HG3 LYS 27 2HG LYS 27 -9.018 3.577 -14.142 251 HD2 LYS 27 1HD LYS 27 -10.368 5.264 -15.366 252 HD3 LYS 27 2HD LYS 27 -9.144 5.312 -16.654 253 HE2 LYS 27 1HE LYS 27 -9.512 2.879 -17.070 254 HE3 LYS 27 2HE LYS 27 -10.757 2.860 -15.814 255 HZ1 LYS 27 3HZ LYS 27 -12.019 4.474 -17.149 256 HZ2 LYS 27 1HZ LYS 27 -11.742 3.119 -18.014 257 HZ3 LYS 27 2HZ LYS 27 -10.872 4.466 -18.314 258 H LYS 28 H LYS 28 -5.789 6.969 -12.136 259 HA LYS 28 HA LYS 28 -4.082 8.451 -12.425 260 HB2 LYS 28 1HB LYS 28 -2.707 5.768 -12.571 261 HB3 LYS 28 2HB LYS 28 -1.756 7.214 -12.783 262 HG2 LYS 28 1HG LYS 28 -3.554 7.400 -10.423 263 HG3 LYS 28 2HG LYS 28 -2.457 6.026 -10.360 264 HD2 LYS 28 1HD LYS 28 -1.392 7.897 -9.278 265 HD3 LYS 28 2HD LYS 28 -0.517 7.525 -10.763 266 HE2 LYS 28 1HE LYS 28 -1.707 9.405 -11.903 267 HE3 LYS 28 2HE LYS 28 -2.581 9.750 -10.403 268 HZ1 LYS 28 3HZ LYS 28 0.369 9.915 -10.738 269 HZ2 LYS 28 1HZ LYS 28 -0.427 10.215 -9.343 270 HZ3 LYS 28 2HZ LYS 28 -0.642 11.190 -10.633 Start of MODEL 4 1 H1 LYS 1 1H LYS 1 15.189 -4.783 13.423 2 H2 LYS 1 2H LYS 1 16.388 -5.807 13.032 3 H3 LYS 1 3H LYS 1 15.989 -4.561 12.028 4 HA LYS 1 HA LYS 1 14.778 -7.170 12.346 5 HB2 LYS 1 1HB LYS 1 13.214 -5.250 13.362 6 HB3 LYS 1 2HB LYS 1 12.794 -5.012 11.670 7 HG2 LYS 1 1HG LYS 1 12.306 -7.578 11.639 8 HG3 LYS 1 2HG LYS 1 12.503 -7.508 13.396 9 HD2 LYS 1 1HD LYS 1 10.733 -5.613 13.350 10 HD3 LYS 1 2HD LYS 1 10.428 -6.099 11.670 11 HE2 LYS 1 1HE LYS 1 9.944 -8.433 12.490 12 HE3 LYS 1 2HE LYS 1 10.207 -7.874 14.146 13 HZ1 LYS 1 3HZ LYS 1 8.080 -6.869 12.326 14 HZ2 LYS 1 1HZ LYS 1 8.352 -6.307 13.834 15 HZ3 LYS 1 2HZ LYS 1 7.852 -7.843 13.616 16 H LYS 2 H LYS 2 16.789 -5.856 10.466 17 HA LYS 2 HA LYS 2 15.582 -4.849 8.126 18 HB2 LYS 2 1HB LYS 2 18.051 -4.756 9.060 19 HB3 LYS 2 2HB LYS 2 18.277 -6.239 8.146 20 HG2 LYS 2 1HG LYS 2 19.018 -4.496 6.753 21 HG3 LYS 2 2HG LYS 2 17.467 -4.959 6.078 22 HD2 LYS 2 1HD LYS 2 16.580 -2.906 6.419 23 HD3 LYS 2 2HD LYS 2 17.132 -2.815 8.086 24 HE2 LYS 2 1HE LYS 2 18.925 -2.296 5.674 25 HE3 LYS 2 2HE LYS 2 18.036 -1.033 6.528 26 HZ1 LYS 2 3HZ LYS 2 19.265 -1.573 8.544 27 HZ2 LYS 2 1HZ LYS 2 20.315 -1.229 7.348 28 HZ3 LYS 2 2HZ LYS 2 20.083 -2.776 7.797 29 H LYS 3 H LYS 3 16.425 -8.151 8.875 30 HA LYS 3 HA LYS 3 16.100 -9.435 6.340 31 HB2 LYS 3 1HB LYS 3 15.552 -10.428 9.168 32 HB3 LYS 3 2HB LYS 3 15.644 -11.479 7.757 33 HG2 LYS 3 1HG LYS 3 17.924 -11.350 7.579 34 HG3 LYS 3 2HG LYS 3 18.017 -9.687 8.156 35 HD2 LYS 3 1HD LYS 3 17.544 -10.442 10.474 36 HD3 LYS 3 2HD LYS 3 17.518 -12.129 9.907 37 HE2 LYS 3 1HE LYS 3 19.857 -11.882 9.105 38 HE3 LYS 3 2HE LYS 3 19.870 -10.195 9.636 39 HZ1 LYS 3 3HZ LYS 3 20.896 -11.649 11.288 40 HZ2 LYS 3 1HZ LYS 3 19.536 -12.538 11.435 41 HZ3 LYS 3 2HZ LYS 3 19.552 -10.977 11.923 42 H ASN 4 H ASN 4 13.672 -8.366 8.639 43 HA ASN 4 HA ASN 4 11.486 -9.764 7.227 44 HB2 ASN 4 1HB ASN 4 12.006 -9.216 9.911 45 HB3 ASN 4 2HB ASN 4 10.820 -7.981 9.504 46 HD21 ASN 4 2HD2 ASN 4 8.695 -8.712 9.871 47 HD22 ASN 4 1HD2 ASN 4 8.254 -10.409 9.736 48 H TRP 5 H TRP 5 13.060 -6.850 6.720 49 HA TRP 5 HA TRP 5 10.923 -5.000 6.392 50 HB2 TRP 5 1HB TRP 5 13.550 -4.755 6.465 51 HB3 TRP 5 2HB TRP 5 13.427 -4.863 4.714 52 HD1 TRP 5 HD1 TRP 5 12.634 -2.645 3.515 53 HE1 TRP 5 HE1 TRP 5 12.097 -0.253 4.324 54 HE3 TRP 5 HE3 TRP 5 12.412 -3.524 8.551 55 HZ2 TRP 5 HZ2 TRP 5 11.646 1.095 6.837 56 HZ3 TRP 5 HZ3 TRP 5 11.924 -1.670 10.137 57 HH2 TRP 5 HH2 TRP 5 11.544 0.637 9.295 58 H PHE 6 H PHE 6 12.047 -7.542 4.255 59 HA PHE 6 HA PHE 6 10.730 -6.686 1.853 60 HB2 PHE 6 1HB PHE 6 12.556 -8.663 2.620 61 HB3 PHE 6 2HB PHE 6 11.138 -9.595 2.224 62 HD1 PHE 6 HD2 PHE 6 10.111 -7.816 -0.158 63 HD2 PHE 6 HD1 PHE 6 14.002 -9.323 0.943 64 HE1 PHE 6 HE2 PHE 6 10.791 -7.786 -2.528 65 HE2 PHE 6 HE1 PHE 6 14.678 -9.301 -1.452 66 HZ PHE 6 HZ PHE 6 13.070 -8.530 -3.191 67 H ASP 7 H ASP 7 9.339 -7.829 4.768 68 HA ASP 7 HA ASP 7 7.106 -9.329 3.659 69 HB2 ASP 7 1HB ASP 7 7.585 -8.059 6.376 70 HB3 ASP 7 2HB ASP 7 6.087 -8.834 5.924 71 H ILE 8 H ILE 8 6.444 -8.001 1.957 72 HA ILE 8 HA ILE 8 5.649 -5.355 2.044 73 HB ILE 8 HB ILE 8 4.392 -5.654 0.062 74 HG12 ILE 8 1HG1 ILE 8 4.423 -8.663 0.558 75 HG13 ILE 8 2HG1 ILE 8 3.010 -7.615 0.698 76 HG21 ILE 8 1HG2 ILE 8 6.632 -7.702 -0.134 77 HG22 ILE 8 2HG2 ILE 8 6.092 -6.522 -1.344 78 HG23 ILE 8 3HG2 ILE 8 6.946 -5.976 0.105 79 HD11 ILE 8 3HD1 ILE 8 3.203 -7.026 -1.718 80 HD12 ILE 8 1HD1 ILE 8 4.511 -8.226 -1.869 81 HD13 ILE 8 2HD1 ILE 8 2.882 -8.744 -1.410 82 H THR 9 H THR 9 3.895 -8.000 3.386 83 HA THR 9 HA THR 9 1.299 -6.953 3.619 84 HB THR 9 HB THR 9 2.027 -9.283 4.113 85 HG1 THR 9 HG1 THR 9 0.495 -9.562 5.748 86 HG21 THR 9 3HG2 THR 9 2.763 -9.919 6.324 87 HG22 THR 9 1HG2 THR 9 2.719 -8.240 6.894 88 HG23 THR 9 2HG2 THR 9 3.909 -8.740 5.675 89 H ASN 10 H ASN 10 4.138 -5.990 5.444 90 HA ASN 10 HA ASN 10 2.756 -4.688 7.613 91 HB2 ASN 10 1HB ASN 10 5.177 -5.347 7.601 92 HB3 ASN 10 2HB ASN 10 5.499 -4.084 6.413 93 HD21 ASN 10 2HD2 ASN 10 4.271 -4.645 9.754 94 HD22 ASN 10 1HD2 ASN 10 4.726 -3.040 10.310 95 H TRP 11 H TRP 11 4.015 -3.418 4.505 96 HA TRP 11 HA TRP 11 2.554 -0.872 4.903 97 HB2 TRP 11 1HB TRP 11 3.932 -0.066 3.003 98 HB3 TRP 11 2HB TRP 11 4.776 -0.475 4.476 99 HD1 TRP 11 HD1 TRP 11 6.569 -2.307 4.427 100 HE1 TRP 11 HE1 TRP 11 7.851 -3.498 2.521 101 HE3 TRP 11 HE3 TRP 11 3.449 -1.178 0.563 102 HZ2 TRP 11 HZ2 TRP 11 7.594 -3.787 -0.346 103 HZ3 TRP 11 HZ3 TRP 11 3.973 -1.935 -1.766 104 HH2 TRP 11 HH2 TRP 11 6.037 -3.230 -2.221 105 H LEU 12 H LEU 12 1.787 -3.763 3.456 106 HA LEU 12 HA LEU 12 0.505 -3.072 1.078 107 HB2 LEU 12 1HB LEU 12 0.223 -5.221 3.104 108 HB3 LEU 12 2HB LEU 12 -1.274 -4.891 2.285 109 HG LEU 12 HG LEU 12 1.311 -5.717 0.919 110 HD11 LEU 12 1HD1 LEU 12 -0.161 -7.705 0.269 111 HD12 LEU 12 2HD1 LEU 12 -1.317 -7.142 1.494 112 HD13 LEU 12 3HD1 LEU 12 0.322 -7.644 1.951 113 HD21 LEU 12 3HD2 LEU 12 0.013 -4.239 -0.601 114 HD22 LEU 12 1HD2 LEU 12 -1.474 -5.134 -0.221 115 HD23 LEU 12 2HD2 LEU 12 -0.153 -5.905 -1.125 116 H TRP 13 H TRP 13 -0.494 -2.245 4.290 117 HA TRP 13 HA TRP 13 -3.273 -1.692 3.785 118 HB2 TRP 13 1HB TRP 13 -2.231 -1.903 6.036 119 HB3 TRP 13 2HB TRP 13 -1.435 -0.356 5.803 120 HD1 TRP 13 HD1 TRP 13 -4.995 -1.835 6.024 121 HE1 TRP 13 HE1 TRP 13 -6.650 0.004 6.752 122 HE3 TRP 13 HE3 TRP 13 -1.795 2.156 6.083 123 HZ2 TRP 13 HZ2 TRP 13 -6.594 2.844 7.239 124 HZ3 TRP 13 HZ3 TRP 13 -2.628 4.432 6.654 125 HH2 TRP 13 HH2 TRP 13 -5.011 4.790 7.214 126 H TYR 14 H TYR 14 -0.400 0.454 3.633 127 HA TYR 14 HA TYR 14 -1.816 2.798 2.765 128 HB2 TYR 14 1HB TYR 14 1.059 2.094 2.116 129 HB3 TYR 14 2HB TYR 14 0.338 3.693 2.209 130 HD1 TYR 14 HD2 TYR 14 -0.508 4.520 4.531 131 HD2 TYR 14 HD1 TYR 14 2.034 1.094 3.993 132 HE1 TYR 14 HE2 TYR 14 0.130 4.615 6.938 133 HE2 TYR 14 HE1 TYR 14 2.672 1.161 6.403 134 HH TYR 14 HH TYR 14 1.377 3.682 8.614 135 H ILE 15 H ILE 15 -0.585 -0.019 1.050 136 HA ILE 15 HA ILE 15 -0.910 1.107 -1.632 137 HB ILE 15 HB ILE 15 -0.856 -1.843 -0.919 138 HG12 ILE 15 1HG1 ILE 15 1.153 -0.950 0.014 139 HG13 ILE 15 2HG1 ILE 15 1.555 -1.787 -1.468 140 HG21 ILE 15 1HG2 ILE 15 -0.341 -0.307 -3.499 141 HG22 ILE 15 2HG2 ILE 15 0.018 -2.036 -3.267 142 HG23 ILE 15 3HG2 ILE 15 -1.648 -1.457 -3.172 143 HD11 ILE 15 3HD1 ILE 15 1.376 1.245 -1.111 144 HD12 ILE 15 1HD1 ILE 15 2.848 0.287 -1.252 145 HD13 ILE 15 2HD1 ILE 15 1.758 0.417 -2.643 146 H LYS 16 H LYS 16 -2.934 -1.090 0.363 147 HA LYS 16 HA LYS 16 -5.190 -1.146 -1.432 148 HB2 LYS 16 1HB LYS 16 -4.707 -1.771 1.452 149 HB3 LYS 16 2HB LYS 16 -6.382 -1.576 0.924 150 HG2 LYS 16 1HG LYS 16 -6.376 -3.385 -0.468 151 HG3 LYS 16 2HG LYS 16 -4.654 -3.283 -0.850 152 HD2 LYS 16 1HD LYS 16 -3.983 -4.488 0.933 153 HD3 LYS 16 2HD LYS 16 -5.296 -3.929 1.987 154 HE2 LYS 16 1HE LYS 16 -6.916 -5.341 0.788 155 HE3 LYS 16 2HE LYS 16 -5.645 -5.928 -0.292 156 HZ1 LYS 16 3HZ LYS 16 -6.105 -7.454 1.579 157 HZ2 LYS 16 1HZ LYS 16 -5.651 -6.319 2.659 158 HZ3 LYS 16 2HZ LYS 16 -4.557 -6.945 1.614 159 H LEU 17 H LEU 17 -4.465 1.015 1.312 160 HA LEU 17 HA LEU 17 -6.765 2.676 1.027 161 HB2 LEU 17 1HB LEU 17 -5.454 2.583 3.061 162 HB3 LEU 17 2HB LEU 17 -4.058 3.294 2.261 163 HG LEU 17 HG LEU 17 -6.518 4.928 1.942 164 HD11 LEU 17 1HD1 LEU 17 -6.685 5.765 4.182 165 HD12 LEU 17 2HD1 LEU 17 -5.431 4.632 4.726 166 HD13 LEU 17 3HD1 LEU 17 -7.011 4.021 4.173 167 HD21 LEU 17 3HD2 LEU 17 -5.040 6.741 2.622 168 HD22 LEU 17 1HD2 LEU 17 -4.195 5.722 1.444 169 HD23 LEU 17 2HD2 LEU 17 -3.815 5.582 3.180 170 H PHE 18 H PHE 18 -3.626 2.863 -0.711 171 HA PHE 18 HA PHE 18 -3.880 5.384 -1.825 172 HB2 PHE 18 1HB PHE 18 -1.932 4.072 -2.255 173 HB3 PHE 18 2HB PHE 18 -2.855 2.860 -3.128 174 HD1 PHE 18 HD1 PHE 18 -2.971 6.637 -3.505 175 HD2 PHE 18 HD2 PHE 18 -2.009 2.815 -5.278 176 HE1 PHE 18 HE1 PHE 18 -2.430 7.757 -5.640 177 HE2 PHE 18 HE2 PHE 18 -1.514 3.949 -7.432 178 HZ PHE 18 HZ PHE 18 -1.713 6.423 -7.612 179 H ILE 19 H ILE 19 -5.580 2.442 -2.979 180 HA ILE 19 HA ILE 19 -7.018 3.780 -5.091 181 HB ILE 19 HB ILE 19 -7.710 1.235 -3.582 182 HG12 ILE 19 1HG1 ILE 19 -6.980 0.179 -5.843 183 HG13 ILE 19 2HG1 ILE 19 -6.151 1.697 -6.158 184 HG21 ILE 19 1HG2 ILE 19 -8.904 2.514 -6.052 185 HG22 ILE 19 2HG2 ILE 19 -9.093 0.775 -5.708 186 HG23 ILE 19 3HG2 ILE 19 -9.730 1.968 -4.586 187 HD11 ILE 19 3HD1 ILE 19 -4.755 -0.200 -5.245 188 HD12 ILE 19 1HD1 ILE 19 -4.626 1.304 -4.338 189 HD13 ILE 19 2HD1 ILE 19 -5.629 -0.037 -3.711 190 H MET 20 H MET 20 -7.666 3.413 -1.634 191 HA MET 20 HA MET 20 -10.449 4.257 -1.706 192 HB2 MET 20 1HB MET 20 -8.450 4.174 0.584 193 HB3 MET 20 2HB MET 20 -10.160 4.518 0.760 194 HG2 MET 20 1HG MET 20 -9.214 1.956 -0.573 195 HG3 MET 20 2HG MET 20 -9.301 2.093 1.175 196 HE1 MET 20 3HE MET 20 -11.640 3.382 2.206 197 HE2 MET 20 1HE MET 20 -12.968 2.205 2.094 198 HE3 MET 20 2HE MET 20 -11.344 1.673 2.580 199 H ILE 21 H ILE 21 -7.393 5.983 -0.908 200 HA ILE 21 HA ILE 21 -8.702 8.503 -0.419 201 HB ILE 21 HB ILE 21 -6.566 7.950 0.573 202 HG12 ILE 21 1HG1 ILE 21 -6.222 10.426 -1.165 203 HG13 ILE 21 2HG1 ILE 21 -7.382 10.339 0.163 204 HG21 ILE 21 1HG2 ILE 21 -5.484 6.811 -1.347 205 HG22 ILE 21 2HG2 ILE 21 -5.266 8.368 -2.163 206 HG23 ILE 21 3HG2 ILE 21 -4.447 8.022 -0.627 207 HD11 ILE 21 3HD1 ILE 21 -5.333 11.420 0.908 208 HD12 ILE 21 1HD1 ILE 21 -5.556 9.882 1.767 209 HD13 ILE 21 2HD1 ILE 21 -4.365 10.012 0.448 210 H VAL 22 H VAL 22 -7.203 7.187 -3.385 211 HA VAL 22 HA VAL 22 -7.664 9.588 -4.959 212 HB VAL 22 HB VAL 22 -7.274 8.190 -6.915 213 HG11 VAL 22 1HG1 VAL 22 -5.283 7.629 -4.726 214 HG12 VAL 22 2HG1 VAL 22 -5.005 7.491 -6.468 215 HG13 VAL 22 3HG1 VAL 22 -5.358 9.085 -5.757 216 HG21 VAL 22 3HG2 VAL 22 -6.545 5.775 -6.546 217 HG22 VAL 22 1HG2 VAL 22 -7.442 5.892 -5.037 218 HG23 VAL 22 2HG2 VAL 22 -8.287 6.134 -6.556 219 H GLY 23 H GLY 23 -9.638 6.723 -4.330 220 HA2 GLY 23 1HA GLY 23 -11.601 5.930 -5.098 221 HA3 GLY 23 2HA GLY 23 -12.193 7.600 -5.113 222 H GLY 24 H GLY 24 -12.144 8.743 -7.066 223 HA2 GLY 24 1HA GLY 24 -12.470 7.211 -9.517 224 HA3 GLY 24 2HA GLY 24 -12.549 8.962 -9.357 225 H LEU 25 H LEU 25 -9.735 9.048 -8.180 226 HA LEU 25 HA LEU 25 -8.352 9.192 -10.763 227 HB2 LEU 25 1HB LEU 25 -6.814 9.702 -8.258 228 HB3 LEU 25 2HB LEU 25 -6.720 10.452 -9.817 229 HG LEU 25 HG LEU 25 -8.886 10.947 -7.747 230 HD11 LEU 25 1HD1 LEU 25 -6.689 11.795 -7.094 231 HD12 LEU 25 2HD1 LEU 25 -7.809 13.118 -7.461 232 HD13 LEU 25 3HD1 LEU 25 -6.553 12.668 -8.639 233 HD21 LEU 25 3HD2 LEU 25 -8.350 12.360 -10.401 234 HD22 LEU 25 1HD2 LEU 25 -9.537 12.864 -9.176 235 HD23 LEU 25 2HD2 LEU 25 -9.757 11.338 -10.041 236 H VAL 26 H VAL 26 -8.941 6.522 -9.083 237 HA VAL 26 HA VAL 26 -6.492 5.189 -8.643 238 HB VAL 26 HB VAL 26 -8.693 4.380 -7.883 239 HG11 VAL 26 1HG1 VAL 26 -9.162 3.310 -10.693 240 HG12 VAL 26 2HG1 VAL 26 -10.184 3.107 -9.261 241 HG13 VAL 26 3HG1 VAL 26 -10.014 4.708 -9.986 242 HG21 VAL 26 3HG2 VAL 26 -7.170 2.317 -9.509 243 HG22 VAL 26 1HG2 VAL 26 -6.735 2.925 -7.895 244 HG23 VAL 26 2HG2 VAL 26 -8.243 2.014 -8.138 245 H LYS 27 H LYS 27 -8.262 5.542 -11.646 246 HA LYS 27 HA LYS 27 -6.635 3.805 -13.281 247 HB2 LYS 27 1HB LYS 27 -8.844 5.750 -13.657 248 HB3 LYS 27 2HB LYS 27 -7.693 5.756 -14.995 249 HG2 LYS 27 1HG LYS 27 -7.918 3.366 -15.315 250 HG3 LYS 27 2HG LYS 27 -8.978 3.217 -13.898 251 HD2 LYS 27 1HD LYS 27 -10.745 4.436 -14.953 252 HD3 LYS 27 2HD LYS 27 -9.678 5.026 -16.246 253 HE2 LYS 27 1HE LYS 27 -9.383 2.727 -17.087 254 HE3 LYS 27 2HE LYS 27 -10.436 2.103 -15.810 255 HZ1 LYS 27 3HZ LYS 27 -12.261 3.388 -16.760 256 HZ2 LYS 27 1HZ LYS 27 -11.621 2.443 -17.927 257 HZ3 LYS 27 2HZ LYS 27 -11.290 4.040 -17.903 258 H LYS 28 H LYS 28 -6.543 7.328 -12.869 259 HA LYS 28 HA LYS 28 -3.688 7.556 -13.372 260 HB2 LYS 28 1HB LYS 28 -3.742 8.796 -15.400 261 HB3 LYS 28 2HB LYS 28 -4.538 7.261 -15.656 262 HG2 LYS 28 1HG LYS 28 -6.089 8.543 -16.719 263 HG3 LYS 28 2HG LYS 28 -6.753 8.696 -15.099 264 HD2 LYS 28 1HD LYS 28 -6.692 10.906 -15.894 265 HD3 LYS 28 2HD LYS 28 -5.237 10.800 -14.879 266 HE2 LYS 28 1HE LYS 28 -3.834 10.433 -16.859 267 HE3 LYS 28 2HE LYS 28 -5.262 10.379 -17.900 268 HZ1 LYS 28 3HZ LYS 28 -4.192 12.559 -17.962 269 HZ2 LYS 28 1HZ LYS 28 -4.388 12.762 -16.355 270 HZ3 LYS 28 2HZ LYS 28 -5.692 12.703 -17.339 Start of MODEL 5 1 H1 LYS 1 1H LYS 1 16.551 -7.006 12.656 2 H2 LYS 1 2H LYS 1 15.447 -7.724 13.607 3 H3 LYS 1 3H LYS 1 15.669 -8.277 12.095 4 HA LYS 1 HA LYS 1 13.619 -6.994 12.318 5 HB2 LYS 1 1HB LYS 1 15.522 -4.779 13.115 6 HB3 LYS 1 2HB LYS 1 13.877 -4.470 12.554 7 HG2 LYS 1 1HG LYS 1 12.861 -5.420 14.417 8 HG3 LYS 1 2HG LYS 1 14.182 -6.527 14.727 9 HD2 LYS 1 1HD LYS 1 14.305 -5.063 16.525 10 HD3 LYS 1 2HD LYS 1 15.601 -4.560 15.458 11 HE2 LYS 1 1HE LYS 1 14.653 -2.544 16.147 12 HE3 LYS 1 2HE LYS 1 13.955 -2.777 14.543 13 HZ1 LYS 1 3HZ LYS 1 12.621 -3.414 17.131 14 HZ2 LYS 1 1HZ LYS 1 11.938 -3.648 15.664 15 HZ3 LYS 1 2HZ LYS 1 12.271 -2.137 16.185 16 H LYS 2 H LYS 2 16.662 -6.013 10.559 17 HA LYS 2 HA LYS 2 15.280 -5.035 8.280 18 HB2 LYS 2 1HB LYS 2 17.870 -5.044 8.952 19 HB3 LYS 2 2HB LYS 2 17.901 -6.493 7.955 20 HG2 LYS 2 1HG LYS 2 18.402 -4.816 6.393 21 HG3 LYS 2 2HG LYS 2 16.669 -5.009 6.160 22 HD2 LYS 2 1HD LYS 2 16.935 -2.673 6.263 23 HD3 LYS 2 2HD LYS 2 16.417 -3.073 7.906 24 HE2 LYS 2 1HE LYS 2 18.998 -3.260 8.408 25 HE3 LYS 2 2HE LYS 2 19.205 -2.419 6.870 26 HZ1 LYS 2 3HZ LYS 2 17.797 -0.612 7.793 27 HZ2 LYS 2 1HZ LYS 2 19.144 -0.840 8.685 28 HZ3 LYS 2 2HZ LYS 2 17.712 -1.393 9.229 29 H LYS 3 H LYS 3 15.963 -8.365 9.111 30 HA LYS 3 HA LYS 3 15.395 -9.695 6.654 31 HB2 LYS 3 1HB LYS 3 15.213 -10.476 9.571 32 HB3 LYS 3 2HB LYS 3 14.453 -11.513 8.381 33 HG2 LYS 3 1HG LYS 3 16.628 -12.336 8.872 34 HG3 LYS 3 2HG LYS 3 16.541 -11.845 7.185 35 HD2 LYS 3 1HD LYS 3 18.183 -10.266 7.414 36 HD3 LYS 3 2HD LYS 3 17.597 -9.728 8.986 37 HE2 LYS 3 1HE LYS 3 19.790 -10.644 9.280 38 HE3 LYS 3 2HE LYS 3 18.601 -11.649 10.108 39 HZ1 LYS 3 3HZ LYS 3 19.845 -12.278 7.480 40 HZ2 LYS 3 1HZ LYS 3 18.726 -13.213 8.225 41 HZ3 LYS 3 2HZ LYS 3 20.194 -13.003 8.898 42 H ASN 4 H ASN 4 13.109 -8.423 9.014 43 HA ASN 4 HA ASN 4 10.796 -9.346 7.400 44 HB2 ASN 4 1HB ASN 4 9.430 -8.678 9.315 45 HB3 ASN 4 2HB ASN 4 10.678 -9.830 9.744 46 HD21 ASN 4 2HD2 ASN 4 9.737 -6.390 10.004 47 HD22 ASN 4 1HD2 ASN 4 10.788 -6.099 11.388 48 H TRP 5 H TRP 5 12.764 -6.903 6.804 49 HA TRP 5 HA TRP 5 10.853 -4.704 6.515 50 HB2 TRP 5 1HB TRP 5 13.386 -4.560 6.894 51 HB3 TRP 5 2HB TRP 5 13.565 -4.956 5.185 52 HD1 TRP 5 HD1 TRP 5 13.070 -3.006 3.472 53 HE1 TRP 5 HE1 TRP 5 12.567 -0.486 3.712 54 HE3 TRP 5 HE3 TRP 5 12.157 -2.837 8.505 55 HZ2 TRP 5 HZ2 TRP 5 11.839 1.348 5.815 56 HZ3 TRP 5 HZ3 TRP 5 11.547 -0.693 9.606 57 HH2 TRP 5 HH2 TRP 5 11.385 1.402 8.276 58 H PHE 6 H PHE 6 12.220 -7.208 4.355 59 HA PHE 6 HA PHE 6 11.079 -6.215 1.921 60 HB2 PHE 6 1HB PHE 6 12.853 -8.242 2.679 61 HB3 PHE 6 2HB PHE 6 11.487 -9.138 2.070 62 HD1 PHE 6 HD1 PHE 6 10.594 -7.334 -0.257 63 HD2 PHE 6 HD2 PHE 6 14.507 -8.549 1.106 64 HE1 PHE 6 HE1 PHE 6 11.469 -7.077 -2.545 65 HE2 PHE 6 HE2 PHE 6 15.379 -8.291 -1.208 66 HZ PHE 6 HZ PHE 6 13.860 -7.555 -3.037 67 H ASP 7 H ASP 7 9.544 -7.769 4.563 68 HA ASP 7 HA ASP 7 7.379 -9.136 3.222 69 HB2 ASP 7 1HB ASP 7 7.870 -8.123 6.022 70 HB3 ASP 7 2HB ASP 7 6.241 -8.562 5.541 71 H ILE 8 H ILE 8 6.572 -7.905 1.594 72 HA ILE 8 HA ILE 8 5.820 -5.230 1.683 73 HB ILE 8 HB ILE 8 4.498 -5.544 -0.255 74 HG12 ILE 8 1HG1 ILE 8 4.573 -8.552 0.246 75 HG13 ILE 8 2HG1 ILE 8 3.157 -7.515 0.426 76 HG21 ILE 8 1HG2 ILE 8 7.066 -5.866 -0.263 77 HG22 ILE 8 2HG2 ILE 8 6.738 -7.581 -0.534 78 HG23 ILE 8 3HG2 ILE 8 6.172 -6.371 -1.704 79 HD11 ILE 8 3HD1 ILE 8 4.588 -8.116 -2.184 80 HD12 ILE 8 1HD1 ILE 8 2.980 -8.653 -1.677 81 HD13 ILE 8 2HD1 ILE 8 3.270 -6.932 -1.995 82 H THR 9 H THR 9 4.153 -7.893 3.122 83 HA THR 9 HA THR 9 1.535 -6.928 3.469 84 HB THR 9 HB THR 9 1.620 -8.416 5.577 85 HG1 THR 9 HG1 THR 9 3.776 -8.508 6.009 86 HG21 THR 9 3HG2 THR 9 0.766 -9.218 3.411 87 HG22 THR 9 1HG2 THR 9 1.677 -10.480 4.256 88 HG23 THR 9 2HG2 THR 9 2.421 -9.617 2.892 89 H ASN 10 H ASN 10 4.455 -5.818 5.089 90 HA ASN 10 HA ASN 10 3.111 -4.588 7.352 91 HB2 ASN 10 1HB ASN 10 5.502 -5.084 7.437 92 HB3 ASN 10 2HB ASN 10 5.810 -4.070 6.027 93 HD21 ASN 10 2HD2 ASN 10 4.179 -3.717 9.278 94 HD22 ASN 10 1HD2 ASN 10 4.900 -2.137 9.546 95 H TRP 11 H TRP 11 4.332 -3.233 4.259 96 HA TRP 11 HA TRP 11 2.813 -0.734 4.705 97 HB2 TRP 11 1HB TRP 11 4.159 0.100 2.787 98 HB3 TRP 11 2HB TRP 11 5.045 -0.350 4.225 99 HD1 TRP 11 HD1 TRP 11 6.825 -2.186 4.069 100 HE1 TRP 11 HE1 TRP 11 7.993 -3.396 2.107 101 HE3 TRP 11 HE3 TRP 11 3.549 -0.999 0.350 102 HZ2 TRP 11 HZ2 TRP 11 7.586 -3.700 -0.741 103 HZ3 TRP 11 HZ3 TRP 11 3.937 -1.794 -1.994 104 HH2 TRP 11 HH2 TRP 11 5.941 -3.139 -2.536 105 H LEU 12 H LEU 12 2.064 -3.611 3.254 106 HA LEU 12 HA LEU 12 0.694 -2.979 0.917 107 HB2 LEU 12 1HB LEU 12 0.516 -5.070 3.014 108 HB3 LEU 12 2HB LEU 12 -1.018 -4.788 2.244 109 HG LEU 12 HG LEU 12 1.525 -5.639 0.833 110 HD11 LEU 12 1HD1 LEU 12 -0.431 -7.145 2.227 111 HD12 LEU 12 2HD1 LEU 12 0.804 -7.739 1.106 112 HD13 LEU 12 3HD1 LEU 12 -0.817 -7.358 0.518 113 HD21 LEU 12 3HD2 LEU 12 0.316 -4.248 -0.744 114 HD22 LEU 12 1HD2 LEU 12 -1.238 -4.958 -0.264 115 HD23 LEU 12 2HD2 LEU 12 -0.035 -5.919 -1.159 116 H TRP 13 H TRP 13 -0.224 -2.157 4.170 117 HA TRP 13 HA TRP 13 -3.021 -1.646 3.716 118 HB2 TRP 13 1HB TRP 13 -1.948 -1.839 5.959 119 HB3 TRP 13 2HB TRP 13 -1.176 -0.282 5.709 120 HD1 TRP 13 HD1 TRP 13 -4.728 -1.795 5.936 121 HE1 TRP 13 HE1 TRP 13 -6.394 0.035 6.659 122 HE3 TRP 13 HE3 TRP 13 -1.552 2.214 5.980 123 HZ2 TRP 13 HZ2 TRP 13 -6.351 2.876 7.156 124 HZ3 TRP 13 HZ3 TRP 13 -2.394 4.485 6.553 125 HH2 TRP 13 HH2 TRP 13 -4.775 4.828 7.130 126 H TYR 14 H TYR 14 -0.178 0.532 3.511 127 HA TYR 14 HA TYR 14 -1.634 2.863 2.678 128 HB2 TYR 14 1HB TYR 14 1.224 2.181 1.940 129 HB3 TYR 14 2HB TYR 14 0.493 3.773 2.054 130 HD1 TYR 14 HD1 TYR 14 -0.280 4.602 4.404 131 HD2 TYR 14 HD2 TYR 14 2.266 1.198 3.783 132 HE1 TYR 14 HE1 TYR 14 0.435 4.698 6.791 133 HE2 TYR 14 HE2 TYR 14 2.964 1.250 6.175 134 HH TYR 14 HH TYR 14 1.741 3.774 8.426 135 H ILE 15 H ILE 15 -0.449 0.042 0.943 136 HA ILE 15 HA ILE 15 -0.869 1.135 -1.729 137 HB ILE 15 HB ILE 15 -0.747 -1.807 -0.986 138 HG12 ILE 15 1HG1 ILE 15 1.261 -0.848 -0.132 139 HG13 ILE 15 2HG1 ILE 15 1.636 -1.712 -1.602 140 HG21 ILE 15 1HG2 ILE 15 0.197 -1.855 -3.416 141 HG22 ILE 15 2HG2 ILE 15 -1.546 -1.706 -3.176 142 HG23 ILE 15 3HG2 ILE 15 -0.586 -0.271 -3.588 143 HD11 ILE 15 3HD1 ILE 15 1.750 0.471 -2.836 144 HD12 ILE 15 1HD1 ILE 15 1.406 1.324 -1.307 145 HD13 ILE 15 2HD1 ILE 15 2.890 0.394 -1.478 146 H LYS 16 H LYS 16 -2.866 -1.048 0.339 147 HA LYS 16 HA LYS 16 -5.122 -0.948 -1.508 148 HB2 LYS 16 1HB LYS 16 -4.733 -1.919 1.318 149 HB3 LYS 16 2HB LYS 16 -6.375 -1.648 0.732 150 HG2 LYS 16 1HG LYS 16 -6.372 -3.485 -0.545 151 HG3 LYS 16 2HG LYS 16 -4.878 -3.025 -1.347 152 HD2 LYS 16 1HD LYS 16 -3.634 -3.969 0.690 153 HD3 LYS 16 2HD LYS 16 -5.199 -4.693 1.151 154 HE2 LYS 16 1HE LYS 16 -5.269 -5.547 -1.323 155 HE3 LYS 16 2HE LYS 16 -3.563 -5.105 -1.396 156 HZ1 LYS 16 3HZ LYS 16 -4.790 -7.108 0.424 157 HZ2 LYS 16 1HZ LYS 16 -3.225 -6.647 0.528 158 HZ3 LYS 16 2HZ LYS 16 -3.772 -7.416 -0.808 159 H LEU 17 H LEU 17 -4.307 1.066 1.304 160 HA LEU 17 HA LEU 17 -6.651 2.699 1.133 161 HB2 LEU 17 1HB LEU 17 -5.270 2.655 3.123 162 HB3 LEU 17 2HB LEU 17 -3.903 3.348 2.259 163 HG LEU 17 HG LEU 17 -6.386 4.968 2.002 164 HD11 LEU 17 1HD1 LEU 17 -6.716 4.117 4.304 165 HD12 LEU 17 2HD1 LEU 17 -6.489 5.872 4.185 166 HD13 LEU 17 3HD1 LEU 17 -5.147 4.850 4.726 167 HD21 LEU 17 3HD2 LEU 17 -3.636 5.688 3.092 168 HD22 LEU 17 1HD2 LEU 17 -4.887 6.809 2.512 169 HD23 LEU 17 2HD2 LEU 17 -4.068 5.736 1.365 170 H PHE 18 H PHE 18 -3.558 2.906 -0.690 171 HA PHE 18 HA PHE 18 -3.883 5.417 -1.812 172 HB2 PHE 18 1HB PHE 18 -1.905 4.166 -2.246 173 HB3 PHE 18 2HB PHE 18 -2.803 2.918 -3.099 174 HD1 PHE 18 HD1 PHE 18 -2.933 6.702 -3.448 175 HD2 PHE 18 HD2 PHE 18 -2.171 2.879 -5.316 176 HE1 PHE 18 HE1 PHE 18 -2.538 7.832 -5.596 177 HE2 PHE 18 HE2 PHE 18 -1.848 4.021 -7.492 178 HZ PHE 18 HZ PHE 18 -2.034 6.508 -7.622 179 H ILE 19 H ILE 19 -5.638 2.463 -2.832 180 HA ILE 19 HA ILE 19 -7.028 3.794 -5.006 181 HB ILE 19 HB ILE 19 -7.730 1.264 -3.478 182 HG12 ILE 19 1HG1 ILE 19 -7.025 0.167 -5.717 183 HG13 ILE 19 2HG1 ILE 19 -6.200 1.678 -6.081 184 HG21 ILE 19 1HG2 ILE 19 -9.759 1.939 -4.442 185 HG22 ILE 19 2HG2 ILE 19 -8.976 2.572 -5.894 186 HG23 ILE 19 3HG2 ILE 19 -9.120 0.814 -5.634 187 HD11 ILE 19 3HD1 ILE 19 -5.643 0.031 -3.590 188 HD12 ILE 19 1HD1 ILE 19 -4.803 -0.210 -5.132 189 HD13 ILE 19 2HD1 ILE 19 -4.644 1.334 -4.297 190 H MET 20 H MET 20 -7.628 3.516 -1.555 191 HA MET 20 HA MET 20 -10.429 4.334 -1.609 192 HB2 MET 20 1HB MET 20 -8.406 4.211 0.662 193 HB3 MET 20 2HB MET 20 -10.118 4.538 0.861 194 HG2 MET 20 1HG MET 20 -9.235 2.020 -0.581 195 HG3 MET 20 2HG MET 20 -9.178 2.094 1.171 196 HE1 MET 20 3HE MET 20 -11.109 3.038 2.575 197 HE2 MET 20 1HE MET 20 -12.717 2.295 2.404 198 HE3 MET 20 2HE MET 20 -11.282 1.273 2.634 199 H ILE 21 H ILE 21 -7.361 6.031 -0.820 200 HA ILE 21 HA ILE 21 -8.562 8.589 -0.302 201 HB ILE 21 HB ILE 21 -6.376 8.037 0.533 202 HG12 ILE 21 1HG1 ILE 21 -6.185 10.408 -1.381 203 HG13 ILE 21 2HG1 ILE 21 -7.050 10.420 0.161 204 HG21 ILE 21 1HG2 ILE 21 -5.223 8.294 -2.276 205 HG22 ILE 21 2HG2 ILE 21 -4.375 7.857 -0.777 206 HG23 ILE 21 3HG2 ILE 21 -5.552 6.759 -1.457 207 HD11 ILE 21 3HD1 ILE 21 -4.881 11.445 0.459 208 HD12 ILE 21 1HD1 ILE 21 -4.898 9.899 1.337 209 HD13 ILE 21 2HD1 ILE 21 -4.049 10.043 -0.223 210 H VAL 22 H VAL 22 -7.189 7.262 -3.330 211 HA VAL 22 HA VAL 22 -7.735 9.625 -4.911 212 HB VAL 22 HB VAL 22 -7.337 8.204 -6.856 213 HG11 VAL 22 1HG1 VAL 22 -5.429 9.133 -5.718 214 HG12 VAL 22 2HG1 VAL 22 -5.330 7.682 -4.680 215 HG13 VAL 22 3HG1 VAL 22 -5.069 7.538 -6.423 216 HG21 VAL 22 3HG2 VAL 22 -6.598 5.800 -6.453 217 HG22 VAL 22 1HG2 VAL 22 -7.481 5.936 -4.938 218 HG23 VAL 22 2HG2 VAL 22 -8.344 6.154 -6.447 219 H GLY 23 H GLY 23 -9.662 6.737 -4.220 220 HA2 GLY 23 1HA GLY 23 -11.697 5.987 -4.841 221 HA3 GLY 23 2HA GLY 23 -12.237 7.675 -4.880 222 H GLY 24 H GLY 24 -12.229 8.766 -6.876 223 HA2 GLY 24 1HA GLY 24 -12.679 7.140 -9.267 224 HA3 GLY 24 2HA GLY 24 -12.796 8.893 -9.147 225 H LEU 25 H LEU 25 -9.928 9.038 -8.062 226 HA LEU 25 HA LEU 25 -8.675 9.216 -10.703 227 HB2 LEU 25 1HB LEU 25 -7.017 9.689 -8.265 228 HB3 LEU 25 2HB LEU 25 -6.987 10.453 -9.820 229 HG LEU 25 HG LEU 25 -9.031 10.944 -7.627 230 HD11 LEU 25 1HD1 LEU 25 -6.797 11.810 -7.150 231 HD12 LEU 25 2HD1 LEU 25 -7.961 13.115 -7.424 232 HD13 LEU 25 3HD1 LEU 25 -6.797 12.688 -8.700 233 HD21 LEU 25 3HD2 LEU 25 -10.143 11.334 -9.764 234 HD22 LEU 25 1HD2 LEU 25 -8.733 12.222 -10.382 235 HD23 LEU 25 2HD2 LEU 25 -9.719 12.900 -9.065 236 H VAL 26 H VAL 26 -9.081 6.558 -8.865 237 HA VAL 26 HA VAL 26 -6.644 5.240 -8.562 238 HB VAL 26 HB VAL 26 -8.835 4.445 -7.727 239 HG11 VAL 26 1HG1 VAL 26 -10.178 4.702 -9.835 240 HG12 VAL 26 2HG1 VAL 26 -9.349 3.256 -10.471 241 HG13 VAL 26 3HG1 VAL 26 -10.355 3.147 -9.018 242 HG21 VAL 26 3HG2 VAL 26 -8.396 2.053 -7.968 243 HG22 VAL 26 1HG2 VAL 26 -7.284 2.361 -9.302 244 HG23 VAL 26 2HG2 VAL 26 -6.909 2.986 -7.681 245 H LYS 27 H LYS 27 -8.476 5.548 -11.517 246 HA LYS 27 HA LYS 27 -6.996 3.697 -13.157 247 HB2 LYS 27 1HB LYS 27 -8.801 6.063 -13.751 248 HB3 LYS 27 2HB LYS 27 -8.049 5.086 -15.029 249 HG2 LYS 27 1HG LYS 27 -9.128 3.062 -14.254 250 HG3 LYS 27 2HG LYS 27 -9.727 3.866 -12.806 251 HD2 LYS 27 1HD LYS 27 -11.541 3.608 -14.278 252 HD3 LYS 27 2HD LYS 27 -11.180 5.327 -14.200 253 HE2 LYS 27 1HE LYS 27 -10.106 3.539 -16.429 254 HE3 LYS 27 2HE LYS 27 -11.747 4.182 -16.490 255 HZ1 LYS 27 3HZ LYS 27 -10.860 6.423 -16.417 256 HZ2 LYS 27 1HZ LYS 27 -10.204 5.619 -17.673 257 HZ3 LYS 27 2HZ LYS 27 -9.318 5.881 -16.332 258 H LYS 28 H LYS 28 -6.101 6.798 -12.033 259 HA LYS 28 HA LYS 28 -4.704 8.488 -12.703 260 HB2 LYS 28 1HB LYS 28 -2.905 6.071 -13.036 261 HB3 LYS 28 2HB LYS 28 -2.355 7.755 -13.043 262 HG2 LYS 28 1HG LYS 28 -3.566 8.034 -10.796 263 HG3 LYS 28 2HG LYS 28 -3.668 6.270 -10.733 264 HD2 LYS 28 1HD LYS 28 -1.072 7.833 -11.109 265 HD3 LYS 28 2HD LYS 28 -1.719 7.381 -9.541 266 HE2 LYS 28 1HE LYS 28 -1.739 4.941 -10.397 267 HE3 LYS 28 2HE LYS 28 -0.779 5.521 -11.763 268 HZ1 LYS 28 3HZ LYS 28 0.890 6.305 -10.131 269 HZ2 LYS 28 1HZ LYS 28 0.660 4.694 -10.009 270 HZ3 LYS 28 2HZ LYS 28 0.011 5.692 -8.898 Start of MODEL 6 1 H1 LYS 1 1H LYS 1 15.966 -6.406 13.203 2 H2 LYS 1 2H LYS 1 14.984 -5.081 13.270 3 H3 LYS 1 3H LYS 1 14.911 -6.236 14.418 4 HA LYS 1 HA LYS 1 14.124 -7.879 12.828 5 HB2 LYS 1 1HB LYS 1 12.382 -5.386 13.049 6 HB3 LYS 1 2HB LYS 1 11.821 -7.000 12.593 7 HG2 LYS 1 1HG LYS 1 12.527 -7.907 14.784 8 HG3 LYS 1 2HG LYS 1 13.125 -6.318 15.255 9 HD2 LYS 1 1HD LYS 1 11.114 -6.519 16.350 10 HD3 LYS 1 2HD LYS 1 10.761 -5.418 15.033 11 HE2 LYS 1 1HE LYS 1 10.254 -8.383 14.635 12 HE3 LYS 1 2HE LYS 1 9.215 -7.521 15.764 13 HZ1 LYS 1 3HZ LYS 1 9.553 -6.745 12.918 14 HZ2 LYS 1 1HZ LYS 1 8.612 -5.973 14.009 15 HZ3 LYS 1 2HZ LYS 1 8.254 -7.495 13.561 16 H LYS 2 H LYS 2 16.027 -5.988 11.170 17 HA LYS 2 HA LYS 2 14.817 -5.072 8.822 18 HB2 LYS 2 1HB LYS 2 17.600 -6.094 9.480 19 HB3 LYS 2 2HB LYS 2 17.218 -5.478 7.884 20 HG2 LYS 2 1HG LYS 2 16.623 -3.799 10.349 21 HG3 LYS 2 2HG LYS 2 18.243 -3.887 9.688 22 HD2 LYS 2 1HD LYS 2 16.429 -3.355 7.476 23 HD3 LYS 2 2HD LYS 2 16.011 -2.286 8.805 24 HE2 LYS 2 1HE LYS 2 17.622 -1.166 7.408 25 HE3 LYS 2 2HE LYS 2 18.361 -1.519 8.969 26 HZ1 LYS 2 3HZ LYS 2 19.968 -2.605 7.865 27 HZ2 LYS 2 1HZ LYS 2 19.262 -2.308 6.429 28 HZ3 LYS 2 2HZ LYS 2 18.905 -3.675 7.241 29 H LYS 3 H LYS 3 15.676 -8.403 9.522 30 HA LYS 3 HA LYS 3 15.575 -9.555 6.913 31 HB2 LYS 3 1HB LYS 3 14.625 -10.685 9.576 32 HB3 LYS 3 2HB LYS 3 14.829 -11.639 8.119 33 HG2 LYS 3 1HG LYS 3 17.268 -10.090 8.887 34 HG3 LYS 3 2HG LYS 3 16.713 -11.244 10.097 35 HD2 LYS 3 1HD LYS 3 16.672 -13.022 8.299 36 HD3 LYS 3 2HD LYS 3 17.482 -11.883 7.212 37 HE2 LYS 3 1HE LYS 3 18.551 -12.492 9.996 38 HE3 LYS 3 2HE LYS 3 18.870 -13.613 8.676 39 HZ1 LYS 3 3HZ LYS 3 20.155 -12.033 7.562 40 HZ2 LYS 3 1HZ LYS 3 20.582 -11.789 9.114 41 HZ3 LYS 3 2HZ LYS 3 19.555 -10.751 8.383 42 H ASN 4 H ASN 4 12.928 -8.469 8.948 43 HA ASN 4 HA ASN 4 10.848 -9.555 7.133 44 HB2 ASN 4 1HB ASN 4 10.718 -8.140 9.828 45 HB3 ASN 4 2HB ASN 4 9.311 -8.676 8.913 46 HD21 ASN 4 2HD2 ASN 4 11.239 -9.637 11.456 47 HD22 ASN 4 1HD2 ASN 4 10.955 -11.364 11.277 48 H TRP 5 H TRP 5 12.765 -6.887 6.819 49 HA TRP 5 HA TRP 5 10.782 -4.824 6.379 50 HB2 TRP 5 1HB TRP 5 13.234 -4.506 6.905 51 HB3 TRP 5 2HB TRP 5 13.594 -4.974 5.243 52 HD1 TRP 5 HD1 TRP 5 13.703 -3.005 3.603 53 HE1 TRP 5 HE1 TRP 5 12.910 -0.551 3.563 54 HE3 TRP 5 HE3 TRP 5 11.087 -2.917 8.008 55 HZ2 TRP 5 HZ2 TRP 5 11.324 1.202 5.210 56 HZ3 TRP 5 HZ3 TRP 5 9.930 -0.840 8.743 57 HH2 TRP 5 HH2 TRP 5 10.040 1.217 7.357 58 H PHE 6 H PHE 6 12.267 -7.240 4.220 59 HA PHE 6 HA PHE 6 11.180 -6.187 1.782 60 HB2 PHE 6 1HB PHE 6 12.990 -8.187 2.530 61 HB3 PHE 6 2HB PHE 6 11.668 -9.099 1.847 62 HD1 PHE 6 HD1 PHE 6 10.813 -7.164 -0.422 63 HD2 PHE 6 HD2 PHE 6 14.682 -8.459 0.989 64 HE1 PHE 6 HE1 PHE 6 11.752 -6.802 -2.673 65 HE2 PHE 6 HE2 PHE 6 15.621 -8.098 -1.288 66 HZ PHE 6 HZ PHE 6 14.154 -7.270 -3.121 67 H ASP 7 H ASP 7 9.587 -7.862 4.346 68 HA ASP 7 HA ASP 7 7.536 -9.221 2.801 69 HB2 ASP 7 1HB ASP 7 7.752 -8.396 5.706 70 HB3 ASP 7 2HB ASP 7 6.255 -9.008 5.034 71 H ILE 8 H ILE 8 6.585 -7.993 1.307 72 HA ILE 8 HA ILE 8 5.910 -5.311 1.451 73 HB ILE 8 HB ILE 8 4.490 -5.591 -0.435 74 HG12 ILE 8 1HG1 ILE 8 4.544 -8.601 0.062 75 HG13 ILE 8 2HG1 ILE 8 3.150 -7.547 0.302 76 HG21 ILE 8 1HG2 ILE 8 6.091 -6.469 -1.953 77 HG22 ILE 8 2HG2 ILE 8 7.043 -5.932 -0.563 78 HG23 ILE 8 3HG2 ILE 8 6.703 -7.654 -0.781 79 HD11 ILE 8 3HD1 ILE 8 3.177 -6.962 -2.126 80 HD12 ILE 8 1HD1 ILE 8 4.470 -8.166 -2.363 81 HD13 ILE 8 2HD1 ILE 8 2.875 -8.680 -1.795 82 H THR 9 H THR 9 4.232 -7.898 3.029 83 HA THR 9 HA THR 9 1.662 -6.817 3.432 84 HB THR 9 HB THR 9 1.599 -8.295 5.439 85 HG1 THR 9 HG1 THR 9 3.626 -8.406 6.187 86 HG21 THR 9 3HG2 THR 9 1.781 -10.394 4.239 87 HG22 THR 9 1HG2 THR 9 2.773 -9.648 2.972 88 HG23 THR 9 2HG2 THR 9 1.068 -9.178 3.169 89 H ASN 10 H ASN 10 4.668 -5.784 4.895 90 HA ASN 10 HA ASN 10 3.463 -4.458 7.196 91 HB2 ASN 10 1HB ASN 10 6.162 -4.641 5.955 92 HB3 ASN 10 2HB ASN 10 5.798 -3.041 6.577 93 HD21 ASN 10 2HD2 ASN 10 5.446 -6.488 7.634 94 HD22 ASN 10 1HD2 ASN 10 5.890 -6.110 9.297 95 H TRP 11 H TRP 11 4.491 -3.256 3.983 96 HA TRP 11 HA TRP 11 3.034 -0.720 4.429 97 HB2 TRP 11 1HB TRP 11 4.300 0.062 2.442 98 HB3 TRP 11 2HB TRP 11 5.235 -0.345 3.860 99 HD1 TRP 11 HD1 TRP 11 7.023 -2.177 3.697 100 HE1 TRP 11 HE1 TRP 11 8.136 -3.424 1.728 101 HE3 TRP 11 HE3 TRP 11 3.637 -1.074 0.052 102 HZ2 TRP 11 HZ2 TRP 11 7.658 -3.773 -1.104 103 HZ3 TRP 11 HZ3 TRP 11 3.972 -1.890 -2.290 104 HH2 TRP 11 HH2 TRP 11 5.972 -3.232 -2.869 105 H LEU 12 H LEU 12 2.178 -3.627 3.049 106 HA LEU 12 HA LEU 12 0.705 -2.948 0.770 107 HB2 LEU 12 1HB LEU 12 0.488 -5.047 2.891 108 HB3 LEU 12 2HB LEU 12 -0.997 -4.734 2.037 109 HG LEU 12 HG LEU 12 1.584 -5.694 0.767 110 HD11 LEU 12 1HD1 LEU 12 -1.186 -6.959 0.912 111 HD12 LEU 12 2HD1 LEU 12 0.103 -7.323 2.060 112 HD13 LEU 12 3HD1 LEU 12 0.325 -7.708 0.348 113 HD21 LEU 12 3HD2 LEU 12 0.544 -4.269 -0.903 114 HD22 LEU 12 1HD2 LEU 12 -1.072 -4.892 -0.500 115 HD23 LEU 12 2HD2 LEU 12 0.128 -5.932 -1.301 116 H TRP 13 H TRP 13 -0.034 -2.093 4.056 117 HA TRP 13 HA TRP 13 -2.844 -1.547 3.728 118 HB2 TRP 13 1HB TRP 13 -1.676 -1.718 5.920 119 HB3 TRP 13 2HB TRP 13 -0.892 -0.176 5.610 120 HD1 TRP 13 HD1 TRP 13 -4.443 -1.639 6.036 121 HE1 TRP 13 HE1 TRP 13 -6.052 0.220 6.811 122 HE3 TRP 13 HE3 TRP 13 -1.226 2.334 5.868 123 HZ2 TRP 13 HZ2 TRP 13 -5.959 3.068 7.248 124 HZ3 TRP 13 HZ3 TRP 13 -2.019 4.624 6.437 125 HH2 TRP 13 HH2 TRP 13 -4.370 5.005 7.107 126 H TYR 14 H TYR 14 0.010 0.590 3.361 127 HA TYR 14 HA TYR 14 -1.449 2.920 2.531 128 HB2 TYR 14 1HB TYR 14 1.376 2.194 1.709 129 HB3 TYR 14 2HB TYR 14 0.665 3.795 1.826 130 HD1 TYR 14 HD1 TYR 14 -0.025 4.656 4.193 131 HD2 TYR 14 HD2 TYR 14 2.481 1.227 3.525 132 HE1 TYR 14 HE1 TYR 14 0.774 4.779 6.551 133 HE2 TYR 14 HE2 TYR 14 3.270 1.316 5.889 134 HH TYR 14 HH TYR 14 2.119 3.859 8.155 135 H ILE 15 H ILE 15 -0.351 0.049 0.814 136 HA ILE 15 HA ILE 15 -0.856 1.101 -1.862 137 HB ILE 15 HB ILE 15 -0.726 -1.828 -1.087 138 HG12 ILE 15 1HG1 ILE 15 1.334 -0.877 -0.331 139 HG13 ILE 15 2HG1 ILE 15 1.636 -1.753 -1.812 140 HG21 ILE 15 1HG2 ILE 15 -0.015 -2.060 -3.491 141 HG22 ILE 15 2HG2 ILE 15 -1.682 -1.516 -3.285 142 HG23 ILE 15 3HG2 ILE 15 -0.429 -0.347 -3.732 143 HD11 ILE 15 3HD1 ILE 15 1.724 0.417 -3.064 144 HD12 ILE 15 1HD1 ILE 15 1.442 1.286 -1.533 145 HD13 ILE 15 2HD1 ILE 15 2.913 0.341 -1.753 146 H LYS 16 H LYS 16 -2.798 -1.057 0.305 147 HA LYS 16 HA LYS 16 -5.119 -1.036 -1.452 148 HB2 LYS 16 1HB LYS 16 -4.768 -1.633 1.512 149 HB3 LYS 16 2HB LYS 16 -6.364 -1.426 0.815 150 HG2 LYS 16 1HG LYS 16 -6.258 -3.635 0.586 151 HG3 LYS 16 2HG LYS 16 -5.573 -3.207 -0.976 152 HD2 LYS 16 1HD LYS 16 -3.305 -3.709 -0.153 153 HD3 LYS 16 2HD LYS 16 -3.915 -3.842 1.504 154 HE2 LYS 16 1HE LYS 16 -3.736 -6.078 0.910 155 HE3 LYS 16 2HE LYS 16 -5.445 -5.730 0.667 156 HZ1 LYS 16 3HZ LYS 16 -4.578 -6.958 -1.204 157 HZ2 LYS 16 1HZ LYS 16 -3.380 -5.887 -1.468 158 HZ3 LYS 16 2HZ LYS 16 -4.938 -5.462 -1.739 159 H LEU 17 H LEU 17 -4.215 1.089 1.273 160 HA LEU 17 HA LEU 17 -6.493 2.788 1.100 161 HB2 LEU 17 1HB LEU 17 -5.062 2.718 3.053 162 HB3 LEU 17 2HB LEU 17 -3.710 3.397 2.155 163 HG LEU 17 HG LEU 17 -6.175 5.046 1.961 164 HD11 LEU 17 1HD1 LEU 17 -6.195 5.940 4.174 165 HD12 LEU 17 2HD1 LEU 17 -4.894 4.838 4.666 166 HD13 LEU 17 3HD1 LEU 17 -6.503 4.195 4.250 167 HD21 LEU 17 3HD2 LEU 17 -4.641 6.865 2.490 168 HD22 LEU 17 1HD2 LEU 17 -3.885 5.812 1.282 169 HD23 LEU 17 2HD2 LEU 17 -3.387 5.710 2.990 170 H PHE 18 H PHE 18 -3.458 2.919 -0.818 171 HA PHE 18 HA PHE 18 -3.774 5.425 -1.963 172 HB2 PHE 18 1HB PHE 18 -1.846 4.127 -2.464 173 HB3 PHE 18 2HB PHE 18 -2.798 2.871 -3.238 174 HD1 PHE 18 HD1 PHE 18 -2.934 6.642 -3.735 175 HD2 PHE 18 HD2 PHE 18 -2.152 2.753 -5.448 176 HE1 PHE 18 HE1 PHE 18 -2.528 7.689 -5.927 177 HE2 PHE 18 HE2 PHE 18 -1.795 3.813 -7.665 178 HZ PHE 18 HZ PHE 18 -1.960 6.269 -7.903 179 H ILE 19 H ILE 19 -5.637 2.497 -2.841 180 HA ILE 19 HA ILE 19 -7.117 3.825 -4.963 181 HB ILE 19 HB ILE 19 -7.749 1.305 -3.389 182 HG12 ILE 19 1HG1 ILE 19 -7.166 0.218 -5.681 183 HG13 ILE 19 2HG1 ILE 19 -6.343 1.726 -6.059 184 HG21 ILE 19 1HG2 ILE 19 -9.260 0.844 -5.441 185 HG22 ILE 19 2HG2 ILE 19 -9.823 2.012 -4.255 186 HG23 ILE 19 3HG2 ILE 19 -9.103 2.592 -5.762 187 HD11 ILE 19 3HD1 ILE 19 -4.722 1.335 -4.317 188 HD12 ILE 19 1HD1 ILE 19 -5.697 0.003 -3.633 189 HD13 ILE 19 2HD1 ILE 19 -4.909 -0.169 -5.212 190 H MET 20 H MET 20 -7.554 3.551 -1.482 191 HA MET 20 HA MET 20 -10.340 4.407 -1.396 192 HB2 MET 20 1HB MET 20 -8.196 4.288 0.761 193 HB3 MET 20 2HB MET 20 -9.883 4.670 1.053 194 HG2 MET 20 1HG MET 20 -9.098 2.093 -0.352 195 HG3 MET 20 2HG MET 20 -9.052 2.220 1.398 196 HE1 MET 20 3HE MET 20 -11.127 3.445 2.676 197 HE2 MET 20 1HE MET 20 -12.627 2.493 2.585 198 HE3 MET 20 2HE MET 20 -11.079 1.687 2.921 199 H ILE 21 H ILE 21 -7.222 6.089 -0.783 200 HA ILE 21 HA ILE 21 -8.395 8.652 -0.228 201 HB ILE 21 HB ILE 21 -6.176 8.066 0.523 202 HG12 ILE 21 1HG1 ILE 21 -6.088 10.483 -1.337 203 HG13 ILE 21 2HG1 ILE 21 -6.874 10.446 0.245 204 HG21 ILE 21 1HG2 ILE 21 -5.425 6.832 -1.530 205 HG22 ILE 21 2HG2 ILE 21 -5.135 8.389 -2.324 206 HG23 ILE 21 3HG2 ILE 21 -4.229 7.922 -0.868 207 HD11 ILE 21 3HD1 ILE 21 -4.658 9.917 1.296 208 HD12 ILE 21 1HD1 ILE 21 -3.894 10.118 -0.301 209 HD13 ILE 21 2HD1 ILE 21 -4.706 11.488 0.466 210 H VAL 22 H VAL 22 -7.170 7.292 -3.304 211 HA VAL 22 HA VAL 22 -7.743 9.660 -4.871 212 HB VAL 22 HB VAL 22 -7.473 8.227 -6.829 213 HG11 VAL 22 1HG1 VAL 22 -5.363 7.699 -4.748 214 HG12 VAL 22 2HG1 VAL 22 -5.188 7.505 -6.496 215 HG13 VAL 22 3HG1 VAL 22 -5.486 9.124 -5.815 216 HG21 VAL 22 3HG2 VAL 22 -7.535 5.963 -4.896 217 HG22 VAL 22 1HG2 VAL 22 -8.489 6.188 -6.350 218 HG23 VAL 22 2HG2 VAL 22 -6.754 5.812 -6.465 219 H GLY 23 H GLY 23 -9.690 6.825 -4.057 220 HA2 GLY 23 1HA GLY 23 -11.735 6.066 -4.632 221 HA3 GLY 23 2HA GLY 23 -12.280 7.750 -4.659 222 H GLY 24 H GLY 24 -12.343 8.834 -6.650 223 HA2 GLY 24 1HA GLY 24 -12.879 7.215 -9.019 224 HA3 GLY 24 2HA GLY 24 -12.961 8.970 -8.903 225 H LEU 25 H LEU 25 -10.050 9.086 -7.942 226 HA LEU 25 HA LEU 25 -8.910 9.231 -10.635 227 HB2 LEU 25 1HB LEU 25 -7.145 9.694 -8.270 228 HB3 LEU 25 2HB LEU 25 -7.162 10.447 -9.833 229 HG LEU 25 HG LEU 25 -9.131 10.979 -7.580 230 HD11 LEU 25 1HD1 LEU 25 -6.869 11.809 -7.157 231 HD12 LEU 25 2HD1 LEU 25 -8.014 13.136 -7.414 232 HD13 LEU 25 3HD1 LEU 25 -6.886 12.676 -8.712 233 HD21 LEU 25 3HD2 LEU 25 -8.847 12.345 -10.297 234 HD22 LEU 25 1HD2 LEU 25 -9.888 12.897 -8.964 235 HD23 LEU 25 2HD2 LEU 25 -10.229 11.361 -9.768 236 H VAL 26 H VAL 26 -9.252 6.599 -8.742 237 HA VAL 26 HA VAL 26 -6.841 5.212 -8.581 238 HB VAL 26 HB VAL 26 -9.018 4.483 -7.646 239 HG11 VAL 26 1HG1 VAL 26 -9.688 3.364 -10.390 240 HG12 VAL 26 2HG1 VAL 26 -10.619 3.208 -8.891 241 HG13 VAL 26 3HG1 VAL 26 -10.462 4.791 -9.656 242 HG21 VAL 26 3HG2 VAL 26 -8.658 2.091 -7.872 243 HG22 VAL 26 1HG2 VAL 26 -7.643 2.335 -9.294 244 HG23 VAL 26 2HG2 VAL 26 -7.116 2.965 -7.716 245 H LYS 27 H LYS 27 -8.746 5.721 -11.426 246 HA LYS 27 HA LYS 27 -7.629 3.789 -13.177 247 HB2 LYS 27 1HB LYS 27 -9.451 6.043 -13.347 248 HB3 LYS 27 2HB LYS 27 -8.301 6.156 -14.677 249 HG2 LYS 27 1HG LYS 27 -8.785 3.752 -15.245 250 HG3 LYS 27 2HG LYS 27 -10.024 3.739 -13.972 251 HD2 LYS 27 1HD LYS 27 -11.253 5.547 -15.129 252 HD3 LYS 27 2HD LYS 27 -9.979 5.631 -16.368 253 HE2 LYS 27 1HE LYS 27 -10.427 3.227 -16.933 254 HE3 LYS 27 2HE LYS 27 -11.768 3.229 -15.780 255 HZ1 LYS 27 3HZ LYS 27 -11.573 4.979 -18.177 256 HZ2 LYS 27 1HZ LYS 27 -12.818 4.982 -17.118 257 HZ3 LYS 27 2HZ LYS 27 -12.536 3.669 -18.046 258 H LYS 28 H LYS 28 -6.130 6.665 -12.050 259 HA LYS 28 HA LYS 28 -4.249 7.877 -12.690 260 HB2 LYS 28 1HB LYS 28 -3.568 5.000 -12.229 261 HB3 LYS 28 2HB LYS 28 -2.265 6.008 -12.826 262 HG2 LYS 28 1HG LYS 28 -3.901 7.104 -10.544 263 HG3 LYS 28 2HG LYS 28 -2.794 5.771 -10.209 264 HD2 LYS 28 1HD LYS 28 -0.887 6.956 -10.814 265 HD3 LYS 28 2HD LYS 28 -1.767 8.144 -11.787 266 HE2 LYS 28 1HE LYS 28 -2.525 9.355 -9.946 267 HE3 LYS 28 2HE LYS 28 -2.298 8.021 -8.818 268 HZ1 LYS 28 3HZ LYS 28 -0.568 9.743 -8.594 269 HZ2 LYS 28 1HZ LYS 28 -0.064 9.486 -10.124 270 HZ3 LYS 28 2HZ LYS 28 0.097 8.311 -9.002 Start of MODEL 7 1 H1 LYS 1 1H LYS 1 15.049 -6.405 12.507 2 H2 LYS 1 2H LYS 1 13.780 -5.955 13.427 3 H3 LYS 1 3H LYS 1 13.551 -6.989 12.186 4 HA LYS 1 HA LYS 1 12.737 -4.801 11.595 5 HB2 LYS 1 1HB LYS 1 15.586 -3.963 12.236 6 HB3 LYS 1 2HB LYS 1 14.502 -2.973 11.264 7 HG2 LYS 1 1HG LYS 1 13.533 -3.931 13.973 8 HG3 LYS 1 2HG LYS 1 14.721 -2.636 13.898 9 HD2 LYS 1 1HD LYS 1 13.308 -1.211 12.637 10 HD3 LYS 1 2HD LYS 1 12.139 -2.482 12.291 11 HE2 LYS 1 1HE LYS 1 12.726 -1.469 15.118 12 HE3 LYS 1 2HE LYS 1 11.520 -0.740 14.056 13 HZ1 LYS 1 3HZ LYS 1 10.313 -2.278 15.288 14 HZ2 LYS 1 1HZ LYS 1 11.445 -3.444 15.234 15 HZ3 LYS 1 2HZ LYS 1 10.555 -3.091 13.903 16 H LYS 2 H LYS 2 16.030 -4.865 10.214 17 HA LYS 2 HA LYS 2 15.223 -4.820 7.569 18 HB2 LYS 2 1HB LYS 2 17.565 -4.522 8.706 19 HB3 LYS 2 2HB LYS 2 17.763 -6.242 8.416 20 HG2 LYS 2 1HG LYS 2 18.811 -5.098 6.633 21 HG3 LYS 2 2HG LYS 2 17.341 -5.782 5.934 22 HD2 LYS 2 1HD LYS 2 16.262 -3.625 5.867 23 HD3 LYS 2 2HD LYS 2 17.435 -2.931 7.005 24 HE2 LYS 2 1HE LYS 2 19.232 -3.383 5.241 25 HE3 LYS 2 2HE LYS 2 17.922 -3.725 4.107 26 HZ1 LYS 2 3HZ LYS 2 17.089 -1.458 4.519 27 HZ2 LYS 2 1HZ LYS 2 18.636 -1.396 4.002 28 HZ3 LYS 2 2HZ LYS 2 18.300 -1.164 5.578 29 H LYS 3 H LYS 3 15.826 -7.718 9.430 30 HA LYS 3 HA LYS 3 15.652 -9.813 7.582 31 HB2 LYS 3 1HB LYS 3 14.566 -9.642 10.422 32 HB3 LYS 3 2HB LYS 3 14.726 -11.148 9.540 33 HG2 LYS 3 1HG LYS 3 17.156 -9.362 9.917 34 HG3 LYS 3 2HG LYS 3 16.583 -10.352 11.246 35 HD2 LYS 3 1HD LYS 3 17.344 -11.482 8.516 36 HD3 LYS 3 2HD LYS 3 18.421 -11.366 9.917 37 HE2 LYS 3 1HE LYS 3 16.558 -12.650 11.215 38 HE3 LYS 3 2HE LYS 3 15.910 -13.052 9.621 39 HZ1 LYS 3 3HZ LYS 3 18.092 -14.058 9.097 40 HZ2 LYS 3 1HZ LYS 3 17.423 -14.770 10.405 41 HZ3 LYS 3 2HZ LYS 3 18.642 -13.707 10.596 42 H ASN 4 H ASN 4 12.949 -7.921 8.797 43 HA ASN 4 HA ASN 4 11.052 -9.513 7.119 44 HB2 ASN 4 1HB ASN 4 9.300 -9.014 8.707 45 HB3 ASN 4 2HB ASN 4 10.619 -9.884 9.465 46 HD21 ASN 4 2HD2 ASN 4 11.372 -9.056 11.396 47 HD22 ASN 4 1HD2 ASN 4 10.887 -7.464 11.977 48 H TRP 5 H TRP 5 12.735 -6.867 6.704 49 HA TRP 5 HA TRP 5 10.773 -4.829 6.154 50 HB2 TRP 5 1HB TRP 5 13.243 -4.545 6.554 51 HB3 TRP 5 2HB TRP 5 13.536 -5.164 4.928 52 HD1 TRP 5 HD1 TRP 5 13.472 -3.395 3.044 53 HE1 TRP 5 HE1 TRP 5 12.813 -0.907 2.858 54 HE3 TRP 5 HE3 TRP 5 11.433 -2.743 7.696 55 HZ2 TRP 5 HZ2 TRP 5 11.548 1.089 4.508 56 HZ3 TRP 5 HZ3 TRP 5 10.495 -0.535 8.364 57 HH2 TRP 5 HH2 TRP 5 10.545 1.380 6.782 58 H PHE 6 H PHE 6 12.140 -7.438 4.144 59 HA PHE 6 HA PHE 6 10.941 -6.592 1.681 60 HB2 PHE 6 1HB PHE 6 12.788 -8.530 2.513 61 HB3 PHE 6 2HB PHE 6 11.444 -9.485 1.942 62 HD1 PHE 6 HD2 PHE 6 10.519 -7.645 -0.406 63 HD2 PHE 6 HD1 PHE 6 14.407 -8.972 0.919 64 HE1 PHE 6 HE2 PHE 6 11.376 -7.424 -2.708 65 HE2 PHE 6 HE1 PHE 6 15.262 -8.756 -1.409 66 HZ PHE 6 HZ PHE 6 13.746 -7.980 -3.224 67 H ASP 7 H ASP 7 9.425 -7.970 4.441 68 HA ASP 7 HA ASP 7 7.309 -9.440 3.048 69 HB2 ASP 7 1HB ASP 7 7.590 -8.453 5.907 70 HB3 ASP 7 2HB ASP 7 6.137 -9.210 5.292 71 H ILE 8 H ILE 8 6.517 -8.113 1.481 72 HA ILE 8 HA ILE 8 5.839 -5.438 1.637 73 HB ILE 8 HB ILE 8 4.471 -5.685 -0.294 74 HG12 ILE 8 1HG1 ILE 8 4.508 -8.703 0.157 75 HG13 ILE 8 2HG1 ILE 8 3.110 -7.651 0.384 76 HG21 ILE 8 1HG2 ILE 8 6.697 -7.739 -0.594 77 HG22 ILE 8 2HG2 ILE 8 6.113 -6.551 -1.777 78 HG23 ILE 8 3HG2 ILE 8 7.020 -6.016 -0.357 79 HD11 ILE 8 3HD1 ILE 8 4.487 -8.218 -2.264 80 HD12 ILE 8 1HD1 ILE 8 2.884 -8.750 -1.739 81 HD13 ILE 8 2HD1 ILE 8 3.185 -7.026 -2.030 82 H THR 9 H THR 9 4.102 -8.028 3.121 83 HA THR 9 HA THR 9 1.529 -6.966 3.486 84 HB THR 9 HB THR 9 1.898 -8.389 5.782 85 HG1 THR 9 HG1 THR 9 3.336 -10.087 5.256 86 HG21 THR 9 3HG2 THR 9 0.291 -8.955 4.018 87 HG22 THR 9 1HG2 THR 9 1.182 -10.388 4.550 88 HG23 THR 9 2HG2 THR 9 1.605 -9.607 3.007 89 H ASN 10 H ASN 10 4.512 -5.992 5.070 90 HA ASN 10 HA ASN 10 3.257 -4.664 7.329 91 HB2 ASN 10 1HB ASN 10 5.980 -4.726 6.070 92 HB3 ASN 10 2HB ASN 10 5.563 -3.226 6.880 93 HD21 ASN 10 2HD2 ASN 10 6.814 -6.338 7.448 94 HD22 ASN 10 1HD2 ASN 10 6.604 -6.279 9.194 95 H TRP 11 H TRP 11 4.350 -3.419 4.154 96 HA TRP 11 HA TRP 11 2.892 -0.886 4.614 97 HB2 TRP 11 1HB TRP 11 4.199 -0.082 2.656 98 HB3 TRP 11 2HB TRP 11 5.098 -0.496 4.095 99 HD1 TRP 11 HD1 TRP 11 6.889 -2.331 3.967 100 HE1 TRP 11 HE1 TRP 11 8.067 -3.546 2.018 101 HE3 TRP 11 HE3 TRP 11 3.600 -1.208 0.243 102 HZ2 TRP 11 HZ2 TRP 11 7.686 -3.844 -0.834 103 HZ3 TRP 11 HZ3 TRP 11 4.016 -1.979 -2.103 104 HH2 TRP 11 HH2 TRP 11 6.051 -3.287 -2.642 105 H LEU 12 H LEU 12 2.069 -3.764 3.191 106 HA LEU 12 HA LEU 12 0.667 -3.094 0.881 107 HB2 LEU 12 1HB LEU 12 0.476 -5.213 2.957 108 HB3 LEU 12 2HB LEU 12 -1.053 -4.891 2.195 109 HG LEU 12 HG LEU 12 1.469 -5.754 0.743 110 HD11 LEU 12 1HD1 LEU 12 -1.093 -7.158 1.551 111 HD12 LEU 12 2HD1 LEU 12 0.592 -7.675 1.767 112 HD13 LEU 12 3HD1 LEU 12 -0.126 -7.724 0.175 113 HD21 LEU 12 3HD2 LEU 12 -0.079 -5.967 -1.242 114 HD22 LEU 12 1HD2 LEU 12 0.127 -4.294 -0.755 115 HD23 LEU 12 2HD2 LEU 12 -1.354 -5.164 -0.298 116 H TRP 13 H TRP 13 -0.181 -2.260 4.140 117 HA TRP 13 HA TRP 13 -2.978 -1.699 3.746 118 HB2 TRP 13 1HB TRP 13 -1.861 -1.932 5.954 119 HB3 TRP 13 2HB TRP 13 -1.062 -0.388 5.707 120 HD1 TRP 13 HD1 TRP 13 -4.623 -1.844 6.054 121 HE1 TRP 13 HE1 TRP 13 -6.235 0.005 6.852 122 HE3 TRP 13 HE3 TRP 13 -1.395 2.125 6.003 123 HZ2 TRP 13 HZ2 TRP 13 -6.140 2.843 7.345 124 HZ3 TRP 13 HZ3 TRP 13 -2.188 4.405 6.613 125 HH2 TRP 13 HH2 TRP 13 -4.546 4.777 7.263 126 H TYR 14 H TYR 14 -0.103 0.431 3.492 127 HA TYR 14 HA TYR 14 -1.546 2.786 2.692 128 HB2 TYR 14 1HB TYR 14 1.302 2.082 1.930 129 HB3 TYR 14 2HB TYR 14 0.586 3.680 2.062 130 HD1 TYR 14 HD2 TYR 14 -0.174 4.490 4.424 131 HD2 TYR 14 HD1 TYR 14 2.347 1.073 3.758 132 HE1 TYR 14 HE2 TYR 14 0.553 4.550 6.816 133 HE2 TYR 14 HE1 TYR 14 3.069 1.104 6.138 134 HH TYR 14 HH TYR 14 2.862 2.168 8.167 135 H ILE 15 H ILE 15 -0.390 -0.028 0.918 136 HA ILE 15 HA ILE 15 -0.819 1.108 -1.747 137 HB ILE 15 HB ILE 15 -0.741 -1.843 -1.039 138 HG12 ILE 15 1HG1 ILE 15 1.308 -0.953 -0.201 139 HG13 ILE 15 2HG1 ILE 15 1.640 -1.797 -1.696 140 HG21 ILE 15 1HG2 ILE 15 -1.630 -1.464 -3.257 141 HG22 ILE 15 2HG2 ILE 15 -0.333 -0.322 -3.645 142 HG23 ILE 15 3HG2 ILE 15 0.026 -2.051 -3.419 143 HD11 ILE 15 3HD1 ILE 15 2.950 0.272 -1.547 144 HD12 ILE 15 1HD1 ILE 15 1.798 0.403 -2.887 145 HD13 ILE 15 2HD1 ILE 15 1.488 1.236 -1.342 146 H LYS 16 H LYS 16 -2.767 -1.081 0.329 147 HA LYS 16 HA LYS 16 -5.082 -1.092 -1.411 148 HB2 LYS 16 1HB LYS 16 -4.546 -1.876 1.429 149 HB3 LYS 16 2HB LYS 16 -6.226 -1.741 0.861 150 HG2 LYS 16 1HG LYS 16 -5.901 -3.282 -0.922 151 HG3 LYS 16 2HG LYS 16 -4.134 -3.253 -0.768 152 HD2 LYS 16 1HD LYS 16 -4.222 -4.388 1.349 153 HD3 LYS 16 2HD LYS 16 -6.004 -4.303 1.367 154 HE2 LYS 16 1HE LYS 16 -6.035 -5.640 -0.768 155 HE3 LYS 16 2HE LYS 16 -4.280 -5.809 -0.665 156 HZ1 LYS 16 3HZ LYS 16 -6.218 -6.825 1.351 157 HZ2 LYS 16 1HZ LYS 16 -4.595 -6.997 1.450 158 HZ3 LYS 16 2HZ LYS 16 -5.428 -7.743 0.262 159 H LEU 17 H LEU 17 -4.228 1.020 1.332 160 HA LEU 17 HA LEU 17 -6.567 2.664 1.166 161 HB2 LEU 17 1HB LEU 17 -5.177 2.583 3.150 162 HB3 LEU 17 2HB LEU 17 -3.811 3.284 2.290 163 HG LEU 17 HG LEU 17 -6.271 4.932 2.065 164 HD11 LEU 17 1HD1 LEU 17 -6.678 4.038 4.319 165 HD12 LEU 17 2HD1 LEU 17 -6.347 5.780 4.300 166 HD13 LEU 17 3HD1 LEU 17 -5.076 4.649 4.805 167 HD21 LEU 17 3HD2 LEU 17 -4.756 6.739 2.675 168 HD22 LEU 17 1HD2 LEU 17 -3.967 5.710 1.467 169 HD23 LEU 17 2HD2 LEU 17 -3.516 5.574 3.186 170 H PHE 18 H PHE 18 -3.498 2.852 -0.691 171 HA PHE 18 HA PHE 18 -3.799 5.372 -1.803 172 HB2 PHE 18 1HB PHE 18 -1.860 4.079 -2.292 173 HB3 PHE 18 2HB PHE 18 -2.800 2.849 -3.120 174 HD1 PHE 18 HD2 PHE 18 -2.934 6.623 -3.518 175 HD2 PHE 18 HD1 PHE 18 -2.092 2.784 -5.315 176 HE1 PHE 18 HE2 PHE 18 -2.508 7.727 -5.676 177 HE2 PHE 18 HE1 PHE 18 -1.716 3.902 -7.499 178 HZ PHE 18 HZ PHE 18 -1.920 6.371 -7.680 179 H ILE 19 H ILE 19 -5.612 2.444 -2.815 180 HA ILE 19 HA ILE 19 -7.068 3.812 -4.916 181 HB ILE 19 HB ILE 19 -7.740 1.268 -3.403 182 HG12 ILE 19 1HG1 ILE 19 -7.110 0.218 -5.692 183 HG13 ILE 19 2HG1 ILE 19 -6.291 1.734 -6.044 184 HG21 ILE 19 1HG2 ILE 19 -9.211 0.842 -5.478 185 HG22 ILE 19 2HG2 ILE 19 -9.791 2.026 -4.318 186 HG23 ILE 19 3HG2 ILE 19 -9.019 2.584 -5.810 187 HD11 ILE 19 3HD1 ILE 19 -5.663 -0.008 -3.627 188 HD12 ILE 19 1HD1 ILE 19 -4.861 -0.171 -5.199 189 HD13 ILE 19 2HD1 ILE 19 -4.683 1.329 -4.294 190 H MET 20 H MET 20 -7.583 3.475 -1.444 191 HA MET 20 HA MET 20 -10.362 4.336 -1.392 192 HB2 MET 20 1HB MET 20 -8.270 4.302 0.817 193 HB3 MET 20 2HB MET 20 -9.983 4.581 1.046 194 HG2 MET 20 1HG MET 20 -8.943 2.037 -0.260 195 HG3 MET 20 2HG MET 20 -9.027 2.213 1.481 196 HE1 MET 20 3HE MET 20 -10.974 2.286 2.917 197 HE2 MET 20 1HE MET 20 -11.804 3.669 2.170 198 HE3 MET 20 2HE MET 20 -12.679 2.147 2.431 199 H ILE 21 H ILE 21 -7.258 6.020 -0.711 200 HA ILE 21 HA ILE 21 -8.454 8.576 -0.178 201 HB ILE 21 HB ILE 21 -6.263 8.002 0.656 202 HG12 ILE 21 1HG1 ILE 21 -6.053 10.407 -1.208 203 HG13 ILE 21 2HG1 ILE 21 -6.965 10.394 0.304 204 HG21 ILE 21 1HG2 ILE 21 -4.259 7.878 -0.676 205 HG22 ILE 21 2HG2 ILE 21 -5.425 6.762 -1.345 206 HG23 ILE 21 3HG2 ILE 21 -5.135 8.306 -2.162 207 HD11 ILE 21 3HD1 ILE 21 -4.865 9.890 1.555 208 HD12 ILE 21 1HD1 ILE 21 -3.952 10.011 0.029 209 HD13 ILE 21 2HD1 ILE 21 -4.799 11.426 0.664 210 H VAL 22 H VAL 22 -7.150 7.228 -3.228 211 HA VAL 22 HA VAL 22 -7.674 9.627 -4.777 212 HB VAL 22 HB VAL 22 -7.362 8.237 -6.751 213 HG11 VAL 22 1HG1 VAL 22 -5.085 7.518 -6.386 214 HG12 VAL 22 2HG1 VAL 22 -5.403 9.111 -5.655 215 HG13 VAL 22 3HG1 VAL 22 -5.302 7.650 -4.636 216 HG21 VAL 22 3HG2 VAL 22 -8.393 6.185 -6.345 217 HG22 VAL 22 1HG2 VAL 22 -6.658 5.814 -6.444 218 HG23 VAL 22 2HG2 VAL 22 -7.463 5.921 -4.882 219 H GLY 23 H GLY 23 -9.647 6.792 -4.045 220 HA2 GLY 23 1HA GLY 23 -11.663 6.026 -4.707 221 HA3 GLY 23 2HA GLY 23 -12.219 7.707 -4.718 222 H GLY 24 H GLY 24 -12.229 8.829 -6.687 223 HA2 GLY 24 1HA GLY 24 -12.695 7.260 -9.097 224 HA3 GLY 24 2HA GLY 24 -12.777 9.013 -8.951 225 H LEU 25 H LEU 25 -9.881 9.096 -7.925 226 HA LEU 25 HA LEU 25 -8.696 9.313 -10.591 227 HB2 LEU 25 1HB LEU 25 -6.983 9.710 -8.171 228 HB3 LEU 25 2HB LEU 25 -6.952 10.496 -9.717 229 HG LEU 25 HG LEU 25 -8.988 10.990 -7.516 230 HD11 LEU 25 1HD1 LEU 25 -6.740 11.811 -7.003 231 HD12 LEU 25 2HD1 LEU 25 -7.872 13.145 -7.279 232 HD13 LEU 25 3HD1 LEU 25 -6.702 12.701 -8.544 233 HD21 LEU 25 3HD2 LEU 25 -8.613 12.414 -10.191 234 HD22 LEU 25 1HD2 LEU 25 -9.701 12.933 -8.883 235 HD23 LEU 25 2HD2 LEU 25 -10.010 11.415 -9.734 236 H VAL 26 H VAL 26 -9.076 6.624 -8.814 237 HA VAL 26 HA VAL 26 -6.664 5.244 -8.616 238 HB VAL 26 HB VAL 26 -8.869 4.526 -7.750 239 HG11 VAL 26 1HG1 VAL 26 -10.257 4.829 -9.786 240 HG12 VAL 26 2HG1 VAL 26 -9.452 3.417 -10.517 241 HG13 VAL 26 3HG1 VAL 26 -10.424 3.236 -9.046 242 HG21 VAL 26 3HG2 VAL 26 -7.452 2.364 -9.342 243 HG22 VAL 26 1HG2 VAL 26 -6.958 3.004 -7.758 244 HG23 VAL 26 2HG2 VAL 26 -8.499 2.137 -7.939 245 H LYS 27 H LYS 27 -8.454 5.829 -11.518 246 HA LYS 27 HA LYS 27 -7.235 3.971 -13.318 247 HB2 LYS 27 1HB LYS 27 -8.587 6.658 -13.666 248 HB3 LYS 27 2HB LYS 27 -7.872 5.831 -15.054 249 HG2 LYS 27 1HG LYS 27 -9.244 3.840 -14.662 250 HG3 LYS 27 2HG LYS 27 -9.925 4.564 -13.195 251 HD2 LYS 27 1HD LYS 27 -10.760 6.478 -14.704 252 HD3 LYS 27 2HD LYS 27 -10.330 5.443 -16.085 253 HE2 LYS 27 1HE LYS 27 -11.826 3.662 -15.209 254 HE3 LYS 27 2HE LYS 27 -12.188 4.655 -13.791 255 HZ1 LYS 27 3HZ LYS 27 -13.941 4.890 -15.417 256 HZ2 LYS 27 1HZ LYS 27 -12.901 5.333 -16.594 257 HZ3 LYS 27 2HZ LYS 27 -13.162 6.318 -15.316 258 H LYS 28 H LYS 28 -5.768 6.743 -11.906 259 HA LYS 28 HA LYS 28 -3.787 7.888 -12.299 260 HB2 LYS 28 1HB LYS 28 -3.285 4.955 -12.161 261 HB3 LYS 28 2HB LYS 28 -1.914 5.897 -12.675 262 HG2 LYS 28 1HG LYS 28 -3.419 6.694 -10.155 263 HG3 LYS 28 2HG LYS 28 -2.270 5.362 -10.169 264 HD2 LYS 28 1HD LYS 28 -0.814 7.006 -9.578 265 HD3 LYS 28 2HD LYS 28 -0.620 7.081 -11.306 266 HE2 LYS 28 1HE LYS 28 -1.110 9.255 -11.249 267 HE3 LYS 28 2HE LYS 28 -2.764 8.855 -10.784 268 HZ1 LYS 28 3HZ LYS 28 -0.519 9.274 -8.876 269 HZ2 LYS 28 1HZ LYS 28 -2.072 8.967 -8.453 270 HZ3 LYS 28 2HZ LYS 28 -1.683 10.367 -9.194 Start of MODEL 8 1 H1 LYS 1 1H LYS 1 14.414 -6.971 13.869 2 H2 LYS 1 2H LYS 1 14.773 -7.838 12.541 3 H3 LYS 1 3H LYS 1 15.654 -6.506 12.922 4 HA LYS 1 HA LYS 1 12.791 -6.516 12.227 5 HB2 LYS 1 1HB LYS 1 13.790 -4.685 13.786 6 HB3 LYS 1 2HB LYS 1 14.442 -3.979 12.318 7 HG2 LYS 1 1HG LYS 1 12.354 -3.391 11.507 8 HG3 LYS 1 2HG LYS 1 11.540 -4.782 12.216 9 HD2 LYS 1 1HD LYS 1 12.473 -2.360 13.815 10 HD3 LYS 1 2HD LYS 1 10.832 -2.622 13.203 11 HE2 LYS 1 1HE LYS 1 10.775 -4.816 14.485 12 HE3 LYS 1 2HE LYS 1 12.312 -4.361 15.230 13 HZ1 LYS 1 3HZ LYS 1 9.772 -2.844 15.470 14 HZ2 LYS 1 1HZ LYS 1 11.195 -2.371 16.123 15 HZ3 LYS 1 2HZ LYS 1 10.468 -3.736 16.643 16 H LYS 2 H LYS 2 15.955 -5.441 10.844 17 HA LYS 2 HA LYS 2 15.202 -4.910 8.268 18 HB2 LYS 2 1HB LYS 2 17.538 -5.011 9.685 19 HB3 LYS 2 2HB LYS 2 17.824 -6.340 8.586 20 HG2 LYS 2 1HG LYS 2 16.857 -3.641 7.546 21 HG3 LYS 2 2HG LYS 2 18.528 -3.822 8.048 22 HD2 LYS 2 1HD LYS 2 17.252 -5.651 5.984 23 HD3 LYS 2 2HD LYS 2 18.076 -4.145 5.569 24 HE2 LYS 2 1HE LYS 2 20.165 -4.923 6.031 25 HE3 LYS 2 2HE LYS 2 19.633 -5.902 7.393 26 HZ1 LYS 2 3HZ LYS 2 19.264 -6.650 4.543 27 HZ2 LYS 2 1HZ LYS 2 18.789 -7.552 5.822 28 HZ3 LYS 2 2HZ LYS 2 20.375 -7.291 5.554 29 H LYS 3 H LYS 3 15.746 -8.178 9.466 30 HA LYS 3 HA LYS 3 15.553 -9.667 7.059 31 HB2 LYS 3 1HB LYS 3 14.970 -11.569 8.445 32 HB3 LYS 3 2HB LYS 3 16.218 -10.612 9.244 33 HG2 LYS 3 1HG LYS 3 14.413 -9.531 10.648 34 HG3 LYS 3 2HG LYS 3 13.233 -10.609 9.909 35 HD2 LYS 3 1HD LYS 3 15.631 -11.548 11.538 36 HD3 LYS 3 2HD LYS 3 14.000 -11.281 12.168 37 HE2 LYS 3 1HE LYS 3 13.219 -12.916 10.287 38 HE3 LYS 3 2HE LYS 3 14.922 -13.381 10.181 39 HZ1 LYS 3 3HZ LYS 3 13.222 -13.543 12.620 40 HZ2 LYS 3 1HZ LYS 3 14.810 -13.923 12.586 41 HZ3 LYS 3 2HZ LYS 3 13.736 -14.810 11.736 42 H ASN 4 H ASN 4 12.989 -8.034 8.735 43 HA ASN 4 HA ASN 4 10.856 -9.298 7.079 44 HB2 ASN 4 1HB ASN 4 10.728 -7.628 9.626 45 HB3 ASN 4 2HB ASN 4 9.334 -8.275 8.764 46 HD21 ASN 4 2HD2 ASN 4 10.676 -8.837 11.553 47 HD22 ASN 4 1HD2 ASN 4 10.645 -10.595 11.554 48 H TRP 5 H TRP 5 12.912 -6.866 6.478 49 HA TRP 5 HA TRP 5 11.151 -4.642 5.956 50 HB2 TRP 5 1HB TRP 5 13.669 -4.625 6.262 51 HB3 TRP 5 2HB TRP 5 13.810 -5.230 4.612 52 HD1 TRP 5 HD1 TRP 5 13.656 -3.426 2.729 53 HE1 TRP 5 HE1 TRP 5 13.274 -0.875 2.662 54 HE3 TRP 5 HE3 TRP 5 12.303 -2.677 7.610 55 HZ2 TRP 5 HZ2 TRP 5 12.455 1.204 4.484 56 HZ3 TRP 5 HZ3 TRP 5 11.714 -0.398 8.421 57 HH2 TRP 5 HH2 TRP 5 11.784 1.542 6.871 58 H PHE 6 H PHE 6 12.248 -7.355 3.927 59 HA PHE 6 HA PHE 6 10.955 -6.480 1.502 60 HB2 PHE 6 1HB PHE 6 12.807 -8.447 2.265 61 HB3 PHE 6 2HB PHE 6 11.415 -9.380 1.783 62 HD1 PHE 6 HD2 PHE 6 10.368 -7.710 -0.569 63 HD2 PHE 6 HD1 PHE 6 14.371 -8.811 0.617 64 HE1 PHE 6 HE2 PHE 6 11.102 -7.571 -2.919 65 HE2 PHE 6 HE1 PHE 6 15.101 -8.674 -1.756 66 HZ PHE 6 HZ PHE 6 13.465 -8.055 -3.527 67 H ASP 7 H ASP 7 9.567 -7.745 4.358 68 HA ASP 7 HA ASP 7 7.380 -9.275 3.187 69 HB2 ASP 7 1HB ASP 7 7.885 -8.135 5.948 70 HB3 ASP 7 2HB ASP 7 6.346 -8.808 5.499 71 H ILE 8 H ILE 8 6.603 -7.975 1.546 72 HA ILE 8 HA ILE 8 5.859 -5.323 1.641 73 HB ILE 8 HB ILE 8 4.523 -5.610 -0.289 74 HG12 ILE 8 1HG1 ILE 8 4.505 -8.614 0.235 75 HG13 ILE 8 2HG1 ILE 8 3.122 -7.531 0.404 76 HG21 ILE 8 1HG2 ILE 8 7.067 -5.977 -0.338 77 HG22 ILE 8 2HG2 ILE 8 6.719 -7.701 -0.542 78 HG23 ILE 8 3HG2 ILE 8 6.156 -6.528 -1.749 79 HD11 ILE 8 3HD1 ILE 8 3.264 -6.974 -2.027 80 HD12 ILE 8 1HD1 ILE 8 4.530 -8.217 -2.196 81 HD13 ILE 8 2HD1 ILE 8 2.898 -8.676 -1.684 82 H THR 9 H THR 9 4.098 -7.935 3.034 83 HA THR 9 HA THR 9 1.543 -6.843 3.441 84 HB THR 9 HB THR 9 2.041 -9.158 3.858 85 HG1 THR 9 HG1 THR 9 0.947 -9.371 5.826 86 HG21 THR 9 3HG2 THR 9 4.255 -9.066 4.849 87 HG22 THR 9 1HG2 THR 9 3.157 -9.914 5.934 88 HG23 THR 9 2HG2 THR 9 3.625 -8.241 6.297 89 H ASN 10 H ASN 10 4.512 -5.934 5.108 90 HA ASN 10 HA ASN 10 3.249 -4.610 7.332 91 HB2 ASN 10 1HB ASN 10 5.667 -5.310 7.161 92 HB3 ASN 10 2HB ASN 10 5.941 -3.971 6.046 93 HD21 ASN 10 2HD2 ASN 10 6.607 -2.036 7.065 94 HD22 ASN 10 1HD2 ASN 10 6.289 -1.718 8.764 95 H TRP 11 H TRP 11 4.342 -3.364 4.154 96 HA TRP 11 HA TRP 11 2.934 -0.793 4.618 97 HB2 TRP 11 1HB TRP 11 4.209 -0.011 2.637 98 HB3 TRP 11 2HB TRP 11 5.128 -0.404 4.069 99 HD1 TRP 11 HD1 TRP 11 6.905 -2.252 3.949 100 HE1 TRP 11 HE1 TRP 11 8.083 -3.470 1.995 101 HE3 TRP 11 HE3 TRP 11 3.616 -1.124 0.234 102 HZ2 TRP 11 HZ2 TRP 11 7.680 -3.788 -0.853 103 HZ3 TRP 11 HZ3 TRP 11 4.019 -1.900 -2.115 104 HH2 TRP 11 HH2 TRP 11 6.043 -3.226 -2.655 105 H LEU 12 H LEU 12 2.059 -3.687 3.244 106 HA LEU 12 HA LEU 12 0.691 -2.997 0.913 107 HB2 LEU 12 1HB LEU 12 0.458 -5.129 2.965 108 HB3 LEU 12 2HB LEU 12 -1.059 -4.793 2.190 109 HG LEU 12 HG LEU 12 1.471 -5.634 0.733 110 HD11 LEU 12 1HD1 LEU 12 -0.070 -7.625 0.158 111 HD12 LEU 12 2HD1 LEU 12 -1.101 -7.068 1.491 112 HD13 LEU 12 3HD1 LEU 12 0.575 -7.574 1.783 113 HD21 LEU 12 3HD2 LEU 12 -1.364 -5.085 -0.289 114 HD22 LEU 12 1HD2 LEU 12 -0.070 -5.842 -1.245 115 HD23 LEU 12 2HD2 LEU 12 0.093 -4.171 -0.732 116 H TRP 13 H TRP 13 -0.176 -2.142 4.157 117 HA TRP 13 HA TRP 13 -2.970 -1.593 3.759 118 HB2 TRP 13 1HB TRP 13 -1.849 -1.785 5.971 119 HB3 TRP 13 2HB TRP 13 -1.055 -0.243 5.694 120 HD1 TRP 13 HD1 TRP 13 -4.612 -1.702 6.065 121 HE1 TRP 13 HE1 TRP 13 -6.227 0.153 6.841 122 HE3 TRP 13 HE3 TRP 13 -1.390 2.270 5.958 123 HZ2 TRP 13 HZ2 TRP 13 -6.137 2.999 7.294 124 HZ3 TRP 13 HZ3 TRP 13 -2.186 4.557 6.537 125 HH2 TRP 13 HH2 TRP 13 -4.545 4.934 7.184 126 H TYR 14 H TYR 14 -0.112 0.557 3.486 127 HA TYR 14 HA TYR 14 -1.549 2.895 2.653 128 HB2 TYR 14 1HB TYR 14 1.289 2.164 1.880 129 HB3 TYR 14 2HB TYR 14 0.585 3.769 1.997 130 HD1 TYR 14 HD2 TYR 14 -0.162 4.603 4.356 131 HD2 TYR 14 HD1 TYR 14 2.360 1.179 3.711 132 HE1 TYR 14 HE2 TYR 14 0.585 4.691 6.741 133 HE2 TYR 14 HE1 TYR 14 3.102 1.239 6.080 134 HH TYR 14 HH TYR 14 2.916 2.334 8.098 135 H ILE 15 H ILE 15 -0.402 0.056 0.914 136 HA ILE 15 HA ILE 15 -0.829 1.163 -1.757 137 HB ILE 15 HB ILE 15 -0.723 -1.782 -1.026 138 HG12 ILE 15 1HG1 ILE 15 1.314 -0.856 -0.187 139 HG13 ILE 15 2HG1 ILE 15 1.659 -1.713 -1.670 140 HG21 ILE 15 1HG2 ILE 15 -1.603 -1.462 -3.240 141 HG22 ILE 15 2HG2 ILE 15 -0.374 -0.250 -3.633 142 HG23 ILE 15 3HG2 ILE 15 0.081 -1.959 -3.419 143 HD11 ILE 15 3HD1 ILE 15 2.947 0.366 -1.547 144 HD12 ILE 15 1HD1 ILE 15 1.791 0.477 -2.887 145 HD13 ILE 15 2HD1 ILE 15 1.479 1.321 -1.347 146 H LYS 16 H LYS 16 -2.803 -1.017 0.338 147 HA LYS 16 HA LYS 16 -5.048 -1.006 -1.490 148 HB2 LYS 16 1HB LYS 16 -4.662 -2.691 0.303 149 HB3 LYS 16 2HB LYS 16 -5.129 -1.506 1.524 150 HG2 LYS 16 1HG LYS 16 -6.982 -2.005 -0.822 151 HG3 LYS 16 2HG LYS 16 -6.858 -3.268 0.381 152 HD2 LYS 16 1HD LYS 16 -7.384 -0.462 1.375 153 HD3 LYS 16 2HD LYS 16 -8.676 -1.301 0.529 154 HE2 LYS 16 1HE LYS 16 -7.425 -3.111 2.446 155 HE3 LYS 16 2HE LYS 16 -7.841 -1.603 3.258 156 HZ1 LYS 16 3HZ LYS 16 -10.122 -1.859 2.460 157 HZ2 LYS 16 1HZ LYS 16 -9.688 -3.195 3.287 158 HZ3 LYS 16 2HZ LYS 16 -9.746 -3.234 1.658 159 H LEU 17 H LEU 17 -4.271 1.074 1.297 160 HA LEU 17 HA LEU 17 -6.583 2.737 1.115 161 HB2 LEU 17 1HB LEU 17 -5.195 2.655 3.096 162 HB3 LEU 17 2HB LEU 17 -3.824 3.349 2.235 163 HG LEU 17 HG LEU 17 -6.294 4.994 2.014 164 HD11 LEU 17 1HD1 LEU 17 -6.335 5.870 4.236 165 HD12 LEU 17 2HD1 LEU 17 -5.047 4.756 4.730 166 HD13 LEU 17 3HD1 LEU 17 -6.654 4.126 4.287 167 HD21 LEU 17 3HD2 LEU 17 -3.522 5.658 3.082 168 HD22 LEU 17 1HD2 LEU 17 -4.772 6.813 2.575 169 HD23 LEU 17 2HD2 LEU 17 -3.998 5.772 1.368 170 H PHE 18 H PHE 18 -3.518 2.932 -0.752 171 HA PHE 18 HA PHE 18 -3.817 5.442 -1.871 172 HB2 PHE 18 1HB PHE 18 -1.903 4.115 -2.384 173 HB3 PHE 18 2HB PHE 18 -2.872 2.899 -3.200 174 HD1 PHE 18 HD2 PHE 18 -2.990 6.676 -3.608 175 HD2 PHE 18 HD1 PHE 18 -2.126 2.834 -5.388 176 HE1 PHE 18 HE2 PHE 18 -2.540 7.774 -5.774 177 HE2 PHE 18 HE1 PHE 18 -1.725 3.946 -7.571 178 HZ PHE 18 HZ PHE 18 -1.920 6.418 -7.765 179 H ILE 19 H ILE 19 -5.578 2.508 -2.942 180 HA ILE 19 HA ILE 19 -7.113 3.830 -4.986 181 HB ILE 19 HB ILE 19 -7.726 1.304 -3.419 182 HG12 ILE 19 1HG1 ILE 19 -7.121 0.241 -5.721 183 HG13 ILE 19 2HG1 ILE 19 -6.300 1.756 -6.073 184 HG21 ILE 19 1HG2 ILE 19 -9.801 2.017 -4.305 185 HG22 ILE 19 2HG2 ILE 19 -9.066 2.575 -5.814 186 HG23 ILE 19 3HG2 ILE 19 -9.225 0.832 -5.467 187 HD11 ILE 19 3HD1 ILE 19 -5.679 0.003 -3.659 188 HD12 ILE 19 1HD1 ILE 19 -4.866 -0.140 -5.229 189 HD13 ILE 19 2HD1 ILE 19 -4.701 1.351 -4.305 190 H MET 20 H MET 20 -7.604 3.493 -1.504 191 HA MET 20 HA MET 20 -10.387 4.332 -1.447 192 HB2 MET 20 1HB MET 20 -8.300 4.368 0.766 193 HB3 MET 20 2HB MET 20 -10.023 4.587 0.982 194 HG2 MET 20 1HG MET 20 -8.896 2.067 -0.297 195 HG3 MET 20 2HG MET 20 -8.969 2.260 1.442 196 HE1 MET 20 3HE MET 20 -11.816 3.626 2.124 197 HE2 MET 20 1HE MET 20 -12.601 2.064 2.437 198 HE3 MET 20 2HE MET 20 -10.901 2.312 2.895 199 H ILE 21 H ILE 21 -7.293 6.065 -0.828 200 HA ILE 21 HA ILE 21 -8.576 8.596 -0.310 201 HB ILE 21 HB ILE 21 -6.414 8.065 0.613 202 HG12 ILE 21 1HG1 ILE 21 -5.996 10.471 -1.190 203 HG13 ILE 21 2HG1 ILE 21 -7.233 10.475 0.068 204 HG21 ILE 21 1HG2 ILE 21 -5.382 6.858 -1.270 205 HG22 ILE 21 2HG2 ILE 21 -5.228 8.364 -2.191 206 HG23 ILE 21 3HG2 ILE 21 -4.328 8.126 -0.681 207 HD11 ILE 21 3HD1 ILE 21 -5.145 11.512 0.852 208 HD12 ILE 21 1HD1 ILE 21 -5.565 10.078 1.807 209 HD13 ILE 21 2HD1 ILE 21 -4.269 9.996 0.593 210 H VAL 22 H VAL 22 -7.200 7.242 -3.321 211 HA VAL 22 HA VAL 22 -7.718 9.629 -4.899 212 HB VAL 22 HB VAL 22 -7.422 8.218 -6.859 213 HG11 VAL 22 1HG1 VAL 22 -5.343 7.658 -4.752 214 HG12 VAL 22 2HG1 VAL 22 -5.137 7.519 -6.504 215 HG13 VAL 22 3HG1 VAL 22 -5.459 9.113 -5.779 216 HG21 VAL 22 3HG2 VAL 22 -7.498 5.929 -4.958 217 HG22 VAL 22 1HG2 VAL 22 -8.438 6.165 -6.419 218 HG23 VAL 22 2HG2 VAL 22 -6.701 5.801 -6.520 219 H GLY 23 H GLY 23 -9.687 6.805 -4.120 220 HA2 GLY 23 1HA GLY 23 -11.726 6.053 -4.731 221 HA3 GLY 23 2HA GLY 23 -12.260 7.740 -4.759 222 H GLY 24 H GLY 24 -12.316 8.826 -6.734 223 HA2 GLY 24 1HA GLY 24 -12.826 7.225 -9.118 224 HA3 GLY 24 2HA GLY 24 -12.921 8.978 -8.987 225 H LEU 25 H LEU 25 -9.991 9.062 -8.009 226 HA LEU 25 HA LEU 25 -8.861 9.263 -10.703 227 HB2 LEU 25 1HB LEU 25 -7.094 9.654 -8.321 228 HB3 LEU 25 2HB LEU 25 -7.080 10.426 -9.873 229 HG LEU 25 HG LEU 25 -9.065 10.970 -7.638 230 HD11 LEU 25 1HD1 LEU 25 -7.919 13.115 -7.444 231 HD12 LEU 25 2HD1 LEU 25 -6.775 12.642 -8.723 232 HD13 LEU 25 3HD1 LEU 25 -6.799 11.770 -7.173 233 HD21 LEU 25 3HD2 LEU 25 -10.114 11.389 -9.852 234 HD22 LEU 25 1HD2 LEU 25 -8.716 12.378 -10.326 235 HD23 LEU 25 2HD2 LEU 25 -9.784 12.905 -9.005 236 H VAL 26 H VAL 26 -9.208 6.578 -8.876 237 HA VAL 26 HA VAL 26 -6.802 5.239 -8.633 238 HB VAL 26 HB VAL 26 -8.995 4.493 -7.789 239 HG11 VAL 26 1HG1 VAL 26 -10.365 4.751 -9.844 240 HG12 VAL 26 2HG1 VAL 26 -9.536 3.341 -10.547 241 HG13 VAL 26 3HG1 VAL 26 -10.523 3.166 -9.086 242 HG21 VAL 26 3HG2 VAL 26 -7.547 2.319 -9.335 243 HG22 VAL 26 1HG2 VAL 26 -7.070 2.988 -7.758 244 HG23 VAL 26 2HG2 VAL 26 -8.603 2.104 -7.940 245 H LYS 27 H LYS 27 -8.527 5.670 -11.588 246 HA LYS 27 HA LYS 27 -7.282 3.811 -13.360 247 HB2 LYS 27 1HB LYS 27 -9.295 5.288 -13.732 248 HB3 LYS 27 2HB LYS 27 -8.170 6.626 -14.019 249 HG2 LYS 27 1HG LYS 27 -7.097 5.202 -15.824 250 HG3 LYS 27 2HG LYS 27 -8.369 4.002 -15.593 251 HD2 LYS 27 1HD LYS 27 -8.954 6.922 -16.226 252 HD3 LYS 27 2HD LYS 27 -8.654 5.724 -17.494 253 HE2 LYS 27 1HE LYS 27 -10.551 4.393 -16.845 254 HE3 LYS 27 2HE LYS 27 -10.803 5.337 -15.372 255 HZ1 LYS 27 3HZ LYS 27 -12.341 5.996 -17.142 256 HZ2 LYS 27 1HZ LYS 27 -11.107 6.411 -18.126 257 HZ3 LYS 27 2HZ LYS 27 -11.375 7.249 -16.749 258 H LYS 28 H LYS 28 -6.022 6.857 -12.125 259 HA LYS 28 HA LYS 28 -3.882 7.193 -14.077 260 HB2 LYS 28 1HB LYS 28 -4.468 8.508 -11.393 261 HB3 LYS 28 2HB LYS 28 -3.145 8.994 -12.440 262 HG2 LYS 28 1HG LYS 28 -6.019 8.959 -13.462 263 HG3 LYS 28 2HG LYS 28 -5.370 10.327 -12.559 264 HD2 LYS 28 1HD LYS 28 -3.644 10.728 -14.188 265 HD3 LYS 28 2HD LYS 28 -4.034 9.240 -15.076 266 HE2 LYS 28 1HE LYS 28 -6.211 10.092 -15.710 267 HE3 LYS 28 2HE LYS 28 -6.021 11.513 -14.676 268 HZ1 LYS 28 3HZ LYS 28 -5.533 12.003 -17.020 269 HZ2 LYS 28 1HZ LYS 28 -4.312 10.922 -17.036 270 HZ3 LYS 28 2HZ LYS 28 -4.212 12.257 -16.100 Start of MODEL 9 1 H1 LYS 1 1H LYS 1 18.886 -5.985 9.422 2 H2 LYS 1 2H LYS 1 19.727 -6.163 10.816 3 H3 LYS 1 3H LYS 1 19.486 -7.446 9.849 4 HA LYS 1 HA LYS 1 18.029 -7.571 11.768 5 HB2 LYS 1 1HB LYS 1 16.855 -4.933 10.766 6 HB3 LYS 1 2HB LYS 1 16.223 -5.936 12.060 7 HG2 LYS 1 1HG LYS 1 17.404 -4.607 13.439 8 HG3 LYS 1 2HG LYS 1 18.769 -5.609 12.986 9 HD2 LYS 1 1HD LYS 1 19.657 -3.496 12.614 10 HD3 LYS 1 2HD LYS 1 19.019 -3.822 10.998 11 HE2 LYS 1 1HE LYS 1 16.831 -2.664 11.892 12 HE3 LYS 1 2HE LYS 1 17.852 -2.101 13.217 13 HZ1 LYS 1 3HZ LYS 1 17.825 -0.452 11.479 14 HZ2 LYS 1 1HZ LYS 1 18.262 -1.522 10.331 15 HZ3 LYS 1 2HZ LYS 1 19.325 -1.093 11.498 16 H LYS 2 H LYS 2 17.806 -9.412 10.309 17 HA LYS 2 HA LYS 2 16.311 -9.400 7.913 18 HB2 LYS 2 1HB LYS 2 17.818 -11.274 9.335 19 HB3 LYS 2 2HB LYS 2 16.198 -11.931 9.465 20 HG2 LYS 2 1HG LYS 2 17.110 -12.912 7.537 21 HG3 LYS 2 2HG LYS 2 16.023 -11.669 6.901 22 HD2 LYS 2 1HD LYS 2 17.947 -10.173 6.482 23 HD3 LYS 2 2HD LYS 2 19.038 -11.315 7.293 24 HE2 LYS 2 1HE LYS 2 18.462 -13.040 5.573 25 HE3 LYS 2 2HE LYS 2 17.476 -11.840 4.726 26 HZ1 LYS 2 3HZ LYS 2 19.495 -10.502 4.420 27 HZ2 LYS 2 1HZ LYS 2 19.724 -11.991 3.795 28 HZ3 LYS 2 2HZ LYS 2 20.400 -11.600 5.225 29 H LYS 3 H LYS 3 15.136 -9.789 11.167 30 HA LYS 3 HA LYS 3 12.475 -10.610 10.774 31 HB2 LYS 3 1HB LYS 3 12.046 -9.832 12.967 32 HB3 LYS 3 2HB LYS 3 13.726 -10.353 12.944 33 HG2 LYS 3 1HG LYS 3 14.296 -7.816 12.551 34 HG3 LYS 3 2HG LYS 3 12.608 -7.524 12.976 35 HD2 LYS 3 1HD LYS 3 13.619 -7.264 15.042 36 HD3 LYS 3 2HD LYS 3 13.132 -8.952 15.115 37 HE2 LYS 3 1HE LYS 3 15.276 -9.448 15.618 38 HE3 LYS 3 2HE LYS 3 15.658 -9.115 13.931 39 HZ1 LYS 3 3HZ LYS 3 17.075 -7.799 15.369 40 HZ2 LYS 3 1HZ LYS 3 15.812 -7.181 16.187 41 HZ3 LYS 3 2HZ LYS 3 16.052 -6.753 14.633 42 H ASN 4 H ASN 4 13.791 -7.494 9.991 43 HA ASN 4 HA ASN 4 11.082 -6.347 9.507 44 HB2 ASN 4 1HB ASN 4 13.081 -5.321 10.994 45 HB3 ASN 4 2HB ASN 4 13.596 -4.695 9.434 46 HD21 ASN 4 2HD2 ASN 4 11.375 -3.824 8.173 47 HD22 ASN 4 1HD2 ASN 4 10.495 -2.683 9.203 48 H TRP 5 H TRP 5 13.314 -8.053 7.739 49 HA TRP 5 HA TRP 5 13.569 -6.445 5.348 50 HB2 TRP 5 1HB TRP 5 15.067 -8.335 6.104 51 HB3 TRP 5 2HB TRP 5 13.790 -9.463 5.656 52 HD1 TRP 5 HD1 TRP 5 13.979 -10.375 3.281 53 HE1 TRP 5 HE1 TRP 5 15.210 -9.720 1.111 54 HE3 TRP 5 HE3 TRP 5 15.973 -5.903 4.790 55 HZ2 TRP 5 HZ2 TRP 5 16.835 -7.540 0.160 56 HZ3 TRP 5 HZ3 TRP 5 17.355 -4.550 3.226 57 HH2 TRP 5 HH2 TRP 5 17.792 -5.355 0.917 58 H PHE 6 H PHE 6 11.208 -8.869 6.414 59 HA PHE 6 HA PHE 6 9.737 -8.802 3.901 60 HB2 PHE 6 1HB PHE 6 10.015 -10.624 6.029 61 HB3 PHE 6 2HB PHE 6 8.356 -10.093 6.144 62 HD1 PHE 6 HD1 PHE 6 7.514 -9.690 3.341 63 HD2 PHE 6 HD2 PHE 6 10.091 -12.704 5.024 64 HE1 PHE 6 HE1 PHE 6 6.997 -11.175 1.440 65 HE2 PHE 6 HE2 PHE 6 9.536 -14.228 3.129 66 HZ PHE 6 HZ PHE 6 7.995 -13.463 1.330 67 H ASP 7 H ASP 7 9.939 -6.270 5.694 68 HA ASP 7 HA ASP 7 7.380 -5.634 6.717 69 HB2 ASP 7 1HB ASP 7 8.044 -3.406 6.782 70 HB3 ASP 7 2HB ASP 7 9.496 -4.335 7.078 71 H ILE 8 H ILE 8 8.257 -5.977 3.418 72 HA ILE 8 HA ILE 8 6.523 -4.346 2.014 73 HB ILE 8 HB ILE 8 6.706 -5.720 0.167 74 HG12 ILE 8 1HG1 ILE 8 7.371 -8.065 1.973 75 HG13 ILE 8 2HG1 ILE 8 5.865 -7.849 1.077 76 HG21 ILE 8 1HG2 ILE 8 9.227 -6.423 1.719 77 HG22 ILE 8 2HG2 ILE 8 9.060 -6.086 -0.012 78 HG23 ILE 8 3HG2 ILE 8 8.872 -4.768 1.149 79 HD11 ILE 8 3HD1 ILE 8 7.188 -7.899 -1.067 80 HD12 ILE 8 1HD1 ILE 8 8.608 -8.386 -0.106 81 HD13 ILE 8 2HD1 ILE 8 7.171 -9.415 -0.150 82 H THR 9 H THR 9 5.522 -7.028 4.052 83 HA THR 9 HA THR 9 2.899 -7.473 2.968 84 HB THR 9 HB THR 9 2.379 -8.343 5.226 85 HG1 THR 9 HG1 THR 9 3.763 -8.141 6.851 86 HG21 THR 9 3HG2 THR 9 3.505 -9.818 3.590 87 HG22 THR 9 1HG2 THR 9 3.994 -10.191 5.253 88 HG23 THR 9 2HG2 THR 9 5.090 -9.286 4.192 89 H ASN 10 H ASN 10 4.185 -5.063 5.228 90 HA ASN 10 HA ASN 10 1.535 -3.871 5.769 91 HB2 ASN 10 1HB ASN 10 4.380 -3.219 6.625 92 HB3 ASN 10 2HB ASN 10 3.062 -2.075 6.860 93 HD21 ASN 10 2HD2 ASN 10 4.629 -4.734 8.317 94 HD22 ASN 10 1HD2 ASN 10 3.365 -5.033 9.505 95 H TRP 11 H TRP 11 4.206 -3.321 3.478 96 HA TRP 11 HA TRP 11 3.432 -0.727 2.604 97 HB2 TRP 11 1HB TRP 11 4.830 -2.987 1.172 98 HB3 TRP 11 2HB TRP 11 4.436 -1.482 0.390 99 HD1 TRP 11 HD1 TRP 11 6.410 -2.546 3.558 100 HE1 TRP 11 HE1 TRP 11 8.465 -1.069 3.788 101 HE3 TRP 11 HE3 TRP 11 5.415 0.605 -0.265 102 HZ2 TRP 11 HZ2 TRP 11 9.536 1.309 2.448 103 HZ3 TRP 11 HZ3 TRP 11 6.960 2.519 -0.802 104 HH2 TRP 11 HH2 TRP 11 9.019 2.864 0.554 105 H LEU 12 H LEU 12 2.090 -3.889 1.834 106 HA LEU 12 HA LEU 12 0.395 -3.271 -0.339 107 HB2 LEU 12 1HB LEU 12 -0.309 -5.113 1.975 108 HB3 LEU 12 2HB LEU 12 -0.965 -5.161 0.344 109 HG LEU 12 HG LEU 12 1.872 -5.854 1.175 110 HD11 LEU 12 1HD1 LEU 12 0.178 -7.526 1.780 111 HD12 LEU 12 2HD1 LEU 12 1.269 -8.124 0.520 112 HD13 LEU 12 3HD1 LEU 12 -0.371 -7.587 0.091 113 HD21 LEU 12 3HD2 LEU 12 2.192 -6.623 -1.158 114 HD22 LEU 12 1HD2 LEU 12 1.938 -4.878 -1.078 115 HD23 LEU 12 2HD2 LEU 12 0.607 -5.941 -1.596 116 H TRP 13 H TRP 13 0.015 -2.365 3.039 117 HA TRP 13 HA TRP 13 -2.794 -1.710 2.983 118 HB2 TRP 13 1HB TRP 13 -1.398 -2.030 5.024 119 HB3 TRP 13 2HB TRP 13 -0.605 -0.497 4.706 120 HD1 TRP 13 HD1 TRP 13 -4.028 -1.914 5.696 121 HE1 TRP 13 HE1 TRP 13 -5.443 -0.056 6.793 122 HE3 TRP 13 HE3 TRP 13 -0.907 2.071 4.910 123 HZ2 TRP 13 HZ2 TRP 13 -5.249 2.779 7.250 124 HZ3 TRP 13 HZ3 TRP 13 -1.558 4.349 5.674 125 HH2 TRP 13 HH2 TRP 13 -3.713 4.714 6.840 126 H TYR 14 H TYR 14 0.117 0.378 2.594 127 HA TYR 14 HA TYR 14 -1.340 2.764 1.941 128 HB2 TYR 14 1HB TYR 14 1.466 2.007 1.058 129 HB3 TYR 14 2HB TYR 14 0.777 3.621 1.103 130 HD1 TYR 14 HD1 TYR 14 0.197 4.684 3.355 131 HD2 TYR 14 HD2 TYR 14 2.421 1.021 2.982 132 HE1 TYR 14 HE1 TYR 14 1.019 4.939 5.705 133 HE2 TYR 14 HE2 TYR 14 3.223 1.250 5.336 134 HH TYR 14 HH TYR 14 3.195 2.537 7.230 135 H ILE 15 H ILE 15 -0.183 0.074 -0.040 136 HA ILE 15 HA ILE 15 -0.816 1.340 -2.601 137 HB ILE 15 HB ILE 15 -0.544 -1.624 -2.001 138 HG12 ILE 15 1HG1 ILE 15 1.522 -0.445 -1.478 139 HG13 ILE 15 2HG1 ILE 15 1.712 -1.474 -2.880 140 HG21 ILE 15 1HG2 ILE 15 -0.076 -1.729 -4.505 141 HG22 ILE 15 2HG2 ILE 15 -1.749 -1.382 -4.064 142 HG23 ILE 15 3HG2 ILE 15 -0.704 -0.063 -4.611 143 HD11 ILE 15 3HD1 ILE 15 1.405 1.567 -2.935 144 HD12 ILE 15 1HD1 ILE 15 2.902 0.653 -3.157 145 HD13 ILE 15 2HD1 ILE 15 1.613 0.523 -4.364 146 H LYS 16 H LYS 16 -2.628 -1.007 -0.581 147 HA LYS 16 HA LYS 16 -5.010 -0.959 -2.216 148 HB2 LYS 16 1HB LYS 16 -4.546 -2.722 -0.609 149 HB3 LYS 16 2HB LYS 16 -4.682 -1.596 0.748 150 HG2 LYS 16 1HG LYS 16 -7.020 -1.349 0.475 151 HG3 LYS 16 2HG LYS 16 -6.989 -1.933 -1.199 152 HD2 LYS 16 1HD LYS 16 -6.507 -4.191 -0.506 153 HD3 LYS 16 2HD LYS 16 -6.356 -3.722 1.192 154 HE2 LYS 16 1HE LYS 16 -8.915 -3.137 -0.333 155 HE3 LYS 16 2HE LYS 16 -8.600 -4.782 0.220 156 HZ1 LYS 16 3HZ LYS 16 -9.863 -3.505 1.861 157 HZ2 LYS 16 1HZ LYS 16 -8.653 -2.420 2.021 158 HZ3 LYS 16 2HZ LYS 16 -8.433 -3.975 2.482 159 H LEU 17 H LEU 17 -4.114 1.003 0.621 160 HA LEU 17 HA LEU 17 -6.459 2.607 0.681 161 HB2 LEU 17 1HB LEU 17 -4.882 2.431 2.527 162 HB3 LEU 17 2HB LEU 17 -3.645 3.285 1.612 163 HG LEU 17 HG LEU 17 -6.206 4.772 1.718 164 HD11 LEU 17 1HD1 LEU 17 -6.441 3.687 3.885 165 HD12 LEU 17 2HD1 LEU 17 -6.102 5.418 4.064 166 HD13 LEU 17 3HD1 LEU 17 -4.806 4.231 4.334 167 HD21 LEU 17 3HD2 LEU 17 -4.026 5.761 1.031 168 HD22 LEU 17 1HD2 LEU 17 -3.415 5.504 2.683 169 HD23 LEU 17 2HD2 LEU 17 -4.767 6.621 2.390 170 H PHE 18 H PHE 18 -3.534 2.995 -1.358 171 HA PHE 18 HA PHE 18 -4.013 5.557 -2.326 172 HB2 PHE 18 1HB PHE 18 -2.041 4.389 -2.980 173 HB3 PHE 18 2HB PHE 18 -2.959 3.142 -3.806 174 HD1 PHE 18 HD1 PHE 18 -3.340 6.919 -4.051 175 HD2 PHE 18 HD2 PHE 18 -2.338 3.213 -6.030 176 HE1 PHE 18 HE1 PHE 18 -3.089 8.126 -6.185 177 HE2 PHE 18 HE2 PHE 18 -2.133 4.433 -8.185 178 HZ PHE 18 HZ PHE 18 -2.501 6.893 -8.265 179 H ILE 19 H ILE 19 -5.748 2.585 -3.329 180 HA ILE 19 HA ILE 19 -7.390 3.967 -5.292 181 HB ILE 19 HB ILE 19 -7.813 1.304 -3.893 182 HG12 ILE 19 1HG1 ILE 19 -7.266 0.426 -6.276 183 HG13 ILE 19 2HG1 ILE 19 -6.558 2.008 -6.578 184 HG21 ILE 19 1HG2 ILE 19 -9.383 0.895 -5.893 185 HG22 ILE 19 2HG2 ILE 19 -9.959 1.982 -4.639 186 HG23 ILE 19 3HG2 ILE 19 -9.315 2.660 -6.142 187 HD11 ILE 19 3HD1 ILE 19 -4.830 1.602 -4.943 188 HD12 ILE 19 1HD1 ILE 19 -5.687 0.164 -4.318 189 HD13 ILE 19 2HD1 ILE 19 -4.968 0.157 -5.939 190 H MET 20 H MET 20 -7.670 3.408 -1.822 191 HA MET 20 HA MET 20 -10.484 4.099 -1.562 192 HB2 MET 20 1HB MET 20 -8.248 4.066 0.502 193 HB3 MET 20 2HB MET 20 -9.948 4.277 0.866 194 HG2 MET 20 1HG MET 20 -8.938 1.835 -0.640 195 HG3 MET 20 2HG MET 20 -8.905 1.918 1.112 196 HE1 MET 20 3HE MET 20 -12.506 1.731 2.285 197 HE2 MET 20 1HE MET 20 -10.778 1.592 2.681 198 HE3 MET 20 2HE MET 20 -11.455 3.161 2.203 199 H ILE 21 H ILE 21 -7.456 5.948 -0.978 200 HA ILE 21 HA ILE 21 -8.770 8.388 -0.237 201 HB ILE 21 HB ILE 21 -6.499 7.891 0.423 202 HG12 ILE 21 1HG1 ILE 21 -6.601 10.431 -1.264 203 HG13 ILE 21 2HG1 ILE 21 -7.354 10.237 0.322 204 HG21 ILE 21 1HG2 ILE 21 -4.583 7.969 -1.019 205 HG22 ILE 21 2HG2 ILE 21 -5.723 6.847 -1.723 206 HG23 ILE 21 3HG2 ILE 21 -5.560 8.468 -2.419 207 HD11 ILE 21 3HD1 ILE 21 -4.370 10.128 -0.282 208 HD12 ILE 21 1HD1 ILE 21 -5.249 11.394 0.582 209 HD13 ILE 21 2HD1 ILE 21 -5.095 9.780 1.308 210 H VAL 22 H VAL 22 -7.586 7.291 -3.426 211 HA VAL 22 HA VAL 22 -8.341 9.722 -4.820 212 HB VAL 22 HB VAL 22 -8.070 8.428 -6.876 213 HG11 VAL 22 1HG1 VAL 22 -6.111 9.392 -5.873 214 HG12 VAL 22 2HG1 VAL 22 -5.852 7.913 -4.908 215 HG13 VAL 22 3HG1 VAL 22 -5.734 7.845 -6.671 216 HG21 VAL 22 3HG2 VAL 22 -7.927 6.054 -5.085 217 HG22 VAL 22 1HG2 VAL 22 -8.938 6.302 -6.497 218 HG23 VAL 22 2HG2 VAL 22 -7.188 6.045 -6.681 219 H GLY 23 H GLY 23 -10.101 6.747 -4.107 220 HA2 GLY 23 1HA GLY 23 -12.086 5.869 -4.719 221 HA3 GLY 23 2HA GLY 23 -12.756 7.502 -4.583 222 H GLY 24 H GLY 24 -13.020 8.717 -6.453 223 HA2 GLY 24 1HA GLY 24 -13.532 7.293 -8.933 224 HA3 GLY 24 2HA GLY 24 -13.701 9.025 -8.666 225 H LEU 25 H LEU 25 -10.753 9.217 -7.822 226 HA LEU 25 HA LEU 25 -9.743 9.619 -10.547 227 HB2 LEU 25 1HB LEU 25 -7.907 10.010 -8.223 228 HB3 LEU 25 2HB LEU 25 -8.018 10.857 -9.734 229 HG LEU 25 HG LEU 25 -9.916 11.166 -7.385 230 HD11 LEU 25 1HD1 LEU 25 -7.672 12.049 -6.978 231 HD12 LEU 25 2HD1 LEU 25 -8.861 13.354 -7.126 232 HD13 LEU 25 3HD1 LEU 25 -7.760 13.003 -8.479 233 HD21 LEU 25 3HD2 LEU 25 -11.081 11.642 -9.532 234 HD22 LEU 25 1HD2 LEU 25 -9.760 12.731 -10.006 235 HD23 LEU 25 2HD2 LEU 25 -10.798 13.129 -8.616 236 H VAL 26 H VAL 26 -9.862 6.823 -8.857 237 HA VAL 26 HA VAL 26 -7.347 5.633 -8.816 238 HB VAL 26 HB VAL 26 -9.434 4.658 -7.933 239 HG11 VAL 26 1HG1 VAL 26 -10.948 3.351 -9.271 240 HG12 VAL 26 2HG1 VAL 26 -10.938 5.007 -9.883 241 HG13 VAL 26 3HG1 VAL 26 -10.061 3.727 -10.758 242 HG21 VAL 26 3HG2 VAL 26 -8.893 2.333 -8.316 243 HG22 VAL 26 1HG2 VAL 26 -7.965 2.732 -9.762 244 HG23 VAL 26 2HG2 VAL 26 -7.407 3.299 -8.172 245 H LYS 27 H LYS 27 -9.265 6.221 -11.611 246 HA LYS 27 HA LYS 27 -8.033 4.453 -13.474 247 HB2 LYS 27 1HB LYS 27 -10.264 5.934 -13.504 248 HB3 LYS 27 2HB LYS 27 -9.222 7.085 -14.348 249 HG2 LYS 27 1HG LYS 27 -8.642 5.144 -15.950 250 HG3 LYS 27 2HG LYS 27 -9.899 4.208 -15.122 251 HD2 LYS 27 1HD LYS 27 -11.568 5.982 -15.733 252 HD3 LYS 27 2HD LYS 27 -10.274 6.862 -16.580 253 HE2 LYS 27 1HE LYS 27 -9.890 4.711 -17.933 254 HE3 LYS 27 2HE LYS 27 -11.394 4.101 -17.232 255 HZ1 LYS 27 3HZ LYS 27 -11.801 5.159 -19.373 256 HZ2 LYS 27 1HZ LYS 27 -11.129 6.562 -18.882 257 HZ3 LYS 27 2HZ LYS 27 -12.529 6.048 -18.212 258 H LYS 28 H LYS 28 -6.650 7.313 -12.152 259 HA LYS 28 HA LYS 28 -4.547 7.348 -14.263 260 HB2 LYS 28 1HB LYS 28 -4.497 9.709 -14.421 261 HB3 LYS 28 2HB LYS 28 -6.139 9.160 -14.691 262 HG2 LYS 28 1HG LYS 28 -6.517 11.001 -13.361 263 HG3 LYS 28 2HG LYS 28 -6.524 9.719 -12.166 264 HD2 LYS 28 1HD LYS 28 -3.829 10.457 -12.206 265 HD3 LYS 28 2HD LYS 28 -4.627 11.984 -12.578 266 HE2 LYS 28 1HE LYS 28 -6.020 11.774 -10.558 267 HE3 LYS 28 2HE LYS 28 -5.354 10.160 -10.249 268 HZ1 LYS 28 3HZ LYS 28 -4.246 11.869 -8.898 269 HZ2 LYS 28 1HZ LYS 28 -3.755 12.670 -10.233 270 HZ3 LYS 28 2HZ LYS 28 -3.179 11.173 -9.916 Start of MODEL 10 1 H1 LYS 1 1H LYS 1 12.953 -5.617 14.745 2 H2 LYS 1 2H LYS 1 14.369 -5.253 14.055 3 H3 LYS 1 3H LYS 1 13.075 -4.260 13.849 4 HA LYS 1 HA LYS 1 13.343 -7.015 12.791 5 HB2 LYS 1 1HB LYS 1 10.963 -5.127 12.812 6 HB3 LYS 1 2HB LYS 1 11.076 -6.445 11.660 7 HG2 LYS 1 1HG LYS 1 10.692 -8.078 13.133 8 HG3 LYS 1 2HG LYS 1 11.567 -7.328 14.455 9 HD2 LYS 1 1HD LYS 1 8.824 -6.364 13.528 10 HD3 LYS 1 2HD LYS 1 9.074 -7.592 14.780 11 HE2 LYS 1 1HE LYS 1 10.478 -5.972 16.075 12 HE3 LYS 1 2HE LYS 1 10.106 -4.719 14.879 13 HZ1 LYS 1 3HZ LYS 1 8.100 -6.124 16.561 14 HZ2 LYS 1 1HZ LYS 1 7.752 -4.962 15.464 15 HZ3 LYS 1 2HZ LYS 1 8.624 -4.599 16.796 16 H LYS 2 H LYS 2 15.176 -4.588 12.263 17 HA LYS 2 HA LYS 2 14.521 -3.381 9.815 18 HB2 LYS 2 1HB LYS 2 16.225 -2.596 11.457 19 HB3 LYS 2 2HB LYS 2 17.274 -3.939 11.009 20 HG2 LYS 2 1HG LYS 2 18.017 -1.888 9.948 21 HG3 LYS 2 2HG LYS 2 17.485 -3.032 8.717 22 HD2 LYS 2 1HD LYS 2 15.312 -1.813 8.539 23 HD3 LYS 2 2HD LYS 2 15.866 -0.658 9.770 24 HE2 LYS 2 1HE LYS 2 17.597 0.177 8.339 25 HE3 LYS 2 2HE LYS 2 17.448 -1.193 7.231 26 HZ1 LYS 2 3HZ LYS 2 16.367 0.787 6.333 27 HZ2 LYS 2 1HZ LYS 2 15.359 0.884 7.614 28 HZ3 LYS 2 2HZ LYS 2 15.259 -0.382 6.582 29 H LYS 3 H LYS 3 16.347 -6.364 10.324 30 HA LYS 3 HA LYS 3 17.001 -6.926 7.574 31 HB2 LYS 3 1HB LYS 3 18.075 -7.985 9.541 32 HB3 LYS 3 2HB LYS 3 16.574 -8.841 9.915 33 HG2 LYS 3 1HG LYS 3 16.703 -10.078 7.807 34 HG3 LYS 3 2HG LYS 3 18.124 -9.165 7.302 35 HD2 LYS 3 1HD LYS 3 18.453 -10.487 9.956 36 HD3 LYS 3 2HD LYS 3 18.065 -11.607 8.661 37 HE2 LYS 3 1HE LYS 3 20.436 -11.512 8.804 38 HE3 LYS 3 2HE LYS 3 19.948 -10.734 7.298 39 HZ1 LYS 3 3HZ LYS 3 20.715 -9.306 9.795 40 HZ2 LYS 3 1HZ LYS 3 20.287 -8.574 8.392 41 HZ3 LYS 3 2HZ LYS 3 21.652 -9.458 8.471 42 H ASN 4 H ASN 4 14.164 -7.794 9.494 43 HA ASN 4 HA ASN 4 12.959 -9.363 7.322 44 HB2 ASN 4 1HB ASN 4 13.003 -9.714 9.994 45 HB3 ASN 4 2HB ASN 4 11.509 -8.788 9.897 46 HD21 ASN 4 2HD2 ASN 4 10.119 -9.723 7.803 47 HD22 ASN 4 1HD2 ASN 4 9.919 -11.469 7.922 48 H TRP 5 H TRP 5 13.040 -6.098 7.811 49 HA TRP 5 HA TRP 5 10.406 -5.192 7.657 50 HB2 TRP 5 1HB TRP 5 12.732 -4.009 8.017 51 HB3 TRP 5 2HB TRP 5 12.642 -3.700 6.288 52 HD1 TRP 5 HD1 TRP 5 11.508 -1.440 5.777 53 HE1 TRP 5 HE1 TRP 5 9.904 0.172 6.996 54 HE3 TRP 5 HE3 TRP 5 10.574 -4.235 9.961 55 HZ2 TRP 5 HZ2 TRP 5 8.402 0.224 9.458 56 HZ3 TRP 5 HZ3 TRP 5 9.033 -3.389 11.728 57 HH2 TRP 5 HH2 TRP 5 7.949 -1.169 11.486 58 H PHE 6 H PHE 6 12.032 -6.808 5.172 59 HA PHE 6 HA PHE 6 10.689 -5.729 2.856 60 HB2 PHE 6 1HB PHE 6 12.756 -7.658 3.436 61 HB3 PHE 6 2HB PHE 6 11.560 -8.455 2.449 62 HD1 PHE 6 HD2 PHE 6 10.670 -7.022 0.364 63 HD2 PHE 6 HD1 PHE 6 14.446 -6.413 2.359 64 HE1 PHE 6 HE2 PHE 6 11.546 -5.850 -1.648 65 HE2 PHE 6 HE1 PHE 6 15.323 -5.257 0.344 66 HZ PHE 6 HZ PHE 6 13.874 -4.966 -1.657 67 H ASP 7 H ASP 7 9.257 -7.319 5.357 68 HA ASP 7 HA ASP 7 7.713 -9.362 4.293 69 HB2 ASP 7 1HB ASP 7 7.764 -7.765 6.721 70 HB3 ASP 7 2HB ASP 7 6.098 -7.995 6.238 71 H ILE 8 H ILE 8 6.832 -9.119 2.359 72 HA ILE 8 HA ILE 8 5.445 -6.913 1.319 73 HB ILE 8 HB ILE 8 4.616 -8.319 -0.447 74 HG12 ILE 8 1HG1 ILE 8 5.610 -10.718 1.159 75 HG13 ILE 8 2HG1 ILE 8 3.916 -10.293 0.878 76 HG21 ILE 8 1HG2 ILE 8 7.011 -7.552 -0.343 77 HG22 ILE 8 2HG2 ILE 8 7.457 -9.156 0.271 78 HG23 ILE 8 3HG2 ILE 8 6.751 -8.979 -1.347 79 HD11 ILE 8 3HD1 ILE 8 4.510 -12.046 -0.648 80 HD12 ILE 8 1HD1 ILE 8 4.269 -10.555 -1.580 81 HD13 ILE 8 2HD1 ILE 8 5.914 -11.151 -1.244 82 H THR 9 H THR 9 4.187 -9.244 3.534 83 HA THR 9 HA THR 9 1.379 -8.938 3.095 84 HB THR 9 HB THR 9 2.427 -10.666 4.520 85 HG1 THR 9 HG1 THR 9 0.772 -10.655 6.020 86 HG21 THR 9 3HG2 THR 9 2.599 -8.535 6.695 87 HG22 THR 9 1HG2 THR 9 4.000 -9.220 5.839 88 HG23 THR 9 2HG2 THR 9 2.978 -10.259 6.839 89 H ASN 10 H ASN 10 3.699 -6.830 4.742 90 HA ASN 10 HA ASN 10 1.600 -4.985 5.703 91 HB2 ASN 10 1HB ASN 10 4.393 -5.504 6.341 92 HB3 ASN 10 2HB ASN 10 4.227 -3.825 5.850 93 HD21 ASN 10 2HD2 ASN 10 2.501 -6.248 7.919 94 HD22 ASN 10 1HD2 ASN 10 2.152 -5.067 9.176 95 H TRP 11 H TRP 11 3.791 -5.241 2.920 96 HA TRP 11 HA TRP 11 3.490 -2.599 1.909 97 HB2 TRP 11 1HB TRP 11 4.074 -5.237 0.557 98 HB3 TRP 11 2HB TRP 11 3.897 -3.751 -0.328 99 HD1 TRP 11 HD1 TRP 11 6.108 -4.949 2.654 100 HE1 TRP 11 HE1 TRP 11 8.434 -3.896 2.386 101 HE3 TRP 11 HE3 TRP 11 5.184 -2.096 -1.434 102 HZ2 TRP 11 HZ2 TRP 11 9.758 -2.092 0.546 103 HZ3 TRP 11 HZ3 TRP 11 6.996 -0.693 -2.466 104 HH2 TRP 11 HH2 TRP 11 9.282 -0.699 -1.478 105 H LEU 12 H LEU 12 1.309 -5.362 1.747 106 HA LEU 12 HA LEU 12 -0.520 -4.516 -0.229 107 HB2 LEU 12 1HB LEU 12 -1.270 -5.860 2.390 108 HB3 LEU 12 2HB LEU 12 -2.177 -5.891 0.884 109 HG LEU 12 HG LEU 12 0.472 -7.255 1.450 110 HD11 LEU 12 1HD1 LEU 12 -0.799 -9.318 1.153 111 HD12 LEU 12 2HD1 LEU 12 -2.281 -8.382 0.848 112 HD13 LEU 12 3HD1 LEU 12 -1.497 -8.327 2.444 113 HD21 LEU 12 3HD2 LEU 12 0.262 -8.293 -0.781 114 HD22 LEU 12 1HD2 LEU 12 0.475 -6.547 -0.904 115 HD23 LEU 12 2HD2 LEU 12 -1.142 -7.255 -1.134 116 H TRP 13 H TRP 13 -0.089 -3.238 3.016 117 HA TRP 13 HA TRP 13 -2.616 -1.890 3.294 118 HB2 TRP 13 1HB TRP 13 -1.006 -2.394 5.119 119 HB3 TRP 13 2HB TRP 13 0.072 -1.153 4.504 120 HD1 TRP 13 HD1 TRP 13 -3.352 -1.555 6.178 121 HE1 TRP 13 HE1 TRP 13 -4.053 0.678 7.261 122 HE3 TRP 13 HE3 TRP 13 0.428 1.427 4.433 123 HZ2 TRP 13 HZ2 TRP 13 -3.095 3.390 7.358 124 HZ3 TRP 13 HZ3 TRP 13 0.498 3.844 5.022 125 HH2 TRP 13 HH2 TRP 13 -1.245 4.832 6.479 126 H TYR 14 H TYR 14 0.583 -0.653 2.195 127 HA TYR 14 HA TYR 14 -0.354 1.973 1.512 128 HB2 TYR 14 1HB TYR 14 1.972 0.450 0.284 129 HB3 TYR 14 2HB TYR 14 1.716 2.188 0.244 130 HD1 TYR 14 HD1 TYR 14 1.811 3.525 2.426 131 HD2 TYR 14 HD2 TYR 14 3.006 -0.598 2.128 132 HE1 TYR 14 HE1 TYR 14 3.084 3.734 4.572 133 HE2 TYR 14 HE2 TYR 14 4.250 -0.408 4.290 134 HH TYR 14 HH TYR 14 4.841 0.972 6.019 135 H ILE 15 H ILE 15 -0.280 -1.060 -0.292 136 HA ILE 15 HA ILE 15 -1.057 0.134 -2.856 137 HB ILE 15 HB ILE 15 -1.399 -2.750 -1.959 138 HG12 ILE 15 1HG1 ILE 15 0.956 -2.120 -1.902 139 HG13 ILE 15 2HG1 ILE 15 0.627 -3.259 -3.190 140 HG21 ILE 15 1HG2 ILE 15 -2.862 -2.347 -3.821 141 HG22 ILE 15 2HG2 ILE 15 -1.644 -1.386 -4.672 142 HG23 ILE 15 3HG2 ILE 15 -1.433 -3.148 -4.479 143 HD11 ILE 15 3HD1 ILE 15 1.068 -0.257 -3.554 144 HD12 ILE 15 1HD1 ILE 15 2.233 -1.543 -3.894 145 HD13 ILE 15 2HD1 ILE 15 0.756 -1.425 -4.863 146 H LYS 16 H LYS 16 -2.957 -1.529 -0.298 147 HA LYS 16 HA LYS 16 -5.529 -1.012 -1.498 148 HB2 LYS 16 1HB LYS 16 -5.157 -2.679 0.244 149 HB3 LYS 16 2HB LYS 16 -4.830 -1.412 1.440 150 HG2 LYS 16 1HG LYS 16 -7.086 -0.596 1.336 151 HG3 LYS 16 2HG LYS 16 -7.429 -1.497 -0.156 152 HD2 LYS 16 1HD LYS 16 -7.281 -3.620 1.017 153 HD3 LYS 16 2HD LYS 16 -6.839 -2.799 2.533 154 HE2 LYS 16 1HE LYS 16 -9.002 -1.618 2.554 155 HE3 LYS 16 2HE LYS 16 -9.441 -2.339 1.001 156 HZ1 LYS 16 3HZ LYS 16 -8.975 -3.877 3.502 157 HZ2 LYS 16 1HZ LYS 16 -9.418 -4.521 2.066 158 HZ3 LYS 16 2HZ LYS 16 -10.441 -3.539 2.869 159 H LEU 17 H LEU 17 -3.687 0.881 0.901 160 HA LEU 17 HA LEU 17 -5.534 3.024 1.149 161 HB2 LEU 17 1HB LEU 17 -3.738 2.594 2.734 162 HB3 LEU 17 2HB LEU 17 -2.519 3.027 1.540 163 HG LEU 17 HG LEU 17 -4.588 5.128 1.875 164 HD11 LEU 17 1HD1 LEU 17 -4.656 4.315 4.165 165 HD12 LEU 17 2HD1 LEU 17 -3.881 5.906 4.071 166 HD13 LEU 17 3HD1 LEU 17 -2.882 4.448 4.265 167 HD21 LEU 17 3HD2 LEU 17 -1.569 5.197 2.265 168 HD22 LEU 17 1HD2 LEU 17 -2.649 6.594 2.061 169 HD23 LEU 17 2HD2 LEU 17 -2.405 5.468 0.717 170 H PHE 18 H PHE 18 -3.017 2.511 -1.350 171 HA PHE 18 HA PHE 18 -3.029 5.036 -2.509 172 HB2 PHE 18 1HB PHE 18 -1.561 3.351 -3.343 173 HB3 PHE 18 2HB PHE 18 -2.896 2.342 -3.882 174 HD1 PHE 18 HD2 PHE 18 -2.266 6.062 -4.384 175 HD2 PHE 18 HD1 PHE 18 -2.855 2.181 -6.183 176 HE1 PHE 18 HE2 PHE 18 -2.115 7.080 -6.619 177 HE2 PHE 18 HE1 PHE 18 -2.791 3.223 -8.428 178 HZ PHE 18 HZ PHE 18 -2.388 5.696 -8.646 179 H ILE 19 H ILE 19 -5.515 2.493 -3.045 180 HA ILE 19 HA ILE 19 -7.157 4.067 -4.805 181 HB ILE 19 HB ILE 19 -7.928 1.764 -2.986 182 HG12 ILE 19 1HG1 ILE 19 -8.088 0.547 -5.263 183 HG13 ILE 19 2HG1 ILE 19 -7.126 1.861 -5.927 184 HG21 ILE 19 1HG2 ILE 19 -9.947 2.932 -3.462 185 HG22 ILE 19 2HG2 ILE 19 -9.467 3.243 -5.138 186 HG23 ILE 19 3HG2 ILE 19 -9.915 1.601 -4.607 187 HD11 ILE 19 3HD1 ILE 19 -5.892 -0.254 -5.317 188 HD12 ILE 19 1HD1 ILE 19 -5.223 1.204 -4.591 189 HD13 ILE 19 2HD1 ILE 19 -6.229 0.098 -3.612 190 H MET 20 H MET 20 -6.973 3.872 -1.272 191 HA MET 20 HA MET 20 -9.415 5.327 -0.702 192 HB2 MET 20 1HB MET 20 -6.950 4.869 1.022 193 HB3 MET 20 2HB MET 20 -8.470 5.532 1.589 194 HG2 MET 20 1HG MET 20 -8.375 2.820 0.219 195 HG3 MET 20 2HG MET 20 -7.980 2.991 1.920 196 HE1 MET 20 3HE MET 20 -11.178 3.761 3.742 197 HE2 MET 20 1HE MET 20 -9.661 2.838 3.795 198 HE3 MET 20 2HE MET 20 -9.620 4.585 3.490 199 H ILE 21 H ILE 21 -5.972 6.369 -0.853 200 HA ILE 21 HA ILE 21 -6.585 9.131 -0.263 201 HB ILE 21 HB ILE 21 -4.425 8.168 0.251 202 HG12 ILE 21 1HG1 ILE 21 -4.145 10.492 -1.702 203 HG13 ILE 21 2HG1 ILE 21 -4.757 10.629 -0.050 204 HG21 ILE 21 1HG2 ILE 21 -2.703 7.722 -1.397 205 HG22 ILE 21 2HG2 ILE 21 -4.114 6.755 -1.749 206 HG23 ILE 21 3HG2 ILE 21 -3.781 8.196 -2.731 207 HD11 ILE 21 3HD1 ILE 21 -1.944 9.798 -0.873 208 HD12 ILE 21 1HD1 ILE 21 -2.442 11.290 -0.066 209 HD13 ILE 21 2HD1 ILE 21 -2.563 9.743 0.797 210 H VAL 22 H VAL 22 -6.180 7.423 -3.394 211 HA VAL 22 HA VAL 22 -6.525 9.834 -4.990 212 HB VAL 22 HB VAL 22 -6.943 8.368 -6.873 213 HG11 VAL 22 1HG1 VAL 22 -4.839 7.217 -6.969 214 HG12 VAL 22 2HG1 VAL 22 -4.667 8.847 -6.275 215 HG13 VAL 22 3HG1 VAL 22 -4.629 7.404 -5.220 216 HG21 VAL 22 3HG2 VAL 22 -7.063 6.156 -4.893 217 HG22 VAL 22 1HG2 VAL 22 -8.250 6.589 -6.109 218 HG23 VAL 22 2HG2 VAL 22 -6.698 5.869 -6.592 219 H GLY 23 H GLY 23 -8.825 7.513 -3.654 220 HA2 GLY 23 1HA GLY 23 -11.048 7.184 -3.820 221 HA3 GLY 23 2HA GLY 23 -11.231 8.945 -3.796 222 H GLY 24 H GLY 24 -11.516 10.024 -5.744 223 HA2 GLY 24 1HA GLY 24 -12.857 8.603 -7.890 224 HA3 GLY 24 2HA GLY 24 -12.498 10.326 -7.842 225 H LEU 25 H LEU 25 -9.506 9.742 -7.526 226 HA LEU 25 HA LEU 25 -8.974 9.605 -10.404 227 HB2 LEU 25 1HB LEU 25 -6.694 9.661 -8.468 228 HB3 LEU 25 2HB LEU 25 -6.847 10.358 -10.044 229 HG LEU 25 HG LEU 25 -8.128 11.407 -7.500 230 HD11 LEU 25 1HD1 LEU 25 -5.837 12.478 -9.181 231 HD12 LEU 25 2HD1 LEU 25 -5.700 11.692 -7.591 232 HD13 LEU 25 3HD1 LEU 25 -6.536 13.246 -7.737 233 HD21 LEU 25 3HD2 LEU 25 -8.092 12.616 -10.309 234 HD22 LEU 25 1HD2 LEU 25 -8.711 13.410 -8.843 235 HD23 LEU 25 2HD2 LEU 25 -9.529 11.979 -9.482 236 H VAL 26 H VAL 26 -9.517 7.102 -8.375 237 HA VAL 26 HA VAL 26 -7.408 5.280 -8.647 238 HB VAL 26 HB VAL 26 -9.379 5.010 -7.182 239 HG11 VAL 26 1HG1 VAL 26 -10.890 3.918 -9.576 240 HG12 VAL 26 2HG1 VAL 26 -11.439 4.046 -7.898 241 HG13 VAL 26 3HG1 VAL 26 -11.189 5.516 -8.844 242 HG21 VAL 26 3HG2 VAL 26 -8.858 2.591 -8.941 243 HG22 VAL 26 1HG2 VAL 26 -7.839 3.159 -7.599 244 HG23 VAL 26 2HG2 VAL 26 -9.495 2.592 -7.292 245 H LYS 27 H LYS 27 -9.875 5.993 -11.003 246 HA LYS 27 HA LYS 27 -9.209 3.888 -12.914 247 HB2 LYS 27 1HB LYS 27 -10.901 6.403 -13.006 248 HB3 LYS 27 2HB LYS 27 -10.680 5.365 -14.422 249 HG2 LYS 27 1HG LYS 27 -11.678 3.470 -13.364 250 HG3 LYS 27 2HG LYS 27 -11.627 4.220 -11.769 251 HD2 LYS 27 1HD LYS 27 -13.890 4.217 -12.643 252 HD3 LYS 27 2HD LYS 27 -13.294 5.866 -12.396 253 HE2 LYS 27 1HE LYS 27 -12.818 6.071 -14.817 254 HE3 LYS 27 2HE LYS 27 -13.352 4.405 -15.079 255 HZ1 LYS 27 3HZ LYS 27 -15.107 6.026 -15.582 256 HZ2 LYS 27 1HZ LYS 27 -15.083 6.598 -14.055 257 HZ3 LYS 27 2HZ LYS 27 -15.574 5.066 -14.349 258 H LYS 28 H LYS 28 -7.509 6.622 -12.115 259 HA LYS 28 HA LYS 28 -5.979 8.021 -13.023 260 HB2 LYS 28 1HB LYS 28 -5.069 5.573 -14.546 261 HB3 LYS 28 2HB LYS 28 -4.126 7.002 -14.099 262 HG2 LYS 28 1HG LYS 28 -4.737 6.385 -11.630 263 HG3 LYS 28 2HG LYS 28 -5.213 4.810 -12.303 264 HD2 LYS 28 1HD LYS 28 -2.888 4.723 -13.382 265 HD3 LYS 28 2HD LYS 28 -2.497 6.164 -12.413 266 HE2 LYS 28 1HE LYS 28 -3.164 4.847 -10.353 267 HE3 LYS 28 2HE LYS 28 -3.371 3.424 -11.376 268 HZ1 LYS 28 3HZ LYS 28 -1.007 3.611 -11.988 269 HZ2 LYS 28 1HZ LYS 28 -1.158 3.442 -10.375 270 HZ3 LYS 28 2HZ LYS 28 -0.815 4.905 -11.011 Start of MODEL 11 1 H1 LYS 1 1H LYS 1 19.205 -9.459 10.912 2 H2 LYS 1 2H LYS 1 18.231 -9.370 9.614 3 H3 LYS 1 3H LYS 1 19.340 -8.194 9.895 4 HA LYS 1 HA LYS 1 17.047 -8.837 11.627 5 HB2 LYS 1 1HB LYS 1 19.352 -7.612 12.464 6 HB3 LYS 1 2HB LYS 1 18.401 -6.212 12.023 7 HG2 LYS 1 1HG LYS 1 17.230 -6.375 13.925 8 HG3 LYS 1 2HG LYS 1 16.638 -7.969 13.490 9 HD2 LYS 1 1HD LYS 1 19.261 -7.391 14.946 10 HD3 LYS 1 2HD LYS 1 17.749 -7.909 15.699 11 HE2 LYS 1 1HE LYS 1 17.820 -10.020 14.338 12 HE3 LYS 1 2HE LYS 1 19.396 -9.525 13.701 13 HZ1 LYS 1 3HZ LYS 1 20.247 -9.543 15.990 14 HZ2 LYS 1 1HZ LYS 1 19.652 -11.009 15.593 15 HZ3 LYS 1 2HZ LYS 1 18.795 -10.023 16.567 16 H LYS 2 H LYS 2 18.176 -6.104 9.548 17 HA LYS 2 HA LYS 2 15.905 -4.662 9.185 18 HB2 LYS 2 1HB LYS 2 18.322 -5.219 7.535 19 HB3 LYS 2 2HB LYS 2 16.971 -4.608 6.609 20 HG2 LYS 2 1HG LYS 2 17.990 -3.223 9.118 21 HG3 LYS 2 2HG LYS 2 18.589 -2.882 7.488 22 HD2 LYS 2 1HD LYS 2 16.274 -2.317 6.750 23 HD3 LYS 2 2HD LYS 2 15.694 -2.517 8.404 24 HE2 LYS 2 1HE LYS 2 17.820 -0.524 7.481 25 HE3 LYS 2 2HE LYS 2 16.116 -0.143 7.734 26 HZ1 LYS 2 3HZ LYS 2 17.434 0.456 9.669 27 HZ2 LYS 2 1HZ LYS 2 17.974 -1.068 9.862 28 HZ3 LYS 2 2HZ LYS 2 16.387 -0.723 10.083 29 H LYS 3 H LYS 3 16.380 -7.720 7.521 30 HA LYS 3 HA LYS 3 14.248 -7.696 5.674 31 HB2 LYS 3 1HB LYS 3 15.544 -9.920 7.268 32 HB3 LYS 3 2HB LYS 3 14.246 -10.259 6.129 33 HG2 LYS 3 1HG LYS 3 16.447 -8.516 5.075 34 HG3 LYS 3 2HG LYS 3 16.915 -10.165 5.454 35 HD2 LYS 3 1HD LYS 3 14.449 -9.629 3.756 36 HD3 LYS 3 2HD LYS 3 16.074 -9.586 3.053 37 HE2 LYS 3 1HE LYS 3 16.535 -11.865 3.887 38 HE3 LYS 3 2HE LYS 3 14.913 -11.957 4.585 39 HZ1 LYS 3 3HZ LYS 3 15.485 -11.613 1.685 40 HZ2 LYS 3 1HZ LYS 3 13.998 -11.785 2.344 41 HZ3 LYS 3 2HZ LYS 3 15.060 -13.022 2.385 42 H ASN 4 H ASN 4 13.923 -7.945 9.167 43 HA ASN 4 HA ASN 4 11.169 -8.888 9.175 44 HB2 ASN 4 1HB ASN 4 12.957 -7.502 11.211 45 HB3 ASN 4 2HB ASN 4 11.231 -7.673 11.501 46 HD21 ASN 4 2HD2 ASN 4 14.221 -9.553 10.994 47 HD22 ASN 4 1HD2 ASN 4 13.528 -11.027 11.679 48 H TRP 5 H TRP 5 12.602 -5.634 8.894 49 HA TRP 5 HA TRP 5 9.996 -4.270 8.974 50 HB2 TRP 5 1HB TRP 5 12.863 -3.484 8.872 51 HB3 TRP 5 2HB TRP 5 11.780 -2.450 7.968 52 HD1 TRP 5 HD1 TRP 5 11.110 -0.458 9.287 53 HE1 TRP 5 HE1 TRP 5 10.405 0.083 11.704 54 HE3 TRP 5 HE3 TRP 5 11.784 -5.085 11.423 55 HZ2 TRP 5 HZ2 TRP 5 10.045 -1.324 14.179 56 HZ3 TRP 5 HZ3 TRP 5 11.199 -5.460 13.797 57 HH2 TRP 5 HH2 TRP 5 10.322 -3.596 15.187 58 H PHE 6 H PHE 6 11.608 -6.067 6.635 59 HA PHE 6 HA PHE 6 10.438 -4.702 4.301 60 HB2 PHE 6 1HB PHE 6 12.758 -6.251 4.757 61 HB3 PHE 6 2HB PHE 6 11.743 -7.260 3.755 62 HD1 PHE 6 HD2 PHE 6 10.802 -6.214 1.555 63 HD2 PHE 6 HD1 PHE 6 13.950 -4.404 3.887 64 HE1 PHE 6 HE2 PHE 6 11.448 -4.818 -0.394 65 HE2 PHE 6 HE1 PHE 6 14.599 -3.019 1.932 66 HZ PHE 6 HZ PHE 6 13.346 -3.219 -0.209 67 H ASP 7 H ASP 7 8.895 -6.368 6.505 68 HA ASP 7 HA ASP 7 7.603 -8.553 5.232 69 HB2 ASP 7 1HB ASP 7 7.076 -6.813 7.614 70 HB3 ASP 7 2HB ASP 7 5.688 -7.653 6.957 71 H ILE 8 H ILE 8 7.068 -8.130 3.165 72 HA ILE 8 HA ILE 8 5.580 -6.017 2.114 73 HB ILE 8 HB ILE 8 5.043 -7.410 0.203 74 HG12 ILE 8 1HG1 ILE 8 6.229 -9.754 1.759 75 HG13 ILE 8 2HG1 ILE 8 4.513 -9.528 1.401 76 HG21 ILE 8 1HG2 ILE 8 7.293 -6.349 0.542 77 HG22 ILE 8 2HG2 ILE 8 7.899 -7.907 1.142 78 HG23 ILE 8 3HG2 ILE 8 7.318 -7.753 -0.526 79 HD11 ILE 8 3HD1 ILE 8 5.429 -11.106 -0.167 80 HD12 ILE 8 1HD1 ILE 8 5.002 -9.618 -1.035 81 HD13 ILE 8 2HD1 ILE 8 6.705 -9.982 -0.655 82 H THR 9 H THR 9 4.319 -8.599 4.027 83 HA THR 9 HA THR 9 1.559 -8.537 3.326 84 HB THR 9 HB THR 9 2.432 -10.263 4.732 85 HG1 THR 9 HG1 THR 9 0.849 -10.231 6.332 86 HG21 THR 9 3HG2 THR 9 4.127 -9.086 6.056 87 HG22 THR 9 1HG2 THR 9 3.000 -9.946 7.101 88 HG23 THR 9 2HG2 THR 9 2.857 -8.188 6.926 89 H ASN 10 H ASN 10 3.438 -6.299 5.361 90 HA ASN 10 HA ASN 10 1.045 -4.709 6.058 91 HB2 ASN 10 1HB ASN 10 3.908 -4.786 6.881 92 HB3 ASN 10 2HB ASN 10 3.266 -3.161 6.694 93 HD21 ASN 10 2HD2 ASN 10 3.765 -5.346 9.068 94 HD22 ASN 10 1HD2 ASN 10 2.388 -4.914 10.076 95 H TRP 11 H TRP 11 3.612 -4.609 3.599 96 HA TRP 11 HA TRP 11 3.165 -1.969 2.647 97 HB2 TRP 11 1HB TRP 11 4.189 -4.457 1.273 98 HB3 TRP 11 2HB TRP 11 3.977 -2.944 0.444 99 HD1 TRP 11 HD1 TRP 11 5.908 -4.123 3.621 100 HE1 TRP 11 HE1 TRP 11 8.122 -2.820 3.725 101 HE3 TRP 11 HE3 TRP 11 5.196 -1.079 -0.376 102 HZ2 TRP 11 HZ2 TRP 11 9.452 -0.755 2.196 103 HZ3 TRP 11 HZ3 TRP 11 6.953 0.571 -1.071 104 HH2 TRP 11 HH2 TRP 11 9.083 0.729 0.214 105 H LEU 12 H LEU 12 1.335 -4.931 2.075 106 HA LEU 12 HA LEU 12 -0.290 -4.149 -0.097 107 HB2 LEU 12 1HB LEU 12 -1.244 -5.728 2.319 108 HB3 LEU 12 2HB LEU 12 -1.927 -5.748 0.698 109 HG LEU 12 HG LEU 12 0.744 -6.882 1.569 110 HD11 LEU 12 1HD1 LEU 12 -1.744 -8.254 0.512 111 HD12 LEU 12 2HD1 LEU 12 -1.226 -8.198 2.214 112 HD13 LEU 12 3HD1 LEU 12 -0.229 -9.035 1.013 113 HD21 LEU 12 3HD2 LEU 12 0.965 -7.789 -0.714 114 HD22 LEU 12 1HD2 LEU 12 0.989 -6.025 -0.728 115 HD23 LEU 12 2HD2 LEU 12 -0.489 -6.891 -1.217 116 H TRP 13 H TRP 13 -0.466 -3.068 3.253 117 HA TRP 13 HA TRP 13 -3.139 -2.009 3.224 118 HB2 TRP 13 1HB TRP 13 -1.757 -2.445 5.241 119 HB3 TRP 13 2HB TRP 13 -0.747 -1.065 4.843 120 HD1 TRP 13 HD1 TRP 13 -4.306 -1.915 5.989 121 HE1 TRP 13 HE1 TRP 13 -5.394 0.168 7.048 122 HE3 TRP 13 HE3 TRP 13 -0.671 1.535 4.934 123 HZ2 TRP 13 HZ2 TRP 13 -4.771 2.960 7.383 124 HZ3 TRP 13 HZ3 TRP 13 -0.956 3.911 5.620 125 HH2 TRP 13 HH2 TRP 13 -2.987 4.631 6.840 126 H TYR 14 H TYR 14 0.012 -0.365 2.653 127 HA TYR 14 HA TYR 14 -1.115 2.181 1.961 128 HB2 TYR 14 1HB TYR 14 1.511 0.997 0.994 129 HB3 TYR 14 2HB TYR 14 1.065 2.695 1.015 130 HD1 TYR 14 HD1 TYR 14 0.736 3.886 3.255 131 HD2 TYR 14 HD2 TYR 14 2.395 -0.067 2.909 132 HE1 TYR 14 HE1 TYR 14 1.671 4.074 5.566 133 HE2 TYR 14 HE2 TYR 14 3.316 0.101 5.228 134 HH TYR 14 HH TYR 14 3.534 1.419 7.087 135 H ILE 15 H ILE 15 -0.484 -0.722 0.056 136 HA ILE 15 HA ILE 15 -1.021 0.534 -2.535 137 HB ILE 15 HB ILE 15 -1.161 -2.414 -1.821 138 HG12 ILE 15 1HG1 ILE 15 1.076 -1.544 -1.413 139 HG13 ILE 15 2HG1 ILE 15 1.058 -2.627 -2.786 140 HG21 ILE 15 1HG2 ILE 15 -2.405 -2.045 -3.851 141 HG22 ILE 15 2HG2 ILE 15 -1.170 -0.948 -4.492 142 HG23 ILE 15 3HG2 ILE 15 -0.831 -2.691 -4.322 143 HD11 ILE 15 3HD1 ILE 15 2.538 -0.705 -3.167 144 HD12 ILE 15 1HD1 ILE 15 1.205 -0.687 -4.333 145 HD13 ILE 15 2HD1 ILE 15 1.195 0.423 -2.939 146 H LYS 16 H LYS 16 -3.067 -1.480 -0.375 147 HA LYS 16 HA LYS 16 -5.498 -1.100 -1.905 148 HB2 LYS 16 1HB LYS 16 -4.856 -2.007 0.891 149 HB3 LYS 16 2HB LYS 16 -6.515 -1.544 0.527 150 HG2 LYS 16 1HG LYS 16 -6.943 -3.362 -0.704 151 HG3 LYS 16 2HG LYS 16 -5.430 -3.261 -1.606 152 HD2 LYS 16 1HD LYS 16 -4.204 -4.389 0.118 153 HD3 LYS 16 2HD LYS 16 -5.616 -4.397 1.205 154 HE2 LYS 16 1HE LYS 16 -6.864 -5.812 -0.349 155 HE3 LYS 16 2HE LYS 16 -5.576 -5.708 -1.554 156 HZ1 LYS 16 3HZ LYS 16 -5.246 -6.968 1.119 157 HZ2 LYS 16 1HZ LYS 16 -4.132 -6.949 -0.085 158 HZ3 LYS 16 2HZ LYS 16 -5.514 -7.792 -0.263 159 H LEU 17 H LEU 17 -4.165 0.794 0.801 160 HA LEU 17 HA LEU 17 -6.254 2.727 0.880 161 HB2 LEU 17 1HB LEU 17 -4.652 2.389 2.678 162 HB3 LEU 17 2HB LEU 17 -3.339 3.017 1.688 163 HG LEU 17 HG LEU 17 -5.651 4.866 1.812 164 HD11 LEU 17 1HD1 LEU 17 -5.357 5.578 4.126 165 HD12 LEU 17 2HD1 LEU 17 -4.241 4.220 4.399 166 HD13 LEU 17 3HD1 LEU 17 -5.958 3.913 4.030 167 HD21 LEU 17 3HD2 LEU 17 -3.928 6.507 2.368 168 HD22 LEU 17 1HD2 LEU 17 -3.391 5.510 1.007 169 HD23 LEU 17 2HD2 LEU 17 -2.742 5.211 2.639 170 H PHE 18 H PHE 18 -3.377 2.609 -1.268 171 HA PHE 18 HA PHE 18 -3.528 5.179 -2.319 172 HB2 PHE 18 1HB PHE 18 -1.760 3.724 -2.988 173 HB3 PHE 18 2HB PHE 18 -2.870 2.597 -3.749 174 HD1 PHE 18 HD1 PHE 18 -2.713 6.382 -4.089 175 HD2 PHE 18 HD2 PHE 18 -2.352 2.526 -5.999 176 HE1 PHE 18 HE1 PHE 18 -2.366 7.493 -6.262 177 HE2 PHE 18 HE2 PHE 18 -2.052 3.654 -8.193 178 HZ PHE 18 HZ PHE 18 -2.047 6.141 -8.324 179 H ILE 19 H ILE 19 -5.702 2.455 -3.144 180 HA ILE 19 HA ILE 19 -7.191 3.991 -5.119 181 HB ILE 19 HB ILE 19 -7.954 1.477 -3.592 182 HG12 ILE 19 1HG1 ILE 19 -7.627 0.417 -5.933 183 HG13 ILE 19 2HG1 ILE 19 -6.718 1.863 -6.353 184 HG21 ILE 19 1HG2 ILE 19 -9.321 2.960 -5.845 185 HG22 ILE 19 2HG2 ILE 19 -9.634 1.232 -5.537 186 HG23 ILE 19 3HG2 ILE 19 -10.001 2.425 -4.302 187 HD11 ILE 19 3HD1 ILE 19 -6.015 0.031 -4.025 188 HD12 ILE 19 1HD1 ILE 19 -5.378 -0.162 -5.668 189 HD13 ILE 19 2HD1 ILE 19 -4.993 1.299 -4.763 190 H MET 20 H MET 20 -7.430 3.605 -1.625 191 HA MET 20 HA MET 20 -10.111 4.693 -1.312 192 HB2 MET 20 1HB MET 20 -7.838 4.406 0.691 193 HB3 MET 20 2HB MET 20 -9.487 4.842 1.092 194 HG2 MET 20 1HG MET 20 -8.850 2.257 -0.379 195 HG3 MET 20 2HG MET 20 -8.732 2.373 1.366 196 HE1 MET 20 3HE MET 20 -10.522 2.456 3.013 197 HE2 MET 20 1HE MET 20 -11.154 4.020 2.456 198 HE3 MET 20 2HE MET 20 -12.261 2.651 2.694 199 H ILE 21 H ILE 21 -6.835 6.097 -0.873 200 HA ILE 21 HA ILE 21 -7.736 8.725 -0.159 201 HB ILE 21 HB ILE 21 -5.534 7.900 0.409 202 HG12 ILE 21 1HG1 ILE 21 -5.382 10.404 -1.330 203 HG13 ILE 21 2HG1 ILE 21 -6.023 10.335 0.315 204 HG21 ILE 21 1HG2 ILE 21 -5.042 6.720 -1.759 205 HG22 ILE 21 2HG2 ILE 21 -4.648 8.290 -2.480 206 HG23 ILE 21 3HG2 ILE 21 -3.708 7.647 -1.113 207 HD11 ILE 21 3HD1 ILE 21 -3.145 9.809 -0.533 208 HD12 ILE 21 1HD1 ILE 21 -3.765 11.182 0.392 209 HD13 ILE 21 2HD1 ILE 21 -3.772 9.559 1.117 210 H VAL 22 H VAL 22 -6.851 7.385 -3.354 211 HA VAL 22 HA VAL 22 -7.302 9.856 -4.802 212 HB VAL 22 HB VAL 22 -7.281 8.477 -6.819 213 HG11 VAL 22 1HG1 VAL 22 -5.050 7.566 -6.659 214 HG12 VAL 22 2HG1 VAL 22 -5.171 9.173 -5.899 215 HG13 VAL 22 3HG1 VAL 22 -5.103 7.697 -4.896 216 HG21 VAL 22 3HG2 VAL 22 -7.412 6.156 -4.956 217 HG22 VAL 22 1HG2 VAL 22 -8.441 6.513 -6.330 218 HG23 VAL 22 2HG2 VAL 22 -6.756 6.000 -6.582 219 H GLY 23 H GLY 23 -9.440 7.185 -3.942 220 HA2 GLY 23 1HA GLY 23 -11.553 6.588 -4.454 221 HA3 GLY 23 2HA GLY 23 -11.977 8.307 -4.383 222 H GLY 24 H GLY 24 -12.074 9.474 -6.320 223 HA2 GLY 24 1HA GLY 24 -12.857 8.007 -8.712 224 HA3 GLY 24 2HA GLY 24 -12.787 9.755 -8.530 225 H LEU 25 H LEU 25 -9.828 9.614 -7.751 226 HA LEU 25 HA LEU 25 -8.835 9.766 -10.499 227 HB2 LEU 25 1HB LEU 25 -6.907 9.972 -8.224 228 HB3 LEU 25 2HB LEU 25 -6.935 10.783 -9.758 229 HG LEU 25 HG LEU 25 -8.738 11.402 -7.393 230 HD11 LEU 25 1HD1 LEU 25 -7.412 13.444 -7.205 231 HD12 LEU 25 2HD1 LEU 25 -6.382 12.919 -8.558 232 HD13 LEU 25 3HD1 LEU 25 -6.397 12.003 -7.033 233 HD21 LEU 25 3HD2 LEU 25 -8.420 12.881 -10.048 234 HD22 LEU 25 1HD2 LEU 25 -9.390 13.423 -8.659 235 HD23 LEU 25 2HD2 LEU 25 -9.859 11.968 -9.547 236 H VAL 26 H VAL 26 -9.270 7.096 -8.652 237 HA VAL 26 HA VAL 26 -6.981 5.510 -8.719 238 HB VAL 26 HB VAL 26 -9.147 4.912 -7.665 239 HG11 VAL 26 1HG1 VAL 26 -10.687 5.426 -9.563 240 HG12 VAL 26 2HG1 VAL 26 -10.082 3.976 -10.402 241 HG13 VAL 26 3HG1 VAL 26 -10.926 3.827 -8.852 242 HG21 VAL 26 3HG2 VAL 26 -8.999 2.518 -8.000 243 HG22 VAL 26 1HG2 VAL 26 -8.084 2.734 -9.493 244 HG23 VAL 26 2HG2 VAL 26 -7.379 3.250 -7.945 245 H LYS 27 H LYS 27 -9.028 6.309 -11.391 246 HA LYS 27 HA LYS 27 -8.231 4.310 -13.243 247 HB2 LYS 27 1HB LYS 27 -10.180 6.187 -13.184 248 HB3 LYS 27 2HB LYS 27 -9.043 7.024 -14.248 249 HG2 LYS 27 1HG LYS 27 -8.998 4.953 -15.698 250 HG3 LYS 27 2HG LYS 27 -10.188 4.213 -14.609 251 HD2 LYS 27 1HD LYS 27 -11.851 5.916 -15.178 252 HD3 LYS 27 2HD LYS 27 -10.644 6.840 -16.081 253 HE2 LYS 27 1HE LYS 27 -11.977 5.690 -17.692 254 HE3 LYS 27 2HE LYS 27 -10.375 4.951 -17.676 255 HZ1 LYS 27 3HZ LYS 27 -11.311 3.151 -16.295 256 HZ2 LYS 27 1HZ LYS 27 -12.111 3.267 -17.709 257 HZ3 LYS 27 2HZ LYS 27 -12.795 3.842 -16.345 258 H LYS 28 H LYS 28 -6.441 7.024 -12.209 259 HA LYS 28 HA LYS 28 -4.566 8.170 -12.998 260 HB2 LYS 28 1HB LYS 28 -3.993 5.234 -12.747 261 HB3 LYS 28 2HB LYS 28 -2.707 6.256 -13.352 262 HG2 LYS 28 1HG LYS 28 -4.118 7.223 -10.882 263 HG3 LYS 28 2HG LYS 28 -3.103 5.797 -10.714 264 HD2 LYS 28 1HD LYS 28 -2.093 8.361 -12.013 265 HD3 LYS 28 2HD LYS 28 -1.971 8.051 -10.274 266 HE2 LYS 28 1HE LYS 28 -0.639 6.046 -10.635 267 HE3 LYS 28 2HE LYS 28 -0.858 6.148 -12.383 268 HZ1 LYS 28 3HZ LYS 28 1.298 7.023 -11.707 269 HZ2 LYS 28 1HZ LYS 28 0.609 8.152 -10.753 270 HZ3 LYS 28 2HZ LYS 28 0.413 8.216 -12.376 Start of MODEL 12 1 H1 LYS 1 1H LYS 1 13.766 -8.519 14.796 2 H2 LYS 1 2H LYS 1 13.797 -7.052 14.077 3 H3 LYS 1 3H LYS 1 12.948 -8.269 13.395 4 HA LYS 1 HA LYS 1 15.874 -8.119 13.682 5 HB2 LYS 1 1HB LYS 1 16.039 -10.216 12.418 6 HB3 LYS 1 2HB LYS 1 15.271 -10.415 13.987 7 HG2 LYS 1 1HG LYS 1 13.054 -10.525 12.936 8 HG3 LYS 1 2HG LYS 1 13.765 -10.268 11.338 9 HD2 LYS 1 1HD LYS 1 14.476 -12.416 11.133 10 HD3 LYS 1 2HD LYS 1 14.978 -12.535 12.827 11 HE2 LYS 1 1HE LYS 1 12.624 -12.773 13.536 12 HE3 LYS 1 2HE LYS 1 12.090 -12.668 11.854 13 HZ1 LYS 1 3HZ LYS 1 13.883 -14.787 12.926 14 HZ2 LYS 1 1HZ LYS 1 13.315 -14.713 11.394 15 HZ3 LYS 1 2HZ LYS 1 12.291 -14.979 12.635 16 H LYS 2 H LYS 2 17.035 -7.425 11.932 17 HA LYS 2 HA LYS 2 15.782 -5.668 10.110 18 HB2 LYS 2 1HB LYS 2 18.247 -5.780 10.955 19 HB3 LYS 2 2HB LYS 2 18.512 -6.912 9.635 20 HG2 LYS 2 1HG LYS 2 19.190 -4.782 8.863 21 HG3 LYS 2 2HG LYS 2 17.660 -5.097 8.042 22 HD2 LYS 2 1HD LYS 2 16.480 -3.651 9.695 23 HD3 LYS 2 2HD LYS 2 17.995 -3.367 10.552 24 HE2 LYS 2 1HE LYS 2 17.452 -2.603 7.644 25 HE3 LYS 2 2HE LYS 2 17.239 -1.517 9.018 26 HZ1 LYS 2 3HZ LYS 2 19.398 -1.175 8.009 27 HZ2 LYS 2 1HZ LYS 2 19.826 -2.734 8.212 28 HZ3 LYS 2 2HZ LYS 2 19.615 -1.764 9.513 29 H LYS 3 H LYS 3 16.552 -9.045 9.633 30 HA LYS 3 HA LYS 3 16.106 -9.314 6.822 31 HB2 LYS 3 1HB LYS 3 15.727 -11.195 9.182 32 HB3 LYS 3 2HB LYS 3 15.388 -11.712 7.527 33 HG2 LYS 3 1HG LYS 3 17.637 -11.403 6.813 34 HG3 LYS 3 2HG LYS 3 18.060 -10.465 8.243 35 HD2 LYS 3 1HD LYS 3 19.032 -12.689 8.405 36 HD3 LYS 3 2HD LYS 3 17.859 -12.411 9.683 37 HE2 LYS 3 1HE LYS 3 17.575 -14.652 8.930 38 HE3 LYS 3 2HE LYS 3 16.161 -13.739 8.405 39 HZ1 LYS 3 3HZ LYS 3 17.146 -13.633 6.173 40 HZ2 LYS 3 1HZ LYS 3 17.051 -15.189 6.650 41 HZ3 LYS 3 2HZ LYS 3 18.488 -14.424 6.677 42 H ASN 4 H ASN 4 13.750 -8.708 9.313 43 HA ASN 4 HA ASN 4 11.485 -9.329 7.492 44 HB2 ASN 4 1HB ASN 4 11.752 -10.091 10.002 45 HB3 ASN 4 2HB ASN 4 11.255 -8.443 10.377 46 HD21 ASN 4 2HD2 ASN 4 10.301 -11.343 8.432 47 HD22 ASN 4 1HD2 ASN 4 8.582 -11.083 8.689 48 H TRP 5 H TRP 5 13.449 -6.663 7.981 49 HA TRP 5 HA TRP 5 11.598 -4.516 8.328 50 HB2 TRP 5 1HB TRP 5 14.071 -4.445 8.659 51 HB3 TRP 5 2HB TRP 5 14.287 -4.525 6.910 52 HD1 TRP 5 HD1 TRP 5 14.373 -2.283 5.686 53 HE1 TRP 5 HE1 TRP 5 13.875 0.180 6.265 54 HE3 TRP 5 HE3 TRP 5 12.346 -2.930 10.348 55 HZ2 TRP 5 HZ2 TRP 5 12.719 1.663 8.445 56 HZ3 TRP 5 HZ3 TRP 5 11.541 -0.968 11.653 57 HH2 TRP 5 HH2 TRP 5 11.719 1.323 10.713 58 H PHE 6 H PHE 6 12.454 -6.319 5.455 59 HA PHE 6 HA PHE 6 11.025 -4.467 3.649 60 HB2 PHE 6 1HB PHE 6 13.305 -6.057 3.362 61 HB3 PHE 6 2HB PHE 6 12.100 -6.935 2.455 62 HD1 PHE 6 HD2 PHE 6 10.733 -5.598 0.667 63 HD2 PHE 6 HD1 PHE 6 14.299 -4.079 2.554 64 HE1 PHE 6 HE2 PHE 6 10.979 -3.916 -1.150 65 HE2 PHE 6 HE1 PHE 6 14.553 -2.406 0.729 66 HZ PHE 6 HZ PHE 6 12.890 -2.321 -1.122 67 H ASP 7 H ASP 7 9.554 -6.007 5.703 68 HA ASP 7 HA ASP 7 8.053 -8.145 4.640 69 HB2 ASP 7 1HB ASP 7 6.460 -7.673 6.464 70 HB3 ASP 7 2HB ASP 7 8.116 -7.908 6.952 71 H ILE 8 H ILE 8 7.444 -7.687 2.541 72 HA ILE 8 HA ILE 8 5.833 -5.630 1.611 73 HB ILE 8 HB ILE 8 5.074 -7.102 -0.186 74 HG12 ILE 8 1HG1 ILE 8 6.657 -9.336 1.149 75 HG13 ILE 8 2HG1 ILE 8 4.897 -9.202 1.248 76 HG21 ILE 8 1HG2 ILE 8 7.279 -7.396 -1.177 77 HG22 ILE 8 2HG2 ILE 8 7.258 -5.913 -0.220 78 HG23 ILE 8 3HG2 ILE 8 8.052 -7.365 0.420 79 HD11 ILE 8 3HD1 ILE 8 4.696 -9.355 -1.195 80 HD12 ILE 8 1HD1 ILE 8 6.463 -9.533 -1.339 81 HD13 ILE 8 2HD1 ILE 8 5.511 -10.770 -0.501 82 H THR 9 H THR 9 4.732 -8.096 3.790 83 HA THR 9 HA THR 9 1.917 -8.093 3.274 84 HB THR 9 HB THR 9 1.820 -8.619 5.800 85 HG1 THR 9 HG1 THR 9 3.727 -7.796 6.540 86 HG21 THR 9 3HG2 THR 9 3.595 -10.347 4.024 87 HG22 THR 9 1HG2 THR 9 1.816 -10.385 4.093 88 HG23 THR 9 2HG2 THR 9 2.766 -10.865 5.510 89 H ASN 10 H ASN 10 4.011 -5.794 4.931 90 HA ASN 10 HA ASN 10 1.758 -4.157 5.921 91 HB2 ASN 10 1HB ASN 10 4.789 -3.867 6.069 92 HB3 ASN 10 2HB ASN 10 3.644 -2.704 6.735 93 HD21 ASN 10 2HD2 ASN 10 3.211 -2.997 8.912 94 HD22 ASN 10 1HD2 ASN 10 3.301 -4.571 9.696 95 H TRP 11 H TRP 11 3.988 -4.200 3.154 96 HA TRP 11 HA TRP 11 3.496 -1.549 2.208 97 HB2 TRP 11 1HB TRP 11 4.351 -4.088 0.802 98 HB3 TRP 11 2HB TRP 11 4.090 -2.587 -0.033 99 HD1 TRP 11 HD1 TRP 11 6.282 -3.713 2.996 100 HE1 TRP 11 HE1 TRP 11 8.541 -2.504 2.819 101 HE3 TRP 11 HE3 TRP 11 5.297 -0.819 -1.060 102 HZ2 TRP 11 HZ2 TRP 11 9.795 -0.568 1.072 103 HZ3 TRP 11 HZ3 TRP 11 7.042 0.717 -2.000 104 HH2 TRP 11 HH2 TRP 11 9.292 0.840 -0.936 105 H LEU 12 H LEU 12 1.612 -4.513 1.958 106 HA LEU 12 HA LEU 12 -0.232 -3.875 -0.066 107 HB2 LEU 12 1HB LEU 12 -0.948 -5.244 2.544 108 HB3 LEU 12 2HB LEU 12 -1.762 -5.415 0.990 109 HG LEU 12 HG LEU 12 0.974 -6.446 1.761 110 HD11 LEU 12 1HD1 LEU 12 -0.897 -7.714 2.686 111 HD12 LEU 12 2HD1 LEU 12 -0.013 -8.657 1.475 112 HD13 LEU 12 3HD1 LEU 12 -1.576 -7.920 1.055 113 HD21 LEU 12 3HD2 LEU 12 1.084 -7.566 -0.414 114 HD22 LEU 12 1HD2 LEU 12 1.028 -5.817 -0.629 115 HD23 LEU 12 2HD2 LEU 12 -0.439 -6.786 -0.913 116 H TRP 13 H TRP 13 -0.021 -2.535 3.176 117 HA TRP 13 HA TRP 13 -2.671 -1.425 3.367 118 HB2 TRP 13 1HB TRP 13 -1.078 -1.760 5.249 119 HB3 TRP 13 2HB TRP 13 -0.103 -0.429 4.651 120 HD1 TRP 13 HD1 TRP 13 -3.504 -1.148 6.255 121 HE1 TRP 13 HE1 TRP 13 -4.450 1.023 7.288 122 HE3 TRP 13 HE3 TRP 13 -0.012 2.180 4.532 123 HZ2 TRP 13 HZ2 TRP 13 -3.801 3.825 7.316 124 HZ3 TRP 13 HZ3 TRP 13 -0.206 4.602 5.074 125 HH2 TRP 13 HH2 TRP 13 -2.083 5.431 6.464 126 H TYR 14 H TYR 14 0.435 0.120 2.399 127 HA TYR 14 HA TYR 14 -0.715 2.625 1.622 128 HB2 TYR 14 1HB TYR 14 1.800 1.322 0.522 129 HB3 TYR 14 2HB TYR 14 1.379 3.026 0.448 130 HD1 TYR 14 HD2 TYR 14 1.274 4.395 2.602 131 HD2 TYR 14 HD1 TYR 14 2.846 0.392 2.432 132 HE1 TYR 14 HE2 TYR 14 2.418 4.754 4.788 133 HE2 TYR 14 HE1 TYR 14 3.978 0.737 4.640 134 HH TYR 14 HH TYR 14 3.736 3.837 6.418 135 H ILE 15 H ILE 15 -0.239 -0.406 -0.134 136 HA ILE 15 HA ILE 15 -0.978 0.676 -2.747 137 HB ILE 15 HB ILE 15 -1.056 -2.211 -1.809 138 HG12 ILE 15 1HG1 ILE 15 1.203 -1.209 -1.687 139 HG13 ILE 15 2HG1 ILE 15 1.082 -2.519 -2.841 140 HG21 ILE 15 1HG2 ILE 15 -0.925 -2.656 -4.323 141 HG22 ILE 15 2HG2 ILE 15 -2.469 -2.025 -3.740 142 HG23 ILE 15 3HG2 ILE 15 -1.341 -0.935 -4.560 143 HD11 ILE 15 3HD1 ILE 15 1.099 0.445 -3.586 144 HD12 ILE 15 1HD1 ILE 15 2.494 -0.644 -3.641 145 HD13 ILE 15 2HD1 ILE 15 1.117 -0.933 -4.716 146 H LYS 16 H LYS 16 -2.853 -1.140 -0.287 147 HA LYS 16 HA LYS 16 -5.390 -0.885 -1.651 148 HB2 LYS 16 1HB LYS 16 -5.020 -2.514 0.107 149 HB3 LYS 16 2HB LYS 16 -4.763 -1.256 1.311 150 HG2 LYS 16 1HG LYS 16 -7.357 -1.171 -0.224 151 HG3 LYS 16 2HG LYS 16 -7.153 -2.530 0.867 152 HD2 LYS 16 1HD LYS 16 -6.712 0.329 1.822 153 HD3 LYS 16 2HD LYS 16 -8.312 -0.427 1.799 154 HE2 LYS 16 1HE LYS 16 -7.603 -2.209 3.265 155 HE3 LYS 16 2HE LYS 16 -5.912 -1.707 3.174 156 HZ1 LYS 16 3HZ LYS 16 -8.083 -0.069 4.377 157 HZ2 LYS 16 1HZ LYS 16 -6.493 0.329 4.347 158 HZ3 LYS 16 2HZ LYS 16 -7.005 -0.948 5.224 159 H LEU 17 H LEU 17 -3.855 1.188 0.806 160 HA LEU 17 HA LEU 17 -5.912 3.138 0.951 161 HB2 LEU 17 1HB LEU 17 -4.150 2.897 2.612 162 HB3 LEU 17 2HB LEU 17 -2.934 3.451 1.468 163 HG LEU 17 HG LEU 17 -5.214 5.331 1.693 164 HD11 LEU 17 1HD1 LEU 17 -3.581 4.818 4.175 165 HD12 LEU 17 2HD1 LEU 17 -5.326 4.517 3.980 166 HD13 LEU 17 3HD1 LEU 17 -4.702 6.176 3.921 167 HD21 LEU 17 3HD2 LEU 17 -3.022 5.886 0.648 168 HD22 LEU 17 1HD2 LEU 17 -2.243 5.697 2.239 169 HD23 LEU 17 2HD2 LEU 17 -3.443 6.982 1.974 170 H PHE 18 H PHE 18 -3.251 2.864 -1.431 171 HA PHE 18 HA PHE 18 -3.465 5.358 -2.634 172 HB2 PHE 18 1HB PHE 18 -1.800 3.816 -3.368 173 HB3 PHE 18 2HB PHE 18 -2.997 2.666 -3.937 174 HD1 PHE 18 HD2 PHE 18 -2.870 6.415 -4.555 175 HD2 PHE 18 HD1 PHE 18 -2.621 2.429 -6.208 176 HE1 PHE 18 HE2 PHE 18 -2.710 7.361 -6.830 177 HE2 PHE 18 HE1 PHE 18 -2.510 3.393 -8.494 178 HZ PHE 18 HZ PHE 18 -2.544 5.861 -8.807 179 H ILE 19 H ILE 19 -5.669 2.578 -3.207 180 HA ILE 19 HA ILE 19 -7.380 3.988 -5.056 181 HB ILE 19 HB ILE 19 -7.983 1.592 -3.291 182 HG12 ILE 19 1HG1 ILE 19 -7.880 0.387 -5.591 183 HG13 ILE 19 2HG1 ILE 19 -6.996 1.795 -6.166 184 HG21 ILE 19 1HG2 ILE 19 -10.088 2.521 -3.876 185 HG22 ILE 19 2HG2 ILE 19 -9.555 2.906 -5.519 186 HG23 ILE 19 3HG2 ILE 19 -9.843 1.217 -5.026 187 HD11 ILE 19 3HD1 ILE 19 -6.120 0.092 -3.798 188 HD12 ILE 19 1HD1 ILE 19 -5.623 -0.207 -5.474 189 HD13 ILE 19 2HD1 ILE 19 -5.152 1.300 -4.692 190 H MET 20 H MET 20 -7.314 3.781 -1.527 191 HA MET 20 HA MET 20 -9.940 4.924 -1.054 192 HB2 MET 20 1HB MET 20 -7.519 4.723 0.774 193 HB3 MET 20 2HB MET 20 -9.131 5.189 1.284 194 HG2 MET 20 1HG MET 20 -8.675 2.541 -0.132 195 HG3 MET 20 2HG MET 20 -8.348 2.710 1.582 196 HE1 MET 20 3HE MET 20 -11.641 2.955 3.341 197 HE2 MET 20 1HE MET 20 -10.072 2.122 3.353 198 HE3 MET 20 2HE MET 20 -10.131 3.891 3.216 199 H ILE 21 H ILE 21 -6.640 6.354 -1.055 200 HA ILE 21 HA ILE 21 -7.574 9.013 -0.430 201 HB ILE 21 HB ILE 21 -5.333 8.262 0.121 202 HG12 ILE 21 1HG1 ILE 21 -5.195 10.665 -1.745 203 HG13 ILE 21 2HG1 ILE 21 -5.984 10.696 -0.165 204 HG21 ILE 21 1HG2 ILE 21 -3.522 8.091 -1.491 205 HG22 ILE 21 2HG2 ILE 21 -4.794 6.978 -1.932 206 HG23 ILE 21 3HG2 ILE 21 -4.606 8.487 -2.840 207 HD11 ILE 21 3HD1 ILE 21 -3.028 10.150 -0.663 208 HD12 ILE 21 1HD1 ILE 21 -3.751 11.605 0.037 209 HD13 ILE 21 2HD1 ILE 21 -3.834 10.070 0.923 210 H VAL 22 H VAL 22 -6.884 7.433 -3.564 211 HA VAL 22 HA VAL 22 -7.444 9.816 -5.138 212 HB VAL 22 HB VAL 22 -7.617 8.325 -7.056 213 HG11 VAL 22 1HG1 VAL 22 -5.426 9.064 -6.372 214 HG12 VAL 22 2HG1 VAL 22 -5.261 7.638 -5.311 215 HG13 VAL 22 3HG1 VAL 22 -5.376 7.426 -7.064 216 HG21 VAL 22 3HG2 VAL 22 -7.055 5.865 -6.737 217 HG22 VAL 22 1HG2 VAL 22 -7.562 6.111 -5.072 218 HG23 VAL 22 2HG2 VAL 22 -8.713 6.388 -6.366 219 H GLY 23 H GLY 23 -9.495 7.203 -3.940 220 HA2 GLY 23 1HA GLY 23 -11.650 6.599 -4.214 221 HA3 GLY 23 2HA GLY 23 -12.057 8.323 -4.186 222 H GLY 24 H GLY 24 -12.386 9.383 -6.134 223 HA2 GLY 24 1HA GLY 24 -13.405 7.840 -8.372 224 HA3 GLY 24 2HA GLY 24 -13.271 9.594 -8.286 225 H LEU 25 H LEU 25 -10.258 9.391 -7.790 226 HA LEU 25 HA LEU 25 -9.527 9.321 -10.632 227 HB2 LEU 25 1HB LEU 25 -7.386 9.702 -8.588 228 HB3 LEU 25 2HB LEU 25 -7.577 10.387 -10.168 229 HG LEU 25 HG LEU 25 -9.108 11.219 -7.680 230 HD11 LEU 25 1HD1 LEU 25 -6.885 12.599 -9.219 231 HD12 LEU 25 2HD1 LEU 25 -6.734 11.807 -7.634 232 HD13 LEU 25 3HD1 LEU 25 -7.752 13.246 -7.807 233 HD21 LEU 25 3HD2 LEU 25 -10.467 11.636 -9.716 234 HD22 LEU 25 1HD2 LEU 25 -9.083 12.446 -10.479 235 HD23 LEU 25 2HD2 LEU 25 -9.859 13.153 -9.044 236 H VAL 26 H VAL 26 -9.909 6.755 -8.668 237 HA VAL 26 HA VAL 26 -7.559 5.224 -8.761 238 HB VAL 26 HB VAL 26 -9.621 4.667 -7.520 239 HG11 VAL 26 1HG1 VAL 26 -11.305 4.997 -9.333 240 HG12 VAL 26 2HG1 VAL 26 -10.718 3.499 -10.100 241 HG13 VAL 26 3HG1 VAL 26 -11.450 3.455 -8.488 242 HG21 VAL 26 3HG2 VAL 26 -7.822 3.033 -7.810 243 HG22 VAL 26 1HG2 VAL 26 -9.417 2.260 -7.672 244 HG23 VAL 26 2HG2 VAL 26 -8.632 2.377 -9.251 245 H LYS 27 H LYS 27 -9.767 5.812 -11.346 246 HA LYS 27 HA LYS 27 -8.921 3.744 -13.174 247 HB2 LYS 27 1HB LYS 27 -10.441 6.341 -13.529 248 HB3 LYS 27 2HB LYS 27 -10.157 5.196 -14.849 249 HG2 LYS 27 1HG LYS 27 -11.396 3.447 -13.776 250 HG3 LYS 27 2HG LYS 27 -11.457 4.319 -12.242 251 HD2 LYS 27 1HD LYS 27 -13.606 4.446 -13.333 252 HD3 LYS 27 2HD LYS 27 -12.871 6.053 -13.209 253 HE2 LYS 27 1HE LYS 27 -12.129 5.876 -15.590 254 HE3 LYS 27 2HE LYS 27 -12.886 4.281 -15.701 255 HZ1 LYS 27 3HZ LYS 27 -15.033 5.349 -15.257 256 HZ2 LYS 27 1HZ LYS 27 -14.336 6.035 -16.565 257 HZ3 LYS 27 2HZ LYS 27 -14.329 6.820 -15.136 258 H LYS 28 H LYS 28 -7.451 6.841 -12.503 259 HA LYS 28 HA LYS 28 -6.010 6.827 -15.127 260 HB2 LYS 28 1HB LYS 28 -5.875 9.176 -15.103 261 HB3 LYS 28 2HB LYS 28 -7.535 8.690 -14.829 262 HG2 LYS 28 1HG LYS 28 -7.380 10.400 -13.312 263 HG3 LYS 28 2HG LYS 28 -6.973 9.044 -12.291 264 HD2 LYS 28 1HD LYS 28 -5.272 10.492 -11.688 265 HD3 LYS 28 2HD LYS 28 -4.476 9.627 -12.994 266 HE2 LYS 28 1HE LYS 28 -3.988 11.850 -13.477 267 HE3 LYS 28 2HE LYS 28 -5.326 11.483 -14.569 268 HZ1 LYS 28 3HZ LYS 28 -6.818 12.586 -12.947 269 HZ2 LYS 28 1HZ LYS 28 -5.651 13.611 -13.443 270 HZ3 LYS 28 2HZ LYS 28 -5.548 12.924 -11.971 Start of MODEL 13 1 H1 LYS 1 1H LYS 1 12.084 -6.183 12.439 2 H2 LYS 1 2H LYS 1 11.915 -6.906 13.897 3 H3 LYS 1 3H LYS 1 13.122 -5.834 13.659 4 HA LYS 1 HA LYS 1 14.233 -7.844 13.548 5 HB2 LYS 1 1HB LYS 1 11.737 -8.931 13.150 6 HB3 LYS 1 2HB LYS 1 12.439 -9.171 11.553 7 HG2 LYS 1 1HG LYS 1 14.387 -10.331 12.610 8 HG3 LYS 1 2HG LYS 1 13.689 -10.008 14.203 9 HD2 LYS 1 1HD LYS 1 11.606 -11.281 12.752 10 HD3 LYS 1 2HD LYS 1 13.058 -12.153 12.281 11 HE2 LYS 1 1HE LYS 1 12.165 -11.610 15.156 12 HE3 LYS 1 2HE LYS 1 11.831 -13.096 14.268 13 HZ1 LYS 1 3HZ LYS 1 14.555 -12.111 14.938 14 HZ2 LYS 1 1HZ LYS 1 14.228 -13.485 14.111 15 HZ3 LYS 1 2HZ LYS 1 13.783 -13.343 15.673 16 H LYS 2 H LYS 2 16.038 -7.598 12.237 17 HA LYS 2 HA LYS 2 15.977 -5.922 9.914 18 HB2 LYS 2 1HB LYS 2 18.022 -7.431 11.436 19 HB3 LYS 2 2HB LYS 2 18.401 -7.292 9.729 20 HG2 LYS 2 1HG LYS 2 17.604 -4.874 11.403 21 HG3 LYS 2 2HG LYS 2 19.269 -5.452 11.261 22 HD2 LYS 2 1HD LYS 2 19.157 -5.214 8.789 23 HD3 LYS 2 2HD LYS 2 17.527 -4.524 8.926 24 HE2 LYS 2 1HE LYS 2 18.325 -2.607 10.123 25 HE3 LYS 2 2HE LYS 2 19.891 -3.362 10.442 26 HZ1 LYS 2 3HZ LYS 2 18.945 -2.541 7.748 27 HZ2 LYS 2 1HZ LYS 2 20.392 -3.229 8.074 28 HZ3 LYS 2 2HZ LYS 2 20.050 -1.744 8.646 29 H LYS 3 H LYS 3 16.250 -9.477 10.035 30 HA LYS 3 HA LYS 3 16.394 -9.917 7.200 31 HB2 LYS 3 1HB LYS 3 15.282 -11.646 9.458 32 HB3 LYS 3 2HB LYS 3 15.290 -12.159 7.766 33 HG2 LYS 3 1HG LYS 3 17.767 -11.712 7.685 34 HG3 LYS 3 2HG LYS 3 17.738 -11.466 9.441 35 HD2 LYS 3 1HD LYS 3 17.042 -13.752 9.827 36 HD3 LYS 3 2HD LYS 3 16.667 -13.993 8.107 37 HE2 LYS 3 1HE LYS 3 19.076 -13.606 7.553 38 HE3 LYS 3 2HE LYS 3 19.443 -13.529 9.281 39 HZ1 LYS 3 3HZ LYS 3 18.232 -15.878 7.909 40 HZ2 LYS 3 1HZ LYS 3 18.656 -15.819 9.487 41 HZ3 LYS 3 2HZ LYS 3 19.803 -15.761 8.327 42 H ASN 4 H ASN 4 13.591 -9.431 9.237 43 HA ASN 4 HA ASN 4 11.751 -9.631 6.923 44 HB2 ASN 4 1HB ASN 4 11.565 -10.573 9.535 45 HB3 ASN 4 2HB ASN 4 10.608 -9.099 9.611 46 HD21 ASN 4 2HD2 ASN 4 11.108 -11.989 7.472 47 HD22 ASN 4 1HD2 ASN 4 9.390 -12.180 7.155 48 H TRP 5 H TRP 5 13.657 -7.189 7.705 49 HA TRP 5 HA TRP 5 11.944 -4.953 8.156 50 HB2 TRP 5 1HB TRP 5 14.395 -4.970 8.442 51 HB3 TRP 5 2HB TRP 5 14.609 -5.114 6.698 52 HD1 TRP 5 HD1 TRP 5 14.616 -2.927 5.327 53 HE1 TRP 5 HE1 TRP 5 14.323 -0.420 5.858 54 HE3 TRP 5 HE3 TRP 5 13.044 -3.302 10.187 55 HZ2 TRP 5 HZ2 TRP 5 13.488 1.198 8.088 56 HZ3 TRP 5 HZ3 TRP 5 12.497 -1.254 11.496 57 HH2 TRP 5 HH2 TRP 5 12.711 0.992 10.457 58 H PHE 6 H PHE 6 12.755 -6.648 5.201 59 HA PHE 6 HA PHE 6 11.447 -4.691 3.429 60 HB2 PHE 6 1HB PHE 6 13.576 -6.471 3.142 61 HB3 PHE 6 2HB PHE 6 12.297 -7.259 2.252 62 HD1 PHE 6 HD2 PHE 6 11.297 -6.116 0.237 63 HD2 PHE 6 HD1 PHE 6 14.515 -4.330 2.488 64 HE1 PHE 6 HE2 PHE 6 11.711 -4.514 -1.616 65 HE2 PHE 6 HE1 PHE 6 14.924 -2.730 0.633 66 HZ PHE 6 HZ PHE 6 13.522 -2.818 -1.421 67 H ASP 7 H ASP 7 9.905 -6.461 5.500 68 HA ASP 7 HA ASP 7 8.307 -8.317 4.117 69 HB2 ASP 7 1HB ASP 7 6.932 -8.434 5.963 70 HB3 ASP 7 2HB ASP 7 8.533 -8.200 6.572 71 H ILE 8 H ILE 8 7.316 -7.834 2.270 72 HA ILE 8 HA ILE 8 5.974 -5.392 1.705 73 HB ILE 8 HB ILE 8 5.016 -6.497 -0.233 74 HG12 ILE 8 1HG1 ILE 8 6.409 -9.052 0.679 75 HG13 ILE 8 2HG1 ILE 8 4.679 -8.778 0.892 76 HG21 ILE 8 1HG2 ILE 8 7.110 -6.742 -1.374 77 HG22 ILE 8 2HG2 ILE 8 7.403 -5.589 -0.069 78 HG23 ILE 8 3HG2 ILE 8 7.951 -7.262 0.102 79 HD11 ILE 8 3HD1 ILE 8 5.186 -10.121 -1.128 80 HD12 ILE 8 1HD1 ILE 8 4.321 -8.617 -1.504 81 HD13 ILE 8 2HD1 ILE 8 6.068 -8.752 -1.822 82 H THR 9 H THR 9 4.904 -7.809 3.838 83 HA THR 9 HA THR 9 2.093 -7.786 3.560 84 HB THR 9 HB THR 9 2.360 -7.969 6.262 85 HG1 THR 9 HG1 THR 9 4.553 -7.711 6.435 86 HG21 THR 9 3HG2 THR 9 2.612 -10.392 5.948 87 HG22 THR 9 1HG2 THR 9 3.107 -10.139 4.258 88 HG23 THR 9 2HG2 THR 9 1.458 -9.715 4.785 89 H ASN 10 H ASN 10 4.156 -5.461 5.411 90 HA ASN 10 HA ASN 10 1.791 -3.833 6.047 91 HB2 ASN 10 1HB ASN 10 4.733 -3.675 6.638 92 HB3 ASN 10 2HB ASN 10 3.855 -2.150 6.572 93 HD21 ASN 10 2HD2 ASN 10 1.621 -2.186 7.804 94 HD22 ASN 10 1HD2 ASN 10 1.735 -2.942 9.387 95 H TRP 11 H TRP 11 4.116 -3.891 3.374 96 HA TRP 11 HA TRP 11 3.551 -1.296 2.332 97 HB2 TRP 11 1HB TRP 11 4.505 -3.834 0.997 98 HB3 TRP 11 2HB TRP 11 4.210 -2.356 0.130 99 HD1 TRP 11 HD1 TRP 11 6.391 -3.402 3.187 100 HE1 TRP 11 HE1 TRP 11 8.594 -2.085 3.074 101 HE3 TRP 11 HE3 TRP 11 5.358 -0.526 -0.866 102 HZ2 TRP 11 HZ2 TRP 11 9.773 -0.042 1.396 103 HZ3 TRP 11 HZ3 TRP 11 7.031 1.121 -1.738 104 HH2 TRP 11 HH2 TRP 11 9.243 1.363 -0.608 105 H LEU 12 H LEU 12 1.743 -4.324 2.111 106 HA LEU 12 HA LEU 12 -0.097 -3.687 0.065 107 HB2 LEU 12 1HB LEU 12 -0.780 -5.130 2.654 108 HB3 LEU 12 2HB LEU 12 -1.661 -5.211 1.137 109 HG LEU 12 HG LEU 12 1.076 -6.368 1.721 110 HD11 LEU 12 1HD1 LEU 12 -0.007 -8.507 1.339 111 HD12 LEU 12 2HD1 LEU 12 -1.551 -7.694 0.998 112 HD13 LEU 12 3HD1 LEU 12 -0.834 -7.613 2.625 113 HD21 LEU 12 3HD2 LEU 12 0.973 -7.352 -0.562 114 HD22 LEU 12 1HD2 LEU 12 1.112 -5.594 -0.600 115 HD23 LEU 12 2HD2 LEU 12 -0.466 -6.363 -0.907 116 H TRP 13 H TRP 13 0.061 -2.373 3.332 117 HA TRP 13 HA TRP 13 -2.615 -1.326 3.486 118 HB2 TRP 13 1HB TRP 13 -1.020 -1.571 5.390 119 HB3 TRP 13 2HB TRP 13 -0.098 -0.211 4.772 120 HD1 TRP 13 HD1 TRP 13 -3.549 -1.032 6.238 121 HE1 TRP 13 HE1 TRP 13 -4.609 1.113 7.211 122 HE3 TRP 13 HE3 TRP 13 -0.070 2.383 4.673 123 HZ2 TRP 13 HZ2 TRP 13 -4.032 3.934 7.266 124 HZ3 TRP 13 HZ3 TRP 13 -0.368 4.803 5.170 125 HH2 TRP 13 HH2 TRP 13 -2.332 5.587 6.462 126 H TYR 14 H TYR 14 0.442 0.302 2.520 127 HA TYR 14 HA TYR 14 -0.772 2.762 1.695 128 HB2 TYR 14 1HB TYR 14 1.782 1.499 0.636 129 HB3 TYR 14 2HB TYR 14 1.320 3.189 0.520 130 HD1 TYR 14 HD1 TYR 14 1.157 4.602 2.639 131 HD2 TYR 14 HD2 TYR 14 2.831 0.639 2.580 132 HE1 TYR 14 HE1 TYR 14 2.299 5.049 4.817 133 HE2 TYR 14 HE2 TYR 14 3.970 1.072 4.758 134 HH TYR 14 HH TYR 14 4.429 2.627 6.377 135 H ILE 15 H ILE 15 -0.221 -0.287 -0.000 136 HA ILE 15 HA ILE 15 -0.978 0.729 -2.630 137 HB ILE 15 HB ILE 15 -0.968 -2.147 -1.661 138 HG12 ILE 15 1HG1 ILE 15 1.246 -1.022 -1.522 139 HG13 ILE 15 2HG1 ILE 15 1.206 -2.384 -2.618 140 HG21 ILE 15 1HG2 ILE 15 -2.354 -2.028 -3.615 141 HG22 ILE 15 2HG2 ILE 15 -1.248 -0.906 -4.428 142 HG23 ILE 15 3HG2 ILE 15 -0.777 -2.608 -4.168 143 HD11 ILE 15 3HD1 ILE 15 1.020 0.510 -3.575 144 HD12 ILE 15 1HD1 ILE 15 2.542 -0.377 -3.389 145 HD13 ILE 15 2HD1 ILE 15 1.327 -0.949 -4.548 146 H LYS 16 H LYS 16 -2.833 -1.111 -0.162 147 HA LYS 16 HA LYS 16 -5.368 -0.899 -1.575 148 HB2 LYS 16 1HB LYS 16 -4.626 -1.480 1.311 149 HB3 LYS 16 2HB LYS 16 -6.274 -1.034 0.914 150 HG2 LYS 16 1HG LYS 16 -6.644 -3.174 0.613 151 HG3 LYS 16 2HG LYS 16 -5.933 -2.950 -0.978 152 HD2 LYS 16 1HD LYS 16 -3.787 -3.785 -0.205 153 HD3 LYS 16 2HD LYS 16 -4.338 -3.839 1.481 154 HE2 LYS 16 1HE LYS 16 -5.736 -5.369 -0.743 155 HE3 LYS 16 2HE LYS 16 -4.327 -6.043 0.085 156 HZ1 LYS 16 3HZ LYS 16 -6.443 -6.760 1.091 157 HZ2 LYS 16 1HZ LYS 16 -6.820 -5.224 1.483 158 HZ3 LYS 16 2HZ LYS 16 -5.528 -5.953 2.169 159 H LEU 17 H LEU 17 -3.892 1.223 0.883 160 HA LEU 17 HA LEU 17 -5.990 3.137 0.954 161 HB2 LEU 17 1HB LEU 17 -4.263 2.972 2.657 162 HB3 LEU 17 2HB LEU 17 -3.028 3.515 1.527 163 HG LEU 17 HG LEU 17 -5.353 5.357 1.669 164 HD11 LEU 17 1HD1 LEU 17 -4.876 6.288 3.863 165 HD12 LEU 17 2HD1 LEU 17 -3.703 4.987 4.165 166 HD13 LEU 17 3HD1 LEU 17 -5.435 4.610 3.989 167 HD21 LEU 17 3HD2 LEU 17 -3.627 7.056 1.882 168 HD22 LEU 17 1HD2 LEU 17 -3.148 5.911 0.619 169 HD23 LEU 17 2HD2 LEU 17 -2.397 5.821 2.230 170 H PHE 18 H PHE 18 -3.266 2.894 -1.371 171 HA PHE 18 HA PHE 18 -3.531 5.362 -2.613 172 HB2 PHE 18 1HB PHE 18 -1.793 3.878 -3.282 173 HB3 PHE 18 2HB PHE 18 -2.932 2.674 -3.863 174 HD1 PHE 18 HD2 PHE 18 -2.832 6.427 -4.521 175 HD2 PHE 18 HD1 PHE 18 -2.616 2.429 -6.142 176 HE1 PHE 18 HE2 PHE 18 -2.664 7.357 -6.795 177 HE2 PHE 18 HE1 PHE 18 -2.501 3.379 -8.435 178 HZ PHE 18 HZ PHE 18 -2.513 5.846 -8.764 179 H ILE 19 H ILE 19 -5.723 2.569 -3.054 180 HA ILE 19 HA ILE 19 -7.360 3.919 -5.049 181 HB ILE 19 HB ILE 19 -7.984 1.535 -3.268 182 HG12 ILE 19 1HG1 ILE 19 -7.784 0.290 -5.537 183 HG13 ILE 19 2HG1 ILE 19 -6.905 1.700 -6.113 184 HG21 ILE 19 1HG2 ILE 19 -10.086 2.375 -3.913 185 HG22 ILE 19 2HG2 ILE 19 -9.519 2.828 -5.525 186 HG23 ILE 19 3HG2 ILE 19 -9.772 1.115 -5.097 187 HD11 ILE 19 3HD1 ILE 19 -5.099 1.269 -4.588 188 HD12 ILE 19 1HD1 ILE 19 -6.075 0.081 -3.676 189 HD13 ILE 19 2HD1 ILE 19 -5.530 -0.271 -5.325 190 H MET 20 H MET 20 -7.348 3.859 -1.529 191 HA MET 20 HA MET 20 -10.032 4.937 -1.148 192 HB2 MET 20 1HB MET 20 -7.646 4.804 0.736 193 HB3 MET 20 2HB MET 20 -9.273 5.270 1.200 194 HG2 MET 20 1HG MET 20 -8.766 2.590 -0.135 195 HG3 MET 20 2HG MET 20 -8.447 2.809 1.574 196 HE1 MET 20 3HE MET 20 -11.783 3.142 3.296 197 HE2 MET 20 1HE MET 20 -10.017 2.962 3.405 198 HE3 MET 20 2HE MET 20 -10.722 4.501 2.869 199 H ILE 21 H ILE 21 -6.744 6.379 -1.025 200 HA ILE 21 HA ILE 21 -7.617 9.056 -0.471 201 HB ILE 21 HB ILE 21 -5.375 8.303 0.014 202 HG12 ILE 21 1HG1 ILE 21 -5.329 10.620 -1.970 203 HG13 ILE 21 2HG1 ILE 21 -5.898 10.725 -0.301 204 HG21 ILE 21 1HG2 ILE 21 -3.651 7.917 -1.603 205 HG22 ILE 21 2HG2 ILE 21 -5.016 6.920 -2.054 206 HG23 ILE 21 3HG2 ILE 21 -4.695 8.411 -2.955 207 HD11 ILE 21 3HD1 ILE 21 -3.057 10.099 -1.208 208 HD12 ILE 21 1HD1 ILE 21 -3.638 11.567 -0.413 209 HD13 ILE 21 2HD1 ILE 21 -3.616 10.033 0.483 210 H VAL 22 H VAL 22 -6.930 7.461 -3.593 211 HA VAL 22 HA VAL 22 -7.530 9.786 -5.217 212 HB VAL 22 HB VAL 22 -7.631 8.225 -7.096 213 HG11 VAL 22 1HG1 VAL 22 -5.305 7.652 -5.279 214 HG12 VAL 22 2HG1 VAL 22 -5.380 7.363 -7.021 215 HG13 VAL 22 3HG1 VAL 22 -5.475 9.031 -6.401 216 HG21 VAL 22 3HG2 VAL 22 -8.709 6.298 -6.373 217 HG22 VAL 22 1HG2 VAL 22 -7.028 5.787 -6.654 218 HG23 VAL 22 2HG2 VAL 22 -7.607 6.096 -5.023 219 H GLY 23 H GLY 23 -9.551 7.141 -4.008 220 HA2 GLY 23 1HA GLY 23 -11.710 6.537 -4.254 221 HA3 GLY 23 2HA GLY 23 -12.117 8.261 -4.285 222 H GLY 24 H GLY 24 -12.400 9.270 -6.287 223 HA2 GLY 24 1HA GLY 24 -13.380 7.624 -8.489 224 HA3 GLY 24 2HA GLY 24 -13.308 9.384 -8.442 225 H LEU 25 H LEU 25 -10.297 9.280 -7.874 226 HA LEU 25 HA LEU 25 -9.497 9.182 -10.693 227 HB2 LEU 25 1HB LEU 25 -7.410 9.624 -8.605 228 HB3 LEU 25 2HB LEU 25 -7.579 10.291 -10.193 229 HG LEU 25 HG LEU 25 -9.192 11.102 -7.751 230 HD11 LEU 25 1HD1 LEU 25 -7.895 13.160 -7.837 231 HD12 LEU 25 2HD1 LEU 25 -6.964 12.542 -9.222 232 HD13 LEU 25 3HD1 LEU 25 -6.840 11.752 -7.633 233 HD21 LEU 25 3HD2 LEU 25 -9.960 13.008 -9.138 234 HD22 LEU 25 1HD2 LEU 25 -10.502 11.474 -9.828 235 HD23 LEU 25 2HD2 LEU 25 -9.121 12.326 -10.550 236 H VAL 26 H VAL 26 -9.873 6.658 -8.655 237 HA VAL 26 HA VAL 26 -7.532 5.138 -8.664 238 HB VAL 26 HB VAL 26 -9.613 4.565 -7.474 239 HG11 VAL 26 1HG1 VAL 26 -11.260 4.870 -9.325 240 HG12 VAL 26 2HG1 VAL 26 -10.645 3.373 -10.072 241 HG13 VAL 26 3HG1 VAL 26 -11.407 3.330 -8.473 242 HG21 VAL 26 3HG2 VAL 26 -8.526 2.294 -9.174 243 HG22 VAL 26 1HG2 VAL 26 -7.809 2.951 -7.685 244 HG23 VAL 26 2HG2 VAL 26 -9.393 2.144 -7.644 245 H LYS 27 H LYS 27 -9.735 5.545 -11.337 246 HA LYS 27 HA LYS 27 -8.606 3.553 -13.094 247 HB2 LYS 27 1HB LYS 27 -10.535 5.830 -13.325 248 HB3 LYS 27 2HB LYS 27 -9.688 5.400 -14.803 249 HG2 LYS 27 1HG LYS 27 -10.380 2.967 -14.406 250 HG3 LYS 27 2HG LYS 27 -11.383 3.559 -13.074 251 HD2 LYS 27 1HD LYS 27 -12.846 3.432 -14.964 252 HD3 LYS 27 2HD LYS 27 -12.465 5.151 -14.782 253 HE2 LYS 27 1HE LYS 27 -10.457 4.483 -16.469 254 HE3 LYS 27 2HE LYS 27 -11.535 3.146 -16.858 255 HZ1 LYS 27 3HZ LYS 27 -13.264 4.848 -17.360 256 HZ2 LYS 27 1HZ LYS 27 -11.955 5.007 -18.323 257 HZ3 LYS 27 2HZ LYS 27 -12.179 6.041 -17.084 258 H LYS 28 H LYS 28 -7.428 6.801 -12.382 259 HA LYS 28 HA LYS 28 -5.288 6.490 -14.376 260 HB2 LYS 28 1HB LYS 28 -5.739 8.394 -15.694 261 HB3 LYS 28 2HB LYS 28 -7.137 7.350 -15.683 262 HG2 LYS 28 1HG LYS 28 -8.214 9.342 -15.463 263 HG3 LYS 28 2HG LYS 28 -8.004 8.961 -13.759 264 HD2 LYS 28 1HD LYS 28 -5.622 10.300 -14.414 265 HD3 LYS 28 2HD LYS 28 -6.802 11.123 -15.434 266 HE2 LYS 28 1HE LYS 28 -8.119 11.795 -13.553 267 HE3 LYS 28 2HE LYS 28 -7.352 10.583 -12.505 268 HZ1 LYS 28 3HZ LYS 28 -5.314 11.816 -12.572 269 HZ2 LYS 28 1HZ LYS 28 -6.491 12.833 -12.077 270 HZ3 LYS 28 2HZ LYS 28 -5.918 12.936 -13.604 Start of MODEL 14 1 H1 LYS 1 1H LYS 1 12.684 -4.297 14.014 2 H2 LYS 1 2H LYS 1 12.465 -5.404 12.840 3 H3 LYS 1 3H LYS 1 13.981 -4.943 13.263 4 HA LYS 1 HA LYS 1 11.936 -3.202 12.049 5 HB2 LYS 1 1HB LYS 1 13.918 -2.301 13.652 6 HB3 LYS 1 2HB LYS 1 14.819 -2.338 12.166 7 HG2 LYS 1 1HG LYS 1 13.974 -0.176 12.337 8 HG3 LYS 1 2HG LYS 1 12.931 -0.918 11.121 9 HD2 LYS 1 1HD LYS 1 11.053 -0.875 12.536 10 HD3 LYS 1 2HD LYS 1 12.022 -1.063 13.996 11 HE2 LYS 1 1HE LYS 1 11.099 1.117 14.079 12 HE3 LYS 1 2HE LYS 1 12.835 1.263 13.811 13 HZ1 LYS 1 3HZ LYS 1 10.747 1.542 11.710 14 HZ2 LYS 1 1HZ LYS 1 12.358 1.677 11.445 15 HZ3 LYS 1 2HZ LYS 1 11.589 2.766 12.380 16 H LYS 2 H LYS 2 15.301 -3.748 10.954 17 HA LYS 2 HA LYS 2 14.587 -3.868 8.213 18 HB2 LYS 2 1HB LYS 2 17.104 -4.946 9.552 19 HB3 LYS 2 2HB LYS 2 16.921 -4.601 7.836 20 HG2 LYS 2 1HG LYS 2 16.829 -2.546 10.083 21 HG3 LYS 2 2HG LYS 2 18.178 -2.846 8.989 22 HD2 LYS 2 1HD LYS 2 16.786 -2.123 7.054 23 HD3 LYS 2 2HD LYS 2 15.426 -1.832 8.155 24 HE2 LYS 2 1HE LYS 2 17.424 -0.410 9.405 25 HE3 LYS 2 2HE LYS 2 17.921 -0.248 7.719 26 HZ1 LYS 2 3HZ LYS 2 15.253 0.484 8.814 27 HZ2 LYS 2 1HZ LYS 2 15.668 0.614 7.238 28 HZ3 LYS 2 2HZ LYS 2 16.412 1.536 8.363 29 H LYS 3 H LYS 3 14.967 -6.576 10.433 30 HA LYS 3 HA LYS 3 14.964 -8.676 8.544 31 HB2 LYS 3 1HB LYS 3 15.344 -8.751 11.120 32 HB3 LYS 3 2HB LYS 3 13.589 -8.850 11.256 33 HG2 LYS 3 1HG LYS 3 14.397 -11.087 11.370 34 HG3 LYS 3 2HG LYS 3 13.694 -10.920 9.766 35 HD2 LYS 3 1HD LYS 3 16.153 -10.353 9.001 36 HD3 LYS 3 2HD LYS 3 16.631 -11.020 10.566 37 HE2 LYS 3 1HE LYS 3 15.677 -13.176 10.015 38 HE3 LYS 3 2HE LYS 3 14.823 -12.507 8.619 39 HZ1 LYS 3 3HZ LYS 3 16.793 -13.660 7.878 40 HZ2 LYS 3 1HZ LYS 3 17.772 -12.779 8.845 41 HZ3 LYS 3 2HZ LYS 3 17.002 -12.071 7.588 42 H ASN 4 H ASN 4 12.247 -6.789 9.617 43 HA ASN 4 HA ASN 4 10.315 -8.443 8.060 44 HB2 ASN 4 1HB ASN 4 9.966 -6.368 10.256 45 HB3 ASN 4 2HB ASN 4 8.626 -6.987 9.296 46 HD21 ASN 4 2HD2 ASN 4 10.277 -7.551 12.192 47 HD22 ASN 4 1HD2 ASN 4 9.758 -9.221 12.364 48 H TRP 5 H TRP 5 12.372 -6.137 7.115 49 HA TRP 5 HA TRP 5 10.640 -4.160 5.908 50 HB2 TRP 5 1HB TRP 5 13.039 -3.818 6.440 51 HB3 TRP 5 2HB TRP 5 13.480 -4.963 5.173 52 HD1 TRP 5 HD1 TRP 5 13.739 -4.000 2.799 53 HE1 TRP 5 HE1 TRP 5 13.286 -1.734 1.657 54 HE3 TRP 5 HE3 TRP 5 11.276 -1.642 6.622 55 HZ2 TRP 5 HZ2 TRP 5 11.979 0.753 2.305 56 HZ3 TRP 5 HZ3 TRP 5 10.424 0.678 6.328 57 HH2 TRP 5 HH2 TRP 5 10.767 1.879 4.182 58 H PHE 6 H PHE 6 12.259 -7.060 4.559 59 HA PHE 6 HA PHE 6 11.173 -6.790 1.920 60 HB2 PHE 6 1HB PHE 6 13.166 -8.276 3.186 61 HB3 PHE 6 2HB PHE 6 11.988 -9.502 2.799 62 HD1 PHE 6 HD2 PHE 6 11.019 -8.257 0.055 63 HD2 PHE 6 HD1 PHE 6 14.907 -8.924 1.814 64 HE1 PHE 6 HE2 PHE 6 12.009 -8.454 -2.198 65 HE2 PHE 6 HE1 PHE 6 15.894 -9.121 -0.463 66 HZ PHE 6 HZ PHE 6 14.443 -8.889 -2.471 67 H ASP 7 H ASP 7 9.633 -7.827 4.781 68 HA ASP 7 HA ASP 7 7.807 -9.800 3.693 69 HB2 ASP 7 1HB ASP 7 7.780 -8.125 6.219 70 HB3 ASP 7 2HB ASP 7 6.451 -9.174 5.761 71 H ILE 8 H ILE 8 7.067 -8.982 1.781 72 HA ILE 8 HA ILE 8 5.846 -6.527 1.288 73 HB ILE 8 HB ILE 8 4.802 -7.491 -0.657 74 HG12 ILE 8 1HG1 ILE 8 5.683 -10.223 0.384 75 HG13 ILE 8 2HG1 ILE 8 4.018 -9.639 0.309 76 HG21 ILE 8 1HG2 ILE 8 7.593 -8.660 -0.314 77 HG22 ILE 8 2HG2 ILE 8 6.822 -8.087 -1.805 78 HG23 ILE 8 3HG2 ILE 8 7.262 -6.930 -0.547 79 HD11 ILE 8 3HD1 ILE 8 5.830 -10.193 -2.067 80 HD12 ILE 8 1HD1 ILE 8 4.378 -11.077 -1.575 81 HD13 ILE 8 2HD1 ILE 8 4.231 -9.414 -2.180 82 H THR 9 H THR 9 4.579 -8.930 3.334 83 HA THR 9 HA THR 9 1.783 -8.719 3.120 84 HB THR 9 HB THR 9 2.613 -8.836 5.906 85 HG1 THR 9 HG1 THR 9 3.804 -10.901 4.456 86 HG21 THR 9 3HG2 THR 9 1.652 -11.019 4.007 87 HG22 THR 9 1HG2 THR 9 0.610 -9.935 4.956 88 HG23 THR 9 2HG2 THR 9 1.669 -11.091 5.785 89 H ASN 10 H ASN 10 4.088 -6.624 4.893 90 HA ASN 10 HA ASN 10 1.948 -4.819 5.832 91 HB2 ASN 10 1HB ASN 10 4.992 -4.637 5.879 92 HB3 ASN 10 2HB ASN 10 3.923 -3.370 6.490 93 HD21 ASN 10 2HD2 ASN 10 5.872 -4.833 8.064 94 HD22 ASN 10 1HD2 ASN 10 4.915 -5.633 9.307 95 H TRP 11 H TRP 11 4.138 -4.948 3.041 96 HA TRP 11 HA TRP 11 3.740 -2.293 2.087 97 HB2 TRP 11 1HB TRP 11 4.426 -4.854 0.629 98 HB3 TRP 11 2HB TRP 11 4.247 -3.320 -0.159 99 HD1 TRP 11 HD1 TRP 11 6.456 -4.760 2.725 100 HE1 TRP 11 HE1 TRP 11 8.768 -3.677 2.553 101 HE3 TRP 11 HE3 TRP 11 5.497 -1.547 -1.102 102 HZ2 TRP 11 HZ2 TRP 11 10.024 -1.565 0.981 103 HZ3 TRP 11 HZ3 TRP 11 7.248 -0.004 -1.955 104 HH2 TRP 11 HH2 TRP 11 9.526 0.001 -0.911 105 H LEU 12 H LEU 12 1.682 -5.158 1.838 106 HA LEU 12 HA LEU 12 -0.142 -4.330 -0.143 107 HB2 LEU 12 1HB LEU 12 -0.900 -5.769 2.422 108 HB3 LEU 12 2HB LEU 12 -1.780 -5.777 0.900 109 HG LEU 12 HG LEU 12 0.875 -7.099 1.487 110 HD11 LEU 12 1HD1 LEU 12 -1.130 -8.229 2.367 111 HD12 LEU 12 2HD1 LEU 12 -0.301 -9.172 1.118 112 HD13 LEU 12 3HD1 LEU 12 -1.797 -8.301 0.717 113 HD21 LEU 12 3HD2 LEU 12 -0.647 -7.028 -1.151 114 HD22 LEU 12 1HD2 LEU 12 0.758 -8.058 -0.791 115 HD23 LEU 12 2HD2 LEU 12 0.950 -6.305 -0.838 116 H TRP 13 H TRP 13 0.141 -3.162 3.173 117 HA TRP 13 HA TRP 13 -2.428 -1.911 3.420 118 HB2 TRP 13 1HB TRP 13 -0.829 -2.349 5.270 119 HB3 TRP 13 2HB TRP 13 0.202 -1.056 4.680 120 HD1 TRP 13 HD1 TRP 13 -3.238 -1.624 6.277 121 HE1 TRP 13 HE1 TRP 13 -4.076 0.571 7.339 122 HE3 TRP 13 HE3 TRP 13 0.446 1.539 4.643 123 HZ2 TRP 13 HZ2 TRP 13 -3.266 3.332 7.442 124 HZ3 TRP 13 HZ3 TRP 13 0.375 3.957 5.224 125 HH2 TRP 13 HH2 TRP 13 -1.465 4.861 6.613 126 H TYR 14 H TYR 14 0.713 -0.479 2.403 127 HA TYR 14 HA TYR 14 -0.346 2.098 1.724 128 HB2 TYR 14 1HB TYR 14 2.073 0.712 0.516 129 HB3 TYR 14 2HB TYR 14 1.731 2.434 0.503 130 HD1 TYR 14 HD2 TYR 14 1.805 3.758 2.666 131 HD2 TYR 14 HD1 TYR 14 3.083 -0.341 2.396 132 HE1 TYR 14 HE2 TYR 14 3.043 4.006 4.815 133 HE2 TYR 14 HE1 TYR 14 4.323 -0.105 4.557 134 HH TYR 14 HH TYR 14 4.393 2.990 6.362 135 H ILE 15 H ILE 15 -0.102 -0.913 -0.102 136 HA ILE 15 HA ILE 15 -0.831 0.268 -2.678 137 HB ILE 15 HB ILE 15 -1.019 -2.635 -1.806 138 HG12 ILE 15 1HG1 ILE 15 1.286 -1.737 -1.680 139 HG13 ILE 15 2HG1 ILE 15 1.097 -3.016 -2.856 140 HG21 ILE 15 1HG2 ILE 15 -1.249 -1.293 -4.530 141 HG22 ILE 15 2HG2 ILE 15 -0.938 -3.037 -4.319 142 HG23 ILE 15 3HG2 ILE 15 -2.439 -2.324 -3.719 143 HD11 ILE 15 3HD1 ILE 15 1.242 -1.424 -4.698 144 HD12 ILE 15 1HD1 ILE 15 1.220 -0.048 -3.568 145 HD13 ILE 15 2HD1 ILE 15 2.600 -1.156 -3.586 146 H LYS 16 H LYS 16 -2.716 -1.501 -0.200 147 HA LYS 16 HA LYS 16 -5.295 -1.124 -1.467 148 HB2 LYS 16 1HB LYS 16 -4.360 -1.842 1.302 149 HB3 LYS 16 2HB LYS 16 -6.036 -1.357 1.079 150 HG2 LYS 16 1HG LYS 16 -6.644 -3.232 0.037 151 HG3 LYS 16 2HG LYS 16 -5.212 -3.298 -0.993 152 HD2 LYS 16 1HD LYS 16 -3.912 -4.393 0.662 153 HD3 LYS 16 2HD LYS 16 -5.094 -4.056 1.935 154 HE2 LYS 16 1HE LYS 16 -5.985 -6.077 1.566 155 HE3 LYS 16 2HE LYS 16 -6.636 -5.414 0.071 156 HZ1 LYS 16 3HZ LYS 16 -4.100 -6.926 0.369 157 HZ2 LYS 16 1HZ LYS 16 -4.542 -6.189 -1.030 158 HZ3 LYS 16 2HZ LYS 16 -5.435 -7.411 -0.422 159 H LEU 17 H LEU 17 -3.582 0.829 0.974 160 HA LEU 17 HA LEU 17 -5.528 2.889 1.198 161 HB2 LEU 17 1HB LEU 17 -3.732 2.531 2.807 162 HB3 LEU 17 2HB LEU 17 -2.521 3.028 1.633 163 HG LEU 17 HG LEU 17 -4.690 5.026 1.958 164 HD11 LEU 17 1HD1 LEU 17 -4.043 5.827 4.163 165 HD12 LEU 17 2HD1 LEU 17 -2.960 4.430 4.355 166 HD13 LEU 17 3HD1 LEU 17 -4.720 4.191 4.252 167 HD21 LEU 17 3HD2 LEU 17 -1.683 5.237 2.386 168 HD22 LEU 17 1HD2 LEU 17 -2.827 6.581 2.167 169 HD23 LEU 17 2HD2 LEU 17 -2.509 5.471 0.824 170 H PHE 18 H PHE 18 -2.927 2.520 -1.252 171 HA PHE 18 HA PHE 18 -3.053 5.039 -2.409 172 HB2 PHE 18 1HB PHE 18 -1.463 3.451 -3.194 173 HB3 PHE 18 2HB PHE 18 -2.712 2.359 -3.764 174 HD1 PHE 18 HD2 PHE 18 -2.372 6.109 -4.320 175 HD2 PHE 18 HD1 PHE 18 -2.471 2.153 -6.053 176 HE1 PHE 18 HE2 PHE 18 -2.218 7.093 -6.574 177 HE2 PHE 18 HE1 PHE 18 -2.365 3.160 -8.323 178 HZ PHE 18 HZ PHE 18 -2.229 5.630 -8.587 179 H ILE 19 H ILE 19 -5.464 2.426 -2.862 180 HA ILE 19 HA ILE 19 -7.073 3.969 -4.730 181 HB ILE 19 HB ILE 19 -7.808 1.583 -3.001 182 HG12 ILE 19 1HG1 ILE 19 -7.812 0.401 -5.305 183 HG13 ILE 19 2HG1 ILE 19 -6.870 1.764 -5.895 184 HG21 ILE 19 1HG2 ILE 19 -9.332 3.063 -5.150 185 HG22 ILE 19 2HG2 ILE 19 -9.708 1.368 -4.742 186 HG23 ILE 19 3HG2 ILE 19 -9.862 2.622 -3.522 187 HD11 ILE 19 3HD1 ILE 19 -6.021 0.004 -3.560 188 HD12 ILE 19 1HD1 ILE 19 -5.592 -0.318 -5.250 189 HD13 ILE 19 2HD1 ILE 19 -5.014 1.158 -4.482 190 H MET 20 H MET 20 -6.940 3.749 -1.215 191 HA MET 20 HA MET 20 -9.502 5.020 -0.675 192 HB2 MET 20 1HB MET 20 -7.064 4.630 1.101 193 HB3 MET 20 2HB MET 20 -8.638 5.181 1.652 194 HG2 MET 20 1HG MET 20 -8.355 2.540 0.180 195 HG3 MET 20 2HG MET 20 -7.993 2.657 1.889 196 HE1 MET 20 3HE MET 20 -9.297 3.513 3.577 197 HE2 MET 20 1HE MET 20 -10.945 4.162 3.431 198 HE3 MET 20 2HE MET 20 -10.695 2.448 3.823 199 H ILE 21 H ILE 21 -6.116 6.218 -0.669 200 HA ILE 21 HA ILE 21 -6.778 8.931 0.011 201 HB ILE 21 HB ILE 21 -4.577 8.002 0.388 202 HG12 ILE 21 1HG1 ILE 21 -4.468 10.403 -1.494 203 HG13 ILE 21 2HG1 ILE 21 -4.939 10.457 0.207 204 HG21 ILE 21 1HG2 ILE 21 -2.942 7.576 -1.308 205 HG22 ILE 21 2HG2 ILE 21 -4.383 6.686 -1.739 206 HG23 ILE 21 3HG2 ILE 21 -4.002 8.188 -2.598 207 HD11 ILE 21 3HD1 ILE 21 -2.642 11.162 0.018 208 HD12 ILE 21 1HD1 ILE 21 -2.665 9.577 0.822 209 HD13 ILE 21 2HD1 ILE 21 -2.197 9.713 -0.892 210 H VAL 22 H VAL 22 -6.329 7.390 -3.190 211 HA VAL 22 HA VAL 22 -6.803 9.821 -4.701 212 HB VAL 22 HB VAL 22 -7.081 8.372 -6.639 213 HG11 VAL 22 1HG1 VAL 22 -4.901 7.330 -6.679 214 HG12 VAL 22 2HG1 VAL 22 -4.846 8.967 -5.979 215 HG13 VAL 22 3HG1 VAL 22 -4.754 7.527 -4.929 216 HG21 VAL 22 3HG2 VAL 22 -8.294 6.501 -5.955 217 HG22 VAL 22 1HG2 VAL 22 -6.679 5.876 -6.360 218 HG23 VAL 22 2HG2 VAL 22 -7.145 6.129 -4.683 219 H GLY 23 H GLY 23 -8.977 7.315 -3.489 220 HA2 GLY 23 1HA GLY 23 -11.181 6.874 -3.683 221 HA3 GLY 23 2HA GLY 23 -11.463 8.622 -3.663 222 H GLY 24 H GLY 24 -11.719 9.698 -5.636 223 HA2 GLY 24 1HA GLY 24 -12.903 8.172 -7.826 224 HA3 GLY 24 2HA GLY 24 -12.716 9.921 -7.742 225 H LEU 25 H LEU 25 -9.679 9.586 -7.324 226 HA LEU 25 HA LEU 25 -9.055 9.601 -10.185 227 HB2 LEU 25 1HB LEU 25 -6.839 9.744 -8.181 228 HB3 LEU 25 2HB LEU 25 -7.005 10.499 -9.732 229 HG LEU 25 HG LEU 25 -8.430 11.333 -7.183 230 HD11 LEU 25 1HD1 LEU 25 -6.191 12.656 -8.747 231 HD12 LEU 25 2HD1 LEU 25 -6.026 11.799 -7.197 232 HD13 LEU 25 3HD1 LEU 25 -6.978 13.289 -7.283 233 HD21 LEU 25 3HD2 LEU 25 -9.832 11.890 -9.149 234 HD22 LEU 25 1HD2 LEU 25 -8.431 12.641 -9.944 235 HD23 LEU 25 2HD2 LEU 25 -9.113 13.352 -8.463 236 H VAL 26 H VAL 26 -9.424 7.011 -8.230 237 HA VAL 26 HA VAL 26 -7.237 5.322 -8.424 238 HB VAL 26 HB VAL 26 -9.311 4.918 -7.141 239 HG11 VAL 26 1HG1 VAL 26 -11.001 5.376 -8.909 240 HG12 VAL 26 2HG1 VAL 26 -10.547 3.846 -9.700 241 HG13 VAL 26 3HG1 VAL 26 -11.242 3.841 -8.070 242 HG21 VAL 26 3HG2 VAL 26 -8.516 2.557 -8.876 243 HG22 VAL 26 1HG2 VAL 26 -7.664 3.145 -7.430 244 HG23 VAL 26 2HG2 VAL 26 -9.314 2.496 -7.304 245 H LYS 27 H LYS 27 -9.460 6.016 -10.979 246 HA LYS 27 HA LYS 27 -8.800 3.950 -12.854 247 HB2 LYS 27 1HB LYS 27 -10.333 6.459 -12.786 248 HB3 LYS 27 2HB LYS 27 -9.497 6.290 -14.323 249 HG2 LYS 27 1HG LYS 27 -10.500 4.124 -14.736 250 HG3 LYS 27 2HG LYS 27 -11.197 4.078 -13.102 251 HD2 LYS 27 1HD LYS 27 -12.589 6.041 -13.606 252 HD3 LYS 27 2HD LYS 27 -11.905 6.139 -15.244 253 HE2 LYS 27 1HE LYS 27 -12.871 4.037 -15.882 254 HE3 LYS 27 2HE LYS 27 -13.272 3.626 -14.210 255 HZ1 LYS 27 3HZ LYS 27 -14.894 5.422 -14.197 256 HZ2 LYS 27 1HZ LYS 27 -15.225 4.413 -15.434 257 HZ3 LYS 27 2HZ LYS 27 -14.519 5.856 -15.727 258 H LYS 28 H LYS 28 -6.909 6.692 -11.955 259 HA LYS 28 HA LYS 28 -5.322 6.684 -14.488 260 HB2 LYS 28 1HB LYS 28 -5.599 8.738 -12.263 261 HB3 LYS 28 2HB LYS 28 -4.508 8.894 -13.631 262 HG2 LYS 28 1HG LYS 28 -7.207 8.279 -14.601 263 HG3 LYS 28 2HG LYS 28 -7.263 9.640 -13.479 264 HD2 LYS 28 1HD LYS 28 -5.573 10.841 -14.791 265 HD3 LYS 28 2HD LYS 28 -5.399 9.451 -15.889 266 HE2 LYS 28 1HE LYS 28 -7.713 9.669 -16.626 267 HE3 LYS 28 2HE LYS 28 -8.023 10.937 -15.435 268 HZ1 LYS 28 3HZ LYS 28 -7.590 11.855 -17.652 269 HZ2 LYS 28 1HZ LYS 28 -6.104 11.184 -17.690 270 HZ3 LYS 28 2HZ LYS 28 -6.446 12.357 -16.604 Start of MODEL 15 1 H1 LYS 1 1H LYS 1 14.716 -6.988 14.660 2 H2 LYS 1 2H LYS 1 14.067 -5.997 13.533 3 H3 LYS 1 3H LYS 1 13.704 -7.590 13.522 4 HA LYS 1 HA LYS 1 16.449 -6.594 13.154 5 HB2 LYS 1 1HB LYS 1 15.905 -9.081 13.841 6 HB3 LYS 1 2HB LYS 1 15.306 -9.251 12.199 7 HG2 LYS 1 1HG LYS 1 17.471 -9.951 11.878 8 HG3 LYS 1 2HG LYS 1 17.717 -8.241 11.563 9 HD2 LYS 1 1HD LYS 1 18.230 -8.130 14.180 10 HD3 LYS 1 2HD LYS 1 18.430 -9.883 13.999 11 HE2 LYS 1 1HE LYS 1 20.024 -9.298 12.022 12 HE3 LYS 1 2HE LYS 1 19.965 -7.637 12.626 13 HZ1 LYS 1 3HZ LYS 1 21.846 -8.765 13.589 14 HZ2 LYS 1 1HZ LYS 1 20.941 -10.011 14.122 15 HZ3 LYS 1 2HZ LYS 1 20.772 -8.531 14.796 16 H LYS 2 H LYS 2 17.184 -6.081 11.084 17 HA LYS 2 HA LYS 2 15.505 -4.972 9.134 18 HB2 LYS 2 1HB LYS 2 18.332 -6.052 8.985 19 HB3 LYS 2 2HB LYS 2 17.570 -5.276 7.604 20 HG2 LYS 2 1HG LYS 2 17.706 -3.874 10.302 21 HG3 LYS 2 2HG LYS 2 19.045 -3.836 9.151 22 HD2 LYS 2 1HD LYS 2 17.638 -2.834 7.431 23 HD3 LYS 2 2HD LYS 2 16.218 -2.880 8.493 24 HE2 LYS 2 1HE LYS 2 17.058 -1.240 9.943 25 HE3 LYS 2 2HE LYS 2 18.735 -1.531 9.474 26 HZ1 LYS 2 3HZ LYS 2 16.718 -0.238 7.718 27 HZ2 LYS 2 1HZ LYS 2 18.293 -0.485 7.344 28 HZ3 LYS 2 2HZ LYS 2 17.892 0.547 8.539 29 H LYS 3 H LYS 3 16.360 -8.358 9.384 30 HA LYS 3 HA LYS 3 15.629 -9.335 6.849 31 HB2 LYS 3 1HB LYS 3 16.584 -10.629 8.834 32 HB3 LYS 3 2HB LYS 3 14.947 -10.663 9.506 33 HG2 LYS 3 1HG LYS 3 14.207 -11.772 7.315 34 HG3 LYS 3 2HG LYS 3 15.920 -11.897 6.885 35 HD2 LYS 3 1HD LYS 3 16.344 -13.380 8.757 36 HD3 LYS 3 2HD LYS 3 14.747 -13.033 9.461 37 HE2 LYS 3 1HE LYS 3 13.686 -13.976 7.372 38 HE3 LYS 3 2HE LYS 3 15.291 -14.480 6.831 39 HZ1 LYS 3 3HZ LYS 3 13.928 -15.395 9.314 40 HZ2 LYS 3 1HZ LYS 3 15.436 -15.848 8.871 41 HZ3 LYS 3 2HZ LYS 3 14.149 -16.286 7.968 42 H ASN 4 H ASN 4 13.488 -8.327 9.476 43 HA ASN 4 HA ASN 4 11.048 -8.994 7.908 44 HB2 ASN 4 1HB ASN 4 11.439 -8.137 10.799 45 HB3 ASN 4 2HB ASN 4 9.881 -8.489 10.050 46 HD21 ASN 4 2HD2 ASN 4 11.295 -9.869 12.342 47 HD22 ASN 4 1HD2 ASN 4 11.328 -11.544 11.804 48 H TRP 5 H TRP 5 13.064 -6.370 7.905 49 HA TRP 5 HA TRP 5 11.174 -4.181 8.179 50 HB2 TRP 5 1HB TRP 5 13.649 -4.033 8.462 51 HB3 TRP 5 2HB TRP 5 13.843 -4.267 6.723 52 HD1 TRP 5 HD1 TRP 5 14.007 -2.114 5.379 53 HE1 TRP 5 HE1 TRP 5 13.444 0.375 5.752 54 HE3 TRP 5 HE3 TRP 5 11.725 -2.467 9.953 55 HZ2 TRP 5 HZ2 TRP 5 12.170 1.991 7.768 56 HZ3 TRP 5 HZ3 TRP 5 10.836 -0.433 11.077 57 HH2 TRP 5 HH2 TRP 5 11.051 1.794 9.997 58 H PHE 6 H PHE 6 12.316 -6.117 5.455 59 HA PHE 6 HA PHE 6 10.784 -4.590 3.471 60 HB2 PHE 6 1HB PHE 6 13.125 -6.124 3.395 61 HB3 PHE 6 2HB PHE 6 11.968 -7.120 2.547 62 HD1 PHE 6 HD2 PHE 6 10.673 -6.063 0.552 63 HD2 PHE 6 HD1 PHE 6 14.053 -4.152 2.439 64 HE1 PHE 6 HE2 PHE 6 10.920 -4.561 -1.405 65 HE2 PHE 6 HE1 PHE 6 14.305 -2.663 0.468 66 HZ PHE 6 HZ PHE 6 12.736 -2.859 -1.452 67 H ASP 7 H ASP 7 9.450 -6.277 5.689 68 HA ASP 7 HA ASP 7 8.032 -8.472 4.595 69 HB2 ASP 7 1HB ASP 7 7.693 -6.642 6.959 70 HB3 ASP 7 2HB ASP 7 6.324 -7.605 6.477 71 H ILE 8 H ILE 8 7.252 -8.134 2.597 72 HA ILE 8 HA ILE 8 5.695 -6.034 1.651 73 HB ILE 8 HB ILE 8 4.915 -7.494 -0.128 74 HG12 ILE 8 1HG1 ILE 8 6.314 -9.791 1.311 75 HG13 ILE 8 2HG1 ILE 8 4.563 -9.562 1.278 76 HG21 ILE 8 1HG2 ILE 8 7.861 -7.974 0.495 77 HG22 ILE 8 2HG2 ILE 8 7.091 -7.903 -1.102 78 HG23 ILE 8 3HG2 ILE 8 7.193 -6.446 -0.112 79 HD11 ILE 8 3HD1 ILE 8 5.174 -11.194 -0.388 80 HD12 ILE 8 1HD1 ILE 8 4.557 -9.736 -1.189 81 HD13 ILE 8 2HD1 ILE 8 6.307 -10.072 -1.159 82 H THR 9 H THR 9 4.601 -8.493 3.814 83 HA THR 9 HA THR 9 1.794 -8.436 3.386 84 HB THR 9 HB THR 9 3.064 -9.987 4.884 85 HG1 THR 9 HG1 THR 9 1.353 -10.161 6.339 86 HG21 THR 9 3HG2 THR 9 3.475 -9.459 7.186 87 HG22 THR 9 1HG2 THR 9 2.755 -7.845 7.027 88 HG23 THR 9 2HG2 THR 9 4.286 -8.225 6.216 89 H ASN 10 H ASN 10 3.867 -6.070 5.034 90 HA ASN 10 HA ASN 10 1.552 -4.438 5.864 91 HB2 ASN 10 1HB ASN 10 3.773 -4.787 7.160 92 HB3 ASN 10 2HB ASN 10 4.472 -3.630 6.021 93 HD21 ASN 10 2HD2 ASN 10 4.678 -2.827 8.531 94 HD22 ASN 10 1HD2 ASN 10 3.404 -1.686 8.956 95 H TRP 11 H TRP 11 3.919 -4.516 3.198 96 HA TRP 11 HA TRP 11 3.455 -1.925 2.129 97 HB2 TRP 11 1HB TRP 11 4.291 -4.518 0.824 98 HB3 TRP 11 2HB TRP 11 4.043 -3.052 -0.073 99 HD1 TRP 11 HD1 TRP 11 6.230 -4.099 2.979 100 HE1 TRP 11 HE1 TRP 11 8.486 -2.877 2.783 101 HE3 TRP 11 HE3 TRP 11 5.230 -1.273 -1.121 102 HZ2 TRP 11 HZ2 TRP 11 9.725 -0.961 1.008 103 HZ3 TRP 11 HZ3 TRP 11 6.968 0.266 -2.080 104 HH2 TRP 11 HH2 TRP 11 9.213 0.416 -1.018 105 H LEU 12 H LEU 12 1.539 -4.878 1.894 106 HA LEU 12 HA LEU 12 -0.276 -4.204 -0.156 107 HB2 LEU 12 1HB LEU 12 -1.020 -5.593 2.442 108 HB3 LEU 12 2HB LEU 12 -1.861 -5.700 0.899 109 HG LEU 12 HG LEU 12 0.843 -6.858 1.606 110 HD11 LEU 12 1HD1 LEU 12 -0.232 -9.007 1.225 111 HD12 LEU 12 2HD1 LEU 12 -1.760 -8.192 0.818 112 HD13 LEU 12 3HD1 LEU 12 -1.096 -8.082 2.464 113 HD21 LEU 12 3HD2 LEU 12 -0.582 -6.956 -1.082 114 HD22 LEU 12 1HD2 LEU 12 0.867 -7.892 -0.637 115 HD23 LEU 12 2HD2 LEU 12 0.960 -6.134 -0.739 116 H TRP 13 H TRP 13 -0.096 -2.887 3.108 117 HA TRP 13 HA TRP 13 -2.742 -1.767 3.265 118 HB2 TRP 13 1HB TRP 13 -1.162 -2.116 5.164 119 HB3 TRP 13 2HB TRP 13 -0.193 -0.771 4.587 120 HD1 TRP 13 HD1 TRP 13 -3.646 -1.513 6.088 121 HE1 TRP 13 HE1 TRP 13 -4.605 0.636 7.141 122 HE3 TRP 13 HE3 TRP 13 -0.070 1.818 4.555 123 HZ2 TRP 13 HZ2 TRP 13 -3.910 3.425 7.296 124 HZ3 TRP 13 HZ3 TRP 13 -0.254 4.226 5.158 125 HH2 TRP 13 HH2 TRP 13 -2.157 5.039 6.518 126 H TYR 14 H TYR 14 0.381 -0.234 2.336 127 HA TYR 14 HA TYR 14 -0.750 2.281 1.563 128 HB2 TYR 14 1HB TYR 14 1.759 0.976 0.458 129 HB3 TYR 14 2HB TYR 14 1.349 2.682 0.409 130 HD1 TYR 14 HD2 TYR 14 1.239 4.014 2.589 131 HD2 TYR 14 HD1 TYR 14 2.796 0.013 2.349 132 HE1 TYR 14 HE2 TYR 14 2.400 4.330 4.785 133 HE2 TYR 14 HE1 TYR 14 3.937 0.308 4.551 134 HH TYR 14 HH TYR 14 4.371 1.742 6.280 135 H ILE 15 H ILE 15 -0.310 -0.746 -0.210 136 HA ILE 15 HA ILE 15 -1.044 0.360 -2.818 137 HB ILE 15 HB ILE 15 -1.172 -2.530 -1.888 138 HG12 ILE 15 1HG1 ILE 15 1.108 -1.657 -1.769 139 HG13 ILE 15 2HG1 ILE 15 0.936 -2.873 -3.017 140 HG21 ILE 15 1HG2 ILE 15 -1.065 -2.966 -4.407 141 HG22 ILE 15 2HG2 ILE 15 -2.595 -2.327 -3.800 142 HG23 ILE 15 3HG2 ILE 15 -1.468 -1.241 -4.629 143 HD11 ILE 15 3HD1 ILE 15 1.103 0.140 -3.488 144 HD12 ILE 15 1HD1 ILE 15 2.393 -1.043 -3.747 145 HD13 ILE 15 2HD1 ILE 15 0.942 -1.098 -4.760 146 H LYS 16 H LYS 16 -2.919 -1.410 -0.337 147 HA LYS 16 HA LYS 16 -5.438 -1.174 -1.722 148 HB2 LYS 16 1HB LYS 16 -4.685 -2.687 0.286 149 HB3 LYS 16 2HB LYS 16 -5.213 -1.354 1.299 150 HG2 LYS 16 1HG LYS 16 -7.250 -2.042 -0.737 151 HG3 LYS 16 2HG LYS 16 -6.696 -3.478 0.115 152 HD2 LYS 16 1HD LYS 16 -7.139 -2.133 2.304 153 HD3 LYS 16 2HD LYS 16 -8.071 -1.031 1.260 154 HE2 LYS 16 1HE LYS 16 -9.414 -2.994 0.460 155 HE3 LYS 16 2HE LYS 16 -8.456 -4.057 1.496 156 HZ1 LYS 16 3HZ LYS 16 -10.510 -3.486 2.597 157 HZ2 LYS 16 1HZ LYS 16 -10.238 -1.883 2.450 158 HZ3 LYS 16 2HZ LYS 16 -9.291 -2.792 3.426 159 H LEU 17 H LEU 17 -3.933 0.874 0.758 160 HA LEU 17 HA LEU 17 -5.981 2.852 0.925 161 HB2 LEU 17 1HB LEU 17 -4.241 2.553 2.612 162 HB3 LEU 17 2HB LEU 17 -2.997 3.068 1.482 163 HG LEU 17 HG LEU 17 -5.204 5.036 1.706 164 HD11 LEU 17 1HD1 LEU 17 -4.661 5.860 3.932 165 HD12 LEU 17 2HD1 LEU 17 -3.587 4.465 4.186 166 HD13 LEU 17 3HD1 LEU 17 -5.337 4.221 3.997 167 HD21 LEU 17 3HD2 LEU 17 -2.223 5.289 2.275 168 HD22 LEU 17 1HD2 LEU 17 -3.371 6.613 1.982 169 HD23 LEU 17 2HD2 LEU 17 -2.970 5.492 0.672 170 H PHE 18 H PHE 18 -3.291 2.553 -1.432 171 HA PHE 18 HA PHE 18 -3.390 5.062 -2.590 172 HB2 PHE 18 1HB PHE 18 -1.797 3.473 -3.353 173 HB3 PHE 18 2HB PHE 18 -3.038 2.381 -3.941 174 HD1 PHE 18 HD1 PHE 18 -2.662 6.128 -4.501 175 HD2 PHE 18 HD2 PHE 18 -2.766 2.168 -6.224 176 HE1 PHE 18 HE1 PHE 18 -2.450 7.103 -6.756 177 HE2 PHE 18 HE2 PHE 18 -2.602 3.164 -8.494 178 HZ PHE 18 HZ PHE 18 -2.432 5.632 -8.762 179 H ILE 19 H ILE 19 -5.781 2.454 -3.137 180 HA ILE 19 HA ILE 19 -7.372 3.974 -5.017 181 HB ILE 19 HB ILE 19 -8.130 1.609 -3.261 182 HG12 ILE 19 1HG1 ILE 19 -8.069 0.424 -5.594 183 HG13 ILE 19 2HG1 ILE 19 -7.054 1.766 -6.103 184 HG21 ILE 19 1HG2 ILE 19 -9.606 3.039 -5.479 185 HG22 ILE 19 2HG2 ILE 19 -9.983 1.350 -5.044 186 HG23 ILE 19 3HG2 ILE 19 -10.176 2.629 -3.855 187 HD11 ILE 19 3HD1 ILE 19 -5.326 1.105 -4.545 188 HD12 ILE 19 1HD1 ILE 19 -6.421 -0.057 -3.746 189 HD13 ILE 19 2HD1 ILE 19 -5.860 -0.336 -5.404 190 H MET 20 H MET 20 -7.284 3.849 -1.495 191 HA MET 20 HA MET 20 -9.881 5.116 -1.063 192 HB2 MET 20 1HB MET 20 -7.543 4.747 0.850 193 HB3 MET 20 2HB MET 20 -9.177 5.245 1.284 194 HG2 MET 20 1HG MET 20 -10.091 3.097 0.577 195 HG3 MET 20 2HG MET 20 -8.534 2.599 -0.077 196 HE1 MET 20 3HE MET 20 -10.816 2.671 3.068 197 HE2 MET 20 1HE MET 20 -9.647 2.732 4.403 198 HE3 MET 20 2HE MET 20 -9.849 4.139 3.338 199 H ILE 21 H ILE 21 -6.480 6.285 -0.978 200 HA ILE 21 HA ILE 21 -7.173 9.007 -0.346 201 HB ILE 21 HB ILE 21 -4.965 8.155 0.123 202 HG12 ILE 21 1HG1 ILE 21 -3.527 9.956 -0.757 203 HG13 ILE 21 2HG1 ILE 21 -4.763 10.413 -1.922 204 HG21 ILE 21 1HG2 ILE 21 -3.262 7.721 -1.537 205 HG22 ILE 21 2HG2 ILE 21 -4.648 6.686 -1.838 206 HG23 ILE 21 3HG2 ILE 21 -4.374 8.106 -2.867 207 HD11 ILE 21 3HD1 ILE 21 -4.696 11.890 0.072 208 HD12 ILE 21 1HD1 ILE 21 -6.268 11.087 -0.076 209 HD13 ILE 21 2HD1 ILE 21 -5.076 10.505 1.115 210 H VAL 22 H VAL 22 -6.617 7.424 -3.507 211 HA VAL 22 HA VAL 22 -7.072 9.819 -5.073 212 HB VAL 22 HB VAL 22 -7.341 8.315 -6.981 213 HG11 VAL 22 1HG1 VAL 22 -5.113 8.937 -6.318 214 HG12 VAL 22 2HG1 VAL 22 -5.024 7.518 -5.235 215 HG13 VAL 22 3HG1 VAL 22 -5.160 7.286 -6.982 216 HG21 VAL 22 3HG2 VAL 22 -7.436 6.145 -4.955 217 HG22 VAL 22 1HG2 VAL 22 -8.550 6.467 -6.266 218 HG23 VAL 22 2HG2 VAL 22 -6.925 5.828 -6.608 219 H GLY 23 H GLY 23 -9.273 7.323 -3.870 220 HA2 GLY 23 1HA GLY 23 -11.473 6.884 -4.100 221 HA3 GLY 23 2HA GLY 23 -11.755 8.632 -4.089 222 H GLY 24 H GLY 24 -11.983 9.702 -6.068 223 HA2 GLY 24 1HA GLY 24 -13.100 8.178 -8.292 224 HA3 GLY 24 2HA GLY 24 -12.907 9.926 -8.206 225 H LEU 25 H LEU 25 -9.894 9.589 -7.682 226 HA LEU 25 HA LEU 25 -9.160 9.542 -10.513 227 HB2 LEU 25 1HB LEU 25 -7.009 9.740 -8.451 228 HB3 LEU 25 2HB LEU 25 -7.138 10.463 -10.021 229 HG LEU 25 HG LEU 25 -8.672 11.332 -7.548 230 HD11 LEU 25 1HD1 LEU 25 -7.209 13.282 -7.583 231 HD12 LEU 25 2HD1 LEU 25 -6.329 12.619 -8.981 232 HD13 LEU 25 3HD1 LEU 25 -6.278 11.786 -7.410 233 HD21 LEU 25 3HD2 LEU 25 -9.302 13.320 -8.869 234 HD22 LEU 25 1HD2 LEU 25 -9.929 11.857 -9.639 235 HD23 LEU 25 2HD2 LEU 25 -8.481 12.650 -10.297 236 H VAL 26 H VAL 26 -9.628 6.985 -8.527 237 HA VAL 26 HA VAL 26 -7.425 5.290 -8.657 238 HB VAL 26 HB VAL 26 -9.531 4.862 -7.420 239 HG11 VAL 26 1HG1 VAL 26 -11.180 5.317 -9.239 240 HG12 VAL 26 2HG1 VAL 26 -10.694 3.787 -10.014 241 HG13 VAL 26 3HG1 VAL 26 -11.429 3.783 -8.402 242 HG21 VAL 26 3HG2 VAL 26 -8.650 2.536 -9.164 243 HG22 VAL 26 1HG2 VAL 26 -7.865 3.111 -7.676 244 HG23 VAL 26 2HG2 VAL 26 -9.508 2.438 -7.624 245 H LYS 27 H LYS 27 -9.650 5.963 -11.239 246 HA LYS 27 HA LYS 27 -8.812 3.845 -13.019 247 HB2 LYS 27 1HB LYS 27 -11.005 5.394 -12.856 248 HB3 LYS 27 2HB LYS 27 -10.118 6.358 -14.037 249 HG2 LYS 27 1HG LYS 27 -9.851 4.166 -15.382 250 HG3 LYS 27 2HG LYS 27 -11.003 3.445 -14.252 251 HD2 LYS 27 1HD LYS 27 -11.517 5.930 -15.952 252 HD3 LYS 27 2HD LYS 27 -12.015 4.293 -16.395 253 HE2 LYS 27 1HE LYS 27 -13.505 4.131 -14.490 254 HE3 LYS 27 2HE LYS 27 -12.919 5.660 -13.823 255 HZ1 LYS 27 3HZ LYS 27 -13.853 6.813 -15.729 256 HZ2 LYS 27 1HZ LYS 27 -15.027 5.928 -15.025 257 HZ3 LYS 27 2HZ LYS 27 -14.346 5.415 -16.416 258 H LYS 28 H LYS 28 -7.207 6.742 -12.238 259 HA LYS 28 HA LYS 28 -5.452 6.589 -14.625 260 HB2 LYS 28 1HB LYS 28 -5.359 9.065 -14.749 261 HB3 LYS 28 2HB LYS 28 -6.827 8.322 -15.337 262 HG2 LYS 28 1HG LYS 28 -6.788 9.355 -12.495 263 HG3 LYS 28 2HG LYS 28 -6.843 10.519 -13.805 264 HD2 LYS 28 1HD LYS 28 -8.802 8.213 -13.707 265 HD3 LYS 28 2HD LYS 28 -9.087 9.662 -12.757 266 HE2 LYS 28 1HE LYS 28 -8.640 9.717 -15.772 267 HE3 LYS 28 2HE LYS 28 -10.229 9.519 -15.029 268 HZ1 LYS 28 3HZ LYS 28 -8.462 11.879 -14.683 269 HZ2 LYS 28 1HZ LYS 28 -9.867 11.659 -13.872 270 HZ3 LYS 28 2HZ LYS 28 -9.878 11.831 -15.490 Start of MODEL 16 1 H1 LYS 1 1H LYS 1 15.760 -4.562 14.309 2 H2 LYS 1 2H LYS 1 16.719 -4.487 13.002 3 H3 LYS 1 3H LYS 1 15.318 -3.639 13.037 4 HA LYS 1 HA LYS 1 15.575 -6.579 12.989 5 HB2 LYS 1 1HB LYS 1 13.092 -6.675 12.916 6 HB3 LYS 1 2HB LYS 1 13.765 -6.124 14.439 7 HG2 LYS 1 1HG LYS 1 13.158 -3.831 14.011 8 HG3 LYS 1 2HG LYS 1 12.767 -4.172 12.326 9 HD2 LYS 1 1HD LYS 1 10.759 -3.848 13.621 10 HD3 LYS 1 2HD LYS 1 10.814 -5.499 13.002 11 HE2 LYS 1 1HE LYS 1 10.946 -6.440 15.080 12 HE3 LYS 1 2HE LYS 1 12.012 -5.181 15.709 13 HZ1 LYS 1 3HZ LYS 1 9.808 -5.132 16.756 14 HZ2 LYS 1 1HZ LYS 1 9.089 -4.828 15.323 15 HZ3 LYS 1 2HZ LYS 1 10.108 -3.732 15.980 16 H LYS 2 H LYS 2 16.964 -5.451 10.985 17 HA LYS 2 HA LYS 2 15.550 -4.640 8.649 18 HB2 LYS 2 1HB LYS 2 18.293 -5.849 9.099 19 HB3 LYS 2 2HB LYS 2 17.734 -5.401 7.492 20 HG2 LYS 2 1HG LYS 2 17.566 -3.376 9.746 21 HG3 LYS 2 2HG LYS 2 19.110 -3.676 8.964 22 HD2 LYS 2 1HD LYS 2 16.632 -2.977 7.335 23 HD3 LYS 2 2HD LYS 2 17.653 -1.738 8.080 24 HE2 LYS 2 1HE LYS 2 19.638 -2.595 6.908 25 HE3 LYS 2 2HE LYS 2 18.680 -3.879 6.163 26 HZ1 LYS 2 3HZ LYS 2 18.242 -0.971 5.724 27 HZ2 LYS 2 1HZ LYS 2 17.395 -2.172 5.005 28 HZ3 LYS 2 2HZ LYS 2 18.980 -1.975 4.673 29 H LYS 3 H LYS 3 16.293 -7.865 9.759 30 HA LYS 3 HA LYS 3 15.594 -9.480 7.550 31 HB2 LYS 3 1HB LYS 3 15.836 -9.763 10.488 32 HB3 LYS 3 2HB LYS 3 14.613 -10.829 9.848 33 HG2 LYS 3 1HG LYS 3 17.392 -10.704 8.617 34 HG3 LYS 3 2HG LYS 3 17.023 -11.690 10.039 35 HD2 LYS 3 1HD LYS 3 15.166 -12.799 8.741 36 HD3 LYS 3 2HD LYS 3 15.733 -11.977 7.284 37 HE2 LYS 3 1HE LYS 3 17.444 -13.803 9.044 38 HE3 LYS 3 2HE LYS 3 16.532 -14.375 7.648 39 HZ1 LYS 3 3HZ LYS 3 17.846 -12.906 6.237 40 HZ2 LYS 3 1HZ LYS 3 18.835 -13.900 7.066 41 HZ3 LYS 3 2HZ LYS 3 18.693 -12.340 7.518 42 H ASN 4 H ASN 4 13.429 -7.680 9.605 43 HA ASN 4 HA ASN 4 11.019 -8.857 8.267 44 HB2 ASN 4 1HB ASN 4 11.504 -7.781 11.067 45 HB3 ASN 4 2HB ASN 4 9.888 -7.838 10.379 46 HD21 ASN 4 2HD2 ASN 4 12.639 -9.940 11.329 47 HD22 ASN 4 1HD2 ASN 4 11.623 -11.375 11.399 48 H TRP 5 H TRP 5 12.958 -6.303 7.734 49 HA TRP 5 HA TRP 5 10.966 -4.157 7.599 50 HB2 TRP 5 1HB TRP 5 13.491 -3.998 8.052 51 HB3 TRP 5 2HB TRP 5 13.710 -4.194 6.314 52 HD1 TRP 5 HD1 TRP 5 13.285 -2.047 4.854 53 HE1 TRP 5 HE1 TRP 5 12.721 0.417 5.377 54 HE3 TRP 5 HE3 TRP 5 12.069 -2.524 9.804 55 HZ2 TRP 5 HZ2 TRP 5 11.853 1.967 7.648 56 HZ3 TRP 5 HZ3 TRP 5 11.367 -0.535 11.129 57 HH2 TRP 5 HH2 TRP 5 11.257 1.706 10.064 58 H PHE 6 H PHE 6 12.050 -6.652 5.446 59 HA PHE 6 HA PHE 6 10.786 -5.441 3.059 60 HB2 PHE 6 1HB PHE 6 13.039 -7.079 3.444 61 HB3 PHE 6 2HB PHE 6 11.865 -8.150 2.725 62 HD1 PHE 6 HD1 PHE 6 10.684 -7.344 0.526 63 HD2 PHE 6 HD2 PHE 6 14.195 -5.458 2.175 64 HE1 PHE 6 HE1 PHE 6 11.134 -6.266 -1.665 65 HE2 PHE 6 HE2 PHE 6 14.652 -4.392 -0.026 66 HZ PHE 6 HZ PHE 6 13.118 -4.789 -1.945 67 H ASP 7 H ASP 7 9.202 -6.322 5.428 68 HA ASP 7 HA ASP 7 7.756 -8.734 4.845 69 HB2 ASP 7 1HB ASP 7 6.364 -8.100 6.682 70 HB3 ASP 7 2HB ASP 7 8.060 -7.981 7.094 71 H ILE 8 H ILE 8 7.218 -8.363 2.644 72 HA ILE 8 HA ILE 8 5.602 -6.388 1.584 73 HB ILE 8 HB ILE 8 4.926 -7.858 -0.199 74 HG12 ILE 8 1HG1 ILE 8 6.161 -10.152 1.387 75 HG13 ILE 8 2HG1 ILE 8 4.430 -9.899 1.124 76 HG21 ILE 8 1HG2 ILE 8 7.221 -6.838 -0.061 77 HG22 ILE 8 2HG2 ILE 8 7.829 -8.393 0.545 78 HG23 ILE 8 3HG2 ILE 8 7.124 -8.276 -1.078 79 HD11 ILE 8 3HD1 ILE 8 4.766 -10.108 -1.331 80 HD12 ILE 8 1HD1 ILE 8 6.477 -10.507 -1.038 81 HD13 ILE 8 2HD1 ILE 8 5.201 -11.569 -0.424 82 H THR 9 H THR 9 4.473 -8.855 3.711 83 HA THR 9 HA THR 9 1.667 -8.820 3.247 84 HB THR 9 HB THR 9 2.647 -10.468 4.666 85 HG1 THR 9 HG1 THR 9 1.258 -10.294 6.447 86 HG21 THR 9 3HG2 THR 9 4.493 -9.243 5.731 87 HG22 THR 9 1HG2 THR 9 3.476 -10.029 6.935 88 HG23 THR 9 2HG2 THR 9 3.333 -8.282 6.677 89 H ASN 10 H ASN 10 3.701 -6.501 5.034 90 HA ASN 10 HA ASN 10 1.371 -4.836 5.788 91 HB2 ASN 10 1HB ASN 10 4.344 -4.759 6.338 92 HB3 ASN 10 2HB ASN 10 3.385 -3.294 6.511 93 HD21 ASN 10 2HD2 ASN 10 2.333 -2.966 8.446 94 HD22 ASN 10 1HD2 ASN 10 2.036 -4.263 9.597 95 H TRP 11 H TRP 11 3.800 -4.915 3.182 96 HA TRP 11 HA TRP 11 3.396 -2.270 2.209 97 HB2 TRP 11 1HB TRP 11 4.239 -4.824 0.833 98 HB3 TRP 11 2HB TRP 11 4.011 -3.333 -0.026 99 HD1 TRP 11 HD1 TRP 11 6.137 -4.460 3.043 100 HE1 TRP 11 HE1 TRP 11 8.395 -3.234 2.926 101 HE3 TRP 11 HE3 TRP 11 5.216 -1.529 -1.002 102 HZ2 TRP 11 HZ2 TRP 11 9.665 -1.264 1.226 103 HZ3 TRP 11 HZ3 TRP 11 6.964 0.038 -1.883 104 HH2 TRP 11 HH2 TRP 11 9.189 0.168 -0.772 105 H LEU 12 H LEU 12 1.445 -5.184 1.847 106 HA LEU 12 HA LEU 12 -0.327 -4.433 -0.213 107 HB2 LEU 12 1HB LEU 12 -1.130 -5.874 2.338 108 HB3 LEU 12 2HB LEU 12 -1.950 -5.931 0.782 109 HG LEU 12 HG LEU 12 0.732 -7.147 1.490 110 HD11 LEU 12 1HD1 LEU 12 -0.386 -9.270 1.058 111 HD12 LEU 12 2HD1 LEU 12 -1.898 -8.416 0.670 112 HD13 LEU 12 3HD1 LEU 12 -1.229 -8.356 2.318 113 HD21 LEU 12 3HD2 LEU 12 -0.687 -7.184 -1.204 114 HD22 LEU 12 1HD2 LEU 12 0.755 -8.136 -0.767 115 HD23 LEU 12 2HD2 LEU 12 0.860 -6.378 -0.843 116 H TRP 13 H TRP 13 -0.201 -3.219 3.093 117 HA TRP 13 HA TRP 13 -2.830 -2.071 3.241 118 HB2 TRP 13 1HB TRP 13 -1.284 -2.480 5.151 119 HB3 TRP 13 2HB TRP 13 -0.286 -1.137 4.618 120 HD1 TRP 13 HD1 TRP 13 -3.771 -1.862 6.050 121 HE1 TRP 13 HE1 TRP 13 -4.714 0.275 7.145 122 HE3 TRP 13 HE3 TRP 13 -0.118 1.454 4.666 123 HZ2 TRP 13 HZ2 TRP 13 -3.980 3.047 7.383 124 HZ3 TRP 13 HZ3 TRP 13 -0.275 3.846 5.331 125 HH2 TRP 13 HH2 TRP 13 -2.190 4.652 6.683 126 H TYR 14 H TYR 14 0.312 -0.543 2.386 127 HA TYR 14 HA TYR 14 -0.782 2.003 1.658 128 HB2 TYR 14 1HB TYR 14 1.727 0.690 0.558 129 HB3 TYR 14 2HB TYR 14 1.338 2.402 0.537 130 HD1 TYR 14 HD1 TYR 14 1.240 3.702 2.732 131 HD2 TYR 14 HD2 TYR 14 2.717 -0.329 2.450 132 HE1 TYR 14 HE1 TYR 14 2.374 3.959 4.948 133 HE2 TYR 14 HE2 TYR 14 3.836 -0.088 4.670 134 HH TYR 14 HH TYR 14 4.273 1.310 6.430 135 H ILE 15 H ILE 15 -0.356 -0.996 -0.174 136 HA ILE 15 HA ILE 15 -1.063 0.176 -2.757 137 HB ILE 15 HB ILE 15 -1.242 -2.738 -1.925 138 HG12 ILE 15 1HG1 ILE 15 1.044 -1.909 -1.716 139 HG13 ILE 15 2HG1 ILE 15 0.892 -3.065 -3.022 140 HG21 ILE 15 1HG2 ILE 15 -1.084 -3.088 -4.451 141 HG22 ILE 15 2HG2 ILE 15 -2.615 -2.428 -3.864 142 HG23 ILE 15 3HG2 ILE 15 -1.436 -1.347 -4.625 143 HD11 ILE 15 3HD1 ILE 15 1.107 -0.035 -3.356 144 HD12 ILE 15 1HD1 ILE 15 2.393 -1.219 -3.624 145 HD13 ILE 15 2HD1 ILE 15 0.973 -1.216 -4.683 146 H LYS 16 H LYS 16 -2.994 -1.580 -0.304 147 HA LYS 16 HA LYS 16 -5.509 -1.251 -1.700 148 HB2 LYS 16 1HB LYS 16 -4.699 -2.409 0.796 149 HB3 LYS 16 2HB LYS 16 -5.868 -1.172 1.198 150 HG2 LYS 16 1HG LYS 16 -7.171 -2.386 -0.907 151 HG3 LYS 16 2HG LYS 16 -6.195 -3.731 -0.307 152 HD2 LYS 16 1HD LYS 16 -7.189 -2.956 2.063 153 HD3 LYS 16 2HD LYS 16 -8.368 -2.125 1.045 154 HE2 LYS 16 1HE LYS 16 -9.472 -4.117 1.352 155 HE3 LYS 16 2HE LYS 16 -8.606 -4.474 -0.145 156 HZ1 LYS 16 3HZ LYS 16 -8.335 -6.266 1.467 157 HZ2 LYS 16 1HZ LYS 16 -7.749 -5.253 2.599 158 HZ3 LYS 16 2HZ LYS 16 -6.878 -5.563 1.250 159 H LEU 17 H LEU 17 -3.997 0.717 0.839 160 HA LEU 17 HA LEU 17 -5.957 2.756 0.984 161 HB2 LEU 17 1HB LEU 17 -4.257 2.363 2.678 162 HB3 LEU 17 2HB LEU 17 -2.981 2.890 1.587 163 HG LEU 17 HG LEU 17 -5.158 4.887 1.834 164 HD11 LEU 17 1HD1 LEU 17 -5.344 3.995 4.096 165 HD12 LEU 17 2HD1 LEU 17 -4.646 5.624 4.099 166 HD13 LEU 17 3HD1 LEU 17 -3.594 4.209 4.323 167 HD21 LEU 17 3HD2 LEU 17 -3.302 6.423 2.208 168 HD22 LEU 17 1HD2 LEU 17 -2.913 5.351 0.853 169 HD23 LEU 17 2HD2 LEU 17 -2.183 5.063 2.452 170 H PHE 18 H PHE 18 -3.263 2.431 -1.336 171 HA PHE 18 HA PHE 18 -3.283 4.955 -2.471 172 HB2 PHE 18 1HB PHE 18 -1.714 3.330 -3.215 173 HB3 PHE 18 2HB PHE 18 -2.973 2.269 -3.820 174 HD1 PHE 18 HD1 PHE 18 -2.532 6.009 -4.381 175 HD2 PHE 18 HD2 PHE 18 -2.639 2.042 -6.097 176 HE1 PHE 18 HE1 PHE 18 -2.272 6.974 -6.630 177 HE2 PHE 18 HE2 PHE 18 -2.422 3.031 -8.364 178 HZ PHE 18 HZ PHE 18 -2.225 5.488 -8.633 179 H ILE 19 H ILE 19 -5.749 2.413 -3.044 180 HA ILE 19 HA ILE 19 -7.244 4.012 -4.955 181 HB ILE 19 HB ILE 19 -8.093 1.613 -3.296 182 HG12 ILE 19 1HG1 ILE 19 -8.024 0.539 -5.702 183 HG13 ILE 19 2HG1 ILE 19 -6.943 1.868 -6.098 184 HG21 ILE 19 1HG2 ILE 19 -9.928 1.449 -5.090 185 HG22 ILE 19 2HG2 ILE 19 -10.105 2.717 -3.890 186 HG23 ILE 19 3HG2 ILE 19 -9.502 3.132 -5.501 187 HD11 ILE 19 3HD1 ILE 19 -5.309 1.061 -4.493 188 HD12 ILE 19 1HD1 ILE 19 -6.471 -0.127 -3.842 189 HD13 ILE 19 2HD1 ILE 19 -5.833 -0.296 -5.487 190 H MET 20 H MET 20 -7.207 3.819 -1.446 191 HA MET 20 HA MET 20 -9.789 5.115 -1.017 192 HB2 MET 20 1HB MET 20 -7.504 4.803 0.966 193 HB3 MET 20 2HB MET 20 -9.197 5.153 1.317 194 HG2 MET 20 1HG MET 20 -9.827 2.930 0.356 195 HG3 MET 20 2HG MET 20 -8.118 2.591 0.083 196 HE1 MET 20 3HE MET 20 -8.427 0.089 2.866 197 HE2 MET 20 1HE MET 20 -9.067 0.366 1.228 198 HE3 MET 20 2HE MET 20 -7.341 0.623 1.566 199 H ILE 21 H ILE 21 -6.379 6.217 -0.825 200 HA ILE 21 HA ILE 21 -6.993 8.943 -0.162 201 HB ILE 21 HB ILE 21 -4.835 7.978 0.303 202 HG12 ILE 21 1HG1 ILE 21 -4.543 10.321 -1.629 203 HG13 ILE 21 2HG1 ILE 21 -5.130 10.449 0.033 204 HG21 ILE 21 1HG2 ILE 21 -4.153 8.077 -2.667 205 HG22 ILE 21 2HG2 ILE 21 -3.144 7.481 -1.329 206 HG23 ILE 21 3HG2 ILE 21 -4.589 6.607 -1.778 207 HD11 ILE 21 3HD1 ILE 21 -2.795 11.075 -0.038 208 HD12 ILE 21 1HD1 ILE 21 -2.942 9.542 0.849 209 HD13 ILE 21 2HD1 ILE 21 -2.345 9.561 -0.830 210 H VAL 22 H VAL 22 -6.478 7.405 -3.351 211 HA VAL 22 HA VAL 22 -6.855 9.854 -4.863 212 HB VAL 22 HB VAL 22 -7.108 8.412 -6.816 213 HG11 VAL 22 1HG1 VAL 22 -4.843 7.520 -5.047 214 HG12 VAL 22 2HG1 VAL 22 -4.947 7.334 -6.802 215 HG13 VAL 22 3HG1 VAL 22 -4.882 8.966 -6.093 216 HG21 VAL 22 3HG2 VAL 22 -6.760 5.909 -6.525 217 HG22 VAL 22 1HG2 VAL 22 -7.275 6.175 -4.863 218 HG23 VAL 22 2HG2 VAL 22 -8.373 6.568 -6.171 219 H GLY 23 H GLY 23 -9.107 7.379 -3.731 220 HA2 GLY 23 1HA GLY 23 -11.288 6.927 -4.055 221 HA3 GLY 23 2HA GLY 23 -11.582 8.671 -3.979 222 H GLY 24 H GLY 24 -11.790 9.814 -5.912 223 HA2 GLY 24 1HA GLY 24 -12.891 8.393 -8.196 224 HA3 GLY 24 2HA GLY 24 -12.650 10.132 -8.060 225 H LEU 25 H LEU 25 -9.655 9.732 -7.547 226 HA LEU 25 HA LEU 25 -8.915 9.748 -10.380 227 HB2 LEU 25 1HB LEU 25 -6.773 9.832 -8.296 228 HB3 LEU 25 2HB LEU 25 -6.870 10.603 -9.846 229 HG LEU 25 HG LEU 25 -8.377 11.443 -7.346 230 HD11 LEU 25 1HD1 LEU 25 -6.867 13.362 -7.353 231 HD12 LEU 25 2HD1 LEU 25 -6.020 12.710 -8.776 232 HD13 LEU 25 3HD1 LEU 25 -5.970 11.841 -7.225 233 HD21 LEU 25 3HD2 LEU 25 -9.648 12.056 -9.400 234 HD22 LEU 25 1HD2 LEU 25 -8.188 12.811 -10.073 235 HD23 LEU 25 2HD2 LEU 25 -8.960 13.486 -8.620 236 H VAL 26 H VAL 26 -9.419 7.139 -8.460 237 HA VAL 26 HA VAL 26 -7.227 5.436 -8.627 238 HB VAL 26 HB VAL 26 -9.308 4.980 -7.384 239 HG11 VAL 26 1HG1 VAL 26 -11.245 3.978 -8.346 240 HG12 VAL 26 2HG1 VAL 26 -10.978 5.513 -9.177 241 HG13 VAL 26 3HG1 VAL 26 -10.540 3.977 -9.969 242 HG21 VAL 26 3HG2 VAL 26 -8.516 2.695 -9.222 243 HG22 VAL 26 1HG2 VAL 26 -7.669 3.206 -7.745 244 HG23 VAL 26 2HG2 VAL 26 -9.323 2.566 -7.658 245 H LYS 27 H LYS 27 -9.499 6.109 -11.194 246 HA LYS 27 HA LYS 27 -8.617 4.059 -13.032 247 HB2 LYS 27 1HB LYS 27 -10.221 6.610 -13.393 248 HB3 LYS 27 2HB LYS 27 -9.877 5.486 -14.718 249 HG2 LYS 27 1HG LYS 27 -10.930 3.635 -13.498 250 HG3 LYS 27 2HG LYS 27 -11.255 4.696 -12.125 251 HD2 LYS 27 1HD LYS 27 -12.717 6.113 -13.575 252 HD3 LYS 27 2HD LYS 27 -12.343 5.055 -14.955 253 HE2 LYS 27 1HE LYS 27 -13.257 3.116 -13.546 254 HE3 LYS 27 2HE LYS 27 -13.845 4.328 -12.402 255 HZ1 LYS 27 3HZ LYS 27 -15.563 3.731 -14.010 256 HZ2 LYS 27 1HZ LYS 27 -14.617 4.145 -15.269 257 HZ3 LYS 27 2HZ LYS 27 -15.156 5.295 -14.239 258 H LYS 28 H LYS 28 -7.240 7.102 -12.245 259 HA LYS 28 HA LYS 28 -6.146 8.774 -13.384 260 HB2 LYS 28 1HB LYS 28 -4.340 6.411 -13.954 261 HB3 LYS 28 2HB LYS 28 -3.926 8.107 -14.241 262 HG2 LYS 28 1HG LYS 28 -4.491 8.534 -11.758 263 HG3 LYS 28 2HG LYS 28 -4.451 6.766 -11.569 264 HD2 LYS 28 1HD LYS 28 -2.146 6.779 -12.584 265 HD3 LYS 28 2HD LYS 28 -2.230 8.553 -12.657 266 HE2 LYS 28 1HE LYS 28 -2.452 8.661 -10.197 267 HE3 LYS 28 2HE LYS 28 -2.434 6.895 -10.110 268 HZ1 LYS 28 3HZ LYS 28 -0.168 6.954 -11.050 269 HZ2 LYS 28 1HZ LYS 28 -0.228 7.801 -9.657 270 HZ3 LYS 28 2HZ LYS 28 -0.190 8.586 -11.085 Start of MODEL 17 1 H1 LYS 1 1H LYS 1 10.887 -2.699 14.296 2 H2 LYS 1 2H LYS 1 12.356 -2.630 13.621 3 H3 LYS 1 3H LYS 1 11.103 -1.770 12.975 4 HA LYS 1 HA LYS 1 11.340 -4.711 13.076 5 HB2 LYS 1 1HB LYS 1 8.968 -3.487 13.300 6 HB3 LYS 1 2HB LYS 1 9.126 -3.360 11.551 7 HG2 LYS 1 1HG LYS 1 9.770 -5.992 11.872 8 HG3 LYS 1 2HG LYS 1 8.817 -5.790 13.323 9 HD2 LYS 1 1HD LYS 1 7.894 -5.119 10.486 10 HD3 LYS 1 2HD LYS 1 7.556 -6.640 11.296 11 HE2 LYS 1 1HE LYS 1 6.624 -3.918 12.321 12 HE3 LYS 1 2HE LYS 1 5.666 -4.982 11.291 13 HZ1 LYS 1 3HZ LYS 1 5.082 -5.348 13.588 14 HZ2 LYS 1 1HZ LYS 1 6.620 -5.674 14.017 15 HZ3 LYS 1 2HZ LYS 1 5.808 -6.695 13.032 16 H LYS 2 H LYS 2 13.075 -2.427 11.594 17 HA LYS 2 HA LYS 2 12.620 -2.453 8.851 18 HB2 LYS 2 1HB LYS 2 15.110 -2.124 10.551 19 HB3 LYS 2 2HB LYS 2 15.211 -2.012 8.803 20 HG2 LYS 2 1HG LYS 2 13.132 -0.337 10.235 21 HG3 LYS 2 2HG LYS 2 14.831 0.148 10.281 22 HD2 LYS 2 1HD LYS 2 14.961 0.208 7.849 23 HD3 LYS 2 2HD LYS 2 13.290 -0.378 7.700 24 HE2 LYS 2 1HE LYS 2 12.434 1.637 8.788 25 HE3 LYS 2 2HE LYS 2 14.074 2.196 9.142 26 HZ1 LYS 2 3HZ LYS 2 13.151 3.286 7.169 27 HZ2 LYS 2 1HZ LYS 2 12.971 1.857 6.402 28 HZ3 LYS 2 2HZ LYS 2 14.466 2.416 6.760 29 H LYS 3 H LYS 3 14.178 -5.068 10.614 30 HA LYS 3 HA LYS 3 15.338 -6.360 8.289 31 HB2 LYS 3 1HB LYS 3 14.548 -7.657 10.932 32 HB3 LYS 3 2HB LYS 3 15.645 -8.296 9.700 33 HG2 LYS 3 1HG LYS 3 16.873 -5.930 10.086 34 HG3 LYS 3 2HG LYS 3 16.074 -6.050 11.662 35 HD2 LYS 3 1HD LYS 3 17.171 -8.291 11.990 36 HD3 LYS 3 2HD LYS 3 17.949 -8.097 10.400 37 HE2 LYS 3 1HE LYS 3 18.825 -5.828 11.327 38 HE3 LYS 3 2HE LYS 3 18.359 -6.438 12.918 39 HZ1 LYS 3 3HZ LYS 3 19.848 -8.354 12.506 40 HZ2 LYS 3 1HZ LYS 3 20.677 -6.948 12.430 41 HZ3 LYS 3 2HZ LYS 3 20.286 -7.733 11.058 42 H ASN 4 H ASN 4 12.078 -6.278 9.399 43 HA ASN 4 HA ASN 4 11.272 -8.557 7.643 44 HB2 ASN 4 1HB ASN 4 9.791 -7.020 9.806 45 HB3 ASN 4 2HB ASN 4 9.069 -8.272 8.803 46 HD21 ASN 4 2HD2 ASN 4 10.645 -7.812 11.782 47 HD22 ASN 4 1HD2 ASN 4 11.097 -9.497 11.995 48 H TRP 5 H TRP 5 11.994 -5.468 6.951 49 HA TRP 5 HA TRP 5 9.600 -4.478 5.746 50 HB2 TRP 5 1HB TRP 5 11.894 -3.332 6.325 51 HB3 TRP 5 2HB TRP 5 12.324 -3.763 4.670 52 HD1 TRP 5 HD1 TRP 5 11.625 -1.919 2.974 53 HE1 TRP 5 HE1 TRP 5 10.009 0.096 2.975 54 HE3 TRP 5 HE3 TRP 5 9.397 -2.672 7.520 55 HZ2 TRP 5 HZ2 TRP 5 8.023 1.232 4.742 56 HZ3 TRP 5 HZ3 TRP 5 7.640 -1.113 8.341 57 HH2 TRP 5 HH2 TRP 5 6.960 0.838 6.972 58 H PHE 6 H PHE 6 11.805 -6.921 4.579 59 HA PHE 6 HA PHE 6 10.971 -6.816 1.812 60 HB2 PHE 6 1HB PHE 6 12.991 -8.067 3.312 61 HB3 PHE 6 2HB PHE 6 11.994 -9.402 2.795 62 HD1 PHE 6 HD1 PHE 6 11.153 -8.392 -0.005 63 HD2 PHE 6 HD2 PHE 6 14.926 -8.322 2.095 64 HE1 PHE 6 HE1 PHE 6 12.357 -8.426 -2.162 65 HE2 PHE 6 HE2 PHE 6 16.130 -8.361 -0.083 66 HZ PHE 6 HZ PHE 6 14.845 -8.414 -2.213 67 H ASP 7 H ASP 7 9.325 -8.011 4.621 68 HA ASP 7 HA ASP 7 7.902 -10.192 3.325 69 HB2 ASP 7 1HB ASP 7 7.868 -8.926 5.987 70 HB3 ASP 7 2HB ASP 7 6.266 -9.302 5.409 71 H ILE 8 H ILE 8 6.860 -9.769 1.533 72 HA ILE 8 HA ILE 8 5.688 -7.375 0.710 73 HB ILE 8 HB ILE 8 4.465 -8.662 -0.977 74 HG12 ILE 8 1HG1 ILE 8 5.616 -11.175 0.314 75 HG13 ILE 8 2HG1 ILE 8 3.935 -10.659 0.490 76 HG21 ILE 8 1HG2 ILE 8 7.353 -9.584 -0.625 77 HG22 ILE 8 2HG2 ILE 8 6.450 -9.441 -2.146 78 HG23 ILE 8 3HG2 ILE 8 6.850 -7.991 -1.226 79 HD11 ILE 8 3HD1 ILE 8 3.609 -10.797 -1.958 80 HD12 ILE 8 1HD1 ILE 8 5.272 -11.410 -2.136 81 HD13 ILE 8 2HD1 ILE 8 4.073 -12.347 -1.231 82 H THR 9 H THR 9 4.367 -9.513 3.098 83 HA THR 9 HA THR 9 1.561 -9.008 2.860 84 HB THR 9 HB THR 9 1.573 -9.517 5.341 85 HG1 THR 9 HG1 THR 9 3.542 -10.302 6.154 86 HG21 THR 9 3HG2 THR 9 3.048 -11.504 3.555 87 HG22 THR 9 1HG2 THR 9 1.283 -11.307 3.660 88 HG23 THR 9 2HG2 THR 9 2.195 -11.879 5.067 89 H ASN 10 H ASN 10 4.186 -7.182 4.445 90 HA ASN 10 HA ASN 10 2.403 -5.115 5.515 91 HB2 ASN 10 1HB ASN 10 5.410 -5.455 5.256 92 HB3 ASN 10 2HB ASN 10 4.729 -3.880 5.641 93 HD21 ASN 10 2HD2 ASN 10 4.204 -3.433 7.763 94 HD22 ASN 10 1HD2 ASN 10 4.108 -4.684 8.995 95 H TRP 11 H TRP 11 4.190 -5.559 2.479 96 HA TRP 11 HA TRP 11 3.887 -2.904 1.460 97 HB2 TRP 11 1HB TRP 11 4.277 -5.564 0.068 98 HB3 TRP 11 2HB TRP 11 4.121 -4.052 -0.778 99 HD1 TRP 11 HD1 TRP 11 6.434 -5.428 2.057 100 HE1 TRP 11 HE1 TRP 11 8.765 -4.454 1.722 101 HE3 TRP 11 HE3 TRP 11 5.426 -2.461 -1.926 102 HZ2 TRP 11 HZ2 TRP 11 10.088 -2.672 -0.180 103 HZ3 TRP 11 HZ3 TRP 11 7.235 -1.124 -3.039 104 HH2 TRP 11 HH2 TRP 11 9.571 -1.235 -2.165 105 H LEU 12 H LEU 12 1.634 -5.620 1.530 106 HA LEU 12 HA LEU 12 -0.327 -4.719 -0.297 107 HB2 LEU 12 1HB LEU 12 -0.910 -6.026 2.382 108 HB3 LEU 12 2HB LEU 12 -1.934 -6.037 0.953 109 HG LEU 12 HG LEU 12 0.730 -7.451 1.258 110 HD11 LEU 12 1HD1 LEU 12 -2.082 -8.567 1.103 111 HD12 LEU 12 2HD1 LEU 12 -1.071 -8.464 2.562 112 HD13 LEU 12 3HD1 LEU 12 -0.574 -9.506 1.219 113 HD21 LEU 12 3HD2 LEU 12 0.371 -6.800 -1.105 114 HD22 LEU 12 1HD2 LEU 12 -1.229 -7.581 -1.066 115 HD23 LEU 12 2HD2 LEU 12 0.255 -8.546 -0.876 116 H TRP 13 H TRP 13 0.455 -3.419 2.876 117 HA TRP 13 HA TRP 13 -1.999 -1.986 3.360 118 HB2 TRP 13 1HB TRP 13 -0.242 -2.515 5.044 119 HB3 TRP 13 2HB TRP 13 0.805 -1.307 4.317 120 HD1 TRP 13 HD1 TRP 13 -2.478 -1.608 6.277 121 HE1 TRP 13 HE1 TRP 13 -3.048 0.658 7.369 122 HE3 TRP 13 HE3 TRP 13 1.212 1.264 4.183 123 HZ2 TRP 13 HZ2 TRP 13 -2.043 3.353 7.326 124 HZ3 TRP 13 HZ3 TRP 13 1.368 3.690 4.715 125 HH2 TRP 13 HH2 TRP 13 -0.241 4.741 6.276 126 H TYR 14 H TYR 14 1.139 -0.861 1.996 127 HA TYR 14 HA TYR 14 0.242 1.772 1.309 128 HB2 TYR 14 1HB TYR 14 2.402 0.099 -0.034 129 HB3 TYR 14 2HB TYR 14 2.197 1.841 -0.171 130 HD1 TYR 14 HD1 TYR 14 2.454 3.305 1.897 131 HD2 TYR 14 HD2 TYR 14 3.568 -0.854 1.795 132 HE1 TYR 14 HE1 TYR 14 3.832 3.633 3.948 133 HE2 TYR 14 HE2 TYR 14 4.934 -0.536 3.884 134 HH TYR 14 HH TYR 14 5.140 2.654 5.515 135 H ILE 15 H ILE 15 0.118 -1.292 -0.433 136 HA ILE 15 HA ILE 15 -0.792 -0.124 -2.958 137 HB ILE 15 HB ILE 15 -1.097 -2.984 -1.982 138 HG12 ILE 15 1HG1 ILE 15 1.267 -2.237 -2.123 139 HG13 ILE 15 2HG1 ILE 15 0.870 -3.540 -3.220 140 HG21 ILE 15 1HG2 ILE 15 -1.523 -1.690 -4.706 141 HG22 ILE 15 2HG2 ILE 15 -1.294 -3.447 -4.485 142 HG23 ILE 15 3HG2 ILE 15 -2.680 -2.631 -3.753 143 HD11 ILE 15 3HD1 ILE 15 2.396 -1.821 -4.190 144 HD12 ILE 15 1HD1 ILE 15 0.908 -2.022 -5.131 145 HD13 ILE 15 2HD1 ILE 15 1.108 -0.612 -4.060 146 H LYS 16 H LYS 16 -2.550 -1.684 -0.268 147 HA LYS 16 HA LYS 16 -5.201 -1.171 -1.301 148 HB2 LYS 16 1HB LYS 16 -4.627 -2.847 0.390 149 HB3 LYS 16 2HB LYS 16 -4.227 -1.601 1.563 150 HG2 LYS 16 1HG LYS 16 -7.001 -1.703 0.322 151 HG3 LYS 16 2HG LYS 16 -6.523 -2.867 1.552 152 HD2 LYS 16 1HD LYS 16 -5.790 -0.752 2.962 153 HD3 LYS 16 2HD LYS 16 -6.813 0.134 1.826 154 HE2 LYS 16 1HE LYS 16 -8.155 -0.391 3.724 155 HE3 LYS 16 2HE LYS 16 -8.701 -1.425 2.395 156 HZ1 LYS 16 3HZ LYS 16 -8.455 -2.650 4.506 157 HZ2 LYS 16 1HZ LYS 16 -6.866 -2.294 4.576 158 HZ3 LYS 16 2HZ LYS 16 -7.441 -3.256 3.386 159 H LEU 17 H LEU 17 -3.149 0.722 0.919 160 HA LEU 17 HA LEU 17 -4.945 2.905 1.271 161 HB2 LEU 17 1HB LEU 17 -3.064 2.461 2.745 162 HB3 LEU 17 2HB LEU 17 -1.912 2.833 1.469 163 HG LEU 17 HG LEU 17 -3.888 5.004 1.900 164 HD11 LEU 17 1HD1 LEU 17 -3.808 4.234 4.208 165 HD12 LEU 17 2HD1 LEU 17 -2.996 5.800 4.023 166 HD13 LEU 17 3HD1 LEU 17 -2.030 4.314 4.173 167 HD21 LEU 17 3HD2 LEU 17 -1.898 6.411 1.916 168 HD22 LEU 17 1HD2 LEU 17 -1.778 5.250 0.584 169 HD23 LEU 17 2HD2 LEU 17 -0.849 4.986 2.081 170 H PHE 18 H PHE 18 -2.600 2.305 -1.381 171 HA PHE 18 HA PHE 18 -2.639 4.804 -2.581 172 HB2 PHE 18 1HB PHE 18 -1.254 3.089 -3.471 173 HB3 PHE 18 2HB PHE 18 -2.626 2.081 -3.896 174 HD1 PHE 18 HD2 PHE 18 -2.080 5.786 -4.581 175 HD2 PHE 18 HD1 PHE 18 -2.602 1.811 -6.191 176 HE1 PHE 18 HE2 PHE 18 -2.060 6.709 -6.866 177 HE2 PHE 18 HE1 PHE 18 -2.632 2.760 -8.487 178 HZ PHE 18 HZ PHE 18 -2.350 5.208 -8.829 179 H ILE 19 H ILE 19 -5.272 2.384 -2.747 180 HA ILE 19 HA ILE 19 -6.936 4.007 -4.493 181 HB ILE 19 HB ILE 19 -7.664 1.721 -2.631 182 HG12 ILE 19 1HG1 ILE 19 -7.992 0.499 -4.892 183 HG13 ILE 19 2HG1 ILE 19 -7.018 1.777 -5.608 184 HG21 ILE 19 1HG2 ILE 19 -9.681 2.900 -2.967 185 HG22 ILE 19 2HG2 ILE 19 -9.292 3.268 -4.652 186 HG23 ILE 19 3HG2 ILE 19 -9.745 1.614 -4.161 187 HD11 ILE 19 3HD1 ILE 19 -5.833 -0.380 -5.044 188 HD12 ILE 19 1HD1 ILE 19 -5.078 1.061 -4.371 189 HD13 ILE 19 2HD1 ILE 19 -6.066 -0.001 -3.329 190 H MET 20 H MET 20 -6.473 3.857 -1.004 191 HA MET 20 HA MET 20 -8.871 5.329 -0.254 192 HB2 MET 20 1HB MET 20 -6.311 4.773 1.292 193 HB3 MET 20 2HB MET 20 -7.775 5.459 1.977 194 HG2 MET 20 1HG MET 20 -7.858 2.782 0.544 195 HG3 MET 20 2HG MET 20 -7.310 2.892 2.205 196 HE1 MET 20 3HE MET 20 -8.773 4.433 3.985 197 HE2 MET 20 1HE MET 20 -10.314 3.615 4.335 198 HE3 MET 20 2HE MET 20 -8.815 2.672 4.202 199 H ILE 21 H ILE 21 -5.419 6.260 -0.606 200 HA ILE 21 HA ILE 21 -5.810 9.031 0.057 201 HB ILE 21 HB ILE 21 -3.653 7.970 0.250 202 HG12 ILE 21 1HG1 ILE 21 -3.552 10.274 -1.749 203 HG13 ILE 21 2HG1 ILE 21 -3.867 10.441 -0.017 204 HG21 ILE 21 1HG2 ILE 21 -2.228 7.361 -1.578 205 HG22 ILE 21 2HG2 ILE 21 -3.762 6.561 -1.823 206 HG23 ILE 21 3HG2 ILE 21 -3.371 7.996 -2.784 207 HD11 ILE 21 3HD1 ILE 21 -1.550 10.964 -0.449 208 HD12 ILE 21 1HD1 ILE 21 -1.617 9.435 0.455 209 HD13 ILE 21 2HD1 ILE 21 -1.292 9.436 -1.297 210 H VAL 22 H VAL 22 -5.792 7.390 -3.126 211 HA VAL 22 HA VAL 22 -6.224 9.818 -4.650 212 HB VAL 22 HB VAL 22 -6.806 8.354 -6.513 213 HG11 VAL 22 1HG1 VAL 22 -4.388 7.370 -5.015 214 HG12 VAL 22 2HG1 VAL 22 -4.727 7.140 -6.734 215 HG13 VAL 22 3HG1 VAL 22 -4.478 8.785 -6.099 216 HG21 VAL 22 3HG2 VAL 22 -6.832 6.163 -4.498 217 HG22 VAL 22 1HG2 VAL 22 -8.080 6.600 -5.649 218 HG23 VAL 22 2HG2 VAL 22 -6.570 5.844 -6.208 219 H GLY 23 H GLY 23 -8.463 7.520 -3.172 220 HA2 GLY 23 1HA GLY 23 -10.706 7.259 -3.144 221 HA3 GLY 23 2HA GLY 23 -10.843 9.024 -3.156 222 H GLY 24 H GLY 24 -11.207 10.067 -5.124 223 HA2 GLY 24 1HA GLY 24 -12.693 8.592 -7.159 224 HA3 GLY 24 2HA GLY 24 -12.364 10.322 -7.142 225 H LEU 25 H LEU 25 -9.339 9.770 -6.986 226 HA LEU 25 HA LEU 25 -8.972 9.655 -9.888 227 HB2 LEU 25 1HB LEU 25 -6.580 9.682 -8.094 228 HB3 LEU 25 2HB LEU 25 -6.833 10.406 -9.650 229 HG LEU 25 HG LEU 25 -7.961 11.414 -7.016 230 HD11 LEU 25 1HD1 LEU 25 -5.540 11.688 -7.241 231 HD12 LEU 25 2HD1 LEU 25 -6.377 13.247 -7.304 232 HD13 LEU 25 3HD1 LEU 25 -5.766 12.509 -8.803 233 HD21 LEU 25 3HD2 LEU 25 -9.478 12.024 -8.880 234 HD22 LEU 25 1HD2 LEU 25 -8.097 12.645 -9.809 235 HD23 LEU 25 2HD2 LEU 25 -8.600 13.443 -8.301 236 H VAL 26 H VAL 26 -9.358 7.165 -7.813 237 HA VAL 26 HA VAL 26 -7.361 5.270 -8.193 238 HB VAL 26 HB VAL 26 -9.327 5.089 -6.688 239 HG11 VAL 26 1HG1 VAL 26 -11.142 5.657 -8.291 240 HG12 VAL 26 2HG1 VAL 26 -10.898 4.081 -9.084 241 HG13 VAL 26 3HG1 VAL 26 -11.426 4.161 -7.395 242 HG21 VAL 26 3HG2 VAL 26 -7.869 3.172 -7.103 243 HG22 VAL 26 1HG2 VAL 26 -9.545 2.675 -6.774 244 HG23 VAL 26 2HG2 VAL 26 -8.929 2.630 -8.424 245 H LYS 27 H LYS 27 -9.732 6.212 -10.516 246 HA LYS 27 HA LYS 27 -9.585 3.989 -12.302 247 HB2 LYS 27 1HB LYS 27 -11.261 5.995 -12.146 248 HB3 LYS 27 2HB LYS 27 -10.150 6.802 -13.264 249 HG2 LYS 27 1HG LYS 27 -10.377 4.823 -14.811 250 HG3 LYS 27 2HG LYS 27 -11.517 4.091 -13.679 251 HD2 LYS 27 1HD LYS 27 -11.922 6.760 -15.101 252 HD3 LYS 27 2HD LYS 27 -12.580 5.203 -15.628 253 HE2 LYS 27 1HE LYS 27 -13.763 5.015 -13.396 254 HE3 LYS 27 2HE LYS 27 -13.238 6.665 -13.035 255 HZ1 LYS 27 3HZ LYS 27 -15.465 6.645 -13.997 256 HZ2 LYS 27 1HZ LYS 27 -14.947 5.874 -15.336 257 HZ3 LYS 27 2HZ LYS 27 -14.452 7.401 -15.030 258 H LYS 28 H LYS 28 -7.293 6.586 -11.888 259 HA LYS 28 HA LYS 28 -5.793 6.029 -14.383 260 HB2 LYS 28 1HB LYS 28 -5.329 7.872 -12.017 261 HB3 LYS 28 2HB LYS 28 -3.998 7.385 -13.062 262 HG2 LYS 28 1HG LYS 28 -5.660 8.079 -15.023 263 HG3 LYS 28 2HG LYS 28 -6.407 9.066 -13.761 264 HD2 LYS 28 1HD LYS 28 -4.326 10.251 -13.374 265 HD3 LYS 28 2HD LYS 28 -3.408 9.121 -14.374 266 HE2 LYS 28 1HE LYS 28 -5.617 10.919 -15.445 267 HE3 LYS 28 2HE LYS 28 -3.899 11.339 -15.456 268 HZ1 LYS 28 3HZ LYS 28 -3.488 9.365 -16.833 269 HZ2 LYS 28 1HZ LYS 28 -4.534 10.373 -17.570 270 HZ3 LYS 28 2HZ LYS 28 -5.083 9.009 -16.867 Start of MODEL 18 1 H1 LYS 1 1H LYS 1 15.755 -4.735 14.250 2 H2 LYS 1 2H LYS 1 16.782 -5.143 13.066 3 H3 LYS 1 3H LYS 1 15.739 -3.886 12.861 4 HA LYS 1 HA LYS 1 15.059 -6.763 13.019 5 HB2 LYS 1 1HB LYS 1 13.238 -4.343 13.260 6 HB3 LYS 1 2HB LYS 1 12.626 -5.928 12.779 7 HG2 LYS 1 1HG LYS 1 13.258 -6.972 14.805 8 HG3 LYS 1 2HG LYS 1 14.212 -5.581 15.342 9 HD2 LYS 1 1HD LYS 1 12.255 -4.214 15.623 10 HD3 LYS 1 2HD LYS 1 11.199 -5.448 14.907 11 HE2 LYS 1 1HE LYS 1 11.273 -6.831 16.754 12 HE3 LYS 1 2HE LYS 1 12.897 -6.320 17.220 13 HZ1 LYS 1 3HZ LYS 1 10.464 -4.657 17.589 14 HZ2 LYS 1 1HZ LYS 1 11.980 -4.250 18.054 15 HZ3 LYS 1 2HZ LYS 1 11.216 -5.497 18.770 16 H LYS 2 H LYS 2 16.789 -5.567 10.938 17 HA LYS 2 HA LYS 2 15.321 -4.786 8.631 18 HB2 LYS 2 1HB LYS 2 18.121 -5.435 9.287 19 HB3 LYS 2 2HB LYS 2 17.671 -5.977 7.680 20 HG2 LYS 2 1HG LYS 2 18.553 -3.775 7.493 21 HG3 LYS 2 2HG LYS 2 16.830 -3.714 7.113 22 HD2 LYS 2 1HD LYS 2 16.336 -2.735 9.314 23 HD3 LYS 2 2HD LYS 2 18.030 -2.952 9.817 24 HE2 LYS 2 1HE LYS 2 18.760 -1.445 7.978 25 HE3 LYS 2 2HE LYS 2 17.076 -1.204 7.500 26 HZ1 LYS 2 3HZ LYS 2 17.929 0.587 8.942 27 HZ2 LYS 2 1HZ LYS 2 18.182 -0.464 10.160 28 HZ3 LYS 2 2HZ LYS 2 16.659 -0.159 9.641 29 H LYS 3 H LYS 3 16.002 -8.037 9.745 30 HA LYS 3 HA LYS 3 15.346 -9.512 7.414 31 HB2 LYS 3 1HB LYS 3 15.746 -10.121 10.208 32 HB3 LYS 3 2HB LYS 3 14.194 -10.809 9.749 33 HG2 LYS 3 1HG LYS 3 15.462 -11.745 7.665 34 HG3 LYS 3 2HG LYS 3 16.932 -11.393 8.566 35 HD2 LYS 3 1HD LYS 3 14.864 -12.933 10.104 36 HD3 LYS 3 2HD LYS 3 15.410 -13.718 8.638 37 HE2 LYS 3 1HE LYS 3 16.748 -14.555 10.386 38 HE3 LYS 3 2HE LYS 3 17.775 -13.533 9.380 39 HZ1 LYS 3 3HZ LYS 3 16.552 -12.688 11.961 40 HZ2 LYS 3 1HZ LYS 3 17.591 -11.791 11.064 41 HZ3 LYS 3 2HZ LYS 3 18.098 -13.163 11.781 42 H ASN 4 H ASN 4 13.172 -8.048 9.748 43 HA ASN 4 HA ASN 4 10.745 -8.990 8.300 44 HB2 ASN 4 1HB ASN 4 11.139 -7.695 11.033 45 HB3 ASN 4 2HB ASN 4 9.588 -8.204 10.367 46 HD21 ASN 4 2HD2 ASN 4 9.258 -10.519 9.921 47 HD22 ASN 4 1HD2 ASN 4 10.175 -11.683 10.887 48 H TRP 5 H TRP 5 12.719 -6.238 8.284 49 HA TRP 5 HA TRP 5 10.808 -4.125 8.076 50 HB2 TRP 5 1HB TRP 5 13.243 -3.880 8.473 51 HB3 TRP 5 2HB TRP 5 13.562 -4.371 6.807 52 HD1 TRP 5 HD1 TRP 5 13.760 -2.459 5.136 53 HE1 TRP 5 HE1 TRP 5 13.147 0.046 5.074 54 HE3 TRP 5 HE3 TRP 5 11.256 -2.121 9.593 55 HZ2 TRP 5 HZ2 TRP 5 11.735 1.932 6.730 56 HZ3 TRP 5 HZ3 TRP 5 10.274 0.045 10.323 57 HH2 TRP 5 HH2 TRP 5 10.505 2.070 8.905 58 H PHE 6 H PHE 6 12.082 -6.329 5.626 59 HA PHE 6 HA PHE 6 10.636 -4.999 3.439 60 HB2 PHE 6 1HB PHE 6 13.036 -6.435 3.619 61 HB3 PHE 6 2HB PHE 6 11.973 -7.524 2.764 62 HD1 PHE 6 HD1 PHE 6 10.871 -6.729 0.584 63 HD2 PHE 6 HD2 PHE 6 13.873 -4.409 2.642 64 HE1 PHE 6 HE1 PHE 6 11.221 -5.362 -1.458 65 HE2 PHE 6 HE2 PHE 6 14.225 -3.053 0.593 66 HZ PHE 6 HZ PHE 6 12.899 -3.524 -1.459 67 H ASP 7 H ASP 7 9.230 -6.668 5.703 68 HA ASP 7 HA ASP 7 7.929 -8.890 4.448 69 HB2 ASP 7 1HB ASP 7 7.383 -7.210 6.886 70 HB3 ASP 7 2HB ASP 7 6.082 -8.193 6.257 71 H ILE 8 H ILE 8 7.202 -8.531 2.464 72 HA ILE 8 HA ILE 8 5.734 -6.398 1.446 73 HB ILE 8 HB ILE 8 5.023 -7.864 -0.359 74 HG12 ILE 8 1HG1 ILE 8 6.200 -10.169 1.265 75 HG13 ILE 8 2HG1 ILE 8 4.481 -9.894 0.961 76 HG21 ILE 8 1HG2 ILE 8 7.913 -8.434 0.424 77 HG22 ILE 8 2HG2 ILE 8 7.230 -8.330 -1.211 78 HG23 ILE 8 3HG2 ILE 8 7.332 -6.880 -0.210 79 HD11 ILE 8 3HD1 ILE 8 5.265 -11.592 -0.547 80 HD12 ILE 8 1HD1 ILE 8 4.887 -10.135 -1.490 81 HD13 ILE 8 2HD1 ILE 8 6.580 -10.563 -1.133 82 H THR 9 H THR 9 4.502 -8.746 3.666 83 HA THR 9 HA THR 9 1.697 -8.662 3.088 84 HB THR 9 HB THR 9 1.481 -9.240 5.531 85 HG1 THR 9 HG1 THR 9 3.307 -9.481 6.721 86 HG21 THR 9 3HG2 THR 9 2.582 -11.442 5.364 87 HG22 THR 9 1HG2 THR 9 3.524 -10.886 3.966 88 HG23 THR 9 2HG2 THR 9 1.755 -11.024 3.854 89 H ASN 10 H ASN 10 3.848 -6.469 4.854 90 HA ASN 10 HA ASN 10 1.631 -4.709 5.728 91 HB2 ASN 10 1HB ASN 10 4.603 -4.848 6.187 92 HB3 ASN 10 2HB ASN 10 3.869 -3.250 6.195 93 HD21 ASN 10 2HD2 ASN 10 3.612 -6.480 7.751 94 HD22 ASN 10 1HD2 ASN 10 2.864 -5.817 9.204 95 H TRP 11 H TRP 11 3.974 -4.836 3.043 96 HA TRP 11 HA TRP 11 3.571 -2.213 2.035 97 HB2 TRP 11 1HB TRP 11 4.329 -4.801 0.674 98 HB3 TRP 11 2HB TRP 11 4.113 -3.311 -0.198 99 HD1 TRP 11 HD1 TRP 11 6.275 -4.462 2.838 100 HE1 TRP 11 HE1 TRP 11 8.548 -3.270 2.683 101 HE3 TRP 11 HE3 TRP 11 5.350 -1.562 -1.226 102 HZ2 TRP 11 HZ2 TRP 11 9.829 -1.342 0.950 103 HZ3 TRP 11 HZ3 TRP 11 7.110 -0.029 -2.143 104 HH2 TRP 11 HH2 TRP 11 9.351 0.078 -1.056 105 H LEU 12 H LEU 12 1.544 -5.083 1.765 106 HA LEU 12 HA LEU 12 -0.244 -4.302 -0.268 107 HB2 LEU 12 1HB LEU 12 -1.041 -5.724 2.292 108 HB3 LEU 12 2HB LEU 12 -1.866 -5.774 0.738 109 HG LEU 12 HG LEU 12 0.791 -7.023 1.464 110 HD11 LEU 12 1HD1 LEU 12 -0.320 -9.128 1.042 111 HD12 LEU 12 2HD1 LEU 12 -1.802 -8.293 0.534 112 HD13 LEU 12 3HD1 LEU 12 -1.251 -8.194 2.224 113 HD21 LEU 12 3HD2 LEU 12 0.806 -8.014 -0.817 114 HD22 LEU 12 1HD2 LEU 12 1.015 -6.263 -0.845 115 HD23 LEU 12 2HD2 LEU 12 -0.567 -6.969 -1.262 116 H TRP 13 H TRP 13 -0.028 -3.087 3.037 117 HA TRP 13 HA TRP 13 -2.636 -1.900 3.234 118 HB2 TRP 13 1HB TRP 13 -1.062 -2.318 5.119 119 HB3 TRP 13 2HB TRP 13 -0.050 -1.000 4.553 120 HD1 TRP 13 HD1 TRP 13 -3.532 -1.639 6.035 121 HE1 TRP 13 HE1 TRP 13 -4.417 0.533 7.117 122 HE3 TRP 13 HE3 TRP 13 0.160 1.581 4.548 123 HZ2 TRP 13 HZ2 TRP 13 -3.634 3.300 7.283 124 HZ3 TRP 13 HZ3 TRP 13 0.048 3.992 5.152 125 HH2 TRP 13 HH2 TRP 13 -1.833 4.860 6.511 126 H TYR 14 H TYR 14 0.507 -0.414 2.300 127 HA TYR 14 HA TYR 14 -0.571 2.145 1.599 128 HB2 TYR 14 1HB TYR 14 1.878 0.805 0.403 129 HB3 TYR 14 2HB TYR 14 1.518 2.523 0.429 130 HD1 TYR 14 HD2 TYR 14 1.523 3.779 2.653 131 HD2 TYR 14 HD1 TYR 14 2.921 -0.268 2.236 132 HE1 TYR 14 HE2 TYR 14 2.728 3.978 4.820 133 HE2 TYR 14 HE1 TYR 14 4.127 -0.085 4.420 134 HH TYR 14 HH TYR 14 4.148 2.957 6.312 135 H ILE 15 H ILE 15 -0.267 -0.863 -0.226 136 HA ILE 15 HA ILE 15 -0.979 0.314 -2.804 137 HB ILE 15 HB ILE 15 -1.130 -2.595 -1.948 138 HG12 ILE 15 1HG1 ILE 15 1.152 -1.622 -1.802 139 HG13 ILE 15 2HG1 ILE 15 1.008 -2.925 -2.960 140 HG21 ILE 15 1HG2 ILE 15 -2.538 -2.303 -3.874 141 HG22 ILE 15 2HG2 ILE 15 -1.368 -1.233 -4.662 142 HG23 ILE 15 3HG2 ILE 15 -1.013 -2.971 -4.468 143 HD11 ILE 15 3HD1 ILE 15 1.142 -1.385 -4.829 144 HD12 ILE 15 1HD1 ILE 15 1.022 0.026 -3.748 145 HD13 ILE 15 2HD1 ILE 15 2.456 -1.011 -3.701 146 H LYS 16 H LYS 16 -2.894 -1.502 -0.365 147 HA LYS 16 HA LYS 16 -5.438 -1.085 -1.719 148 HB2 LYS 16 1HB LYS 16 -4.678 -1.809 1.133 149 HB3 LYS 16 2HB LYS 16 -6.306 -1.265 0.775 150 HG2 LYS 16 1HG LYS 16 -6.791 -3.376 0.407 151 HG3 LYS 16 2HG LYS 16 -6.109 -3.122 -1.192 152 HD2 LYS 16 1HD LYS 16 -3.997 -4.148 -0.500 153 HD3 LYS 16 2HD LYS 16 -4.547 -4.217 1.195 154 HE2 LYS 16 1HE LYS 16 -6.454 -5.668 0.500 155 HE3 LYS 16 2HE LYS 16 -5.869 -5.642 -1.165 156 HZ1 LYS 16 3HZ LYS 16 -5.163 -7.640 0.032 157 HZ2 LYS 16 1HZ LYS 16 -4.366 -6.758 1.145 158 HZ3 LYS 16 2HZ LYS 16 -3.860 -6.775 -0.420 159 H LEU 17 H LEU 17 -3.794 0.834 0.794 160 HA LEU 17 HA LEU 17 -5.760 2.873 0.996 161 HB2 LEU 17 1HB LEU 17 -3.997 2.523 2.640 162 HB3 LEU 17 2HB LEU 17 -2.764 3.041 1.497 163 HG LEU 17 HG LEU 17 -4.964 5.014 1.795 164 HD11 LEU 17 1HD1 LEU 17 -3.269 4.412 4.215 165 HD12 LEU 17 2HD1 LEU 17 -5.028 4.161 4.077 166 HD13 LEU 17 3HD1 LEU 17 -4.360 5.802 4.017 167 HD21 LEU 17 3HD2 LEU 17 -2.765 5.491 0.703 168 HD22 LEU 17 1HD2 LEU 17 -1.969 5.262 2.279 169 HD23 LEU 17 2HD2 LEU 17 -3.125 6.590 2.044 170 H PHE 18 H PHE 18 -3.102 2.556 -1.389 171 HA PHE 18 HA PHE 18 -3.222 5.088 -2.523 172 HB2 PHE 18 1HB PHE 18 -1.590 3.541 -3.282 173 HB3 PHE 18 2HB PHE 18 -2.803 2.414 -3.867 174 HD1 PHE 18 HD2 PHE 18 -2.515 6.171 -4.431 175 HD2 PHE 18 HD1 PHE 18 -2.554 2.202 -6.149 176 HE1 PHE 18 HE2 PHE 18 -2.372 7.143 -6.690 177 HE2 PHE 18 HE1 PHE 18 -2.464 3.198 -8.421 178 HZ PHE 18 HZ PHE 18 -2.371 5.660 -8.691 179 H ILE 19 H ILE 19 -5.583 2.447 -3.079 180 HA ILE 19 HA ILE 19 -7.169 3.992 -4.964 181 HB ILE 19 HB ILE 19 -7.912 1.573 -3.280 182 HG12 ILE 19 1HG1 ILE 19 -7.838 0.416 -5.599 183 HG13 ILE 19 2HG1 ILE 19 -6.888 1.794 -6.140 184 HG21 ILE 19 1HG2 ILE 19 -9.760 1.346 -5.078 185 HG22 ILE 19 2HG2 ILE 19 -9.968 2.578 -3.842 186 HG23 ILE 19 3HG2 ILE 19 -9.403 3.054 -5.449 187 HD11 ILE 19 3HD1 ILE 19 -5.614 -0.284 -5.475 188 HD12 ILE 19 1HD1 ILE 19 -5.078 1.191 -4.676 189 HD13 ILE 19 2HD1 ILE 19 -6.103 0.019 -3.798 190 H MET 20 H MET 20 -7.118 3.737 -1.450 191 HA MET 20 HA MET 20 -9.709 4.975 -0.961 192 HB2 MET 20 1HB MET 20 -7.294 4.566 0.847 193 HB3 MET 20 2HB MET 20 -8.846 5.184 1.382 194 HG2 MET 20 1HG MET 20 -8.657 2.518 -0.061 195 HG3 MET 20 2HG MET 20 -8.328 2.642 1.661 196 HE1 MET 20 3HE MET 20 -11.486 4.010 3.213 197 HE2 MET 20 1HE MET 20 -10.637 2.484 3.548 198 HE3 MET 20 2HE MET 20 -9.708 3.958 3.210 199 H ILE 21 H ILE 21 -6.340 6.220 -0.856 200 HA ILE 21 HA ILE 21 -7.068 8.906 -0.156 201 HB ILE 21 HB ILE 21 -4.867 7.993 0.270 202 HG12 ILE 21 1HG1 ILE 21 -4.742 10.454 -1.529 203 HG13 ILE 21 2HG1 ILE 21 -5.266 10.439 0.158 204 HG21 ILE 21 1HG2 ILE 21 -4.214 8.252 -2.698 205 HG22 ILE 21 2HG2 ILE 21 -3.163 7.660 -1.394 206 HG23 ILE 21 3HG2 ILE 21 -4.564 6.728 -1.863 207 HD11 ILE 21 3HD1 ILE 21 -2.988 11.187 0.098 208 HD12 ILE 21 1HD1 ILE 21 -2.986 9.552 0.794 209 HD13 ILE 21 2HD1 ILE 21 -2.480 9.814 -0.895 210 H VAL 22 H VAL 22 -6.514 7.429 -3.358 211 HA VAL 22 HA VAL 22 -6.989 9.868 -4.858 212 HB VAL 22 HB VAL 22 -7.208 8.412 -6.810 213 HG11 VAL 22 1HG1 VAL 22 -4.898 7.595 -5.062 214 HG12 VAL 22 2HG1 VAL 22 -5.015 7.411 -6.817 215 HG13 VAL 22 3HG1 VAL 22 -4.993 9.043 -6.105 216 HG21 VAL 22 3HG2 VAL 22 -8.399 6.529 -6.144 217 HG22 VAL 22 1HG2 VAL 22 -6.766 5.924 -6.504 218 HG23 VAL 22 2HG2 VAL 22 -7.279 6.179 -4.842 219 H GLY 23 H GLY 23 -9.144 7.310 -3.718 220 HA2 GLY 23 1HA GLY 23 -11.325 6.812 -3.980 221 HA3 GLY 23 2HA GLY 23 -11.655 8.552 -3.925 222 H GLY 24 H GLY 24 -11.899 9.666 -5.884 223 HA2 GLY 24 1HA GLY 24 -12.994 8.167 -8.134 224 HA3 GLY 24 2HA GLY 24 -12.819 9.916 -8.021 225 H LEU 25 H LEU 25 -9.812 9.641 -7.516 226 HA LEU 25 HA LEU 25 -9.078 9.640 -10.351 227 HB2 LEU 25 1HB LEU 25 -6.932 9.851 -8.285 228 HB3 LEU 25 2HB LEU 25 -7.083 10.604 -9.840 229 HG LEU 25 HG LEU 25 -8.587 11.394 -7.321 230 HD11 LEU 25 1HD1 LEU 25 -7.168 13.374 -7.374 231 HD12 LEU 25 2HD1 LEU 25 -6.334 12.762 -8.822 232 HD13 LEU 25 3HD1 LEU 25 -6.196 11.897 -7.273 233 HD21 LEU 25 3HD2 LEU 25 -9.966 11.941 -9.290 234 HD22 LEU 25 1HD2 LEU 25 -8.563 12.681 -10.091 235 HD23 LEU 25 2HD2 LEU 25 -9.255 13.418 -8.628 236 H VAL 26 H VAL 26 -9.469 7.062 -8.370 237 HA VAL 26 HA VAL 26 -7.240 5.394 -8.551 238 HB VAL 26 HB VAL 26 -9.314 4.892 -7.291 239 HG11 VAL 26 1HG1 VAL 26 -11.007 5.412 -9.069 240 HG12 VAL 26 2HG1 VAL 26 -10.543 3.897 -9.886 241 HG13 VAL 26 3HG1 VAL 26 -11.237 3.860 -8.259 242 HG21 VAL 26 3HG2 VAL 26 -9.286 2.481 -7.595 243 HG22 VAL 26 1HG2 VAL 26 -8.480 2.645 -9.156 244 HG23 VAL 26 2HG2 VAL 26 -7.646 3.163 -7.674 245 H LYS 27 H LYS 27 -9.565 6.046 -11.046 246 HA LYS 27 HA LYS 27 -8.746 3.991 -12.889 247 HB2 LYS 27 1HB LYS 27 -10.917 5.724 -12.571 248 HB3 LYS 27 2HB LYS 27 -10.131 6.367 -14.011 249 HG2 LYS 27 1HG LYS 27 -10.235 4.115 -15.055 250 HG3 LYS 27 2HG LYS 27 -10.949 3.452 -13.569 251 HD2 LYS 27 1HD LYS 27 -12.925 4.869 -13.811 252 HD3 LYS 27 2HD LYS 27 -12.203 5.691 -15.213 253 HE2 LYS 27 1HE LYS 27 -12.145 3.548 -16.446 254 HE3 LYS 27 2HE LYS 27 -12.884 2.715 -15.072 255 HZ1 LYS 27 3HZ LYS 27 -14.891 3.914 -15.400 256 HZ2 LYS 27 1HZ LYS 27 -14.443 3.475 -16.906 257 HZ3 LYS 27 2HZ LYS 27 -14.210 5.010 -16.403 258 H LYS 28 H LYS 28 -7.213 6.877 -12.128 259 HA LYS 28 HA LYS 28 -5.994 8.495 -13.211 260 HB2 LYS 28 1HB LYS 28 -4.502 5.912 -13.748 261 HB3 LYS 28 2HB LYS 28 -3.879 7.480 -14.245 262 HG2 LYS 28 1HG LYS 28 -4.425 8.088 -11.650 263 HG3 LYS 28 2HG LYS 28 -4.123 6.347 -11.492 264 HD2 LYS 28 1HD LYS 28 -1.962 6.669 -12.746 265 HD3 LYS 28 2HD LYS 28 -2.281 8.415 -12.800 266 HE2 LYS 28 1HE LYS 28 -2.160 8.589 -10.383 267 HE3 LYS 28 2HE LYS 28 -2.065 6.832 -10.222 268 HZ1 LYS 28 3HZ LYS 28 0.138 7.839 -10.055 269 HZ2 LYS 28 1HZ LYS 28 -0.001 8.519 -11.531 270 HZ3 LYS 28 2HZ LYS 28 0.074 6.894 -11.382 Start of MODEL 19 1 H1 LYS 1 1H LYS 1 15.517 -8.005 14.261 2 H2 LYS 1 2H LYS 1 15.245 -8.646 12.790 3 H3 LYS 1 3H LYS 1 16.580 -7.730 13.056 4 HA LYS 1 HA LYS 1 13.777 -6.802 13.140 5 HB2 LYS 1 1HB LYS 1 15.504 -5.662 14.728 6 HB3 LYS 1 2HB LYS 1 16.173 -4.943 13.282 7 HG2 LYS 1 1HG LYS 1 14.663 -3.304 13.539 8 HG3 LYS 1 2HG LYS 1 13.423 -4.423 12.988 9 HD2 LYS 1 1HD LYS 1 14.262 -3.932 15.883 10 HD3 LYS 1 2HD LYS 1 12.823 -3.268 15.104 11 HE2 LYS 1 1HE LYS 1 11.855 -5.501 14.830 12 HE3 LYS 1 2HE LYS 1 13.339 -6.256 15.433 13 HZ1 LYS 1 3HZ LYS 1 12.928 -5.027 17.563 14 HZ2 LYS 1 1HZ LYS 1 11.821 -6.177 17.234 15 HZ3 LYS 1 2HZ LYS 1 11.450 -4.605 17.006 16 H LYS 2 H LYS 2 16.780 -5.853 11.378 17 HA LYS 2 HA LYS 2 15.634 -4.705 9.146 18 HB2 LYS 2 1HB LYS 2 18.207 -6.319 9.275 19 HB3 LYS 2 2HB LYS 2 17.798 -5.188 7.992 20 HG2 LYS 2 1HG LYS 2 17.968 -4.322 10.913 21 HG3 LYS 2 2HG LYS 2 19.384 -4.412 9.891 22 HD2 LYS 2 1HD LYS 2 16.963 -2.707 9.157 23 HD3 LYS 2 2HD LYS 2 18.310 -2.139 10.154 24 HE2 LYS 2 1HE LYS 2 19.877 -2.886 8.270 25 HE3 LYS 2 2HE LYS 2 18.439 -3.076 7.260 26 HZ1 LYS 2 3HZ LYS 2 19.440 -0.878 6.989 27 HZ2 LYS 2 1HZ LYS 2 19.303 -0.551 8.578 28 HZ3 LYS 2 2HZ LYS 2 17.961 -0.701 7.657 29 H LYS 3 H LYS 3 16.309 -8.156 9.465 30 HA LYS 3 HA LYS 3 15.623 -9.168 6.934 31 HB2 LYS 3 1HB LYS 3 16.581 -10.513 8.727 32 HB3 LYS 3 2HB LYS 3 15.124 -10.325 9.711 33 HG2 LYS 3 1HG LYS 3 13.813 -11.627 8.090 34 HG3 LYS 3 2HG LYS 3 15.225 -11.762 7.022 35 HD2 LYS 3 1HD LYS 3 16.414 -13.091 8.670 36 HD3 LYS 3 2HD LYS 3 15.172 -12.799 9.893 37 HE2 LYS 3 1HE LYS 3 13.983 -13.894 7.449 38 HE3 LYS 3 2HE LYS 3 15.313 -14.921 7.981 39 HZ1 LYS 3 3HZ LYS 3 14.255 -15.093 10.156 40 HZ2 LYS 3 1HZ LYS 3 13.198 -15.563 9.008 41 HZ3 LYS 3 2HZ LYS 3 13.035 -14.099 9.708 42 H ASN 4 H ASN 4 13.387 -8.231 9.512 43 HA ASN 4 HA ASN 4 11.022 -8.985 7.880 44 HB2 ASN 4 1HB ASN 4 11.349 -9.800 10.256 45 HB3 ASN 4 2HB ASN 4 11.204 -8.128 10.798 46 HD21 ASN 4 2HD2 ASN 4 9.380 -10.437 8.629 47 HD22 ASN 4 1HD2 ASN 4 7.832 -9.982 9.327 48 H TRP 5 H TRP 5 12.904 -6.314 7.936 49 HA TRP 5 HA TRP 5 10.895 -4.217 8.217 50 HB2 TRP 5 1HB TRP 5 13.511 -4.222 8.561 51 HB3 TRP 5 2HB TRP 5 13.553 -3.840 6.844 52 HD1 TRP 5 HD1 TRP 5 12.950 -1.339 6.222 53 HE1 TRP 5 HE1 TRP 5 12.439 0.785 7.599 54 HE3 TRP 5 HE3 TRP 5 12.287 -3.493 10.813 55 HZ2 TRP 5 HZ2 TRP 5 11.819 1.449 10.338 56 HZ3 TRP 5 HZ3 TRP 5 11.724 -2.097 12.796 57 HH2 TRP 5 HH2 TRP 5 11.492 0.367 12.571 58 H PHE 6 H PHE 6 11.994 -6.212 5.594 59 HA PHE 6 HA PHE 6 10.609 -4.604 3.522 60 HB2 PHE 6 1HB PHE 6 13.034 -5.978 3.530 61 HB3 PHE 6 2HB PHE 6 11.982 -7.073 2.667 62 HD1 PHE 6 HD2 PHE 6 10.794 -6.244 0.563 63 HD2 PHE 6 HD1 PHE 6 13.691 -3.855 2.671 64 HE1 PHE 6 HE2 PHE 6 10.986 -4.740 -1.412 65 HE2 PHE 6 HE1 PHE 6 13.898 -2.354 0.689 66 HZ PHE 6 HZ PHE 6 12.539 -2.796 -1.349 67 H ASP 7 H ASP 7 9.178 -6.143 5.635 68 HA ASP 7 HA ASP 7 7.982 -8.512 4.611 69 HB2 ASP 7 1HB ASP 7 6.452 -8.305 6.446 70 HB3 ASP 7 2HB ASP 7 8.100 -8.045 6.966 71 H ILE 8 H ILE 8 7.234 -8.261 2.541 72 HA ILE 8 HA ILE 8 5.682 -6.219 1.500 73 HB ILE 8 HB ILE 8 4.965 -7.692 -0.264 74 HG12 ILE 8 1HG1 ILE 8 6.196 -10.002 1.304 75 HG13 ILE 8 2HG1 ILE 8 4.461 -9.717 1.139 76 HG21 ILE 8 1HG2 ILE 8 7.111 -8.052 -1.183 77 HG22 ILE 8 2HG2 ILE 8 7.356 -6.748 -0.015 78 HG23 ILE 8 3HG2 ILE 8 7.846 -8.402 0.397 79 HD11 ILE 8 3HD1 ILE 8 5.177 -11.416 -0.441 80 HD12 ILE 8 1HD1 ILE 8 4.604 -9.976 -1.303 81 HD13 ILE 8 2HD1 ILE 8 6.349 -10.307 -1.171 82 H THR 9 H THR 9 4.541 -8.559 3.752 83 HA THR 9 HA THR 9 1.717 -8.545 3.271 84 HB THR 9 HB THR 9 1.713 -9.039 5.828 85 HG1 THR 9 HG1 THR 9 3.870 -9.788 6.448 86 HG21 THR 9 3HG2 THR 9 2.573 -11.322 5.483 87 HG22 THR 9 1HG2 THR 9 3.348 -10.822 3.963 88 HG23 THR 9 2HG2 THR 9 1.574 -10.811 4.113 89 H ASN 10 H ASN 10 3.875 -6.271 4.939 90 HA ASN 10 HA ASN 10 1.651 -4.564 5.870 91 HB2 ASN 10 1HB ASN 10 3.755 -4.853 7.183 92 HB3 ASN 10 2HB ASN 10 4.669 -4.104 5.870 93 HD21 ASN 10 2HD2 ASN 10 2.146 -3.509 8.351 94 HD22 ASN 10 1HD2 ASN 10 2.371 -1.765 8.324 95 H TRP 11 H TRP 11 3.985 -4.618 3.152 96 HA TRP 11 HA TRP 11 3.502 -2.047 2.093 97 HB2 TRP 11 1HB TRP 11 4.279 -4.637 0.753 98 HB3 TRP 11 2HB TRP 11 4.047 -3.157 -0.127 99 HD1 TRP 11 HD1 TRP 11 6.245 -4.258 2.899 100 HE1 TRP 11 HE1 TRP 11 8.525 -3.095 2.680 101 HE3 TRP 11 HE3 TRP 11 5.283 -1.422 -1.207 102 HZ2 TRP 11 HZ2 TRP 11 9.804 -1.234 0.881 103 HZ3 TRP 11 HZ3 TRP 11 7.052 0.059 -2.187 104 HH2 TRP 11 HH2 TRP 11 9.314 0.150 -1.146 105 H LEU 12 H LEU 12 1.503 -4.941 1.881 106 HA LEU 12 HA LEU 12 -0.307 -4.215 -0.160 107 HB2 LEU 12 1HB LEU 12 -1.075 -5.574 2.448 108 HB3 LEU 12 2HB LEU 12 -1.921 -5.668 0.907 109 HG LEU 12 HG LEU 12 0.761 -6.885 1.611 110 HD11 LEU 12 1HD1 LEU 12 -1.199 -8.057 2.496 111 HD12 LEU 12 2HD1 LEU 12 -0.373 -9.012 1.254 112 HD13 LEU 12 3HD1 LEU 12 -1.885 -8.163 0.858 113 HD21 LEU 12 3HD2 LEU 12 -0.695 -6.985 -1.064 114 HD22 LEU 12 1HD2 LEU 12 0.742 -7.939 -0.622 115 HD23 LEU 12 2HD2 LEU 12 0.864 -6.185 -0.747 116 H TRP 13 H TRP 13 -0.057 -2.897 3.101 117 HA TRP 13 HA TRP 13 -2.665 -1.697 3.278 118 HB2 TRP 13 1HB TRP 13 -1.102 -2.097 5.168 119 HB3 TRP 13 2HB TRP 13 -0.070 -0.802 4.581 120 HD1 TRP 13 HD1 TRP 13 -3.520 -1.388 6.142 121 HE1 TRP 13 HE1 TRP 13 -4.390 0.812 7.170 122 HE3 TRP 13 HE3 TRP 13 0.135 1.796 4.486 123 HZ2 TRP 13 HZ2 TRP 13 -3.607 3.582 7.248 124 HZ3 TRP 13 HZ3 TRP 13 0.037 4.221 5.039 125 HH2 TRP 13 HH2 TRP 13 -1.817 5.120 6.415 126 H TYR 14 H TYR 14 0.492 -0.260 2.298 127 HA TYR 14 HA TYR 14 -0.582 2.293 1.555 128 HB2 TYR 14 1HB TYR 14 1.871 0.922 0.401 129 HB3 TYR 14 2HB TYR 14 1.509 2.640 0.365 130 HD1 TYR 14 HD1 TYR 14 1.485 3.970 2.549 131 HD2 TYR 14 HD2 TYR 14 2.901 -0.084 2.277 132 HE1 TYR 14 HE1 TYR 14 2.658 4.228 4.741 133 HE2 TYR 14 HE2 TYR 14 4.059 0.158 4.476 134 HH TYR 14 HH TYR 14 4.498 1.540 6.235 135 H ILE 15 H ILE 15 -0.283 -0.747 -0.208 136 HA ILE 15 HA ILE 15 -1.011 0.371 -2.809 137 HB ILE 15 HB ILE 15 -1.166 -2.516 -1.880 138 HG12 ILE 15 1HG1 ILE 15 1.122 -1.545 -1.782 139 HG13 ILE 15 2HG1 ILE 15 0.961 -2.880 -2.902 140 HG21 ILE 15 1HG2 ILE 15 -2.592 -2.272 -3.796 141 HG22 ILE 15 2HG2 ILE 15 -1.430 -1.222 -4.625 142 HG23 ILE 15 3HG2 ILE 15 -1.075 -2.957 -4.393 143 HD11 ILE 15 3HD1 ILE 15 0.950 0.043 -3.792 144 HD12 ILE 15 1HD1 ILE 15 2.401 -0.968 -3.697 145 HD13 ILE 15 2HD1 ILE 15 1.098 -1.409 -4.813 146 H LYS 16 H LYS 16 -2.907 -1.388 -0.326 147 HA LYS 16 HA LYS 16 -5.474 -1.010 -1.634 148 HB2 LYS 16 1HB LYS 16 -4.598 -1.662 1.194 149 HB3 LYS 16 2HB LYS 16 -6.248 -1.143 0.918 150 HG2 LYS 16 1HG LYS 16 -6.874 -3.132 0.279 151 HG3 LYS 16 2HG LYS 16 -5.778 -3.111 -1.090 152 HD2 LYS 16 1HD LYS 16 -4.096 -4.291 0.031 153 HD3 LYS 16 2HD LYS 16 -4.735 -3.941 1.646 154 HE2 LYS 16 1HE LYS 16 -6.347 -5.516 -0.388 155 HE3 LYS 16 2HE LYS 16 -5.120 -6.323 0.592 156 HZ1 LYS 16 3HZ LYS 16 -7.496 -6.261 1.504 157 HZ2 LYS 16 1HZ LYS 16 -7.227 -4.698 1.889 158 HZ3 LYS 16 2HZ LYS 16 -6.305 -5.875 2.549 159 H LEU 17 H LEU 17 -3.803 0.987 0.800 160 HA LEU 17 HA LEU 17 -5.775 3.025 0.955 161 HB2 LEU 17 1HB LEU 17 -4.010 2.716 2.602 162 HB3 LEU 17 2HB LEU 17 -2.782 3.214 1.444 163 HG LEU 17 HG LEU 17 -4.984 5.185 1.685 164 HD11 LEU 17 1HD1 LEU 17 -3.328 4.634 4.145 165 HD12 LEU 17 2HD1 LEU 17 -5.086 4.386 3.982 166 HD13 LEU 17 3HD1 LEU 17 -4.411 6.024 3.898 167 HD21 LEU 17 3HD2 LEU 17 -2.780 5.642 0.607 168 HD22 LEU 17 1HD2 LEU 17 -1.994 5.443 2.194 169 HD23 LEU 17 2HD2 LEU 17 -3.148 6.767 1.924 170 H PHE 18 H PHE 18 -3.140 2.640 -1.450 171 HA PHE 18 HA PHE 18 -3.284 5.145 -2.648 172 HB2 PHE 18 1HB PHE 18 -1.656 3.569 -3.386 173 HB3 PHE 18 2HB PHE 18 -2.879 2.445 -3.956 174 HD1 PHE 18 HD2 PHE 18 -2.587 6.195 -4.557 175 HD2 PHE 18 HD1 PHE 18 -2.625 2.220 -6.242 176 HE1 PHE 18 HE2 PHE 18 -2.417 7.154 -6.820 177 HE2 PHE 18 HE1 PHE 18 -2.507 3.200 -8.523 178 HZ PHE 18 HZ PHE 18 -2.390 5.668 -8.814 179 H ILE 19 H ILE 19 -5.650 2.488 -3.062 180 HA ILE 19 HA ILE 19 -7.259 3.968 -4.990 181 HB ILE 19 HB ILE 19 -7.971 1.590 -3.236 182 HG12 ILE 19 1HG1 ILE 19 -7.917 0.378 -5.528 183 HG13 ILE 19 2HG1 ILE 19 -6.988 1.752 -6.118 184 HG21 ILE 19 1HG2 ILE 19 -10.038 2.577 -3.801 185 HG22 ILE 19 2HG2 ILE 19 -9.493 3.009 -5.427 186 HG23 ILE 19 3HG2 ILE 19 -9.840 1.312 -5.005 187 HD11 ILE 19 3HD1 ILE 19 -5.686 -0.299 -5.424 188 HD12 ILE 19 1HD1 ILE 19 -5.149 1.198 -4.667 189 HD13 ILE 19 2HD1 ILE 19 -6.150 0.038 -3.747 190 H MET 20 H MET 20 -7.165 3.820 -1.468 191 HA MET 20 HA MET 20 -9.754 5.066 -0.982 192 HB2 MET 20 1HB MET 20 -7.313 4.768 0.808 193 HB3 MET 20 2HB MET 20 -8.878 5.351 1.338 194 HG2 MET 20 1HG MET 20 -8.579 2.634 0.004 195 HG3 MET 20 2HG MET 20 -8.255 2.855 1.713 196 HE1 MET 20 3HE MET 20 -11.556 3.478 3.411 197 HE2 MET 20 1HE MET 20 -9.778 3.447 3.486 198 HE3 MET 20 2HE MET 20 -10.617 4.861 2.813 199 H ILE 21 H ILE 21 -6.386 6.313 -0.937 200 HA ILE 21 HA ILE 21 -7.079 9.024 -0.320 201 HB ILE 21 HB ILE 21 -4.874 8.109 0.080 202 HG12 ILE 21 1HG1 ILE 21 -4.790 10.507 -1.805 203 HG13 ILE 21 2HG1 ILE 21 -5.242 10.552 -0.097 204 HG21 ILE 21 1HG2 ILE 21 -4.665 6.785 -2.048 205 HG22 ILE 21 2HG2 ILE 21 -4.269 8.288 -2.900 206 HG23 ILE 21 3HG2 ILE 21 -3.228 7.673 -1.596 207 HD11 ILE 21 3HD1 ILE 21 -2.956 11.277 -0.302 208 HD12 ILE 21 1HD1 ILE 21 -2.949 9.680 0.478 209 HD13 ILE 21 2HD1 ILE 21 -2.509 9.847 -1.241 210 H VAL 22 H VAL 22 -6.588 7.445 -3.488 211 HA VAL 22 HA VAL 22 -7.085 9.838 -5.049 212 HB VAL 22 HB VAL 22 -7.324 8.336 -6.958 213 HG11 VAL 22 1HG1 VAL 22 -5.130 7.327 -6.957 214 HG12 VAL 22 2HG1 VAL 22 -5.104 8.982 -6.300 215 HG13 VAL 22 3HG1 VAL 22 -4.997 7.572 -5.211 216 HG21 VAL 22 3HG2 VAL 22 -7.379 6.149 -4.942 217 HG22 VAL 22 1HG2 VAL 22 -8.506 6.461 -6.250 218 HG23 VAL 22 2HG2 VAL 22 -6.870 5.854 -6.599 219 H GLY 23 H GLY 23 -9.227 7.303 -3.825 220 HA2 GLY 23 1HA GLY 23 -11.418 6.815 -4.043 221 HA3 GLY 23 2HA GLY 23 -11.735 8.557 -4.032 222 H GLY 24 H GLY 24 -11.994 9.621 -6.014 223 HA2 GLY 24 1HA GLY 24 -13.120 8.076 -8.216 224 HA3 GLY 24 2HA GLY 24 -12.942 9.826 -8.143 225 H LEU 25 H LEU 25 -9.927 9.533 -7.659 226 HA LEU 25 HA LEU 25 -9.203 9.433 -10.502 227 HB2 LEU 25 1HB LEU 25 -7.045 9.736 -8.465 228 HB3 LEU 25 2HB LEU 25 -7.227 10.442 -10.037 229 HG LEU 25 HG LEU 25 -8.712 11.292 -7.528 230 HD11 LEU 25 1HD1 LEU 25 -6.465 12.632 -9.062 231 HD12 LEU 25 2HD1 LEU 25 -6.322 11.806 -7.492 232 HD13 LEU 25 3HD1 LEU 25 -7.301 13.276 -7.629 233 HD21 LEU 25 3HD2 LEU 25 -8.681 12.547 -10.312 234 HD22 LEU 25 1HD2 LEU 25 -9.409 13.271 -8.860 235 HD23 LEU 25 2HD2 LEU 25 -10.082 11.783 -9.533 236 H VAL 26 H VAL 26 -9.722 6.902 -8.571 237 HA VAL 26 HA VAL 26 -7.447 5.255 -8.620 238 HB VAL 26 HB VAL 26 -9.519 4.795 -7.371 239 HG11 VAL 26 1HG1 VAL 26 -10.710 3.701 -9.945 240 HG12 VAL 26 2HG1 VAL 26 -11.420 3.686 -8.321 241 HG13 VAL 26 3HG1 VAL 26 -11.205 5.224 -9.161 242 HG21 VAL 26 3HG2 VAL 26 -9.451 2.371 -7.565 243 HG22 VAL 26 1HG2 VAL 26 -8.639 2.480 -9.129 244 HG23 VAL 26 2HG2 VAL 26 -7.821 3.078 -7.668 245 H LYS 27 H LYS 27 -9.711 5.815 -11.219 246 HA LYS 27 HA LYS 27 -8.880 3.733 -13.008 247 HB2 LYS 27 1HB LYS 27 -10.336 6.367 -13.329 248 HB3 LYS 27 2HB LYS 27 -9.851 5.456 -14.766 249 HG2 LYS 27 1HG LYS 27 -11.085 3.515 -14.115 250 HG3 LYS 27 2HG LYS 27 -11.397 4.152 -12.493 251 HD2 LYS 27 1HD LYS 27 -12.789 5.946 -13.417 252 HD3 LYS 27 2HD LYS 27 -12.507 5.371 -15.067 253 HE2 LYS 27 1HE LYS 27 -13.680 3.585 -12.891 254 HE3 LYS 27 2HE LYS 27 -14.702 4.678 -13.825 255 HZ1 LYS 27 3HZ LYS 27 -14.605 2.434 -14.789 256 HZ2 LYS 27 1HZ LYS 27 -13.003 2.572 -15.053 257 HZ3 LYS 27 2HZ LYS 27 -14.053 3.547 -15.842 258 H LYS 28 H LYS 28 -7.594 7.038 -12.690 259 HA LYS 28 HA LYS 28 -5.058 6.283 -13.841 260 HB2 LYS 28 1HB LYS 28 -5.018 7.620 -15.823 261 HB3 LYS 28 2HB LYS 28 -6.359 6.507 -15.907 262 HG2 LYS 28 1HG LYS 28 -7.421 8.373 -16.682 263 HG3 LYS 28 2HG LYS 28 -7.776 8.548 -14.969 264 HD2 LYS 28 1HD LYS 28 -5.310 9.846 -15.204 265 HD3 LYS 28 2HD LYS 28 -6.045 10.180 -16.773 266 HE2 LYS 28 1HE LYS 28 -8.013 11.157 -15.694 267 HE3 LYS 28 2HE LYS 28 -7.451 10.608 -14.108 268 HZ1 LYS 28 3HZ LYS 28 -5.559 12.097 -14.302 269 HZ2 LYS 28 1HZ LYS 28 -6.939 12.955 -14.445 270 HZ3 LYS 28 2HZ LYS 28 -6.046 12.624 -15.774 Start of MODEL 20 1 H1 LYS 1 1H LYS 1 16.487 -8.427 13.313 2 H2 LYS 1 2H LYS 1 15.770 -6.988 13.017 3 H3 LYS 1 3H LYS 1 15.023 -8.372 12.579 4 HA LYS 1 HA LYS 1 17.549 -7.347 11.431 5 HB2 LYS 1 1HB LYS 1 15.950 -9.878 10.819 6 HB3 LYS 1 2HB LYS 1 17.026 -9.141 9.644 7 HG2 LYS 1 1HG LYS 1 18.893 -9.331 11.412 8 HG3 LYS 1 2HG LYS 1 17.790 -10.449 12.251 9 HD2 LYS 1 1HD LYS 1 17.554 -11.637 9.949 10 HD3 LYS 1 2HD LYS 1 18.936 -10.678 9.424 11 HE2 LYS 1 1HE LYS 1 18.876 -12.676 11.732 12 HE3 LYS 1 2HE LYS 1 19.533 -12.971 10.122 13 HZ1 LYS 1 3HZ LYS 1 21.174 -11.200 10.545 14 HZ2 LYS 1 1HZ LYS 1 21.302 -12.403 11.638 15 HZ3 LYS 1 2HZ LYS 1 20.601 -10.996 12.066 16 H LYS 2 H LYS 2 17.441 -6.681 9.247 17 HA LYS 2 HA LYS 2 15.415 -4.912 8.451 18 HB2 LYS 2 1HB LYS 2 17.772 -4.963 7.672 19 HB3 LYS 2 2HB LYS 2 17.444 -6.421 6.744 20 HG2 LYS 2 1HG LYS 2 17.543 -4.433 5.346 21 HG3 LYS 2 2HG LYS 2 15.951 -5.180 5.239 22 HD2 LYS 2 1HD LYS 2 14.917 -3.446 6.484 23 HD3 LYS 2 2HD LYS 2 16.458 -2.892 7.178 24 HE2 LYS 2 1HE LYS 2 17.211 -2.109 4.978 25 HE3 LYS 2 2HE LYS 2 15.724 -2.688 4.224 26 HZ1 LYS 2 3HZ LYS 2 14.482 -1.082 5.564 27 HZ2 LYS 2 1HZ LYS 2 15.644 -0.296 4.732 28 HZ3 LYS 2 2HZ LYS 2 15.843 -0.582 6.323 29 H LYS 3 H LYS 3 15.537 -8.360 7.841 30 HA LYS 3 HA LYS 3 13.583 -8.700 5.807 31 HB2 LYS 3 1HB LYS 3 14.288 -10.419 8.228 32 HB3 LYS 3 2HB LYS 3 13.041 -10.874 7.086 33 HG2 LYS 3 1HG LYS 3 14.969 -12.062 6.499 34 HG3 LYS 3 2HG LYS 3 14.666 -10.894 5.227 35 HD2 LYS 3 1HD LYS 3 16.577 -10.014 7.363 36 HD3 LYS 3 2HD LYS 3 17.107 -11.402 6.442 37 HE2 LYS 3 1HE LYS 3 16.067 -8.957 4.981 38 HE3 LYS 3 2HE LYS 3 17.711 -8.964 5.632 39 HZ1 LYS 3 3HZ LYS 3 16.681 -11.013 3.742 40 HZ2 LYS 3 1HZ LYS 3 18.206 -10.923 4.323 41 HZ3 LYS 3 2HZ LYS 3 17.645 -9.762 3.329 42 H ASN 4 H ASN 4 13.038 -8.144 9.278 43 HA ASN 4 HA ASN 4 10.150 -8.380 9.158 44 HB2 ASN 4 1HB ASN 4 11.619 -8.724 11.177 45 HB3 ASN 4 2HB ASN 4 11.902 -6.981 11.224 46 HD21 ASN 4 2HD2 ASN 4 11.014 -7.362 13.492 47 HD22 ASN 4 1HD2 ASN 4 9.259 -7.337 13.639 48 H TRP 5 H TRP 5 12.408 -5.659 8.751 49 HA TRP 5 HA TRP 5 10.345 -3.591 8.656 50 HB2 TRP 5 1HB TRP 5 13.289 -3.737 8.354 51 HB3 TRP 5 2HB TRP 5 12.525 -2.582 7.282 52 HD1 TRP 5 HD1 TRP 5 12.445 -0.272 8.231 53 HE1 TRP 5 HE1 TRP 5 12.184 0.822 10.548 54 HE3 TRP 5 HE3 TRP 5 12.107 -4.502 11.111 55 HZ2 TRP 5 HZ2 TRP 5 11.781 -0.024 13.266 56 HZ3 TRP 5 HZ3 TRP 5 11.721 -4.328 13.548 57 HH2 TRP 5 HH2 TRP 5 11.562 -2.099 14.645 58 H PHE 6 H PHE 6 12.011 -5.591 6.263 59 HA PHE 6 HA PHE 6 10.656 -4.377 3.978 60 HB2 PHE 6 1HB PHE 6 13.050 -5.826 4.389 61 HB3 PHE 6 2HB PHE 6 12.064 -6.875 3.405 62 HD1 PHE 6 HD1 PHE 6 11.161 -5.986 1.166 63 HD2 PHE 6 HD2 PHE 6 14.006 -3.809 3.559 64 HE1 PHE 6 HE1 PHE 6 11.713 -4.557 -0.789 65 HE2 PHE 6 HE2 PHE 6 14.568 -2.383 1.594 66 HZ PHE 6 HZ PHE 6 13.416 -2.755 -0.578 67 H ASP 7 H ASP 7 9.209 -6.223 6.169 68 HA ASP 7 HA ASP 7 8.097 -8.421 4.755 69 HB2 ASP 7 1HB ASP 7 7.449 -6.957 7.267 70 HB3 ASP 7 2HB ASP 7 6.086 -7.743 6.517 71 H ILE 8 H ILE 8 7.380 -8.121 2.784 72 HA ILE 8 HA ILE 8 5.871 -6.036 1.722 73 HB ILE 8 HB ILE 8 5.290 -7.501 -0.112 74 HG12 ILE 8 1HG1 ILE 8 6.414 -9.797 1.564 75 HG13 ILE 8 2HG1 ILE 8 4.715 -9.554 1.152 76 HG21 ILE 8 1HG2 ILE 8 7.526 -7.892 -0.880 77 HG22 ILE 8 2HG2 ILE 8 7.604 -6.499 0.201 78 HG23 ILE 8 3HG2 ILE 8 8.146 -8.091 0.770 79 HD11 ILE 8 3HD1 ILE 8 6.956 -10.173 -0.805 80 HD12 ILE 8 1HD1 ILE 8 5.622 -11.227 -0.314 81 HD13 ILE 8 2HD1 ILE 8 5.284 -9.771 -1.272 82 H THR 9 H THR 9 4.685 -8.477 3.877 83 HA THR 9 HA THR 9 1.897 -8.495 3.285 84 HB THR 9 HB THR 9 1.937 -8.822 5.983 85 HG1 THR 9 HG1 THR 9 3.905 -9.923 6.458 86 HG21 THR 9 3HG2 THR 9 2.884 -10.885 3.952 87 HG22 THR 9 1HG2 THR 9 1.197 -10.516 4.388 88 HG23 THR 9 2HG2 THR 9 2.279 -11.233 5.591 89 H ASN 10 H ASN 10 3.908 -6.178 5.097 90 HA ASN 10 HA ASN 10 1.532 -4.593 5.881 91 HB2 ASN 10 1HB ASN 10 3.468 -4.790 7.419 92 HB3 ASN 10 2HB ASN 10 4.508 -4.021 6.213 93 HD21 ASN 10 2HD2 ASN 10 1.369 -3.409 7.964 94 HD22 ASN 10 1HD2 ASN 10 1.689 -1.688 8.108 95 H TRP 11 H TRP 11 4.009 -4.536 3.313 96 HA TRP 11 HA TRP 11 3.537 -1.922 2.321 97 HB2 TRP 11 1HB TRP 11 4.446 -4.461 0.958 98 HB3 TRP 11 2HB TRP 11 4.201 -2.972 0.093 99 HD1 TRP 11 HD1 TRP 11 6.301 -4.062 3.191 100 HE1 TRP 11 HE1 TRP 11 8.536 -2.795 3.115 101 HE3 TRP 11 HE3 TRP 11 5.405 -1.169 -0.881 102 HZ2 TRP 11 HZ2 TRP 11 9.810 -0.825 1.422 103 HZ3 TRP 11 HZ3 TRP 11 7.145 0.418 -1.743 104 HH2 TRP 11 HH2 TRP 11 9.350 0.586 -0.594 105 H LEU 12 H LEU 12 1.632 -4.859 1.940 106 HA LEU 12 HA LEU 12 -0.115 -4.128 -0.148 107 HB2 LEU 12 1HB LEU 12 -0.951 -5.582 2.382 108 HB3 LEU 12 2HB LEU 12 -1.709 -5.673 0.793 109 HG LEU 12 HG LEU 12 0.979 -6.792 1.616 110 HD11 LEU 12 1HD1 LEU 12 -1.542 -8.198 0.693 111 HD12 LEU 12 2HD1 LEU 12 -0.990 -8.054 2.381 112 HD13 LEU 12 3HD1 LEU 12 -0.021 -8.958 1.206 113 HD21 LEU 12 3HD2 LEU 12 1.108 -7.809 -0.635 114 HD22 LEU 12 1HD2 LEU 12 1.167 -6.048 -0.721 115 HD23 LEU 12 2HD2 LEU 12 -0.343 -6.902 -1.128 116 H TRP 13 H TRP 13 -0.046 -2.919 3.168 117 HA TRP 13 HA TRP 13 -2.698 -1.821 3.284 118 HB2 TRP 13 1HB TRP 13 -1.181 -2.208 5.218 119 HB3 TRP 13 2HB TRP 13 -0.188 -0.855 4.699 120 HD1 TRP 13 HD1 TRP 13 -3.668 -1.621 6.112 121 HE1 TRP 13 HE1 TRP 13 -4.666 0.514 7.161 122 HE3 TRP 13 HE3 TRP 13 -0.080 1.747 4.693 123 HZ2 TRP 13 HZ2 TRP 13 -3.999 3.307 7.346 124 HZ3 TRP 13 HZ3 TRP 13 -0.298 4.150 5.305 125 HH2 TRP 13 HH2 TRP 13 -2.241 4.938 6.623 126 H TYR 14 H TYR 14 0.427 -0.237 2.460 127 HA TYR 14 HA TYR 14 -0.705 2.295 1.739 128 HB2 TYR 14 1HB TYR 14 1.826 1.022 0.642 129 HB3 TYR 14 2HB TYR 14 1.414 2.729 0.627 130 HD1 TYR 14 HD2 TYR 14 1.253 4.005 2.838 131 HD2 TYR 14 HD1 TYR 14 2.835 0.016 2.528 132 HE1 TYR 14 HE2 TYR 14 2.347 4.263 5.071 133 HE2 TYR 14 HE1 TYR 14 3.915 0.255 4.769 134 HH TYR 14 HH TYR 14 4.283 1.633 6.550 135 H ILE 15 H ILE 15 -0.241 -0.684 -0.090 136 HA ILE 15 HA ILE 15 -0.907 0.481 -2.688 137 HB ILE 15 HB ILE 15 -0.992 -2.434 -1.842 138 HG12 ILE 15 1HG1 ILE 15 1.255 -1.386 -1.623 139 HG13 ILE 15 2HG1 ILE 15 1.187 -2.697 -2.778 140 HG21 ILE 15 1HG2 ILE 15 -2.344 -2.191 -3.810 141 HG22 ILE 15 2HG2 ILE 15 -1.185 -1.082 -4.563 142 HG23 ILE 15 3HG2 ILE 15 -0.780 -2.807 -4.355 143 HD11 ILE 15 3HD1 ILE 15 1.341 -1.168 -4.648 144 HD12 ILE 15 1HD1 ILE 15 1.121 0.247 -3.589 145 HD13 ILE 15 2HD1 ILE 15 2.593 -0.729 -3.474 146 H LYS 16 H LYS 16 -2.830 -1.417 -0.336 147 HA LYS 16 HA LYS 16 -5.351 -1.121 -1.732 148 HB2 LYS 16 1HB LYS 16 -4.554 -1.870 1.063 149 HB3 LYS 16 2HB LYS 16 -6.243 -1.481 0.735 150 HG2 LYS 16 1HG LYS 16 -6.626 -3.308 -0.554 151 HG3 LYS 16 2HG LYS 16 -5.020 -3.298 -1.292 152 HD2 LYS 16 1HD LYS 16 -4.017 -4.278 0.652 153 HD3 LYS 16 2HD LYS 16 -5.553 -4.215 1.549 154 HE2 LYS 16 1HE LYS 16 -6.587 -5.739 -0.108 155 HE3 LYS 16 2HE LYS 16 -5.089 -5.764 -1.046 156 HZ1 LYS 16 3HZ LYS 16 -3.992 -6.815 0.867 157 HZ2 LYS 16 1HZ LYS 16 -5.261 -7.715 0.379 158 HZ3 LYS 16 2HZ LYS 16 -5.385 -6.803 1.725 159 H LEU 17 H LEU 17 -3.857 0.868 0.817 160 HA LEU 17 HA LEU 17 -5.919 2.828 0.964 161 HB2 LEU 17 1HB LEU 17 -4.207 2.531 2.673 162 HB3 LEU 17 2HB LEU 17 -2.952 3.099 1.577 163 HG LEU 17 HG LEU 17 -5.227 4.991 1.787 164 HD11 LEU 17 1HD1 LEU 17 -4.754 5.793 4.036 165 HD12 LEU 17 2HD1 LEU 17 -3.633 4.434 4.284 166 HD13 LEU 17 3HD1 LEU 17 -5.376 4.133 4.058 167 HD21 LEU 17 3HD2 LEU 17 -3.456 6.627 2.124 168 HD22 LEU 17 1HD2 LEU 17 -3.006 5.550 0.793 169 HD23 LEU 17 2HD2 LEU 17 -2.265 5.336 2.398 170 H PHE 18 H PHE 18 -3.165 2.617 -1.340 171 HA PHE 18 HA PHE 18 -3.347 5.146 -2.466 172 HB2 PHE 18 1HB PHE 18 -1.639 3.658 -3.188 173 HB3 PHE 18 2HB PHE 18 -2.797 2.508 -3.834 174 HD1 PHE 18 HD2 PHE 18 -2.608 6.279 -4.327 175 HD2 PHE 18 HD1 PHE 18 -2.448 2.349 -6.114 176 HE1 PHE 18 HE2 PHE 18 -2.385 7.302 -6.558 177 HE2 PHE 18 HE1 PHE 18 -2.274 3.392 -8.361 178 HZ PHE 18 HZ PHE 18 -2.231 5.870 -8.586 179 H ILE 19 H ILE 19 -5.588 2.425 -3.106 180 HA ILE 19 HA ILE 19 -7.176 3.910 -5.029 181 HB ILE 19 HB ILE 19 -7.874 1.467 -3.362 182 HG12 ILE 19 1HG1 ILE 19 -7.695 0.314 -5.677 183 HG13 ILE 19 2HG1 ILE 19 -6.789 1.729 -6.199 184 HG21 ILE 19 1HG2 ILE 19 -9.951 2.391 -3.979 185 HG22 ILE 19 2HG2 ILE 19 -9.363 2.894 -5.568 186 HG23 ILE 19 3HG2 ILE 19 -9.663 1.173 -5.211 187 HD11 ILE 19 3HD1 ILE 19 -5.449 -0.295 -5.503 188 HD12 ILE 19 1HD1 ILE 19 -4.990 1.200 -4.694 189 HD13 ILE 19 2HD1 ILE 19 -5.987 -0.012 -3.837 190 H MET 20 H MET 20 -7.216 3.687 -1.511 191 HA MET 20 HA MET 20 -9.867 4.830 -1.110 192 HB2 MET 20 1HB MET 20 -7.499 4.563 0.780 193 HB3 MET 20 2HB MET 20 -9.102 5.088 1.250 194 HG2 MET 20 1HG MET 20 -8.673 2.416 -0.133 195 HG3 MET 20 2HG MET 20 -8.415 2.600 1.590 196 HE1 MET 20 3HE MET 20 -10.838 4.507 2.665 197 HE2 MET 20 1HE MET 20 -11.798 3.105 3.177 198 HE3 MET 20 2HE MET 20 -10.025 3.073 3.330 199 H ILE 21 H ILE 21 -6.545 6.189 -0.894 200 HA ILE 21 HA ILE 21 -7.386 8.856 -0.252 201 HB ILE 21 HB ILE 21 -5.172 8.069 0.270 202 HG12 ILE 21 1HG1 ILE 21 -4.890 10.382 -1.693 203 HG13 ILE 21 2HG1 ILE 21 -5.699 10.539 -0.132 204 HG21 ILE 21 1HG2 ILE 21 -3.401 7.712 -1.330 205 HG22 ILE 21 2HG2 ILE 21 -4.759 6.716 -1.800 206 HG23 ILE 21 3HG2 ILE 21 -4.433 8.210 -2.688 207 HD11 ILE 21 3HD1 ILE 21 -3.376 11.309 -0.003 208 HD12 ILE 21 1HD1 ILE 21 -3.634 9.902 1.047 209 HD13 ILE 21 2HD1 ILE 21 -2.785 9.721 -0.507 210 H VAL 22 H VAL 22 -6.683 7.370 -3.420 211 HA VAL 22 HA VAL 22 -7.192 9.783 -4.951 212 HB VAL 22 HB VAL 22 -7.304 8.314 -6.899 213 HG11 VAL 22 1HG1 VAL 22 -5.135 9.021 -6.124 214 HG12 VAL 22 2HG1 VAL 22 -5.025 7.580 -5.075 215 HG13 VAL 22 3HG1 VAL 22 -5.079 7.388 -6.832 216 HG21 VAL 22 3HG2 VAL 22 -7.363 6.086 -4.927 217 HG22 VAL 22 1HG2 VAL 22 -8.449 6.389 -6.271 218 HG23 VAL 22 2HG2 VAL 22 -6.783 5.842 -6.568 219 H GLY 23 H GLY 23 -9.297 7.156 -3.862 220 HA2 GLY 23 1HA GLY 23 -11.466 6.613 -4.163 221 HA3 GLY 23 2HA GLY 23 -11.831 8.345 -4.137 222 H GLY 24 H GLY 24 -12.050 9.434 -6.108 223 HA2 GLY 24 1HA GLY 24 -13.037 7.889 -8.381 224 HA3 GLY 24 2HA GLY 24 -12.936 9.643 -8.265 225 H LEU 25 H LEU 25 -9.926 9.457 -7.668 226 HA LEU 25 HA LEU 25 -9.109 9.486 -10.483 227 HB2 LEU 25 1HB LEU 25 -7.031 9.765 -8.359 228 HB3 LEU 25 2HB LEU 25 -7.165 10.515 -9.916 229 HG LEU 25 HG LEU 25 -8.767 11.252 -7.443 230 HD11 LEU 25 1HD1 LEU 25 -7.411 13.275 -7.440 231 HD12 LEU 25 2HD1 LEU 25 -6.507 12.696 -8.858 232 HD13 LEU 25 3HD1 LEU 25 -6.396 11.830 -7.307 233 HD21 LEU 25 3HD2 LEU 25 -10.079 11.758 -9.482 234 HD22 LEU 25 1HD2 LEU 25 -8.674 12.579 -10.193 235 HD23 LEU 25 2HD2 LEU 25 -9.473 13.247 -8.750 236 H VAL 26 H VAL 26 -9.529 6.882 -8.571 237 HA VAL 26 HA VAL 26 -7.238 5.297 -8.621 238 HB VAL 26 HB VAL 26 -9.357 4.753 -7.475 239 HG11 VAL 26 1HG1 VAL 26 -10.396 3.701 -10.130 240 HG12 VAL 26 2HG1 VAL 26 -11.181 3.621 -8.543 241 HG13 VAL 26 3HG1 VAL 26 -10.966 5.187 -9.329 242 HG21 VAL 26 3HG2 VAL 26 -7.608 3.075 -7.731 243 HG22 VAL 26 1HG2 VAL 26 -9.227 2.339 -7.716 244 HG23 VAL 26 2HG2 VAL 26 -8.351 2.495 -9.239 245 H LYS 27 H LYS 27 -9.358 5.919 -11.289 246 HA LYS 27 HA LYS 27 -8.435 3.926 -13.132 247 HB2 LYS 27 1HB LYS 27 -10.529 5.555 -13.102 248 HB3 LYS 27 2HB LYS 27 -9.457 6.642 -13.989 249 HG2 LYS 27 1HG LYS 27 -9.120 4.696 -15.656 250 HG3 LYS 27 2HG LYS 27 -10.381 3.837 -14.752 251 HD2 LYS 27 1HD LYS 27 -11.905 5.853 -15.173 252 HD3 LYS 27 2HD LYS 27 -10.623 6.518 -16.188 253 HE2 LYS 27 1HE LYS 27 -12.154 5.504 -17.670 254 HE3 LYS 27 2HE LYS 27 -10.749 4.436 -17.620 255 HZ1 LYS 27 3HZ LYS 27 -11.978 2.963 -16.145 256 HZ2 LYS 27 1HZ LYS 27 -12.912 3.256 -17.450 257 HZ3 LYS 27 2HZ LYS 27 -13.236 4.005 -16.039 258 H LYS 28 H LYS 28 -6.848 6.759 -12.050 259 HA LYS 28 HA LYS 28 -4.888 6.798 -14.316 260 HB2 LYS 28 1HB LYS 28 -5.905 9.009 -12.487 261 HB3 LYS 28 2HB LYS 28 -4.475 9.197 -13.495 262 HG2 LYS 28 1HG LYS 28 -7.168 8.409 -14.675 263 HG3 LYS 28 2HG LYS 28 -6.725 10.087 -14.406 264 HD2 LYS 28 1HD LYS 28 -4.802 8.317 -15.933 265 HD3 LYS 28 2HD LYS 28 -6.251 8.876 -16.751 266 HE2 LYS 28 1HE LYS 28 -4.448 10.832 -15.281 267 HE3 LYS 28 2HE LYS 28 -4.036 10.272 -16.904 268 HZ1 LYS 28 3HZ LYS 28 -5.335 12.320 -16.985 269 HZ2 LYS 28 1HZ LYS 28 -6.590 11.623 -16.209 270 HZ3 LYS 28 2HZ LYS 28 -6.160 11.111 -17.700
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