NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
621738 | 5o2y | 26919 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 25 1H MET 25 25.756 -2.979 -1.620 2 H2 MET 25 2H MET 25 24.109 -2.702 -1.861 3 H3 MET 25 3H MET 25 25.119 -1.428 -1.402 4 HA MET 25 HA MET 25 24.540 -1.318 -3.742 5 HB2 MET 25 1HB MET 25 27.415 -1.884 -3.024 6 HB3 MET 25 2HB MET 25 26.934 -1.304 -4.611 7 HG2 MET 25 1HG MET 25 26.435 0.123 -2.008 8 HG3 MET 25 2HG MET 25 27.718 0.498 -3.157 9 HE1 MET 25 1HE MET 25 25.350 3.549 -3.642 10 HE2 MET 25 2HE MET 25 26.993 3.008 -3.294 11 HE3 MET 25 3HE MET 25 25.703 2.721 -2.126 12 H GLY 26 H GLY 26 24.017 -2.396 -5.537 13 HA2 GLY 26 1HA GLY 26 25.271 -4.403 -6.835 14 HA3 GLY 26 2HA GLY 26 24.371 -5.262 -5.595 15 H ASN 27 H ASN 27 23.675 -6.030 -7.944 16 HA ASN 27 HA ASN 27 21.569 -4.390 -9.072 17 HB2 ASN 27 1HB ASN 27 23.001 -5.667 -10.580 18 HB3 ASN 27 2HB ASN 27 22.536 -7.168 -9.787 19 HD21 ASN 27 1HD2 ASN 27 20.116 -5.412 -12.536 20 HD22 ASN 27 2HD2 ASN 27 21.498 -4.595 -11.891 21 H LYS 28 H LYS 28 21.911 -7.188 -7.023 22 HA LYS 28 HA LYS 28 19.397 -8.332 -7.131 23 HB2 LYS 28 1HB LYS 28 21.249 -9.300 -5.864 24 HB3 LYS 28 2HB LYS 28 21.185 -7.971 -4.718 25 HG2 LYS 28 1HG LYS 28 18.641 -8.882 -4.578 26 HG3 LYS 28 2HG LYS 28 19.517 -10.375 -4.920 27 HD2 LYS 28 1HD LYS 28 19.451 -10.193 -2.565 28 HD3 LYS 28 2HD LYS 28 21.084 -9.722 -3.036 29 HE2 LYS 28 1HE LYS 28 20.333 -8.162 -1.393 30 HE3 LYS 28 2HE LYS 28 20.333 -7.336 -2.949 31 HZ1 LYS 28 1HZ LYS 28 18.323 -6.766 -1.873 32 HZ2 LYS 28 2HZ LYS 28 18.000 -8.377 -1.454 33 HZ3 LYS 28 3HZ LYS 28 17.898 -7.897 -3.072 34 H GLU 29 H GLU 29 20.509 -5.717 -5.003 35 HA GLU 29 HA GLU 29 18.165 -5.448 -3.519 36 HB2 GLU 29 1HB GLU 29 20.501 -4.424 -3.126 37 HB3 GLU 29 2HB GLU 29 19.940 -3.111 -4.155 38 HG2 GLU 29 1HG GLU 29 19.534 -2.411 -1.955 39 HG3 GLU 29 2HG GLU 29 17.966 -2.909 -2.594 40 H LYS 30 H LYS 30 19.151 -3.871 -6.528 41 HA LYS 30 HA LYS 30 17.029 -2.036 -6.685 42 HB2 LYS 30 1HB LYS 30 18.567 -3.335 -8.942 43 HB3 LYS 30 2HB LYS 30 17.546 -1.912 -9.091 44 HG2 LYS 30 1HG LYS 30 19.051 -0.768 -7.452 45 HG3 LYS 30 2HG LYS 30 20.124 -2.165 -7.567 46 HD2 LYS 30 1HD LYS 30 20.284 -1.795 -10.005 47 HD3 LYS 30 2HD LYS 30 19.287 -0.350 -9.827 48 HE2 LYS 30 1HE LYS 30 21.586 0.319 -9.919 49 HE3 LYS 30 2HE LYS 30 20.996 0.567 -8.277 50 HZ1 LYS 30 1HZ LYS 30 22.035 -1.554 -7.660 51 HZ2 LYS 30 2HZ LYS 30 23.166 -0.430 -8.231 52 HZ3 LYS 30 3HZ LYS 30 22.660 -1.697 -9.225 53 H ALA 31 H ALA 31 17.395 -5.317 -7.961 54 HA ALA 31 HA ALA 31 14.922 -5.428 -9.305 55 HB1 ALA 31 1HB ALA 31 16.558 -7.680 -8.144 56 HB2 ALA 31 2HB ALA 31 16.742 -6.990 -9.755 57 HB3 ALA 31 3HB ALA 31 15.264 -7.850 -9.328 58 H ASP 32 H ASP 32 15.872 -6.266 -6.003 59 HA ASP 32 HA ASP 32 13.403 -7.429 -5.246 60 HB2 ASP 32 1HB ASP 32 15.685 -6.261 -3.673 61 HB3 ASP 32 2HB ASP 32 14.220 -6.815 -2.872 62 H ARG 33 H ARG 33 14.695 -4.135 -4.832 63 HA ARG 33 HA ARG 33 12.366 -3.257 -3.473 64 HB2 ARG 33 1HB ARG 33 13.238 -0.996 -3.678 65 HB3 ARG 33 2HB ARG 33 14.454 -2.116 -3.095 66 HG2 ARG 33 1HG ARG 33 15.415 -2.193 -5.364 67 HG3 ARG 33 2HG ARG 33 14.243 -0.968 -5.864 68 HD2 ARG 33 1HD ARG 33 16.288 -0.667 -3.670 69 HD3 ARG 33 2HD ARG 33 16.412 0.026 -5.285 70 HE ARG 33 HE ARG 33 14.501 1.426 -4.728 71 HH11 ARG 33 1HH1 ARG 33 16.011 -0.237 -2.038 72 HH12 ARG 33 2HH1 ARG 33 15.551 0.961 -0.873 73 HH21 ARG 33 1HH2 ARG 33 13.894 3.010 -3.177 74 HH22 ARG 33 2HH2 ARG 33 14.360 2.802 -1.517 75 H GLN 34 H GLN 34 13.311 -3.196 -6.881 76 HA GLN 34 HA GLN 34 11.145 -1.661 -7.809 77 HB2 GLN 34 1HB GLN 34 12.832 -3.797 -9.072 78 HB3 GLN 34 2HB GLN 34 11.450 -3.134 -9.930 79 HG2 GLN 34 1HG GLN 34 13.749 -1.512 -8.858 80 HG3 GLN 34 2HG GLN 34 13.576 -2.051 -10.529 81 HE21 GLN 34 1HE2 GLN 34 11.488 1.137 -9.146 82 HE22 GLN 34 2HE2 GLN 34 12.421 0.138 -8.086 83 H LYS 35 H LYS 35 11.416 -5.115 -7.102 84 HA LYS 35 HA LYS 35 8.801 -5.866 -7.832 85 HB2 LYS 35 1HB LYS 35 10.474 -7.546 -7.375 86 HB3 LYS 35 2HB LYS 35 10.685 -6.957 -5.734 87 HG2 LYS 35 1HG LYS 35 8.426 -7.687 -5.176 88 HG3 LYS 35 2HG LYS 35 8.204 -8.266 -6.828 89 HD2 LYS 35 1HD LYS 35 9.915 -9.913 -6.557 90 HD3 LYS 35 2HD LYS 35 10.389 -9.241 -4.998 91 HE2 LYS 35 1HE LYS 35 9.070 -11.279 -4.729 92 HE3 LYS 35 2HE LYS 35 8.239 -9.882 -4.051 93 HZ1 LYS 35 1HZ LYS 35 6.751 -11.309 -5.320 94 HZ2 LYS 35 2HZ LYS 35 7.687 -11.082 -6.708 95 HZ3 LYS 35 3HZ LYS 35 6.867 -9.778 -6.019 96 H VAL 36 H VAL 36 10.168 -4.550 -4.877 97 HA VAL 36 HA VAL 36 7.877 -4.568 -3.270 98 HB VAL 36 HB VAL 36 10.332 -2.828 -3.315 99 HG11 VAL 36 1HG1 VAL 36 9.563 -2.048 -1.026 100 HG12 VAL 36 2HG1 VAL 36 7.951 -2.583 -1.503 101 HG13 VAL 36 3HG1 VAL 36 8.773 -1.318 -2.423 102 HG21 VAL 36 1HG2 VAL 36 9.328 -4.911 -1.380 103 HG22 VAL 36 2HG2 VAL 36 10.839 -4.013 -1.233 104 HG23 VAL 36 3HG2 VAL 36 10.603 -5.131 -2.578 105 H VAL 37 H VAL 37 9.141 -2.056 -5.447 106 HA VAL 37 HA VAL 37 7.137 -0.147 -5.021 107 HB VAL 37 HB VAL 37 8.755 -0.628 -7.532 108 HG11 VAL 37 1HG1 VAL 37 6.796 0.749 -7.993 109 HG12 VAL 37 2HG1 VAL 37 8.268 1.717 -8.064 110 HG13 VAL 37 3HG1 VAL 37 7.215 1.815 -6.653 111 HG21 VAL 37 1HG2 VAL 37 9.233 1.230 -5.204 112 HG22 VAL 37 2HG2 VAL 37 10.209 1.143 -6.670 113 HG23 VAL 37 3HG2 VAL 37 10.147 -0.233 -5.569 114 H SER 38 H SER 38 7.284 -2.884 -7.249 115 HA SER 38 HA SER 38 5.036 -2.287 -8.807 116 HB2 SER 38 1HB SER 38 6.057 -5.020 -7.988 117 HB3 SER 38 2HB SER 38 5.003 -4.675 -9.358 118 HG SER 38 HG SER 38 7.554 -3.470 -9.076 119 H ASP 39 H ASP 39 5.299 -4.215 -5.827 120 HA ASP 39 HA ASP 39 2.499 -4.662 -5.589 121 HB2 ASP 39 1HB ASP 39 4.778 -4.894 -3.637 122 HB3 ASP 39 2HB ASP 39 3.111 -5.211 -3.171 123 H LEU 40 H LEU 40 4.701 -2.211 -4.435 124 HA LEU 40 HA LEU 40 3.072 -0.932 -2.565 125 HB2 LEU 40 1HB LEU 40 5.519 -0.548 -3.013 126 HB3 LEU 40 2HB LEU 40 5.054 0.390 -4.417 127 HG LEU 40 HG LEU 40 3.787 1.913 -2.856 128 HD11 LEU 40 1HD1 LEU 40 4.451 1.860 -0.492 129 HD12 LEU 40 2HD1 LEU 40 5.321 0.353 -0.778 130 HD13 LEU 40 3HD1 LEU 40 3.568 0.409 -0.964 131 HD21 LEU 40 1HD2 LEU 40 5.949 2.516 -3.782 132 HD22 LEU 40 2HD2 LEU 40 6.768 1.641 -2.488 133 HD23 LEU 40 3HD2 LEU 40 5.815 3.078 -2.115 134 H VAL 41 H VAL 41 3.425 -0.370 -6.059 135 HA VAL 41 HA VAL 41 1.518 1.688 -6.269 136 HB VAL 41 HB VAL 41 2.309 -0.367 -8.348 137 HG11 VAL 41 1HG1 VAL 41 0.911 2.287 -8.681 138 HG12 VAL 41 2HG1 VAL 41 0.193 0.694 -8.923 139 HG13 VAL 41 3HG1 VAL 41 1.480 1.252 -9.992 140 HG21 VAL 41 1HG2 VAL 41 3.334 2.425 -7.834 141 HG22 VAL 41 2HG2 VAL 41 3.793 1.400 -9.195 142 HG23 VAL 41 3HG2 VAL 41 4.211 0.920 -7.549 143 H ALA 42 H ALA 42 1.216 -1.836 -6.480 144 HA ALA 42 HA ALA 42 -1.520 -1.949 -7.120 145 HB1 ALA 42 1HB ALA 42 -1.446 -4.246 -6.281 146 HB2 ALA 42 2HB ALA 42 0.121 -3.925 -5.538 147 HB3 ALA 42 3HB ALA 42 -0.046 -3.886 -7.293 148 H LEU 43 H LEU 43 0.148 -1.756 -4.012 149 HA LEU 43 HA LEU 43 -2.049 -2.079 -2.304 150 HB2 LEU 43 1HB LEU 43 0.464 -0.434 -1.990 151 HB3 LEU 43 2HB LEU 43 -0.684 -0.696 -0.693 152 HG LEU 43 HG LEU 43 0.908 -2.857 -2.072 153 HD11 LEU 43 1HD1 LEU 43 2.324 -1.439 -0.726 154 HD12 LEU 43 2HD1 LEU 43 2.080 -2.977 0.100 155 HD13 LEU 43 3HD1 LEU 43 1.196 -1.543 0.625 156 HD21 LEU 43 1HD2 LEU 43 -1.258 -3.644 -1.263 157 HD22 LEU 43 2HD2 LEU 43 -0.922 -2.960 0.325 158 HD23 LEU 43 3HD2 LEU 43 0.058 -4.290 -0.287 159 H GLU 44 H GLU 44 -0.616 0.837 -3.687 160 HA GLU 44 HA GLU 44 -2.448 2.631 -2.505 161 HB2 GLU 44 1HB GLU 44 -0.170 3.168 -3.451 162 HB3 GLU 44 2HB GLU 44 -0.890 3.056 -5.050 163 HG2 GLU 44 1HG GLU 44 -2.340 4.895 -4.599 164 HG3 GLU 44 2HG GLU 44 -1.843 4.930 -2.907 165 H GLY 45 H GLY 45 -2.381 0.894 -5.563 166 HA2 GLY 45 1HA GLY 45 -4.619 2.091 -6.768 167 HA3 GLY 45 2HA GLY 45 -4.043 0.464 -7.089 168 H ALA 46 H ALA 46 -4.387 -0.650 -4.519 169 HA ALA 46 HA ALA 46 -7.133 -1.287 -4.490 170 HB1 ALA 46 1HB ALA 46 -5.088 -1.607 -2.292 171 HB2 ALA 46 2HB ALA 46 -5.447 -2.778 -3.559 172 HB3 ALA 46 3HB ALA 46 -6.666 -2.391 -2.348 173 H LEU 47 H LEU 47 -5.202 0.980 -2.607 174 HA LEU 47 HA LEU 47 -7.199 1.923 -0.881 175 HB2 LEU 47 1HB LEU 47 -4.616 2.964 -1.919 176 HB3 LEU 47 2HB LEU 47 -5.701 4.122 -1.185 177 HG LEU 47 HG LEU 47 -5.610 2.986 0.925 178 HD11 LEU 47 1HD1 LEU 47 -3.993 0.873 -0.483 179 HD12 LEU 47 2HD1 LEU 47 -5.607 0.691 0.203 180 HD13 LEU 47 3HD1 LEU 47 -4.230 0.980 1.262 181 HD21 LEU 47 1HD2 LEU 47 -3.256 3.209 1.460 182 HD22 LEU 47 2HD2 LEU 47 -3.776 4.511 0.390 183 HD23 LEU 47 3HD2 LEU 47 -2.846 3.158 -0.254 184 H ASP 48 H ASP 48 -6.154 3.115 -4.054 185 HA ASP 48 HA ASP 48 -8.016 5.220 -4.218 186 HB2 ASP 48 1HB ASP 48 -6.408 3.727 -6.272 187 HB3 ASP 48 2HB ASP 48 -7.584 4.946 -6.759 188 H MET 49 H MET 49 -8.203 1.835 -5.185 189 HA MET 49 HA MET 49 -10.693 2.055 -6.521 190 HB2 MET 49 1HB MET 49 -9.295 -0.313 -5.273 191 HB3 MET 49 2HB MET 49 -10.826 -0.446 -6.129 192 HG2 MET 49 1HG MET 49 -8.251 0.577 -7.305 193 HG3 MET 49 2HG MET 49 -8.917 -1.038 -7.537 194 HE1 MET 49 1HE MET 49 -9.434 0.616 -11.052 195 HE2 MET 49 2HE MET 49 -8.756 -0.755 -10.172 196 HE3 MET 49 3HE MET 49 -8.075 0.857 -9.954 197 H TYR 50 H TYR 50 -9.804 1.290 -3.189 198 HA TYR 50 HA TYR 50 -12.415 0.814 -2.241 199 HB2 TYR 50 1HB TYR 50 -10.411 0.208 -0.956 200 HB3 TYR 50 2HB TYR 50 -10.006 1.910 -0.767 201 HD1 TYR 50 HD1 TYR 50 -12.240 -0.791 0.330 202 HD2 TYR 50 HD2 TYR 50 -11.212 3.308 0.792 203 HE1 TYR 50 HE1 TYR 50 -13.560 -0.697 2.406 204 HE2 TYR 50 HE2 TYR 50 -12.522 3.414 2.862 205 HH TYR 50 HH TYR 50 -13.786 0.582 4.394 206 H LYS 51 H LYS 51 -10.505 3.757 -2.604 207 HA LYS 51 HA LYS 51 -12.387 5.517 -1.417 208 HB2 LYS 51 1HB LYS 51 -10.020 6.119 -1.755 209 HB3 LYS 51 2HB LYS 51 -10.268 6.109 -3.496 210 HG2 LYS 51 1HG LYS 51 -11.869 7.949 -3.275 211 HG3 LYS 51 2HG LYS 51 -11.607 7.962 -1.532 212 HD2 LYS 51 1HD LYS 51 -9.233 8.481 -1.912 213 HD3 LYS 51 2HD LYS 51 -9.531 8.507 -3.651 214 HE2 LYS 51 1HE LYS 51 -10.884 10.306 -1.642 215 HE3 LYS 51 2HE LYS 51 -9.488 10.764 -2.619 216 HZ1 LYS 51 1HZ LYS 51 -10.811 10.431 -4.609 217 HZ2 LYS 51 2HZ LYS 51 -11.560 11.549 -3.588 218 HZ3 LYS 51 3HZ LYS 51 -12.146 9.968 -3.682 219 H LEU 52 H LEU 52 -12.008 4.232 -4.659 220 HA LEU 52 HA LEU 52 -13.794 5.964 -5.967 221 HB2 LEU 52 1HB LEU 52 -12.283 4.477 -7.176 222 HB3 LEU 52 2HB LEU 52 -13.131 3.076 -6.550 223 HG LEU 52 HG LEU 52 -15.163 3.802 -7.786 224 HD11 LEU 52 1HD1 LEU 52 -14.934 5.497 -9.533 225 HD12 LEU 52 2HD1 LEU 52 -13.303 5.858 -8.967 226 HD13 LEU 52 3HD1 LEU 52 -14.690 6.183 -7.927 227 HD21 LEU 52 1HD2 LEU 52 -13.643 2.140 -8.724 228 HD22 LEU 52 2HD2 LEU 52 -12.688 3.423 -9.465 229 HD23 LEU 52 3HD2 LEU 52 -14.348 3.144 -9.990 230 H ASP 53 H ASP 53 -14.312 2.815 -4.416 231 HA ASP 53 HA ASP 53 -17.126 2.843 -4.952 232 HB2 ASP 53 1HB ASP 53 -15.908 0.734 -4.817 233 HB3 ASP 53 2HB ASP 53 -15.506 1.056 -3.132 234 H ASN 54 H ASN 54 -15.152 3.422 -2.049 235 HA ASN 54 HA ASN 54 -17.619 3.857 -0.514 236 HB2 ASN 54 1HB ASN 54 -14.784 3.393 0.432 237 HB3 ASN 54 2HB ASN 54 -16.176 3.631 1.486 238 HD21 ASN 54 1HD2 ASN 54 -15.529 0.080 -0.345 239 HD22 ASN 54 2HD2 ASN 54 -14.596 1.480 -0.729 240 H SER 55 H SER 55 -15.461 5.664 -2.172 241 HA SER 55 HA SER 55 -15.075 7.884 -2.332 242 HB2 SER 55 1HB SER 55 -17.326 8.136 -0.338 243 HB3 SER 55 2HB SER 55 -16.718 9.414 -1.389 244 HG SER 55 HG SER 55 -18.443 7.364 -1.941 245 H ARG 56 H ARG 56 -13.658 6.319 -0.261 246 HA ARG 56 HA ARG 56 -12.328 8.527 0.972 247 HB2 ARG 56 1HB ARG 56 -12.710 7.978 3.286 248 HB3 ARG 56 2HB ARG 56 -14.266 8.217 2.507 249 HG2 ARG 56 1HG ARG 56 -14.903 6.267 3.344 250 HG3 ARG 56 2HG ARG 56 -13.737 5.484 2.273 251 HD2 ARG 56 1HD ARG 56 -12.006 5.741 3.996 252 HD3 ARG 56 2HD ARG 56 -13.191 6.483 5.067 253 HE ARG 56 HE ARG 56 -13.694 3.770 4.081 254 HH11 ARG 56 1HH1 ARG 56 -12.897 5.911 6.730 255 HH12 ARG 56 2HH1 ARG 56 -13.156 4.705 7.951 256 HH21 ARG 56 1HH2 ARG 56 -14.012 2.172 5.667 257 HH22 ARG 56 2HH2 ARG 56 -13.813 2.578 7.348 258 H TYR 57 H TYR 57 -10.389 7.836 2.141 259 HA TYR 57 HA TYR 57 -9.260 5.488 0.886 260 HB2 TYR 57 1HB TYR 57 -8.175 7.791 2.440 261 HB3 TYR 57 2HB TYR 57 -7.224 6.312 2.367 262 HD1 TYR 57 HD1 TYR 57 -7.048 5.308 -0.112 263 HD2 TYR 57 HD2 TYR 57 -7.726 9.396 0.834 264 HE1 TYR 57 HE1 TYR 57 -6.144 5.956 -2.304 265 HE2 TYR 57 HE2 TYR 57 -6.829 10.057 -1.358 266 HH TYR 57 HH TYR 57 -6.142 7.732 -3.853 267 HA PRO 58 HA PRO 58 -10.042 2.752 4.185 268 HB2 PRO 58 1HB PRO 58 -8.197 0.842 3.608 269 HB3 PRO 58 2HB PRO 58 -9.689 1.064 2.697 270 HG2 PRO 58 1HG PRO 58 -6.924 1.829 2.013 271 HG3 PRO 58 2HG PRO 58 -8.245 1.330 0.954 272 HD2 PRO 58 1HD PRO 58 -7.400 3.938 1.324 273 HD3 PRO 58 2HD PRO 58 -8.986 3.457 0.699 274 H THR 59 H THR 59 -9.250 1.847 6.079 275 HA THR 59 HA THR 59 -7.003 3.209 7.276 276 HB THR 59 HB THR 59 -7.714 1.928 9.332 277 HG1 THR 59 HG1 THR 59 -9.306 0.518 9.181 278 HG21 THR 59 1HG2 THR 59 -9.755 3.258 9.676 279 HG22 THR 59 2HG2 THR 59 -9.810 3.609 7.948 280 HG23 THR 59 3HG2 THR 59 -8.476 4.214 8.928 281 H THR 60 H THR 60 -5.807 1.576 8.938 282 HA THR 60 HA THR 60 -3.799 0.509 7.425 283 HB THR 60 HB THR 60 -3.437 1.055 9.728 284 HG1 THR 60 HG1 THR 60 -2.230 -0.782 8.746 285 HG21 THR 60 1HG2 THR 60 -5.639 0.465 10.617 286 HG22 THR 60 2HG2 THR 60 -4.348 -0.262 11.572 287 HG23 THR 60 3HG2 THR 60 -5.260 -1.248 10.430 288 H GLU 61 H GLU 61 -6.525 -1.344 8.831 289 HA GLU 61 HA GLU 61 -5.490 -3.818 7.773 290 HB2 GLU 61 1HB GLU 61 -6.824 -3.792 9.841 291 HB3 GLU 61 2HB GLU 61 -8.213 -3.202 8.938 292 HG2 GLU 61 1HG GLU 61 -8.324 -5.248 7.679 293 HG3 GLU 61 2HG GLU 61 -6.846 -5.835 8.438 294 H GLN 62 H GLN 62 -8.067 -1.567 6.941 295 HA GLN 62 HA GLN 62 -9.281 -3.157 4.964 296 HB2 GLN 62 1HB GLN 62 -9.312 -0.161 5.328 297 HB3 GLN 62 2HB GLN 62 -10.370 -1.047 4.240 298 HG2 GLN 62 1HG GLN 62 -11.293 -2.260 6.175 299 HG3 GLN 62 2HG GLN 62 -10.276 -1.290 7.238 300 HE21 GLN 62 1HE2 GLN 62 -12.287 1.546 7.115 301 HE22 GLN 62 2HE2 GLN 62 -10.759 0.867 7.563 302 H GLY 63 H GLY 63 -6.639 -0.848 4.825 303 HA2 GLY 63 1HA GLY 63 -6.631 -0.483 2.020 304 HA3 GLY 63 2HA GLY 63 -5.279 -0.182 3.099 305 H LEU 64 H LEU 64 -4.700 -2.649 4.072 306 HA LEU 64 HA LEU 64 -3.306 -3.812 1.894 307 HB2 LEU 64 1HB LEU 64 -3.326 -4.029 4.739 308 HB3 LEU 64 2HB LEU 64 -3.312 -5.633 4.023 309 HG LEU 64 HG LEU 64 -1.060 -4.826 4.466 310 HD11 LEU 64 1HD1 LEU 64 -1.370 -6.347 2.613 311 HD12 LEU 64 2HD1 LEU 64 -0.088 -5.190 2.257 312 HD13 LEU 64 3HD1 LEU 64 -1.684 -4.988 1.534 313 HD21 LEU 64 1HD2 LEU 64 -1.690 -2.621 2.525 314 HD22 LEU 64 2HD2 LEU 64 -0.117 -2.938 3.263 315 HD23 LEU 64 3HD2 LEU 64 -1.481 -2.434 4.267 316 H GLN 65 H GLN 65 -6.215 -4.680 3.675 317 HA GLN 65 HA GLN 65 -6.526 -7.233 2.453 318 HB2 GLN 65 1HB GLN 65 -8.332 -5.484 4.092 319 HB3 GLN 65 2HB GLN 65 -8.930 -6.961 3.347 320 HG2 GLN 65 1HG GLN 65 -6.628 -6.785 5.278 321 HG3 GLN 65 2HG GLN 65 -8.267 -7.306 5.670 322 HE21 GLN 65 1HE2 GLN 65 -5.937 -10.191 4.959 323 HE22 GLN 65 2HE2 GLN 65 -5.752 -8.754 5.904 324 H ALA 66 H ALA 66 -7.328 -4.032 1.449 325 HA ALA 66 HA ALA 66 -9.588 -4.522 -0.129 326 HB1 ALA 66 1HB ALA 66 -9.016 -2.428 -1.286 327 HB2 ALA 66 2HB ALA 66 -7.440 -2.439 -0.495 328 HB3 ALA 66 3HB ALA 66 -8.909 -2.278 0.467 329 H LEU 67 H LEU 67 -6.241 -5.206 -0.730 330 HA LEU 67 HA LEU 67 -6.560 -5.615 -3.559 331 HB2 LEU 67 1HB LEU 67 -4.394 -6.000 -1.573 332 HB3 LEU 67 2HB LEU 67 -4.309 -6.953 -3.038 333 HG LEU 67 HG LEU 67 -4.251 -3.951 -2.798 334 HD11 LEU 67 1HD1 LEU 67 -2.240 -5.978 -3.755 335 HD12 LEU 67 2HD1 LEU 67 -2.168 -5.052 -2.255 336 HD13 LEU 67 3HD1 LEU 67 -2.033 -4.224 -3.807 337 HD21 LEU 67 1HD2 LEU 67 -5.549 -4.567 -4.777 338 HD22 LEU 67 2HD2 LEU 67 -4.258 -5.652 -5.289 339 HD23 LEU 67 3HD2 LEU 67 -3.977 -3.914 -5.231 340 H VAL 68 H VAL 68 -7.317 -7.411 -0.783 341 HA VAL 68 HA VAL 68 -7.003 -9.984 -2.183 342 HB VAL 68 HB VAL 68 -7.257 -9.498 0.789 343 HG11 VAL 68 1HG1 VAL 68 -6.525 -11.831 0.993 344 HG12 VAL 68 2HG1 VAL 68 -6.565 -11.987 -0.763 345 HG13 VAL 68 3HG1 VAL 68 -8.056 -11.687 0.130 346 HG21 VAL 68 1HG2 VAL 68 -4.873 -10.033 0.915 347 HG22 VAL 68 2HG2 VAL 68 -5.164 -8.582 -0.047 348 HG23 VAL 68 3HG2 VAL 68 -4.798 -10.112 -0.846 349 H SER 69 H SER 69 -9.134 -8.442 0.232 350 HA SER 69 HA SER 69 -11.475 -9.593 -1.028 351 HB2 SER 69 1HB SER 69 -10.593 -11.416 0.444 352 HB3 SER 69 2HB SER 69 -10.748 -10.332 1.824 353 HG SER 69 HG SER 69 -12.546 -11.923 1.146 354 H ALA 70 H ALA 70 -13.400 -8.599 -0.329 355 HA ALA 70 HA ALA 70 -13.202 -5.903 0.340 356 HB1 ALA 70 1HB ALA 70 -15.619 -5.940 0.583 357 HB2 ALA 70 2HB ALA 70 -15.599 -7.701 0.666 358 HB3 ALA 70 3HB ALA 70 -15.125 -6.884 -0.822 359 HA PRO 71 HA PRO 71 -12.314 -6.073 4.723 360 HB2 PRO 71 1HB PRO 71 -13.424 -3.316 4.453 361 HB3 PRO 71 2HB PRO 71 -11.939 -3.860 5.244 362 HG2 PRO 71 1HG PRO 71 -11.831 -2.665 2.881 363 HG3 PRO 71 2HG PRO 71 -10.790 -4.059 3.231 364 HD2 PRO 71 1HD PRO 71 -13.279 -3.916 1.588 365 HD3 PRO 71 2HD PRO 71 -11.804 -4.869 1.325 366 H SER 72 H SER 72 -13.519 -6.554 6.452 367 HA SER 72 HA SER 72 -16.391 -6.593 6.217 368 HB2 SER 72 1HB SER 72 -16.226 -7.606 8.537 369 HB3 SER 72 2HB SER 72 -15.388 -8.496 7.266 370 HG SER 72 HG SER 72 -14.359 -7.689 9.499 371 H ALA 73 H ALA 73 -13.988 -4.525 7.448 372 HA ALA 73 HA ALA 73 -15.500 -3.153 9.418 373 HB1 ALA 73 1HB ALA 73 -13.144 -2.215 7.784 374 HB2 ALA 73 2HB ALA 73 -13.063 -3.038 9.340 375 HB3 ALA 73 3HB ALA 73 -13.772 -1.427 9.231 376 H GLU 74 H GLU 74 -16.682 -1.284 9.269 377 HA GLU 74 HA GLU 74 -18.026 -0.870 6.765 378 HB2 GLU 74 1HB GLU 74 -19.418 0.704 8.042 379 HB3 GLU 74 2HB GLU 74 -19.273 -0.845 8.863 380 HG2 GLU 74 1HG GLU 74 -17.565 0.104 10.336 381 HG3 GLU 74 2HG GLU 74 -17.734 1.656 9.521 382 HA PRO 75 HA PRO 75 -19.105 0.468 5.603 383 HB2 PRO 75 1HB PRO 75 -18.839 1.452 3.112 384 HB3 PRO 75 2HB PRO 75 -19.426 2.443 4.453 385 HG2 PRO 75 1HG PRO 75 -16.688 2.316 3.250 386 HG3 PRO 75 2HG PRO 75 -17.626 3.736 3.746 387 HD2 PRO 75 1HD PRO 75 -15.654 2.638 5.267 388 HD3 PRO 75 2HD PRO 75 -17.040 3.508 5.950 389 H HIS 76 H HIS 76 -19.415 -1.375 4.461 390 HA HIS 76 HA HIS 76 -17.159 -3.011 3.879 391 HB2 HIS 76 1HB HIS 76 -19.417 -3.815 4.687 392 HB3 HIS 76 2HB HIS 76 -20.032 -3.503 3.069 393 HD1 HIS 76 HD1 HIS 76 -18.375 -6.029 5.090 394 HD2 HIS 76 HD2 HIS 76 -18.782 -5.203 1.040 395 HE1 HIS 76 HE1 HIS 76 -17.737 -8.148 3.904 396 HE2 HIS 76 HE2 HIS 76 -18.222 -7.693 1.479 397 H ALA 77 H ALA 77 -15.991 -3.024 2.095 398 HA ALA 77 HA ALA 77 -16.432 -1.376 -0.106 399 HB1 ALA 77 1HB ALA 77 -14.732 -3.865 -0.025 400 HB2 ALA 77 2HB ALA 77 -14.232 -2.270 0.542 401 HB3 ALA 77 3HB ALA 77 -14.587 -2.529 -1.167 402 H ARG 78 H ARG 78 -17.553 -1.537 -1.915 403 HA ARG 78 HA ARG 78 -18.768 -4.139 -2.592 404 HB2 ARG 78 1HB ARG 78 -19.727 -1.348 -3.261 405 HB3 ARG 78 2HB ARG 78 -20.513 -2.838 -3.757 406 HG2 ARG 78 1HG ARG 78 -20.152 -1.908 -0.916 407 HG3 ARG 78 2HG ARG 78 -21.641 -1.804 -1.859 408 HD2 ARG 78 1HD ARG 78 -20.197 -4.328 -1.060 409 HD3 ARG 78 2HD ARG 78 -21.700 -3.723 -0.370 410 HE ARG 78 HE ARG 78 -21.704 -4.233 -3.234 411 HH11 ARG 78 1HH1 ARG 78 -22.511 -5.376 -0.030 412 HH12 ARG 78 2HH1 ARG 78 -23.630 -6.569 -0.600 413 HH21 ARG 78 1HH2 ARG 78 -23.176 -5.794 -3.989 414 HH22 ARG 78 2HH2 ARG 78 -24.004 -6.817 -2.857 415 H ASN 79 H ASN 79 -19.129 -4.465 -4.943 416 HA ASN 79 HA ASN 79 -18.433 -4.606 -7.097 417 HB2 ASN 79 1HB ASN 79 -17.364 -1.814 -6.614 418 HB3 ASN 79 2HB ASN 79 -17.533 -2.578 -8.189 419 HD21 ASN 79 1HD2 ASN 79 -20.704 -0.904 -6.326 420 HD22 ASN 79 2HD2 ASN 79 -19.148 -1.018 -5.571 421 H TYR 80 H TYR 80 -16.789 -5.570 -4.983 422 HA TYR 80 HA TYR 80 -14.050 -5.066 -5.803 423 HB2 TYR 80 1HB TYR 80 -13.451 -6.513 -3.902 424 HB3 TYR 80 2HB TYR 80 -14.554 -5.236 -3.401 425 HD1 TYR 80 HD1 TYR 80 -14.047 -8.809 -3.704 426 HD2 TYR 80 HD2 TYR 80 -16.940 -5.788 -2.924 427 HE1 TYR 80 HE1 TYR 80 -15.534 -10.496 -2.718 428 HE2 TYR 80 HE2 TYR 80 -18.438 -7.470 -1.936 429 HH TYR 80 HH TYR 80 -17.382 -10.658 -1.200 430 HA PRO 81 HA PRO 81 -13.891 -8.562 -8.525 431 HB2 PRO 81 1HB PRO 81 -11.219 -9.060 -8.452 432 HB3 PRO 81 2HB PRO 81 -11.925 -7.708 -9.344 433 HG2 PRO 81 1HG PRO 81 -10.621 -7.726 -6.653 434 HG3 PRO 81 2HG PRO 81 -10.456 -6.551 -7.970 435 HD2 PRO 81 1HD PRO 81 -12.034 -6.115 -5.813 436 HD3 PRO 81 2HD PRO 81 -12.417 -5.475 -7.424 437 H GLU 82 H GLU 82 -14.069 -10.721 -8.343 438 HA GLU 82 HA GLU 82 -14.107 -11.947 -5.800 439 HB2 GLU 82 1HB GLU 82 -14.059 -13.238 -8.532 440 HB3 GLU 82 2HB GLU 82 -14.523 -14.024 -7.030 441 HG2 GLU 82 1HG GLU 82 -16.445 -12.592 -6.822 442 HG3 GLU 82 2HG GLU 82 -15.954 -11.675 -8.246 443 H GLY 83 H GLY 83 -12.514 -12.852 -4.662 444 HA2 GLY 83 1HA GLY 83 -10.516 -13.966 -4.236 445 HA3 GLY 83 2HA GLY 83 -10.201 -14.008 -5.964 446 H GLY 84 H GLY 84 -10.958 -10.958 -5.644 447 HA2 GLY 84 1HA GLY 84 -9.870 -8.979 -5.146 448 HA3 GLY 84 2HA GLY 84 -8.642 -9.902 -4.295 449 H TYR 85 H TYR 85 -7.397 -8.142 -5.460 450 HA TYR 85 HA TYR 85 -6.787 -8.706 -8.237 451 HB2 TYR 85 1HB TYR 85 -5.425 -6.852 -6.262 452 HB3 TYR 85 2HB TYR 85 -5.132 -6.897 -7.998 453 HD1 TYR 85 HD1 TYR 85 -7.408 -5.806 -5.359 454 HD2 TYR 85 HD2 TYR 85 -6.796 -6.006 -9.562 455 HE1 TYR 85 HE1 TYR 85 -9.201 -4.164 -5.687 456 HE2 TYR 85 HE2 TYR 85 -8.593 -4.362 -9.904 457 HH TYR 85 HH TYR 85 -9.959 -2.570 -7.320 458 H ILE 86 H ILE 86 -5.540 -9.257 -5.048 459 HA ILE 86 HA ILE 86 -3.839 -11.376 -6.110 460 HB ILE 86 HB ILE 86 -2.254 -9.605 -5.749 461 HG12 ILE 86 1HG1 ILE 86 -2.151 -11.518 -3.409 462 HG13 ILE 86 2HG1 ILE 86 -1.572 -11.858 -5.034 463 HG21 ILE 86 1HG2 ILE 86 -3.426 -9.302 -2.990 464 HG22 ILE 86 2HG2 ILE 86 -3.546 -8.155 -4.325 465 HG23 ILE 86 3HG2 ILE 86 -1.982 -8.479 -3.581 466 HD11 ILE 86 1HD1 ILE 86 0.261 -11.309 -3.548 467 HD12 ILE 86 2HD1 ILE 86 -0.482 -9.752 -3.184 468 HD13 ILE 86 3HD1 ILE 86 0.095 -10.094 -4.815 469 H ARG 87 H ARG 87 -4.100 -13.224 -5.002 470 HA ARG 87 HA ARG 87 -6.356 -13.358 -3.302 471 HB2 ARG 87 1HB ARG 87 -4.380 -15.431 -4.210 472 HB3 ARG 87 2HB ARG 87 -5.720 -15.814 -3.136 473 HG2 ARG 87 1HG ARG 87 -7.274 -14.910 -4.847 474 HG3 ARG 87 2HG ARG 87 -5.897 -14.712 -5.928 475 HD2 ARG 87 1HD ARG 87 -5.486 -17.068 -5.943 476 HD3 ARG 87 2HD ARG 87 -6.687 -17.335 -4.681 477 HE ARG 87 HE ARG 87 -7.991 -16.111 -6.810 478 HH11 ARG 87 1HH1 ARG 87 -6.271 -19.102 -6.220 479 HH12 ARG 87 2HH1 ARG 87 -7.251 -20.030 -7.312 480 HH21 ARG 87 1HH2 ARG 87 -9.281 -17.328 -8.248 481 HH22 ARG 87 2HH2 ARG 87 -8.952 -19.016 -8.481 482 H ARG 88 H ARG 88 -3.027 -13.006 -2.586 483 HA ARG 88 HA ARG 88 -3.656 -13.417 0.256 484 HB2 ARG 88 1HB ARG 88 -1.199 -14.300 -1.250 485 HB3 ARG 88 2HB ARG 88 -1.202 -14.104 0.497 486 HG2 ARG 88 1HG ARG 88 -3.033 -15.937 -1.036 487 HG3 ARG 88 2HG ARG 88 -1.550 -16.432 -0.217 488 HD2 ARG 88 1HD ARG 88 -3.993 -15.219 1.069 489 HD3 ARG 88 2HD ARG 88 -3.485 -16.902 1.173 490 HE ARG 88 HE ARG 88 -1.349 -15.727 2.185 491 HH11 ARG 88 1HH1 ARG 88 -4.733 -15.022 2.782 492 HH12 ARG 88 2HH1 ARG 88 -4.457 -14.470 4.404 493 HH21 ARG 88 1HH2 ARG 88 -0.989 -14.997 4.312 494 HH22 ARG 88 2HH2 ARG 88 -2.330 -14.455 5.272 495 H LEU 89 H LEU 89 -2.332 -12.151 1.712 496 HA LEU 89 HA LEU 89 -2.140 -9.468 0.948 497 HB2 LEU 89 1HB LEU 89 -0.954 -10.958 3.284 498 HB3 LEU 89 2HB LEU 89 -0.768 -9.231 3.082 499 HG LEU 89 HG LEU 89 -2.520 -9.649 4.666 500 HD11 LEU 89 1HD1 LEU 89 -4.384 -8.475 3.631 501 HD12 LEU 89 2HD1 LEU 89 -3.699 -8.779 2.036 502 HD13 LEU 89 3HD1 LEU 89 -2.840 -7.752 3.182 503 HD21 LEU 89 1HD2 LEU 89 -3.125 -11.909 4.033 504 HD22 LEU 89 2HD2 LEU 89 -3.839 -11.317 2.533 505 HD23 LEU 89 3HD2 LEU 89 -4.554 -10.878 4.082 506 HA PRO 90 HA PRO 90 1.683 -9.637 -1.334 507 HB2 PRO 90 1HB PRO 90 2.054 -6.913 -1.417 508 HB3 PRO 90 2HB PRO 90 1.027 -7.811 -2.536 509 HG2 PRO 90 1HG PRO 90 0.268 -6.262 -0.098 510 HG3 PRO 90 2HG PRO 90 -0.549 -6.349 -1.669 511 HD2 PRO 90 1HD PRO 90 -1.431 -7.713 0.470 512 HD3 PRO 90 2HD PRO 90 -1.547 -8.377 -1.173 513 H GLN 91 H GLN 91 3.828 -9.503 -0.823 514 HA GLN 91 HA GLN 91 4.538 -8.412 1.802 515 HB2 GLN 91 1HB GLN 91 5.005 -11.256 0.879 516 HB3 GLN 91 2HB GLN 91 5.762 -10.542 2.296 517 HG2 GLN 91 1HG GLN 91 3.638 -10.284 3.373 518 HG3 GLN 91 2HG GLN 91 2.790 -10.805 1.918 519 HE21 GLN 91 1HE2 GLN 91 3.216 -13.557 4.473 520 HE22 GLN 91 2HE2 GLN 91 2.758 -11.889 4.634 521 H ASP 92 H ASP 92 6.617 -7.672 1.953 522 HA ASP 92 HA ASP 92 8.277 -7.201 -0.231 523 HB2 ASP 92 1HB ASP 92 9.256 -7.788 2.583 524 HB3 ASP 92 2HB ASP 92 10.069 -6.834 1.356 525 HA PRO 93 HA PRO 93 9.694 -11.162 -1.521 526 HB2 PRO 93 1HB PRO 93 12.361 -10.511 -2.031 527 HB3 PRO 93 2HB PRO 93 11.017 -10.346 -3.161 528 HG2 PRO 93 1HG PRO 93 12.297 -8.289 -1.426 529 HG3 PRO 93 2HG PRO 93 11.647 -8.129 -3.068 530 HD2 PRO 93 1HD PRO 93 10.306 -7.201 -0.947 531 HD3 PRO 93 2HD PRO 93 9.456 -7.953 -2.315 532 H TRP 94 H TRP 94 11.254 -9.525 1.097 533 HA TRP 94 HA TRP 94 12.898 -11.767 1.856 534 HB2 TRP 94 1HB TRP 94 12.243 -9.207 3.329 535 HB3 TRP 94 2HB TRP 94 13.448 -10.390 3.833 536 HD1 TRP 94 HD1 TRP 94 15.701 -10.549 2.366 537 HE1 TRP 94 HE1 TRP 94 16.824 -8.859 0.783 538 HE3 TRP 94 HE3 TRP 94 11.777 -7.370 1.660 539 HZ2 TRP 94 HZ2 TRP 94 16.131 -6.489 -0.589 540 HZ3 TRP 94 HZ3 TRP 94 12.080 -5.413 0.197 541 HH2 TRP 94 HH2 TRP 94 14.217 -4.983 -0.902 542 H GLY 95 H GLY 95 9.638 -10.905 2.280 543 HA2 GLY 95 1HA GLY 95 8.166 -12.617 3.147 544 HA3 GLY 95 2HA GLY 95 9.387 -12.995 4.350 545 H SER 96 H SER 96 8.589 -9.680 3.629 546 HA SER 96 HA SER 96 7.436 -9.446 6.320 547 HB2 SER 96 1HB SER 96 8.516 -7.238 4.552 548 HB3 SER 96 2HB SER 96 8.103 -7.126 6.262 549 HG SER 96 HG SER 96 10.443 -7.573 5.399 550 H ASP 97 H ASP 97 5.398 -8.560 6.623 551 HA ASP 97 HA ASP 97 3.711 -8.412 4.255 552 HB2 ASP 97 1HB ASP 97 3.035 -8.206 7.197 553 HB3 ASP 97 2HB ASP 97 1.853 -8.182 5.897 554 H TYR 98 H TYR 98 3.353 -6.561 3.235 555 HA TYR 98 HA TYR 98 4.392 -4.102 3.903 556 HB2 TYR 98 1HB TYR 98 1.994 -4.760 2.198 557 HB3 TYR 98 2HB TYR 98 2.677 -3.144 2.310 558 HD1 TYR 98 HD1 TYR 98 5.413 -3.237 1.973 559 HD2 TYR 98 HD2 TYR 98 2.568 -5.927 0.324 560 HE1 TYR 98 HE1 TYR 98 6.990 -3.792 0.167 561 HE2 TYR 98 HE2 TYR 98 4.139 -6.495 -1.478 562 HH TYR 98 HH TYR 98 6.138 -5.252 -2.623 563 H GLN 99 H GLN 99 3.585 -2.182 4.766 564 HA GLN 99 HA GLN 99 1.259 -2.561 6.530 565 HB2 GLN 99 1HB GLN 99 3.815 -1.064 7.125 566 HB3 GLN 99 2HB GLN 99 2.412 -1.135 8.183 567 HG2 GLN 99 1HG GLN 99 4.028 -3.514 7.309 568 HG3 GLN 99 2HG GLN 99 4.212 -2.674 8.847 569 HE21 GLN 99 1HE2 GLN 99 1.904 -5.690 8.965 570 HE22 GLN 99 2HE2 GLN 99 3.412 -5.446 8.149 571 H LEU 100 H LEU 100 -0.133 -0.913 6.792 572 HA LEU 100 HA LEU 100 0.345 1.570 5.277 573 HB2 LEU 100 1HB LEU 100 -1.414 0.365 4.162 574 HB3 LEU 100 2HB LEU 100 -2.219 0.033 5.688 575 HG LEU 100 HG LEU 100 -2.396 2.612 5.892 576 HD11 LEU 100 1HD1 LEU 100 -2.033 2.335 2.924 577 HD12 LEU 100 2HD1 LEU 100 -0.939 3.157 4.036 578 HD13 LEU 100 3HD1 LEU 100 -2.566 3.779 3.779 579 HD21 LEU 100 1HD2 LEU 100 -4.496 2.600 4.621 580 HD22 LEU 100 2HD2 LEU 100 -4.310 1.204 5.680 581 HD23 LEU 100 3HD2 LEU 100 -4.047 1.034 3.943 582 H LEU 101 H LEU 101 -0.123 3.482 6.342 583 HA LEU 101 HA LEU 101 -1.310 3.186 9.010 584 HB2 LEU 101 1HB LEU 101 1.221 3.577 8.938 585 HB3 LEU 101 2HB LEU 101 0.854 5.181 8.341 586 HG LEU 101 HG LEU 101 1.386 5.014 10.798 587 HD11 LEU 101 1HD1 LEU 101 -0.342 6.564 11.499 588 HD12 LEU 101 2HD1 LEU 101 -1.325 6.121 10.104 589 HD13 LEU 101 3HD1 LEU 101 0.218 6.942 9.870 590 HD21 LEU 101 1HD2 LEU 101 -0.362 4.231 12.299 591 HD22 LEU 101 2HD2 LEU 101 0.208 2.927 11.255 592 HD23 LEU 101 3HD2 LEU 101 -1.331 3.719 10.918 593 H SER 102 H SER 102 -3.244 4.067 8.895 594 HA SER 102 HA SER 102 -3.544 6.698 7.624 595 HB2 SER 102 1HB SER 102 -5.107 4.890 6.876 596 HB3 SER 102 2HB SER 102 -5.715 4.782 8.525 597 HG SER 102 HG SER 102 -6.451 6.462 6.591 598 HA PRO 103 HA PRO 103 -4.283 8.542 7.751 599 HB2 PRO 103 1HB PRO 103 -3.451 10.913 9.165 600 HB3 PRO 103 2HB PRO 103 -5.004 10.587 8.398 601 HG2 PRO 103 1HG PRO 103 -4.663 10.835 11.103 602 HG3 PRO 103 2HG PRO 103 -5.963 9.889 10.353 603 HD2 PRO 103 1HD PRO 103 -3.356 8.955 11.498 604 HD3 PRO 103 2HD PRO 103 -4.975 8.237 11.649 605 H GLY 104 H GLY 104 -2.622 9.100 6.416 606 HA2 GLY 104 1HA GLY 104 -0.127 7.968 6.988 607 HA3 GLY 104 2HA GLY 104 -0.498 8.959 5.589 608 H GLN 105 H GLN 105 1.942 8.874 6.978 609 HA GLN 105 HA GLN 105 2.219 11.119 8.717 610 HB2 GLN 105 1HB GLN 105 3.720 9.125 8.735 611 HB3 GLN 105 2HB GLN 105 4.339 9.616 7.167 612 HG2 GLN 105 1HG GLN 105 5.851 10.239 8.973 613 HG3 GLN 105 2HG GLN 105 5.235 11.654 8.123 614 HE21 GLN 105 1HE2 GLN 105 3.596 13.007 10.883 615 HE22 GLN 105 2HE2 GLN 105 3.842 13.053 9.170 616 H HIS 106 H HIS 106 2.288 10.618 5.290 617 HA HIS 106 HA HIS 106 3.365 13.337 4.902 618 HB2 HIS 106 1HB HIS 106 3.277 11.049 2.922 619 HB3 HIS 106 2HB HIS 106 3.990 12.632 2.641 620 HD1 HIS 106 HD1 HIS 106 6.239 13.152 3.921 621 HD2 HIS 106 HD2 HIS 106 4.882 9.236 4.247 622 HE1 HIS 106 HE1 HIS 106 8.197 11.824 4.773 623 HE2 HIS 106 HE2 HIS 106 7.407 9.432 4.764 624 H GLY 107 H GLY 107 0.684 11.201 4.329 625 HA2 GLY 107 1HA GLY 107 -0.850 13.485 3.323 626 HA3 GLY 107 2HA GLY 107 -0.765 12.059 2.304 627 H GLN 108 H GLN 108 -2.907 11.528 2.385 628 HA GLN 108 HA GLN 108 -4.371 11.400 4.842 629 HB2 GLN 108 1HB GLN 108 -5.447 11.841 2.653 630 HB3 GLN 108 2HB GLN 108 -5.029 10.215 2.136 631 HG2 GLN 108 1HG GLN 108 -7.348 10.326 2.806 632 HG3 GLN 108 2HG GLN 108 -6.439 9.286 3.900 633 HE21 GLN 108 1HE2 GLN 108 -6.965 11.251 6.731 634 HE22 GLN 108 2HE2 GLN 108 -6.104 9.933 6.011 635 H VAL 109 H VAL 109 -2.849 9.078 2.688 636 HA VAL 109 HA VAL 109 -2.728 7.136 4.868 637 HB VAL 109 HB VAL 109 -3.168 5.346 3.018 638 HG11 VAL 109 1HG1 VAL 109 -4.556 5.659 4.998 639 HG12 VAL 109 2HG1 VAL 109 -5.535 5.289 3.578 640 HG13 VAL 109 3HG1 VAL 109 -5.438 6.947 4.178 641 HG21 VAL 109 1HG2 VAL 109 -4.595 7.738 1.873 642 HG22 VAL 109 2HG2 VAL 109 -4.847 6.070 1.360 643 HG23 VAL 109 3HG2 VAL 109 -3.276 6.838 1.123 644 H ASP 110 H ASP 110 -0.746 6.280 5.037 645 HA ASP 110 HA ASP 110 1.032 6.551 2.708 646 HB2 ASP 110 1HB ASP 110 1.500 7.102 5.597 647 HB3 ASP 110 2HB ASP 110 2.841 6.447 4.659 648 H ILE 111 H ILE 111 1.870 4.808 1.903 649 HA ILE 111 HA ILE 111 1.699 2.286 3.403 650 HB ILE 111 HB ILE 111 2.124 1.281 1.068 651 HG12 ILE 111 1HG1 ILE 111 1.225 4.062 0.281 652 HG13 ILE 111 2HG1 ILE 111 2.803 3.355 -0.041 653 HG21 ILE 111 1HG2 ILE 111 -0.251 1.343 0.502 654 HG22 ILE 111 2HG2 ILE 111 -0.483 2.679 1.629 655 HG23 ILE 111 3HG2 ILE 111 0.002 1.092 2.230 656 HD11 ILE 111 1HD1 ILE 111 0.181 2.401 -1.160 657 HD12 ILE 111 2HD1 ILE 111 1.762 1.688 -1.482 658 HD13 ILE 111 3HD1 ILE 111 1.409 3.331 -2.018 659 H PHE 112 H PHE 112 3.529 1.150 3.839 660 HA PHE 112 HA PHE 112 6.017 1.976 2.569 661 HB2 PHE 112 1HB PHE 112 7.092 1.964 4.918 662 HB3 PHE 112 2HB PHE 112 6.198 3.390 4.409 663 HD1 PHE 112 HD1 PHE 112 6.265 0.530 6.686 664 HD2 PHE 112 HD2 PHE 112 4.076 3.954 5.422 665 HE1 PHE 112 HE1 PHE 112 4.886 0.396 8.719 666 HE2 PHE 112 HE2 PHE 112 2.693 3.824 7.450 667 HZ PHE 112 HZ PHE 112 3.098 2.045 9.104 668 H SER 113 H SER 113 7.668 0.492 2.647 669 HA SER 113 HA SER 113 6.773 -2.253 3.153 670 HB2 SER 113 1HB SER 113 9.137 -1.367 1.499 671 HB3 SER 113 2HB SER 113 8.301 -2.919 1.451 672 HG SER 113 HG SER 113 7.235 -0.400 0.674 673 H LEU 114 H LEU 114 8.231 -3.743 4.166 674 HA LEU 114 HA LEU 114 9.529 -2.346 6.370 675 HB2 LEU 114 1HB LEU 114 8.953 -5.287 6.050 676 HB3 LEU 114 2HB LEU 114 9.512 -4.498 7.505 677 HG LEU 114 HG LEU 114 7.227 -4.903 7.852 678 HD11 LEU 114 1HD1 LEU 114 7.470 -2.053 6.919 679 HD12 LEU 114 2HD1 LEU 114 7.905 -2.670 8.512 680 HD13 LEU 114 3HD1 LEU 114 6.222 -2.692 7.989 681 HD21 LEU 114 1HD2 LEU 114 6.712 -5.367 5.461 682 HD22 LEU 114 2HD2 LEU 114 6.578 -3.625 5.207 683 HD23 LEU 114 3HD2 LEU 114 5.475 -4.444 6.310 684 H GLY 115 H GLY 115 10.327 -4.168 3.585 685 HA2 GLY 115 1HA GLY 115 12.385 -4.531 2.629 686 HA3 GLY 115 2HA GLY 115 13.108 -3.620 3.946 687 HA PRO 116 HA PRO 116 14.462 -8.023 4.363 688 HB2 PRO 116 1HB PRO 116 16.998 -6.790 5.149 689 HB3 PRO 116 2HB PRO 116 16.671 -7.935 3.847 690 HG2 PRO 116 1HG PRO 116 17.310 -5.360 3.365 691 HG3 PRO 116 2HG PRO 116 16.206 -6.274 2.322 692 HD2 PRO 116 1HD PRO 116 15.568 -4.272 4.458 693 HD3 PRO 116 2HD PRO 116 14.841 -4.470 2.848 694 H ASP 117 H ASP 117 14.582 -5.241 6.405 695 HA ASP 117 HA ASP 117 15.431 -6.753 8.744 696 HB2 ASP 117 1HB ASP 117 15.171 -4.383 9.786 697 HB3 ASP 117 2HB ASP 117 16.502 -4.689 8.673 698 H GLY 118 H GLY 118 12.525 -5.712 7.288 699 HA2 GLY 118 1HA GLY 118 10.367 -6.218 7.908 700 HA3 GLY 118 2HA GLY 118 11.017 -7.055 9.304 701 H VAL 119 H VAL 119 12.189 -3.881 9.216 702 HA VAL 119 HA VAL 119 10.401 -3.285 11.441 703 HB VAL 119 HB VAL 119 11.977 -1.446 12.005 704 HG11 VAL 119 1HG1 VAL 119 12.141 -3.610 13.077 705 HG12 VAL 119 2HG1 VAL 119 13.746 -2.925 12.832 706 HG13 VAL 119 3HG1 VAL 119 13.161 -4.204 11.769 707 HG21 VAL 119 1HG2 VAL 119 14.190 -1.414 10.972 708 HG22 VAL 119 2HG2 VAL 119 12.929 -1.037 9.798 709 HG23 VAL 119 3HG2 VAL 119 13.669 -2.638 9.814 710 HA PRO 120 HA PRO 120 8.072 -0.536 8.856 711 HB2 PRO 120 1HB PRO 120 6.165 0.030 10.664 712 HB3 PRO 120 2HB PRO 120 6.251 -1.536 9.850 713 HG2 PRO 120 1HG PRO 120 7.172 -0.771 12.592 714 HG3 PRO 120 2HG PRO 120 6.312 -2.230 12.066 715 HD2 PRO 120 1HD PRO 120 9.007 -2.139 12.500 716 HD3 PRO 120 2HD PRO 120 8.234 -3.258 11.360 717 H GLU 121 H GLU 121 7.872 1.598 8.557 718 HA GLU 121 HA GLU 121 8.063 3.842 8.810 719 HB2 GLU 121 1HB GLU 121 7.936 3.235 11.767 720 HB3 GLU 121 2HB GLU 121 7.758 4.828 11.042 721 HG2 GLU 121 1HG GLU 121 5.734 4.140 9.929 722 HG3 GLU 121 2HG GLU 121 5.937 2.490 10.518 723 H SER 122 H SER 122 10.349 1.980 8.840 724 HA SER 122 HA SER 122 12.387 3.447 10.304 725 HB2 SER 122 1HB SER 122 13.755 1.510 9.087 726 HB3 SER 122 2HB SER 122 12.806 1.198 10.542 727 HG SER 122 HG SER 122 12.515 0.127 8.108 728 H ASN 123 H ASN 123 14.557 3.601 8.935 729 HA ASN 123 HA ASN 123 14.135 5.537 6.925 730 HB2 ASN 123 1HB ASN 123 16.190 5.489 8.233 731 HB3 ASN 123 2HB ASN 123 16.598 3.903 7.589 732 HD21 ASN 123 1HD2 ASN 123 18.621 5.545 5.306 733 HD22 ASN 123 2HD2 ASN 123 18.498 4.475 6.660 734 H ASP 124 H ASP 124 14.919 2.113 6.812 735 HA ASP 124 HA ASP 124 15.358 1.883 4.036 736 HB2 ASP 124 1HB ASP 124 15.285 -0.472 4.380 737 HB3 ASP 124 2HB ASP 124 15.960 0.203 5.863 738 H ASP 125 H ASP 125 12.486 2.256 5.855 739 HA ASP 125 HA ASP 125 10.725 0.548 4.540 740 HB2 ASP 125 1HB ASP 125 10.424 2.947 6.261 741 HB3 ASP 125 2HB ASP 125 9.017 2.422 5.344 742 H ILE 126 H ILE 126 10.494 0.487 2.466 743 HA ILE 126 HA ILE 126 10.687 2.764 0.750 744 HB ILE 126 HB ILE 126 9.726 -0.033 0.119 745 HG12 ILE 126 1HG1 ILE 126 12.482 1.173 -0.203 746 HG13 ILE 126 2HG1 ILE 126 12.020 0.064 1.084 747 HG21 ILE 126 1HG2 ILE 126 9.997 0.455 -2.152 748 HG22 ILE 126 2HG2 ILE 126 10.927 1.918 -1.816 749 HG23 ILE 126 3HG2 ILE 126 9.190 1.885 -1.493 750 HD11 ILE 126 1HD1 ILE 126 13.240 -1.058 -0.704 751 HD12 ILE 126 2HD1 ILE 126 11.997 -0.569 -1.857 752 HD13 ILE 126 3HD1 ILE 126 11.597 -1.679 -0.547 753 H GLY 127 H GLY 127 9.106 4.235 0.919 754 HA2 GLY 127 1HA GLY 127 6.317 3.267 0.858 755 HA3 GLY 127 2HA GLY 127 6.827 4.790 1.575 756 H ASN 128 H ASN 128 4.837 5.142 -0.051 757 HA ASN 128 HA ASN 128 5.546 5.371 -2.791 758 HB2 ASN 128 1HB ASN 128 3.488 6.835 -2.970 759 HB3 ASN 128 2HB ASN 128 3.225 5.200 -2.386 760 HD21 ASN 128 1HD2 ASN 128 1.153 6.830 -0.086 761 HD22 ASN 128 2HD2 ASN 128 1.225 5.982 -1.596 762 H TRP 129 H TRP 129 5.960 7.439 -0.038 763 HA TRP 129 HA TRP 129 6.648 9.774 -1.556 764 HB2 TRP 129 1HB TRP 129 5.910 9.830 0.840 765 HB3 TRP 129 2HB TRP 129 7.437 9.077 1.284 766 HD1 TRP 129 HD1 TRP 129 9.685 10.589 0.886 767 HE1 TRP 129 HE1 TRP 129 9.992 13.139 0.918 768 HE3 TRP 129 HE3 TRP 129 4.803 12.008 0.352 769 HZ2 TRP 129 HZ2 TRP 129 8.384 15.448 0.761 770 HZ3 TRP 129 HZ3 TRP 129 4.273 14.409 0.308 771 HH2 TRP 129 HH2 TRP 129 6.028 16.093 0.509 772 H THR 130 H THR 130 8.319 6.956 -0.386 773 HA THR 130 HA THR 130 10.967 7.890 -0.703 774 HB THR 130 HB THR 130 10.039 5.025 -0.956 775 HG1 THR 130 HG1 THR 130 10.531 6.595 1.382 776 HG21 THR 130 1HG2 THR 130 12.613 6.241 0.055 777 HG22 THR 130 2HG2 THR 130 12.395 5.421 -1.490 778 HG23 THR 130 3HG2 THR 130 12.234 4.520 0.017 779 H ILE 131 H ILE 131 8.822 5.991 -2.799 780 HA ILE 131 HA ILE 131 10.744 5.867 -4.906 781 HB ILE 131 HB ILE 131 9.217 4.039 -4.722 782 HG12 ILE 131 1HG1 ILE 131 8.199 4.000 -7.003 783 HG13 ILE 131 2HG1 ILE 131 8.610 5.702 -7.173 784 HG21 ILE 131 1HG2 ILE 131 6.784 4.319 -5.136 785 HG22 ILE 131 2HG2 ILE 131 7.019 6.065 -5.049 786 HG23 ILE 131 3HG2 ILE 131 7.354 5.058 -3.642 787 HD11 ILE 131 1HD1 ILE 131 10.974 5.153 -6.959 788 HD12 ILE 131 2HD1 ILE 131 10.224 4.284 -8.296 789 HD13 ILE 131 3HD1 ILE 131 10.563 3.447 -6.783 790 H GLY 132 H GLY 132 7.908 7.865 -4.238 791 HA2 GLY 132 1HA GLY 132 8.130 10.197 -4.993 792 HA3 GLY 132 2HA GLY 132 8.753 9.560 -6.506 793 H PHE 133 H PHE 133 6.031 8.103 -4.872 794 HA PHE 133 HA PHE 133 4.312 8.963 -7.089 795 HB2 PHE 133 1HB PHE 133 4.285 6.620 -5.234 796 HB3 PHE 133 2HB PHE 133 2.758 7.173 -5.907 797 HD1 PHE 133 HD1 PHE 133 2.412 7.150 -8.357 798 HD2 PHE 133 HD2 PHE 133 5.850 5.418 -6.551 799 HE1 PHE 133 HE1 PHE 133 2.839 5.868 -10.412 800 HE2 PHE 133 HE2 PHE 133 6.286 4.134 -8.602 801 HZ PHE 133 HZ PHE 133 4.779 4.357 -10.536 802 H HIS 134 H HIS 134 4.995 9.714 -3.889 803 HA HIS 134 HA HIS 134 2.261 10.331 -3.135 804 HB2 HIS 134 1HB HIS 134 4.128 9.400 -1.579 805 HB3 HIS 134 2HB HIS 134 4.668 11.075 -1.503 806 HD1 HIS 134 HD1 HIS 134 2.792 8.847 0.403 807 HD2 HIS 134 HD2 HIS 134 2.127 12.755 -0.848 808 HE1 HIS 134 HE1 HIS 134 1.038 9.764 1.950 809 HE2 HIS 134 HE2 HIS 134 0.475 12.025 0.997 810 H HIS 135 H HIS 135 2.006 11.845 -4.896 811 HA HIS 135 HA HIS 135 2.886 14.528 -4.085 812 HB2 HIS 135 1HB HIS 135 2.805 13.415 -6.897 813 HB3 HIS 135 2HB HIS 135 2.958 15.130 -6.532 814 HD1 HIS 135 HD1 HIS 135 4.955 12.216 -7.193 815 HD2 HIS 135 HD2 HIS 135 5.387 15.631 -4.865 816 HE1 HIS 135 HE1 HIS 135 7.418 12.408 -6.725 817 HE2 HIS 135 HE2 HIS 135 7.669 14.571 -5.458 818 H HIS 136 H HIS 136 1.454 16.058 -5.804 819 HA HIS 136 HA HIS 136 -0.585 17.005 -6.075 820 HB2 HIS 136 1HB HIS 136 -1.316 14.100 -6.377 821 HB3 HIS 136 2HB HIS 136 -2.529 15.368 -6.492 822 HD1 HIS 136 HD1 HIS 136 -0.014 13.589 -8.454 823 HD2 HIS 136 HD2 HIS 136 -2.044 17.210 -8.687 824 HE1 HIS 136 HE1 HIS 136 0.253 14.365 -10.832 825 HE2 HIS 136 HE2 HIS 136 -1.111 16.475 -10.982 826 H HIS 137 H HIS 137 0.349 16.585 -3.403 827 HA HIS 137 HA HIS 137 -2.207 16.920 -2.059 828 HB2 HIS 137 1HB HIS 137 -1.506 14.476 -1.844 829 HB3 HIS 137 2HB HIS 137 -0.159 15.047 -0.868 830 HD1 HIS 137 HD1 HIS 137 -3.762 14.273 -0.725 831 HD2 HIS 137 HD2 HIS 137 -0.940 16.175 1.664 832 HE1 HIS 137 HE1 HIS 137 -4.815 14.454 1.549 833 HE2 HIS 137 HE2 HIS 137 -3.097 15.608 2.983 834 H HIS 138 H HIS 138 -1.090 19.059 -2.416 835 HA HIS 138 HA HIS 138 0.350 19.694 0.049 836 HB2 HIS 138 1HB HIS 138 1.815 21.283 -1.143 837 HB3 HIS 138 2HB HIS 138 2.068 19.631 -1.685 838 HD1 HIS 138 HD1 HIS 138 1.446 22.991 -2.908 839 HD2 HIS 138 HD2 HIS 138 0.768 19.121 -4.290 840 HE1 HIS 138 HE1 HIS 138 1.066 23.203 -5.387 841 HE2 HIS 138 HE2 HIS 138 0.824 20.842 -6.220 842 H HIS 139 H HIS 139 -0.837 21.043 1.165 843 HA HIS 139 HA HIS 139 -3.059 22.423 0.025 844 HB2 HIS 139 1HB HIS 139 -1.820 22.437 2.771 845 HB3 HIS 139 2HB HIS 139 -3.175 23.480 2.360 846 HD1 HIS 139 HD1 HIS 139 -5.190 22.489 3.378 847 HD2 HIS 139 HD2 HIS 139 -2.724 19.591 1.712 848 HE1 HIS 139 HE1 HIS 139 -6.402 20.314 3.686 849 HE2 HIS 139 HE2 HIS 139 -4.806 18.560 2.844 850 H LYS 140 H LYS 140 0.227 23.164 0.404 851 HA LYS 140 HA LYS 140 -0.226 26.030 0.072 852 HB2 LYS 140 1HB LYS 140 1.483 25.310 1.695 853 HB3 LYS 140 2HB LYS 140 2.351 24.480 0.412 854 HG2 LYS 140 1HG LYS 140 2.760 26.599 -0.707 855 HG3 LYS 140 2HG LYS 140 1.856 27.448 0.547 856 HD2 LYS 140 1HD LYS 140 4.371 25.838 0.982 857 HD3 LYS 140 2HD LYS 140 4.283 27.599 0.899 858 HE2 LYS 140 1HE LYS 140 2.758 27.575 2.843 859 HE3 LYS 140 2HE LYS 140 2.951 25.827 2.943 860 HZ1 LYS 140 1HZ LYS 140 5.105 27.842 3.259 861 HZ2 LYS 140 2HZ LYS 140 5.328 26.167 3.303 862 HZ3 LYS 140 3HZ LYS 140 4.404 26.929 4.495 Start of MODEL 2 1 H1 MET 25 1H MET 25 23.939 -14.175 0.924 2 H2 MET 25 2H MET 25 25.196 -13.056 0.745 3 H3 MET 25 3H MET 25 24.968 -14.269 -0.408 4 HA MET 25 HA MET 25 22.835 -13.339 -1.014 5 HB2 MET 25 1HB MET 25 23.644 -11.165 0.926 6 HB3 MET 25 2HB MET 25 22.297 -11.053 -0.197 7 HG2 MET 25 1HG MET 25 22.570 -13.047 2.037 8 HG3 MET 25 2HG MET 25 21.544 -11.614 2.044 9 HE1 MET 25 1HE MET 25 19.462 -13.146 2.714 10 HE2 MET 25 2HE MET 25 20.503 -14.569 2.690 11 HE3 MET 25 3HE MET 25 18.978 -14.577 1.805 12 H GLY 26 H GLY 26 22.670 -11.459 -2.517 13 HA2 GLY 26 1HA GLY 26 25.328 -10.499 -3.349 14 HA3 GLY 26 2HA GLY 26 24.222 -11.207 -4.518 15 H ASN 27 H ASN 27 25.080 -8.764 -5.087 16 HA ASN 27 HA ASN 27 23.422 -6.709 -3.984 17 HB2 ASN 27 1HB ASN 27 25.358 -6.797 -6.287 18 HB3 ASN 27 2HB ASN 27 24.368 -5.377 -5.974 19 HD21 ASN 27 1HD2 ASN 27 27.091 -4.273 -4.103 20 HD22 ASN 27 2HD2 ASN 27 26.188 -4.131 -5.571 21 H LYS 28 H LYS 28 21.304 -6.926 -4.321 22 HA LYS 28 HA LYS 28 20.322 -6.826 -7.055 23 HB2 LYS 28 1HB LYS 28 18.648 -8.653 -6.535 24 HB3 LYS 28 2HB LYS 28 20.307 -9.178 -6.777 25 HG2 LYS 28 1HG LYS 28 20.611 -9.283 -4.338 26 HG3 LYS 28 2HG LYS 28 18.921 -8.823 -4.128 27 HD2 LYS 28 1HD LYS 28 19.756 -11.231 -5.725 28 HD3 LYS 28 2HD LYS 28 19.463 -11.303 -3.989 29 HE2 LYS 28 1HE LYS 28 17.457 -10.338 -6.021 30 HE3 LYS 28 2HE LYS 28 17.511 -11.976 -5.371 31 HZ1 LYS 28 1HZ LYS 28 17.219 -11.007 -3.139 32 HZ2 LYS 28 2HZ LYS 28 15.909 -10.701 -4.162 33 HZ3 LYS 28 3HZ LYS 28 17.026 -9.475 -3.838 34 H GLU 29 H GLU 29 20.408 -5.202 -4.507 35 HA GLU 29 HA GLU 29 17.862 -5.041 -3.345 36 HB2 GLU 29 1HB GLU 29 19.841 -4.008 -2.344 37 HB3 GLU 29 2HB GLU 29 19.947 -2.877 -3.686 38 HG2 GLU 29 1HG GLU 29 17.778 -1.930 -3.041 39 HG3 GLU 29 2HG GLU 29 17.711 -3.044 -1.678 40 H LYS 30 H LYS 30 19.220 -3.526 -6.216 41 HA LYS 30 HA LYS 30 17.133 -1.693 -6.672 42 HB2 LYS 30 1HB LYS 30 19.331 -1.557 -7.785 43 HB3 LYS 30 2HB LYS 30 18.950 -3.005 -8.701 44 HG2 LYS 30 1HG LYS 30 18.654 -0.936 -10.001 45 HG3 LYS 30 2HG LYS 30 17.162 -1.868 -9.851 46 HD2 LYS 30 1HD LYS 30 16.408 -0.394 -8.063 47 HD3 LYS 30 2HD LYS 30 17.912 0.521 -8.164 48 HE2 LYS 30 1HE LYS 30 15.971 0.214 -10.446 49 HE3 LYS 30 2HE LYS 30 15.949 1.564 -9.316 50 HZ1 LYS 30 1HZ LYS 30 18.195 2.127 -10.003 51 HZ2 LYS 30 2HZ LYS 30 17.141 2.124 -11.327 52 HZ3 LYS 30 3HZ LYS 30 18.209 0.836 -11.095 53 H ALA 31 H ALA 31 17.582 -5.060 -7.613 54 HA ALA 31 HA ALA 31 15.236 -5.221 -9.219 55 HB1 ALA 31 1HB ALA 31 17.062 -6.819 -9.463 56 HB2 ALA 31 2HB ALA 31 15.553 -7.644 -9.081 57 HB3 ALA 31 3HB ALA 31 16.772 -7.414 -7.828 58 H ASP 32 H ASP 32 15.959 -5.934 -5.830 59 HA ASP 32 HA ASP 32 13.482 -7.098 -5.182 60 HB2 ASP 32 1HB ASP 32 15.551 -5.707 -3.490 61 HB3 ASP 32 2HB ASP 32 14.082 -6.387 -2.799 62 H ARG 33 H ARG 33 14.606 -3.738 -4.869 63 HA ARG 33 HA ARG 33 12.233 -2.771 -3.709 64 HB2 ARG 33 1HB ARG 33 13.000 -0.530 -4.318 65 HB3 ARG 33 2HB ARG 33 14.287 -1.481 -3.595 66 HG2 ARG 33 1HG ARG 33 15.185 -1.915 -5.846 67 HG3 ARG 33 2HG ARG 33 13.925 -0.877 -6.521 68 HD2 ARG 33 1HD ARG 33 15.986 -0.017 -4.497 69 HD3 ARG 33 2HD ARG 33 16.083 0.293 -6.228 70 HE ARG 33 HE ARG 33 13.686 1.351 -5.530 71 HH11 ARG 33 1HH1 ARG 33 16.940 1.745 -4.316 72 HH12 ARG 33 2HH1 ARG 33 16.697 3.388 -3.822 73 HH21 ARG 33 1HH2 ARG 33 13.353 3.511 -4.888 74 HH22 ARG 33 2HH2 ARG 33 14.652 4.403 -4.161 75 H GLN 34 H GLN 34 13.163 -3.234 -7.067 76 HA GLN 34 HA GLN 34 11.036 -1.886 -8.287 77 HB2 GLN 34 1HB GLN 34 12.688 -4.255 -9.130 78 HB3 GLN 34 2HB GLN 34 11.419 -3.600 -10.156 79 HG2 GLN 34 1HG GLN 34 12.531 -1.523 -10.363 80 HG3 GLN 34 2HG GLN 34 13.673 -1.931 -9.085 81 HE21 GLN 34 1HE2 GLN 34 15.052 -2.392 -12.585 82 HE22 GLN 34 2HE2 GLN 34 14.092 -1.138 -11.883 83 H LYS 35 H LYS 35 11.247 -5.185 -7.009 84 HA LYS 35 HA LYS 35 8.616 -5.950 -7.784 85 HB2 LYS 35 1HB LYS 35 10.328 -7.000 -5.521 86 HB3 LYS 35 2HB LYS 35 8.871 -7.768 -6.139 87 HG2 LYS 35 1HG LYS 35 9.969 -8.025 -8.325 88 HG3 LYS 35 2HG LYS 35 11.441 -7.330 -7.644 89 HD2 LYS 35 1HD LYS 35 11.632 -9.725 -7.645 90 HD3 LYS 35 2HD LYS 35 11.474 -9.169 -5.981 91 HE2 LYS 35 1HE LYS 35 9.179 -9.836 -5.909 92 HE3 LYS 35 2HE LYS 35 9.173 -10.183 -7.637 93 HZ1 LYS 35 1HZ LYS 35 10.762 -11.965 -7.240 94 HZ2 LYS 35 2HZ LYS 35 9.349 -12.205 -6.343 95 HZ3 LYS 35 3HZ LYS 35 10.746 -11.636 -5.583 96 H VAL 36 H VAL 36 9.999 -4.405 -4.969 97 HA VAL 36 HA VAL 36 7.764 -4.376 -3.284 98 HB VAL 36 HB VAL 36 10.031 -2.396 -3.578 99 HG11 VAL 36 1HG1 VAL 36 8.040 -1.356 -2.530 100 HG12 VAL 36 2HG1 VAL 36 9.430 -1.463 -1.449 101 HG13 VAL 36 3HG1 VAL 36 8.092 -2.602 -1.282 102 HG21 VAL 36 1HG2 VAL 36 10.915 -3.497 -1.578 103 HG22 VAL 36 2HG2 VAL 36 10.723 -4.630 -2.916 104 HG23 VAL 36 3HG2 VAL 36 9.552 -4.616 -1.598 105 H VAL 37 H VAL 37 8.864 -2.047 -5.721 106 HA VAL 37 HA VAL 37 6.797 -0.186 -5.433 107 HB VAL 37 HB VAL 37 8.368 -0.870 -7.923 108 HG11 VAL 37 1HG1 VAL 37 7.758 1.382 -8.691 109 HG12 VAL 37 2HG1 VAL 37 6.717 1.570 -7.280 110 HG13 VAL 37 3HG1 VAL 37 6.344 0.346 -8.495 111 HG21 VAL 37 1HG2 VAL 37 9.754 1.045 -7.302 112 HG22 VAL 37 2HG2 VAL 37 9.779 -0.199 -6.052 113 HG23 VAL 37 3HG2 VAL 37 8.806 1.255 -5.831 114 H SER 38 H SER 38 6.984 -3.147 -7.350 115 HA SER 38 HA SER 38 4.670 -2.753 -8.887 116 HB2 SER 38 1HB SER 38 6.387 -4.495 -9.341 117 HB3 SER 38 2HB SER 38 5.820 -5.387 -7.931 118 HG SER 38 HG SER 38 4.141 -6.062 -9.022 119 H ASP 39 H ASP 39 5.095 -4.438 -5.768 120 HA ASP 39 HA ASP 39 2.311 -4.963 -5.463 121 HB2 ASP 39 1HB ASP 39 4.638 -5.034 -3.556 122 HB3 ASP 39 2HB ASP 39 2.990 -5.308 -3.001 123 H LEU 40 H LEU 40 4.440 -2.357 -4.522 124 HA LEU 40 HA LEU 40 2.741 -1.002 -2.749 125 HB2 LEU 40 1HB LEU 40 5.228 -0.632 -3.231 126 HB3 LEU 40 2HB LEU 40 4.710 0.325 -4.603 127 HG LEU 40 HG LEU 40 3.435 1.780 -2.980 128 HD11 LEU 40 1HD1 LEU 40 4.152 1.691 -0.632 129 HD12 LEU 40 2HD1 LEU 40 5.059 0.218 -0.976 130 HD13 LEU 40 3HD1 LEU 40 3.302 0.226 -1.122 131 HD21 LEU 40 1HD2 LEU 40 5.432 2.996 -2.263 132 HD22 LEU 40 2HD2 LEU 40 5.568 2.460 -3.937 133 HD23 LEU 40 3HD2 LEU 40 6.428 1.597 -2.663 134 H VAL 41 H VAL 41 3.181 -0.616 -6.274 135 HA VAL 41 HA VAL 41 1.253 1.432 -6.540 136 HB VAL 41 HB VAL 41 1.243 1.007 -8.932 137 HG11 VAL 41 1HG1 VAL 41 3.075 2.298 -8.012 138 HG12 VAL 41 2HG1 VAL 41 3.623 1.341 -9.389 139 HG13 VAL 41 3HG1 VAL 41 4.004 0.823 -7.746 140 HG21 VAL 41 1HG2 VAL 41 1.261 -1.431 -8.911 141 HG22 VAL 41 2HG2 VAL 41 2.928 -1.418 -8.335 142 HG23 VAL 41 3HG2 VAL 41 2.543 -0.787 -9.936 143 H ALA 42 H ALA 42 1.013 -2.088 -6.623 144 HA ALA 42 HA ALA 42 -1.691 -2.285 -7.367 145 HB1 ALA 42 1HB ALA 42 -1.659 -4.464 -6.225 146 HB2 ALA 42 2HB ALA 42 -0.101 -4.053 -5.507 147 HB3 ALA 42 3HB ALA 42 -0.245 -4.237 -7.255 148 H LEU 43 H LEU 43 -0.156 -1.828 -4.201 149 HA LEU 43 HA LEU 43 -2.483 -1.722 -2.633 150 HB2 LEU 43 1HB LEU 43 0.150 -0.276 -2.310 151 HB3 LEU 43 2HB LEU 43 -1.102 -0.308 -1.085 152 HG LEU 43 HG LEU 43 0.364 -2.736 -2.119 153 HD11 LEU 43 1HD1 LEU 43 1.393 -2.709 0.141 154 HD12 LEU 43 2HD1 LEU 43 0.661 -1.126 0.407 155 HD13 LEU 43 3HD1 LEU 43 1.861 -1.338 -0.865 156 HD21 LEU 43 1HD2 LEU 43 -1.529 -2.428 0.209 157 HD22 LEU 43 2HD2 LEU 43 -0.705 -3.905 -0.290 158 HD23 LEU 43 3HD2 LEU 43 -1.930 -3.184 -1.331 159 H GLU 44 H GLU 44 -0.676 0.845 -4.273 160 HA GLU 44 HA GLU 44 -2.240 3.035 -3.604 161 HB2 GLU 44 1HB GLU 44 -0.701 2.384 -6.122 162 HB3 GLU 44 2HB GLU 44 -1.456 3.948 -5.849 163 HG2 GLU 44 1HG GLU 44 0.478 2.812 -3.873 164 HG3 GLU 44 2HG GLU 44 1.035 3.664 -5.314 165 H GLY 45 H GLY 45 -2.635 0.718 -6.250 166 HA2 GLY 45 1HA GLY 45 -4.832 1.996 -7.483 167 HA3 GLY 45 2HA GLY 45 -4.395 0.302 -7.665 168 H ALA 46 H ALA 46 -4.709 -0.731 -5.196 169 HA ALA 46 HA ALA 46 -7.485 -1.108 -5.020 170 HB1 ALA 46 1HB ALA 46 -5.395 -1.694 -2.924 171 HB2 ALA 46 2HB ALA 46 -5.841 -2.760 -4.257 172 HB3 ALA 46 3HB ALA 46 -7.019 -2.381 -3.000 173 H LEU 47 H LEU 47 -5.279 0.945 -3.207 174 HA LEU 47 HA LEU 47 -7.065 1.851 -1.248 175 HB2 LEU 47 1HB LEU 47 -4.468 2.743 -2.362 176 HB3 LEU 47 2HB LEU 47 -5.419 3.975 -1.552 177 HG LEU 47 HG LEU 47 -5.346 2.814 0.524 178 HD11 LEU 47 1HD1 LEU 47 -5.714 0.549 -0.222 179 HD12 LEU 47 2HD1 LEU 47 -4.269 0.621 0.786 180 HD13 LEU 47 3HD1 LEU 47 -4.115 0.504 -0.968 181 HD21 LEU 47 1HD2 LEU 47 -3.340 4.061 -0.019 182 HD22 LEU 47 2HD2 LEU 47 -2.654 2.645 -0.815 183 HD23 LEU 47 3HD2 LEU 47 -2.936 2.627 0.925 184 H ASP 48 H ASP 48 -6.215 3.283 -4.391 185 HA ASP 48 HA ASP 48 -8.014 5.471 -4.063 186 HB2 ASP 48 1HB ASP 48 -5.949 5.352 -5.594 187 HB3 ASP 48 2HB ASP 48 -6.997 4.497 -6.723 188 H MET 49 H MET 49 -8.260 2.269 -5.465 189 HA MET 49 HA MET 49 -10.745 2.645 -6.760 190 HB2 MET 49 1HB MET 49 -9.412 0.142 -5.718 191 HB3 MET 49 2HB MET 49 -10.934 0.129 -6.601 192 HG2 MET 49 1HG MET 49 -9.855 1.087 -8.539 193 HG3 MET 49 2HG MET 49 -8.333 1.215 -7.658 194 HE1 MET 49 1HE MET 49 -7.438 -1.609 -10.149 195 HE2 MET 49 2HE MET 49 -6.945 -0.076 -9.429 196 HE3 MET 49 3HE MET 49 -8.375 -0.148 -10.457 197 H TYR 50 H TYR 50 -9.902 1.481 -3.517 198 HA TYR 50 HA TYR 50 -12.529 1.067 -2.616 199 HB2 TYR 50 1HB TYR 50 -10.667 0.245 -1.310 200 HB3 TYR 50 2HB TYR 50 -10.040 1.877 -1.094 201 HD1 TYR 50 HD1 TYR 50 -10.879 3.299 0.605 202 HD2 TYR 50 HD2 TYR 50 -12.771 -0.432 -0.139 203 HE1 TYR 50 HE1 TYR 50 -12.166 3.552 2.674 204 HE2 TYR 50 HE2 TYR 50 -14.071 -0.191 1.938 205 HH TYR 50 HH TYR 50 -14.132 0.976 3.956 206 H LYS 51 H LYS 51 -10.501 3.950 -2.740 207 HA LYS 51 HA LYS 51 -12.282 5.682 -1.401 208 HB2 LYS 51 1HB LYS 51 -9.936 6.276 -1.772 209 HB3 LYS 51 2HB LYS 51 -10.216 6.337 -3.509 210 HG2 LYS 51 1HG LYS 51 -11.814 8.167 -3.171 211 HG3 LYS 51 2HG LYS 51 -11.480 8.124 -1.441 212 HD2 LYS 51 1HD LYS 51 -9.171 8.722 -1.844 213 HD3 LYS 51 2HD LYS 51 -9.439 8.668 -3.586 214 HE2 LYS 51 1HE LYS 51 -10.817 10.534 -1.661 215 HE3 LYS 51 2HE LYS 51 -9.460 10.966 -2.704 216 HZ1 LYS 51 1HZ LYS 51 -10.820 10.521 -4.633 217 HZ2 LYS 51 2HZ LYS 51 -11.607 11.635 -3.631 218 HZ3 LYS 51 3HZ LYS 51 -12.110 10.024 -3.662 219 H LEU 52 H LEU 52 -12.092 4.621 -4.749 220 HA LEU 52 HA LEU 52 -13.914 6.520 -5.775 221 HB2 LEU 52 1HB LEU 52 -12.430 5.129 -7.181 222 HB3 LEU 52 2HB LEU 52 -13.364 3.711 -6.743 223 HG LEU 52 HG LEU 52 -15.347 4.711 -7.844 224 HD11 LEU 52 1HD1 LEU 52 -15.029 6.643 -9.323 225 HD12 LEU 52 2HD1 LEU 52 -13.392 6.840 -8.698 226 HD13 LEU 52 3HD1 LEU 52 -14.776 7.059 -7.628 227 HD21 LEU 52 1HD2 LEU 52 -12.901 4.485 -9.593 228 HD22 LEU 52 2HD2 LEU 52 -14.576 4.368 -10.135 229 HD23 LEU 52 3HD2 LEU 52 -13.913 3.147 -9.049 230 H ASP 53 H ASP 53 -14.308 3.335 -4.332 231 HA ASP 53 HA ASP 53 -17.129 3.214 -4.812 232 HB2 ASP 53 1HB ASP 53 -15.730 1.190 -4.660 233 HB3 ASP 53 2HB ASP 53 -15.423 1.539 -2.962 234 H ASN 54 H ASN 54 -15.136 3.913 -1.937 235 HA ASN 54 HA ASN 54 -17.626 4.504 -0.461 236 HB2 ASN 54 1HB ASN 54 -14.945 3.529 0.511 237 HB3 ASN 54 2HB ASN 54 -16.168 4.172 1.600 238 HD21 ASN 54 1HD2 ASN 54 -16.522 0.467 0.024 239 HD22 ASN 54 2HD2 ASN 54 -15.276 1.553 -0.475 240 H SER 55 H SER 55 -15.637 6.208 -2.137 241 HA SER 55 HA SER 55 -14.789 8.299 -2.160 242 HB2 SER 55 1HB SER 55 -16.197 10.016 -0.974 243 HB3 SER 55 2HB SER 55 -17.060 8.961 -2.086 244 HG SER 55 HG SER 55 -16.958 8.003 0.489 245 H ARG 56 H ARG 56 -13.432 6.619 -0.270 246 HA ARG 56 HA ARG 56 -11.966 8.645 1.087 247 HB2 ARG 56 1HB ARG 56 -12.418 8.116 3.357 248 HB3 ARG 56 2HB ARG 56 -13.985 8.299 2.588 249 HG2 ARG 56 1HG ARG 56 -14.494 6.367 3.591 250 HG3 ARG 56 2HG ARG 56 -13.516 5.609 2.328 251 HD2 ARG 56 1HD ARG 56 -11.537 5.825 3.783 252 HD3 ARG 56 2HD ARG 56 -12.564 6.495 5.045 253 HE ARG 56 HE ARG 56 -13.239 3.841 4.038 254 HH11 ARG 56 1HH1 ARG 56 -11.880 5.835 6.574 255 HH12 ARG 56 2HH1 ARG 56 -11.828 4.544 7.733 256 HH21 ARG 56 1HH2 ARG 56 -13.118 2.131 5.536 257 HH22 ARG 56 2HH2 ARG 56 -12.509 2.437 7.139 258 H TYR 57 H TYR 57 -10.024 7.774 2.109 259 HA TYR 57 HA TYR 57 -9.126 5.383 0.747 260 HB2 TYR 57 1HB TYR 57 -7.765 7.490 2.397 261 HB3 TYR 57 2HB TYR 57 -6.939 5.982 2.014 262 HD1 TYR 57 HD1 TYR 57 -7.450 9.276 0.954 263 HD2 TYR 57 HD2 TYR 57 -7.075 5.317 -0.556 264 HE1 TYR 57 HE1 TYR 57 -6.818 10.176 -1.247 265 HE2 TYR 57 HE2 TYR 57 -6.439 6.205 -2.754 266 HH TYR 57 HH TYR 57 -6.720 8.257 -4.061 267 HA PRO 58 HA PRO 58 -10.007 2.554 3.907 268 HB2 PRO 58 1HB PRO 58 -8.165 0.632 3.421 269 HB3 PRO 58 2HB PRO 58 -9.539 0.931 2.349 270 HG2 PRO 58 1HG PRO 58 -6.701 1.858 2.088 271 HG3 PRO 58 2HG PRO 58 -7.770 1.172 0.847 272 HD2 PRO 58 1HD PRO 58 -7.337 3.827 1.071 273 HD3 PRO 58 2HD PRO 58 -8.895 3.164 0.541 274 H THR 59 H THR 59 -9.482 1.988 5.941 275 HA THR 59 HA THR 59 -7.330 3.367 7.208 276 HB THR 59 HB THR 59 -8.231 2.010 9.234 277 HG1 THR 59 HG1 THR 59 -10.173 1.034 8.920 278 HG21 THR 59 1HG2 THR 59 -10.081 3.603 9.498 279 HG22 THR 59 2HG2 THR 59 -9.961 4.021 7.789 280 HG23 THR 59 3HG2 THR 59 -8.632 4.398 8.885 281 H THR 60 H THR 60 -6.217 1.938 9.072 282 HA THR 60 HA THR 60 -4.123 0.725 7.792 283 HB THR 60 HB THR 60 -3.963 1.573 10.063 284 HG1 THR 60 HG1 THR 60 -2.464 -0.052 9.331 285 HG21 THR 60 1HG2 THR 60 -6.109 0.832 10.949 286 HG22 THR 60 2HG2 THR 60 -4.789 0.273 11.977 287 HG23 THR 60 3HG2 THR 60 -5.579 -0.849 10.868 288 H GLU 61 H GLU 61 -6.969 -0.929 9.162 289 HA GLU 61 HA GLU 61 -5.930 -3.529 8.541 290 HB2 GLU 61 1HB GLU 61 -7.585 -3.078 10.363 291 HB3 GLU 61 2HB GLU 61 -8.787 -2.741 9.126 292 HG2 GLU 61 1HG GLU 61 -9.074 -4.978 9.947 293 HG3 GLU 61 2HG GLU 61 -8.520 -5.030 8.273 294 H GLN 62 H GLN 62 -8.236 -1.306 7.078 295 HA GLN 62 HA GLN 62 -9.199 -3.186 5.171 296 HB2 GLN 62 1HB GLN 62 -9.509 -0.184 5.270 297 HB3 GLN 62 2HB GLN 62 -10.426 -1.270 4.234 298 HG2 GLN 62 1HG GLN 62 -11.337 -2.370 6.238 299 HG3 GLN 62 2HG GLN 62 -10.463 -1.218 7.244 300 HE21 GLN 62 1HE2 GLN 62 -13.466 0.557 7.279 301 HE22 GLN 62 2HE2 GLN 62 -12.348 -0.425 8.157 302 H GLY 63 H GLY 63 -6.600 -0.874 5.180 303 HA2 GLY 63 1HA GLY 63 -6.425 -0.412 2.403 304 HA3 GLY 63 2HA GLY 63 -5.125 -0.189 3.560 305 H LEU 64 H LEU 64 -4.590 -2.691 4.436 306 HA LEU 64 HA LEU 64 -3.185 -3.791 2.219 307 HB2 LEU 64 1HB LEU 64 -3.574 -4.795 5.012 308 HB3 LEU 64 2HB LEU 64 -2.576 -5.613 3.835 309 HG LEU 64 HG LEU 64 -0.928 -4.426 4.768 310 HD11 LEU 64 1HD1 LEU 64 -2.194 -2.180 3.247 311 HD12 LEU 64 2HD1 LEU 64 -1.127 -3.411 2.572 312 HD13 LEU 64 3HD1 LEU 64 -0.511 -2.265 3.764 313 HD21 LEU 64 1HD2 LEU 64 -2.960 -2.404 5.682 314 HD22 LEU 64 2HD2 LEU 64 -1.247 -2.391 6.100 315 HD23 LEU 64 3HD2 LEU 64 -2.276 -3.714 6.643 316 H GLN 65 H GLN 65 -6.178 -4.510 3.818 317 HA GLN 65 HA GLN 65 -6.563 -7.092 2.681 318 HB2 GLN 65 1HB GLN 65 -8.452 -5.131 3.975 319 HB3 GLN 65 2HB GLN 65 -8.964 -6.709 3.395 320 HG2 GLN 65 1HG GLN 65 -6.822 -6.256 5.460 321 HG3 GLN 65 2HG GLN 65 -8.504 -6.641 5.821 322 HE21 GLN 65 1HE2 GLN 65 -5.911 -9.517 4.633 323 HE22 GLN 65 2HE2 GLN 65 -5.476 -7.841 4.638 324 H ALA 66 H ALA 66 -6.922 -3.917 1.447 325 HA ALA 66 HA ALA 66 -9.316 -4.104 0.038 326 HB1 ALA 66 1HB ALA 66 -6.934 -2.394 -0.645 327 HB2 ALA 66 2HB ALA 66 -8.173 -2.000 0.546 328 HB3 ALA 66 3HB ALA 66 -8.599 -2.130 -1.161 329 H LEU 67 H LEU 67 -6.085 -5.132 -0.973 330 HA LEU 67 HA LEU 67 -7.191 -5.748 -3.608 331 HB2 LEU 67 1HB LEU 67 -4.713 -6.505 -4.001 332 HB3 LEU 67 2HB LEU 67 -5.203 -4.833 -4.139 333 HG LEU 67 HG LEU 67 -4.218 -4.314 -1.991 334 HD11 LEU 67 1HD1 LEU 67 -2.991 -5.983 -0.696 335 HD12 LEU 67 2HD1 LEU 67 -3.534 -7.244 -1.802 336 HD13 LEU 67 3HD1 LEU 67 -4.704 -6.386 -0.802 337 HD21 LEU 67 1HD2 LEU 67 -2.390 -5.998 -3.697 338 HD22 LEU 67 2HD2 LEU 67 -1.873 -4.799 -2.509 339 HD23 LEU 67 3HD2 LEU 67 -2.765 -4.290 -3.943 340 H VAL 68 H VAL 68 -6.975 -7.291 -0.731 341 HA VAL 68 HA VAL 68 -6.466 -9.924 -1.942 342 HB VAL 68 HB VAL 68 -6.612 -9.137 0.974 343 HG11 VAL 68 1HG1 VAL 68 -5.933 -11.802 -0.269 344 HG12 VAL 68 2HG1 VAL 68 -7.402 -11.422 0.630 345 HG13 VAL 68 3HG1 VAL 68 -5.841 -11.412 1.449 346 HG21 VAL 68 1HG2 VAL 68 -4.214 -9.618 1.008 347 HG22 VAL 68 2HG2 VAL 68 -4.599 -8.318 -0.120 348 HG23 VAL 68 3HG2 VAL 68 -4.256 -9.938 -0.726 349 H SER 69 H SER 69 -8.622 -8.534 0.522 350 HA SER 69 HA SER 69 -10.880 -9.975 -0.648 351 HB2 SER 69 1HB SER 69 -10.144 -10.054 2.287 352 HB3 SER 69 2HB SER 69 -11.597 -10.753 1.576 353 HG SER 69 HG SER 69 -9.713 -11.797 0.182 354 H ALA 70 H ALA 70 -12.823 -8.865 -0.441 355 HA ALA 70 HA ALA 70 -12.771 -6.105 -0.003 356 HB1 ALA 70 1HB ALA 70 -15.119 -7.989 0.166 357 HB2 ALA 70 2HB ALA 70 -14.536 -7.178 -1.287 358 HB3 ALA 70 3HB ALA 70 -15.224 -6.234 0.035 359 HA PRO 71 HA PRO 71 -12.284 -6.057 4.418 360 HB2 PRO 71 1HB PRO 71 -13.338 -3.300 4.085 361 HB3 PRO 71 2HB PRO 71 -11.864 -3.852 4.886 362 HG2 PRO 71 1HG PRO 71 -11.764 -2.656 2.506 363 HG3 PRO 71 2HG PRO 71 -10.684 -4.007 2.901 364 HD2 PRO 71 1HD PRO 71 -13.135 -3.972 1.196 365 HD3 PRO 71 2HD PRO 71 -11.625 -4.883 0.990 366 H SER 72 H SER 72 -13.614 -6.599 6.000 367 HA SER 72 HA SER 72 -16.483 -6.401 5.582 368 HB2 SER 72 1HB SER 72 -14.941 -7.721 7.829 369 HB3 SER 72 2HB SER 72 -16.654 -7.927 7.466 370 HG SER 72 HG SER 72 -15.931 -9.558 6.340 371 H ALA 73 H ALA 73 -14.041 -4.643 7.016 372 HA ALA 73 HA ALA 73 -15.558 -3.511 9.180 373 HB1 ALA 73 1HB ALA 73 -13.121 -3.634 9.309 374 HB2 ALA 73 2HB ALA 73 -13.672 -1.961 9.396 375 HB3 ALA 73 3HB ALA 73 -12.984 -2.586 7.897 376 H GLU 74 H GLU 74 -16.907 -1.846 9.072 377 HA GLU 74 HA GLU 74 -17.681 -0.770 6.538 378 HB2 GLU 74 1HB GLU 74 -19.210 -1.272 8.469 379 HB3 GLU 74 2HB GLU 74 -18.509 0.096 9.313 380 HG2 GLU 74 1HG GLU 74 -19.364 1.615 7.661 381 HG3 GLU 74 2HG GLU 74 -19.951 0.270 6.684 382 HA PRO 75 HA PRO 75 -18.539 1.174 5.529 383 HB2 PRO 75 1HB PRO 75 -16.767 2.417 3.552 384 HB3 PRO 75 2HB PRO 75 -18.375 2.911 4.084 385 HG2 PRO 75 1HG PRO 75 -16.176 4.308 4.740 386 HG3 PRO 75 2HG PRO 75 -17.559 4.160 5.842 387 HD2 PRO 75 1HD PRO 75 -14.957 2.671 5.856 388 HD3 PRO 75 2HD PRO 75 -15.852 3.382 7.215 389 H HIS 76 H HIS 76 -18.915 -0.367 4.055 390 HA HIS 76 HA HIS 76 -16.828 -2.353 3.712 391 HB2 HIS 76 1HB HIS 76 -19.277 -2.759 4.440 392 HB3 HIS 76 2HB HIS 76 -19.672 -2.562 2.739 393 HD1 HIS 76 HD1 HIS 76 -18.778 -5.058 5.156 394 HD2 HIS 76 HD2 HIS 76 -18.190 -4.547 1.072 395 HE1 HIS 76 HE1 HIS 76 -18.235 -7.343 4.260 396 HE2 HIS 76 HE2 HIS 76 -17.998 -7.030 1.773 397 H ALA 77 H ALA 77 -15.877 -2.898 1.801 398 HA ALA 77 HA ALA 77 -16.153 -1.146 -0.448 399 HB1 ALA 77 1HB ALA 77 -14.440 -2.493 -1.490 400 HB2 ALA 77 2HB ALA 77 -14.644 -3.750 -0.270 401 HB3 ALA 77 3HB ALA 77 -13.999 -2.173 0.189 402 H ARG 78 H ARG 78 -17.563 -1.297 -2.051 403 HA ARG 78 HA ARG 78 -18.973 -3.855 -2.432 404 HB2 ARG 78 1HB ARG 78 -19.762 -1.102 -3.402 405 HB3 ARG 78 2HB ARG 78 -20.730 -2.563 -3.510 406 HG2 ARG 78 1HG ARG 78 -19.897 -1.187 -0.967 407 HG3 ARG 78 2HG ARG 78 -21.493 -1.110 -1.713 408 HD2 ARG 78 1HD ARG 78 -21.741 -3.528 -1.414 409 HD3 ARG 78 2HD ARG 78 -20.144 -3.595 -0.668 410 HE ARG 78 HE ARG 78 -21.779 -1.726 0.683 411 HH11 ARG 78 1HH1 ARG 78 -21.291 -5.169 0.301 412 HH12 ARG 78 2HH1 ARG 78 -21.965 -5.561 1.852 413 HH21 ARG 78 1HH2 ARG 78 -22.638 -2.241 2.732 414 HH22 ARG 78 2HH2 ARG 78 -22.733 -3.901 3.231 415 H ASN 79 H ASN 79 -19.417 -4.564 -4.579 416 HA ASN 79 HA ASN 79 -18.838 -5.159 -6.688 417 HB2 ASN 79 1HB ASN 79 -18.000 -2.256 -6.879 418 HB3 ASN 79 2HB ASN 79 -18.115 -3.355 -8.250 419 HD21 ASN 79 1HD2 ASN 79 -21.409 -1.631 -6.661 420 HD22 ASN 79 2HD2 ASN 79 -19.846 -1.457 -5.944 421 H TYR 80 H TYR 80 -17.107 -6.037 -4.912 422 HA TYR 80 HA TYR 80 -14.410 -5.255 -5.694 423 HB2 TYR 80 1HB TYR 80 -13.659 -6.607 -3.834 424 HB3 TYR 80 2HB TYR 80 -14.988 -5.591 -3.284 425 HD1 TYR 80 HD1 TYR 80 -17.268 -6.628 -2.986 426 HD2 TYR 80 HD2 TYR 80 -13.785 -8.959 -3.714 427 HE1 TYR 80 HE1 TYR 80 -18.432 -8.624 -2.142 428 HE2 TYR 80 HE2 TYR 80 -14.939 -10.957 -2.875 429 HH TYR 80 HH TYR 80 -18.238 -11.135 -2.438 430 HA PRO 81 HA PRO 81 -13.968 -8.690 -8.480 431 HB2 PRO 81 1HB PRO 81 -11.261 -8.948 -8.417 432 HB3 PRO 81 2HB PRO 81 -12.085 -7.656 -9.296 433 HG2 PRO 81 1HG PRO 81 -10.781 -7.583 -6.608 434 HG3 PRO 81 2HG PRO 81 -10.720 -6.386 -7.915 435 HD2 PRO 81 1HD PRO 81 -12.329 -6.107 -5.754 436 HD3 PRO 81 2HD PRO 81 -12.771 -5.493 -7.360 437 H GLU 82 H GLU 82 -14.000 -10.874 -8.264 438 HA GLU 82 HA GLU 82 -13.838 -12.043 -5.699 439 HB2 GLU 82 1HB GLU 82 -13.846 -13.388 -8.409 440 HB3 GLU 82 2HB GLU 82 -14.061 -14.215 -6.875 441 HG2 GLU 82 1HG GLU 82 -16.219 -13.975 -7.697 442 HG3 GLU 82 2HG GLU 82 -16.062 -12.666 -6.527 443 H GLY 83 H GLY 83 -12.161 -12.786 -4.592 444 HA2 GLY 83 1HA GLY 83 -10.079 -13.723 -4.174 445 HA3 GLY 83 2HA GLY 83 -9.813 -13.833 -5.908 446 H GLY 84 H GLY 84 -10.844 -10.769 -5.289 447 HA2 GLY 84 1HA GLY 84 -9.820 -8.726 -5.158 448 HA3 GLY 84 2HA GLY 84 -8.536 -9.512 -4.252 449 H TYR 85 H TYR 85 -7.008 -8.212 -5.298 450 HA TYR 85 HA TYR 85 -6.537 -8.838 -8.124 451 HB2 TYR 85 1HB TYR 85 -5.383 -6.686 -6.333 452 HB3 TYR 85 2HB TYR 85 -4.843 -6.981 -7.985 453 HD1 TYR 85 HD1 TYR 85 -6.749 -6.993 -9.788 454 HD2 TYR 85 HD2 TYR 85 -7.079 -5.107 -5.985 455 HE1 TYR 85 HE1 TYR 85 -8.550 -5.567 -10.655 456 HE2 TYR 85 HE2 TYR 85 -8.884 -3.681 -6.846 457 HH TYR 85 HH TYR 85 -9.679 -2.828 -9.022 458 H ILE 86 H ILE 86 -5.325 -9.210 -4.905 459 HA ILE 86 HA ILE 86 -3.511 -11.266 -5.935 460 HB ILE 86 HB ILE 86 -2.041 -9.460 -5.294 461 HG12 ILE 86 1HG1 ILE 86 -2.085 -11.634 -3.192 462 HG13 ILE 86 2HG1 ILE 86 -1.306 -11.726 -4.768 463 HG21 ILE 86 1HG2 ILE 86 -3.432 -8.161 -3.853 464 HG22 ILE 86 2HG2 ILE 86 -1.983 -8.616 -2.956 465 HG23 ILE 86 3HG2 ILE 86 -3.502 -9.463 -2.666 466 HD11 ILE 86 1HD1 ILE 86 0.306 -11.313 -2.994 467 HD12 ILE 86 2HD1 ILE 86 -0.546 -9.833 -2.559 468 HD13 ILE 86 3HD1 ILE 86 0.242 -9.966 -4.130 469 H ARG 87 H ARG 87 -3.577 -13.171 -4.782 470 HA ARG 87 HA ARG 87 -6.119 -13.500 -3.514 471 HB2 ARG 87 1HB ARG 87 -5.235 -15.085 -5.178 472 HB3 ARG 87 2HB ARG 87 -3.965 -15.541 -4.053 473 HG2 ARG 87 1HG ARG 87 -5.497 -16.553 -2.578 474 HG3 ARG 87 2HG ARG 87 -6.876 -15.815 -3.398 475 HD2 ARG 87 1HD ARG 87 -6.458 -17.157 -5.370 476 HD3 ARG 87 2HD ARG 87 -5.009 -17.837 -4.633 477 HE ARG 87 HE ARG 87 -6.985 -18.475 -2.877 478 HH11 ARG 87 1HH1 ARG 87 -6.583 -18.919 -6.323 479 HH12 ARG 87 2HH1 ARG 87 -7.451 -20.421 -6.362 480 HH21 ARG 87 1HH2 ARG 87 -8.137 -20.457 -2.921 481 HH22 ARG 87 2HH2 ARG 87 -8.339 -21.294 -4.431 482 H ARG 88 H ARG 88 -2.848 -13.286 -2.371 483 HA ARG 88 HA ARG 88 -3.875 -13.754 0.342 484 HB2 ARG 88 1HB ARG 88 -1.248 -14.752 -0.761 485 HB3 ARG 88 2HB ARG 88 -1.647 -14.730 0.947 486 HG2 ARG 88 1HG ARG 88 -3.666 -16.156 0.313 487 HG3 ARG 88 2HG ARG 88 -2.854 -16.387 -1.236 488 HD2 ARG 88 1HD ARG 88 -2.318 -18.225 0.240 489 HD3 ARG 88 2HD ARG 88 -0.876 -17.248 -0.036 490 HE ARG 88 HE ARG 88 -2.030 -16.249 2.259 491 HH11 ARG 88 1HH1 ARG 88 -0.739 -19.335 1.223 492 HH12 ARG 88 2HH1 ARG 88 -0.271 -19.818 2.822 493 HH21 ARG 88 1HH2 ARG 88 -1.409 -16.885 4.367 494 HH22 ARG 88 2HH2 ARG 88 -0.640 -18.421 4.606 495 H LEU 89 H LEU 89 -2.209 -12.916 1.996 496 HA LEU 89 HA LEU 89 -1.975 -10.163 1.734 497 HB2 LEU 89 1HB LEU 89 -0.521 -12.110 3.513 498 HB3 LEU 89 2HB LEU 89 -0.338 -10.373 3.656 499 HG LEU 89 HG LEU 89 -2.980 -11.800 3.934 500 HD11 LEU 89 1HD1 LEU 89 -1.098 -10.812 6.074 501 HD12 LEU 89 2HD1 LEU 89 -1.448 -12.500 5.703 502 HD13 LEU 89 3HD1 LEU 89 -2.718 -11.455 6.339 503 HD21 LEU 89 1HD2 LEU 89 -2.085 -8.993 4.571 504 HD22 LEU 89 2HD2 LEU 89 -3.668 -9.671 4.960 505 HD23 LEU 89 3HD2 LEU 89 -3.181 -9.476 3.276 506 HA PRO 90 HA PRO 90 1.530 -9.862 -1.001 507 HB2 PRO 90 1HB PRO 90 1.832 -7.156 -0.790 508 HB3 PRO 90 2HB PRO 90 0.620 -7.924 -1.823 509 HG2 PRO 90 1HG PRO 90 0.310 -6.726 0.900 510 HG3 PRO 90 2HG PRO 90 -0.769 -6.616 -0.503 511 HD2 PRO 90 1HD PRO 90 -1.242 -8.294 1.565 512 HD3 PRO 90 2HD PRO 90 -1.706 -8.685 -0.104 513 H GLN 91 H GLN 91 3.700 -9.844 -0.706 514 HA GLN 91 HA GLN 91 4.781 -8.718 1.764 515 HB2 GLN 91 1HB GLN 91 4.962 -11.593 0.923 516 HB3 GLN 91 2HB GLN 91 6.227 -10.867 1.904 517 HG2 GLN 91 1HG GLN 91 4.496 -10.247 3.571 518 HG3 GLN 91 2HG GLN 91 3.315 -11.138 2.613 519 HE21 GLN 91 1HE2 GLN 91 4.042 -13.773 4.788 520 HE22 GLN 91 2HE2 GLN 91 2.920 -12.537 4.338 521 H ASP 92 H ASP 92 6.724 -7.837 1.564 522 HA ASP 92 HA ASP 92 7.984 -7.359 -0.884 523 HB2 ASP 92 1HB ASP 92 9.178 -7.354 1.898 524 HB3 ASP 92 2HB ASP 92 9.962 -6.690 0.472 525 HA PRO 93 HA PRO 93 10.281 -10.982 -1.979 526 HB2 PRO 93 1HB PRO 93 12.686 -9.225 -2.072 527 HB3 PRO 93 2HB PRO 93 12.053 -10.331 -3.297 528 HG2 PRO 93 1HG PRO 93 11.727 -7.707 -3.555 529 HG3 PRO 93 2HG PRO 93 10.426 -8.828 -4.000 530 HD2 PRO 93 1HD PRO 93 10.696 -7.093 -1.586 531 HD3 PRO 93 2HD PRO 93 9.245 -7.524 -2.510 532 H TRP 94 H TRP 94 11.489 -8.901 0.568 533 HA TRP 94 HA TRP 94 13.317 -10.861 1.617 534 HB2 TRP 94 1HB TRP 94 12.278 -8.328 2.897 535 HB3 TRP 94 2HB TRP 94 13.669 -9.269 3.426 536 HD1 TRP 94 HD1 TRP 94 15.744 -9.395 1.523 537 HE1 TRP 94 HE1 TRP 94 16.611 -7.504 0.004 538 HE3 TRP 94 HE3 TRP 94 11.688 -6.291 1.701 539 HZ2 TRP 94 HZ2 TRP 94 15.694 -5.025 -0.983 540 HZ3 TRP 94 HZ3 TRP 94 11.763 -4.181 0.442 541 HH2 TRP 94 HH2 TRP 94 13.725 -3.561 -0.871 542 H GLY 95 H GLY 95 9.977 -10.418 1.783 543 HA2 GLY 95 1HA GLY 95 8.550 -12.005 2.824 544 HA3 GLY 95 2HA GLY 95 9.807 -12.323 4.008 545 H SER 96 H SER 96 8.699 -9.121 3.061 546 HA SER 96 HA SER 96 7.959 -8.678 5.856 547 HB2 SER 96 1HB SER 96 8.609 -6.663 3.701 548 HB3 SER 96 2HB SER 96 8.290 -6.302 5.395 549 HG SER 96 HG SER 96 10.576 -6.497 4.710 550 H ASP 97 H ASP 97 5.960 -8.170 6.452 551 HA ASP 97 HA ASP 97 3.811 -8.192 4.534 552 HB2 ASP 97 1HB ASP 97 3.412 -9.271 6.636 553 HB3 ASP 97 2HB ASP 97 3.924 -7.850 7.537 554 H TYR 98 H TYR 98 2.940 -6.479 3.564 555 HA TYR 98 HA TYR 98 4.081 -3.906 3.831 556 HB2 TYR 98 1HB TYR 98 1.668 -4.926 2.345 557 HB3 TYR 98 2HB TYR 98 2.120 -3.224 2.326 558 HD1 TYR 98 HD1 TYR 98 4.039 -2.464 1.101 559 HD2 TYR 98 HD2 TYR 98 3.104 -6.606 1.282 560 HE1 TYR 98 HE1 TYR 98 5.648 -2.902 -0.704 561 HE2 TYR 98 HE2 TYR 98 4.710 -7.054 -0.520 562 HH TYR 98 HH TYR 98 7.054 -4.909 -1.434 563 H GLN 99 H GLN 99 3.370 -2.056 4.788 564 HA GLN 99 HA GLN 99 1.177 -2.429 6.717 565 HB2 GLN 99 1HB GLN 99 3.587 -0.618 6.929 566 HB3 GLN 99 2HB GLN 99 2.328 -0.802 8.143 567 HG2 GLN 99 1HG GLN 99 4.215 -2.956 7.219 568 HG3 GLN 99 2HG GLN 99 4.329 -2.051 8.729 569 HE21 GLN 99 1HE2 GLN 99 2.563 -5.402 9.031 570 HE22 GLN 99 2HE2 GLN 99 3.968 -4.932 8.141 571 H LEU 100 H LEU 100 -0.366 -0.907 6.932 572 HA LEU 100 HA LEU 100 -0.192 1.498 5.253 573 HB2 LEU 100 1HB LEU 100 -1.732 -0.193 4.283 574 HB3 LEU 100 2HB LEU 100 -2.664 -0.179 5.762 575 HG LEU 100 HG LEU 100 -3.586 1.116 3.763 576 HD11 LEU 100 1HD1 LEU 100 -4.533 1.406 5.953 577 HD12 LEU 100 2HD1 LEU 100 -4.405 2.973 5.156 578 HD13 LEU 100 3HD1 LEU 100 -3.242 2.521 6.401 579 HD21 LEU 100 1HD2 LEU 100 -2.727 3.238 3.251 580 HD22 LEU 100 2HD2 LEU 100 -1.340 2.152 3.272 581 HD23 LEU 100 3HD2 LEU 100 -1.640 3.221 4.640 582 H LEU 101 H LEU 101 -0.354 3.294 6.391 583 HA LEU 101 HA LEU 101 -1.170 3.087 9.211 584 HB2 LEU 101 1HB LEU 101 1.146 3.967 8.187 585 HB3 LEU 101 2HB LEU 101 0.246 5.466 8.135 586 HG LEU 101 HG LEU 101 0.889 3.837 10.592 587 HD11 LEU 101 1HD1 LEU 101 2.765 5.091 9.714 588 HD12 LEU 101 2HD1 LEU 101 2.186 5.823 11.211 589 HD13 LEU 101 3HD1 LEU 101 1.785 6.557 9.657 590 HD21 LEU 101 1HD2 LEU 101 -1.327 4.835 10.825 591 HD22 LEU 101 2HD2 LEU 101 -0.675 6.408 10.367 592 HD23 LEU 101 3HD2 LEU 101 -0.157 5.643 11.869 593 H SER 102 H SER 102 -3.231 3.714 9.503 594 HA SER 102 HA SER 102 -4.146 6.161 8.174 595 HB2 SER 102 1HB SER 102 -6.420 5.432 9.011 596 HB3 SER 102 2HB SER 102 -5.683 4.360 7.822 597 HG SER 102 HG SER 102 -5.973 4.000 10.609 598 HA PRO 103 HA PRO 103 -4.515 7.986 8.235 599 HB2 PRO 103 1HB PRO 103 -3.887 10.500 8.867 600 HB3 PRO 103 2HB PRO 103 -5.466 9.827 9.289 601 HG2 PRO 103 1HG PRO 103 -3.064 10.251 11.011 602 HG3 PRO 103 2HG PRO 103 -4.776 10.504 11.395 603 HD2 PRO 103 1HD PRO 103 -3.296 8.270 12.105 604 HD3 PRO 103 2HD PRO 103 -5.065 8.332 12.011 605 H GLY 104 H GLY 104 -2.969 8.915 6.775 606 HA2 GLY 104 1HA GLY 104 -0.296 7.936 7.341 607 HA3 GLY 104 2HA GLY 104 -0.884 8.538 5.799 608 H GLN 105 H GLN 105 1.607 9.183 6.746 609 HA GLN 105 HA GLN 105 1.417 11.926 7.768 610 HB2 GLN 105 1HB GLN 105 3.079 10.371 8.762 611 HB3 GLN 105 2HB GLN 105 3.838 10.203 7.186 612 HG2 GLN 105 1HG GLN 105 4.240 12.682 7.233 613 HG3 GLN 105 2HG GLN 105 3.714 12.655 8.915 614 HE21 GLN 105 1HE2 GLN 105 7.077 12.247 9.704 615 HE22 GLN 105 2HE2 GLN 105 5.691 13.282 9.720 616 H HIS 106 H HIS 106 2.321 10.025 4.988 617 HA HIS 106 HA HIS 106 3.191 12.394 3.497 618 HB2 HIS 106 1HB HIS 106 3.210 9.484 2.658 619 HB3 HIS 106 2HB HIS 106 4.025 10.817 1.848 620 HD1 HIS 106 HD1 HIS 106 4.583 8.188 4.264 621 HD2 HIS 106 HD2 HIS 106 6.129 11.997 3.579 622 HE1 HIS 106 HE1 HIS 106 6.771 8.277 5.508 623 HE2 HIS 106 HE2 HIS 106 7.602 10.635 5.215 624 H GLY 107 H GLY 107 0.357 11.426 4.260 625 HA2 GLY 107 1HA GLY 107 -1.108 12.570 2.242 626 HA3 GLY 107 2HA GLY 107 -0.980 10.871 1.799 627 H GLN 108 H GLN 108 -3.328 10.760 2.090 628 HA GLN 108 HA GLN 108 -4.421 11.077 4.707 629 HB2 GLN 108 1HB GLN 108 -5.395 9.924 2.144 630 HB3 GLN 108 2HB GLN 108 -6.224 9.460 3.624 631 HG2 GLN 108 1HG GLN 108 -5.842 12.250 2.570 632 HG3 GLN 108 2HG GLN 108 -7.345 11.330 2.613 633 HE21 GLN 108 1HE2 GLN 108 -6.968 11.534 6.405 634 HE22 GLN 108 2HE2 GLN 108 -6.597 10.244 5.315 635 H VAL 109 H VAL 109 -3.019 8.417 2.928 636 HA VAL 109 HA VAL 109 -2.833 6.920 5.432 637 HB VAL 109 HB VAL 109 -3.279 4.794 4.235 638 HG11 VAL 109 1HG1 VAL 109 -5.056 5.819 5.532 639 HG12 VAL 109 2HG1 VAL 109 -5.708 5.007 4.107 640 HG13 VAL 109 3HG1 VAL 109 -5.553 6.764 4.128 641 HG21 VAL 109 1HG2 VAL 109 -4.375 4.830 2.050 642 HG22 VAL 109 2HG2 VAL 109 -2.757 5.528 1.970 643 HG23 VAL 109 3HG2 VAL 109 -4.172 6.582 1.979 644 H ASP 110 H ASP 110 -1.004 5.480 5.489 645 HA ASP 110 HA ASP 110 1.029 6.217 3.480 646 HB2 ASP 110 1HB ASP 110 1.055 6.627 6.273 647 HB3 ASP 110 2HB ASP 110 2.215 5.343 5.946 648 H ILE 111 H ILE 111 1.718 4.581 2.284 649 HA ILE 111 HA ILE 111 1.630 1.869 3.418 650 HB ILE 111 HB ILE 111 2.023 1.156 0.990 651 HG12 ILE 111 1HG1 ILE 111 1.087 3.992 0.496 652 HG13 ILE 111 2HG1 ILE 111 2.675 3.343 0.103 653 HG21 ILE 111 1HG2 ILE 111 -0.604 2.490 1.588 654 HG22 ILE 111 2HG2 ILE 111 -0.111 0.917 2.216 655 HG23 ILE 111 3HG2 ILE 111 -0.317 1.150 0.479 656 HD11 ILE 111 1HD1 ILE 111 1.293 3.478 -1.871 657 HD12 ILE 111 2HD1 ILE 111 0.058 2.478 -1.105 658 HD13 ILE 111 3HD1 ILE 111 1.640 1.794 -1.481 659 H PHE 112 H PHE 112 3.487 0.891 3.908 660 HA PHE 112 HA PHE 112 5.915 1.636 2.519 661 HB2 PHE 112 1HB PHE 112 7.168 2.066 4.611 662 HB3 PHE 112 2HB PHE 112 5.919 3.262 4.303 663 HD1 PHE 112 HD1 PHE 112 3.833 3.239 5.650 664 HD2 PHE 112 HD2 PHE 112 7.140 0.714 6.551 665 HE1 PHE 112 HE1 PHE 112 2.943 2.886 7.916 666 HE2 PHE 112 HE2 PHE 112 6.252 0.353 8.817 667 HZ PHE 112 HZ PHE 112 4.149 1.440 9.502 668 H SER 113 H SER 113 7.468 0.140 2.499 669 HA SER 113 HA SER 113 6.782 -2.526 3.440 670 HB2 SER 113 1HB SER 113 9.066 -1.514 1.729 671 HB3 SER 113 2HB SER 113 8.704 -3.210 2.050 672 HG SER 113 HG SER 113 7.374 -3.122 0.464 673 H LEU 114 H LEU 114 7.897 -3.627 4.968 674 HA LEU 114 HA LEU 114 9.332 -2.181 6.928 675 HB2 LEU 114 1HB LEU 114 9.234 -5.165 6.534 676 HB3 LEU 114 2HB LEU 114 9.687 -4.326 7.998 677 HG LEU 114 HG LEU 114 6.936 -4.314 6.748 678 HD11 LEU 114 1HD1 LEU 114 7.969 -5.673 9.234 679 HD12 LEU 114 2HD1 LEU 114 7.511 -6.470 7.728 680 HD13 LEU 114 3HD1 LEU 114 6.290 -5.641 8.695 681 HD21 LEU 114 1HD2 LEU 114 7.375 -2.227 7.881 682 HD22 LEU 114 2HD2 LEU 114 7.962 -3.091 9.303 683 HD23 LEU 114 3HD2 LEU 114 6.264 -3.204 8.841 684 H GLY 115 H GLY 115 10.288 -3.671 4.028 685 HA2 GLY 115 1HA GLY 115 12.339 -3.504 2.977 686 HA3 GLY 115 2HA GLY 115 12.996 -2.803 4.448 687 HA PRO 116 HA PRO 116 14.767 -7.035 3.793 688 HB2 PRO 116 1HB PRO 116 17.231 -5.701 4.685 689 HB3 PRO 116 2HB PRO 116 16.932 -6.648 3.225 690 HG2 PRO 116 1HG PRO 116 17.260 -3.986 3.130 691 HG3 PRO 116 2HG PRO 116 16.136 -4.827 2.046 692 HD2 PRO 116 1HD PRO 116 15.556 -3.286 4.552 693 HD3 PRO 116 2HD PRO 116 14.682 -3.283 3.005 694 H ASP 117 H ASP 117 15.212 -4.745 6.466 695 HA ASP 117 HA ASP 117 16.002 -6.927 8.221 696 HB2 ASP 117 1HB ASP 117 16.393 -5.189 9.919 697 HB3 ASP 117 2HB ASP 117 17.273 -4.879 8.432 698 H GLY 118 H GLY 118 13.149 -5.442 7.285 699 HA2 GLY 118 1HA GLY 118 10.994 -5.987 7.925 700 HA3 GLY 118 2HA GLY 118 11.664 -6.972 9.214 701 H VAL 119 H VAL 119 13.042 -3.941 9.368 702 HA VAL 119 HA VAL 119 11.432 -3.293 11.694 703 HB VAL 119 HB VAL 119 13.881 -1.919 10.573 704 HG11 VAL 119 1HG1 VAL 119 12.518 -0.378 11.885 705 HG12 VAL 119 2HG1 VAL 119 14.002 -0.788 12.746 706 HG13 VAL 119 3HG1 VAL 119 12.475 -1.535 13.214 707 HG21 VAL 119 1HG2 VAL 119 14.346 -4.179 11.348 708 HG22 VAL 119 2HG2 VAL 119 13.565 -3.825 12.890 709 HG23 VAL 119 3HG2 VAL 119 15.053 -2.992 12.443 710 HA PRO 120 HA PRO 120 8.886 -0.609 9.183 711 HB2 PRO 120 1HB PRO 120 7.194 0.134 11.175 712 HB3 PRO 120 2HB PRO 120 7.085 -1.419 10.343 713 HG2 PRO 120 1HG PRO 120 8.273 -0.774 13.003 714 HG3 PRO 120 2HG PRO 120 7.311 -2.180 12.515 715 HD2 PRO 120 1HD PRO 120 10.023 -2.233 12.762 716 HD3 PRO 120 2HD PRO 120 9.126 -3.272 11.638 717 H GLU 121 H GLU 121 8.562 1.537 8.896 718 HA GLU 121 HA GLU 121 8.930 3.747 8.908 719 HB2 GLU 121 1HB GLU 121 8.494 4.988 10.888 720 HB3 GLU 121 2HB GLU 121 7.456 3.573 10.916 721 HG2 GLU 121 1HG GLU 121 8.962 2.502 12.511 722 HG3 GLU 121 2HG GLU 121 10.008 3.921 12.474 723 H SER 122 H SER 122 11.221 1.919 9.012 724 HA SER 122 HA SER 122 13.286 3.575 10.225 725 HB2 SER 122 1HB SER 122 14.641 1.535 9.136 726 HB3 SER 122 2HB SER 122 13.825 1.401 10.695 727 HG SER 122 HG SER 122 13.362 0.039 8.438 728 H ASN 123 H ASN 123 15.408 3.552 8.686 729 HA ASN 123 HA ASN 123 14.670 5.323 6.562 730 HB2 ASN 123 1HB ASN 123 17.374 4.168 7.281 731 HB3 ASN 123 2HB ASN 123 17.101 5.468 6.128 732 HD21 ASN 123 1HD2 ASN 123 16.685 7.958 8.537 733 HD22 ASN 123 2HD2 ASN 123 16.516 7.506 6.874 734 H ASP 124 H ASP 124 15.488 1.967 6.803 735 HA ASP 124 HA ASP 124 16.009 1.555 4.006 736 HB2 ASP 124 1HB ASP 124 16.095 -0.783 4.551 737 HB3 ASP 124 2HB ASP 124 16.856 0.083 5.885 738 H ASP 125 H ASP 125 13.222 1.945 5.903 739 HA ASP 125 HA ASP 125 11.414 0.186 4.657 740 HB2 ASP 125 1HB ASP 125 11.131 2.663 6.311 741 HB3 ASP 125 2HB ASP 125 9.715 2.010 5.496 742 H ILE 126 H ILE 126 10.591 0.211 2.709 743 HA ILE 126 HA ILE 126 10.934 2.565 1.026 744 HB ILE 126 HB ILE 126 9.968 -0.211 0.307 745 HG12 ILE 126 1HG1 ILE 126 12.658 1.099 -0.154 746 HG13 ILE 126 2HG1 ILE 126 12.328 -0.120 1.072 747 HG21 ILE 126 1HG2 ILE 126 9.165 1.624 -1.174 748 HG22 ILE 126 2HG2 ILE 126 10.190 0.441 -1.985 749 HG23 ILE 126 3HG2 ILE 126 10.849 2.014 -1.528 750 HD11 ILE 126 1HD1 ILE 126 11.810 -1.738 -0.667 751 HD12 ILE 126 2HD1 ILE 126 13.428 -1.070 -0.881 752 HD13 ILE 126 3HD1 ILE 126 12.102 -0.515 -1.903 753 H GLY 127 H GLY 127 9.354 4.020 1.283 754 HA2 GLY 127 1HA GLY 127 6.581 3.019 1.432 755 HA3 GLY 127 2HA GLY 127 7.125 4.533 2.139 756 H ASN 128 H ASN 128 5.024 4.885 0.715 757 HA ASN 128 HA ASN 128 5.256 5.135 -2.054 758 HB2 ASN 128 1HB ASN 128 3.423 6.904 -1.790 759 HB3 ASN 128 2HB ASN 128 3.071 5.291 -1.193 760 HD21 ASN 128 1HD2 ASN 128 1.825 6.959 1.607 761 HD22 ASN 128 2HD2 ASN 128 1.459 6.105 0.149 762 H TRP 129 H TRP 129 6.156 7.372 0.504 763 HA TRP 129 HA TRP 129 6.759 9.535 -1.259 764 HB2 TRP 129 1HB TRP 129 6.177 9.583 1.267 765 HB3 TRP 129 2HB TRP 129 7.888 9.246 1.509 766 HD1 TRP 129 HD1 TRP 129 9.582 11.229 1.162 767 HE1 TRP 129 HE1 TRP 129 9.279 13.751 0.745 768 HE3 TRP 129 HE3 TRP 129 4.597 11.284 0.022 769 HZ2 TRP 129 HZ2 TRP 129 7.208 15.526 0.040 770 HZ3 TRP 129 HZ3 TRP 129 3.533 13.437 -0.507 771 HH2 TRP 129 HH2 TRP 129 4.812 15.514 -0.499 772 H THR 130 H THR 130 8.460 6.741 -0.183 773 HA THR 130 HA THR 130 11.117 7.635 -0.468 774 HB THR 130 HB THR 130 10.041 4.836 -0.880 775 HG1 THR 130 HG1 THR 130 11.180 5.839 1.516 776 HG21 THR 130 1HG2 THR 130 12.803 5.819 -0.155 777 HG22 THR 130 2HG2 THR 130 12.328 5.082 -1.683 778 HG23 THR 130 3HG2 THR 130 12.300 4.129 -0.200 779 H ILE 131 H ILE 131 8.864 6.110 -2.738 780 HA ILE 131 HA ILE 131 10.793 6.325 -4.895 781 HB ILE 131 HB ILE 131 9.506 4.327 -4.971 782 HG12 ILE 131 1HG1 ILE 131 8.439 6.246 -7.050 783 HG13 ILE 131 2HG1 ILE 131 9.964 5.374 -7.142 784 HG21 ILE 131 1HG2 ILE 131 7.065 6.081 -4.806 785 HG22 ILE 131 2HG2 ILE 131 7.617 4.888 -3.627 786 HG23 ILE 131 3HG2 ILE 131 7.025 4.365 -5.203 787 HD11 ILE 131 1HD1 ILE 131 8.742 3.261 -7.198 788 HD12 ILE 131 2HD1 ILE 131 8.278 4.328 -8.523 789 HD13 ILE 131 3HD1 ILE 131 7.218 4.147 -7.126 790 H GLY 132 H GLY 132 7.746 7.841 -3.906 791 HA2 GLY 132 1HA GLY 132 7.857 10.321 -4.383 792 HA3 GLY 132 2HA GLY 132 8.182 9.837 -6.040 793 H PHE 133 H PHE 133 5.882 8.144 -4.011 794 HA PHE 133 HA PHE 133 3.753 8.986 -5.826 795 HB2 PHE 133 1HB PHE 133 3.857 6.805 -3.737 796 HB3 PHE 133 2HB PHE 133 2.407 7.218 -4.639 797 HD1 PHE 133 HD1 PHE 133 4.164 4.600 -4.441 798 HD2 PHE 133 HD2 PHE 133 3.733 7.703 -7.322 799 HE1 PHE 133 HE1 PHE 133 4.837 3.040 -6.220 800 HE2 PHE 133 HE2 PHE 133 4.406 6.148 -9.102 801 HZ PHE 133 HZ PHE 133 4.958 3.813 -8.553 802 H HIS 134 H HIS 134 2.002 10.107 -5.202 803 HA HIS 134 HA HIS 134 1.287 10.527 -2.478 804 HB2 HIS 134 1HB HIS 134 3.121 12.157 -2.592 805 HB3 HIS 134 2HB HIS 134 2.402 12.885 -4.024 806 HD1 HIS 134 HD1 HIS 134 1.835 12.539 -0.301 807 HD2 HIS 134 HD2 HIS 134 0.401 14.723 -3.538 808 HE1 HIS 134 HE1 HIS 134 0.378 14.334 0.684 809 HE2 HIS 134 HE2 HIS 134 -0.405 15.699 -1.281 810 H HIS 135 H HIS 135 -0.838 10.502 -2.546 811 HA HIS 135 HA HIS 135 -2.271 10.811 -4.991 812 HB2 HIS 135 1HB HIS 135 -3.278 10.524 -2.149 813 HB3 HIS 135 2HB HIS 135 -4.290 10.448 -3.587 814 HD1 HIS 135 HD1 HIS 135 -4.077 8.315 -5.071 815 HD2 HIS 135 HD2 HIS 135 -1.820 8.228 -1.587 816 HE1 HIS 135 HE1 HIS 135 -3.359 5.924 -4.793 817 HE2 HIS 135 HE2 HIS 135 -1.756 5.964 -2.844 818 H HIS 136 H HIS 136 -1.708 12.912 -5.595 819 HA HIS 136 HA HIS 136 -2.207 15.155 -3.920 820 HB2 HIS 136 1HB HIS 136 -1.655 16.503 -5.932 821 HB3 HIS 136 2HB HIS 136 -0.435 15.310 -5.526 822 HD1 HIS 136 HD1 HIS 136 -2.885 16.241 -8.173 823 HD2 HIS 136 HD2 HIS 136 -0.126 13.227 -7.406 824 HE1 HIS 136 HE1 HIS 136 -2.585 15.029 -10.352 825 HE2 HIS 136 HE2 HIS 136 -1.006 13.136 -9.837 826 H HIS 137 H HIS 137 -4.074 16.021 -3.478 827 HA HIS 137 HA HIS 137 -6.173 15.989 -5.537 828 HB2 HIS 137 1HB HIS 137 -6.461 15.552 -2.563 829 HB3 HIS 137 2HB HIS 137 -7.824 15.913 -3.618 830 HD1 HIS 137 HD1 HIS 137 -5.922 13.148 -2.284 831 HD2 HIS 137 HD2 HIS 137 -8.110 13.872 -5.739 832 HE1 HIS 137 HE1 HIS 137 -6.417 10.884 -3.256 833 HE2 HIS 137 HE2 HIS 137 -7.586 11.357 -5.434 834 H HIS 138 H HIS 138 -4.263 18.010 -5.196 835 HA HIS 138 HA HIS 138 -5.833 20.189 -4.008 836 HB2 HIS 138 1HB HIS 138 -2.890 19.974 -4.656 837 HB3 HIS 138 2HB HIS 138 -3.664 21.500 -4.249 838 HD1 HIS 138 HD1 HIS 138 -3.904 22.033 -1.817 839 HD2 HIS 138 HD2 HIS 138 -2.955 18.042 -2.480 840 HE1 HIS 138 HE1 HIS 138 -3.451 21.060 0.455 841 HE2 HIS 138 HE2 HIS 138 -3.047 18.606 0.044 842 H HIS 139 H HIS 139 -6.058 22.163 -5.222 843 HA HIS 139 HA HIS 139 -5.676 21.830 -8.124 844 HB2 HIS 139 1HB HIS 139 -8.087 22.993 -6.714 845 HB3 HIS 139 2HB HIS 139 -7.807 23.103 -8.446 846 HD1 HIS 139 HD1 HIS 139 -8.391 21.076 -9.863 847 HD2 HIS 139 HD2 HIS 139 -8.725 20.376 -5.776 848 HE1 HIS 139 HE1 HIS 139 -9.557 18.861 -9.647 849 HE2 HIS 139 HE2 HIS 139 -9.818 18.493 -7.169 850 H LYS 140 H LYS 140 -4.960 23.605 -9.227 851 HA LYS 140 HA LYS 140 -4.173 25.903 -7.606 852 HB2 LYS 140 1HB LYS 140 -3.377 25.024 -10.384 853 HB3 LYS 140 2HB LYS 140 -2.854 26.537 -9.655 854 HG2 LYS 140 1HG LYS 140 -1.753 25.298 -7.863 855 HG3 LYS 140 2HG LYS 140 -2.283 23.778 -8.588 856 HD2 LYS 140 1HD LYS 140 -0.968 24.227 -10.570 857 HD3 LYS 140 2HD LYS 140 -0.514 25.814 -9.945 858 HE2 LYS 140 1HE LYS 140 0.660 24.760 -8.088 859 HE3 LYS 140 2HE LYS 140 0.174 23.169 -8.669 860 HZ1 LYS 140 1HZ LYS 140 2.449 23.750 -9.306 861 HZ2 LYS 140 2HZ LYS 140 1.872 25.078 -10.181 862 HZ3 LYS 140 3HZ LYS 140 1.463 23.509 -10.655 Start of MODEL 3 1 H1 MET 25 1H MET 25 26.802 -9.191 -10.796 2 H2 MET 25 2H MET 25 26.657 -9.458 -9.133 3 H3 MET 25 3H MET 25 27.934 -8.525 -9.737 4 HA MET 25 HA MET 25 26.342 -6.887 -10.565 5 HB2 MET 25 1HB MET 25 24.406 -8.690 -9.111 6 HB3 MET 25 2HB MET 25 24.032 -7.023 -9.522 7 HG2 MET 25 1HG MET 25 24.767 -9.156 -11.512 8 HG3 MET 25 2HG MET 25 23.121 -8.664 -11.119 9 HE1 MET 25 1HE MET 25 24.499 -8.691 -14.077 10 HE2 MET 25 2HE MET 25 23.790 -7.216 -14.735 11 HE3 MET 25 3HE MET 25 22.803 -8.317 -13.774 12 H GLY 26 H GLY 26 27.113 -8.474 -7.604 13 HA2 GLY 26 1HA GLY 26 28.047 -7.481 -5.724 14 HA3 GLY 26 2HA GLY 26 27.607 -5.904 -6.361 15 H ASN 27 H ASN 27 25.056 -5.788 -6.596 16 HA ASN 27 HA ASN 27 23.864 -6.771 -4.096 17 HB2 ASN 27 1HB ASN 27 23.710 -3.971 -5.227 18 HB3 ASN 27 2HB ASN 27 22.621 -4.569 -3.981 19 HD21 ASN 27 1HD2 ASN 27 26.424 -3.495 -3.092 20 HD22 ASN 27 2HD2 ASN 27 25.875 -3.613 -4.726 21 H LYS 28 H LYS 28 21.650 -7.185 -4.171 22 HA LYS 28 HA LYS 28 20.504 -7.287 -6.880 23 HB2 LYS 28 1HB LYS 28 19.030 -9.054 -6.017 24 HB3 LYS 28 2HB LYS 28 20.725 -9.475 -5.813 25 HG2 LYS 28 1HG LYS 28 20.562 -8.712 -3.452 26 HG3 LYS 28 2HG LYS 28 18.828 -8.494 -3.696 27 HD2 LYS 28 1HD LYS 28 18.656 -10.883 -4.314 28 HD3 LYS 28 2HD LYS 28 20.372 -11.071 -3.951 29 HE2 LYS 28 1HE LYS 28 19.088 -11.805 -2.057 30 HE3 LYS 28 2HE LYS 28 19.923 -10.309 -1.641 31 HZ1 LYS 28 1HZ LYS 28 17.058 -10.630 -2.335 32 HZ2 LYS 28 2HZ LYS 28 17.815 -9.124 -2.176 33 HZ3 LYS 28 3HZ LYS 28 17.705 -10.164 -0.845 34 H GLU 29 H GLU 29 20.620 -5.049 -4.955 35 HA GLU 29 HA GLU 29 18.253 -4.602 -3.571 36 HB2 GLU 29 1HB GLU 29 20.383 -3.276 -3.423 37 HB3 GLU 29 2HB GLU 29 19.942 -2.508 -4.940 38 HG2 GLU 29 1HG GLU 29 19.346 -1.030 -3.194 39 HG3 GLU 29 2HG GLU 29 17.853 -1.711 -3.839 40 H LYS 30 H LYS 30 19.120 -3.827 -6.909 41 HA LYS 30 HA LYS 30 16.828 -2.360 -7.590 42 HB2 LYS 30 1HB LYS 30 18.522 -4.113 -9.373 43 HB3 LYS 30 2HB LYS 30 17.405 -2.873 -9.919 44 HG2 LYS 30 1HG LYS 30 18.759 -1.147 -8.952 45 HG3 LYS 30 2HG LYS 30 19.822 -2.344 -8.209 46 HD2 LYS 30 1HD LYS 30 20.410 -3.166 -10.461 47 HD3 LYS 30 2HD LYS 30 19.416 -1.890 -11.162 48 HE2 LYS 30 1HE LYS 30 20.840 -0.205 -10.118 49 HE3 LYS 30 2HE LYS 30 21.822 -1.478 -9.391 50 HZ1 LYS 30 1HZ LYS 30 22.845 -0.615 -11.396 51 HZ2 LYS 30 2HZ LYS 30 21.473 -1.010 -12.303 52 HZ3 LYS 30 3HZ LYS 30 22.410 -2.234 -11.608 53 H ALA 31 H ALA 31 17.504 -5.811 -7.689 54 HA ALA 31 HA ALA 31 15.161 -6.549 -9.102 55 HB1 ALA 31 1HB ALA 31 16.915 -8.206 -7.291 56 HB2 ALA 31 2HB ALA 31 17.135 -7.979 -9.026 57 HB3 ALA 31 3HB ALA 31 15.714 -8.831 -8.421 58 H ASP 32 H ASP 32 15.975 -6.381 -5.658 59 HA ASP 32 HA ASP 32 13.535 -7.526 -4.761 60 HB2 ASP 32 1HB ASP 32 15.559 -5.788 -3.343 61 HB3 ASP 32 2HB ASP 32 14.156 -6.488 -2.545 62 H ARG 33 H ARG 33 14.638 -4.165 -5.090 63 HA ARG 33 HA ARG 33 12.324 -3.082 -3.881 64 HB2 ARG 33 1HB ARG 33 13.078 -0.907 -4.694 65 HB3 ARG 33 2HB ARG 33 14.371 -1.805 -3.919 66 HG2 ARG 33 1HG ARG 33 15.289 -2.389 -6.093 67 HG3 ARG 33 2HG ARG 33 13.964 -1.535 -6.890 68 HD2 ARG 33 1HD ARG 33 15.941 -0.262 -5.004 69 HD3 ARG 33 2HD ARG 33 16.066 -0.220 -6.761 70 HE ARG 33 HE ARG 33 14.022 1.074 -6.804 71 HH11 ARG 33 1HH1 ARG 33 15.524 0.733 -3.652 72 HH12 ARG 33 2HH1 ARG 33 14.819 2.189 -3.028 73 HH21 ARG 33 1HH2 ARG 33 13.094 2.977 -5.971 74 HH22 ARG 33 2HH2 ARG 33 13.445 3.465 -4.344 75 H GLN 34 H GLN 34 13.094 -3.815 -7.249 76 HA GLN 34 HA GLN 34 10.972 -2.374 -8.389 77 HB2 GLN 34 1HB GLN 34 12.478 -4.809 -9.312 78 HB3 GLN 34 2HB GLN 34 11.163 -4.121 -10.259 79 HG2 GLN 34 1HG GLN 34 12.346 -1.983 -10.342 80 HG3 GLN 34 2HG GLN 34 13.669 -2.685 -9.412 81 HE21 GLN 34 1HE2 GLN 34 15.104 -4.362 -12.103 82 HE22 GLN 34 2HE2 GLN 34 15.027 -4.170 -10.386 83 H LYS 35 H LYS 35 11.077 -5.662 -7.052 84 HA LYS 35 HA LYS 35 8.386 -6.296 -7.620 85 HB2 LYS 35 1HB LYS 35 9.624 -8.152 -6.920 86 HB3 LYS 35 2HB LYS 35 10.349 -7.280 -5.573 87 HG2 LYS 35 1HG LYS 35 8.362 -7.395 -4.302 88 HG3 LYS 35 2HG LYS 35 7.422 -7.937 -5.689 89 HD2 LYS 35 1HD LYS 35 8.294 -10.085 -5.598 90 HD3 LYS 35 2HD LYS 35 9.710 -9.578 -4.675 91 HE2 LYS 35 1HE LYS 35 7.988 -10.862 -3.368 92 HE3 LYS 35 2HE LYS 35 8.421 -9.292 -2.695 93 HZ1 LYS 35 1HZ LYS 35 6.403 -8.358 -3.666 94 HZ2 LYS 35 2HZ LYS 35 6.036 -9.653 -2.636 95 HZ3 LYS 35 3HZ LYS 35 5.997 -9.869 -4.312 96 H VAL 36 H VAL 36 9.944 -4.652 -4.932 97 HA VAL 36 HA VAL 36 7.716 -4.406 -3.249 98 HB VAL 36 HB VAL 36 10.073 -2.525 -3.503 99 HG11 VAL 36 1HG1 VAL 36 9.546 -2.169 -1.034 100 HG12 VAL 36 2HG1 VAL 36 7.964 -2.862 -1.399 101 HG13 VAL 36 3HG1 VAL 36 8.494 -1.388 -2.214 102 HG21 VAL 36 1HG2 VAL 36 9.690 -4.919 -1.715 103 HG22 VAL 36 2HG2 VAL 36 11.068 -3.818 -1.695 104 HG23 VAL 36 3HG2 VAL 36 10.768 -4.831 -3.108 105 H VAL 37 H VAL 37 9.005 -2.244 -5.737 106 HA VAL 37 HA VAL 37 7.043 -0.243 -5.529 107 HB VAL 37 HB VAL 37 8.711 -1.093 -7.898 108 HG11 VAL 37 1HG1 VAL 37 6.707 0.060 -8.677 109 HG12 VAL 37 2HG1 VAL 37 8.145 1.054 -8.907 110 HG13 VAL 37 3HG1 VAL 37 7.043 1.394 -7.573 111 HG21 VAL 37 1HG2 VAL 37 10.029 -0.283 -6.047 112 HG22 VAL 37 2HG2 VAL 37 9.011 1.151 -5.915 113 HG23 VAL 37 3HG2 VAL 37 10.022 0.915 -7.341 114 H SER 38 H SER 38 7.152 -3.257 -7.373 115 HA SER 38 HA SER 38 4.814 -2.851 -8.881 116 HB2 SER 38 1HB SER 38 6.016 -5.454 -7.909 117 HB3 SER 38 2HB SER 38 4.828 -5.292 -9.202 118 HG SER 38 HG SER 38 7.474 -4.235 -9.165 119 H ASP 39 H ASP 39 5.300 -4.447 -5.724 120 HA ASP 39 HA ASP 39 2.554 -5.029 -5.294 121 HB2 ASP 39 1HB ASP 39 4.751 -4.603 -3.251 122 HB3 ASP 39 2HB ASP 39 3.176 -5.307 -2.915 123 H LEU 40 H LEU 40 4.611 -2.302 -4.595 124 HA LEU 40 HA LEU 40 2.909 -0.795 -2.969 125 HB2 LEU 40 1HB LEU 40 5.351 -0.422 -3.439 126 HB3 LEU 40 2HB LEU 40 4.887 0.248 -4.989 127 HG LEU 40 HG LEU 40 3.547 1.972 -3.727 128 HD11 LEU 40 1HD1 LEU 40 3.354 0.801 -1.609 129 HD12 LEU 40 2HD1 LEU 40 4.175 2.346 -1.386 130 HD13 LEU 40 3HD1 LEU 40 5.105 0.848 -1.403 131 HD21 LEU 40 1HD2 LEU 40 5.544 3.299 -3.164 132 HD22 LEU 40 2HD2 LEU 40 5.678 2.499 -4.730 133 HD23 LEU 40 3HD2 LEU 40 6.531 1.848 -3.330 134 H VAL 41 H VAL 41 3.278 -0.866 -6.500 135 HA VAL 41 HA VAL 41 1.392 1.134 -7.099 136 HB VAL 41 HB VAL 41 2.248 -1.256 -8.749 137 HG11 VAL 41 1HG1 VAL 41 0.743 1.214 -9.608 138 HG12 VAL 41 2HG1 VAL 41 0.090 -0.422 -9.523 139 HG13 VAL 41 3HG1 VAL 41 1.363 -0.041 -10.682 140 HG21 VAL 41 1HG2 VAL 41 3.129 1.630 -8.794 141 HG22 VAL 41 2HG2 VAL 41 3.652 0.383 -9.927 142 HG23 VAL 41 3HG2 VAL 41 4.076 0.257 -8.219 143 H ALA 42 H ALA 42 1.076 -2.343 -6.590 144 HA ALA 42 HA ALA 42 -1.664 -2.565 -7.188 145 HB1 ALA 42 1HB ALA 42 -1.598 -4.630 -5.863 146 HB2 ALA 42 2HB ALA 42 -0.006 -4.181 -5.252 147 HB3 ALA 42 3HB ALA 42 -0.228 -4.519 -6.970 148 H LEU 43 H LEU 43 0.042 -1.790 -4.187 149 HA LEU 43 HA LEU 43 -2.223 -1.618 -2.514 150 HB2 LEU 43 1HB LEU 43 0.410 -0.148 -2.335 151 HB3 LEU 43 2HB LEU 43 -0.772 -0.245 -1.049 152 HG LEU 43 HG LEU 43 0.756 -2.582 -2.194 153 HD11 LEU 43 1HD1 LEU 43 2.191 -1.120 -0.914 154 HD12 LEU 43 2HD1 LEU 43 1.858 -2.583 0.012 155 HD13 LEU 43 3HD1 LEU 43 1.018 -1.082 0.403 156 HD21 LEU 43 1HD2 LEU 43 -1.463 -3.225 -1.405 157 HD22 LEU 43 2HD2 LEU 43 -1.154 -2.426 0.137 158 HD23 LEU 43 3HD2 LEU 43 -0.206 -3.838 -0.331 159 H GLU 44 H GLU 44 -0.450 0.869 -4.325 160 HA GLU 44 HA GLU 44 -2.019 3.072 -3.642 161 HB2 GLU 44 1HB GLU 44 -0.145 2.393 -5.825 162 HB3 GLU 44 2HB GLU 44 -1.259 3.709 -6.154 163 HG2 GLU 44 1HG GLU 44 0.497 3.593 -3.726 164 HG3 GLU 44 2HG GLU 44 0.954 4.391 -5.228 165 H GLY 45 H GLY 45 -2.360 0.804 -6.351 166 HA2 GLY 45 1HA GLY 45 -4.615 2.027 -7.512 167 HA3 GLY 45 2HA GLY 45 -4.158 0.345 -7.701 168 H ALA 46 H ALA 46 -4.337 -0.506 -5.043 169 HA ALA 46 HA ALA 46 -7.079 -1.021 -4.738 170 HB1 ALA 46 1HB ALA 46 -6.512 -2.049 -2.666 171 HB2 ALA 46 2HB ALA 46 -5.019 -1.115 -2.545 172 HB3 ALA 46 3HB ALA 46 -5.185 -2.352 -3.787 173 H LEU 47 H LEU 47 -4.961 1.335 -3.175 174 HA LEU 47 HA LEU 47 -6.873 2.436 -1.423 175 HB2 LEU 47 1HB LEU 47 -4.212 3.202 -2.462 176 HB3 LEU 47 2HB LEU 47 -5.206 4.516 -1.858 177 HG LEU 47 HG LEU 47 -5.274 3.590 0.335 178 HD11 LEU 47 1HD1 LEU 47 -3.994 1.133 -0.845 179 HD12 LEU 47 2HD1 LEU 47 -5.603 1.267 -0.130 180 HD13 LEU 47 3HD1 LEU 47 -4.172 1.441 0.883 181 HD21 LEU 47 1HD2 LEU 47 -2.499 3.290 -0.797 182 HD22 LEU 47 2HD2 LEU 47 -2.899 3.472 0.912 183 HD23 LEU 47 3HD2 LEU 47 -3.235 4.784 -0.218 184 H ASP 48 H ASP 48 -5.848 3.412 -4.682 185 HA ASP 48 HA ASP 48 -7.542 5.641 -4.919 186 HB2 ASP 48 1HB ASP 48 -6.120 3.875 -6.864 187 HB3 ASP 48 2HB ASP 48 -7.382 4.939 -7.479 188 H MET 49 H MET 49 -8.049 2.237 -5.750 189 HA MET 49 HA MET 49 -10.637 2.603 -6.839 190 HB2 MET 49 1HB MET 49 -9.263 0.166 -5.706 191 HB3 MET 49 2HB MET 49 -10.870 0.115 -6.417 192 HG2 MET 49 1HG MET 49 -8.319 0.911 -7.799 193 HG3 MET 49 2HG MET 49 -9.228 -0.581 -8.032 194 HE1 MET 49 1HE MET 49 -9.256 -0.210 -10.651 195 HE2 MET 49 2HE MET 49 -8.313 1.264 -10.430 196 HE3 MET 49 3HE MET 49 -9.772 1.291 -11.420 197 H TYR 50 H TYR 50 -9.509 1.742 -3.598 198 HA TYR 50 HA TYR 50 -12.042 1.217 -2.493 199 HB2 TYR 50 1HB TYR 50 -9.641 0.756 -1.560 200 HB3 TYR 50 2HB TYR 50 -9.805 2.358 -0.850 201 HD1 TYR 50 HD1 TYR 50 -11.419 2.761 0.952 202 HD2 TYR 50 HD2 TYR 50 -10.981 -1.091 -0.794 203 HE1 TYR 50 HE1 TYR 50 -12.672 1.770 2.828 204 HE2 TYR 50 HE2 TYR 50 -12.226 -2.088 1.068 205 HH TYR 50 HH TYR 50 -14.083 -0.359 3.192 206 H LYS 51 H LYS 51 -10.117 4.183 -2.691 207 HA LYS 51 HA LYS 51 -11.917 5.793 -1.196 208 HB2 LYS 51 1HB LYS 51 -9.596 6.477 -1.565 209 HB3 LYS 51 2HB LYS 51 -9.889 6.593 -3.296 210 HG2 LYS 51 1HG LYS 51 -11.542 8.372 -2.865 211 HG3 LYS 51 2HG LYS 51 -11.142 8.293 -1.149 212 HD2 LYS 51 1HD LYS 51 -8.818 8.887 -1.680 213 HD3 LYS 51 2HD LYS 51 -9.241 8.986 -3.391 214 HE2 LYS 51 1HE LYS 51 -10.411 10.678 -1.184 215 HE3 LYS 51 2HE LYS 51 -9.178 11.199 -2.331 216 HZ1 LYS 51 1HZ LYS 51 -10.771 10.849 -4.130 217 HZ2 LYS 51 2HZ LYS 51 -11.365 11.955 -2.996 218 HZ3 LYS 51 3HZ LYS 51 -11.948 10.373 -3.015 219 H LEU 52 H LEU 52 -11.752 4.877 -4.581 220 HA LEU 52 HA LEU 52 -13.548 6.856 -5.517 221 HB2 LEU 52 1HB LEU 52 -12.058 5.626 -7.015 222 HB3 LEU 52 2HB LEU 52 -12.903 4.134 -6.650 223 HG LEU 52 HG LEU 52 -14.957 5.082 -7.671 224 HD11 LEU 52 1HD1 LEU 52 -14.483 7.442 -7.328 225 HD12 LEU 52 2HD1 LEU 52 -14.777 7.104 -9.031 226 HD13 LEU 52 3HD1 LEU 52 -13.130 7.348 -8.454 227 HD21 LEU 52 1HD2 LEU 52 -14.194 4.912 -9.989 228 HD22 LEU 52 2HD2 LEU 52 -13.480 3.657 -8.977 229 HD23 LEU 52 3HD2 LEU 52 -12.521 5.059 -9.449 230 H ASP 53 H ASP 53 -14.023 3.439 -4.637 231 HA ASP 53 HA ASP 53 -16.856 3.592 -5.057 232 HB2 ASP 53 1HB ASP 53 -15.076 1.463 -3.889 233 HB3 ASP 53 2HB ASP 53 -16.827 1.296 -3.949 234 H ASN 54 H ASN 54 -14.762 3.561 -2.200 235 HA ASN 54 HA ASN 54 -17.127 3.656 -0.480 236 HB2 ASN 54 1HB ASN 54 -14.206 3.300 0.218 237 HB3 ASN 54 2HB ASN 54 -15.531 3.281 1.378 238 HD21 ASN 54 1HD2 ASN 54 -14.749 0.064 -0.968 239 HD22 ASN 54 2HD2 ASN 54 -13.955 1.582 -1.203 240 H SER 55 H SER 55 -15.294 5.841 -2.037 241 HA SER 55 HA SER 55 -15.351 8.105 -2.005 242 HB2 SER 55 1HB SER 55 -17.090 7.869 0.448 243 HB3 SER 55 2HB SER 55 -16.966 9.255 -0.636 244 HG SER 55 HG SER 55 -17.697 7.665 -2.309 245 H ARG 56 H ARG 56 -13.743 6.341 0.192 246 HA ARG 56 HA ARG 56 -12.179 8.577 1.057 247 HB2 ARG 56 1HB ARG 56 -12.422 7.958 3.526 248 HB3 ARG 56 2HB ARG 56 -13.734 8.865 2.791 249 HG2 ARG 56 1HG ARG 56 -14.773 7.246 4.119 250 HG3 ARG 56 2HG ARG 56 -14.901 6.631 2.473 251 HD2 ARG 56 1HD ARG 56 -14.295 4.838 3.967 252 HD3 ARG 56 2HD ARG 56 -12.946 5.191 2.888 253 HE ARG 56 HE ARG 56 -11.708 5.936 4.683 254 HH11 ARG 56 1HH1 ARG 56 -15.023 5.386 5.704 255 HH12 ARG 56 2HH1 ARG 56 -14.628 5.398 7.395 256 HH21 ARG 56 1HH2 ARG 56 -11.210 5.959 6.906 257 HH22 ARG 56 2HH2 ARG 56 -12.467 5.700 8.076 258 H TYR 57 H TYR 57 -10.346 7.876 2.460 259 HA TYR 57 HA TYR 57 -9.105 5.616 1.233 260 HB2 TYR 57 1HB TYR 57 -8.249 7.592 3.326 261 HB3 TYR 57 2HB TYR 57 -7.244 6.206 2.915 262 HD1 TYR 57 HD1 TYR 57 -6.670 5.911 0.408 263 HD2 TYR 57 HD2 TYR 57 -8.049 9.558 2.101 264 HE1 TYR 57 HE1 TYR 57 -5.717 7.141 -1.490 265 HE2 TYR 57 HE2 TYR 57 -7.099 10.803 0.208 266 HH TYR 57 HH TYR 57 -5.974 9.256 -2.630 267 HA PRO 58 HA PRO 58 -10.169 2.485 4.143 268 HB2 PRO 58 1HB PRO 58 -8.191 0.728 3.593 269 HB3 PRO 58 2HB PRO 58 -9.526 1.028 2.472 270 HG2 PRO 58 1HG PRO 58 -6.747 2.153 2.448 271 HG3 PRO 58 2HG PRO 58 -7.686 1.485 1.099 272 HD2 PRO 58 1HD PRO 58 -7.469 4.139 1.530 273 HD3 PRO 58 2HD PRO 58 -8.943 3.408 0.865 274 H THR 59 H THR 59 -9.706 1.973 6.220 275 HA THR 59 HA THR 59 -7.515 3.182 7.582 276 HB THR 59 HB THR 59 -9.121 0.941 8.757 277 HG1 THR 59 HG1 THR 59 -10.870 2.025 8.147 278 HG21 THR 59 1HG2 THR 59 -7.490 1.933 10.219 279 HG22 THR 59 2HG2 THR 59 -9.086 2.463 10.742 280 HG23 THR 59 3HG2 THR 59 -8.052 3.554 9.821 281 H THR 60 H THR 60 -6.304 1.512 9.199 282 HA THR 60 HA THR 60 -4.272 0.526 7.642 283 HB THR 60 HB THR 60 -3.911 1.084 9.955 284 HG1 THR 60 HG1 THR 60 -2.589 -0.598 8.890 285 HG21 THR 60 1HG2 THR 60 -6.017 0.318 10.913 286 HG22 THR 60 2HG2 THR 60 -4.649 -0.373 11.785 287 HG23 THR 60 3HG2 THR 60 -5.551 -1.359 10.633 288 H GLU 61 H GLU 61 -6.946 -1.379 9.039 289 HA GLU 61 HA GLU 61 -5.877 -3.847 8.013 290 HB2 GLU 61 1HB GLU 61 -7.281 -3.769 10.048 291 HB3 GLU 61 2HB GLU 61 -8.641 -3.230 9.076 292 HG2 GLU 61 1HG GLU 61 -8.827 -5.586 9.588 293 HG3 GLU 61 2HG GLU 61 -8.618 -5.341 7.856 294 H GLN 62 H GLN 62 -8.279 -1.500 7.013 295 HA GLN 62 HA GLN 62 -9.461 -3.125 4.999 296 HB2 GLN 62 1HB GLN 62 -9.534 -0.120 5.296 297 HB3 GLN 62 2HB GLN 62 -10.624 -1.093 4.317 298 HG2 GLN 62 1HG GLN 62 -11.498 -2.163 6.308 299 HG3 GLN 62 2HG GLN 62 -10.370 -1.252 7.310 300 HE21 GLN 62 1HE2 GLN 62 -13.800 0.427 5.986 301 HE22 GLN 62 2HE2 GLN 62 -13.283 -1.127 5.438 302 H GLY 63 H GLY 63 -6.795 -0.861 5.051 303 HA2 GLY 63 1HA GLY 63 -6.617 -0.351 2.284 304 HA3 GLY 63 2HA GLY 63 -5.300 -0.205 3.436 305 H LEU 64 H LEU 64 -4.913 -2.732 4.285 306 HA LEU 64 HA LEU 64 -3.520 -3.905 2.113 307 HB2 LEU 64 1HB LEU 64 -3.649 -4.181 4.941 308 HB3 LEU 64 2HB LEU 64 -3.844 -5.771 4.231 309 HG LEU 64 HG LEU 64 -1.732 -5.483 3.009 310 HD11 LEU 64 1HD1 LEU 64 -0.257 -3.593 3.562 311 HD12 LEU 64 2HD1 LEU 64 -1.562 -2.872 4.514 312 HD13 LEU 64 3HD1 LEU 64 -1.743 -3.060 2.770 313 HD21 LEU 64 1HD2 LEU 64 -0.263 -5.682 4.930 314 HD22 LEU 64 2HD2 LEU 64 -1.779 -6.532 5.229 315 HD23 LEU 64 3HD2 LEU 64 -1.492 -4.958 5.967 316 H GLN 65 H GLN 65 -6.595 -4.565 3.679 317 HA GLN 65 HA GLN 65 -7.015 -7.077 2.398 318 HB2 GLN 65 1HB GLN 65 -8.859 -5.196 3.854 319 HB3 GLN 65 2HB GLN 65 -9.425 -6.695 3.132 320 HG2 GLN 65 1HG GLN 65 -7.395 -6.392 5.332 321 HG3 GLN 65 2HG GLN 65 -9.032 -7.035 5.468 322 HE21 GLN 65 1HE2 GLN 65 -5.969 -9.361 4.237 323 HE22 GLN 65 2HE2 GLN 65 -5.776 -7.672 4.562 324 H ALA 66 H ALA 66 -7.448 -3.815 1.380 325 HA ALA 66 HA ALA 66 -9.740 -4.029 -0.197 326 HB1 ALA 66 1HB ALA 66 -8.996 -1.981 -1.275 327 HB2 ALA 66 2HB ALA 66 -7.382 -2.200 -0.600 328 HB3 ALA 66 3HB ALA 66 -8.753 -1.905 0.470 329 H LEU 67 H LEU 67 -6.457 -4.972 -0.907 330 HA LEU 67 HA LEU 67 -7.230 -5.495 -3.681 331 HB2 LEU 67 1HB LEU 67 -4.835 -5.824 -4.140 332 HB3 LEU 67 2HB LEU 67 -5.246 -4.203 -3.643 333 HG LEU 67 HG LEU 67 -4.025 -6.235 -1.773 334 HD11 LEU 67 1HD1 LEU 67 -2.648 -4.145 -3.463 335 HD12 LEU 67 2HD1 LEU 67 -2.553 -5.892 -3.698 336 HD13 LEU 67 3HD1 LEU 67 -1.881 -5.162 -2.241 337 HD21 LEU 67 1HD2 LEU 67 -3.294 -4.180 -0.575 338 HD22 LEU 67 2HD2 LEU 67 -5.042 -4.379 -0.612 339 HD23 LEU 67 3HD2 LEU 67 -4.266 -3.225 -1.694 340 H VAL 68 H VAL 68 -7.236 -7.060 -0.865 341 HA VAL 68 HA VAL 68 -6.270 -9.604 -1.989 342 HB VAL 68 HB VAL 68 -6.568 -8.709 0.871 343 HG11 VAL 68 1HG1 VAL 68 -7.148 -11.073 0.686 344 HG12 VAL 68 2HG1 VAL 68 -5.599 -10.872 1.504 345 HG13 VAL 68 3HG1 VAL 68 -5.647 -11.381 -0.184 346 HG21 VAL 68 1HG2 VAL 68 -4.134 -8.994 0.946 347 HG22 VAL 68 2HG2 VAL 68 -4.633 -7.779 -0.229 348 HG23 VAL 68 3HG2 VAL 68 -4.141 -9.383 -0.773 349 H SER 69 H SER 69 -8.679 -8.427 0.331 350 HA SER 69 HA SER 69 -10.804 -9.877 -0.956 351 HB2 SER 69 1HB SER 69 -11.378 -11.086 1.227 352 HB3 SER 69 2HB SER 69 -10.006 -11.726 0.323 353 HG SER 69 HG SER 69 -9.641 -9.806 2.364 354 H ALA 70 H ALA 70 -12.771 -8.942 -0.485 355 HA ALA 70 HA ALA 70 -12.719 -6.263 0.207 356 HB1 ALA 70 1HB ALA 70 -14.493 -7.274 -1.126 357 HB2 ALA 70 2HB ALA 70 -15.153 -6.362 0.231 358 HB3 ALA 70 3HB ALA 70 -15.085 -8.123 0.302 359 HA PRO 71 HA PRO 71 -12.246 -6.415 4.630 360 HB2 PRO 71 1HB PRO 71 -13.257 -3.632 4.359 361 HB3 PRO 71 2HB PRO 71 -11.806 -4.229 5.173 362 HG2 PRO 71 1HG PRO 71 -11.633 -2.975 2.835 363 HG3 PRO 71 2HG PRO 71 -10.599 -4.368 3.196 364 HD2 PRO 71 1HD PRO 71 -13.036 -4.212 1.477 365 HD3 PRO 71 2HD PRO 71 -11.542 -5.142 1.240 366 H SER 72 H SER 72 -13.612 -6.966 6.205 367 HA SER 72 HA SER 72 -16.471 -6.631 5.782 368 HB2 SER 72 1HB SER 72 -14.995 -8.046 8.018 369 HB3 SER 72 2HB SER 72 -16.726 -8.137 7.693 370 HG SER 72 HG SER 72 -14.722 -8.911 5.835 371 H ALA 73 H ALA 73 -14.136 -4.739 6.875 372 HA ALA 73 HA ALA 73 -15.498 -3.618 9.188 373 HB1 ALA 73 1HB ALA 73 -12.973 -2.764 7.768 374 HB2 ALA 73 2HB ALA 73 -13.055 -3.774 9.212 375 HB3 ALA 73 3HB ALA 73 -13.581 -2.091 9.279 376 H GLU 74 H GLU 74 -16.329 -1.506 9.229 377 HA GLU 74 HA GLU 74 -17.518 -0.645 6.764 378 HB2 GLU 74 1HB GLU 74 -17.640 0.328 9.605 379 HB3 GLU 74 2HB GLU 74 -18.380 1.238 8.295 380 HG2 GLU 74 1HG GLU 74 -19.006 -1.648 8.839 381 HG3 GLU 74 2HG GLU 74 -19.901 -0.311 9.564 382 HA PRO 75 HA PRO 75 -18.255 0.918 5.651 383 HB2 PRO 75 1HB PRO 75 -17.702 1.887 3.211 384 HB3 PRO 75 2HB PRO 75 -18.080 2.955 4.568 385 HG2 PRO 75 1HG PRO 75 -15.419 2.236 3.403 386 HG3 PRO 75 2HG PRO 75 -16.016 3.816 3.939 387 HD2 PRO 75 1HD PRO 75 -14.381 2.211 5.443 388 HD3 PRO 75 2HD PRO 75 -15.503 3.400 6.133 389 H HIS 76 H HIS 76 -18.775 -0.996 4.837 390 HA HIS 76 HA HIS 76 -16.877 -2.900 4.013 391 HB2 HIS 76 1HB HIS 76 -19.214 -3.303 4.956 392 HB3 HIS 76 2HB HIS 76 -19.820 -2.970 3.337 393 HD1 HIS 76 HD1 HIS 76 -18.713 -5.668 5.429 394 HD2 HIS 76 HD2 HIS 76 -18.634 -4.858 1.356 395 HE1 HIS 76 HE1 HIS 76 -18.317 -7.881 4.307 396 HE2 HIS 76 HE2 HIS 76 -18.509 -7.389 1.847 397 H ALA 77 H ALA 77 -15.932 -3.238 2.131 398 HA ALA 77 HA ALA 77 -16.129 -1.450 -0.008 399 HB1 ALA 77 1HB ALA 77 -14.121 -2.732 0.451 400 HB2 ALA 77 2HB ALA 77 -14.665 -3.010 -1.202 401 HB3 ALA 77 3HB ALA 77 -14.958 -4.227 0.039 402 H ARG 78 H ARG 78 -17.313 -1.379 -1.799 403 HA ARG 78 HA ARG 78 -19.119 -3.635 -2.384 404 HB2 ARG 78 1HB ARG 78 -19.581 -0.673 -2.786 405 HB3 ARG 78 2HB ARG 78 -20.667 -1.937 -3.342 406 HG2 ARG 78 1HG ARG 78 -19.942 -1.421 -0.466 407 HG3 ARG 78 2HG ARG 78 -21.420 -0.875 -1.262 408 HD2 ARG 78 1HD ARG 78 -20.557 -3.740 -0.877 409 HD3 ARG 78 2HD ARG 78 -21.818 -2.904 0.024 410 HE ARG 78 HE ARG 78 -22.102 -3.112 -2.879 411 HH11 ARG 78 1HH1 ARG 78 -23.115 -4.137 0.311 412 HH12 ARG 78 2HH1 ARG 78 -24.592 -4.851 -0.255 413 HH21 ARG 78 1HH2 ARG 78 -24.023 -4.061 -3.623 414 HH22 ARG 78 2HH2 ARG 78 -25.105 -4.818 -2.497 415 H ASN 79 H ASN 79 -19.476 -4.156 -4.549 416 HA ASN 79 HA ASN 79 -18.963 -4.464 -6.739 417 HB2 ASN 79 1HB ASN 79 -18.227 -1.536 -6.537 418 HB3 ASN 79 2HB ASN 79 -18.293 -2.429 -8.052 419 HD21 ASN 79 1HD2 ASN 79 -21.509 -0.611 -7.148 420 HD22 ASN 79 2HD2 ASN 79 -19.853 -0.135 -6.989 421 H TYR 80 H TYR 80 -17.132 -5.389 -4.997 422 HA TYR 80 HA TYR 80 -14.490 -4.559 -5.921 423 HB2 TYR 80 1HB TYR 80 -13.633 -5.937 -4.092 424 HB3 TYR 80 2HB TYR 80 -14.864 -4.832 -3.493 425 HD1 TYR 80 HD1 TYR 80 -13.948 -8.310 -4.020 426 HD2 TYR 80 HD2 TYR 80 -17.093 -5.694 -2.846 427 HE1 TYR 80 HE1 TYR 80 -15.150 -10.209 -3.029 428 HE2 TYR 80 HE2 TYR 80 -18.306 -7.592 -1.853 429 HH TYR 80 HH TYR 80 -16.857 -10.602 -1.293 430 HA PRO 81 HA PRO 81 -14.078 -8.168 -8.494 431 HB2 PRO 81 1HB PRO 81 -11.382 -8.421 -8.551 432 HB3 PRO 81 2HB PRO 81 -12.234 -7.139 -9.416 433 HG2 PRO 81 1HG PRO 81 -10.739 -7.022 -6.844 434 HG3 PRO 81 2HG PRO 81 -10.847 -5.817 -8.138 435 HD2 PRO 81 1HD PRO 81 -12.271 -5.721 -5.775 436 HD3 PRO 81 2HD PRO 81 -12.743 -4.901 -7.273 437 H GLU 82 H GLU 82 -14.041 -10.352 -8.197 438 HA GLU 82 HA GLU 82 -13.868 -11.394 -5.580 439 HB2 GLU 82 1HB GLU 82 -13.820 -12.833 -8.238 440 HB3 GLU 82 2HB GLU 82 -14.023 -13.617 -6.678 441 HG2 GLU 82 1HG GLU 82 -16.074 -12.260 -6.331 442 HG3 GLU 82 2HG GLU 82 -15.894 -11.654 -7.978 443 H GLY 83 H GLY 83 -12.180 -12.047 -4.426 444 HA2 GLY 83 1HA GLY 83 -10.053 -12.823 -3.938 445 HA3 GLY 83 2HA GLY 83 -9.783 -13.069 -5.658 446 H GLY 84 H GLY 84 -10.975 -10.003 -5.023 447 HA2 GLY 84 1HA GLY 84 -10.066 -7.910 -5.117 448 HA3 GLY 84 2HA GLY 84 -8.726 -8.568 -4.191 449 H TYR 85 H TYR 85 -6.856 -8.259 -5.116 450 HA TYR 85 HA TYR 85 -6.630 -8.618 -8.027 451 HB2 TYR 85 1HB TYR 85 -5.202 -6.578 -6.300 452 HB3 TYR 85 2HB TYR 85 -4.813 -6.899 -7.986 453 HD1 TYR 85 HD1 TYR 85 -6.938 -5.070 -5.729 454 HD2 TYR 85 HD2 TYR 85 -6.608 -6.471 -9.734 455 HE1 TYR 85 HE1 TYR 85 -8.646 -3.450 -6.431 456 HE2 TYR 85 HE2 TYR 85 -8.314 -4.850 -10.445 457 HH TYR 85 HH TYR 85 -10.111 -3.550 -9.545 458 H ILE 86 H ILE 86 -5.132 -8.792 -4.855 459 HA ILE 86 HA ILE 86 -3.564 -11.083 -5.817 460 HB ILE 86 HB ILE 86 -2.016 -9.273 -5.329 461 HG12 ILE 86 1HG1 ILE 86 -1.959 -11.333 -3.116 462 HG13 ILE 86 2HG1 ILE 86 -1.369 -11.591 -4.753 463 HG21 ILE 86 1HG2 ILE 86 -3.240 -9.204 -2.580 464 HG22 ILE 86 2HG2 ILE 86 -3.385 -7.960 -3.821 465 HG23 ILE 86 3HG2 ILE 86 -1.814 -8.301 -3.093 466 HD11 ILE 86 1HD1 ILE 86 0.443 -11.129 -3.195 467 HD12 ILE 86 2HD1 ILE 86 -0.287 -9.572 -2.802 468 HD13 ILE 86 3HD1 ILE 86 0.320 -9.876 -4.430 469 H ARG 87 H ARG 87 -3.914 -12.945 -4.712 470 HA ARG 87 HA ARG 87 -6.279 -12.988 -3.143 471 HB2 ARG 87 1HB ARG 87 -4.345 -15.189 -3.841 472 HB3 ARG 87 2HB ARG 87 -5.855 -15.448 -2.978 473 HG2 ARG 87 1HG ARG 87 -7.026 -14.387 -4.940 474 HG3 ARG 87 2HG ARG 87 -5.484 -14.471 -5.795 475 HD2 ARG 87 1HD ARG 87 -6.814 -16.389 -6.381 476 HD3 ARG 87 2HD ARG 87 -5.449 -16.915 -5.398 477 HE ARG 87 HE ARG 87 -7.871 -16.401 -3.914 478 HH11 ARG 87 1HH1 ARG 87 -5.994 -18.791 -5.653 479 HH12 ARG 87 2HH1 ARG 87 -6.753 -20.137 -4.869 480 HH21 ARG 87 1HH2 ARG 87 -8.873 -18.169 -2.890 481 HH22 ARG 87 2HH2 ARG 87 -8.389 -19.786 -3.293 482 H ARG 88 H ARG 88 -2.965 -12.790 -2.263 483 HA ARG 88 HA ARG 88 -3.734 -13.218 0.541 484 HB2 ARG 88 1HB ARG 88 -1.178 -14.128 -0.791 485 HB3 ARG 88 2HB ARG 88 -1.458 -14.152 0.943 486 HG2 ARG 88 1HG ARG 88 -3.319 -15.713 0.612 487 HG3 ARG 88 2HG ARG 88 -2.996 -15.710 -1.124 488 HD2 ARG 88 1HD ARG 88 -1.994 -17.658 -0.069 489 HD3 ARG 88 2HD ARG 88 -0.748 -16.581 -0.699 490 HE ARG 88 HE ARG 88 -1.393 -16.158 2.081 491 HH11 ARG 88 1HH1 ARG 88 0.611 -17.915 -0.183 492 HH12 ARG 88 2HH1 ARG 88 1.847 -18.263 0.982 493 HH21 ARG 88 1HH2 ARG 88 0.240 -16.597 3.617 494 HH22 ARG 88 2HH2 ARG 88 1.638 -17.514 3.149 495 H LEU 89 H LEU 89 -2.186 -12.184 2.073 496 HA LEU 89 HA LEU 89 -1.873 -9.464 1.498 497 HB2 LEU 89 1HB LEU 89 -0.655 -11.195 3.641 498 HB3 LEU 89 2HB LEU 89 -0.407 -9.461 3.566 499 HG LEU 89 HG LEU 89 -3.073 -10.838 3.910 500 HD11 LEU 89 1HD1 LEU 89 -2.992 -9.885 6.167 501 HD12 LEU 89 2HD1 LEU 89 -1.365 -9.285 5.849 502 HD13 LEU 89 3HD1 LEU 89 -1.672 -11.021 5.886 503 HD21 LEU 89 1HD2 LEU 89 -3.893 -8.547 4.358 504 HD22 LEU 89 2HD2 LEU 89 -3.341 -8.769 2.701 505 HD23 LEU 89 3HD2 LEU 89 -2.323 -7.918 3.860 506 HA PRO 90 HA PRO 90 1.871 -9.579 -0.895 507 HB2 PRO 90 1HB PRO 90 2.300 -6.883 -0.911 508 HB3 PRO 90 2HB PRO 90 1.136 -7.689 -1.968 509 HG2 PRO 90 1HG PRO 90 0.669 -6.218 0.591 510 HG3 PRO 90 2HG PRO 90 -0.283 -6.196 -0.904 511 HD2 PRO 90 1HD PRO 90 -1.012 -7.640 1.266 512 HD3 PRO 90 2HD PRO 90 -1.367 -8.165 -0.392 513 H GLN 91 H GLN 91 3.983 -9.694 -0.370 514 HA GLN 91 HA GLN 91 4.879 -8.455 2.138 515 HB2 GLN 91 1HB GLN 91 5.472 -11.299 1.289 516 HB3 GLN 91 2HB GLN 91 6.064 -10.508 2.743 517 HG2 GLN 91 1HG GLN 91 3.823 -10.352 3.620 518 HG3 GLN 91 2HG GLN 91 3.164 -11.030 2.133 519 HE21 GLN 91 1HE2 GLN 91 3.121 -14.053 3.841 520 HE22 GLN 91 2HE2 GLN 91 2.213 -12.739 3.180 521 H ASP 92 H ASP 92 6.931 -7.650 2.079 522 HA ASP 92 HA ASP 92 8.116 -7.252 -0.473 523 HB2 ASP 92 1HB ASP 92 9.933 -6.104 0.739 524 HB3 ASP 92 2HB ASP 92 8.351 -5.540 1.248 525 HA PRO 93 HA PRO 93 10.461 -10.728 -1.262 526 HB2 PRO 93 1HB PRO 93 12.911 -9.145 -1.714 527 HB3 PRO 93 2HB PRO 93 12.000 -10.158 -2.838 528 HG2 PRO 93 1HG PRO 93 11.955 -7.479 -2.991 529 HG3 PRO 93 2HG PRO 93 10.539 -8.467 -3.385 530 HD2 PRO 93 1HD PRO 93 11.108 -6.860 -0.942 531 HD3 PRO 93 2HD PRO 93 9.572 -7.130 -1.787 532 H TRP 94 H TRP 94 11.665 -8.612 1.167 533 HA TRP 94 HA TRP 94 13.817 -10.353 1.961 534 HB2 TRP 94 1HB TRP 94 12.671 -7.920 3.337 535 HB3 TRP 94 2HB TRP 94 14.172 -8.738 3.764 536 HD1 TRP 94 HD1 TRP 94 16.167 -8.637 1.844 537 HE1 TRP 94 HE1 TRP 94 16.728 -6.760 0.173 538 HE3 TRP 94 HE3 TRP 94 11.730 -6.107 1.948 539 HZ2 TRP 94 HZ2 TRP 94 15.458 -4.505 -0.944 540 HZ3 TRP 94 HZ3 TRP 94 11.485 -4.099 0.549 541 HH2 TRP 94 HH2 TRP 94 13.312 -3.316 -0.867 542 H GLY 95 H GLY 95 10.473 -9.807 2.820 543 HA2 GLY 95 1HA GLY 95 9.519 -12.020 3.557 544 HA3 GLY 95 2HA GLY 95 10.758 -11.989 4.797 545 H SER 96 H SER 96 9.468 -8.891 4.198 546 HA SER 96 HA SER 96 7.895 -9.161 6.666 547 HB2 SER 96 1HB SER 96 8.891 -6.621 5.372 548 HB3 SER 96 2HB SER 96 8.194 -6.798 6.982 549 HG SER 96 HG SER 96 10.749 -7.163 6.160 550 H ASP 97 H ASP 97 5.826 -8.288 6.824 551 HA ASP 97 HA ASP 97 4.310 -8.347 4.355 552 HB2 ASP 97 1HB ASP 97 3.439 -7.977 7.233 553 HB3 ASP 97 2HB ASP 97 2.348 -8.162 5.868 554 H TYR 98 H TYR 98 3.483 -6.614 3.313 555 HA TYR 98 HA TYR 98 4.348 -3.991 3.852 556 HB2 TYR 98 1HB TYR 98 2.084 -5.051 2.163 557 HB3 TYR 98 2HB TYR 98 2.453 -3.335 2.265 558 HD1 TYR 98 HD1 TYR 98 4.456 -2.437 1.195 559 HD2 TYR 98 HD2 TYR 98 3.568 -6.587 1.037 560 HE1 TYR 98 HE1 TYR 98 6.119 -2.723 -0.596 561 HE2 TYR 98 HE2 TYR 98 5.226 -6.887 -0.740 562 HH TYR 98 HH TYR 98 6.328 -5.587 -2.457 563 H GLN 99 H GLN 99 3.214 -2.172 4.674 564 HA GLN 99 HA GLN 99 0.833 -2.852 6.256 565 HB2 GLN 99 1HB GLN 99 3.207 -1.242 7.209 566 HB3 GLN 99 2HB GLN 99 1.694 -1.418 8.089 567 HG2 GLN 99 1HG GLN 99 3.583 -3.646 7.363 568 HG3 GLN 99 2HG GLN 99 3.413 -2.906 8.953 569 HE21 GLN 99 1HE2 GLN 99 1.408 -6.096 8.493 570 HE22 GLN 99 2HE2 GLN 99 3.013 -5.674 8.008 571 H LEU 100 H LEU 100 -0.711 -1.344 6.409 572 HA LEU 100 HA LEU 100 -0.294 1.211 5.005 573 HB2 LEU 100 1HB LEU 100 -2.005 -0.303 4.026 574 HB3 LEU 100 2HB LEU 100 -2.856 -0.320 5.554 575 HG LEU 100 HG LEU 100 -3.803 1.135 3.680 576 HD11 LEU 100 1HD1 LEU 100 -4.648 1.371 5.903 577 HD12 LEU 100 2HD1 LEU 100 -4.411 2.977 5.218 578 HD13 LEU 100 3HD1 LEU 100 -3.252 2.337 6.383 579 HD21 LEU 100 1HD2 LEU 100 -1.684 3.069 4.552 580 HD22 LEU 100 2HD2 LEU 100 -2.856 3.239 3.244 581 HD23 LEU 100 3HD2 LEU 100 -1.545 2.072 3.108 582 H LEU 101 H LEU 101 -0.238 2.959 6.295 583 HA LEU 101 HA LEU 101 -0.988 2.532 9.108 584 HB2 LEU 101 1HB LEU 101 1.418 2.989 8.440 585 HB3 LEU 101 2HB LEU 101 0.906 4.604 8.008 586 HG LEU 101 HG LEU 101 2.033 4.232 10.292 587 HD11 LEU 101 1HD1 LEU 101 -0.591 5.695 10.135 588 HD12 LEU 101 2HD1 LEU 101 0.987 6.325 9.659 589 HD13 LEU 101 3HD1 LEU 101 0.662 5.947 11.351 590 HD21 LEU 101 1HD2 LEU 101 0.559 3.609 12.114 591 HD22 LEU 101 2HD2 LEU 101 0.699 2.288 10.954 592 HD23 LEU 101 3HD2 LEU 101 -0.748 3.295 10.974 593 H SER 102 H SER 102 -2.892 3.344 9.560 594 HA SER 102 HA SER 102 -3.654 5.971 8.496 595 HB2 SER 102 1HB SER 102 -5.944 5.295 9.373 596 HB3 SER 102 2HB SER 102 -5.326 4.327 8.033 597 HG SER 102 HG SER 102 -4.927 3.575 10.735 598 HA PRO 103 HA PRO 103 -4.365 7.753 8.797 599 HB2 PRO 103 1HB PRO 103 -3.811 10.242 9.598 600 HB3 PRO 103 2HB PRO 103 -5.292 9.428 10.118 601 HG2 PRO 103 1HG PRO 103 -2.729 9.832 11.604 602 HG3 PRO 103 2HG PRO 103 -4.396 9.969 12.191 603 HD2 PRO 103 1HD PRO 103 -2.787 7.761 12.560 604 HD3 PRO 103 2HD PRO 103 -4.559 7.728 12.587 605 H GLY 104 H GLY 104 -3.034 8.962 7.286 606 HA2 GLY 104 1HA GLY 104 -0.402 7.863 7.241 607 HA3 GLY 104 2HA GLY 104 -1.092 8.955 6.052 608 H GLN 105 H GLN 105 1.547 8.998 6.923 609 HA GLN 105 HA GLN 105 1.768 11.395 8.595 610 HB2 GLN 105 1HB GLN 105 3.265 9.524 9.116 611 HB3 GLN 105 2HB GLN 105 3.866 9.522 7.467 612 HG2 GLN 105 1HG GLN 105 4.699 11.855 7.871 613 HG3 GLN 105 2HG GLN 105 4.278 11.633 9.568 614 HE21 GLN 105 1HE2 GLN 105 6.744 8.749 9.491 615 HE22 GLN 105 2HE2 GLN 105 5.015 8.788 9.494 616 H HIS 106 H HIS 106 2.300 10.149 5.360 617 HA HIS 106 HA HIS 106 3.185 12.804 4.433 618 HB2 HIS 106 1HB HIS 106 3.146 10.215 2.871 619 HB3 HIS 106 2HB HIS 106 3.962 11.710 2.432 620 HD1 HIS 106 HD1 HIS 106 4.500 8.515 4.029 621 HD2 HIS 106 HD2 HIS 106 6.196 12.312 4.282 622 HE1 HIS 106 HE1 HIS 106 6.753 8.190 5.117 623 HE2 HIS 106 HE2 HIS 106 7.741 10.500 5.298 624 H GLY 107 H GLY 107 0.418 11.228 4.919 625 HA2 GLY 107 1HA GLY 107 -1.146 12.873 3.236 626 HA3 GLY 107 2HA GLY 107 -1.029 11.258 2.547 627 H GLN 108 H GLN 108 -3.344 11.069 2.895 628 HA GLN 108 HA GLN 108 -4.328 11.026 5.581 629 HB2 GLN 108 1HB GLN 108 -5.533 9.952 3.032 630 HB3 GLN 108 2HB GLN 108 -6.358 9.982 4.585 631 HG2 GLN 108 1HG GLN 108 -5.473 12.316 2.919 632 HG3 GLN 108 2HG GLN 108 -7.115 11.852 3.358 633 HE21 GLN 108 1HE2 GLN 108 -6.108 12.791 6.908 634 HE22 GLN 108 2HE2 GLN 108 -6.290 11.246 6.150 635 H VAL 109 H VAL 109 -2.926 8.715 3.416 636 HA VAL 109 HA VAL 109 -2.685 6.831 5.628 637 HB VAL 109 HB VAL 109 -3.189 4.911 4.077 638 HG11 VAL 109 1HG1 VAL 109 -5.609 5.035 4.320 639 HG12 VAL 109 2HG1 VAL 109 -5.489 6.762 4.659 640 HG13 VAL 109 3HG1 VAL 109 -4.787 5.592 5.777 641 HG21 VAL 109 1HG2 VAL 109 -4.580 5.347 2.109 642 HG22 VAL 109 2HG2 VAL 109 -2.988 6.091 1.959 643 HG23 VAL 109 3HG2 VAL 109 -4.390 7.081 2.366 644 H ASP 110 H ASP 110 -0.860 5.433 5.405 645 HA ASP 110 HA ASP 110 0.908 6.094 3.144 646 HB2 ASP 110 1HB ASP 110 1.475 6.194 6.047 647 HB3 ASP 110 2HB ASP 110 2.730 5.489 5.033 648 H ILE 111 H ILE 111 1.787 4.473 2.094 649 HA ILE 111 HA ILE 111 1.509 1.754 3.189 650 HB ILE 111 HB ILE 111 1.791 1.077 0.727 651 HG12 ILE 111 1HG1 ILE 111 1.014 3.979 0.372 652 HG13 ILE 111 2HG1 ILE 111 2.549 3.255 -0.093 653 HG21 ILE 111 1HG2 ILE 111 -0.316 0.904 2.002 654 HG22 ILE 111 2HG2 ILE 111 -0.571 1.249 0.291 655 HG23 ILE 111 3HG2 ILE 111 -0.730 2.539 1.480 656 HD11 ILE 111 1HD1 ILE 111 1.116 3.580 -2.004 657 HD12 ILE 111 2HD1 ILE 111 -0.141 2.593 -1.259 658 HD13 ILE 111 3HD1 ILE 111 1.396 1.863 -1.725 659 H PHE 112 H PHE 112 3.341 0.657 3.588 660 HA PHE 112 HA PHE 112 5.779 1.326 2.165 661 HB2 PHE 112 1HB PHE 112 7.001 1.568 4.405 662 HB3 PHE 112 2HB PHE 112 6.047 2.936 3.846 663 HD1 PHE 112 HD1 PHE 112 6.035 0.050 6.168 664 HD2 PHE 112 HD2 PHE 112 4.300 3.797 5.141 665 HE1 PHE 112 HE1 PHE 112 4.811 0.066 8.301 666 HE2 PHE 112 HE2 PHE 112 3.075 3.819 7.271 667 HZ PHE 112 HZ PHE 112 3.330 1.951 8.856 668 H SER 113 H SER 113 7.534 -0.107 2.605 669 HA SER 113 HA SER 113 6.688 -2.748 3.566 670 HB2 SER 113 1HB SER 113 8.814 -3.458 2.288 671 HB3 SER 113 2HB SER 113 7.430 -2.938 1.324 672 HG SER 113 HG SER 113 8.457 -1.151 0.764 673 H LEU 114 H LEU 114 8.058 -3.895 4.988 674 HA LEU 114 HA LEU 114 9.394 -2.099 6.841 675 HB2 LEU 114 1HB LEU 114 8.482 -4.946 6.970 676 HB3 LEU 114 2HB LEU 114 9.562 -4.302 8.185 677 HG LEU 114 HG LEU 114 7.909 -2.699 8.904 678 HD11 LEU 114 1HD1 LEU 114 5.668 -2.616 7.942 679 HD12 LEU 114 2HD1 LEU 114 6.156 -3.768 6.698 680 HD13 LEU 114 3HD1 LEU 114 6.897 -2.167 6.758 681 HD21 LEU 114 1HD2 LEU 114 7.782 -4.935 9.854 682 HD22 LEU 114 2HD2 LEU 114 6.692 -5.433 8.561 683 HD23 LEU 114 3HD2 LEU 114 6.178 -4.211 9.725 684 H GLY 115 H GLY 115 10.169 -4.506 4.493 685 HA2 GLY 115 1HA GLY 115 12.186 -4.692 3.401 686 HA3 GLY 115 2HA GLY 115 12.871 -3.541 4.532 687 HA PRO 116 HA PRO 116 14.845 -7.627 5.304 688 HB2 PRO 116 1HB PRO 116 17.219 -5.988 5.775 689 HB3 PRO 116 2HB PRO 116 16.975 -7.289 4.611 690 HG2 PRO 116 1HG PRO 116 17.204 -4.697 3.870 691 HG3 PRO 116 2HG PRO 116 16.213 -5.864 2.976 692 HD2 PRO 116 1HD PRO 116 15.367 -3.762 4.933 693 HD3 PRO 116 2HD PRO 116 14.591 -4.264 3.414 694 H ASP 117 H ASP 117 14.728 -4.647 7.062 695 HA ASP 117 HA ASP 117 15.776 -5.831 9.505 696 HB2 ASP 117 1HB ASP 117 15.117 -3.443 10.361 697 HB3 ASP 117 2HB ASP 117 16.522 -3.644 9.316 698 H GLY 118 H GLY 118 12.765 -5.382 7.990 699 HA2 GLY 118 1HA GLY 118 10.700 -6.156 8.640 700 HA3 GLY 118 2HA GLY 118 11.455 -6.784 10.096 701 H VAL 119 H VAL 119 11.986 -3.425 9.576 702 HA VAL 119 HA VAL 119 9.983 -2.916 11.666 703 HB VAL 119 HB VAL 119 11.349 -1.013 12.419 704 HG11 VAL 119 1HG1 VAL 119 12.743 -3.683 12.355 705 HG12 VAL 119 2HG1 VAL 119 11.573 -3.124 13.550 706 HG13 VAL 119 3HG1 VAL 119 13.157 -2.356 13.439 707 HG21 VAL 119 1HG2 VAL 119 13.393 -2.033 10.448 708 HG22 VAL 119 2HG2 VAL 119 13.673 -0.794 11.672 709 HG23 VAL 119 3HG2 VAL 119 12.535 -0.495 10.357 710 HA PRO 120 HA PRO 120 8.023 -0.159 8.768 711 HB2 PRO 120 1HB PRO 120 5.894 0.390 10.310 712 HB3 PRO 120 2HB PRO 120 6.078 -1.172 9.503 713 HG2 PRO 120 1HG PRO 120 6.609 -0.436 12.349 714 HG3 PRO 120 2HG PRO 120 5.841 -1.894 11.693 715 HD2 PRO 120 1HD PRO 120 8.463 -1.762 12.502 716 HD3 PRO 120 2HD PRO 120 7.849 -2.915 11.302 717 H GLU 121 H GLU 121 7.606 2.067 8.646 718 HA GLU 121 HA GLU 121 7.848 4.278 9.076 719 HB2 GLU 121 1HB GLU 121 6.397 3.733 11.052 720 HB3 GLU 121 2HB GLU 121 7.858 3.523 12.007 721 HG2 GLU 121 1HG GLU 121 8.453 5.854 11.628 722 HG3 GLU 121 2HG GLU 121 7.007 6.069 10.644 723 H SER 122 H SER 122 10.040 2.796 8.447 724 HA SER 122 HA SER 122 12.174 4.110 9.981 725 HB2 SER 122 1HB SER 122 13.508 2.068 8.943 726 HB3 SER 122 2HB SER 122 12.574 1.885 10.430 727 HG SER 122 HG SER 122 12.274 0.599 8.112 728 H ASN 123 H ASN 123 14.299 4.071 8.483 729 HA ASN 123 HA ASN 123 13.633 5.821 6.312 730 HB2 ASN 123 1HB ASN 123 16.229 4.738 7.377 731 HB3 ASN 123 2HB ASN 123 16.176 5.674 5.889 732 HD21 ASN 123 1HD2 ASN 123 15.794 7.464 9.502 733 HD22 ASN 123 2HD2 ASN 123 15.805 5.743 9.341 734 H ASP 124 H ASP 124 14.514 2.468 6.611 735 HA ASP 124 HA ASP 124 15.281 2.008 3.917 736 HB2 ASP 124 1HB ASP 124 15.122 -0.340 4.451 737 HB3 ASP 124 2HB ASP 124 15.787 0.488 5.857 738 H ASP 125 H ASP 125 12.259 2.270 5.530 739 HA ASP 125 HA ASP 125 10.562 0.569 4.237 740 HB2 ASP 125 1HB ASP 125 10.145 3.329 5.344 741 HB3 ASP 125 2HB ASP 125 8.817 2.428 4.634 742 H ILE 126 H ILE 126 10.361 0.242 2.108 743 HA ILE 126 HA ILE 126 10.520 2.454 0.245 744 HB ILE 126 HB ILE 126 9.833 -0.441 -0.296 745 HG12 ILE 126 1HG1 ILE 126 12.197 -0.274 -1.426 746 HG13 ILE 126 2HG1 ILE 126 12.432 1.053 -0.299 747 HG21 ILE 126 1HG2 ILE 126 8.956 1.164 -1.960 748 HG22 ILE 126 2HG2 ILE 126 10.148 0.048 -2.624 749 HG23 ILE 126 3HG2 ILE 126 10.608 1.712 -2.257 750 HD11 ILE 126 1HD1 ILE 126 13.339 -1.028 0.565 751 HD12 ILE 126 2HD1 ILE 126 11.748 -1.780 0.444 752 HD13 ILE 126 3HD1 ILE 126 12.010 -0.448 1.569 753 H GLY 127 H GLY 127 8.817 3.765 0.253 754 HA2 GLY 127 1HA GLY 127 6.155 2.535 -0.014 755 HA3 GLY 127 2HA GLY 127 6.423 3.908 1.048 756 H ASN 128 H ASN 128 4.619 4.670 -0.395 757 HA ASN 128 HA ASN 128 5.056 5.236 -3.123 758 HB2 ASN 128 1HB ASN 128 3.081 6.727 -2.912 759 HB3 ASN 128 2HB ASN 128 2.804 5.128 -2.234 760 HD21 ASN 128 1HD2 ASN 128 1.655 7.982 -0.003 761 HD22 ASN 128 2HD2 ASN 128 1.527 7.748 -1.711 762 H TRP 129 H TRP 129 5.706 7.076 -0.209 763 HA TRP 129 HA TRP 129 6.096 9.548 -1.608 764 HB2 TRP 129 1HB TRP 129 5.248 9.406 0.728 765 HB3 TRP 129 2HB TRP 129 6.829 8.827 1.235 766 HD1 TRP 129 HD1 TRP 129 5.196 11.988 -0.270 767 HE1 TRP 129 HE1 TRP 129 6.585 14.028 0.458 768 HE3 TRP 129 HE3 TRP 129 9.013 9.563 2.116 769 HZ2 TRP 129 HZ2 TRP 129 8.980 14.542 1.857 770 HZ3 TRP 129 HZ3 TRP 129 10.814 10.904 3.124 771 HH2 TRP 129 HH2 TRP 129 10.795 13.341 2.995 772 H THR 130 H THR 130 8.096 6.853 -0.864 773 HA THR 130 HA THR 130 10.525 8.429 -1.079 774 HB THR 130 HB THR 130 10.260 6.405 0.478 775 HG1 THR 130 HG1 THR 130 12.398 6.296 0.458 776 HG21 THR 130 1HG2 THR 130 10.863 4.239 -0.502 777 HG22 THR 130 2HG2 THR 130 10.795 4.950 -2.112 778 HG23 THR 130 3HG2 THR 130 9.330 4.833 -1.137 779 H ILE 131 H ILE 131 8.452 6.581 -3.150 780 HA ILE 131 HA ILE 131 10.550 6.331 -5.150 781 HB ILE 131 HB ILE 131 9.210 4.352 -5.005 782 HG12 ILE 131 1HG1 ILE 131 8.481 5.950 -7.468 783 HG13 ILE 131 2HG1 ILE 131 9.938 4.988 -7.246 784 HG21 ILE 131 1HG2 ILE 131 6.797 4.349 -5.412 785 HG22 ILE 131 2HG2 ILE 131 6.811 6.110 -5.500 786 HG23 ILE 131 3HG2 ILE 131 7.218 5.300 -3.988 787 HD11 ILE 131 1HD1 ILE 131 8.321 3.842 -8.636 788 HD12 ILE 131 2HD1 ILE 131 7.126 3.934 -7.342 789 HD13 ILE 131 3HD1 ILE 131 8.585 2.970 -7.125 790 H GLY 132 H GLY 132 7.442 8.016 -4.741 791 HA2 GLY 132 1HA GLY 132 7.848 10.342 -5.898 792 HA3 GLY 132 2HA GLY 132 7.867 9.326 -7.328 793 H PHE 133 H PHE 133 5.788 7.603 -5.817 794 HA PHE 133 HA PHE 133 3.535 8.757 -7.103 795 HB2 PHE 133 1HB PHE 133 3.787 6.441 -5.186 796 HB3 PHE 133 2HB PHE 133 2.257 6.928 -5.903 797 HD1 PHE 133 HD1 PHE 133 4.760 4.620 -6.157 798 HD2 PHE 133 HD2 PHE 133 2.551 7.313 -8.601 799 HE1 PHE 133 HE1 PHE 133 5.231 3.217 -8.121 800 HE2 PHE 133 HE2 PHE 133 3.020 5.914 -10.570 801 HZ PHE 133 HZ PHE 133 4.359 3.862 -10.331 802 H HIS 134 H HIS 134 2.958 10.716 -6.307 803 HA HIS 134 HA HIS 134 2.224 10.880 -3.464 804 HB2 HIS 134 1HB HIS 134 2.661 12.976 -5.587 805 HB3 HIS 134 2HB HIS 134 1.834 13.348 -4.083 806 HD1 HIS 134 HD1 HIS 134 3.454 14.686 -2.792 807 HD2 HIS 134 HD2 HIS 134 5.238 11.370 -4.543 808 HE1 HIS 134 HE1 HIS 134 5.817 14.668 -1.947 809 HE2 HIS 134 HE2 HIS 134 6.928 12.773 -3.177 810 H HIS 135 H HIS 135 0.122 11.430 -2.843 811 HA HIS 135 HA HIS 135 -1.937 10.571 -4.642 812 HB2 HIS 135 1HB HIS 135 -2.071 11.768 -1.868 813 HB3 HIS 135 2HB HIS 135 -3.481 11.212 -2.764 814 HD1 HIS 135 HD1 HIS 135 -1.180 10.078 -0.297 815 HD2 HIS 135 HD2 HIS 135 -3.055 8.322 -3.558 816 HE1 HIS 135 HE1 HIS 135 -1.046 7.601 0.102 817 HE2 HIS 135 HE2 HIS 135 -1.901 6.577 -2.041 818 H HIS 136 H HIS 136 -2.717 11.779 -6.190 819 HA HIS 136 HA HIS 136 -2.006 14.506 -6.457 820 HB2 HIS 136 1HB HIS 136 -2.358 12.822 -8.318 821 HB3 HIS 136 2HB HIS 136 -4.087 13.022 -8.064 822 HD1 HIS 136 HD1 HIS 136 -1.190 14.523 -9.741 823 HD2 HIS 136 HD2 HIS 136 -5.054 15.660 -8.731 824 HE1 HIS 136 HE1 HIS 136 -1.684 16.551 -11.141 825 HE2 HIS 136 HE2 HIS 136 -3.959 17.317 -10.385 826 H HIS 137 H HIS 137 -2.901 16.106 -5.358 827 HA HIS 137 HA HIS 137 -5.636 15.879 -4.392 828 HB2 HIS 137 1HB HIS 137 -3.509 17.975 -3.901 829 HB3 HIS 137 2HB HIS 137 -5.112 17.994 -3.172 830 HD1 HIS 137 HD1 HIS 137 -1.746 16.607 -2.772 831 HD2 HIS 137 HD2 HIS 137 -5.556 15.802 -1.325 832 HE1 HIS 137 HE1 HIS 137 -1.407 15.121 -0.779 833 HE2 HIS 137 HE2 HIS 137 -3.708 14.794 0.183 834 H HIS 138 H HIS 138 -6.861 16.115 -6.236 835 HA HIS 138 HA HIS 138 -6.332 18.299 -8.059 836 HB2 HIS 138 1HB HIS 138 -8.169 17.354 -9.406 837 HB3 HIS 138 2HB HIS 138 -6.948 16.155 -9.015 838 HD1 HIS 138 HD1 HIS 138 -10.537 16.953 -8.572 839 HD2 HIS 138 HD2 HIS 138 -7.798 14.148 -7.188 840 HE1 HIS 138 HE1 HIS 138 -11.906 15.123 -7.531 841 HE2 HIS 138 HE2 HIS 138 -10.238 13.351 -6.893 842 H HIS 139 H HIS 139 -7.381 18.754 -5.255 843 HA HIS 139 HA HIS 139 -9.710 20.375 -6.051 844 HB2 HIS 139 1HB HIS 139 -8.981 19.151 -3.400 845 HB3 HIS 139 2HB HIS 139 -10.122 20.486 -3.515 846 HD1 HIS 139 HD1 HIS 139 -12.439 19.984 -4.526 847 HD2 HIS 139 HD2 HIS 139 -9.927 16.680 -4.323 848 HE1 HIS 139 HE1 HIS 139 -13.906 17.988 -4.938 849 HE2 HIS 139 HE2 HIS 139 -12.402 15.997 -4.618 850 H LYS 140 H LYS 140 -6.497 20.593 -5.545 851 HA LYS 140 HA LYS 140 -6.700 23.390 -4.689 852 HB2 LYS 140 1HB LYS 140 -4.651 21.387 -3.723 853 HB3 LYS 140 2HB LYS 140 -4.592 23.114 -3.403 854 HG2 LYS 140 1HG LYS 140 -6.683 22.961 -2.161 855 HG3 LYS 140 2HG LYS 140 -6.766 21.233 -2.501 856 HD2 LYS 140 1HD LYS 140 -5.912 21.578 -0.269 857 HD3 LYS 140 2HD LYS 140 -4.631 20.929 -1.293 858 HE2 LYS 140 1HE LYS 140 -3.677 23.144 -1.548 859 HE3 LYS 140 2HE LYS 140 -4.998 23.848 -0.616 860 HZ1 LYS 140 1HZ LYS 140 -4.269 22.546 1.296 861 HZ2 LYS 140 2HZ LYS 140 -3.043 23.574 0.747 862 HZ3 LYS 140 3HZ LYS 140 -2.980 21.922 0.399 Start of MODEL 4 1 H1 MET 25 1H MET 25 26.685 -2.235 -7.496 2 H2 MET 25 2H MET 25 25.110 -2.612 -7.970 3 H3 MET 25 3H MET 25 26.156 -1.837 -9.052 4 HA MET 25 HA MET 25 25.939 -4.156 -9.614 5 HB2 MET 25 1HB MET 25 28.638 -3.491 -8.410 6 HB3 MET 25 2HB MET 25 28.332 -4.775 -9.567 7 HG2 MET 25 1HG MET 25 29.269 -2.991 -10.777 8 HG3 MET 25 2HG MET 25 27.552 -3.013 -11.171 9 HE1 MET 25 1HE MET 25 29.298 -1.618 -7.883 10 HE2 MET 25 2HE MET 25 29.564 0.056 -8.368 11 HE3 MET 25 3HE MET 25 30.415 -1.247 -9.198 12 H GLY 26 H GLY 26 25.031 -5.891 -8.716 13 HA2 GLY 26 1HA GLY 26 24.874 -7.760 -7.351 14 HA3 GLY 26 2HA GLY 26 26.292 -7.200 -6.476 15 H ASN 27 H ASN 27 23.728 -4.963 -6.902 16 HA ASN 27 HA ASN 27 23.277 -4.920 -4.045 17 HB2 ASN 27 1HB ASN 27 22.182 -3.204 -6.280 18 HB3 ASN 27 2HB ASN 27 21.803 -2.968 -4.578 19 HD21 ASN 27 1HD2 ASN 27 24.797 -1.385 -3.794 20 HD22 ASN 27 2HD2 ASN 27 23.336 -2.109 -3.218 21 H LYS 28 H LYS 28 22.214 -6.790 -3.594 22 HA LYS 28 HA LYS 28 20.073 -7.911 -4.971 23 HB2 LYS 28 1HB LYS 28 19.561 -9.036 -2.771 24 HB3 LYS 28 2HB LYS 28 21.207 -9.226 -3.354 25 HG2 LYS 28 1HG LYS 28 21.976 -7.512 -1.812 26 HG3 LYS 28 2HG LYS 28 20.324 -7.255 -1.255 27 HD2 LYS 28 1HD LYS 28 21.562 -8.654 0.311 28 HD3 LYS 28 2HD LYS 28 20.247 -9.563 -0.434 29 HE2 LYS 28 1HE LYS 28 21.828 -10.581 -1.991 30 HE3 LYS 28 2HE LYS 28 23.143 -9.657 -1.268 31 HZ1 LYS 28 1HZ LYS 28 22.774 -10.811 0.811 32 HZ2 LYS 28 2HZ LYS 28 23.056 -11.922 -0.431 33 HZ3 LYS 28 3HZ LYS 28 21.485 -11.677 0.142 34 H GLU 29 H GLU 29 20.129 -5.372 -2.564 35 HA GLU 29 HA GLU 29 17.429 -5.285 -1.865 36 HB2 GLU 29 1HB GLU 29 19.177 -4.027 -0.698 37 HB3 GLU 29 2HB GLU 29 19.403 -3.012 -2.113 38 HG2 GLU 29 1HG GLU 29 16.889 -2.468 -1.799 39 HG3 GLU 29 2HG GLU 29 17.154 -3.064 -0.159 40 H LYS 30 H LYS 30 19.167 -3.784 -4.550 41 HA LYS 30 HA LYS 30 17.151 -2.049 -5.425 42 HB2 LYS 30 1HB LYS 30 19.343 -3.380 -7.024 43 HB3 LYS 30 2HB LYS 30 18.386 -2.009 -7.567 44 HG2 LYS 30 1HG LYS 30 20.148 -1.985 -5.128 45 HG3 LYS 30 2HG LYS 30 20.643 -1.415 -6.721 46 HD2 LYS 30 1HD LYS 30 18.296 -0.331 -5.167 47 HD3 LYS 30 2HD LYS 30 19.904 0.393 -5.184 48 HE2 LYS 30 1HE LYS 30 19.708 0.595 -7.663 49 HE3 LYS 30 2HE LYS 30 18.043 0.034 -7.525 50 HZ1 LYS 30 1HZ LYS 30 18.091 2.419 -7.614 51 HZ2 LYS 30 2HZ LYS 30 19.172 2.495 -6.317 52 HZ3 LYS 30 3HZ LYS 30 17.596 1.940 -6.072 53 H ALA 31 H ALA 31 17.813 -5.415 -6.199 54 HA ALA 31 HA ALA 31 15.898 -5.583 -8.300 55 HB1 ALA 31 1HB ALA 31 17.108 -7.791 -6.641 56 HB2 ALA 31 2HB ALA 31 17.801 -7.122 -8.117 57 HB3 ALA 31 3HB ALA 31 16.264 -7.982 -8.176 58 H ASP 32 H ASP 32 15.876 -6.483 -4.870 59 HA ASP 32 HA ASP 32 13.278 -7.623 -4.963 60 HB2 ASP 32 1HB ASP 32 14.998 -6.721 -2.659 61 HB3 ASP 32 2HB ASP 32 13.413 -7.454 -2.437 62 H ARG 33 H ARG 33 14.470 -4.421 -4.003 63 HA ARG 33 HA ARG 33 12.004 -3.517 -3.005 64 HB2 ARG 33 1HB ARG 33 12.880 -1.268 -3.110 65 HB3 ARG 33 2HB ARG 33 14.093 -2.366 -2.481 66 HG2 ARG 33 1HG ARG 33 15.190 -2.371 -4.683 67 HG3 ARG 33 2HG ARG 33 13.991 -1.209 -5.257 68 HD2 ARG 33 1HD ARG 33 15.907 -0.791 -2.960 69 HD3 ARG 33 2HD ARG 33 16.061 -0.090 -4.571 70 HE ARG 33 HE ARG 33 13.768 0.929 -3.992 71 HH11 ARG 33 1HH1 ARG 33 16.379 0.419 -1.687 72 HH12 ARG 33 2HH1 ARG 33 15.878 1.732 -0.665 73 HH21 ARG 33 1HH2 ARG 33 13.137 2.648 -2.638 74 HH22 ARG 33 2HH2 ARG 33 14.047 2.990 -1.200 75 H GLN 34 H GLN 34 13.292 -3.545 -6.286 76 HA GLN 34 HA GLN 34 11.327 -1.974 -7.512 77 HB2 GLN 34 1HB GLN 34 12.961 -4.297 -8.503 78 HB3 GLN 34 2HB GLN 34 11.782 -3.498 -9.536 79 HG2 GLN 34 1HG GLN 34 12.963 -1.381 -9.245 80 HG3 GLN 34 2HG GLN 34 14.145 -2.188 -8.213 81 HE21 GLN 34 1HE2 GLN 34 15.936 -3.627 -10.831 82 HE22 GLN 34 2HE2 GLN 34 15.637 -3.575 -9.127 83 H LYS 35 H LYS 35 11.280 -5.377 -6.576 84 HA LYS 35 HA LYS 35 8.735 -5.976 -7.692 85 HB2 LYS 35 1HB LYS 35 10.347 -7.728 -7.039 86 HB3 LYS 35 2HB LYS 35 10.163 -7.263 -5.353 87 HG2 LYS 35 1HG LYS 35 8.852 -9.206 -5.696 88 HG3 LYS 35 2HG LYS 35 7.735 -7.849 -5.549 89 HD2 LYS 35 1HD LYS 35 7.562 -7.749 -8.002 90 HD3 LYS 35 2HD LYS 35 8.646 -9.136 -8.123 91 HE2 LYS 35 1HE LYS 35 6.462 -10.001 -8.339 92 HE3 LYS 35 2HE LYS 35 6.980 -10.397 -6.704 93 HZ1 LYS 35 1HZ LYS 35 5.734 -8.429 -5.923 94 HZ2 LYS 35 2HZ LYS 35 4.745 -9.592 -6.657 95 HZ3 LYS 35 3HZ LYS 35 5.166 -8.193 -7.498 96 H VAL 36 H VAL 36 9.856 -4.798 -4.577 97 HA VAL 36 HA VAL 36 7.418 -4.862 -3.188 98 HB VAL 36 HB VAL 36 9.663 -2.864 -2.834 99 HG11 VAL 36 1HG1 VAL 36 7.499 -3.791 -0.949 100 HG12 VAL 36 2HG1 VAL 36 7.660 -2.187 -1.666 101 HG13 VAL 36 3HG1 VAL 36 8.857 -2.758 -0.504 102 HG21 VAL 36 1HG2 VAL 36 10.540 -4.398 -1.150 103 HG22 VAL 36 2HG2 VAL 36 10.501 -5.149 -2.744 104 HG23 VAL 36 3HG2 VAL 36 9.275 -5.560 -1.546 105 H VAL 37 H VAL 37 8.915 -2.372 -5.200 106 HA VAL 37 HA VAL 37 6.964 -0.387 -4.909 107 HB VAL 37 HB VAL 37 8.726 -0.980 -7.298 108 HG11 VAL 37 1HG1 VAL 37 8.314 1.355 -7.949 109 HG12 VAL 37 2HG1 VAL 37 7.146 1.505 -6.637 110 HG13 VAL 37 3HG1 VAL 37 6.836 0.393 -7.971 111 HG21 VAL 37 1HG2 VAL 37 10.135 0.816 -6.402 112 HG22 VAL 37 2HG2 VAL 37 9.979 -0.518 -5.259 113 HG23 VAL 37 3HG2 VAL 37 9.056 0.965 -5.014 114 H SER 38 H SER 38 7.167 -3.138 -7.129 115 HA SER 38 HA SER 38 5.021 -2.473 -8.796 116 HB2 SER 38 1HB SER 38 6.631 -4.260 -9.313 117 HB3 SER 38 2HB SER 38 6.008 -5.220 -7.974 118 HG SER 38 HG SER 38 4.802 -4.597 -10.443 119 H ASP 39 H ASP 39 5.080 -4.479 -5.853 120 HA ASP 39 HA ASP 39 2.272 -4.919 -5.834 121 HB2 ASP 39 1HB ASP 39 4.343 -5.192 -3.648 122 HB3 ASP 39 2HB ASP 39 2.657 -5.664 -3.462 123 H LEU 40 H LEU 40 4.389 -2.521 -4.453 124 HA LEU 40 HA LEU 40 2.601 -1.246 -2.718 125 HB2 LEU 40 1HB LEU 40 5.119 -0.940 -2.979 126 HB3 LEU 40 2HB LEU 40 4.748 0.123 -4.322 127 HG LEU 40 HG LEU 40 3.499 1.599 -2.782 128 HD11 LEU 40 1HD1 LEU 40 4.534 -0.290 -0.669 129 HD12 LEU 40 2HD1 LEU 40 2.846 -0.024 -1.102 130 HD13 LEU 40 3HD1 LEU 40 3.779 1.273 -0.358 131 HD21 LEU 40 1HD2 LEU 40 6.345 0.993 -1.990 132 HD22 LEU 40 2HD2 LEU 40 5.473 2.481 -1.624 133 HD23 LEU 40 3HD2 LEU 40 5.829 2.058 -3.299 134 H VAL 41 H VAL 41 3.227 -0.771 -6.181 135 HA VAL 41 HA VAL 41 1.451 1.386 -6.572 136 HB VAL 41 HB VAL 41 2.169 -0.769 -8.570 137 HG11 VAL 41 1HG1 VAL 41 1.650 0.943 -10.256 138 HG12 VAL 41 2HG1 VAL 41 1.117 2.028 -8.972 139 HG13 VAL 41 3HG1 VAL 41 0.245 0.527 -9.275 140 HG21 VAL 41 1HG2 VAL 41 4.165 0.295 -7.661 141 HG22 VAL 41 2HG2 VAL 41 3.500 1.884 -8.039 142 HG23 VAL 41 3HG2 VAL 41 3.909 0.766 -9.340 143 H ALA 42 H ALA 42 0.993 -2.114 -6.599 144 HA ALA 42 HA ALA 42 -1.687 -2.168 -7.432 145 HB1 ALA 42 1HB ALA 42 -0.260 -4.048 -5.554 146 HB2 ALA 42 2HB ALA 42 -0.346 -4.189 -7.309 147 HB3 ALA 42 3HB ALA 42 -1.807 -4.366 -6.336 148 H LEU 43 H LEU 43 -0.243 -1.640 -4.259 149 HA LEU 43 HA LEU 43 -2.636 -1.620 -2.772 150 HB2 LEU 43 1HB LEU 43 0.119 -0.619 -2.355 151 HB3 LEU 43 2HB LEU 43 -1.134 0.113 -1.371 152 HG LEU 43 HG LEU 43 -1.769 -2.103 -0.525 153 HD11 LEU 43 1HD1 LEU 43 -0.353 -4.030 -0.968 154 HD12 LEU 43 2HD1 LEU 43 0.584 -3.084 -2.124 155 HD13 LEU 43 3HD1 LEU 43 -1.114 -3.436 -2.446 156 HD21 LEU 43 1HD2 LEU 43 1.151 -1.436 -0.248 157 HD22 LEU 43 2HD2 LEU 43 0.229 -2.476 0.838 158 HD23 LEU 43 3HD2 LEU 43 -0.171 -0.764 0.703 159 H GLU 44 H GLU 44 -0.806 1.026 -4.304 160 HA GLU 44 HA GLU 44 -2.507 3.123 -3.644 161 HB2 GLU 44 1HB GLU 44 -0.608 2.630 -5.890 162 HB3 GLU 44 2HB GLU 44 -1.700 4.004 -6.002 163 HG2 GLU 44 1HG GLU 44 0.237 3.475 -3.769 164 HG3 GLU 44 2HG GLU 44 0.456 4.636 -5.077 165 H GLY 45 H GLY 45 -2.709 0.774 -6.253 166 HA2 GLY 45 1HA GLY 45 -4.915 1.933 -7.595 167 HA3 GLY 45 2HA GLY 45 -4.413 0.253 -7.695 168 H ALA 46 H ALA 46 -4.716 -0.602 -5.112 169 HA ALA 46 HA ALA 46 -7.469 -1.111 -4.911 170 HB1 ALA 46 1HB ALA 46 -5.490 -1.289 -2.651 171 HB2 ALA 46 2HB ALA 46 -5.601 -2.478 -3.947 172 HB3 ALA 46 3HB ALA 46 -6.972 -2.220 -2.870 173 H LEU 47 H LEU 47 -5.384 1.126 -3.142 174 HA LEU 47 HA LEU 47 -7.345 2.226 -1.456 175 HB2 LEU 47 1HB LEU 47 -4.659 3.064 -2.435 176 HB3 LEU 47 2HB LEU 47 -5.662 4.271 -1.654 177 HG LEU 47 HG LEU 47 -5.685 3.031 0.405 178 HD11 LEU 47 1HD1 LEU 47 -4.179 0.873 -1.060 179 HD12 LEU 47 2HD1 LEU 47 -5.833 0.771 -0.456 180 HD13 LEU 47 3HD1 LEU 47 -4.489 0.913 0.675 181 HD21 LEU 47 1HD2 LEU 47 -2.909 3.083 -0.763 182 HD22 LEU 47 2HD2 LEU 47 -3.305 3.017 0.954 183 HD23 LEU 47 3HD2 LEU 47 -3.741 4.437 0.002 184 H ASP 48 H ASP 48 -6.212 3.144 -4.664 185 HA ASP 48 HA ASP 48 -7.734 5.489 -4.961 186 HB2 ASP 48 1HB ASP 48 -5.845 4.914 -6.427 187 HB3 ASP 48 2HB ASP 48 -6.752 3.554 -7.077 188 H MET 49 H MET 49 -8.394 2.127 -5.849 189 HA MET 49 HA MET 49 -10.937 2.583 -6.987 190 HB2 MET 49 1HB MET 49 -9.750 0.104 -5.737 191 HB3 MET 49 2HB MET 49 -11.287 0.127 -6.582 192 HG2 MET 49 1HG MET 49 -8.857 1.122 -7.981 193 HG3 MET 49 2HG MET 49 -9.078 -0.612 -7.778 194 HE1 MET 49 1HE MET 49 -11.842 2.282 -8.607 195 HE2 MET 49 2HE MET 49 -11.672 2.196 -10.360 196 HE3 MET 49 3HE MET 49 -10.296 2.663 -9.360 197 H TYR 50 H TYR 50 -9.920 1.709 -3.712 198 HA TYR 50 HA TYR 50 -12.521 1.303 -2.701 199 HB2 TYR 50 1HB TYR 50 -10.480 0.445 -1.588 200 HB3 TYR 50 2HB TYR 50 -10.042 2.096 -1.156 201 HD1 TYR 50 HD1 TYR 50 -12.437 -0.639 -0.528 202 HD2 TYR 50 HD2 TYR 50 -11.130 3.231 0.657 203 HE1 TYR 50 HE1 TYR 50 -13.793 -0.809 1.516 204 HE2 TYR 50 HE2 TYR 50 -12.474 3.067 2.701 205 HH TYR 50 HH TYR 50 -14.012 0.124 3.672 206 H LYS 51 H LYS 51 -10.392 4.174 -2.640 207 HA LYS 51 HA LYS 51 -12.277 5.752 -1.199 208 HB2 LYS 51 1HB LYS 51 -9.891 6.364 -1.247 209 HB3 LYS 51 2HB LYS 51 -10.013 6.696 -2.974 210 HG2 LYS 51 1HG LYS 51 -11.657 8.454 -2.513 211 HG3 LYS 51 2HG LYS 51 -11.511 8.132 -0.788 212 HD2 LYS 51 1HD LYS 51 -9.173 8.808 -0.845 213 HD3 LYS 51 2HD LYS 51 -9.279 9.072 -2.588 214 HE2 LYS 51 1HE LYS 51 -10.930 10.816 -2.254 215 HE3 LYS 51 2HE LYS 51 -10.930 10.518 -0.520 216 HZ1 LYS 51 1HZ LYS 51 -9.599 12.456 -1.170 217 HZ2 LYS 51 2HZ LYS 51 -8.576 11.453 -2.066 218 HZ3 LYS 51 3HZ LYS 51 -8.673 11.280 -0.386 219 H LEU 52 H LEU 52 -11.734 5.116 -4.607 220 HA LEU 52 HA LEU 52 -13.376 7.173 -5.615 221 HB2 LEU 52 1HB LEU 52 -11.781 5.842 -6.968 222 HB3 LEU 52 2HB LEU 52 -12.835 4.451 -6.803 223 HG LEU 52 HG LEU 52 -14.605 5.669 -8.024 224 HD11 LEU 52 1HD1 LEU 52 -14.010 7.738 -9.214 225 HD12 LEU 52 2HD1 LEU 52 -12.478 7.781 -8.342 226 HD13 LEU 52 3HD1 LEU 52 -13.998 7.942 -7.463 227 HD21 LEU 52 1HD2 LEU 52 -13.107 4.182 -9.230 228 HD22 LEU 52 2HD2 LEU 52 -11.956 5.499 -9.454 229 HD23 LEU 52 3HD2 LEU 52 -13.540 5.571 -10.227 230 H ASP 53 H ASP 53 -14.055 3.842 -4.638 231 HA ASP 53 HA ASP 53 -16.828 3.997 -5.361 232 HB2 ASP 53 1HB ASP 53 -15.536 1.869 -5.334 233 HB3 ASP 53 2HB ASP 53 -15.453 1.979 -3.579 234 H ASN 54 H ASN 54 -15.042 4.121 -2.280 235 HA ASN 54 HA ASN 54 -17.593 4.375 -0.856 236 HB2 ASN 54 1HB ASN 54 -14.815 3.708 0.114 237 HB3 ASN 54 2HB ASN 54 -16.186 3.951 1.191 238 HD21 ASN 54 1HD2 ASN 54 -15.763 0.516 -0.914 239 HD22 ASN 54 2HD2 ASN 54 -14.736 1.882 -1.182 240 H SER 55 H SER 55 -15.262 6.387 -2.045 241 HA SER 55 HA SER 55 -14.861 8.601 -1.832 242 HB2 SER 55 1HB SER 55 -17.211 8.593 0.066 243 HB3 SER 55 2HB SER 55 -16.521 10.007 -0.728 244 HG SER 55 HG SER 55 -17.056 8.910 -2.753 245 H ARG 56 H ARG 56 -13.720 6.591 0.095 246 HA ARG 56 HA ARG 56 -12.351 8.511 1.733 247 HB2 ARG 56 1HB ARG 56 -12.865 7.515 3.894 248 HB3 ARG 56 2HB ARG 56 -14.343 8.062 3.124 249 HG2 ARG 56 1HG ARG 56 -15.141 6.060 3.703 250 HG3 ARG 56 2HG ARG 56 -14.242 5.471 2.306 251 HD2 ARG 56 1HD ARG 56 -13.747 4.084 4.215 252 HD3 ARG 56 2HD ARG 56 -12.312 5.015 3.785 253 HE ARG 56 HE ARG 56 -13.446 6.558 5.676 254 HH11 ARG 56 1HH1 ARG 56 -12.655 3.143 5.597 255 HH12 ARG 56 2HH1 ARG 56 -12.440 3.022 7.312 256 HH21 ARG 56 1HH2 ARG 56 -13.147 6.405 7.932 257 HH22 ARG 56 2HH2 ARG 56 -12.711 4.882 8.646 258 H TYR 57 H TYR 57 -10.396 7.699 2.573 259 HA TYR 57 HA TYR 57 -9.308 5.480 1.129 260 HB2 TYR 57 1HB TYR 57 -8.241 7.362 3.204 261 HB3 TYR 57 2HB TYR 57 -7.335 5.917 2.779 262 HD1 TYR 57 HD1 TYR 57 -7.004 5.589 0.153 263 HD2 TYR 57 HD2 TYR 57 -7.770 9.299 2.080 264 HE1 TYR 57 HE1 TYR 57 -5.984 6.776 -1.744 265 HE2 TYR 57 HE2 TYR 57 -6.758 10.494 0.194 266 HH TYR 57 HH TYR 57 -6.062 9.007 -2.775 267 HA PRO 58 HA PRO 58 -10.142 2.222 3.982 268 HB2 PRO 58 1HB PRO 58 -8.026 0.607 3.425 269 HB3 PRO 58 2HB PRO 58 -9.431 0.760 2.363 270 HG2 PRO 58 1HG PRO 58 -6.742 2.050 2.163 271 HG3 PRO 58 2HG PRO 58 -7.746 1.348 0.879 272 HD2 PRO 58 1HD PRO 58 -7.593 4.013 1.325 273 HD3 PRO 58 2HD PRO 58 -9.063 3.229 0.713 274 H THR 59 H THR 59 -9.655 1.723 6.044 275 HA THR 59 HA THR 59 -7.545 3.107 7.390 276 HB THR 59 HB THR 59 -8.323 1.730 9.373 277 HG1 THR 59 HG1 THR 59 -10.679 0.990 8.480 278 HG21 THR 59 1HG2 THR 59 -10.421 3.320 7.893 279 HG22 THR 59 2HG2 THR 59 -9.158 3.995 8.922 280 HG23 THR 59 3HG2 THR 59 -10.411 2.969 9.622 281 H THR 60 H THR 60 -6.279 1.624 9.109 282 HA THR 60 HA THR 60 -4.257 0.398 7.695 283 HB THR 60 HB THR 60 -4.022 1.174 10.017 284 HG1 THR 60 HG1 THR 60 -2.545 -0.396 9.090 285 HG21 THR 60 1HG2 THR 60 -4.737 -0.231 11.885 286 HG22 THR 60 2HG2 THR 60 -5.514 -1.344 10.760 287 HG23 THR 60 3HG2 THR 60 -6.123 0.301 10.935 288 H GLU 61 H GLU 61 -7.149 -1.099 9.050 289 HA GLU 61 HA GLU 61 -6.303 -3.773 8.464 290 HB2 GLU 61 1HB GLU 61 -9.035 -2.681 9.152 291 HB3 GLU 61 2HB GLU 61 -8.610 -4.385 9.088 292 HG2 GLU 61 1HG GLU 61 -7.468 -2.339 10.975 293 HG3 GLU 61 2HG GLU 61 -8.645 -3.591 11.373 294 H GLN 62 H GLN 62 -8.381 -1.385 6.930 295 HA GLN 62 HA GLN 62 -9.469 -3.173 4.995 296 HB2 GLN 62 1HB GLN 62 -9.422 -0.161 5.120 297 HB3 GLN 62 2HB GLN 62 -10.311 -1.085 3.920 298 HG2 GLN 62 1HG GLN 62 -11.707 -2.046 5.626 299 HG3 GLN 62 2HG GLN 62 -10.753 -1.267 6.890 300 HE21 GLN 62 1HE2 GLN 62 -13.887 0.651 5.947 301 HE22 GLN 62 2HE2 GLN 62 -13.613 -1.038 6.198 302 H GLY 63 H GLY 63 -6.747 -0.940 5.020 303 HA2 GLY 63 1HA GLY 63 -6.460 -0.517 2.283 304 HA3 GLY 63 2HA GLY 63 -5.158 -0.418 3.452 305 H LEU 64 H LEU 64 -4.850 -2.990 4.256 306 HA LEU 64 HA LEU 64 -3.399 -4.083 2.076 307 HB2 LEU 64 1HB LEU 64 -3.871 -4.768 4.907 308 HB3 LEU 64 2HB LEU 64 -3.429 -6.101 3.861 309 HG LEU 64 HG LEU 64 -1.345 -5.025 3.279 310 HD11 LEU 64 1HD1 LEU 64 -0.644 -2.918 4.235 311 HD12 LEU 64 2HD1 LEU 64 -2.193 -2.752 5.067 312 HD13 LEU 64 3HD1 LEU 64 -2.126 -2.693 3.306 313 HD21 LEU 64 1HD2 LEU 64 -0.277 -5.047 5.474 314 HD22 LEU 64 2HD2 LEU 64 -1.420 -6.378 5.299 315 HD23 LEU 64 3HD2 LEU 64 -1.860 -4.957 6.244 316 H GLN 65 H GLN 65 -6.452 -4.910 3.615 317 HA GLN 65 HA GLN 65 -6.749 -7.386 2.244 318 HB2 GLN 65 1HB GLN 65 -8.642 -5.695 3.852 319 HB3 GLN 65 2HB GLN 65 -9.153 -7.186 3.071 320 HG2 GLN 65 1HG GLN 65 -6.948 -6.950 5.106 321 HG3 GLN 65 2HG GLN 65 -8.588 -7.509 5.429 322 HE21 GLN 65 1HE2 GLN 65 -8.102 -10.717 4.153 323 HE22 GLN 65 2HE2 GLN 65 -9.248 -9.517 4.639 324 H ALA 66 H ALA 66 -7.378 -4.131 1.349 325 HA ALA 66 HA ALA 66 -9.772 -4.392 -0.052 326 HB1 ALA 66 1HB ALA 66 -9.232 -2.278 -1.096 327 HB2 ALA 66 2HB ALA 66 -7.541 -2.450 -0.623 328 HB3 ALA 66 3HB ALA 66 -8.786 -2.247 0.610 329 H LEU 67 H LEU 67 -6.553 -5.287 -1.052 330 HA LEU 67 HA LEU 67 -7.562 -5.645 -3.775 331 HB2 LEU 67 1HB LEU 67 -5.251 -5.817 -4.536 332 HB3 LEU 67 2HB LEU 67 -5.596 -4.293 -3.760 333 HG LEU 67 HG LEU 67 -4.193 -6.523 -2.302 334 HD11 LEU 67 1HD1 LEU 67 -2.089 -5.426 -2.911 335 HD12 LEU 67 2HD1 LEU 67 -2.970 -4.311 -3.957 336 HD13 LEU 67 3HD1 LEU 67 -2.931 -6.034 -4.334 337 HD21 LEU 67 1HD2 LEU 67 -3.291 -4.624 -0.993 338 HD22 LEU 67 2HD2 LEU 67 -5.043 -4.758 -0.881 339 HD23 LEU 67 3HD2 LEU 67 -4.319 -3.531 -1.919 340 H VAL 68 H VAL 68 -7.280 -7.475 -1.072 341 HA VAL 68 HA VAL 68 -6.753 -9.884 -2.690 342 HB VAL 68 HB VAL 68 -4.882 -9.566 -1.176 343 HG11 VAL 68 1HG1 VAL 68 -5.174 -9.670 1.261 344 HG12 VAL 68 2HG1 VAL 68 -6.923 -9.604 1.036 345 HG13 VAL 68 3HG1 VAL 68 -5.918 -8.240 0.547 346 HG21 VAL 68 1HG2 VAL 68 -6.664 -11.827 -0.280 347 HG22 VAL 68 2HG2 VAL 68 -4.922 -11.723 -0.025 348 HG23 VAL 68 3HG2 VAL 68 -5.569 -11.850 -1.661 349 H SER 69 H SER 69 -8.631 -8.506 -0.028 350 HA SER 69 HA SER 69 -10.767 -10.385 -0.512 351 HB2 SER 69 1HB SER 69 -9.203 -11.614 1.029 352 HB3 SER 69 2HB SER 69 -9.446 -10.336 2.216 353 HG SER 69 HG SER 69 -11.303 -11.173 2.723 354 H ALA 70 H ALA 70 -12.678 -9.412 -0.111 355 HA ALA 70 HA ALA 70 -12.835 -6.679 0.336 356 HB1 ALA 70 1HB ALA 70 -15.239 -7.003 0.571 357 HB2 ALA 70 2HB ALA 70 -14.989 -8.737 0.774 358 HB3 ALA 70 3HB ALA 70 -14.592 -7.962 -0.761 359 HA PRO 71 HA PRO 71 -12.209 -6.483 4.774 360 HB2 PRO 71 1HB PRO 71 -13.131 -3.703 4.390 361 HB3 PRO 71 2HB PRO 71 -11.616 -4.301 5.071 362 HG2 PRO 71 1HG PRO 71 -11.701 -3.150 2.655 363 HG3 PRO 71 2HG PRO 71 -10.608 -4.503 3.004 364 HD2 PRO 71 1HD PRO 71 -13.215 -4.502 1.535 365 HD3 PRO 71 2HD PRO 71 -11.718 -5.388 1.180 366 H SER 72 H SER 72 -13.563 -6.827 6.415 367 HA SER 72 HA SER 72 -16.418 -6.543 5.993 368 HB2 SER 72 1HB SER 72 -16.479 -7.642 8.314 369 HB3 SER 72 2HB SER 72 -15.816 -8.605 6.993 370 HG SER 72 HG SER 72 -14.628 -7.778 9.278 371 H ALA 73 H ALA 73 -13.832 -4.901 7.487 372 HA ALA 73 HA ALA 73 -15.180 -3.424 9.470 373 HB1 ALA 73 1HB ALA 73 -13.281 -1.876 9.309 374 HB2 ALA 73 2HB ALA 73 -12.759 -2.677 7.826 375 HB3 ALA 73 3HB ALA 73 -12.745 -3.556 9.356 376 H GLU 74 H GLU 74 -16.328 -1.562 9.392 377 HA GLU 74 HA GLU 74 -17.591 -0.833 6.961 378 HB2 GLU 74 1HB GLU 74 -18.570 1.022 8.333 379 HB3 GLU 74 2HB GLU 74 -18.806 -0.584 9.009 380 HG2 GLU 74 1HG GLU 74 -17.164 -0.233 10.669 381 HG3 GLU 74 2HG GLU 74 -16.565 1.221 9.872 382 HA PRO 75 HA PRO 75 -18.460 0.655 5.728 383 HB2 PRO 75 1HB PRO 75 -17.297 1.464 3.171 384 HB3 PRO 75 2HB PRO 75 -18.703 2.119 4.011 385 HG2 PRO 75 1HG PRO 75 -16.404 3.508 3.752 386 HG3 PRO 75 2HG PRO 75 -17.462 3.671 5.166 387 HD2 PRO 75 1HD PRO 75 -14.932 2.087 4.867 388 HD3 PRO 75 2HD PRO 75 -15.468 3.109 6.219 389 H HIS 76 H HIS 76 -18.987 -1.300 4.963 390 HA HIS 76 HA HIS 76 -16.969 -3.207 4.308 391 HB2 HIS 76 1HB HIS 76 -19.156 -3.722 5.455 392 HB3 HIS 76 2HB HIS 76 -19.958 -3.465 3.914 393 HD1 HIS 76 HD1 HIS 76 -18.584 -6.064 5.939 394 HD2 HIS 76 HD2 HIS 76 -18.895 -5.374 1.854 395 HE1 HIS 76 HE1 HIS 76 -18.237 -8.304 4.846 396 HE2 HIS 76 HE2 HIS 76 -18.642 -7.889 2.396 397 H ALA 77 H ALA 77 -16.059 -3.527 2.395 398 HA ALA 77 HA ALA 77 -16.661 -1.981 0.137 399 HB1 ALA 77 1HB ALA 77 -15.019 -3.348 -1.029 400 HB2 ALA 77 2HB ALA 77 -15.062 -4.533 0.277 401 HB3 ALA 77 3HB ALA 77 -14.443 -2.910 0.580 402 H ARG 78 H ARG 78 -18.168 -2.174 -1.342 403 HA ARG 78 HA ARG 78 -19.469 -4.777 -1.767 404 HB2 ARG 78 1HB ARG 78 -20.500 -2.091 -2.672 405 HB3 ARG 78 2HB ARG 78 -21.375 -3.612 -2.633 406 HG2 ARG 78 1HG ARG 78 -20.475 -2.000 -0.269 407 HG3 ARG 78 2HG ARG 78 -22.125 -2.174 -0.857 408 HD2 ARG 78 1HD ARG 78 -20.383 -4.339 0.312 409 HD3 ARG 78 2HD ARG 78 -21.789 -3.595 1.066 410 HE ARG 78 HE ARG 78 -22.005 -5.159 -1.424 411 HH11 ARG 78 1HH1 ARG 78 -23.049 -4.472 1.856 412 HH12 ARG 78 2HH1 ARG 78 -24.331 -5.641 1.819 413 HH21 ARG 78 1HH2 ARG 78 -23.697 -6.689 -1.464 414 HH22 ARG 78 2HH2 ARG 78 -24.695 -6.899 -0.060 415 H ASN 79 H ASN 79 -20.154 -5.195 -4.012 416 HA ASN 79 HA ASN 79 -19.603 -5.644 -6.155 417 HB2 ASN 79 1HB ASN 79 -19.313 -3.611 -7.616 418 HB3 ASN 79 2HB ASN 79 -20.747 -3.626 -6.610 419 HD21 ASN 79 1HD2 ASN 79 -17.825 -0.875 -5.955 420 HD22 ASN 79 2HD2 ASN 79 -17.497 -2.347 -6.807 421 H TYR 80 H TYR 80 -17.530 -6.157 -4.485 422 HA TYR 80 HA TYR 80 -15.086 -5.141 -5.688 423 HB2 TYR 80 1HB TYR 80 -13.972 -6.476 -3.926 424 HB3 TYR 80 2HB TYR 80 -15.183 -5.393 -3.249 425 HD1 TYR 80 HD1 TYR 80 -17.328 -6.306 -2.409 426 HD2 TYR 80 HD2 TYR 80 -14.201 -8.857 -3.755 427 HE1 TYR 80 HE1 TYR 80 -18.404 -8.209 -1.287 428 HE2 TYR 80 HE2 TYR 80 -15.273 -10.767 -2.638 429 HH TYR 80 HH TYR 80 -18.419 -10.740 -1.568 430 HA PRO 81 HA PRO 81 -14.569 -8.686 -8.338 431 HB2 PRO 81 1HB PRO 81 -11.859 -8.740 -8.524 432 HB3 PRO 81 2HB PRO 81 -12.851 -7.540 -9.360 433 HG2 PRO 81 1HG PRO 81 -11.318 -7.282 -6.804 434 HG3 PRO 81 2HG PRO 81 -11.453 -6.134 -8.150 435 HD2 PRO 81 1HD PRO 81 -12.885 -5.886 -5.860 436 HD3 PRO 81 2HD PRO 81 -13.495 -5.348 -7.437 437 H GLU 82 H GLU 82 -14.420 -10.841 -8.004 438 HA GLU 82 HA GLU 82 -13.960 -11.814 -5.388 439 HB2 GLU 82 1HB GLU 82 -14.265 -13.305 -7.998 440 HB3 GLU 82 2HB GLU 82 -14.266 -14.058 -6.408 441 HG2 GLU 82 1HG GLU 82 -16.240 -12.714 -5.805 442 HG3 GLU 82 2HG GLU 82 -16.257 -12.050 -7.437 443 H GLY 83 H GLY 83 -12.154 -12.397 -4.432 444 HA2 GLY 83 1HA GLY 83 -10.009 -13.266 -4.189 445 HA3 GLY 83 2HA GLY 83 -9.889 -13.402 -5.939 446 H GLY 84 H GLY 84 -11.047 -10.389 -5.207 447 HA2 GLY 84 1HA GLY 84 -10.131 -8.288 -5.121 448 HA3 GLY 84 2HA GLY 84 -8.690 -9.017 -4.430 449 H TYR 85 H TYR 85 -7.188 -7.914 -5.567 450 HA TYR 85 HA TYR 85 -7.191 -8.264 -8.498 451 HB2 TYR 85 1HB TYR 85 -5.743 -6.176 -6.852 452 HB3 TYR 85 2HB TYR 85 -5.721 -6.300 -8.607 453 HD1 TYR 85 HD1 TYR 85 -7.966 -6.012 -9.829 454 HD2 TYR 85 HD2 TYR 85 -7.356 -4.887 -5.773 455 HE1 TYR 85 HE1 TYR 85 -9.919 -4.521 -9.954 456 HE2 TYR 85 HE2 TYR 85 -9.308 -3.398 -5.885 457 HH TYR 85 HH TYR 85 -11.531 -3.470 -8.481 458 H ILE 86 H ILE 86 -5.749 -9.103 -5.569 459 HA ILE 86 HA ILE 86 -3.577 -10.461 -6.990 460 HB ILE 86 HB ILE 86 -2.638 -8.414 -5.934 461 HG12 ILE 86 1HG1 ILE 86 -1.744 -10.978 -4.598 462 HG13 ILE 86 2HG1 ILE 86 -1.264 -10.452 -6.207 463 HG21 ILE 86 1HG2 ILE 86 -2.516 -8.229 -3.508 464 HG22 ILE 86 2HG2 ILE 86 -3.504 -9.680 -3.339 465 HG23 ILE 86 3HG2 ILE 86 -4.190 -8.226 -4.064 466 HD11 ILE 86 1HD1 ILE 86 -0.144 -8.519 -5.257 467 HD12 ILE 86 2HD1 ILE 86 0.466 -10.014 -4.550 468 HD13 ILE 86 3HD1 ILE 86 -0.656 -9.003 -3.641 469 H ARG 87 H ARG 87 -3.055 -12.459 -6.136 470 HA ARG 87 HA ARG 87 -5.272 -13.786 -4.975 471 HB2 ARG 87 1HB ARG 87 -3.888 -14.883 -6.631 472 HB3 ARG 87 2HB ARG 87 -2.480 -14.757 -5.588 473 HG2 ARG 87 1HG ARG 87 -3.507 -16.270 -3.989 474 HG3 ARG 87 2HG ARG 87 -4.952 -16.369 -4.996 475 HD2 ARG 87 1HD ARG 87 -3.474 -18.303 -5.298 476 HD3 ARG 87 2HD ARG 87 -3.673 -17.379 -6.786 477 HE ARG 87 HE ARG 87 -1.388 -16.418 -5.524 478 HH11 ARG 87 1HH1 ARG 87 -2.506 -19.429 -6.920 479 HH12 ARG 87 2HH1 ARG 87 -0.918 -19.938 -7.408 480 HH21 ARG 87 1HH2 ARG 87 0.698 -17.078 -6.166 481 HH22 ARG 87 2HH2 ARG 87 0.897 -18.587 -7.001 482 H ARG 88 H ARG 88 -2.284 -12.566 -3.676 483 HA ARG 88 HA ARG 88 -3.080 -13.549 -1.023 484 HB2 ARG 88 1HB ARG 88 -0.318 -13.592 -2.244 485 HB3 ARG 88 2HB ARG 88 -0.625 -13.822 -0.530 486 HG2 ARG 88 1HG ARG 88 -1.918 -15.817 -1.002 487 HG3 ARG 88 2HG ARG 88 -1.687 -15.572 -2.737 488 HD2 ARG 88 1HD ARG 88 -0.137 -17.243 -1.810 489 HD3 ARG 88 2HD ARG 88 0.701 -15.851 -2.492 490 HE ARG 88 HE ARG 88 0.194 -15.998 0.401 491 HH11 ARG 88 1HH1 ARG 88 2.437 -15.877 -2.289 492 HH12 ARG 88 2HH1 ARG 88 3.818 -15.572 -1.284 493 HH21 ARG 88 1HH2 ARG 88 2.023 -15.610 1.721 494 HH22 ARG 88 2HH2 ARG 88 3.585 -15.436 0.991 495 H LEU 89 H LEU 89 -2.407 -12.220 0.734 496 HA LEU 89 HA LEU 89 -2.380 -9.448 0.257 497 HB2 LEU 89 1HB LEU 89 -2.904 -10.840 2.427 498 HB3 LEU 89 2HB LEU 89 -1.188 -10.637 2.744 499 HG LEU 89 HG LEU 89 -3.090 -8.330 2.308 500 HD11 LEU 89 1HD1 LEU 89 -3.750 -9.569 4.288 501 HD12 LEU 89 2HD1 LEU 89 -3.002 -8.038 4.737 502 HD13 LEU 89 3HD1 LEU 89 -2.090 -9.539 4.882 503 HD21 LEU 89 1HD2 LEU 89 -0.709 -7.868 1.861 504 HD22 LEU 89 2HD2 LEU 89 -0.314 -8.425 3.486 505 HD23 LEU 89 3HD2 LEU 89 -1.315 -6.993 3.265 506 HA PRO 90 HA PRO 90 1.629 -9.167 -1.535 507 HB2 PRO 90 1HB PRO 90 1.975 -6.453 -0.926 508 HB3 PRO 90 2HB PRO 90 1.254 -7.114 -2.395 509 HG2 PRO 90 1HG PRO 90 -0.063 -6.067 0.061 510 HG3 PRO 90 2HG PRO 90 -0.579 -5.948 -1.631 511 HD2 PRO 90 1HD PRO 90 -1.751 -7.651 0.059 512 HD3 PRO 90 2HD PRO 90 -1.465 -8.097 -1.637 513 H GLN 91 H GLN 91 3.456 -9.775 -0.734 514 HA GLN 91 HA GLN 91 4.452 -8.579 1.764 515 HB2 GLN 91 1HB GLN 91 4.798 -11.423 0.782 516 HB3 GLN 91 2HB GLN 91 5.664 -10.733 2.144 517 HG2 GLN 91 1HG GLN 91 3.592 -10.452 3.357 518 HG3 GLN 91 2HG GLN 91 2.676 -11.046 1.972 519 HE21 GLN 91 1HE2 GLN 91 2.746 -14.124 3.624 520 HE22 GLN 91 2HE2 GLN 91 1.806 -12.747 3.164 521 H ASP 92 H ASP 92 6.563 -7.861 1.669 522 HA ASP 92 HA ASP 92 7.763 -7.613 -0.909 523 HB2 ASP 92 1HB ASP 92 9.699 -6.626 0.336 524 HB3 ASP 92 2HB ASP 92 8.161 -5.844 0.672 525 HA PRO 93 HA PRO 93 10.027 -11.291 -1.453 526 HB2 PRO 93 1HB PRO 93 12.438 -9.624 -1.958 527 HB3 PRO 93 2HB PRO 93 11.693 -10.865 -2.971 528 HG2 PRO 93 1HG PRO 93 11.400 -8.297 -3.565 529 HG3 PRO 93 2HG PRO 93 10.043 -9.427 -3.746 530 HD2 PRO 93 1HD PRO 93 10.562 -7.412 -1.598 531 HD3 PRO 93 2HD PRO 93 9.032 -7.866 -2.375 532 H TRP 94 H TRP 94 11.144 -8.999 0.871 533 HA TRP 94 HA TRP 94 13.204 -10.703 1.953 534 HB2 TRP 94 1HB TRP 94 11.940 -8.204 3.098 535 HB3 TRP 94 2HB TRP 94 13.391 -8.997 3.709 536 HD1 TRP 94 HD1 TRP 94 15.407 -9.216 1.657 537 HE1 TRP 94 HE1 TRP 94 16.193 -7.334 0.090 538 HE3 TRP 94 HE3 TRP 94 11.360 -6.117 2.027 539 HZ2 TRP 94 HZ2 TRP 94 15.225 -4.856 -0.860 540 HZ3 TRP 94 HZ3 TRP 94 11.371 -4.009 0.760 541 HH2 TRP 94 HH2 TRP 94 13.264 -3.393 -0.654 542 H GLY 95 H GLY 95 9.815 -10.274 2.320 543 HA2 GLY 95 1HA GLY 95 8.627 -12.242 3.104 544 HA3 GLY 95 2HA GLY 95 9.867 -12.435 4.332 545 H SER 96 H SER 96 8.729 -9.237 3.706 546 HA SER 96 HA SER 96 7.482 -9.276 6.365 547 HB2 SER 96 1HB SER 96 8.076 -6.696 5.033 548 HB3 SER 96 2HB SER 96 8.358 -7.193 6.704 549 HG SER 96 HG SER 96 9.917 -7.705 4.401 550 H ASP 97 H ASP 97 5.483 -8.342 6.724 551 HA ASP 97 HA ASP 97 3.690 -8.325 4.424 552 HB2 ASP 97 1HB ASP 97 2.777 -9.631 6.114 553 HB3 ASP 97 2HB ASP 97 3.372 -8.573 7.393 554 H TYR 98 H TYR 98 2.859 -6.548 3.568 555 HA TYR 98 HA TYR 98 4.006 -4.060 3.932 556 HB2 TYR 98 1HB TYR 98 1.494 -4.971 2.583 557 HB3 TYR 98 2HB TYR 98 1.868 -3.255 2.675 558 HD1 TYR 98 HD1 TYR 98 2.605 -2.505 0.626 559 HD2 TYR 98 HD2 TYR 98 3.956 -6.291 2.002 560 HE1 TYR 98 HE1 TYR 98 4.027 -2.714 -1.366 561 HE2 TYR 98 HE2 TYR 98 5.382 -6.511 0.015 562 HH TYR 98 HH TYR 98 5.903 -3.882 -2.166 563 H GLN 99 H GLN 99 3.236 -2.061 4.717 564 HA GLN 99 HA GLN 99 1.273 -2.349 6.898 565 HB2 GLN 99 1HB GLN 99 3.475 -0.287 6.753 566 HB3 GLN 99 2HB GLN 99 2.426 -0.627 8.115 567 HG2 GLN 99 1HG GLN 99 4.413 -1.593 8.754 568 HG3 GLN 99 2HG GLN 99 3.529 -2.963 8.082 569 HE21 GLN 99 1HE2 GLN 99 5.842 -3.582 5.567 570 HE22 GLN 99 2HE2 GLN 99 4.362 -4.028 6.346 571 H LEU 100 H LEU 100 -0.445 -1.008 6.913 572 HA LEU 100 HA LEU 100 -0.330 1.410 5.232 573 HB2 LEU 100 1HB LEU 100 -1.910 -0.302 4.342 574 HB3 LEU 100 2HB LEU 100 -2.780 -0.261 5.860 575 HG LEU 100 HG LEU 100 -3.742 1.027 3.842 576 HD11 LEU 100 1HD1 LEU 100 -4.711 1.267 6.018 577 HD12 LEU 100 2HD1 LEU 100 -4.559 2.863 5.286 578 HD13 LEU 100 3HD1 LEU 100 -3.414 2.350 6.524 579 HD21 LEU 100 1HD2 LEU 100 -1.513 2.122 3.378 580 HD22 LEU 100 2HD2 LEU 100 -1.846 3.158 4.765 581 HD23 LEU 100 3HD2 LEU 100 -2.926 3.169 3.370 582 H LEU 101 H LEU 101 -0.445 3.222 6.394 583 HA LEU 101 HA LEU 101 -1.442 2.997 9.159 584 HB2 LEU 101 1HB LEU 101 1.062 3.344 8.721 585 HB3 LEU 101 2HB LEU 101 0.636 4.955 8.190 586 HG LEU 101 HG LEU 101 1.495 4.814 10.531 587 HD11 LEU 101 1HD1 LEU 101 -0.198 6.274 11.519 588 HD12 LEU 101 2HD1 LEU 101 -1.312 5.847 10.220 589 HD13 LEU 101 3HD1 LEU 101 0.177 6.720 9.854 590 HD21 LEU 101 1HD2 LEU 101 0.462 2.680 11.134 591 HD22 LEU 101 2HD2 LEU 101 -1.130 3.438 11.075 592 HD23 LEU 101 3HD2 LEU 101 0.049 3.955 12.280 593 H SER 102 H SER 102 -3.387 3.917 9.241 594 HA SER 102 HA SER 102 -3.745 6.551 8.003 595 HB2 SER 102 1HB SER 102 -6.197 6.143 8.538 596 HB3 SER 102 2HB SER 102 -5.496 5.059 7.338 597 HG SER 102 HG SER 102 -6.461 4.522 9.861 598 HA PRO 103 HA PRO 103 -4.116 8.386 8.143 599 HB2 PRO 103 1HB PRO 103 -3.481 10.840 8.993 600 HB3 PRO 103 2HB PRO 103 -5.115 10.198 9.181 601 HG2 PRO 103 1HG PRO 103 -2.949 10.488 11.201 602 HG3 PRO 103 2HG PRO 103 -4.697 10.698 11.388 603 HD2 PRO 103 1HD PRO 103 -3.245 8.429 12.107 604 HD3 PRO 103 2HD PRO 103 -5.001 8.503 11.882 605 H GLY 104 H GLY 104 -2.421 8.711 6.794 606 HA2 GLY 104 1HA GLY 104 0.118 7.759 7.610 607 HA3 GLY 104 2HA GLY 104 -0.275 8.436 6.037 608 H GLN 105 H GLN 105 2.152 8.834 7.248 609 HA GLN 105 HA GLN 105 2.152 11.410 8.563 610 HB2 GLN 105 1HB GLN 105 3.675 9.578 9.244 611 HB3 GLN 105 2HB GLN 105 4.453 9.665 7.673 612 HG2 GLN 105 1HG GLN 105 5.431 11.728 8.131 613 HG3 GLN 105 2HG GLN 105 4.329 12.057 9.467 614 HE21 GLN 105 1HE2 GLN 105 7.682 9.831 10.032 615 HE22 GLN 105 2HE2 GLN 105 7.149 10.278 8.452 616 H HIS 106 H HIS 106 2.440 10.153 5.384 617 HA HIS 106 HA HIS 106 3.565 12.697 4.406 618 HB2 HIS 106 1HB HIS 106 3.256 10.078 2.921 619 HB3 HIS 106 2HB HIS 106 4.083 11.520 2.338 620 HD1 HIS 106 HD1 HIS 106 4.652 8.387 4.068 621 HD2 HIS 106 HD2 HIS 106 6.480 12.132 3.956 622 HE1 HIS 106 HE1 HIS 106 6.970 8.050 5.001 623 HE2 HIS 106 HE2 HIS 106 8.092 10.293 4.803 624 H GLY 107 H GLY 107 0.935 10.379 3.879 625 HA2 GLY 107 1HA GLY 107 -0.581 12.579 2.606 626 HA3 GLY 107 2HA GLY 107 -0.668 10.923 2.020 627 H GLN 108 H GLN 108 -2.935 10.888 2.352 628 HA GLN 108 HA GLN 108 -4.060 11.264 4.962 629 HB2 GLN 108 1HB GLN 108 -5.171 11.292 2.556 630 HB3 GLN 108 2HB GLN 108 -5.380 9.577 2.868 631 HG2 GLN 108 1HG GLN 108 -6.384 11.752 4.689 632 HG3 GLN 108 2HG GLN 108 -7.347 11.007 3.419 633 HE21 GLN 108 1HE2 GLN 108 -6.774 9.155 6.966 634 HE22 GLN 108 2HE2 GLN 108 -5.956 10.621 6.557 635 H VAL 109 H VAL 109 -3.214 8.476 2.963 636 HA VAL 109 HA VAL 109 -2.804 6.932 5.430 637 HB VAL 109 HB VAL 109 -3.396 4.868 4.138 638 HG11 VAL 109 1HG1 VAL 109 -4.957 5.912 5.714 639 HG12 VAL 109 2HG1 VAL 109 -5.783 5.093 4.389 640 HG13 VAL 109 3HG1 VAL 109 -5.643 6.854 4.391 641 HG21 VAL 109 1HG2 VAL 109 -4.776 5.112 2.119 642 HG22 VAL 109 2HG2 VAL 109 -3.139 5.729 1.885 643 HG23 VAL 109 3HG2 VAL 109 -4.476 6.851 2.141 644 H ASP 110 H ASP 110 -0.922 5.720 5.494 645 HA ASP 110 HA ASP 110 0.893 6.198 3.225 646 HB2 ASP 110 1HB ASP 110 1.233 6.626 6.070 647 HB3 ASP 110 2HB ASP 110 2.485 5.567 5.427 648 H ILE 111 H ILE 111 1.581 4.527 2.143 649 HA ILE 111 HA ILE 111 1.481 1.865 3.386 650 HB ILE 111 HB ILE 111 1.681 1.036 0.985 651 HG12 ILE 111 1HG1 ILE 111 0.895 3.899 0.397 652 HG13 ILE 111 2HG1 ILE 111 2.436 3.154 -0.010 653 HG21 ILE 111 1HG2 ILE 111 -0.401 0.951 2.265 654 HG22 ILE 111 2HG2 ILE 111 -0.696 1.256 0.552 655 HG23 ILE 111 3HG2 ILE 111 -0.798 2.580 1.710 656 HD11 ILE 111 1HD1 ILE 111 1.273 1.595 -1.498 657 HD12 ILE 111 2HD1 ILE 111 1.009 3.278 -1.950 658 HD13 ILE 111 3HD1 ILE 111 -0.257 2.384 -1.111 659 H PHE 112 H PHE 112 3.331 0.881 3.836 660 HA PHE 112 HA PHE 112 5.725 1.408 2.306 661 HB2 PHE 112 1HB PHE 112 7.078 1.997 4.312 662 HB3 PHE 112 2HB PHE 112 5.893 3.220 3.878 663 HD1 PHE 112 HD1 PHE 112 7.042 0.932 6.414 664 HD2 PHE 112 HD2 PHE 112 3.827 3.466 5.250 665 HE1 PHE 112 HE1 PHE 112 6.201 0.917 8.724 666 HE2 PHE 112 HE2 PHE 112 2.976 3.450 7.558 667 HZ PHE 112 HZ PHE 112 4.164 2.178 9.301 668 H SER 113 H SER 113 7.528 0.001 2.945 669 HA SER 113 HA SER 113 6.668 -2.410 4.406 670 HB2 SER 113 1HB SER 113 8.473 -2.361 1.975 671 HB3 SER 113 2HB SER 113 7.866 -3.789 2.814 672 HG SER 113 HG SER 113 5.879 -2.087 2.028 673 H LEU 114 H LEU 114 8.334 -3.493 5.585 674 HA LEU 114 HA LEU 114 9.913 -1.609 6.992 675 HB2 LEU 114 1HB LEU 114 9.960 -4.619 7.173 676 HB3 LEU 114 2HB LEU 114 10.770 -3.532 8.276 677 HG LEU 114 HG LEU 114 8.921 -4.102 9.481 678 HD11 LEU 114 1HD1 LEU 114 9.037 -1.689 9.335 679 HD12 LEU 114 2HD1 LEU 114 7.370 -2.238 9.507 680 HD13 LEU 114 3HD1 LEU 114 7.966 -1.709 7.934 681 HD21 LEU 114 1HD2 LEU 114 7.183 -3.950 7.031 682 HD22 LEU 114 2HD2 LEU 114 6.719 -4.515 8.634 683 HD23 LEU 114 3HD2 LEU 114 7.886 -5.429 7.680 684 H GLY 115 H GLY 115 10.613 -3.698 4.348 685 HA2 GLY 115 1HA GLY 115 12.530 -3.641 3.022 686 HA3 GLY 115 2HA GLY 115 13.324 -2.669 4.255 687 HA PRO 116 HA PRO 116 14.971 -7.039 4.257 688 HB2 PRO 116 1HB PRO 116 17.583 -5.738 4.487 689 HB3 PRO 116 2HB PRO 116 17.013 -6.896 3.284 690 HG2 PRO 116 1HG PRO 116 17.464 -4.296 2.700 691 HG3 PRO 116 2HG PRO 116 16.214 -5.257 1.889 692 HD2 PRO 116 1HD PRO 116 15.936 -3.238 4.079 693 HD3 PRO 116 2HD PRO 116 14.892 -3.530 2.671 694 H ASP 117 H ASP 117 15.494 -4.271 6.289 695 HA ASP 117 HA ASP 117 16.784 -5.910 8.345 696 HB2 ASP 117 1HB ASP 117 17.104 -3.643 9.487 697 HB3 ASP 117 2HB ASP 117 18.017 -3.943 8.013 698 H GLY 118 H GLY 118 13.723 -4.757 7.567 699 HA2 GLY 118 1HA GLY 118 11.743 -5.104 8.702 700 HA3 GLY 118 2HA GLY 118 12.668 -5.789 10.022 701 H VAL 119 H VAL 119 13.825 -2.722 9.191 702 HA VAL 119 HA VAL 119 12.693 -1.640 11.642 703 HB VAL 119 HB VAL 119 14.718 -0.407 9.768 704 HG11 VAL 119 1HG1 VAL 119 13.935 0.348 12.584 705 HG12 VAL 119 2HG1 VAL 119 13.534 1.251 11.123 706 HG13 VAL 119 3HG1 VAL 119 15.216 1.097 11.631 707 HG21 VAL 119 1HG2 VAL 119 15.103 -1.916 12.353 708 HG22 VAL 119 2HG2 VAL 119 16.371 -1.080 11.458 709 HG23 VAL 119 3HG2 VAL 119 15.556 -2.471 10.742 710 HA PRO 120 HA PRO 120 9.584 0.528 9.186 711 HB2 PRO 120 1HB PRO 120 8.394 1.274 11.715 712 HB3 PRO 120 2HB PRO 120 7.772 0.172 10.487 713 HG2 PRO 120 1HG PRO 120 8.624 -0.630 12.958 714 HG3 PRO 120 2HG PRO 120 8.632 -1.669 11.523 715 HD2 PRO 120 1HD PRO 120 10.888 -0.183 12.807 716 HD3 PRO 120 2HD PRO 120 10.869 -1.800 12.069 717 H GLU 121 H GLU 121 9.008 2.684 8.876 718 HA GLU 121 HA GLU 121 9.141 4.948 8.913 719 HB2 GLU 121 1HB GLU 121 9.870 4.378 11.776 720 HB3 GLU 121 2HB GLU 121 9.829 6.017 11.145 721 HG2 GLU 121 1HG GLU 121 7.498 4.123 11.041 722 HG3 GLU 121 2HG GLU 121 7.762 5.298 12.329 723 H SER 122 H SER 122 11.518 3.093 8.469 724 HA SER 122 HA SER 122 13.751 4.883 8.998 725 HB2 SER 122 1HB SER 122 14.922 2.797 7.878 726 HB3 SER 122 2HB SER 122 14.346 2.716 9.545 727 HG SER 122 HG SER 122 13.691 1.107 7.633 728 H ASN 123 H ASN 123 15.439 4.847 7.068 729 HA ASN 123 HA ASN 123 14.032 6.012 4.813 730 HB2 ASN 123 1HB ASN 123 16.983 5.818 5.436 731 HB3 ASN 123 2HB ASN 123 16.331 6.593 3.998 732 HD21 ASN 123 1HD2 ASN 123 15.249 9.484 5.657 733 HD22 ASN 123 2HD2 ASN 123 15.086 8.499 4.246 734 H ASP 124 H ASP 124 15.710 3.101 5.622 735 HA ASP 124 HA ASP 124 16.043 2.099 2.969 736 HB2 ASP 124 1HB ASP 124 16.542 0.008 3.973 737 HB3 ASP 124 2HB ASP 124 17.130 1.207 5.124 738 H ASP 125 H ASP 125 13.407 2.457 5.115 739 HA ASP 125 HA ASP 125 11.688 0.389 4.411 740 HB2 ASP 125 1HB ASP 125 11.284 3.181 5.406 741 HB3 ASP 125 2HB ASP 125 9.889 2.248 4.888 742 H ILE 126 H ILE 126 10.478 -0.033 2.666 743 HA ILE 126 HA ILE 126 10.770 1.705 0.372 744 HB ILE 126 HB ILE 126 9.076 -0.785 0.520 745 HG12 ILE 126 1HG1 ILE 126 11.352 -1.387 1.178 746 HG13 ILE 126 2HG1 ILE 126 11.024 -1.979 -0.446 747 HG21 ILE 126 1HG2 ILE 126 9.260 -0.777 -1.872 748 HG22 ILE 126 2HG2 ILE 126 10.418 0.555 -1.822 749 HG23 ILE 126 3HG2 ILE 126 8.742 0.831 -1.349 750 HD11 ILE 126 1HD1 ILE 126 12.256 -0.067 -1.366 751 HD12 ILE 126 2HD1 ILE 126 13.252 -1.073 -0.315 752 HD13 ILE 126 3HD1 ILE 126 12.622 0.465 0.274 753 H GLY 127 H GLY 127 9.639 3.507 0.705 754 HA2 GLY 127 1HA GLY 127 6.808 3.257 1.468 755 HA3 GLY 127 2HA GLY 127 7.791 4.700 1.690 756 H ASN 128 H ASN 128 5.227 4.317 0.297 757 HA ASN 128 HA ASN 128 5.661 4.449 -2.494 758 HB2 ASN 128 1HB ASN 128 3.486 3.927 -1.378 759 HB3 ASN 128 2HB ASN 128 3.347 5.632 -0.959 760 HD21 ASN 128 1HD2 ASN 128 1.503 5.877 -3.893 761 HD22 ASN 128 2HD2 ASN 128 1.487 5.862 -2.164 762 H TRP 129 H TRP 129 5.818 6.777 0.051 763 HA TRP 129 HA TRP 129 5.896 9.096 -1.620 764 HB2 TRP 129 1HB TRP 129 5.274 9.239 0.748 765 HB3 TRP 129 2HB TRP 129 6.862 8.644 1.217 766 HD1 TRP 129 HD1 TRP 129 5.126 11.775 -0.160 767 HE1 TRP 129 HE1 TRP 129 6.677 13.792 0.211 768 HE3 TRP 129 HE3 TRP 129 9.283 9.308 1.504 769 HZ2 TRP 129 HZ2 TRP 129 9.316 14.272 1.090 770 HZ3 TRP 129 HZ3 TRP 129 11.278 10.618 2.086 771 HH2 TRP 129 HH2 TRP 129 11.295 13.051 1.883 772 H THR 130 H THR 130 8.167 6.718 -0.530 773 HA THR 130 HA THR 130 10.535 8.230 -1.025 774 HB THR 130 HB THR 130 10.419 5.225 -0.953 775 HG1 THR 130 HG1 THR 130 10.788 6.375 1.488 776 HG21 THR 130 1HG2 THR 130 12.411 7.259 0.063 777 HG22 THR 130 2HG2 THR 130 12.588 6.261 -1.380 778 HG23 THR 130 3HG2 THR 130 12.570 5.509 0.215 779 H ILE 131 H ILE 131 8.649 5.842 -2.839 780 HA ILE 131 HA ILE 131 10.476 5.867 -5.055 781 HB ILE 131 HB ILE 131 9.212 3.854 -4.695 782 HG12 ILE 131 1HG1 ILE 131 8.180 3.553 -6.944 783 HG13 ILE 131 2HG1 ILE 131 8.335 5.286 -7.208 784 HG21 ILE 131 1HG2 ILE 131 6.755 5.539 -5.092 785 HG22 ILE 131 2HG2 ILE 131 7.256 4.707 -3.620 786 HG23 ILE 131 3HG2 ILE 131 6.768 3.776 -5.035 787 HD11 ILE 131 1HD1 ILE 131 10.608 3.368 -6.746 788 HD12 ILE 131 2HD1 ILE 131 10.757 5.100 -7.037 789 HD13 ILE 131 3HD1 ILE 131 10.121 4.046 -8.299 790 H GLY 132 H GLY 132 7.378 7.421 -4.290 791 HA2 GLY 132 1HA GLY 132 7.357 9.797 -4.836 792 HA3 GLY 132 2HA GLY 132 8.126 9.386 -6.355 793 H PHE 133 H PHE 133 5.627 7.188 -5.564 794 HA PHE 133 HA PHE 133 4.033 8.127 -7.726 795 HB2 PHE 133 1HB PHE 133 3.605 6.019 -5.631 796 HB3 PHE 133 2HB PHE 133 2.307 6.473 -6.727 797 HD1 PHE 133 HD1 PHE 133 5.482 4.741 -6.387 798 HD2 PHE 133 HD2 PHE 133 2.493 6.034 -9.120 799 HE1 PHE 133 HE1 PHE 133 6.374 3.199 -8.082 800 HE2 PHE 133 HE2 PHE 133 3.378 4.494 -10.820 801 HZ PHE 133 HZ PHE 133 5.321 3.073 -10.301 802 H HIS 134 H HIS 134 3.026 7.753 -4.323 803 HA HIS 134 HA HIS 134 0.997 9.790 -4.736 804 HB2 HIS 134 1HB HIS 134 0.775 7.567 -3.377 805 HB3 HIS 134 2HB HIS 134 1.561 8.477 -2.093 806 HD1 HIS 134 HD1 HIS 134 -1.671 7.626 -3.317 807 HD2 HIS 134 HD2 HIS 134 -0.001 11.008 -1.548 808 HE1 HIS 134 HE1 HIS 134 -3.613 8.969 -2.433 809 HE2 HIS 134 HE2 HIS 134 -2.569 10.935 -1.257 810 H HIS 135 H HIS 135 2.881 11.313 -5.138 811 HA HIS 135 HA HIS 135 4.113 12.301 -2.678 812 HB2 HIS 135 1HB HIS 135 5.506 13.687 -4.149 813 HB3 HIS 135 2HB HIS 135 5.577 11.998 -4.629 814 HD1 HIS 135 HD1 HIS 135 4.799 11.408 -6.980 815 HD2 HIS 135 HD2 HIS 135 4.119 15.387 -5.970 816 HE1 HIS 135 HE1 HIS 135 4.113 12.543 -9.114 817 HE2 HIS 135 HE2 HIS 135 3.876 14.976 -8.513 818 H HIS 136 H HIS 136 3.900 14.460 -1.984 819 HA HIS 136 HA HIS 136 1.433 15.744 -2.917 820 HB2 HIS 136 1HB HIS 136 1.695 15.254 -0.468 821 HB3 HIS 136 2HB HIS 136 3.050 16.375 -0.436 822 HD1 HIS 136 HD1 HIS 136 2.409 18.619 0.378 823 HD2 HIS 136 HD2 HIS 136 -0.743 16.714 -1.551 824 HE1 HIS 136 HE1 HIS 136 0.468 20.218 0.502 825 HE2 HIS 136 HE2 HIS 136 -1.388 19.094 -0.777 826 H HIS 137 H HIS 137 1.437 17.794 -3.760 827 HA HIS 137 HA HIS 137 4.039 18.695 -4.698 828 HB2 HIS 137 1HB HIS 137 2.218 18.385 -6.327 829 HB3 HIS 137 2HB HIS 137 1.263 19.600 -5.486 830 HD1 HIS 137 HD1 HIS 137 4.530 19.315 -7.390 831 HD2 HIS 137 HD2 HIS 137 1.674 22.145 -6.353 832 HE1 HIS 137 HE1 HIS 137 5.203 21.418 -8.581 833 HE2 HIS 137 HE2 HIS 137 3.588 23.164 -7.751 834 H HIS 138 H HIS 138 4.726 19.538 -2.631 835 HA HIS 138 HA HIS 138 4.002 22.348 -2.432 836 HB2 HIS 138 1HB HIS 138 2.553 21.060 -0.793 837 HB3 HIS 138 2HB HIS 138 4.031 20.648 0.066 838 HD1 HIS 138 HD1 HIS 138 1.872 23.621 -0.803 839 HD2 HIS 138 HD2 HIS 138 4.996 22.614 1.750 840 HE1 HIS 138 HE1 HIS 138 2.115 25.564 0.771 841 HE2 HIS 138 HE2 HIS 138 3.860 24.837 2.430 842 H HIS 139 H HIS 139 6.253 19.858 -2.338 843 HA HIS 139 HA HIS 139 8.269 21.372 -0.883 844 HB2 HIS 139 1HB HIS 139 8.116 18.925 -0.555 845 HB3 HIS 139 2HB HIS 139 8.462 18.681 -2.262 846 HD1 HIS 139 HD1 HIS 139 10.799 17.957 -2.585 847 HD2 HIS 139 HD2 HIS 139 10.444 20.613 0.595 848 HE1 HIS 139 HE1 HIS 139 13.122 18.237 -1.677 849 HE2 HIS 139 HE2 HIS 139 12.854 19.704 0.350 850 H LYS 140 H LYS 140 7.327 20.587 -4.126 851 HA LYS 140 HA LYS 140 9.797 21.701 -5.219 852 HB2 LYS 140 1HB LYS 140 7.466 20.334 -6.582 853 HB3 LYS 140 2HB LYS 140 8.908 20.918 -7.401 854 HG2 LYS 140 1HG LYS 140 10.284 19.355 -6.160 855 HG3 LYS 140 2HG LYS 140 8.875 18.806 -5.253 856 HD2 LYS 140 1HD LYS 140 9.395 17.230 -7.023 857 HD3 LYS 140 2HD LYS 140 7.854 18.022 -7.351 858 HE2 LYS 140 1HE LYS 140 8.931 19.515 -8.931 859 HE3 LYS 140 2HE LYS 140 10.501 18.804 -8.564 860 HZ1 LYS 140 1HZ LYS 140 8.202 17.371 -9.780 861 HZ2 LYS 140 2HZ LYS 140 9.717 16.700 -9.447 862 HZ3 LYS 140 3HZ LYS 140 9.570 17.917 -10.611 Start of MODEL 5 1 H1 MET 25 1H MET 25 28.516 -9.703 -3.455 2 H2 MET 25 2H MET 25 29.620 -10.342 -4.562 3 H3 MET 25 3H MET 25 28.444 -11.339 -3.862 4 HA MET 25 HA MET 25 27.915 -9.068 -5.676 5 HB2 MET 25 1HB MET 25 27.702 -12.049 -6.148 6 HB3 MET 25 2HB MET 25 27.142 -10.811 -7.261 7 HG2 MET 25 1HG MET 25 29.212 -11.546 -8.087 8 HG3 MET 25 2HG MET 25 29.512 -9.975 -7.349 9 HE1 MET 25 1HE MET 25 29.040 -13.499 -5.564 10 HE2 MET 25 2HE MET 25 30.719 -14.030 -5.508 11 HE3 MET 25 3HE MET 25 29.910 -13.831 -7.061 12 H GLY 26 H GLY 26 26.475 -8.326 -3.979 13 HA2 GLY 26 1HA GLY 26 23.920 -9.779 -4.089 14 HA3 GLY 26 2HA GLY 26 24.568 -9.283 -2.531 15 H ASN 27 H ASN 27 25.172 -7.222 -5.212 16 HA ASN 27 HA ASN 27 23.469 -5.211 -3.984 17 HB2 ASN 27 1HB ASN 27 25.795 -4.617 -4.574 18 HB3 ASN 27 2HB ASN 27 25.434 -4.929 -6.268 19 HD21 ASN 27 1HD2 ASN 27 24.137 -1.518 -4.457 20 HD22 ASN 27 2HD2 ASN 27 24.695 -2.869 -3.529 21 H LYS 28 H LYS 28 21.586 -6.464 -4.632 22 HA LYS 28 HA LYS 28 20.746 -5.787 -7.373 23 HB2 LYS 28 1HB LYS 28 19.653 -7.943 -5.545 24 HB3 LYS 28 2HB LYS 28 19.091 -7.599 -7.177 25 HG2 LYS 28 1HG LYS 28 21.299 -8.204 -8.055 26 HG3 LYS 28 2HG LYS 28 21.839 -8.578 -6.418 27 HD2 LYS 28 1HD LYS 28 20.117 -10.320 -6.260 28 HD3 LYS 28 2HD LYS 28 19.594 -9.948 -7.905 29 HE2 LYS 28 1HE LYS 28 21.843 -10.532 -8.724 30 HE3 LYS 28 2HE LYS 28 22.318 -10.955 -7.081 31 HZ1 LYS 28 1HZ LYS 28 21.721 -12.914 -8.343 32 HZ2 LYS 28 2HZ LYS 28 20.187 -12.280 -8.671 33 HZ3 LYS 28 3HZ LYS 28 20.615 -12.682 -7.086 34 H GLU 29 H GLU 29 20.827 -3.962 -5.274 35 HA GLU 29 HA GLU 29 18.584 -3.710 -3.653 36 HB2 GLU 29 1HB GLU 29 20.727 -2.411 -3.500 37 HB3 GLU 29 2HB GLU 29 20.189 -1.458 -4.873 38 HG2 GLU 29 1HG GLU 29 19.724 -0.186 -2.952 39 HG3 GLU 29 2HG GLU 29 18.177 -0.826 -3.511 40 H LYS 30 H LYS 30 19.163 -2.494 -6.927 41 HA LYS 30 HA LYS 30 16.761 -0.974 -7.045 42 HB2 LYS 30 1HB LYS 30 18.456 -2.015 -9.316 43 HB3 LYS 30 2HB LYS 30 17.225 -0.771 -9.436 44 HG2 LYS 30 1HG LYS 30 18.533 0.663 -7.946 45 HG3 LYS 30 2HG LYS 30 19.775 -0.584 -7.850 46 HD2 LYS 30 1HD LYS 30 18.885 0.812 -10.374 47 HD3 LYS 30 2HD LYS 30 20.349 1.185 -9.465 48 HE2 LYS 30 1HE LYS 30 19.721 -1.468 -10.762 49 HE3 LYS 30 2HE LYS 30 20.794 -0.238 -11.424 50 HZ1 LYS 30 1HZ LYS 30 21.186 -1.713 -8.876 51 HZ2 LYS 30 2HZ LYS 30 22.198 -0.486 -9.453 52 HZ3 LYS 30 3HZ LYS 30 22.056 -1.939 -10.308 53 H ALA 31 H ALA 31 17.651 -4.234 -7.966 54 HA ALA 31 HA ALA 31 15.308 -4.844 -9.429 55 HB1 ALA 31 1HB ALA 31 17.417 -6.121 -9.584 56 HB2 ALA 31 2HB ALA 31 16.017 -7.146 -9.269 57 HB3 ALA 31 3HB ALA 31 17.128 -6.745 -7.960 58 H ASP 32 H ASP 32 16.235 -5.396 -6.047 59 HA ASP 32 HA ASP 32 13.877 -6.757 -5.306 60 HB2 ASP 32 1HB ASP 32 16.039 -5.356 -3.776 61 HB3 ASP 32 2HB ASP 32 14.590 -5.901 -2.940 62 H ARG 33 H ARG 33 14.777 -3.330 -5.116 63 HA ARG 33 HA ARG 33 12.443 -2.603 -3.695 64 HB2 ARG 33 1HB ARG 33 13.017 -0.273 -4.203 65 HB3 ARG 33 2HB ARG 33 14.377 -1.178 -3.563 66 HG2 ARG 33 1HG ARG 33 15.217 -1.442 -5.881 67 HG3 ARG 33 2HG ARG 33 13.910 -0.384 -6.425 68 HD2 ARG 33 1HD ARG 33 16.025 0.349 -4.406 69 HD3 ARG 33 2HD ARG 33 16.040 0.820 -6.103 70 HE ARG 33 HE ARG 33 13.956 2.063 -5.631 71 HH11 ARG 33 1HH1 ARG 33 16.036 1.218 -2.938 72 HH12 ARG 33 2HH1 ARG 33 15.545 2.574 -1.976 73 HH21 ARG 33 1HH2 ARG 33 13.305 3.833 -4.357 74 HH22 ARG 33 2HH2 ARG 33 13.998 4.058 -2.780 75 H GLN 34 H GLN 34 13.148 -2.773 -7.163 76 HA GLN 34 HA GLN 34 10.796 -1.451 -8.008 77 HB2 GLN 34 1HB GLN 34 12.481 -3.542 -9.374 78 HB3 GLN 34 2HB GLN 34 11.097 -2.775 -10.141 79 HG2 GLN 34 1HG GLN 34 12.249 -0.564 -9.654 80 HG3 GLN 34 2HG GLN 34 13.683 -1.523 -9.283 81 HE21 GLN 34 1HE2 GLN 34 12.450 -0.984 -13.104 82 HE22 GLN 34 2HE2 GLN 34 11.497 -0.476 -11.753 83 H LYS 35 H LYS 35 11.447 -4.813 -7.177 84 HA LYS 35 HA LYS 35 8.916 -5.888 -7.802 85 HB2 LYS 35 1HB LYS 35 10.851 -7.291 -7.245 86 HB3 LYS 35 2HB LYS 35 10.879 -6.636 -5.616 87 HG2 LYS 35 1HG LYS 35 9.912 -8.827 -5.572 88 HG3 LYS 35 2HG LYS 35 8.663 -7.636 -5.210 89 HD2 LYS 35 1HD LYS 35 7.758 -9.276 -6.708 90 HD3 LYS 35 2HD LYS 35 7.933 -7.755 -7.580 91 HE2 LYS 35 1HE LYS 35 10.011 -8.570 -8.576 92 HE3 LYS 35 2HE LYS 35 9.846 -10.084 -7.689 93 HZ1 LYS 35 1HZ LYS 35 8.013 -9.055 -9.782 94 HZ2 LYS 35 2HZ LYS 35 7.743 -10.460 -8.877 95 HZ3 LYS 35 3HZ LYS 35 9.069 -10.368 -9.923 96 H VAL 36 H VAL 36 10.187 -4.283 -4.957 97 HA VAL 36 HA VAL 36 7.918 -4.404 -3.323 98 HB VAL 36 HB VAL 36 10.104 -2.326 -3.515 99 HG11 VAL 36 1HG1 VAL 36 9.427 -1.506 -1.359 100 HG12 VAL 36 2HG1 VAL 36 8.116 -2.684 -1.281 101 HG13 VAL 36 3HG1 VAL 36 8.067 -1.388 -2.478 102 HG21 VAL 36 1HG2 VAL 36 9.668 -4.623 -1.615 103 HG22 VAL 36 2HG2 VAL 36 10.985 -3.453 -1.527 104 HG23 VAL 36 3HG2 VAL 36 10.869 -4.550 -2.904 105 H VAL 37 H VAL 37 8.922 -2.053 -5.774 106 HA VAL 37 HA VAL 37 6.814 -0.235 -5.481 107 HB VAL 37 HB VAL 37 8.368 -0.918 -7.986 108 HG11 VAL 37 1HG1 VAL 37 6.295 0.246 -8.532 109 HG12 VAL 37 2HG1 VAL 37 7.690 1.294 -8.793 110 HG13 VAL 37 3HG1 VAL 37 6.683 1.506 -7.360 111 HG21 VAL 37 1HG2 VAL 37 9.729 1.021 -7.419 112 HG22 VAL 37 2HG2 VAL 37 9.775 -0.176 -6.124 113 HG23 VAL 37 3HG2 VAL 37 8.781 1.271 -5.952 114 H SER 38 H SER 38 7.051 -3.210 -7.393 115 HA SER 38 HA SER 38 4.685 -2.885 -8.870 116 HB2 SER 38 1HB SER 38 6.022 -5.443 -7.953 117 HB3 SER 38 2HB SER 38 4.794 -5.330 -9.214 118 HG SER 38 HG SER 38 6.728 -3.572 -9.758 119 H ASP 39 H ASP 39 5.243 -4.550 -5.761 120 HA ASP 39 HA ASP 39 2.497 -5.188 -5.415 121 HB2 ASP 39 1HB ASP 39 4.859 -5.179 -3.565 122 HB3 ASP 39 2HB ASP 39 3.235 -5.456 -2.944 123 H LEU 40 H LEU 40 4.508 -2.491 -4.555 124 HA LEU 40 HA LEU 40 2.792 -1.223 -2.719 125 HB2 LEU 40 1HB LEU 40 5.235 -0.785 -3.094 126 HB3 LEU 40 2HB LEU 40 4.798 0.079 -4.554 127 HG LEU 40 HG LEU 40 3.526 1.701 -3.194 128 HD11 LEU 40 1HD1 LEU 40 3.884 1.690 -0.741 129 HD12 LEU 40 2HD1 LEU 40 4.616 0.093 -0.888 130 HD13 LEU 40 3HD1 LEU 40 2.921 0.328 -1.312 131 HD21 LEU 40 1HD2 LEU 40 5.797 2.221 -3.787 132 HD22 LEU 40 2HD2 LEU 40 6.409 1.265 -2.438 133 HD23 LEU 40 3HD2 LEU 40 5.507 2.747 -2.129 134 H VAL 41 H VAL 41 3.190 -0.781 -6.245 135 HA VAL 41 HA VAL 41 1.256 1.257 -6.474 136 HB VAL 41 HB VAL 41 1.156 0.797 -8.861 137 HG11 VAL 41 1HG1 VAL 41 3.010 2.106 -8.030 138 HG12 VAL 41 2HG1 VAL 41 3.524 1.121 -9.401 139 HG13 VAL 41 3HG1 VAL 41 3.952 0.640 -7.759 140 HG21 VAL 41 1HG2 VAL 41 2.840 -1.633 -8.272 141 HG22 VAL 41 2HG2 VAL 41 2.450 -1.014 -9.878 142 HG23 VAL 41 3HG2 VAL 41 1.169 -1.633 -8.834 143 H ALA 42 H ALA 42 0.994 -2.263 -6.543 144 HA ALA 42 HA ALA 42 -1.737 -2.440 -7.182 145 HB1 ALA 42 1HB ALA 42 -0.071 -4.213 -5.399 146 HB2 ALA 42 2HB ALA 42 -0.331 -4.409 -7.133 147 HB3 ALA 42 3HB ALA 42 -1.677 -4.617 -6.008 148 H LEU 43 H LEU 43 -0.092 -1.930 -4.086 149 HA LEU 43 HA LEU 43 -2.367 -1.946 -2.432 150 HB2 LEU 43 1HB LEU 43 0.244 -0.462 -2.157 151 HB3 LEU 43 2HB LEU 43 -0.978 -0.518 -0.903 152 HG LEU 43 HG LEU 43 0.585 -2.864 -1.975 153 HD11 LEU 43 1HD1 LEU 43 1.471 -2.904 0.331 154 HD12 LEU 43 2HD1 LEU 43 0.622 -1.392 0.650 155 HD13 LEU 43 3HD1 LEU 43 1.907 -1.442 -0.557 156 HD21 LEU 43 1HD2 LEU 43 -1.546 -2.739 0.157 157 HD22 LEU 43 2HD2 LEU 43 -0.519 -4.133 -0.177 158 HD23 LEU 43 3HD2 LEU 43 -1.661 -3.567 -1.394 159 H GLU 44 H GLU 44 -0.690 0.740 -4.053 160 HA GLU 44 HA GLU 44 -2.411 2.756 -3.113 161 HB2 GLU 44 1HB GLU 44 -0.202 3.224 -4.130 162 HB3 GLU 44 2HB GLU 44 -0.842 2.739 -5.697 163 HG2 GLU 44 1HG GLU 44 -2.536 4.534 -5.507 164 HG3 GLU 44 2HG GLU 44 -1.759 5.054 -4.015 165 H GLY 45 H GLY 45 -2.528 0.679 -5.955 166 HA2 GLY 45 1HA GLY 45 -4.706 1.869 -7.260 167 HA3 GLY 45 2HA GLY 45 -4.248 0.176 -7.383 168 H ALA 46 H ALA 46 -4.614 -0.704 -4.817 169 HA ALA 46 HA ALA 46 -7.371 -1.152 -4.648 170 HB1 ALA 46 1HB ALA 46 -5.579 -2.572 -3.650 171 HB2 ALA 46 2HB ALA 46 -6.926 -2.233 -2.563 172 HB3 ALA 46 3HB ALA 46 -5.403 -1.364 -2.379 173 H LEU 47 H LEU 47 -5.288 1.086 -2.860 174 HA LEU 47 HA LEU 47 -7.268 2.199 -1.201 175 HB2 LEU 47 1HB LEU 47 -4.569 3.025 -2.138 176 HB3 LEU 47 2HB LEU 47 -5.586 4.259 -1.426 177 HG LEU 47 HG LEU 47 -5.662 3.101 0.669 178 HD11 LEU 47 1HD1 LEU 47 -5.840 0.822 -0.072 179 HD12 LEU 47 2HD1 LEU 47 -4.469 0.976 1.026 180 HD13 LEU 47 3HD1 LEU 47 -4.195 0.864 -0.714 181 HD21 LEU 47 1HD2 LEU 47 -3.697 4.466 0.268 182 HD22 LEU 47 2HD2 LEU 47 -2.862 3.084 -0.442 183 HD23 LEU 47 3HD2 LEU 47 -3.292 3.072 1.268 184 H ASP 48 H ASP 48 -6.088 3.146 -4.387 185 HA ASP 48 HA ASP 48 -7.586 5.511 -4.654 186 HB2 ASP 48 1HB ASP 48 -5.653 4.950 -6.075 187 HB3 ASP 48 2HB ASP 48 -6.570 3.638 -6.807 188 H MET 49 H MET 49 -8.279 2.169 -5.582 189 HA MET 49 HA MET 49 -10.805 2.742 -6.760 190 HB2 MET 49 1HB MET 49 -9.645 0.162 -5.691 191 HB3 MET 49 2HB MET 49 -11.180 0.270 -6.542 192 HG2 MET 49 1HG MET 49 -10.045 1.098 -8.521 193 HG3 MET 49 2HG MET 49 -8.503 1.052 -7.671 194 HE1 MET 49 1HE MET 49 -11.468 -1.063 -9.123 195 HE2 MET 49 2HE MET 49 -11.425 -1.592 -7.442 196 HE3 MET 49 3HE MET 49 -10.967 -2.706 -8.729 197 H TYR 50 H TYR 50 -9.761 1.771 -3.544 198 HA TYR 50 HA TYR 50 -12.291 1.316 -2.412 199 HB2 TYR 50 1HB TYR 50 -9.833 0.932 -1.506 200 HB3 TYR 50 2HB TYR 50 -10.086 2.516 -0.786 201 HD1 TYR 50 HD1 TYR 50 -11.883 2.832 0.909 202 HD2 TYR 50 HD2 TYR 50 -10.912 -0.998 -0.666 203 HE1 TYR 50 HE1 TYR 50 -13.077 1.759 2.782 204 HE2 TYR 50 HE2 TYR 50 -12.100 -2.076 1.191 205 HH TYR 50 HH TYR 50 -14.193 -0.427 3.255 206 H LYS 51 H LYS 51 -10.300 4.222 -2.656 207 HA LYS 51 HA LYS 51 -12.122 5.935 -1.299 208 HB2 LYS 51 1HB LYS 51 -9.728 6.462 -1.535 209 HB3 LYS 51 2HB LYS 51 -9.933 6.619 -3.274 210 HG2 LYS 51 1HG LYS 51 -11.352 8.539 -2.985 211 HG3 LYS 51 2HG LYS 51 -11.330 8.338 -1.232 212 HD2 LYS 51 1HD LYS 51 -8.922 8.752 -1.214 213 HD3 LYS 51 2HD LYS 51 -8.936 8.936 -2.968 214 HE2 LYS 51 1HE LYS 51 -10.489 10.665 -1.050 215 HE3 LYS 51 2HE LYS 51 -8.923 11.091 -1.736 216 HZ1 LYS 51 1HZ LYS 51 -9.928 10.964 -3.947 217 HZ2 LYS 51 2HZ LYS 51 -10.692 12.120 -2.976 218 HZ3 LYS 51 3HZ LYS 51 -11.433 10.626 -3.250 219 H LEU 52 H LEU 52 -11.757 4.923 -4.640 220 HA LEU 52 HA LEU 52 -13.437 6.859 -5.802 221 HB2 LEU 52 1HB LEU 52 -11.976 5.360 -7.096 222 HB3 LEU 52 2HB LEU 52 -12.983 3.999 -6.650 223 HG LEU 52 HG LEU 52 -14.881 5.053 -7.858 224 HD11 LEU 52 1HD1 LEU 52 -14.169 7.374 -7.716 225 HD12 LEU 52 2HD1 LEU 52 -14.424 6.897 -9.394 226 HD13 LEU 52 3HD1 LEU 52 -12.786 7.025 -8.753 227 HD21 LEU 52 1HD2 LEU 52 -14.078 4.535 -10.082 228 HD22 LEU 52 2HD2 LEU 52 -13.453 3.364 -8.922 229 HD23 LEU 52 3HD2 LEU 52 -12.408 4.647 -9.530 230 H ASP 53 H ASP 53 -14.134 3.598 -4.576 231 HA ASP 53 HA ASP 53 -16.939 3.832 -5.094 232 HB2 ASP 53 1HB ASP 53 -15.176 1.780 -3.863 233 HB3 ASP 53 2HB ASP 53 -16.893 1.725 -3.475 234 H ASN 54 H ASN 54 -14.953 4.075 -2.162 235 HA ASN 54 HA ASN 54 -17.407 4.466 -0.604 236 HB2 ASN 54 1HB ASN 54 -14.571 3.962 0.320 237 HB3 ASN 54 2HB ASN 54 -15.967 4.126 1.379 238 HD21 ASN 54 1HD2 ASN 54 -15.238 0.678 -0.614 239 HD22 ASN 54 2HD2 ASN 54 -14.322 2.116 -0.905 240 H SER 55 H SER 55 -15.251 6.361 -2.178 241 HA SER 55 HA SER 55 -14.840 8.583 -2.214 242 HB2 SER 55 1HB SER 55 -17.072 8.716 -0.187 243 HB3 SER 55 2HB SER 55 -16.423 10.087 -1.087 244 HG SER 55 HG SER 55 -17.895 7.872 -2.036 245 H ARG 56 H ARG 56 -13.662 6.770 -0.014 246 HA ARG 56 HA ARG 56 -12.182 8.877 1.276 247 HB2 ARG 56 1HB ARG 56 -12.672 8.184 3.569 248 HB3 ARG 56 2HB ARG 56 -14.138 8.704 2.755 249 HG2 ARG 56 1HG ARG 56 -15.008 6.838 3.626 250 HG3 ARG 56 2HG ARG 56 -14.205 6.037 2.275 251 HD2 ARG 56 1HD ARG 56 -13.623 4.822 4.229 252 HD3 ARG 56 2HD ARG 56 -12.201 5.758 3.776 253 HE ARG 56 HE ARG 56 -13.695 7.256 5.614 254 HH11 ARG 56 1HH1 ARG 56 -11.726 4.367 5.493 255 HH12 ARG 56 2HH1 ARG 56 -11.325 4.405 7.181 256 HH21 ARG 56 1HH2 ARG 56 -13.159 7.319 7.839 257 HH22 ARG 56 2HH2 ARG 56 -12.137 6.086 8.511 258 H TYR 57 H TYR 57 -10.219 8.173 2.114 259 HA TYR 57 HA TYR 57 -9.143 5.819 0.975 260 HB2 TYR 57 1HB TYR 57 -8.138 7.882 2.895 261 HB3 TYR 57 2HB TYR 57 -7.227 6.391 2.685 262 HD1 TYR 57 HD1 TYR 57 -7.346 9.665 1.664 263 HD2 TYR 57 HD2 TYR 57 -7.048 5.753 0.022 264 HE1 TYR 57 HE1 TYR 57 -6.260 10.591 -0.339 265 HE2 TYR 57 HE2 TYR 57 -5.967 6.665 -1.982 266 HH TYR 57 HH TYR 57 -4.817 9.895 -2.141 267 HA PRO 58 HA PRO 58 -10.295 2.787 3.947 268 HB2 PRO 58 1HB PRO 58 -8.374 0.945 3.446 269 HB3 PRO 58 2HB PRO 58 -9.723 1.240 2.342 270 HG2 PRO 58 1HG PRO 58 -6.912 2.267 2.216 271 HG3 PRO 58 2HG PRO 58 -7.911 1.597 0.913 272 HD2 PRO 58 1HD PRO 58 -7.582 4.251 1.245 273 HD3 PRO 58 2HD PRO 58 -9.107 3.561 0.656 274 H THR 59 H THR 59 -9.774 2.098 5.987 275 HA THR 59 HA THR 59 -7.524 3.339 7.287 276 HB THR 59 HB THR 59 -9.268 1.330 8.652 277 HG1 THR 59 HG1 THR 59 -10.986 2.427 8.043 278 HG21 THR 59 1HG2 THR 59 -9.116 2.985 10.483 279 HG22 THR 59 2HG2 THR 59 -8.136 4.019 9.444 280 HG23 THR 59 3HG2 THR 59 -7.529 2.444 9.948 281 H THR 60 H THR 60 -6.469 1.642 9.029 282 HA THR 60 HA THR 60 -4.494 0.485 7.516 283 HB THR 60 HB THR 60 -4.152 1.122 9.826 284 HG1 THR 60 HG1 THR 60 -2.734 -0.437 8.952 285 HG21 THR 60 1HG2 THR 60 -4.933 -0.286 11.677 286 HG22 THR 60 2HG2 THR 60 -5.841 -1.278 10.536 287 HG23 THR 60 3HG2 THR 60 -6.282 0.412 10.779 288 H GLU 61 H GLU 61 -7.330 -1.177 8.896 289 HA GLU 61 HA GLU 61 -6.416 -3.753 8.007 290 HB2 GLU 61 1HB GLU 61 -7.929 -3.467 9.965 291 HB3 GLU 61 2HB GLU 61 -9.194 -2.924 8.871 292 HG2 GLU 61 1HG GLU 61 -9.599 -5.209 9.404 293 HG3 GLU 61 2HG GLU 61 -9.069 -5.122 7.725 294 H GLN 62 H GLN 62 -8.665 -1.317 6.872 295 HA GLN 62 HA GLN 62 -9.861 -2.914 4.859 296 HB2 GLN 62 1HB GLN 62 -9.786 0.099 5.017 297 HB3 GLN 62 2HB GLN 62 -10.957 -0.886 4.150 298 HG2 GLN 62 1HG GLN 62 -11.795 -1.772 6.249 299 HG3 GLN 62 2HG GLN 62 -10.593 -0.837 7.137 300 HE21 GLN 62 1HE2 GLN 62 -14.014 0.867 5.827 301 HE22 GLN 62 2HE2 GLN 62 -13.581 -0.749 5.399 302 H GLY 63 H GLY 63 -7.101 -0.750 4.908 303 HA2 GLY 63 1HA GLY 63 -6.919 -0.376 2.095 304 HA3 GLY 63 2HA GLY 63 -5.643 -0.071 3.263 305 H LEU 64 H LEU 64 -5.122 -2.496 4.300 306 HA LEU 64 HA LEU 64 -3.564 -3.729 2.304 307 HB2 LEU 64 1HB LEU 64 -3.840 -3.833 5.106 308 HB3 LEU 64 2HB LEU 64 -4.059 -5.474 4.533 309 HG LEU 64 HG LEU 64 -1.889 -5.401 3.421 310 HD11 LEU 64 1HD1 LEU 64 -1.728 -2.606 4.544 311 HD12 LEU 64 2HD1 LEU 64 -1.795 -3.054 2.841 312 HD13 LEU 64 3HD1 LEU 64 -0.382 -3.483 3.805 313 HD21 LEU 64 1HD2 LEU 64 -0.502 -5.349 5.423 314 HD22 LEU 64 2HD2 LEU 64 -2.044 -6.143 5.744 315 HD23 LEU 64 3HD2 LEU 64 -1.773 -4.490 6.292 316 H GLN 65 H GLN 65 -6.656 -4.580 3.771 317 HA GLN 65 HA GLN 65 -6.780 -7.128 2.521 318 HB2 GLN 65 1HB GLN 65 -8.745 -5.482 4.054 319 HB3 GLN 65 2HB GLN 65 -9.258 -6.944 3.218 320 HG2 GLN 65 1HG GLN 65 -7.263 -8.036 4.471 321 HG3 GLN 65 2HG GLN 65 -7.412 -6.636 5.536 322 HE21 GLN 65 1HE2 GLN 65 -9.533 -9.630 6.520 323 HE22 GLN 65 2HE2 GLN 65 -7.920 -9.529 5.918 324 H ALA 66 H ALA 66 -7.519 -3.976 1.402 325 HA ALA 66 HA ALA 66 -9.837 -4.441 -0.072 326 HB1 ALA 66 1HB ALA 66 -7.645 -2.452 -0.615 327 HB2 ALA 66 2HB ALA 66 -9.040 -2.215 0.436 328 HB3 ALA 66 3HB ALA 66 -9.269 -2.404 -1.303 329 H LEU 67 H LEU 67 -6.545 -5.285 -0.855 330 HA LEU 67 HA LEU 67 -7.411 -5.899 -3.583 331 HB2 LEU 67 1HB LEU 67 -5.072 -6.041 -4.233 332 HB3 LEU 67 2HB LEU 67 -5.484 -4.478 -3.576 333 HG LEU 67 HG LEU 67 -4.094 -6.573 -1.917 334 HD11 LEU 67 1HD1 LEU 67 -1.992 -5.444 -2.505 335 HD12 LEU 67 2HD1 LEU 67 -2.860 -4.449 -3.677 336 HD13 LEU 67 3HD1 LEU 67 -2.748 -6.195 -3.910 337 HD21 LEU 67 1HD2 LEU 67 -5.073 -4.725 -0.674 338 HD22 LEU 67 2HD2 LEU 67 -4.280 -3.564 -1.736 339 HD23 LEU 67 3HD2 LEU 67 -3.316 -4.591 -0.675 340 H VAL 68 H VAL 68 -7.175 -7.494 -0.713 341 HA VAL 68 HA VAL 68 -6.519 -10.004 -2.118 342 HB VAL 68 HB VAL 68 -4.820 -9.580 -0.438 343 HG11 VAL 68 1HG1 VAL 68 -5.334 -9.538 1.952 344 HG12 VAL 68 2HG1 VAL 68 -7.061 -9.551 1.584 345 HG13 VAL 68 3HG1 VAL 68 -6.065 -8.177 1.103 346 HG21 VAL 68 1HG2 VAL 68 -5.418 -11.887 -0.862 347 HG22 VAL 68 2HG2 VAL 68 -6.687 -11.808 0.360 348 HG23 VAL 68 3HG2 VAL 68 -4.994 -11.672 0.836 349 H SER 69 H SER 69 -8.584 -8.565 0.383 350 HA SER 69 HA SER 69 -10.763 -10.302 -0.365 351 HB2 SER 69 1HB SER 69 -9.645 -10.420 2.454 352 HB3 SER 69 2HB SER 69 -11.113 -11.219 1.896 353 HG SER 69 HG SER 69 -9.044 -11.854 0.296 354 H ALA 70 H ALA 70 -12.638 -9.202 -0.129 355 HA ALA 70 HA ALA 70 -12.617 -6.467 0.387 356 HB1 ALA 70 1HB ALA 70 -15.055 -6.597 0.305 357 HB2 ALA 70 2HB ALA 70 -14.963 -8.351 0.446 358 HB3 ALA 70 3HB ALA 70 -14.311 -7.547 -0.981 359 HA PRO 71 HA PRO 71 -12.471 -6.473 4.851 360 HB2 PRO 71 1HB PRO 71 -13.162 -3.621 4.498 361 HB3 PRO 71 2HB PRO 71 -11.777 -4.350 5.317 362 HG2 PRO 71 1HG PRO 71 -11.505 -3.119 2.961 363 HG3 PRO 71 2HG PRO 71 -10.568 -4.571 3.359 364 HD2 PRO 71 1HD PRO 71 -12.995 -4.296 1.629 365 HD3 PRO 71 2HD PRO 71 -11.542 -5.288 1.390 366 H SER 72 H SER 72 -13.995 -6.799 6.339 367 HA SER 72 HA SER 72 -16.770 -6.288 5.686 368 HB2 SER 72 1HB SER 72 -17.115 -7.437 7.954 369 HB3 SER 72 2HB SER 72 -16.397 -8.413 6.672 370 HG SER 72 HG SER 72 -15.183 -8.715 8.504 371 H ALA 73 H ALA 73 -14.250 -4.702 7.197 372 HA ALA 73 HA ALA 73 -15.673 -3.256 9.200 373 HB1 ALA 73 1HB ALA 73 -13.067 -2.645 7.806 374 HB2 ALA 73 2HB ALA 73 -13.262 -3.521 9.323 375 HB3 ALA 73 3HB ALA 73 -13.679 -1.810 9.232 376 H GLU 74 H GLU 74 -16.702 -1.315 9.075 377 HA GLU 74 HA GLU 74 -17.532 -0.406 6.484 378 HB2 GLU 74 1HB GLU 74 -18.146 0.453 9.296 379 HB3 GLU 74 2HB GLU 74 -18.652 1.435 7.932 380 HG2 GLU 74 1HG GLU 74 -20.442 -0.012 8.693 381 HG3 GLU 74 2HG GLU 74 -19.949 -0.416 7.051 382 HA PRO 75 HA PRO 75 -18.300 1.418 5.429 383 HB2 PRO 75 1HB PRO 75 -17.316 2.272 3.044 384 HB3 PRO 75 2HB PRO 75 -17.927 3.370 4.286 385 HG2 PRO 75 1HG PRO 75 -15.101 2.622 3.640 386 HG3 PRO 75 2HG PRO 75 -15.778 4.216 4.025 387 HD2 PRO 75 1HD PRO 75 -14.438 2.725 5.843 388 HD3 PRO 75 2HD PRO 75 -15.764 3.815 6.294 389 H HIS 76 H HIS 76 -18.883 -0.426 4.521 390 HA HIS 76 HA HIS 76 -16.994 -2.504 4.086 391 HB2 HIS 76 1HB HIS 76 -19.389 -2.757 4.895 392 HB3 HIS 76 2HB HIS 76 -19.894 -2.485 3.232 393 HD1 HIS 76 HD1 HIS 76 -19.065 -5.121 5.521 394 HD2 HIS 76 HD2 HIS 76 -18.693 -4.550 1.420 395 HE1 HIS 76 HE1 HIS 76 -18.769 -7.417 4.541 396 HE2 HIS 76 HE2 HIS 76 -18.391 -7.030 2.086 397 H ALA 77 H ALA 77 -15.997 -3.115 2.276 398 HA ALA 77 HA ALA 77 -16.075 -1.441 -0.017 399 HB1 ALA 77 1HB ALA 77 -14.744 -4.122 0.326 400 HB2 ALA 77 2HB ALA 77 -14.031 -2.562 0.732 401 HB3 ALA 77 3HB ALA 77 -14.412 -2.948 -0.945 402 H ARG 78 H ARG 78 -17.343 -1.531 -1.710 403 HA ARG 78 HA ARG 78 -18.606 -4.088 -2.437 404 HB2 ARG 78 1HB ARG 78 -19.677 -1.281 -2.789 405 HB3 ARG 78 2HB ARG 78 -20.429 -2.725 -3.452 406 HG2 ARG 78 1HG ARG 78 -19.991 -2.187 -0.523 407 HG3 ARG 78 2HG ARG 78 -21.511 -1.961 -1.389 408 HD2 ARG 78 1HD ARG 78 -21.588 -4.332 -1.914 409 HD3 ARG 78 2HD ARG 78 -20.032 -4.577 -1.124 410 HE ARG 78 HE ARG 78 -21.918 -3.401 0.650 411 HH11 ARG 78 1HH1 ARG 78 -21.040 -6.447 -0.840 412 HH12 ARG 78 2HH1 ARG 78 -21.659 -7.409 0.466 413 HH21 ARG 78 1HH2 ARG 78 -22.752 -4.664 2.360 414 HH22 ARG 78 2HH2 ARG 78 -22.644 -6.396 2.281 415 H ASN 79 H ASN 79 -19.105 -4.239 -4.794 416 HA ASN 79 HA ASN 79 -18.397 -4.337 -6.951 417 HB2 ASN 79 1HB ASN 79 -17.331 -1.575 -6.317 418 HB3 ASN 79 2HB ASN 79 -17.352 -2.279 -7.931 419 HD21 ASN 79 1HD2 ASN 79 -20.396 -0.153 -7.005 420 HD22 ASN 79 2HD2 ASN 79 -18.725 0.050 -6.580 421 H TYR 80 H TYR 80 -16.874 -5.598 -5.038 422 HA TYR 80 HA TYR 80 -14.078 -5.018 -5.669 423 HB2 TYR 80 1HB TYR 80 -13.566 -6.515 -3.769 424 HB3 TYR 80 2HB TYR 80 -14.634 -5.200 -3.296 425 HD1 TYR 80 HD1 TYR 80 -14.346 -8.813 -3.793 426 HD2 TYR 80 HD2 TYR 80 -16.960 -5.639 -2.699 427 HE1 TYR 80 HE1 TYR 80 -15.937 -10.445 -2.879 428 HE2 TYR 80 HE2 TYR 80 -18.558 -7.266 -1.783 429 HH TYR 80 HH TYR 80 -19.141 -9.593 -1.997 430 HA PRO 81 HA PRO 81 -13.842 -8.604 -8.302 431 HB2 PRO 81 1HB PRO 81 -11.158 -8.913 -8.335 432 HB3 PRO 81 2HB PRO 81 -11.968 -7.607 -9.207 433 HG2 PRO 81 1HG PRO 81 -10.576 -7.536 -6.559 434 HG3 PRO 81 2HG PRO 81 -10.507 -6.368 -7.891 435 HD2 PRO 81 1HD PRO 81 -12.054 -6.010 -5.682 436 HD3 PRO 81 2HD PRO 81 -12.484 -5.366 -7.279 437 H GLU 82 H GLU 82 -13.743 -10.793 -8.041 438 HA GLU 82 HA GLU 82 -13.669 -11.863 -5.427 439 HB2 GLU 82 1HB GLU 82 -13.626 -13.185 -8.139 440 HB3 GLU 82 2HB GLU 82 -13.706 -14.083 -6.630 441 HG2 GLU 82 1HG GLU 82 -15.724 -12.071 -7.597 442 HG3 GLU 82 2HG GLU 82 -15.908 -13.825 -7.624 443 H GLY 83 H GLY 83 -12.018 -12.488 -4.223 444 HA2 GLY 83 1HA GLY 83 -9.940 -13.317 -3.642 445 HA3 GLY 83 2HA GLY 83 -9.630 -13.644 -5.341 446 H GLY 84 H GLY 84 -10.686 -10.495 -4.843 447 HA2 GLY 84 1HA GLY 84 -9.651 -8.452 -4.923 448 HA3 GLY 84 2HA GLY 84 -8.298 -9.196 -4.085 449 H TYR 85 H TYR 85 -6.795 -8.059 -5.295 450 HA TYR 85 HA TYR 85 -6.560 -8.903 -8.102 451 HB2 TYR 85 1HB TYR 85 -5.553 -6.440 -6.681 452 HB3 TYR 85 2HB TYR 85 -4.912 -6.945 -8.243 453 HD1 TYR 85 HD1 TYR 85 -6.762 -7.455 -10.058 454 HD2 TYR 85 HD2 TYR 85 -7.334 -4.933 -6.677 455 HE1 TYR 85 HE1 TYR 85 -8.614 -6.336 -11.217 456 HE2 TYR 85 HE2 TYR 85 -9.193 -3.811 -7.829 457 HH TYR 85 HH TYR 85 -10.586 -5.041 -10.710 458 H ILE 86 H ILE 86 -5.444 -9.438 -5.042 459 HA ILE 86 HA ILE 86 -3.300 -11.073 -6.139 460 HB ILE 86 HB ILE 86 -2.150 -9.073 -5.291 461 HG12 ILE 86 1HG1 ILE 86 -1.757 -11.520 -3.553 462 HG13 ILE 86 2HG1 ILE 86 -1.043 -11.255 -5.140 463 HG21 ILE 86 1HG2 ILE 86 -3.765 -8.348 -3.631 464 HG22 ILE 86 2HG2 ILE 86 -2.170 -8.529 -2.902 465 HG23 ILE 86 3HG2 ILE 86 -3.404 -9.761 -2.638 466 HD11 ILE 86 1HD1 ILE 86 0.573 -10.839 -3.395 467 HD12 ILE 86 2HD1 ILE 86 -0.492 -9.640 -2.662 468 HD13 ILE 86 3HD1 ILE 86 0.204 -9.348 -4.257 469 H ARG 87 H ARG 87 -3.105 -13.023 -5.105 470 HA ARG 87 HA ARG 87 -5.549 -13.877 -3.929 471 HB2 ARG 87 1HB ARG 87 -4.113 -15.157 -5.568 472 HB3 ARG 87 2HB ARG 87 -3.024 -15.492 -4.230 473 HG2 ARG 87 1HG ARG 87 -4.730 -16.709 -3.070 474 HG3 ARG 87 2HG ARG 87 -5.933 -16.241 -4.277 475 HD2 ARG 87 1HD ARG 87 -3.490 -17.944 -4.778 476 HD3 ARG 87 2HD ARG 87 -5.145 -18.535 -4.632 477 HE ARG 87 HE ARG 87 -5.264 -16.679 -6.626 478 HH11 ARG 87 1HH1 ARG 87 -3.346 -19.555 -6.089 479 HH12 ARG 87 2HH1 ARG 87 -3.207 -19.926 -7.776 480 HH21 ARG 87 1HH2 ARG 87 -5.090 -17.173 -8.842 481 HH22 ARG 87 2HH2 ARG 87 -4.207 -18.581 -9.343 482 H ARG 88 H ARG 88 -2.494 -12.934 -2.630 483 HA ARG 88 HA ARG 88 -3.492 -13.560 0.053 484 HB2 ARG 88 1HB ARG 88 -0.743 -14.244 -0.990 485 HB3 ARG 88 2HB ARG 88 -1.131 -14.168 0.722 486 HG2 ARG 88 1HG ARG 88 -2.939 -15.888 0.217 487 HG3 ARG 88 2HG ARG 88 -2.126 -16.103 -1.336 488 HD2 ARG 88 1HD ARG 88 -1.351 -17.733 0.325 489 HD3 ARG 88 2HD ARG 88 -0.051 -16.659 -0.196 490 HE ARG 88 HE ARG 88 -1.384 -15.713 2.154 491 HH11 ARG 88 1HH1 ARG 88 1.086 -17.907 1.002 492 HH12 ARG 88 2HH1 ARG 88 1.947 -17.932 2.504 493 HH21 ARG 88 1HH2 ARG 88 -0.246 -15.724 4.123 494 HH22 ARG 88 2HH2 ARG 88 1.190 -16.683 4.284 495 H LEU 89 H LEU 89 -2.196 -12.394 1.755 496 HA LEU 89 HA LEU 89 -1.906 -9.667 1.308 497 HB2 LEU 89 1HB LEU 89 -0.835 -11.544 3.375 498 HB3 LEU 89 2HB LEU 89 -0.233 -9.904 3.335 499 HG LEU 89 HG LEU 89 -2.032 -10.222 4.985 500 HD11 LEU 89 1HD1 LEU 89 -3.347 -8.276 4.358 501 HD12 LEU 89 2HD1 LEU 89 -2.760 -8.403 2.699 502 HD13 LEU 89 3HD1 LEU 89 -1.634 -8.034 4.007 503 HD21 LEU 89 1HD2 LEU 89 -3.720 -10.829 2.565 504 HD22 LEU 89 2HD2 LEU 89 -4.357 -10.473 4.169 505 HD23 LEU 89 3HD2 LEU 89 -3.366 -11.908 3.913 506 HA PRO 90 HA PRO 90 1.819 -9.570 -1.120 507 HB2 PRO 90 1HB PRO 90 2.289 -6.881 -0.869 508 HB3 PRO 90 2HB PRO 90 1.141 -7.582 -2.016 509 HG2 PRO 90 1HG PRO 90 0.637 -6.330 0.646 510 HG3 PRO 90 2HG PRO 90 -0.304 -6.204 -0.851 511 HD2 PRO 90 1HD PRO 90 -1.036 -7.804 1.206 512 HD3 PRO 90 2HD PRO 90 -1.382 -8.205 -0.489 513 H GLN 91 H GLN 91 3.784 -10.099 -0.498 514 HA GLN 91 HA GLN 91 4.902 -8.881 1.939 515 HB2 GLN 91 1HB GLN 91 5.307 -11.669 0.842 516 HB3 GLN 91 2HB GLN 91 6.276 -10.977 2.131 517 HG2 GLN 91 1HG GLN 91 4.247 -10.744 3.500 518 HG3 GLN 91 2HG GLN 91 3.312 -11.520 2.220 519 HE21 GLN 91 1HE2 GLN 91 3.864 -14.482 3.980 520 HE22 GLN 91 2HE2 GLN 91 2.735 -13.263 3.499 521 H ASP 92 H ASP 92 6.945 -8.061 1.797 522 HA ASP 92 HA ASP 92 8.034 -7.607 -0.812 523 HB2 ASP 92 1HB ASP 92 9.884 -6.460 0.399 524 HB3 ASP 92 2HB ASP 92 8.296 -5.870 0.857 525 HA PRO 93 HA PRO 93 10.526 -11.058 -1.561 526 HB2 PRO 93 1HB PRO 93 12.964 -9.912 -2.223 527 HB3 PRO 93 2HB PRO 93 11.599 -10.118 -3.324 528 HG2 PRO 93 1HG PRO 93 12.437 -7.707 -1.769 529 HG3 PRO 93 2HG PRO 93 11.812 -7.817 -3.427 530 HD2 PRO 93 1HD PRO 93 10.246 -7.012 -1.421 531 HD3 PRO 93 2HD PRO 93 9.612 -8.051 -2.712 532 H TRP 94 H TRP 94 11.615 -8.820 0.845 533 HA TRP 94 HA TRP 94 13.766 -10.504 1.775 534 HB2 TRP 94 1HB TRP 94 12.501 -8.084 3.073 535 HB3 TRP 94 2HB TRP 94 14.006 -8.855 3.566 536 HD1 TRP 94 HD1 TRP 94 16.011 -8.805 1.575 537 HE1 TRP 94 HE1 TRP 94 16.602 -6.870 -0.016 538 HE3 TRP 94 HE3 TRP 94 11.651 -6.162 1.868 539 HZ2 TRP 94 HZ2 TRP 94 15.374 -4.523 -1.009 540 HZ3 TRP 94 HZ3 TRP 94 11.438 -4.082 0.576 541 HH2 TRP 94 HH2 TRP 94 13.263 -3.281 -0.837 542 H GLY 95 H GLY 95 10.382 -9.999 2.473 543 HA2 GLY 95 1HA GLY 95 9.307 -12.097 3.221 544 HA3 GLY 95 2HA GLY 95 10.585 -12.220 4.416 545 H SER 96 H SER 96 9.335 -9.046 3.878 546 HA SER 96 HA SER 96 7.902 -9.270 6.435 547 HB2 SER 96 1HB SER 96 8.990 -6.835 5.010 548 HB3 SER 96 2HB SER 96 8.101 -6.798 6.534 549 HG SER 96 HG SER 96 10.707 -7.303 6.104 550 H ASP 97 H ASP 97 5.907 -8.185 6.717 551 HA ASP 97 HA ASP 97 4.187 -8.439 4.377 552 HB2 ASP 97 1HB ASP 97 3.516 -9.632 6.381 553 HB3 ASP 97 2HB ASP 97 3.607 -8.159 7.334 554 H TYR 98 H TYR 98 3.290 -6.756 3.364 555 HA TYR 98 HA TYR 98 4.178 -4.120 3.775 556 HB2 TYR 98 1HB TYR 98 1.950 -5.316 2.152 557 HB3 TYR 98 2HB TYR 98 2.165 -3.572 2.234 558 HD1 TYR 98 HD1 TYR 98 3.471 -2.575 0.607 559 HD2 TYR 98 HD2 TYR 98 4.162 -6.660 1.551 560 HE1 TYR 98 HE1 TYR 98 5.125 -2.708 -1.203 561 HE2 TYR 98 HE2 TYR 98 5.822 -6.801 -0.250 562 HH TYR 98 HH TYR 98 7.058 -4.055 -1.813 563 H GLN 99 H GLN 99 3.123 -2.271 4.586 564 HA GLN 99 HA GLN 99 0.800 -2.861 6.290 565 HB2 GLN 99 1HB GLN 99 3.190 -1.172 7.044 566 HB3 GLN 99 2HB GLN 99 1.741 -1.374 8.018 567 HG2 GLN 99 1HG GLN 99 3.677 -3.545 7.249 568 HG3 GLN 99 2HG GLN 99 3.542 -2.776 8.830 569 HE21 GLN 99 1HE2 GLN 99 1.645 -6.059 8.466 570 HE22 GLN 99 2HE2 GLN 99 3.207 -5.578 7.908 571 H LEU 100 H LEU 100 -0.783 -1.402 6.359 572 HA LEU 100 HA LEU 100 -0.394 1.168 4.973 573 HB2 LEU 100 1HB LEU 100 -2.112 -0.361 3.997 574 HB3 LEU 100 2HB LEU 100 -2.967 -0.339 5.523 575 HG LEU 100 HG LEU 100 -3.797 1.147 3.555 576 HD11 LEU 100 1HD1 LEU 100 -4.567 2.884 5.135 577 HD12 LEU 100 2HD1 LEU 100 -3.481 2.212 6.353 578 HD13 LEU 100 3HD1 LEU 100 -4.813 1.241 5.724 579 HD21 LEU 100 1HD2 LEU 100 -1.836 3.088 4.720 580 HD22 LEU 100 2HD2 LEU 100 -2.826 3.245 3.268 581 HD23 LEU 100 3HD2 LEU 100 -1.466 2.129 3.291 582 H LEU 101 H LEU 101 -0.346 2.898 6.285 583 HA LEU 101 HA LEU 101 -1.168 2.433 9.074 584 HB2 LEU 101 1HB LEU 101 1.283 2.675 8.539 585 HB3 LEU 101 2HB LEU 101 0.954 4.329 8.077 586 HG LEU 101 HG LEU 101 1.925 3.856 10.417 587 HD11 LEU 101 1HD1 LEU 101 1.158 6.045 9.724 588 HD12 LEU 101 2HD1 LEU 101 0.689 5.721 11.393 589 HD13 LEU 101 3HD1 LEU 101 -0.507 5.599 10.103 590 HD21 LEU 101 1HD2 LEU 101 0.352 2.080 11.021 591 HD22 LEU 101 2HD2 LEU 101 -0.976 3.239 10.950 592 HD23 LEU 101 3HD2 LEU 101 0.291 3.425 12.161 593 H SER 102 H SER 102 -3.021 3.405 9.489 594 HA SER 102 HA SER 102 -3.444 6.158 8.559 595 HB2 SER 102 1HB SER 102 -5.432 4.239 9.798 596 HB3 SER 102 2HB SER 102 -5.795 5.816 9.097 597 HG SER 102 HG SER 102 -4.449 4.352 7.310 598 HA PRO 103 HA PRO 103 -3.955 7.989 8.955 599 HB2 PRO 103 1HB PRO 103 -3.112 10.344 9.910 600 HB3 PRO 103 2HB PRO 103 -4.695 9.692 10.351 601 HG2 PRO 103 1HG PRO 103 -2.146 9.700 11.912 602 HG3 PRO 103 2HG PRO 103 -3.803 9.992 12.470 603 HD2 PRO 103 1HD PRO 103 -2.466 7.593 12.733 604 HD3 PRO 103 2HD PRO 103 -4.230 7.765 12.727 605 H GLY 104 H GLY 104 -2.533 8.644 7.380 606 HA2 GLY 104 1HA GLY 104 0.045 7.505 7.451 607 HA3 GLY 104 2HA GLY 104 -0.567 8.581 6.205 608 H GLN 105 H GLN 105 2.051 8.599 7.000 609 HA GLN 105 HA GLN 105 2.365 10.872 8.810 610 HB2 GLN 105 1HB GLN 105 3.715 8.866 9.229 611 HB3 GLN 105 2HB GLN 105 4.397 8.972 7.617 612 HG2 GLN 105 1HG GLN 105 4.725 11.331 9.368 613 HG3 GLN 105 2HG GLN 105 5.630 9.880 9.794 614 HE21 GLN 105 1HE2 GLN 105 7.857 10.079 7.114 615 HE22 GLN 105 2HE2 GLN 105 7.160 9.063 8.338 616 H HIS 106 H HIS 106 2.887 9.842 5.498 617 HA HIS 106 HA HIS 106 3.913 12.494 4.773 618 HB2 HIS 106 1HB HIS 106 3.528 10.025 3.059 619 HB3 HIS 106 2HB HIS 106 4.293 11.522 2.545 620 HD1 HIS 106 HD1 HIS 106 4.966 8.295 4.119 621 HD2 HIS 106 HD2 HIS 106 6.845 12.009 3.864 622 HE1 HIS 106 HE1 HIS 106 7.366 7.899 4.780 623 HE2 HIS 106 HE2 HIS 106 8.468 10.162 4.683 624 H GLY 107 H GLY 107 1.238 10.282 4.216 625 HA2 GLY 107 1HA GLY 107 -0.334 12.562 3.181 626 HA3 GLY 107 2HA GLY 107 -0.459 10.955 2.477 627 H GLN 108 H GLN 108 -2.759 11.115 2.995 628 HA GLN 108 HA GLN 108 -3.561 11.060 5.740 629 HB2 GLN 108 1HB GLN 108 -4.959 10.561 3.141 630 HB3 GLN 108 2HB GLN 108 -5.730 10.106 4.654 631 HG2 GLN 108 1HG GLN 108 -4.801 12.860 3.879 632 HG3 GLN 108 2HG GLN 108 -6.469 12.293 3.954 633 HE21 GLN 108 1HE2 GLN 108 -5.864 11.892 7.682 634 HE22 GLN 108 2HE2 GLN 108 -5.917 10.725 6.406 635 H VAL 109 H VAL 109 -2.816 8.667 3.298 636 HA VAL 109 HA VAL 109 -2.653 6.677 5.443 637 HB VAL 109 HB VAL 109 -3.420 4.927 3.772 638 HG11 VAL 109 1HG1 VAL 109 -4.806 5.631 5.636 639 HG12 VAL 109 2HG1 VAL 109 -5.786 5.290 4.210 640 HG13 VAL 109 3HG1 VAL 109 -5.446 6.961 4.669 641 HG21 VAL 109 1HG2 VAL 109 -4.474 7.355 2.333 642 HG22 VAL 109 2HG2 VAL 109 -4.894 5.682 1.964 643 HG23 VAL 109 3HG2 VAL 109 -3.238 6.246 1.740 644 H ASP 110 H ASP 110 -0.706 5.775 5.504 645 HA ASP 110 HA ASP 110 1.028 6.121 3.160 646 HB2 ASP 110 1HB ASP 110 1.484 6.256 6.056 647 HB3 ASP 110 2HB ASP 110 2.706 5.339 5.179 648 H ILE 111 H ILE 111 1.505 4.443 1.978 649 HA ILE 111 HA ILE 111 1.390 1.751 3.153 650 HB ILE 111 HB ILE 111 1.570 1.010 0.707 651 HG12 ILE 111 1HG1 ILE 111 0.761 3.891 0.260 652 HG13 ILE 111 2HG1 ILE 111 2.294 3.166 -0.208 653 HG21 ILE 111 1HG2 ILE 111 -0.811 1.198 0.327 654 HG22 ILE 111 2HG2 ILE 111 -0.921 2.494 1.516 655 HG23 ILE 111 3HG2 ILE 111 -0.490 0.860 2.029 656 HD11 ILE 111 1HD1 ILE 111 -0.394 2.342 -1.276 657 HD12 ILE 111 2HD1 ILE 111 1.180 1.734 -1.790 658 HD13 ILE 111 3HD1 ILE 111 0.744 3.417 -2.090 659 H PHE 112 H PHE 112 3.247 0.706 3.515 660 HA PHE 112 HA PHE 112 5.613 1.351 1.974 661 HB2 PHE 112 1HB PHE 112 6.941 1.666 4.141 662 HB3 PHE 112 2HB PHE 112 5.944 3.010 3.600 663 HD1 PHE 112 HD1 PHE 112 6.044 0.162 5.977 664 HD2 PHE 112 HD2 PHE 112 4.294 3.908 4.974 665 HE1 PHE 112 HE1 PHE 112 4.928 0.225 8.166 666 HE2 PHE 112 HE2 PHE 112 3.175 3.978 7.164 667 HZ PHE 112 HZ PHE 112 3.492 2.133 8.763 668 H SER 113 H SER 113 7.411 -0.045 2.404 669 HA SER 113 HA SER 113 6.558 -2.694 3.363 670 HB2 SER 113 1HB SER 113 8.949 -2.110 1.618 671 HB3 SER 113 2HB SER 113 8.093 -3.639 1.825 672 HG SER 113 HG SER 113 6.697 -1.423 0.844 673 H LEU 114 H LEU 114 7.489 -3.469 5.128 674 HA LEU 114 HA LEU 114 9.184 -1.895 6.719 675 HB2 LEU 114 1HB LEU 114 8.261 -4.738 6.862 676 HB3 LEU 114 2HB LEU 114 9.485 -4.158 7.973 677 HG LEU 114 HG LEU 114 7.953 -2.513 8.879 678 HD11 LEU 114 1HD1 LEU 114 5.608 -2.443 8.175 679 HD12 LEU 114 2HD1 LEU 114 5.980 -3.560 6.862 680 HD13 LEU 114 3HD1 LEU 114 6.708 -1.955 6.886 681 HD21 LEU 114 1HD2 LEU 114 6.322 -4.004 9.904 682 HD22 LEU 114 2HD2 LEU 114 7.915 -4.758 9.833 683 HD23 LEU 114 3HD2 LEU 114 6.665 -5.230 8.682 684 H GLY 115 H GLY 115 9.821 -4.482 4.435 685 HA2 GLY 115 1HA GLY 115 11.770 -4.763 3.238 686 HA3 GLY 115 2HA GLY 115 12.512 -3.499 4.203 687 HA PRO 116 HA PRO 116 14.581 -7.446 5.232 688 HB2 PRO 116 1HB PRO 116 16.869 -5.697 5.790 689 HB3 PRO 116 2HB PRO 116 16.735 -7.048 4.661 690 HG2 PRO 116 1HG PRO 116 16.892 -4.492 3.821 691 HG3 PRO 116 2HG PRO 116 15.949 -5.717 2.953 692 HD2 PRO 116 1HD PRO 116 15.008 -3.577 4.826 693 HD3 PRO 116 2HD PRO 116 14.288 -4.131 3.295 694 H ASP 117 H ASP 117 14.361 -4.466 7.102 695 HA ASP 117 HA ASP 117 15.552 -5.749 9.425 696 HB2 ASP 117 1HB ASP 117 15.580 -3.623 10.468 697 HB3 ASP 117 2HB ASP 117 15.983 -3.323 8.784 698 H GLY 118 H GLY 118 12.456 -5.405 8.117 699 HA2 GLY 118 1HA GLY 118 10.426 -6.170 8.893 700 HA3 GLY 118 2HA GLY 118 11.262 -6.781 10.315 701 H VAL 119 H VAL 119 11.811 -3.485 9.687 702 HA VAL 119 HA VAL 119 9.890 -2.765 11.802 703 HB VAL 119 HB VAL 119 12.634 -1.581 11.343 704 HG11 VAL 119 1HG1 VAL 119 12.211 -0.292 13.377 705 HG12 VAL 119 2HG1 VAL 119 10.581 -0.955 13.464 706 HG13 VAL 119 3HG1 VAL 119 11.036 0.094 12.121 707 HG21 VAL 119 1HG2 VAL 119 12.748 -3.791 12.350 708 HG22 VAL 119 2HG2 VAL 119 11.580 -3.309 13.580 709 HG23 VAL 119 3HG2 VAL 119 13.173 -2.555 13.534 710 HA PRO 120 HA PRO 120 8.309 -0.045 8.657 711 HB2 PRO 120 1HB PRO 120 6.200 0.843 10.067 712 HB3 PRO 120 2HB PRO 120 6.258 -0.794 9.403 713 HG2 PRO 120 1HG PRO 120 6.807 0.137 12.193 714 HG3 PRO 120 2HG PRO 120 5.884 -1.275 11.646 715 HD2 PRO 120 1HD PRO 120 8.468 -1.409 12.511 716 HD3 PRO 120 2HD PRO 120 7.770 -2.541 11.336 717 H GLU 121 H GLU 121 8.396 2.082 8.204 718 HA GLU 121 HA GLU 121 8.869 4.290 8.332 719 HB2 GLU 121 1HB GLU 121 7.053 4.319 10.023 720 HB3 GLU 121 2HB GLU 121 8.243 4.024 11.282 721 HG2 GLU 121 1HG GLU 121 7.626 6.360 11.218 722 HG3 GLU 121 2HG GLU 121 9.318 6.156 10.777 723 H SER 122 H SER 122 10.839 2.122 8.894 724 HA SER 122 HA SER 122 12.907 3.628 10.280 725 HB2 SER 122 1HB SER 122 14.102 1.371 9.273 726 HB3 SER 122 2HB SER 122 13.333 1.477 10.858 727 HG SER 122 HG SER 122 12.563 0.097 8.630 728 H ASN 123 H ASN 123 15.135 3.505 9.035 729 HA ASN 123 HA ASN 123 14.713 5.195 6.755 730 HB2 ASN 123 1HB ASN 123 17.115 5.526 6.770 731 HB3 ASN 123 2HB ASN 123 16.494 5.637 8.412 732 HD21 ASN 123 1HD2 ASN 123 19.613 3.546 8.183 733 HD22 ASN 123 2HD2 ASN 123 19.186 5.085 7.520 734 H ASP 124 H ASP 124 14.688 1.949 6.997 735 HA ASP 124 HA ASP 124 15.980 1.461 4.397 736 HB2 ASP 124 1HB ASP 124 15.936 -0.877 4.985 737 HB3 ASP 124 2HB ASP 124 16.549 0.008 6.382 738 H ASP 125 H ASP 125 13.018 2.030 5.835 739 HA ASP 125 HA ASP 125 11.329 0.192 4.525 740 HB2 ASP 125 1HB ASP 125 10.927 2.743 6.032 741 HB3 ASP 125 2HB ASP 125 9.583 2.067 5.120 742 H ILE 126 H ILE 126 10.342 0.221 2.623 743 HA ILE 126 HA ILE 126 10.823 2.505 0.837 744 HB ILE 126 HB ILE 126 9.919 -0.302 0.166 745 HG12 ILE 126 1HG1 ILE 126 12.241 -0.255 0.954 746 HG13 ILE 126 2HG1 ILE 126 12.173 -0.605 -0.768 747 HG21 ILE 126 1HG2 ILE 126 10.259 0.300 -2.149 748 HG22 ILE 126 2HG2 ILE 126 10.779 1.920 -1.681 749 HG23 ILE 126 3HG2 ILE 126 9.113 1.415 -1.405 750 HD11 ILE 126 1HD1 ILE 126 13.980 0.922 -0.252 751 HD12 ILE 126 2HD1 ILE 126 12.837 2.055 0.466 752 HD13 ILE 126 3HD1 ILE 126 12.766 1.708 -1.261 753 H GLY 127 H GLY 127 9.196 3.933 0.917 754 HA2 GLY 127 1HA GLY 127 6.447 2.882 1.155 755 HA3 GLY 127 2HA GLY 127 6.957 4.468 1.707 756 H ASN 128 H ASN 128 4.798 4.524 0.236 757 HA ASN 128 HA ASN 128 5.144 4.626 -2.564 758 HB2 ASN 128 1HB ASN 128 2.957 4.562 -1.235 759 HB3 ASN 128 2HB ASN 128 3.153 6.299 -1.043 760 HD21 ASN 128 1HD2 ASN 128 1.221 6.538 -3.942 761 HD22 ASN 128 2HD2 ASN 128 1.310 6.753 -2.225 762 H TRP 129 H TRP 129 5.766 6.908 -0.025 763 HA TRP 129 HA TRP 129 6.148 9.159 -1.762 764 HB2 TRP 129 1HB TRP 129 5.537 9.189 0.738 765 HB3 TRP 129 2HB TRP 129 7.245 8.891 1.033 766 HD1 TRP 129 HD1 TRP 129 8.931 10.904 0.621 767 HE1 TRP 129 HE1 TRP 129 8.571 13.428 0.262 768 HE3 TRP 129 HE3 TRP 129 3.907 10.889 -0.337 769 HZ2 TRP 129 HZ2 TRP 129 6.447 15.177 -0.346 770 HZ3 TRP 129 HZ3 TRP 129 2.789 13.032 -0.794 771 HH2 TRP 129 HH2 TRP 129 4.033 15.131 -0.799 772 H THR 130 H THR 130 7.997 6.450 -0.782 773 HA THR 130 HA THR 130 10.597 7.550 -1.224 774 HB THR 130 HB THR 130 9.790 4.637 -1.318 775 HG1 THR 130 HG1 THR 130 10.053 6.429 0.809 776 HG21 THR 130 1HG2 THR 130 12.095 4.223 -0.644 777 HG22 THR 130 2HG2 THR 130 12.417 5.957 -0.628 778 HG23 THR 130 3HG2 THR 130 12.051 5.143 -2.149 779 H ILE 131 H ILE 131 8.291 5.670 -3.149 780 HA ILE 131 HA ILE 131 10.021 5.690 -5.455 781 HB ILE 131 HB ILE 131 8.594 3.767 -5.169 782 HG12 ILE 131 1HG1 ILE 131 7.410 3.754 -7.374 783 HG13 ILE 131 2HG1 ILE 131 7.761 5.472 -7.521 784 HG21 ILE 131 1HG2 ILE 131 6.272 5.673 -5.334 785 HG22 ILE 131 2HG2 ILE 131 6.771 4.726 -3.932 786 HG23 ILE 131 3HG2 ILE 131 6.147 3.914 -5.368 787 HD11 ILE 131 1HD1 ILE 131 9.334 4.136 -8.793 788 HD12 ILE 131 2HD1 ILE 131 9.796 3.263 -7.332 789 HD13 ILE 131 3HD1 ILE 131 10.149 4.985 -7.481 790 H GLY 132 H GLY 132 7.179 7.452 -4.325 791 HA2 GLY 132 1HA GLY 132 7.118 9.810 -4.675 792 HA3 GLY 132 2HA GLY 132 7.995 9.580 -6.176 793 H PHE 133 H PHE 133 5.111 7.757 -5.193 794 HA PHE 133 HA PHE 133 3.775 8.755 -7.574 795 HB2 PHE 133 1HB PHE 133 3.135 6.573 -5.616 796 HB3 PHE 133 2HB PHE 133 1.900 7.182 -6.714 797 HD1 PHE 133 HD1 PHE 133 4.455 4.820 -6.305 798 HD2 PHE 133 HD2 PHE 133 2.620 7.305 -9.229 799 HE1 PHE 133 HE1 PHE 133 5.313 3.355 -8.083 800 HE2 PHE 133 HE2 PHE 133 3.476 5.845 -11.013 801 HZ PHE 133 HZ PHE 133 4.824 3.866 -10.440 802 H HIS 134 H HIS 134 3.671 10.923 -6.827 803 HA HIS 134 HA HIS 134 1.659 11.423 -4.753 804 HB2 HIS 134 1HB HIS 134 3.803 12.598 -4.484 805 HB3 HIS 134 2HB HIS 134 3.614 13.318 -6.079 806 HD1 HIS 134 HD1 HIS 134 1.941 13.347 -2.679 807 HD2 HIS 134 HD2 HIS 134 2.262 15.683 -6.101 808 HE1 HIS 134 HE1 HIS 134 0.791 15.512 -2.128 809 HE2 HIS 134 HE2 HIS 134 1.138 16.967 -4.157 810 H HIS 135 H HIS 135 -0.310 11.361 -5.616 811 HA HIS 135 HA HIS 135 -0.723 12.424 -8.314 812 HB2 HIS 135 1HB HIS 135 -2.659 10.844 -6.608 813 HB3 HIS 135 2HB HIS 135 -2.821 11.216 -8.321 814 HD1 HIS 135 HD1 HIS 135 -1.347 9.831 -9.981 815 HD2 HIS 135 HD2 HIS 135 -0.999 8.708 -5.995 816 HE1 HIS 135 HE1 HIS 135 -0.178 7.605 -10.002 817 HE2 HIS 135 HE2 HIS 135 -0.182 6.851 -7.593 818 H HIS 136 H HIS 136 -1.305 14.473 -8.434 819 HA HIS 136 HA HIS 136 -3.448 15.453 -6.734 820 HB2 HIS 136 1HB HIS 136 -1.468 16.054 -5.442 821 HB3 HIS 136 2HB HIS 136 -0.740 16.806 -6.854 822 HD1 HIS 136 HD1 HIS 136 -0.883 19.263 -6.757 823 HD2 HIS 136 HD2 HIS 136 -4.149 17.459 -4.923 824 HE1 HIS 136 HE1 HIS 136 -2.321 21.150 -5.924 825 HE2 HIS 136 HE2 HIS 136 -4.367 20.033 -4.967 826 H HIS 137 H HIS 137 -4.640 15.460 -8.656 827 HA HIS 137 HA HIS 137 -3.777 16.869 -10.979 828 HB2 HIS 137 1HB HIS 137 -5.448 15.050 -11.080 829 HB3 HIS 137 2HB HIS 137 -6.578 16.048 -10.173 830 HD1 HIS 137 HD1 HIS 137 -8.181 17.310 -11.568 831 HD2 HIS 137 HD2 HIS 137 -4.705 16.401 -13.653 832 HE1 HIS 137 HE1 HIS 137 -8.564 18.128 -13.912 833 HE2 HIS 137 HE2 HIS 137 -6.532 17.380 -15.196 834 H HIS 138 H HIS 138 -4.028 18.940 -11.526 835 HA HIS 138 HA HIS 138 -5.859 20.623 -10.010 836 HB2 HIS 138 1HB HIS 138 -4.145 22.370 -9.691 837 HB3 HIS 138 2HB HIS 138 -3.725 20.888 -8.845 838 HD1 HIS 138 HD1 HIS 138 -1.615 19.613 -9.655 839 HD2 HIS 138 HD2 HIS 138 -2.445 23.074 -11.805 840 HE1 HIS 138 HE1 HIS 138 0.442 20.075 -11.020 841 HE2 HIS 138 HE2 HIS 138 -0.153 22.069 -12.432 842 H HIS 139 H HIS 139 -6.806 22.180 -11.236 843 HA HIS 139 HA HIS 139 -5.783 22.608 -13.952 844 HB2 HIS 139 1HB HIS 139 -7.512 20.766 -13.928 845 HB3 HIS 139 2HB HIS 139 -8.681 21.954 -13.370 846 HD1 HIS 139 HD1 HIS 139 -10.152 22.547 -15.262 847 HD2 HIS 139 HD2 HIS 139 -6.207 22.050 -16.476 848 HE1 HIS 139 HE1 HIS 139 -10.131 23.051 -17.725 849 HE2 HIS 139 HE2 HIS 139 -7.709 22.896 -18.400 850 H LYS 140 H LYS 140 -6.054 24.114 -11.353 851 HA LYS 140 HA LYS 140 -7.546 26.416 -12.412 852 HB2 LYS 140 1HB LYS 140 -6.960 25.729 -9.525 853 HB3 LYS 140 2HB LYS 140 -7.799 27.172 -10.076 854 HG2 LYS 140 1HG LYS 140 -8.764 24.347 -10.470 855 HG3 LYS 140 2HG LYS 140 -9.330 25.456 -9.222 856 HD2 LYS 140 1HD LYS 140 -10.147 26.983 -10.945 857 HD3 LYS 140 2HD LYS 140 -9.549 25.898 -12.200 858 HE2 LYS 140 1HE LYS 140 -11.641 25.200 -10.145 859 HE3 LYS 140 2HE LYS 140 -11.970 25.660 -11.814 860 HZ1 LYS 140 1HZ LYS 140 -11.986 23.249 -11.474 861 HZ2 LYS 140 2HZ LYS 140 -10.365 23.298 -10.995 862 HZ3 LYS 140 3HZ LYS 140 -10.795 23.722 -12.575 Start of MODEL 6 1 H1 MET 25 1H MET 25 15.262 -10.937 -3.419 2 H2 MET 25 2H MET 25 16.336 -9.630 -3.522 3 H3 MET 25 3H MET 25 15.826 -10.200 -2.009 4 HA MET 25 HA MET 25 16.932 -12.272 -2.329 5 HB2 MET 25 1HB MET 25 18.362 -12.643 -4.274 6 HB3 MET 25 2HB MET 25 16.688 -12.412 -4.752 7 HG2 MET 25 1HG MET 25 17.164 -10.137 -5.424 8 HG3 MET 25 2HG MET 25 18.831 -10.305 -4.875 9 HE1 MET 25 1HE MET 25 16.629 -12.987 -6.770 10 HE2 MET 25 2HE MET 25 17.044 -12.626 -8.445 11 HE3 MET 25 3HE MET 25 16.140 -11.453 -7.489 12 H GLY 26 H GLY 26 17.811 -8.936 -2.760 13 HA2 GLY 26 1HA GLY 26 19.223 -7.878 -1.168 14 HA3 GLY 26 2HA GLY 26 20.033 -9.412 -0.900 15 H ASN 27 H ASN 27 20.679 -10.183 -3.437 16 HA ASN 27 HA ASN 27 23.017 -8.631 -3.858 17 HB2 ASN 27 1HB ASN 27 21.858 -10.842 -5.566 18 HB3 ASN 27 2HB ASN 27 23.477 -10.175 -5.729 19 HD21 ASN 27 1HD2 ASN 27 24.557 -12.803 -3.741 20 HD22 ASN 27 2HD2 ASN 27 24.566 -12.031 -5.288 21 H LYS 28 H LYS 28 19.869 -8.603 -5.279 22 HA LYS 28 HA LYS 28 20.798 -6.632 -7.258 23 HB2 LYS 28 1HB LYS 28 18.427 -8.501 -7.421 24 HB3 LYS 28 2HB LYS 28 18.793 -7.243 -8.594 25 HG2 LYS 28 1HG LYS 28 20.901 -8.350 -9.130 26 HG3 LYS 28 2HG LYS 28 20.539 -9.610 -7.949 27 HD2 LYS 28 1HD LYS 28 18.566 -10.257 -9.215 28 HD3 LYS 28 2HD LYS 28 18.866 -8.962 -10.374 29 HE2 LYS 28 1HE LYS 28 20.667 -11.317 -9.832 30 HE3 LYS 28 2HE LYS 28 19.627 -11.110 -11.237 31 HZ1 LYS 28 1HZ LYS 28 20.916 -9.099 -11.786 32 HZ2 LYS 28 2HZ LYS 28 21.856 -10.505 -11.803 33 HZ3 LYS 28 3HZ LYS 28 21.964 -9.437 -10.500 34 H GLU 29 H GLU 29 20.618 -5.095 -5.524 35 HA GLU 29 HA GLU 29 18.354 -4.666 -3.956 36 HB2 GLU 29 1HB GLU 29 20.679 -3.766 -3.592 37 HB3 GLU 29 2HB GLU 29 20.333 -2.560 -4.823 38 HG2 GLU 29 1HG GLU 29 20.010 -1.597 -2.654 39 HG3 GLU 29 2HG GLU 29 18.448 -1.753 -3.460 40 H LYS 30 H LYS 30 19.279 -3.252 -7.072 41 HA LYS 30 HA LYS 30 17.272 -1.279 -7.172 42 HB2 LYS 30 1HB LYS 30 18.576 -2.724 -9.488 43 HB3 LYS 30 2HB LYS 30 17.694 -1.209 -9.586 44 HG2 LYS 30 1HG LYS 30 20.262 -1.644 -8.077 45 HG3 LYS 30 2HG LYS 30 20.109 -0.872 -9.656 46 HD2 LYS 30 1HD LYS 30 18.618 0.827 -8.594 47 HD3 LYS 30 2HD LYS 30 18.996 0.103 -7.030 48 HE2 LYS 30 1HE LYS 30 20.965 1.338 -8.950 49 HE3 LYS 30 2HE LYS 30 20.397 2.049 -7.442 50 HZ1 LYS 30 1HZ LYS 30 21.405 0.193 -6.249 51 HZ2 LYS 30 2HZ LYS 30 22.556 1.037 -7.153 52 HZ3 LYS 30 3HZ LYS 30 21.976 -0.452 -7.704 53 H ALA 31 H ALA 31 17.385 -4.575 -8.446 54 HA ALA 31 HA ALA 31 14.802 -4.455 -9.630 55 HB1 ALA 31 1HB ALA 31 16.506 -6.841 -8.932 56 HB2 ALA 31 2HB ALA 31 16.517 -5.962 -10.461 57 HB3 ALA 31 3HB ALA 31 15.082 -6.862 -9.971 58 H ASP 32 H ASP 32 16.036 -5.570 -6.520 59 HA ASP 32 HA ASP 32 13.724 -6.948 -5.689 60 HB2 ASP 32 1HB ASP 32 15.998 -5.689 -4.179 61 HB3 ASP 32 2HB ASP 32 14.636 -6.412 -3.331 62 H ARG 33 H ARG 33 14.758 -3.588 -5.119 63 HA ARG 33 HA ARG 33 12.430 -2.953 -3.636 64 HB2 ARG 33 1HB ARG 33 13.059 -0.613 -3.865 65 HB3 ARG 33 2HB ARG 33 14.424 -1.598 -3.379 66 HG2 ARG 33 1HG ARG 33 15.302 -1.517 -5.651 67 HG3 ARG 33 2HG ARG 33 13.909 -0.554 -6.159 68 HD2 ARG 33 1HD ARG 33 14.559 1.129 -4.424 69 HD3 ARG 33 2HD ARG 33 16.034 0.205 -4.165 70 HE ARG 33 HE ARG 33 15.678 0.911 -6.909 71 HH11 ARG 33 1HH1 ARG 33 16.778 2.085 -3.800 72 HH12 ARG 33 2HH1 ARG 33 17.787 3.322 -4.476 73 HH21 ARG 33 1HH2 ARG 33 16.999 2.553 -7.811 74 HH22 ARG 33 2HH2 ARG 33 17.914 3.587 -6.758 75 H GLN 34 H GLN 34 13.194 -2.824 -7.065 76 HA GLN 34 HA GLN 34 10.931 -1.376 -7.887 77 HB2 GLN 34 1HB GLN 34 12.668 -3.389 -9.283 78 HB3 GLN 34 2HB GLN 34 11.283 -2.657 -10.083 79 HG2 GLN 34 1HG GLN 34 12.224 -0.452 -9.765 80 HG3 GLN 34 2HG GLN 34 13.586 -1.139 -8.883 81 HE21 GLN 34 1HE2 GLN 34 14.313 -0.473 -12.534 82 HE22 GLN 34 2HE2 GLN 34 13.480 0.457 -11.337 83 H LYS 35 H LYS 35 11.344 -4.823 -7.184 84 HA LYS 35 HA LYS 35 8.752 -5.611 -8.020 85 HB2 LYS 35 1HB LYS 35 10.549 -7.243 -7.518 86 HB3 LYS 35 2HB LYS 35 10.446 -6.812 -5.815 87 HG2 LYS 35 1HG LYS 35 8.144 -7.611 -5.740 88 HG3 LYS 35 2HG LYS 35 8.227 -8.024 -7.451 89 HD2 LYS 35 1HD LYS 35 10.017 -9.633 -6.966 90 HD3 LYS 35 2HD LYS 35 9.904 -9.229 -5.249 91 HE2 LYS 35 1HE LYS 35 7.573 -9.974 -5.237 92 HE3 LYS 35 2HE LYS 35 7.693 -10.392 -6.945 93 HZ1 LYS 35 1HZ LYS 35 9.465 -11.984 -6.313 94 HZ2 LYS 35 2HZ LYS 35 7.953 -12.356 -5.645 95 HZ3 LYS 35 3HZ LYS 35 9.151 -11.647 -4.688 96 H VAL 36 H VAL 36 10.060 -4.395 -4.999 97 HA VAL 36 HA VAL 36 7.758 -4.530 -3.410 98 HB VAL 36 HB VAL 36 10.024 -2.528 -3.353 99 HG11 VAL 36 1HG1 VAL 36 8.043 -3.165 -1.173 100 HG12 VAL 36 2HG1 VAL 36 8.019 -1.711 -2.170 101 HG13 VAL 36 3HG1 VAL 36 9.378 -2.013 -1.086 102 HG21 VAL 36 1HG2 VAL 36 9.584 -5.066 -1.787 103 HG22 VAL 36 2HG2 VAL 36 10.924 -3.942 -1.572 104 HG23 VAL 36 3HG2 VAL 36 10.757 -4.833 -3.083 105 H VAL 37 H VAL 37 8.984 -1.946 -5.510 106 HA VAL 37 HA VAL 37 6.954 -0.074 -5.093 107 HB VAL 37 HB VAL 37 8.502 -0.567 -7.645 108 HG11 VAL 37 1HG1 VAL 37 6.547 0.825 -8.042 109 HG12 VAL 37 2HG1 VAL 37 8.021 1.786 -8.150 110 HG13 VAL 37 3HG1 VAL 37 7.009 1.882 -6.709 111 HG21 VAL 37 1HG2 VAL 37 9.984 1.215 -6.823 112 HG22 VAL 37 2HG2 VAL 37 9.987 -0.201 -5.772 113 HG23 VAL 37 3HG2 VAL 37 9.084 1.239 -5.306 114 H SER 38 H SER 38 7.117 -2.846 -7.255 115 HA SER 38 HA SER 38 4.803 -2.324 -8.759 116 HB2 SER 38 1HB SER 38 5.989 -5.012 -8.029 117 HB3 SER 38 2HB SER 38 4.895 -4.686 -9.373 118 HG SER 38 HG SER 38 7.583 -3.868 -9.031 119 H ASP 39 H ASP 39 5.259 -4.247 -5.786 120 HA ASP 39 HA ASP 39 2.489 -4.841 -5.507 121 HB2 ASP 39 1HB ASP 39 4.829 -4.988 -3.623 122 HB3 ASP 39 2HB ASP 39 3.189 -5.329 -3.075 123 H LEU 40 H LEU 40 4.561 -2.267 -4.403 124 HA LEU 40 HA LEU 40 2.838 -1.064 -2.544 125 HB2 LEU 40 1HB LEU 40 5.319 -0.650 -2.966 126 HB3 LEU 40 2HB LEU 40 4.819 0.387 -4.287 127 HG LEU 40 HG LEU 40 3.572 1.793 -2.652 128 HD11 LEU 40 1HD1 LEU 40 4.142 1.513 -0.257 129 HD12 LEU 40 2HD1 LEU 40 4.911 -0.024 -0.654 130 HD13 LEU 40 3HD1 LEU 40 3.179 0.186 -0.904 131 HD21 LEU 40 1HD2 LEU 40 6.522 1.400 -2.175 132 HD22 LEU 40 2HD2 LEU 40 5.593 2.804 -1.654 133 HD23 LEU 40 3HD2 LEU 40 5.776 2.457 -3.373 134 H VAL 41 H VAL 41 3.282 -0.434 -6.038 135 HA VAL 41 HA VAL 41 1.305 1.590 -6.155 136 HB VAL 41 HB VAL 41 1.299 1.349 -8.569 137 HG11 VAL 41 1HG1 VAL 41 3.683 1.746 -9.002 138 HG12 VAL 41 2HG1 VAL 41 4.062 1.135 -7.391 139 HG13 VAL 41 3HG1 VAL 41 3.105 2.607 -7.574 140 HG21 VAL 41 1HG2 VAL 41 3.007 -1.100 -8.152 141 HG22 VAL 41 2HG2 VAL 41 2.657 -0.342 -9.706 142 HG23 VAL 41 3HG2 VAL 41 1.355 -1.074 -8.767 143 H ALA 42 H ALA 42 1.168 -1.910 -6.479 144 HA ALA 42 HA ALA 42 -1.529 -2.141 -7.230 145 HB1 ALA 42 1HB ALA 42 -1.415 -4.406 -6.368 146 HB2 ALA 42 2HB ALA 42 0.065 -4.019 -5.488 147 HB3 ALA 42 3HB ALA 42 0.062 -4.018 -7.250 148 H LEU 43 H LEU 43 0.004 -1.810 -4.045 149 HA LEU 43 HA LEU 43 -2.312 -1.983 -2.466 150 HB2 LEU 43 1HB LEU 43 0.230 -0.407 -2.056 151 HB3 LEU 43 2HB LEU 43 -1.018 -0.564 -0.834 152 HG LEU 43 HG LEU 43 0.609 -2.830 -1.988 153 HD11 LEU 43 1HD1 LEU 43 1.940 -1.418 -0.558 154 HD12 LEU 43 2HD1 LEU 43 1.559 -2.914 0.294 155 HD13 LEU 43 3HD1 LEU 43 0.684 -1.432 0.679 156 HD21 LEU 43 1HD2 LEU 43 -1.624 -3.571 -1.377 157 HD22 LEU 43 2HD2 LEU 43 -1.472 -2.798 0.198 158 HD23 LEU 43 3HD2 LEU 43 -0.443 -4.169 -0.213 159 H GLU 44 H GLU 44 -0.752 0.802 -4.015 160 HA GLU 44 HA GLU 44 -2.589 2.780 -3.327 161 HB2 GLU 44 1HB GLU 44 -0.801 2.357 -5.696 162 HB3 GLU 44 2HB GLU 44 -1.953 3.686 -5.704 163 HG2 GLU 44 1HG GLU 44 0.025 3.273 -3.491 164 HG3 GLU 44 2HG GLU 44 0.386 4.219 -4.934 165 H GLY 45 H GLY 45 -2.716 0.303 -5.819 166 HA2 GLY 45 1HA GLY 45 -4.962 1.167 -7.238 167 HA3 GLY 45 2HA GLY 45 -4.461 -0.509 -7.063 168 H ALA 46 H ALA 46 -4.766 -0.913 -4.359 169 HA ALA 46 HA ALA 46 -7.536 -1.330 -4.070 170 HB1 ALA 46 1HB ALA 46 -6.953 -1.772 -1.655 171 HB2 ALA 46 2HB ALA 46 -5.292 -1.346 -2.060 172 HB3 ALA 46 3HB ALA 46 -6.065 -2.728 -2.839 173 H LEU 47 H LEU 47 -5.387 1.168 -2.788 174 HA LEU 47 HA LEU 47 -7.303 2.444 -1.159 175 HB2 LEU 47 1HB LEU 47 -4.636 3.163 -2.264 176 HB3 LEU 47 2HB LEU 47 -5.626 4.455 -1.620 177 HG LEU 47 HG LEU 47 -5.591 3.526 0.569 178 HD11 LEU 47 1HD1 LEU 47 -4.330 1.083 -0.662 179 HD12 LEU 47 2HD1 LEU 47 -5.919 1.197 0.101 180 HD13 LEU 47 3HD1 LEU 47 -4.459 1.386 1.072 181 HD21 LEU 47 1HD2 LEU 47 -3.211 3.457 1.064 182 HD22 LEU 47 2HD2 LEU 47 -3.571 4.726 -0.107 183 HD23 LEU 47 3HD2 LEU 47 -2.851 3.209 -0.644 184 H ASP 48 H ASP 48 -6.265 3.063 -4.486 185 HA ASP 48 HA ASP 48 -7.923 5.332 -4.863 186 HB2 ASP 48 1HB ASP 48 -6.493 3.474 -6.740 187 HB3 ASP 48 2HB ASP 48 -7.597 4.697 -7.360 188 H MET 49 H MET 49 -8.371 1.886 -5.506 189 HA MET 49 HA MET 49 -10.887 2.176 -6.770 190 HB2 MET 49 1HB MET 49 -9.550 -0.175 -5.442 191 HB3 MET 49 2HB MET 49 -11.155 -0.287 -6.149 192 HG2 MET 49 1HG MET 49 -8.624 0.452 -7.597 193 HG3 MET 49 2HG MET 49 -9.465 -1.095 -7.683 194 HE1 MET 49 1HE MET 49 -12.833 -0.060 -9.438 195 HE2 MET 49 2HE MET 49 -12.565 0.012 -7.697 196 HE3 MET 49 3HE MET 49 -11.946 -1.351 -8.629 197 H TYR 50 H TYR 50 -9.958 1.504 -3.425 198 HA TYR 50 HA TYR 50 -12.558 1.094 -2.450 199 HB2 TYR 50 1HB TYR 50 -10.543 0.447 -1.198 200 HB3 TYR 50 2HB TYR 50 -10.135 2.145 -0.971 201 HD1 TYR 50 HD1 TYR 50 -12.578 -0.490 -0.088 202 HD2 TYR 50 HD2 TYR 50 -11.151 3.429 0.736 203 HE1 TYR 50 HE1 TYR 50 -13.928 -0.437 1.969 204 HE2 TYR 50 HE2 TYR 50 -12.490 3.493 2.789 205 HH TYR 50 HH TYR 50 -14.436 0.703 3.814 206 H LYS 51 H LYS 51 -10.610 4.049 -2.757 207 HA LYS 51 HA LYS 51 -12.565 5.724 -1.538 208 HB2 LYS 51 1HB LYS 51 -10.150 6.366 -1.802 209 HB3 LYS 51 2HB LYS 51 -10.453 6.589 -3.523 210 HG2 LYS 51 1HG LYS 51 -12.186 8.265 -2.957 211 HG3 LYS 51 2HG LYS 51 -11.748 8.097 -1.259 212 HD2 LYS 51 1HD LYS 51 -9.464 8.847 -1.801 213 HD3 LYS 51 2HD LYS 51 -9.953 9.063 -3.485 214 HE2 LYS 51 1HE LYS 51 -11.701 10.657 -2.708 215 HE3 LYS 51 2HE LYS 51 -11.053 10.513 -1.076 216 HZ1 LYS 51 1HZ LYS 51 -9.585 11.539 -3.447 217 HZ2 LYS 51 2HZ LYS 51 -8.944 11.392 -1.889 218 HZ3 LYS 51 3HZ LYS 51 -10.206 12.476 -2.182 219 H LEU 52 H LEU 52 -12.021 4.572 -4.799 220 HA LEU 52 HA LEU 52 -13.730 6.328 -6.158 221 HB2 LEU 52 1HB LEU 52 -12.184 4.790 -7.284 222 HB3 LEU 52 2HB LEU 52 -13.134 3.424 -6.735 223 HG LEU 52 HG LEU 52 -15.044 4.254 -8.090 224 HD11 LEU 52 1HD1 LEU 52 -14.624 5.965 -9.791 225 HD12 LEU 52 2HD1 LEU 52 -13.024 6.247 -9.108 226 HD13 LEU 52 3HD1 LEU 52 -14.464 6.615 -8.160 227 HD21 LEU 52 1HD2 LEU 52 -14.116 3.587 -10.242 228 HD22 LEU 52 2HD2 LEU 52 -13.527 2.543 -8.949 229 HD23 LEU 52 3HD2 LEU 52 -12.483 3.800 -9.613 230 H ASP 53 H ASP 53 -14.397 3.153 -4.689 231 HA ASP 53 HA ASP 53 -17.203 3.317 -5.259 232 HB2 ASP 53 1HB ASP 53 -15.580 1.413 -3.584 233 HB3 ASP 53 2HB ASP 53 -17.327 1.288 -3.739 234 H ASN 54 H ASN 54 -15.255 3.758 -2.312 235 HA ASN 54 HA ASN 54 -17.746 4.179 -0.815 236 HB2 ASN 54 1HB ASN 54 -14.942 3.615 0.156 237 HB3 ASN 54 2HB ASN 54 -16.330 3.875 1.207 238 HD21 ASN 54 1HD2 ASN 54 -15.791 0.348 -0.718 239 HD22 ASN 54 2HD2 ASN 54 -14.825 1.735 -1.077 240 H SER 55 H SER 55 -15.447 6.007 -2.306 241 HA SER 55 HA SER 55 -15.009 8.224 -2.361 242 HB2 SER 55 1HB SER 55 -17.411 8.475 -0.547 243 HB3 SER 55 2HB SER 55 -16.712 9.750 -1.545 244 HG SER 55 HG SER 55 -18.424 7.729 -2.226 245 H ARG 56 H ARG 56 -13.777 6.589 -0.206 246 HA ARG 56 HA ARG 56 -12.694 8.809 1.278 247 HB2 ARG 56 1HB ARG 56 -13.252 8.102 3.470 248 HB3 ARG 56 2HB ARG 56 -14.752 8.067 2.560 249 HG2 ARG 56 1HG ARG 56 -15.020 6.043 3.465 250 HG3 ARG 56 2HG ARG 56 -13.852 5.508 2.254 251 HD2 ARG 56 1HD ARG 56 -12.032 5.898 3.861 252 HD3 ARG 56 2HD ARG 56 -13.216 6.387 5.069 253 HE ARG 56 HE ARG 56 -13.747 3.777 4.039 254 HH11 ARG 56 1HH1 ARG 56 -11.751 5.543 6.309 255 HH12 ARG 56 2HH1 ARG 56 -11.505 4.176 7.349 256 HH21 ARG 56 1HH2 ARG 56 -13.398 1.973 5.375 257 HH22 ARG 56 2HH2 ARG 56 -12.466 2.147 6.836 258 H TYR 57 H TYR 57 -10.757 8.285 2.399 259 HA TYR 57 HA TYR 57 -9.235 6.185 1.165 260 HB2 TYR 57 1HB TYR 57 -8.580 8.229 3.290 261 HB3 TYR 57 2HB TYR 57 -7.421 7.030 2.729 262 HD1 TYR 57 HD1 TYR 57 -6.821 7.022 0.258 263 HD2 TYR 57 HD2 TYR 57 -8.872 10.244 2.124 264 HE1 TYR 57 HE1 TYR 57 -6.161 8.502 -1.586 265 HE2 TYR 57 HE2 TYR 57 -8.221 11.734 0.281 266 HH TYR 57 HH TYR 57 -6.885 10.561 -2.642 267 HA PRO 58 HA PRO 58 -10.310 3.139 4.144 268 HB2 PRO 58 1HB PRO 58 -8.515 1.242 3.509 269 HB3 PRO 58 2HB PRO 58 -9.852 1.661 2.429 270 HG2 PRO 58 1HG PRO 58 -6.995 2.579 2.328 271 HG3 PRO 58 2HG PRO 58 -8.015 1.977 1.006 272 HD2 PRO 58 1HD PRO 58 -7.609 4.617 1.435 273 HD3 PRO 58 2HD PRO 58 -9.140 3.985 0.796 274 H THR 59 H THR 59 -9.745 2.475 6.142 275 HA THR 59 HA THR 59 -7.469 3.598 7.436 276 HB THR 59 HB THR 59 -8.523 1.664 9.126 277 HG1 THR 59 HG1 THR 59 -10.486 1.254 8.437 278 HG21 THR 59 1HG2 THR 59 -7.996 3.967 9.740 279 HG22 THR 59 2HG2 THR 59 -9.651 3.572 10.204 280 HG23 THR 59 3HG2 THR 59 -9.348 4.549 8.768 281 H THR 60 H THR 60 -6.292 1.863 9.011 282 HA THR 60 HA THR 60 -4.314 0.870 7.394 283 HB THR 60 HB THR 60 -3.880 1.307 9.713 284 HG1 THR 60 HG1 THR 60 -2.408 -0.133 9.053 285 HG21 THR 60 1HG2 THR 60 -6.008 0.643 10.691 286 HG22 THR 60 2HG2 THR 60 -4.675 -0.174 11.507 287 HG23 THR 60 3HG2 THR 60 -5.662 -1.049 10.336 288 H GLU 61 H GLU 61 -7.008 -0.996 8.783 289 HA GLU 61 HA GLU 61 -6.047 -3.464 7.665 290 HB2 GLU 61 1HB GLU 61 -7.342 -3.476 9.725 291 HB3 GLU 61 2HB GLU 61 -8.707 -2.736 8.902 292 HG2 GLU 61 1HG GLU 61 -8.933 -4.728 7.500 293 HG3 GLU 61 2HG GLU 61 -7.580 -5.470 8.354 294 H GLN 62 H GLN 62 -8.520 -1.102 6.853 295 HA GLN 62 HA GLN 62 -9.874 -2.651 4.943 296 HB2 GLN 62 1HB GLN 62 -9.781 0.290 5.521 297 HB3 GLN 62 2HB GLN 62 -10.674 -0.319 4.138 298 HG2 GLN 62 1HG GLN 62 -12.108 0.039 6.081 299 HG3 GLN 62 2HG GLN 62 -12.081 -1.649 5.580 300 HE21 GLN 62 1HE2 GLN 62 -10.750 -2.852 8.565 301 HE22 GLN 62 2HE2 GLN 62 -11.165 -3.179 6.919 302 H GLY 63 H GLY 63 -7.148 -0.431 4.631 303 HA2 GLY 63 1HA GLY 63 -7.242 -0.388 1.764 304 HA3 GLY 63 2HA GLY 63 -5.923 0.188 2.770 305 H LEU 64 H LEU 64 -5.285 -2.113 4.131 306 HA LEU 64 HA LEU 64 -3.589 -3.367 2.249 307 HB2 LEU 64 1HB LEU 64 -3.908 -3.208 5.077 308 HB3 LEU 64 2HB LEU 64 -3.750 -4.893 4.630 309 HG LEU 64 HG LEU 64 -1.579 -4.589 3.779 310 HD11 LEU 64 1HD1 LEU 64 -1.921 -2.587 2.444 311 HD12 LEU 64 2HD1 LEU 64 -0.524 -2.379 3.501 312 HD13 LEU 64 3HD1 LEU 64 -2.064 -1.614 3.906 313 HD21 LEU 64 1HD2 LEU 64 -1.765 -4.520 6.223 314 HD22 LEU 64 2HD2 LEU 64 -1.852 -2.759 6.155 315 HD23 LEU 64 3HD2 LEU 64 -0.387 -3.592 5.633 316 H GLN 65 H GLN 65 -6.498 -4.473 3.967 317 HA GLN 65 HA GLN 65 -6.294 -7.149 3.001 318 HB2 GLN 65 1HB GLN 65 -8.589 -5.650 4.261 319 HB3 GLN 65 2HB GLN 65 -8.652 -7.357 3.847 320 HG2 GLN 65 1HG GLN 65 -6.718 -6.096 5.778 321 HG3 GLN 65 2HG GLN 65 -8.174 -6.986 6.216 322 HE21 GLN 65 1HE2 GLN 65 -4.763 -8.916 5.220 323 HE22 GLN 65 2HE2 GLN 65 -4.918 -7.200 5.080 324 H ALA 66 H ALA 66 -7.607 -4.244 1.688 325 HA ALA 66 HA ALA 66 -9.760 -5.249 0.210 326 HB1 ALA 66 1HB ALA 66 -9.635 -3.173 -1.066 327 HB2 ALA 66 2HB ALA 66 -8.042 -2.849 -0.383 328 HB3 ALA 66 3HB ALA 66 -9.461 -2.881 0.665 329 H LEU 67 H LEU 67 -6.371 -5.495 -0.404 330 HA LEU 67 HA LEU 67 -6.693 -5.888 -3.251 331 HB2 LEU 67 1HB LEU 67 -4.566 -5.138 -1.689 332 HB3 LEU 67 2HB LEU 67 -4.221 -6.820 -2.030 333 HG LEU 67 HG LEU 67 -4.308 -6.386 -4.431 334 HD11 LEU 67 1HD1 LEU 67 -4.550 -3.480 -3.692 335 HD12 LEU 67 2HD1 LEU 67 -5.875 -4.457 -4.321 336 HD13 LEU 67 3HD1 LEU 67 -4.447 -4.162 -5.311 337 HD21 LEU 67 1HD2 LEU 67 -2.188 -6.267 -3.236 338 HD22 LEU 67 2HD2 LEU 67 -2.459 -4.550 -2.929 339 HD23 LEU 67 3HD2 LEU 67 -2.237 -5.125 -4.579 340 H VAL 68 H VAL 68 -7.079 -7.838 -0.493 341 HA VAL 68 HA VAL 68 -6.673 -10.234 -2.161 342 HB VAL 68 HB VAL 68 -4.980 -10.103 -0.382 343 HG11 VAL 68 1HG1 VAL 68 -7.299 -10.290 1.526 344 HG12 VAL 68 2HG1 VAL 68 -6.217 -8.912 1.321 345 HG13 VAL 68 3HG1 VAL 68 -5.593 -10.437 1.954 346 HG21 VAL 68 1HG2 VAL 68 -6.965 -12.344 -0.041 347 HG22 VAL 68 2HG2 VAL 68 -5.295 -12.365 0.527 348 HG23 VAL 68 3HG2 VAL 68 -5.638 -12.280 -1.201 349 H SER 69 H SER 69 -8.740 -8.593 0.129 350 HA SER 69 HA SER 69 -10.976 -10.172 -0.777 351 HB2 SER 69 1HB SER 69 -10.033 -11.539 1.097 352 HB3 SER 69 2HB SER 69 -10.296 -10.170 2.177 353 HG SER 69 HG SER 69 -12.000 -11.821 2.107 354 H ALA 70 H ALA 70 -13.039 -9.288 0.080 355 HA ALA 70 HA ALA 70 -12.963 -6.429 0.156 356 HB1 ALA 70 1HB ALA 70 -15.397 -6.577 0.355 357 HB2 ALA 70 2HB ALA 70 -15.271 -8.317 0.607 358 HB3 ALA 70 3HB ALA 70 -14.794 -7.612 -0.939 359 HA PRO 71 HA PRO 71 -12.349 -6.126 4.598 360 HB2 PRO 71 1HB PRO 71 -13.259 -3.350 4.084 361 HB3 PRO 71 2HB PRO 71 -11.789 -3.922 4.879 362 HG2 PRO 71 1HG PRO 71 -11.707 -2.885 2.423 363 HG3 PRO 71 2HG PRO 71 -10.678 -4.255 2.875 364 HD2 PRO 71 1HD PRO 71 -13.196 -4.225 1.264 365 HD3 PRO 71 2HD PRO 71 -11.720 -5.185 1.035 366 H SER 72 H SER 72 -13.705 -6.410 6.235 367 HA SER 72 HA SER 72 -16.541 -6.396 5.741 368 HB2 SER 72 1HB SER 72 -14.964 -7.118 8.223 369 HB3 SER 72 2HB SER 72 -16.685 -7.416 7.982 370 HG SER 72 HG SER 72 -14.585 -8.893 7.178 371 H ALA 73 H ALA 73 -14.212 -4.438 7.428 372 HA ALA 73 HA ALA 73 -15.963 -3.068 9.162 373 HB1 ALA 73 1HB ALA 73 -13.525 -3.077 9.439 374 HB2 ALA 73 2HB ALA 73 -14.176 -1.439 9.396 375 HB3 ALA 73 3HB ALA 73 -13.361 -2.100 7.979 376 H GLU 74 H GLU 74 -17.420 -1.555 8.792 377 HA GLU 74 HA GLU 74 -18.043 -0.613 6.196 378 HB2 GLU 74 1HB GLU 74 -19.691 -0.863 8.024 379 HB3 GLU 74 2HB GLU 74 -18.910 0.449 8.895 380 HG2 GLU 74 1HG GLU 74 -19.470 1.970 7.040 381 HG3 GLU 74 2HG GLU 74 -20.324 0.646 6.248 382 HA PRO 75 HA PRO 75 -18.811 1.158 4.973 383 HB2 PRO 75 1HB PRO 75 -16.916 2.167 2.964 384 HB3 PRO 75 2HB PRO 75 -18.564 2.691 3.317 385 HG2 PRO 75 1HG PRO 75 -16.440 4.208 3.946 386 HG3 PRO 75 2HG PRO 75 -17.890 4.158 4.967 387 HD2 PRO 75 1HD PRO 75 -15.263 2.762 5.335 388 HD3 PRO 75 2HD PRO 75 -16.279 3.584 6.537 389 H HIS 76 H HIS 76 -19.099 -0.729 4.028 390 HA HIS 76 HA HIS 76 -16.885 -2.560 3.757 391 HB2 HIS 76 1HB HIS 76 -19.188 -3.145 4.662 392 HB3 HIS 76 2HB HIS 76 -19.784 -3.010 3.013 393 HD1 HIS 76 HD1 HIS 76 -18.810 -5.476 5.310 394 HD2 HIS 76 HD2 HIS 76 -18.080 -4.887 1.262 395 HE1 HIS 76 HE1 HIS 76 -18.145 -7.724 4.407 396 HE2 HIS 76 HE2 HIS 76 -17.954 -7.382 1.922 397 H ALA 77 H ALA 77 -15.852 -3.048 1.912 398 HA ALA 77 HA ALA 77 -16.271 -1.565 -0.452 399 HB1 ALA 77 1HB ALA 77 -14.689 -4.105 -0.081 400 HB2 ALA 77 2HB ALA 77 -14.084 -2.468 0.181 401 HB3 ALA 77 3HB ALA 77 -14.557 -2.986 -1.437 402 H ARG 78 H ARG 78 -17.681 -1.855 -2.026 403 HA ARG 78 HA ARG 78 -19.007 -4.472 -2.275 404 HB2 ARG 78 1HB ARG 78 -20.035 -1.725 -3.021 405 HB3 ARG 78 2HB ARG 78 -20.903 -3.233 -3.266 406 HG2 ARG 78 1HG ARG 78 -20.041 -2.205 -0.571 407 HG3 ARG 78 2HG ARG 78 -21.634 -1.929 -1.279 408 HD2 ARG 78 1HD ARG 78 -20.426 -4.641 -0.739 409 HD3 ARG 78 2HD ARG 78 -21.586 -3.829 0.309 410 HE ARG 78 HE ARG 78 -22.726 -3.923 -2.215 411 HH11 ARG 78 1HH1 ARG 78 -21.652 -6.230 0.204 412 HH12 ARG 78 2HH1 ARG 78 -22.816 -7.429 -0.256 413 HH21 ARG 78 1HH2 ARG 78 -24.258 -5.512 -2.798 414 HH22 ARG 78 2HH2 ARG 78 -24.288 -7.027 -1.950 415 H ASN 79 H ASN 79 -19.634 -5.105 -4.455 416 HA ASN 79 HA ASN 79 -19.143 -5.621 -6.606 417 HB2 ASN 79 1HB ASN 79 -18.313 -2.714 -6.745 418 HB3 ASN 79 2HB ASN 79 -18.501 -3.771 -8.142 419 HD21 ASN 79 1HD2 ASN 79 -21.708 -2.087 -6.352 420 HD22 ASN 79 2HD2 ASN 79 -20.106 -1.913 -5.724 421 H TYR 80 H TYR 80 -17.223 -6.045 -4.562 422 HA TYR 80 HA TYR 80 -14.590 -5.496 -5.499 423 HB2 TYR 80 1HB TYR 80 -13.936 -7.164 -3.749 424 HB3 TYR 80 2HB TYR 80 -14.977 -5.884 -3.139 425 HD1 TYR 80 HD1 TYR 80 -17.308 -6.353 -2.533 426 HD2 TYR 80 HD2 TYR 80 -14.703 -9.460 -3.831 427 HE1 TYR 80 HE1 TYR 80 -18.881 -8.027 -1.663 428 HE2 TYR 80 HE2 TYR 80 -16.272 -11.141 -2.963 429 HH TYR 80 HH TYR 80 -18.055 -11.338 -1.356 430 HA PRO 81 HA PRO 81 -14.193 -8.865 -8.381 431 HB2 PRO 81 1HB PRO 81 -11.493 -9.141 -8.358 432 HB3 PRO 81 2HB PRO 81 -12.308 -7.808 -9.180 433 HG2 PRO 81 1HG PRO 81 -10.966 -7.852 -6.508 434 HG3 PRO 81 2HG PRO 81 -10.917 -6.603 -7.766 435 HD2 PRO 81 1HD PRO 81 -12.495 -6.428 -5.559 436 HD3 PRO 81 2HD PRO 81 -12.927 -5.697 -7.117 437 H GLU 82 H GLU 82 -14.237 -11.036 -8.204 438 HA GLU 82 HA GLU 82 -14.080 -12.249 -5.655 439 HB2 GLU 82 1HB GLU 82 -14.176 -13.528 -8.391 440 HB3 GLU 82 2HB GLU 82 -14.453 -14.362 -6.867 441 HG2 GLU 82 1HG GLU 82 -16.377 -12.874 -6.445 442 HG3 GLU 82 2HG GLU 82 -16.120 -12.144 -8.029 443 H GLY 83 H GLY 83 -12.411 -13.059 -4.595 444 HA2 GLY 83 1HA GLY 83 -10.348 -14.126 -4.294 445 HA3 GLY 83 2HA GLY 83 -10.058 -14.003 -6.025 446 H GLY 84 H GLY 84 -11.152 -11.075 -4.959 447 HA2 GLY 84 1HA GLY 84 -10.169 -9.087 -4.369 448 HA3 GLY 84 2HA GLY 84 -8.797 -10.003 -3.764 449 H TYR 85 H TYR 85 -7.327 -8.549 -4.594 450 HA TYR 85 HA TYR 85 -7.185 -8.281 -7.515 451 HB2 TYR 85 1HB TYR 85 -5.918 -6.753 -5.229 452 HB3 TYR 85 2HB TYR 85 -5.424 -6.533 -6.913 453 HD1 TYR 85 HD1 TYR 85 -8.322 -6.238 -4.603 454 HD2 TYR 85 HD2 TYR 85 -6.663 -5.159 -8.367 455 HE1 TYR 85 HE1 TYR 85 -10.152 -4.636 -4.942 456 HE2 TYR 85 HE2 TYR 85 -8.487 -3.552 -8.716 457 HH TYR 85 HH TYR 85 -10.661 -2.663 -6.219 458 H ILE 86 H ILE 86 -5.411 -9.289 -4.675 459 HA ILE 86 HA ILE 86 -3.728 -10.978 -6.383 460 HB ILE 86 HB ILE 86 -2.319 -9.131 -5.661 461 HG12 ILE 86 1HG1 ILE 86 -1.706 -11.605 -4.034 462 HG13 ILE 86 2HG1 ILE 86 -1.340 -11.402 -5.742 463 HG21 ILE 86 1HG2 ILE 86 -1.900 -8.649 -3.305 464 HG22 ILE 86 2HG2 ILE 86 -3.103 -9.851 -2.842 465 HG23 ILE 86 3HG2 ILE 86 -3.595 -8.405 -3.723 466 HD11 ILE 86 1HD1 ILE 86 0.629 -11.047 -4.375 467 HD12 ILE 86 2HD1 ILE 86 -0.202 -9.769 -3.487 468 HD13 ILE 86 3HD1 ILE 86 0.162 -9.558 -5.199 469 H ARG 87 H ARG 87 -3.428 -13.048 -5.589 470 HA ARG 87 HA ARG 87 -5.593 -13.973 -4.020 471 HB2 ARG 87 1HB ARG 87 -3.152 -15.482 -4.957 472 HB3 ARG 87 2HB ARG 87 -4.616 -16.209 -4.311 473 HG2 ARG 87 1HG ARG 87 -5.843 -15.049 -6.205 474 HG3 ARG 87 2HG ARG 87 -4.252 -14.742 -6.899 475 HD2 ARG 87 1HD ARG 87 -5.416 -17.438 -6.225 476 HD3 ARG 87 2HD ARG 87 -5.249 -16.756 -7.840 477 HE ARG 87 HE ARG 87 -2.712 -16.745 -6.833 478 HH11 ARG 87 1HH1 ARG 87 -5.183 -19.174 -7.313 479 HH12 ARG 87 2HH1 ARG 87 -4.052 -20.471 -7.533 480 HH21 ARG 87 1HH2 ARG 87 -1.208 -18.448 -7.131 481 HH22 ARG 87 2HH2 ARG 87 -1.786 -20.056 -7.423 482 H ARG 88 H ARG 88 -2.412 -13.025 -3.181 483 HA ARG 88 HA ARG 88 -2.849 -14.026 -0.449 484 HB2 ARG 88 1HB ARG 88 -0.191 -13.947 -1.899 485 HB3 ARG 88 2HB ARG 88 -0.450 -14.477 -0.244 486 HG2 ARG 88 1HG ARG 88 -1.846 -16.329 -1.093 487 HG3 ARG 88 2HG ARG 88 -1.467 -15.818 -2.739 488 HD2 ARG 88 1HD ARG 88 0.543 -16.670 -0.662 489 HD3 ARG 88 2HD ARG 88 -0.041 -17.673 -1.985 490 HE ARG 88 HE ARG 88 0.963 -15.905 -3.477 491 HH11 ARG 88 1HH1 ARG 88 2.191 -16.477 -0.245 492 HH12 ARG 88 2HH1 ARG 88 3.814 -16.012 -0.642 493 HH21 ARG 88 1HH2 ARG 88 3.106 -15.298 -3.993 494 HH22 ARG 88 2HH2 ARG 88 4.329 -15.335 -2.762 495 H LEU 89 H LEU 89 -1.976 -12.685 1.212 496 HA LEU 89 HA LEU 89 -1.890 -9.939 0.887 497 HB2 LEU 89 1HB LEU 89 -0.742 -11.814 2.911 498 HB3 LEU 89 2HB LEU 89 -0.254 -10.137 2.954 499 HG LEU 89 HG LEU 89 -2.073 -10.671 4.533 500 HD11 LEU 89 1HD1 LEU 89 -1.749 -8.410 3.695 501 HD12 LEU 89 2HD1 LEU 89 -3.458 -8.749 3.981 502 HD13 LEU 89 3HD1 LEU 89 -2.822 -8.753 2.336 503 HD21 LEU 89 1HD2 LEU 89 -4.339 -11.037 3.665 504 HD22 LEU 89 2HD2 LEU 89 -3.249 -12.360 3.249 505 HD23 LEU 89 3HD2 LEU 89 -3.682 -11.160 2.032 506 HA PRO 90 HA PRO 90 1.736 -9.436 -1.603 507 HB2 PRO 90 1HB PRO 90 2.153 -6.766 -1.002 508 HB3 PRO 90 2HB PRO 90 1.062 -7.364 -2.253 509 HG2 PRO 90 1HG PRO 90 0.448 -6.464 0.526 510 HG3 PRO 90 2HG PRO 90 -0.475 -6.213 -0.967 511 HD2 PRO 90 1HD PRO 90 -1.197 -8.052 0.852 512 HD3 PRO 90 2HD PRO 90 -1.414 -8.327 -0.890 513 H GLN 91 H GLN 91 3.861 -9.688 -1.262 514 HA GLN 91 HA GLN 91 5.008 -8.855 1.293 515 HB2 GLN 91 1HB GLN 91 5.005 -11.645 0.181 516 HB3 GLN 91 2HB GLN 91 6.278 -11.100 1.263 517 HG2 GLN 91 1HG GLN 91 4.541 -10.535 2.933 518 HG3 GLN 91 2HG GLN 91 3.336 -11.242 1.858 519 HE21 GLN 91 1HE2 GLN 91 3.805 -14.144 3.720 520 HE22 GLN 91 2HE2 GLN 91 2.783 -12.792 3.374 521 H ASP 92 H ASP 92 6.976 -8.100 1.175 522 HA ASP 92 HA ASP 92 8.333 -7.576 -1.227 523 HB2 ASP 92 1HB ASP 92 9.479 -7.742 1.571 524 HB3 ASP 92 2HB ASP 92 10.194 -6.894 0.204 525 HA PRO 93 HA PRO 93 10.549 -11.275 -2.233 526 HB2 PRO 93 1HB PRO 93 13.065 -10.196 -2.695 527 HB3 PRO 93 2HB PRO 93 11.752 -10.265 -3.873 528 HG2 PRO 93 1HG PRO 93 12.609 -8.003 -2.120 529 HG3 PRO 93 2HG PRO 93 12.066 -7.972 -3.809 530 HD2 PRO 93 1HD PRO 93 10.439 -7.231 -1.824 531 HD3 PRO 93 2HD PRO 93 9.823 -8.142 -3.220 532 H TRP 94 H TRP 94 11.644 -9.176 0.309 533 HA TRP 94 HA TRP 94 13.565 -11.055 1.359 534 HB2 TRP 94 1HB TRP 94 12.398 -8.617 2.714 535 HB3 TRP 94 2HB TRP 94 13.869 -9.476 3.163 536 HD1 TRP 94 HD1 TRP 94 15.844 -9.428 1.098 537 HE1 TRP 94 HE1 TRP 94 16.523 -7.405 -0.349 538 HE3 TRP 94 HE3 TRP 94 11.687 -6.531 1.755 539 HZ2 TRP 94 HZ2 TRP 94 15.435 -4.916 -1.105 540 HZ3 TRP 94 HZ3 TRP 94 11.586 -4.341 0.639 541 HH2 TRP 94 HH2 TRP 94 13.425 -3.555 -0.760 542 H GLY 95 H GLY 95 10.219 -10.737 1.438 543 HA2 GLY 95 1HA GLY 95 8.801 -12.374 2.388 544 HA3 GLY 95 2HA GLY 95 10.052 -12.741 3.567 545 H SER 96 H SER 96 8.996 -9.492 2.806 546 HA SER 96 HA SER 96 8.142 -9.233 5.594 547 HB2 SER 96 1HB SER 96 8.929 -7.063 3.639 548 HB3 SER 96 2HB SER 96 8.621 -6.861 5.366 549 HG SER 96 HG SER 96 10.832 -7.027 5.065 550 H ASP 97 H ASP 97 6.253 -8.140 6.127 551 HA ASP 97 HA ASP 97 4.175 -8.189 4.058 552 HB2 ASP 97 1HB ASP 97 3.602 -9.532 5.946 553 HB3 ASP 97 2HB ASP 97 4.096 -8.281 7.081 554 H TYR 98 H TYR 98 2.859 -6.393 3.679 555 HA TYR 98 HA TYR 98 4.204 -3.871 4.119 556 HB2 TYR 98 1HB TYR 98 1.811 -4.683 2.479 557 HB3 TYR 98 2HB TYR 98 2.333 -3.006 2.616 558 HD1 TYR 98 HD1 TYR 98 2.989 -6.250 1.126 559 HD2 TYR 98 HD2 TYR 98 4.549 -2.337 1.702 560 HE1 TYR 98 HE1 TYR 98 4.628 -6.648 -0.661 561 HE2 TYR 98 HE2 TYR 98 6.184 -2.720 -0.093 562 HH TYR 98 HH TYR 98 7.322 -4.834 -1.090 563 H GLN 99 H GLN 99 3.344 -2.033 5.072 564 HA GLN 99 HA GLN 99 0.980 -2.471 6.777 565 HB2 GLN 99 1HB GLN 99 3.429 -0.781 7.302 566 HB3 GLN 99 2HB GLN 99 1.962 -0.678 8.258 567 HG2 GLN 99 1HG GLN 99 3.498 -2.024 9.449 568 HG3 GLN 99 2HG GLN 99 2.254 -3.095 8.812 569 HE21 GLN 99 1HE2 GLN 99 4.827 -5.145 7.785 570 HE22 GLN 99 2HE2 GLN 99 3.505 -4.892 8.871 571 H LEU 100 H LEU 100 -0.454 -0.772 7.051 572 HA LEU 100 HA LEU 100 -0.017 1.661 5.461 573 HB2 LEU 100 1HB LEU 100 -1.674 0.506 4.205 574 HB3 LEU 100 2HB LEU 100 -2.527 0.004 5.656 575 HG LEU 100 HG LEU 100 -2.930 2.521 6.049 576 HD11 LEU 100 1HD1 LEU 100 -2.356 2.590 3.099 577 HD12 LEU 100 2HD1 LEU 100 -1.345 3.308 4.354 578 HD13 LEU 100 3HD1 LEU 100 -2.980 3.910 4.085 579 HD21 LEU 100 1HD2 LEU 100 -4.925 2.492 4.671 580 HD22 LEU 100 2HD2 LEU 100 -4.680 0.950 5.485 581 HD23 LEU 100 3HD2 LEU 100 -4.295 1.113 3.772 582 H LEU 101 H LEU 101 -0.517 3.541 6.551 583 HA LEU 101 HA LEU 101 -2.052 3.235 9.023 584 HB2 LEU 101 1HB LEU 101 0.457 3.327 9.424 585 HB3 LEU 101 2HB LEU 101 0.408 4.974 8.836 586 HG LEU 101 HG LEU 101 0.431 4.656 11.357 587 HD11 LEU 101 1HD1 LEU 101 -1.117 6.479 11.764 588 HD12 LEU 101 2HD1 LEU 101 -1.855 6.225 10.182 589 HD13 LEU 101 3HD1 LEU 101 -0.182 6.773 10.296 590 HD21 LEU 101 1HD2 LEU 101 -1.672 4.143 12.440 591 HD22 LEU 101 2HD2 LEU 101 -1.172 2.795 11.417 592 HD23 LEU 101 3HD2 LEU 101 -2.443 3.891 10.876 593 H SER 102 H SER 102 -3.824 4.379 8.763 594 HA SER 102 HA SER 102 -3.635 7.077 7.603 595 HB2 SER 102 1HB SER 102 -5.339 5.440 6.666 596 HB3 SER 102 2HB SER 102 -6.156 5.516 8.226 597 HG SER 102 HG SER 102 -5.631 7.732 6.519 598 HA PRO 103 HA PRO 103 -4.328 9.123 7.799 599 HB2 PRO 103 1HB PRO 103 -3.009 11.098 9.494 600 HB3 PRO 103 2HB PRO 103 -4.504 11.249 8.569 601 HG2 PRO 103 1HG PRO 103 -4.468 11.180 11.272 602 HG3 PRO 103 2HG PRO 103 -5.815 10.535 10.316 603 HD2 PRO 103 1HD PRO 103 -3.544 9.071 11.618 604 HD3 PRO 103 2HD PRO 103 -5.270 8.650 11.565 605 H GLY 104 H GLY 104 -2.629 9.359 6.463 606 HA2 GLY 104 1HA GLY 104 -0.374 7.742 7.061 607 HA3 GLY 104 2HA GLY 104 -0.633 8.653 5.584 608 H GLN 105 H GLN 105 1.781 8.222 7.183 609 HA GLN 105 HA GLN 105 2.574 10.609 8.448 610 HB2 GLN 105 1HB GLN 105 3.762 8.405 8.576 611 HB3 GLN 105 2HB GLN 105 4.318 8.659 6.928 612 HG2 GLN 105 1HG GLN 105 5.439 10.747 7.710 613 HG3 GLN 105 2HG GLN 105 5.010 10.289 9.357 614 HE21 GLN 105 1HE2 GLN 105 8.466 9.144 8.387 615 HE22 GLN 105 2HE2 GLN 105 7.638 10.653 8.213 616 H HIS 106 H HIS 106 2.246 9.714 5.119 617 HA HIS 106 HA HIS 106 3.298 12.345 4.315 618 HB2 HIS 106 1HB HIS 106 3.653 9.861 2.635 619 HB3 HIS 106 2HB HIS 106 4.422 11.432 2.429 620 HD1 HIS 106 HD1 HIS 106 4.815 8.166 4.073 621 HD2 HIS 106 HD2 HIS 106 6.507 11.962 4.350 622 HE1 HIS 106 HE1 HIS 106 6.973 7.864 5.338 623 HE2 HIS 106 HE2 HIS 106 8.056 10.140 5.334 624 H GLY 107 H GLY 107 0.650 11.916 4.828 625 HA2 GLY 107 1HA GLY 107 -0.849 12.952 2.925 626 HA3 GLY 107 2HA GLY 107 -0.688 11.316 2.297 627 H GLN 108 H GLN 108 -3.136 11.445 2.585 628 HA GLN 108 HA GLN 108 -4.086 11.218 5.281 629 HB2 GLN 108 1HB GLN 108 -5.428 10.582 2.654 630 HB3 GLN 108 2HB GLN 108 -6.227 10.483 4.218 631 HG2 GLN 108 1HG GLN 108 -5.127 12.928 2.865 632 HG3 GLN 108 2HG GLN 108 -6.808 12.565 3.243 633 HE21 GLN 108 1HE2 GLN 108 -5.783 12.914 6.882 634 HE22 GLN 108 2HE2 GLN 108 -6.107 11.514 5.914 635 H VAL 109 H VAL 109 -2.965 9.043 2.840 636 HA VAL 109 HA VAL 109 -3.043 6.877 4.814 637 HB VAL 109 HB VAL 109 -3.348 5.309 2.775 638 HG11 VAL 109 1HG1 VAL 109 -5.795 5.429 2.982 639 HG12 VAL 109 2HG1 VAL 109 -5.629 6.971 3.823 640 HG13 VAL 109 3HG1 VAL 109 -4.978 5.500 4.543 641 HG21 VAL 109 1HG2 VAL 109 -4.514 7.860 1.664 642 HG22 VAL 109 2HG2 VAL 109 -4.713 6.253 0.965 643 HG23 VAL 109 3HG2 VAL 109 -3.114 6.992 1.034 644 H ASP 110 H ASP 110 -1.112 5.955 5.100 645 HA ASP 110 HA ASP 110 0.937 6.437 3.037 646 HB2 ASP 110 1HB ASP 110 1.208 7.714 5.219 647 HB3 ASP 110 2HB ASP 110 1.488 6.158 5.992 648 H ILE 111 H ILE 111 1.549 4.653 2.082 649 HA ILE 111 HA ILE 111 1.396 2.101 3.532 650 HB ILE 111 HB ILE 111 1.638 1.084 1.219 651 HG12 ILE 111 1HG1 ILE 111 0.959 3.909 0.369 652 HG13 ILE 111 2HG1 ILE 111 2.497 3.100 0.092 653 HG21 ILE 111 1HG2 ILE 111 -0.728 1.357 0.678 654 HG22 ILE 111 2HG2 ILE 111 -0.817 2.740 1.768 655 HG23 ILE 111 3HG2 ILE 111 -0.483 1.132 2.411 656 HD11 ILE 111 1HD1 ILE 111 1.173 3.089 -1.911 657 HD12 ILE 111 2HD1 ILE 111 -0.167 2.315 -1.062 658 HD13 ILE 111 3HD1 ILE 111 1.349 1.444 -1.303 659 H PHE 112 H PHE 112 3.202 0.958 3.923 660 HA PHE 112 HA PHE 112 5.673 1.598 2.547 661 HB2 PHE 112 1HB PHE 112 6.895 2.064 4.648 662 HB3 PHE 112 2HB PHE 112 5.668 3.276 4.301 663 HD1 PHE 112 HD1 PHE 112 3.640 3.415 5.655 664 HD2 PHE 112 HD2 PHE 112 6.722 0.623 6.561 665 HE1 PHE 112 HE1 PHE 112 2.687 3.099 7.901 666 HE2 PHE 112 HE2 PHE 112 5.775 0.299 8.806 667 HZ PHE 112 HZ PHE 112 3.755 1.538 9.480 668 H SER 113 H SER 113 7.401 0.160 3.061 669 HA SER 113 HA SER 113 6.561 -2.366 4.323 670 HB2 SER 113 1HB SER 113 7.040 -2.789 2.007 671 HB3 SER 113 2HB SER 113 8.518 -1.828 2.076 672 HG SER 113 HG SER 113 8.260 -4.419 2.490 673 H LEU 114 H LEU 114 8.057 -3.365 5.703 674 HA LEU 114 HA LEU 114 9.686 -1.597 7.228 675 HB2 LEU 114 1HB LEU 114 9.678 -4.620 7.269 676 HB3 LEU 114 2HB LEU 114 10.406 -3.582 8.471 677 HG LEU 114 HG LEU 114 8.515 -4.081 9.584 678 HD11 LEU 114 1HD1 LEU 114 6.805 -2.377 9.367 679 HD12 LEU 114 2HD1 LEU 114 7.449 -1.919 7.790 680 HD13 LEU 114 3HD1 LEU 114 8.423 -1.685 9.241 681 HD21 LEU 114 1HD2 LEU 114 6.367 -4.659 8.558 682 HD22 LEU 114 2HD2 LEU 114 7.691 -5.666 7.962 683 HD23 LEU 114 3HD2 LEU 114 7.059 -4.358 6.965 684 H GLY 115 H GLY 115 10.191 -3.655 4.512 685 HA2 GLY 115 1HA GLY 115 12.103 -3.815 3.185 686 HA3 GLY 115 2HA GLY 115 13.008 -2.948 4.422 687 HA PRO 116 HA PRO 116 14.232 -7.422 4.551 688 HB2 PRO 116 1HB PRO 116 16.900 -6.310 5.056 689 HB3 PRO 116 2HB PRO 116 16.377 -7.441 3.808 690 HG2 PRO 116 1HG PRO 116 17.060 -4.898 3.241 691 HG3 PRO 116 2HG PRO 116 15.801 -5.764 2.340 692 HD2 PRO 116 1HD PRO 116 15.519 -3.720 4.509 693 HD3 PRO 116 2HD PRO 116 14.581 -3.914 3.013 694 H ASP 117 H ASP 117 14.868 -4.728 6.724 695 HA ASP 117 HA ASP 117 16.002 -6.464 8.751 696 HB2 ASP 117 1HB ASP 117 16.562 -4.511 9.959 697 HB3 ASP 117 2HB ASP 117 16.813 -4.105 8.267 698 H GLY 118 H GLY 118 12.871 -5.514 7.922 699 HA2 GLY 118 1HA GLY 118 10.864 -5.992 8.954 700 HA3 GLY 118 2HA GLY 118 11.767 -6.768 10.245 701 H VAL 119 H VAL 119 12.800 -3.597 9.653 702 HA VAL 119 HA VAL 119 11.203 -2.618 11.929 703 HB VAL 119 HB VAL 119 14.054 -1.933 11.202 704 HG11 VAL 119 1HG1 VAL 119 14.049 -0.456 13.152 705 HG12 VAL 119 2HG1 VAL 119 12.331 -0.773 13.393 706 HG13 VAL 119 3HG1 VAL 119 12.876 0.077 11.947 707 HG21 VAL 119 1HG2 VAL 119 14.562 -2.856 13.410 708 HG22 VAL 119 2HG2 VAL 119 13.787 -4.051 12.370 709 HG23 VAL 119 3HG2 VAL 119 12.859 -3.249 13.636 710 HA PRO 120 HA PRO 120 9.659 0.302 8.957 711 HB2 PRO 120 1HB PRO 120 7.920 1.521 10.624 712 HB3 PRO 120 2HB PRO 120 7.619 -0.083 9.950 713 HG2 PRO 120 1HG PRO 120 8.620 0.679 12.660 714 HG3 PRO 120 2HG PRO 120 7.458 -0.581 12.205 715 HD2 PRO 120 1HD PRO 120 10.081 -1.079 12.786 716 HD3 PRO 120 2HD PRO 120 9.107 -2.090 11.702 717 H GLU 121 H GLU 121 9.638 2.510 8.571 718 HA GLU 121 HA GLU 121 10.334 4.661 8.607 719 HB2 GLU 121 1HB GLU 121 9.045 4.541 10.819 720 HB3 GLU 121 2HB GLU 121 10.615 4.434 11.598 721 HG2 GLU 121 1HG GLU 121 11.234 6.585 10.557 722 HG3 GLU 121 2HG GLU 121 9.603 6.700 9.899 723 H SER 122 H SER 122 12.181 2.347 8.588 724 HA SER 122 HA SER 122 14.643 3.505 9.627 725 HB2 SER 122 1HB SER 122 15.325 1.124 8.475 726 HB3 SER 122 2HB SER 122 14.808 1.305 10.154 727 HG SER 122 HG SER 122 13.625 -0.092 8.254 728 H ASN 123 H ASN 123 16.596 2.965 8.011 729 HA ASN 123 HA ASN 123 16.086 4.607 5.698 730 HB2 ASN 123 1HB ASN 123 18.605 3.164 6.550 731 HB3 ASN 123 2HB ASN 123 18.499 4.360 5.263 732 HD21 ASN 123 1HD2 ASN 123 18.489 7.123 7.387 733 HD22 ASN 123 2HD2 ASN 123 18.208 6.523 5.789 734 H ASP 124 H ASP 124 16.461 1.238 6.399 735 HA ASP 124 HA ASP 124 16.864 0.373 3.685 736 HB2 ASP 124 1HB ASP 124 16.683 -1.856 4.571 737 HB3 ASP 124 2HB ASP 124 17.592 -0.904 5.745 738 H ASP 125 H ASP 125 14.252 1.420 5.510 739 HA ASP 125 HA ASP 125 12.165 -0.232 4.588 740 HB2 ASP 125 1HB ASP 125 12.338 2.450 5.893 741 HB3 ASP 125 2HB ASP 125 10.799 1.919 5.228 742 H ILE 126 H ILE 126 10.682 0.040 2.961 743 HA ILE 126 HA ILE 126 11.316 2.110 0.970 744 HB ILE 126 HB ILE 126 10.049 -0.601 0.551 745 HG12 ILE 126 1HG1 ILE 126 12.681 0.560 -0.392 746 HG13 ILE 126 2HG1 ILE 126 12.492 -0.626 0.896 747 HG21 ILE 126 1HG2 ILE 126 9.055 1.137 -0.897 748 HG22 ILE 126 2HG2 ILE 126 9.961 -0.070 -1.806 749 HG23 ILE 126 3HG2 ILE 126 10.666 1.521 -1.507 750 HD11 ILE 126 1HD1 ILE 126 11.678 -2.254 -0.676 751 HD12 ILE 126 2HD1 ILE 126 13.226 -1.611 -1.224 752 HD13 ILE 126 3HD1 ILE 126 11.728 -1.065 -1.978 753 H GLY 127 H GLY 127 9.904 3.688 0.868 754 HA2 GLY 127 1HA GLY 127 7.138 3.160 1.759 755 HA3 GLY 127 2HA GLY 127 8.003 4.665 2.065 756 H ASN 128 H ASN 128 5.487 4.486 0.791 757 HA ASN 128 HA ASN 128 5.615 4.760 -1.994 758 HB2 ASN 128 1HB ASN 128 3.505 5.981 -1.812 759 HB3 ASN 128 2HB ASN 128 3.493 4.605 -0.716 760 HD21 ASN 128 1HD2 ASN 128 3.352 6.539 2.223 761 HD22 ASN 128 2HD2 ASN 128 3.697 4.979 1.530 762 H TRP 129 H TRP 129 6.283 6.979 0.602 763 HA TRP 129 HA TRP 129 6.476 9.301 -1.052 764 HB2 TRP 129 1HB TRP 129 5.798 9.373 1.319 765 HB3 TRP 129 2HB TRP 129 7.401 8.823 1.785 766 HD1 TRP 129 HD1 TRP 129 5.645 11.890 0.250 767 HE1 TRP 129 HE1 TRP 129 7.099 13.961 0.711 768 HE3 TRP 129 HE3 TRP 129 9.700 9.583 2.337 769 HZ2 TRP 129 HZ2 TRP 129 9.616 14.535 1.821 770 HZ3 TRP 129 HZ3 TRP 129 11.591 10.972 3.077 771 HH2 TRP 129 HH2 TRP 129 11.548 13.398 2.821 772 H THR 130 H THR 130 8.679 6.830 0.031 773 HA THR 130 HA THR 130 11.026 8.434 -0.422 774 HB THR 130 HB THR 130 12.277 6.348 0.068 775 HG1 THR 130 HG1 THR 130 11.012 4.705 -0.592 776 HG21 THR 130 1HG2 THR 130 11.614 7.839 1.893 777 HG22 THR 130 2HG2 THR 130 11.603 6.153 2.410 778 HG23 THR 130 3HG2 THR 130 10.085 6.973 2.045 779 H ILE 131 H ILE 131 9.122 6.118 -2.215 780 HA ILE 131 HA ILE 131 11.167 5.802 -4.237 781 HB ILE 131 HB ILE 131 9.765 3.875 -3.701 782 HG12 ILE 131 1HG1 ILE 131 9.075 3.273 -6.017 783 HG13 ILE 131 2HG1 ILE 131 9.343 4.945 -6.497 784 HG21 ILE 131 1HG2 ILE 131 7.708 4.963 -3.092 785 HG22 ILE 131 2HG2 ILE 131 7.397 3.821 -4.400 786 HG23 ILE 131 3HG2 ILE 131 7.489 5.549 -4.740 787 HD11 ILE 131 1HD1 ILE 131 11.439 3.067 -5.432 788 HD12 ILE 131 2HD1 ILE 131 11.702 4.737 -5.935 789 HD13 ILE 131 3HD1 ILE 131 11.214 3.525 -7.120 790 H GLY 132 H GLY 132 8.220 7.674 -3.798 791 HA2 GLY 132 1HA GLY 132 8.528 9.833 -5.144 792 HA3 GLY 132 2HA GLY 132 8.579 8.747 -6.523 793 H PHE 133 H PHE 133 6.479 7.122 -4.875 794 HA PHE 133 HA PHE 133 4.195 8.450 -6.074 795 HB2 PHE 133 1HB PHE 133 4.494 5.788 -4.673 796 HB3 PHE 133 2HB PHE 133 2.958 6.397 -5.278 797 HD1 PHE 133 HD1 PHE 133 2.520 6.531 -7.655 798 HD2 PHE 133 HD2 PHE 133 6.219 5.027 -6.187 799 HE1 PHE 133 HE1 PHE 133 3.018 5.598 -9.877 800 HE2 PHE 133 HE2 PHE 133 6.724 4.090 -8.404 801 HZ PHE 133 HZ PHE 133 5.124 4.376 -10.253 802 H HIS 134 H HIS 134 4.915 10.171 -4.352 803 HA HIS 134 HA HIS 134 4.021 9.715 -1.671 804 HB2 HIS 134 1HB HIS 134 4.481 12.125 -1.327 805 HB3 HIS 134 2HB HIS 134 5.845 11.260 -2.017 806 HD1 HIS 134 HD1 HIS 134 4.027 14.305 -2.371 807 HD2 HIS 134 HD2 HIS 134 5.917 11.708 -5.005 808 HE1 HIS 134 HE1 HIS 134 4.457 15.647 -4.452 809 HE2 HIS 134 HE2 HIS 134 5.472 14.016 -6.079 810 H HIS 135 H HIS 135 2.341 10.943 -0.597 811 HA HIS 135 HA HIS 135 0.010 11.205 -2.359 812 HB2 HIS 135 1HB HIS 135 0.212 10.636 0.602 813 HB3 HIS 135 2HB HIS 135 -1.308 10.912 -0.236 814 HD1 HIS 135 HD1 HIS 135 1.570 8.444 -0.152 815 HD2 HIS 135 HD2 HIS 135 -2.376 8.700 -1.433 816 HE1 HIS 135 HE1 HIS 135 0.925 6.115 -0.828 817 HE2 HIS 135 HE2 HIS 135 -1.383 6.336 -1.809 818 H HIS 136 H HIS 136 0.706 13.384 -2.945 819 HA HIS 136 HA HIS 136 0.816 15.390 -0.878 820 HB2 HIS 136 1HB HIS 136 2.163 15.511 -2.992 821 HB3 HIS 136 2HB HIS 136 0.668 15.813 -3.869 822 HD1 HIS 136 HD1 HIS 136 0.047 18.207 -4.130 823 HD2 HIS 136 HD2 HIS 136 2.668 17.605 -0.963 824 HE1 HIS 136 HE1 HIS 136 0.589 20.499 -3.256 825 HE2 HIS 136 HE2 HIS 136 2.044 20.097 -1.244 826 H HIS 137 H HIS 137 -1.635 13.951 -2.775 827 HA HIS 137 HA HIS 137 -3.484 16.170 -2.468 828 HB2 HIS 137 1HB HIS 137 -3.444 14.685 -4.504 829 HB3 HIS 137 2HB HIS 137 -4.032 13.375 -3.491 830 HD1 HIS 137 HD1 HIS 137 -5.109 16.785 -4.739 831 HD2 HIS 137 HD2 HIS 137 -6.743 13.280 -3.219 832 HE1 HIS 137 HE1 HIS 137 -7.595 17.035 -4.994 833 HE2 HIS 137 HE2 HIS 137 -8.565 14.974 -3.923 834 H HIS 138 H HIS 138 -3.626 16.347 -0.216 835 HA HIS 138 HA HIS 138 -5.116 14.183 1.089 836 HB2 HIS 138 1HB HIS 138 -3.798 14.624 3.188 837 HB3 HIS 138 2HB HIS 138 -2.878 13.873 1.893 838 HD1 HIS 138 HD1 HIS 138 -3.211 17.102 3.790 839 HD2 HIS 138 HD2 HIS 138 -0.757 15.378 0.914 840 HE1 HIS 138 HE1 HIS 138 -1.234 18.631 3.586 841 HE2 HIS 138 HE2 HIS 138 0.293 17.512 1.926 842 H HIS 139 H HIS 139 -6.874 14.850 2.138 843 HA HIS 139 HA HIS 139 -7.230 17.739 2.507 844 HB2 HIS 139 1HB HIS 139 -8.932 16.604 1.127 845 HB3 HIS 139 2HB HIS 139 -9.301 15.528 2.470 846 HD1 HIS 139 HD1 HIS 139 -10.654 16.528 4.458 847 HD2 HIS 139 HD2 HIS 139 -10.027 19.159 1.305 848 HE1 HIS 139 HE1 HIS 139 -12.197 18.466 4.877 849 HE2 HIS 139 HE2 HIS 139 -11.671 20.121 3.056 850 H LYS 140 H LYS 140 -6.250 18.091 4.459 851 HA LYS 140 HA LYS 140 -6.718 16.432 6.740 852 HB2 LYS 140 1HB LYS 140 -4.663 17.817 6.406 853 HB3 LYS 140 2HB LYS 140 -5.642 19.256 6.655 854 HG2 LYS 140 1HG LYS 140 -6.184 18.502 8.910 855 HG3 LYS 140 2HG LYS 140 -5.203 17.055 8.661 856 HD2 LYS 140 1HD LYS 140 -3.227 18.468 8.323 857 HD3 LYS 140 2HD LYS 140 -4.215 19.903 8.596 858 HE2 LYS 140 1HE LYS 140 -3.690 17.694 10.578 859 HE3 LYS 140 2HE LYS 140 -2.977 19.305 10.606 860 HZ1 LYS 140 1HZ LYS 140 -5.195 20.230 10.908 861 HZ2 LYS 140 2HZ LYS 140 -4.814 19.145 12.148 862 HZ3 LYS 140 3HZ LYS 140 -5.864 18.677 10.908 Start of MODEL 7 1 H1 MET 25 1H MET 25 24.767 -15.094 -3.367 2 H2 MET 25 2H MET 25 23.842 -14.579 -4.683 3 H3 MET 25 3H MET 25 23.710 -13.789 -3.196 4 HA MET 25 HA MET 25 25.995 -13.053 -3.349 5 HB2 MET 25 1HB MET 25 26.863 -14.871 -4.716 6 HB3 MET 25 2HB MET 25 25.850 -14.377 -6.064 7 HG2 MET 25 1HG MET 25 27.087 -12.319 -6.290 8 HG3 MET 25 2HG MET 25 28.055 -12.714 -4.874 9 HE1 MET 25 1HE MET 25 30.154 -15.764 -6.098 10 HE2 MET 25 2HE MET 25 28.631 -15.793 -5.210 11 HE3 MET 25 3HE MET 25 29.872 -14.615 -4.789 12 H GLY 26 H GLY 26 23.396 -13.116 -5.724 13 HA2 GLY 26 1HA GLY 26 23.959 -10.449 -6.664 14 HA3 GLY 26 2HA GLY 26 22.572 -11.439 -7.091 15 H ASN 27 H ASN 27 23.907 -9.278 -4.659 16 HA ASN 27 HA ASN 27 21.294 -8.971 -3.404 17 HB2 ASN 27 1HB ASN 27 24.015 -7.820 -2.792 18 HB3 ASN 27 2HB ASN 27 22.559 -7.255 -1.986 19 HD21 ASN 27 1HD2 ASN 27 22.281 -9.996 0.142 20 HD22 ASN 27 2HD2 ASN 27 21.521 -8.593 -0.526 21 H LYS 28 H LYS 28 20.461 -8.228 -5.532 22 HA LYS 28 HA LYS 28 21.287 -5.604 -6.413 23 HB2 LYS 28 1HB LYS 28 19.007 -7.353 -7.346 24 HB3 LYS 28 2HB LYS 28 19.561 -5.884 -8.138 25 HG2 LYS 28 1HG LYS 28 21.731 -6.937 -8.556 26 HG3 LYS 28 2HG LYS 28 21.153 -8.414 -7.781 27 HD2 LYS 28 1HD LYS 28 19.360 -8.557 -9.473 28 HD3 LYS 28 2HD LYS 28 20.033 -7.134 -10.271 29 HE2 LYS 28 1HE LYS 28 22.140 -8.338 -10.620 30 HE3 LYS 28 2HE LYS 28 21.449 -9.762 -9.844 31 HZ1 LYS 28 1HZ LYS 28 21.330 -9.957 -12.229 32 HZ2 LYS 28 2HZ LYS 28 20.482 -8.499 -12.351 33 HZ3 LYS 28 3HZ LYS 28 19.770 -9.833 -11.596 34 H GLU 29 H GLU 29 20.782 -4.071 -5.001 35 HA GLU 29 HA GLU 29 18.609 -3.948 -3.272 36 HB2 GLU 29 1HB GLU 29 20.626 -2.529 -3.108 37 HB3 GLU 29 2HB GLU 29 20.118 -1.654 -4.545 38 HG2 GLU 29 1HG GLU 29 19.550 -0.313 -2.693 39 HG3 GLU 29 2HG GLU 29 18.044 -1.004 -3.299 40 H LYS 30 H LYS 30 18.971 -2.679 -6.556 41 HA LYS 30 HA LYS 30 16.494 -1.313 -6.603 42 HB2 LYS 30 1HB LYS 30 18.239 -2.335 -8.839 43 HB3 LYS 30 2HB LYS 30 16.819 -1.331 -9.085 44 HG2 LYS 30 1HG LYS 30 17.846 0.449 -7.767 45 HG3 LYS 30 2HG LYS 30 19.273 -0.560 -7.523 46 HD2 LYS 30 1HD LYS 30 19.645 -0.611 -9.940 47 HD3 LYS 30 2HD LYS 30 18.219 0.398 -10.181 48 HE2 LYS 30 1HE LYS 30 19.251 2.205 -8.942 49 HE3 LYS 30 2HE LYS 30 20.655 1.196 -8.595 50 HZ1 LYS 30 1HZ LYS 30 19.778 2.078 -11.292 51 HZ2 LYS 30 2HZ LYS 30 21.118 1.098 -10.963 52 HZ3 LYS 30 3HZ LYS 30 21.090 2.698 -10.423 53 H ALA 31 H ALA 31 17.470 -4.511 -7.789 54 HA ALA 31 HA ALA 31 15.085 -5.117 -9.122 55 HB1 ALA 31 1HB ALA 31 15.864 -7.394 -9.170 56 HB2 ALA 31 2HB ALA 31 17.000 -7.071 -7.862 57 HB3 ALA 31 3HB ALA 31 17.228 -6.309 -9.435 58 H ASP 32 H ASP 32 16.120 -5.894 -5.808 59 HA ASP 32 HA ASP 32 13.750 -7.344 -5.211 60 HB2 ASP 32 1HB ASP 32 15.956 -6.244 -3.500 61 HB3 ASP 32 2HB ASP 32 14.536 -7.015 -2.793 62 H ARG 33 H ARG 33 14.724 -3.981 -4.641 63 HA ARG 33 HA ARG 33 12.415 -3.392 -3.104 64 HB2 ARG 33 1HB ARG 33 13.000 -1.091 -3.230 65 HB3 ARG 33 2HB ARG 33 14.484 -2.006 -3.041 66 HG2 ARG 33 1HG ARG 33 14.930 -1.757 -5.429 67 HG3 ARG 33 2HG ARG 33 13.445 -0.818 -5.603 68 HD2 ARG 33 1HD ARG 33 14.355 0.787 -3.926 69 HD3 ARG 33 2HD ARG 33 15.871 -0.112 -3.963 70 HE ARG 33 HE ARG 33 14.944 0.782 -6.542 71 HH11 ARG 33 1HH1 ARG 33 16.859 1.581 -3.722 72 HH12 ARG 33 2HH1 ARG 33 17.833 2.745 -4.560 73 HH21 ARG 33 1HH2 ARG 33 16.205 2.315 -7.644 74 HH22 ARG 33 2HH2 ARG 33 17.462 3.168 -6.802 75 H GLN 34 H GLN 34 13.108 -3.289 -6.559 76 HA GLN 34 HA GLN 34 10.784 -1.979 -7.404 77 HB2 GLN 34 1HB GLN 34 12.448 -4.107 -8.734 78 HB3 GLN 34 2HB GLN 34 11.059 -3.373 -9.521 79 HG2 GLN 34 1HG GLN 34 13.545 -1.962 -8.584 80 HG3 GLN 34 2HG GLN 34 13.088 -2.304 -10.251 81 HE21 GLN 34 1HE2 GLN 34 10.855 0.367 -10.532 82 HE22 GLN 34 2HE2 GLN 34 11.392 -1.141 -11.188 83 H LYS 35 H LYS 35 11.273 -5.318 -6.396 84 HA LYS 35 HA LYS 35 8.730 -6.330 -7.106 85 HB2 LYS 35 1HB LYS 35 10.376 -7.044 -4.667 86 HB3 LYS 35 2HB LYS 35 9.086 -8.010 -5.365 87 HG2 LYS 35 1HG LYS 35 10.435 -8.318 -7.392 88 HG3 LYS 35 2HG LYS 35 11.738 -7.386 -6.650 89 HD2 LYS 35 1HD LYS 35 11.839 -9.034 -4.819 90 HD3 LYS 35 2HD LYS 35 10.580 -9.976 -5.617 91 HE2 LYS 35 1HE LYS 35 12.681 -10.973 -6.144 92 HE3 LYS 35 2HE LYS 35 12.082 -10.172 -7.596 93 HZ1 LYS 35 1HZ LYS 35 13.534 -8.271 -7.020 94 HZ2 LYS 35 2HZ LYS 35 14.386 -9.693 -7.357 95 HZ3 LYS 35 3HZ LYS 35 14.194 -9.188 -5.751 96 H VAL 36 H VAL 36 9.937 -4.712 -4.229 97 HA VAL 36 HA VAL 36 7.567 -4.633 -2.746 98 HB VAL 36 HB VAL 36 10.002 -2.857 -2.803 99 HG11 VAL 36 1HG1 VAL 36 9.057 -2.030 -0.547 100 HG12 VAL 36 2HG1 VAL 36 7.494 -2.513 -1.212 101 HG13 VAL 36 3HG1 VAL 36 8.476 -1.302 -2.043 102 HG21 VAL 36 1HG2 VAL 36 10.436 -3.891 -0.618 103 HG22 VAL 36 2HG2 VAL 36 10.317 -5.089 -1.905 104 HG23 VAL 36 3HG2 VAL 36 8.970 -4.857 -0.792 105 H VAL 37 H VAL 37 8.930 -2.348 -5.089 106 HA VAL 37 HA VAL 37 6.939 -0.387 -4.940 107 HB VAL 37 HB VAL 37 8.590 -1.150 -7.356 108 HG11 VAL 37 1HG1 VAL 37 7.145 1.419 -6.711 109 HG12 VAL 37 2HG1 VAL 37 6.684 0.252 -7.949 110 HG13 VAL 37 3HG1 VAL 37 8.194 1.149 -8.102 111 HG21 VAL 37 1HG2 VAL 37 10.110 0.624 -6.635 112 HG22 VAL 37 2HG2 VAL 37 9.977 -0.638 -5.411 113 HG23 VAL 37 3HG2 VAL 37 9.125 0.890 -5.198 114 H SER 38 H SER 38 7.111 -3.351 -6.857 115 HA SER 38 HA SER 38 4.889 -2.890 -8.500 116 HB2 SER 38 1HB SER 38 6.501 -4.709 -8.901 117 HB3 SER 38 2HB SER 38 5.940 -5.532 -7.447 118 HG SER 38 HG SER 38 4.390 -4.955 -9.761 119 H ASP 39 H ASP 39 5.096 -4.527 -5.331 120 HA ASP 39 HA ASP 39 2.295 -4.963 -5.150 121 HB2 ASP 39 1HB ASP 39 4.393 -4.838 -2.977 122 HB3 ASP 39 2HB ASP 39 2.728 -5.348 -2.722 123 H LEU 40 H LEU 40 4.456 -2.423 -4.231 124 HA LEU 40 HA LEU 40 2.835 -0.910 -2.535 125 HB2 LEU 40 1HB LEU 40 5.307 -0.720 -2.969 126 HB3 LEU 40 2HB LEU 40 4.918 0.106 -4.461 127 HG LEU 40 HG LEU 40 3.720 1.832 -3.045 128 HD11 LEU 40 1HD1 LEU 40 5.242 0.415 -0.857 129 HD12 LEU 40 2HD1 LEU 40 3.487 0.512 -1.013 130 HD13 LEU 40 3HD1 LEU 40 4.426 1.972 -0.701 131 HD21 LEU 40 1HD2 LEU 40 5.827 2.953 -2.465 132 HD22 LEU 40 2HD2 LEU 40 5.876 2.232 -4.074 133 HD23 LEU 40 3HD2 LEU 40 6.690 1.438 -2.728 134 H VAL 41 H VAL 41 3.324 -0.651 -6.068 135 HA VAL 41 HA VAL 41 1.503 1.489 -6.394 136 HB VAL 41 HB VAL 41 1.514 1.023 -8.779 137 HG11 VAL 41 1HG1 VAL 41 3.399 2.229 -7.831 138 HG12 VAL 41 2HG1 VAL 41 3.914 1.236 -9.195 139 HG13 VAL 41 3HG1 VAL 41 4.245 0.707 -7.546 140 HG21 VAL 41 1HG2 VAL 41 3.032 -1.489 -8.090 141 HG22 VAL 41 2HG2 VAL 41 2.772 -0.860 -9.717 142 HG23 VAL 41 3HG2 VAL 41 1.400 -1.403 -8.751 143 H ALA 42 H ALA 42 1.109 -2.021 -6.453 144 HA ALA 42 HA ALA 42 -1.588 -2.101 -7.237 145 HB1 ALA 42 1HB ALA 42 -1.661 -4.287 -6.083 146 HB2 ALA 42 2HB ALA 42 -0.076 -3.947 -5.390 147 HB3 ALA 42 3HB ALA 42 -0.256 -4.120 -7.136 148 H LEU 43 H LEU 43 -0.085 -1.744 -4.050 149 HA LEU 43 HA LEU 43 -2.420 -1.673 -2.494 150 HB2 LEU 43 1HB LEU 43 0.216 -0.246 -2.090 151 HB3 LEU 43 2HB LEU 43 -1.027 -0.400 -0.863 152 HG LEU 43 HG LEU 43 0.521 -2.686 -2.085 153 HD11 LEU 43 1HD1 LEU 43 1.520 -2.839 0.167 154 HD12 LEU 43 2HD1 LEU 43 0.688 -1.345 0.606 155 HD13 LEU 43 3HD1 LEU 43 1.917 -1.331 -0.658 156 HD21 LEU 43 1HD2 LEU 43 -1.498 -2.634 0.155 157 HD22 LEU 43 2HD2 LEU 43 -0.535 -4.030 -0.331 158 HD23 LEU 43 3HD2 LEU 43 -1.727 -3.354 -1.438 159 H GLU 44 H GLU 44 -0.540 0.937 -3.963 160 HA GLU 44 HA GLU 44 -2.115 3.079 -3.071 161 HB2 GLU 44 1HB GLU 44 0.230 3.113 -4.046 162 HB3 GLU 44 2HB GLU 44 -0.507 2.967 -5.628 163 HG2 GLU 44 1HG GLU 44 -1.229 5.208 -3.778 164 HG3 GLU 44 2HG GLU 44 0.199 5.285 -4.805 165 H GLY 45 H GLY 45 -2.289 1.087 -5.980 166 HA2 GLY 45 1HA GLY 45 -4.351 2.487 -7.293 167 HA3 GLY 45 2HA GLY 45 -3.954 0.792 -7.528 168 H ALA 46 H ALA 46 -4.487 -0.307 -5.086 169 HA ALA 46 HA ALA 46 -7.285 -0.620 -5.159 170 HB1 ALA 46 1HB ALA 46 -5.416 -1.349 -2.913 171 HB2 ALA 46 2HB ALA 46 -5.705 -2.329 -4.350 172 HB3 ALA 46 3HB ALA 46 -7.018 -2.021 -3.215 173 H LEU 47 H LEU 47 -5.187 1.324 -3.111 174 HA LEU 47 HA LEU 47 -7.039 2.175 -1.211 175 HB2 LEU 47 1HB LEU 47 -4.474 3.181 -2.285 176 HB3 LEU 47 2HB LEU 47 -5.479 4.368 -1.479 177 HG LEU 47 HG LEU 47 -5.365 3.204 0.593 178 HD11 LEU 47 1HD1 LEU 47 -4.050 0.944 -0.904 179 HD12 LEU 47 2HD1 LEU 47 -5.652 0.929 -0.167 180 HD13 LEU 47 3HD1 LEU 47 -4.216 1.045 0.849 181 HD21 LEU 47 1HD2 LEU 47 -2.949 3.093 0.996 182 HD22 LEU 47 2HD2 LEU 47 -3.400 4.520 0.064 183 HD23 LEU 47 3HD2 LEU 47 -2.667 3.134 -0.743 184 H ASP 48 H ASP 48 -6.266 3.563 -4.386 185 HA ASP 48 HA ASP 48 -8.176 5.659 -4.222 186 HB2 ASP 48 1HB ASP 48 -6.404 5.858 -5.823 187 HB3 ASP 48 2HB ASP 48 -6.850 4.338 -6.591 188 H MET 49 H MET 49 -8.315 2.341 -5.397 189 HA MET 49 HA MET 49 -10.802 2.454 -6.671 190 HB2 MET 49 1HB MET 49 -9.532 0.132 -5.212 191 HB3 MET 49 2HB MET 49 -10.927 0.005 -6.272 192 HG2 MET 49 1HG MET 49 -8.133 0.800 -7.036 193 HG3 MET 49 2HG MET 49 -8.975 -0.689 -7.457 194 HE1 MET 49 1HE MET 49 -8.752 0.988 -10.936 195 HE2 MET 49 2HE MET 49 -8.529 -0.493 -10.008 196 HE3 MET 49 3HE MET 49 -7.530 0.918 -9.666 197 H TYR 50 H TYR 50 -9.977 1.715 -3.304 198 HA TYR 50 HA TYR 50 -12.650 1.279 -2.488 199 HB2 TYR 50 1HB TYR 50 -10.718 0.463 -1.188 200 HB3 TYR 50 2HB TYR 50 -10.290 2.126 -0.794 201 HD1 TYR 50 HD1 TYR 50 -13.224 -0.182 -0.578 202 HD2 TYR 50 HD2 TYR 50 -11.025 2.977 1.230 203 HE1 TYR 50 HE1 TYR 50 -14.722 -0.260 1.369 204 HE2 TYR 50 HE2 TYR 50 -12.517 2.907 3.179 205 HH TYR 50 HH TYR 50 -14.917 0.394 3.573 206 H LYS 51 H LYS 51 -10.606 4.164 -2.597 207 HA LYS 51 HA LYS 51 -12.404 5.864 -1.230 208 HB2 LYS 51 1HB LYS 51 -10.049 6.479 -1.631 209 HB3 LYS 51 2HB LYS 51 -10.381 6.600 -3.356 210 HG2 LYS 51 1HG LYS 51 -11.983 8.399 -2.912 211 HG3 LYS 51 2HG LYS 51 -11.619 8.290 -1.191 212 HD2 LYS 51 1HD LYS 51 -9.291 8.890 -1.655 213 HD3 LYS 51 2HD LYS 51 -9.669 9.004 -3.376 214 HE2 LYS 51 1HE LYS 51 -11.243 10.795 -2.937 215 HE3 LYS 51 2HE LYS 51 -10.946 10.656 -1.205 216 HZ1 LYS 51 1HZ LYS 51 -8.905 11.405 -3.225 217 HZ2 LYS 51 2HZ LYS 51 -8.683 11.350 -1.550 218 HZ3 LYS 51 3HZ LYS 51 -9.726 12.493 -2.225 219 H LEU 52 H LEU 52 -12.112 4.905 -4.604 220 HA LEU 52 HA LEU 52 -14.117 6.644 -5.602 221 HB2 LEU 52 1HB LEU 52 -12.518 5.561 -7.078 222 HB3 LEU 52 2HB LEU 52 -13.116 3.980 -6.615 223 HG LEU 52 HG LEU 52 -15.296 4.526 -7.661 224 HD11 LEU 52 1HD1 LEU 52 -15.429 6.469 -9.161 225 HD12 LEU 52 2HD1 LEU 52 -13.867 7.023 -8.558 226 HD13 LEU 52 3HD1 LEU 52 -15.251 6.935 -7.469 227 HD21 LEU 52 1HD2 LEU 52 -14.534 4.330 -9.967 228 HD22 LEU 52 2HD2 LEU 52 -13.591 3.293 -8.896 229 HD23 LEU 52 3HD2 LEU 52 -12.909 4.812 -9.480 230 H ASP 53 H ASP 53 -14.160 3.465 -4.147 231 HA ASP 53 HA ASP 53 -16.881 2.896 -4.815 232 HB2 ASP 53 1HB ASP 53 -15.411 1.050 -4.543 233 HB3 ASP 53 2HB ASP 53 -14.898 1.602 -2.953 234 H ASN 54 H ASN 54 -15.256 3.908 -1.793 235 HA ASN 54 HA ASN 54 -17.943 4.448 -0.708 236 HB2 ASN 54 1HB ASN 54 -15.753 2.852 0.422 237 HB3 ASN 54 2HB ASN 54 -16.470 4.001 1.549 238 HD21 ASN 54 1HD2 ASN 54 -18.509 0.708 0.367 239 HD22 ASN 54 2HD2 ASN 54 -16.994 1.130 -0.351 240 H SER 55 H SER 55 -15.766 6.162 -1.972 241 HA SER 55 HA SER 55 -15.490 8.407 -1.948 242 HB2 SER 55 1HB SER 55 -17.092 8.408 0.610 243 HB3 SER 55 2HB SER 55 -16.743 9.804 -0.410 244 HG SER 55 HG SER 55 -17.796 7.989 -1.989 245 H ARG 56 H ARG 56 -14.317 6.465 0.600 246 HA ARG 56 HA ARG 56 -12.383 8.560 1.255 247 HB2 ARG 56 1HB ARG 56 -12.565 8.143 3.644 248 HB3 ARG 56 2HB ARG 56 -14.114 8.640 2.989 249 HG2 ARG 56 1HG ARG 56 -14.829 6.937 4.312 250 HG3 ARG 56 2HG ARG 56 -14.462 6.003 2.860 251 HD2 ARG 56 1HD ARG 56 -12.455 5.203 3.737 252 HD3 ARG 56 2HD ARG 56 -12.383 6.464 4.966 253 HE ARG 56 HE ARG 56 -14.642 5.048 5.566 254 HH11 ARG 56 1HH1 ARG 56 -11.263 4.263 5.139 255 HH12 ARG 56 2HH1 ARG 56 -11.295 2.960 6.289 256 HH21 ARG 56 1HH2 ARG 56 -14.666 3.364 7.126 257 HH22 ARG 56 2HH2 ARG 56 -13.220 2.453 7.417 258 H TYR 57 H TYR 57 -10.428 7.776 2.274 259 HA TYR 57 HA TYR 57 -9.431 5.477 0.918 260 HB2 TYR 57 1HB TYR 57 -8.258 7.403 2.903 261 HB3 TYR 57 2HB TYR 57 -7.365 5.976 2.392 262 HD1 TYR 57 HD1 TYR 57 -8.159 9.362 1.635 263 HD2 TYR 57 HD2 TYR 57 -6.996 5.678 -0.140 264 HE1 TYR 57 HE1 TYR 57 -7.337 10.575 -0.335 265 HE2 TYR 57 HE2 TYR 57 -6.174 6.883 -2.118 266 HH TYR 57 HH TYR 57 -6.551 9.027 -3.247 267 HA PRO 58 HA PRO 58 -10.108 2.320 3.928 268 HB2 PRO 58 1HB PRO 58 -8.097 0.628 3.300 269 HB3 PRO 58 2HB PRO 58 -9.506 0.849 2.257 270 HG2 PRO 58 1HG PRO 58 -6.774 2.055 2.034 271 HG3 PRO 58 2HG PRO 58 -7.792 1.353 0.762 272 HD2 PRO 58 1HD PRO 58 -7.596 4.023 1.169 273 HD3 PRO 58 2HD PRO 58 -9.078 3.254 0.570 274 H THR 59 H THR 59 -9.401 1.631 5.923 275 HA THR 59 HA THR 59 -7.324 3.186 7.166 276 HB THR 59 HB THR 59 -7.961 1.874 9.216 277 HG1 THR 59 HG1 THR 59 -10.059 0.720 8.871 278 HG21 THR 59 1HG2 THR 59 -8.993 4.039 8.722 279 HG22 THR 59 2HG2 THR 59 -10.153 2.944 9.474 280 HG23 THR 59 3HG2 THR 59 -10.217 3.236 7.736 281 H THR 60 H THR 60 -5.941 1.807 8.848 282 HA THR 60 HA THR 60 -3.944 0.561 7.434 283 HB THR 60 HB THR 60 -3.576 1.394 9.674 284 HG1 THR 60 HG1 THR 60 -2.266 -0.383 8.866 285 HG21 THR 60 1HG2 THR 60 -5.716 0.815 10.689 286 HG22 THR 60 2HG2 THR 60 -4.377 0.197 11.659 287 HG23 THR 60 3HG2 THR 60 -5.297 -0.897 10.625 288 H GLU 61 H GLU 61 -6.769 -0.935 8.921 289 HA GLU 61 HA GLU 61 -5.918 -3.619 8.383 290 HB2 GLU 61 1HB GLU 61 -7.463 -2.987 10.237 291 HB3 GLU 61 2HB GLU 61 -8.677 -2.564 9.040 292 HG2 GLU 61 1HG GLU 61 -9.151 -4.734 9.942 293 HG3 GLU 61 2HG GLU 61 -8.678 -4.891 8.251 294 H GLN 62 H GLN 62 -8.163 -1.322 6.908 295 HA GLN 62 HA GLN 62 -9.208 -3.191 5.024 296 HB2 GLN 62 1HB GLN 62 -9.379 -0.176 5.019 297 HB3 GLN 62 2HB GLN 62 -10.375 -1.269 4.068 298 HG2 GLN 62 1HG GLN 62 -11.353 -2.172 6.103 299 HG3 GLN 62 2HG GLN 62 -10.325 -1.117 7.074 300 HE21 GLN 62 1HE2 GLN 62 -13.707 0.285 5.341 301 HE22 GLN 62 2HE2 GLN 62 -13.121 -1.311 5.041 302 H GLY 63 H GLY 63 -6.479 -1.042 5.008 303 HA2 GLY 63 1HA GLY 63 -6.421 -0.353 2.291 304 HA3 GLY 63 2HA GLY 63 -5.041 -0.328 3.372 305 H LEU 64 H LEU 64 -4.520 -2.922 3.916 306 HA LEU 64 HA LEU 64 -3.476 -3.852 1.429 307 HB2 LEU 64 1HB LEU 64 -3.291 -4.696 4.245 308 HB3 LEU 64 2HB LEU 64 -3.112 -5.980 3.063 309 HG LEU 64 HG LEU 64 -1.316 -4.581 1.968 310 HD11 LEU 64 1HD1 LEU 64 -0.246 -2.861 3.333 311 HD12 LEU 64 2HD1 LEU 64 -1.533 -3.011 4.532 312 HD13 LEU 64 3HD1 LEU 64 -1.903 -2.421 2.910 313 HD21 LEU 64 1HD2 LEU 64 -0.782 -6.495 3.353 314 HD22 LEU 64 2HD2 LEU 64 -0.874 -5.497 4.802 315 HD23 LEU 64 3HD2 LEU 64 0.391 -5.205 3.610 316 H GLN 65 H GLN 65 -6.268 -4.644 3.351 317 HA GLN 65 HA GLN 65 -6.784 -7.136 2.076 318 HB2 GLN 65 1HB GLN 65 -8.553 -5.367 3.759 319 HB3 GLN 65 2HB GLN 65 -9.025 -6.958 3.173 320 HG2 GLN 65 1HG GLN 65 -6.882 -6.258 5.148 321 HG3 GLN 65 2HG GLN 65 -8.294 -7.290 5.371 322 HE21 GLN 65 1HE2 GLN 65 -6.815 -10.151 3.997 323 HE22 GLN 65 2HE2 GLN 65 -8.293 -9.369 4.434 324 H ALA 66 H ALA 66 -7.453 -3.868 1.249 325 HA ALA 66 HA ALA 66 -9.848 -4.151 -0.161 326 HB1 ALA 66 1HB ALA 66 -9.289 -2.039 -1.226 327 HB2 ALA 66 2HB ALA 66 -7.619 -2.193 -0.680 328 HB3 ALA 66 3HB ALA 66 -8.919 -1.995 0.497 329 H LEU 67 H LEU 67 -6.616 -5.039 -1.076 330 HA LEU 67 HA LEU 67 -7.543 -5.499 -3.815 331 HB2 LEU 67 1HB LEU 67 -5.116 -5.943 -4.324 332 HB3 LEU 67 2HB LEU 67 -5.573 -4.286 -4.010 333 HG LEU 67 HG LEU 67 -4.288 -6.037 -1.912 334 HD11 LEU 67 1HD1 LEU 67 -2.161 -5.032 -2.552 335 HD12 LEU 67 2HD1 LEU 67 -2.948 -4.171 -3.877 336 HD13 LEU 67 3HD1 LEU 67 -2.845 -5.934 -3.903 337 HD21 LEU 67 1HD2 LEU 67 -4.385 -3.038 -2.251 338 HD22 LEU 67 2HD2 LEU 67 -3.674 -3.922 -0.902 339 HD23 LEU 67 3HD2 LEU 67 -5.416 -3.958 -1.160 340 H VAL 68 H VAL 68 -7.381 -7.124 -1.020 341 HA VAL 68 HA VAL 68 -6.641 -9.681 -2.283 342 HB VAL 68 HB VAL 68 -6.818 -8.939 0.637 343 HG11 VAL 68 1HG1 VAL 68 -5.974 -11.538 -0.642 344 HG12 VAL 68 2HG1 VAL 68 -7.432 -11.268 0.314 345 HG13 VAL 68 3HG1 VAL 68 -5.846 -11.156 1.076 346 HG21 VAL 68 1HG2 VAL 68 -4.884 -7.963 -0.473 347 HG22 VAL 68 2HG2 VAL 68 -4.407 -9.558 -1.051 348 HG23 VAL 68 3HG2 VAL 68 -4.408 -9.210 0.679 349 H SER 69 H SER 69 -8.852 -8.479 0.231 350 HA SER 69 HA SER 69 -11.105 -9.882 -0.915 351 HB2 SER 69 1HB SER 69 -10.039 -11.662 0.413 352 HB3 SER 69 2HB SER 69 -10.019 -10.610 1.825 353 HG SER 69 HG SER 69 -11.965 -11.236 2.229 354 H ALA 70 H ALA 70 -13.027 -8.924 -0.295 355 HA ALA 70 HA ALA 70 -12.918 -6.250 0.429 356 HB1 ALA 70 1HB ALA 70 -15.341 -6.344 0.607 357 HB2 ALA 70 2HB ALA 70 -15.282 -8.104 0.673 358 HB3 ALA 70 3HB ALA 70 -14.786 -7.259 -0.794 359 HA PRO 71 HA PRO 71 -12.143 -6.532 4.820 360 HB2 PRO 71 1HB PRO 71 -13.045 -3.704 4.652 361 HB3 PRO 71 2HB PRO 71 -11.574 -4.375 5.364 362 HG2 PRO 71 1HG PRO 71 -11.484 -3.088 3.040 363 HG3 PRO 71 2HG PRO 71 -10.499 -4.539 3.315 364 HD2 PRO 71 1HD PRO 71 -13.037 -4.235 1.766 365 HD3 PRO 71 2HD PRO 71 -11.603 -5.216 1.404 366 H SER 72 H SER 72 -13.400 -6.905 6.553 367 HA SER 72 HA SER 72 -16.275 -6.647 6.267 368 HB2 SER 72 1HB SER 72 -14.694 -7.737 8.609 369 HB3 SER 72 2HB SER 72 -16.408 -7.982 8.281 370 HG SER 72 HG SER 72 -14.190 -9.211 7.168 371 H ALA 73 H ALA 73 -13.727 -4.807 7.409 372 HA ALA 73 HA ALA 73 -15.001 -3.408 9.532 373 HB1 ALA 73 1HB ALA 73 -12.760 -2.515 7.715 374 HB2 ALA 73 2HB ALA 73 -12.568 -3.392 9.234 375 HB3 ALA 73 3HB ALA 73 -13.225 -1.753 9.236 376 H GLU 74 H GLU 74 -16.148 -1.525 9.505 377 HA GLU 74 HA GLU 74 -17.724 -1.081 7.155 378 HB2 GLU 74 1HB GLU 74 -18.723 -1.021 9.380 379 HB3 GLU 74 2HB GLU 74 -17.673 0.310 9.839 380 HG2 GLU 74 1HG GLU 74 -18.754 1.668 8.042 381 HG3 GLU 74 2HG GLU 74 -19.907 0.349 7.832 382 HA PRO 75 HA PRO 75 -18.776 0.116 5.965 383 HB2 PRO 75 1HB PRO 75 -18.178 1.264 3.385 384 HB3 PRO 75 2HB PRO 75 -19.493 1.665 4.490 385 HG2 PRO 75 1HG PRO 75 -17.430 3.359 3.917 386 HG3 PRO 75 2HG PRO 75 -18.337 3.395 5.440 387 HD2 PRO 75 1HD PRO 75 -15.668 2.171 4.849 388 HD3 PRO 75 2HD PRO 75 -16.192 3.100 6.269 389 H HIS 76 H HIS 76 -19.143 -1.656 4.681 390 HA HIS 76 HA HIS 76 -16.954 -3.314 4.016 391 HB2 HIS 76 1HB HIS 76 -19.113 -4.251 4.641 392 HB3 HIS 76 2HB HIS 76 -19.874 -3.501 3.246 393 HD1 HIS 76 HD1 HIS 76 -17.333 -6.201 4.062 394 HD2 HIS 76 HD2 HIS 76 -19.869 -5.025 0.986 395 HE1 HIS 76 HE1 HIS 76 -17.242 -8.050 2.365 396 HE2 HIS 76 HE2 HIS 76 -18.931 -7.402 0.611 397 H ALA 77 H ALA 77 -15.793 -3.487 2.220 398 HA ALA 77 HA ALA 77 -15.944 -1.575 0.164 399 HB1 ALA 77 1HB ALA 77 -14.204 -2.910 -0.939 400 HB2 ALA 77 2HB ALA 77 -14.476 -4.207 0.223 401 HB3 ALA 77 3HB ALA 77 -13.856 -2.649 0.770 402 H ARG 78 H ARG 78 -17.036 -1.496 -1.663 403 HA ARG 78 HA ARG 78 -18.486 -3.909 -2.547 404 HB2 ARG 78 1HB ARG 78 -19.146 -1.010 -3.099 405 HB3 ARG 78 2HB ARG 78 -20.097 -2.402 -3.596 406 HG2 ARG 78 1HG ARG 78 -19.572 -1.590 -0.747 407 HG3 ARG 78 2HG ARG 78 -21.044 -1.242 -1.655 408 HD2 ARG 78 1HD ARG 78 -21.456 -3.634 -1.912 409 HD3 ARG 78 2HD ARG 78 -19.971 -3.989 -1.030 410 HE ARG 78 HE ARG 78 -21.435 -2.386 0.639 411 HH11 ARG 78 1HH1 ARG 78 -21.922 -5.485 -0.915 412 HH12 ARG 78 2HH1 ARG 78 -22.977 -6.078 0.329 413 HH21 ARG 78 1HH2 ARG 78 -22.809 -3.155 2.267 414 HH22 ARG 78 2HH2 ARG 78 -23.492 -4.748 2.141 415 H ASN 79 H ASN 79 -18.836 -4.016 -4.919 416 HA ASN 79 HA ASN 79 -18.108 -4.080 -7.069 417 HB2 ASN 79 1HB ASN 79 -16.768 -1.449 -6.383 418 HB3 ASN 79 2HB ASN 79 -17.003 -2.083 -8.007 419 HD21 ASN 79 1HD2 ASN 79 -19.961 -0.122 -6.090 420 HD22 ASN 79 2HD2 ASN 79 -18.437 -0.456 -5.334 421 H TYR 80 H TYR 80 -16.595 -5.440 -5.088 422 HA TYR 80 HA TYR 80 -13.815 -4.960 -5.836 423 HB2 TYR 80 1HB TYR 80 -13.199 -6.367 -3.973 424 HB3 TYR 80 2HB TYR 80 -14.387 -5.193 -3.425 425 HD1 TYR 80 HD1 TYR 80 -13.614 -8.699 -3.850 426 HD2 TYR 80 HD2 TYR 80 -16.735 -5.937 -2.988 427 HE1 TYR 80 HE1 TYR 80 -14.964 -10.527 -2.916 428 HE2 TYR 80 HE2 TYR 80 -18.093 -7.761 -2.052 429 HH TYR 80 HH TYR 80 -16.789 -10.870 -1.392 430 HA PRO 81 HA PRO 81 -13.833 -8.331 -8.709 431 HB2 PRO 81 1HB PRO 81 -11.133 -8.701 -8.847 432 HB3 PRO 81 2HB PRO 81 -11.977 -7.386 -9.671 433 HG2 PRO 81 1HG PRO 81 -10.444 -7.345 -7.108 434 HG3 PRO 81 2HG PRO 81 -10.488 -6.143 -8.410 435 HD2 PRO 81 1HD PRO 81 -11.874 -5.862 -6.095 436 HD3 PRO 81 2HD PRO 81 -12.432 -5.195 -7.640 437 H GLU 82 H GLU 82 -13.808 -10.531 -8.609 438 HA GLU 82 HA GLU 82 -13.642 -11.807 -6.104 439 HB2 GLU 82 1HB GLU 82 -13.437 -13.166 -8.798 440 HB3 GLU 82 2HB GLU 82 -13.958 -13.888 -7.286 441 HG2 GLU 82 1HG GLU 82 -15.960 -13.566 -8.339 442 HG3 GLU 82 2HG GLU 82 -15.836 -12.083 -7.395 443 H GLY 83 H GLY 83 -11.944 -12.528 -5.007 444 HA2 GLY 83 1HA GLY 83 -9.837 -13.421 -4.604 445 HA3 GLY 83 2HA GLY 83 -9.551 -13.456 -6.339 446 H GLY 84 H GLY 84 -10.666 -10.462 -5.789 447 HA2 GLY 84 1HA GLY 84 -9.732 -8.387 -5.459 448 HA3 GLY 84 2HA GLY 84 -8.418 -9.171 -4.596 449 H TYR 85 H TYR 85 -7.043 -7.620 -5.647 450 HA TYR 85 HA TYR 85 -6.521 -8.114 -8.478 451 HB2 TYR 85 1HB TYR 85 -5.218 -6.186 -6.537 452 HB3 TYR 85 2HB TYR 85 -4.857 -6.293 -8.256 453 HD1 TYR 85 HD1 TYR 85 -6.802 -5.853 -9.891 454 HD2 TYR 85 HD2 TYR 85 -6.907 -4.765 -5.779 455 HE1 TYR 85 HE1 TYR 85 -8.582 -4.227 -10.371 456 HE2 TYR 85 HE2 TYR 85 -8.691 -3.140 -6.248 457 HH TYR 85 HH TYR 85 -10.397 -3.075 -9.182 458 H ILE 86 H ILE 86 -5.422 -8.883 -5.324 459 HA ILE 86 HA ILE 86 -3.478 -10.727 -6.495 460 HB ILE 86 HB ILE 86 -2.162 -8.835 -5.660 461 HG12 ILE 86 1HG1 ILE 86 -1.908 -11.238 -3.840 462 HG13 ILE 86 2HG1 ILE 86 -1.272 -11.138 -5.477 463 HG21 ILE 86 1HG2 ILE 86 -3.441 -9.395 -2.991 464 HG22 ILE 86 2HG2 ILE 86 -3.694 -7.967 -3.996 465 HG23 ILE 86 3HG2 ILE 86 -2.112 -8.272 -3.279 466 HD11 ILE 86 1HD1 ILE 86 0.211 -9.338 -4.809 467 HD12 ILE 86 2HD1 ILE 86 0.458 -10.767 -3.809 468 HD13 ILE 86 3HD1 ILE 86 -0.444 -9.393 -3.171 469 H ARG 87 H ARG 87 -3.665 -12.739 -5.676 470 HA ARG 87 HA ARG 87 -6.097 -13.275 -4.326 471 HB2 ARG 87 1HB ARG 87 -5.088 -14.714 -6.091 472 HB3 ARG 87 2HB ARG 87 -3.859 -15.207 -4.933 473 HG2 ARG 87 1HG ARG 87 -5.538 -16.203 -3.515 474 HG3 ARG 87 2HG ARG 87 -6.819 -15.626 -4.584 475 HD2 ARG 87 1HD ARG 87 -5.839 -16.985 -6.409 476 HD3 ARG 87 2HD ARG 87 -4.668 -17.628 -5.257 477 HE ARG 87 HE ARG 87 -6.882 -18.280 -4.011 478 HH11 ARG 87 1HH1 ARG 87 -6.184 -18.492 -7.436 479 HH12 ARG 87 2HH1 ARG 87 -7.278 -19.813 -7.700 480 HH21 ARG 87 1HH2 ARG 87 -8.331 -20.000 -4.366 481 HH22 ARG 87 2HH2 ARG 87 -8.497 -20.672 -5.962 482 H ARG 88 H ARG 88 -2.842 -12.921 -3.217 483 HA ARG 88 HA ARG 88 -3.769 -13.588 -0.512 484 HB2 ARG 88 1HB ARG 88 -1.098 -14.332 -1.716 485 HB3 ARG 88 2HB ARG 88 -1.477 -14.448 -0.006 486 HG2 ARG 88 1HG ARG 88 -3.341 -16.011 -0.625 487 HG3 ARG 88 2HG ARG 88 -2.693 -16.015 -2.266 488 HD2 ARG 88 1HD ARG 88 -1.864 -17.931 -1.015 489 HD3 ARG 88 2HD ARG 88 -0.546 -16.825 -1.406 490 HE ARG 88 HE ARG 88 -1.797 -16.546 1.211 491 HH11 ARG 88 1HH1 ARG 88 0.894 -17.743 -0.674 492 HH12 ARG 88 2HH1 ARG 88 1.963 -17.860 0.688 493 HH21 ARG 88 1HH2 ARG 88 -0.396 -16.691 3.010 494 HH22 ARG 88 2HH2 ARG 88 1.229 -17.252 2.784 495 H LEU 89 H LEU 89 -2.147 -12.676 1.148 496 HA LEU 89 HA LEU 89 -2.073 -9.897 0.894 497 HB2 LEU 89 1HB LEU 89 -0.817 -11.848 2.774 498 HB3 LEU 89 2HB LEU 89 -0.281 -10.185 2.811 499 HG LEU 89 HG LEU 89 -1.990 -10.670 4.515 500 HD11 LEU 89 1HD1 LEU 89 -2.882 -8.755 2.369 501 HD12 LEU 89 2HD1 LEU 89 -1.716 -8.416 3.648 502 HD13 LEU 89 3HD1 LEU 89 -3.401 -8.743 4.053 503 HD21 LEU 89 1HD2 LEU 89 -4.318 -11.019 3.840 504 HD22 LEU 89 2HD2 LEU 89 -3.285 -12.351 3.322 505 HD23 LEU 89 3HD2 LEU 89 -3.809 -11.139 2.155 506 HA PRO 90 HA PRO 90 1.697 -9.347 -1.480 507 HB2 PRO 90 1HB PRO 90 1.849 -6.644 -1.110 508 HB3 PRO 90 2HB PRO 90 0.807 -7.396 -2.321 509 HG2 PRO 90 1HG PRO 90 0.115 -6.342 0.385 510 HG3 PRO 90 2HG PRO 90 -0.792 -6.215 -1.132 511 HD2 PRO 90 1HD PRO 90 -1.417 -7.998 0.814 512 HD3 PRO 90 2HD PRO 90 -1.699 -8.320 -0.909 513 H GLN 91 H GLN 91 3.696 -9.667 -0.688 514 HA GLN 91 HA GLN 91 4.344 -8.552 1.952 515 HB2 GLN 91 1HB GLN 91 4.848 -11.400 1.068 516 HB3 GLN 91 2HB GLN 91 5.404 -10.691 2.578 517 HG2 GLN 91 1HG GLN 91 3.051 -10.326 3.233 518 HG3 GLN 91 2HG GLN 91 2.545 -11.132 1.750 519 HE21 GLN 91 1HE2 GLN 91 3.845 -13.250 4.947 520 HE22 GLN 91 2HE2 GLN 91 3.972 -11.529 4.882 521 H ASP 92 H ASP 92 6.444 -7.988 2.277 522 HA ASP 92 HA ASP 92 8.133 -7.319 0.166 523 HB2 ASP 92 1HB ASP 92 9.050 -8.028 2.963 524 HB3 ASP 92 2HB ASP 92 9.859 -6.970 1.821 525 HA PRO 93 HA PRO 93 9.846 -11.108 -1.288 526 HB2 PRO 93 1HB PRO 93 12.446 -9.671 -1.370 527 HB3 PRO 93 2HB PRO 93 11.586 -10.518 -2.661 528 HG2 PRO 93 1HG PRO 93 11.648 -7.854 -2.574 529 HG3 PRO 93 2HG PRO 93 10.189 -8.722 -3.089 530 HD2 PRO 93 1HD PRO 93 10.774 -7.366 -0.496 531 HD3 PRO 93 2HD PRO 93 9.250 -7.473 -1.399 532 H TRP 94 H TRP 94 11.372 -9.427 1.348 533 HA TRP 94 HA TRP 94 13.109 -11.618 2.039 534 HB2 TRP 94 1HB TRP 94 12.480 -9.070 3.540 535 HB3 TRP 94 2HB TRP 94 13.782 -10.197 3.919 536 HD1 TRP 94 HD1 TRP 94 15.868 -10.282 2.208 537 HE1 TRP 94 HE1 TRP 94 16.749 -8.561 0.508 538 HE3 TRP 94 HE3 TRP 94 11.776 -7.241 1.950 539 HZ2 TRP 94 HZ2 TRP 94 15.821 -6.222 -0.772 540 HZ3 TRP 94 HZ3 TRP 94 11.850 -5.281 0.465 541 HH2 TRP 94 HH2 TRP 94 13.833 -4.783 -0.866 542 H GLY 95 H GLY 95 9.860 -11.080 2.458 543 HA2 GLY 95 1HA GLY 95 8.546 -12.803 3.487 544 HA3 GLY 95 2HA GLY 95 9.823 -13.024 4.672 545 H SER 96 H SER 96 9.086 -9.777 3.981 546 HA SER 96 HA SER 96 7.813 -9.516 6.595 547 HB2 SER 96 1HB SER 96 8.911 -7.375 4.756 548 HB3 SER 96 2HB SER 96 8.312 -7.123 6.393 549 HG SER 96 HG SER 96 10.738 -7.535 5.834 550 H ASP 97 H ASP 97 6.031 -7.906 6.780 551 HA ASP 97 HA ASP 97 4.185 -8.134 4.497 552 HB2 ASP 97 1HB ASP 97 3.352 -9.335 6.399 553 HB3 ASP 97 2HB ASP 97 3.730 -7.999 7.480 554 H TYR 98 H TYR 98 3.499 -6.264 3.548 555 HA TYR 98 HA TYR 98 4.638 -3.772 4.297 556 HB2 TYR 98 1HB TYR 98 2.247 -4.180 2.498 557 HB3 TYR 98 2HB TYR 98 3.274 -2.762 2.572 558 HD1 TYR 98 HD1 TYR 98 5.747 -3.070 1.925 559 HD2 TYR 98 HD2 TYR 98 2.702 -5.865 0.952 560 HE1 TYR 98 HE1 TYR 98 7.160 -3.973 0.123 561 HE2 TYR 98 HE2 TYR 98 4.102 -6.777 -0.846 562 HH TYR 98 HH TYR 98 5.953 -6.065 -2.277 563 H GLN 99 H GLN 99 3.371 -1.809 4.786 564 HA GLN 99 HA GLN 99 1.006 -2.430 6.415 565 HB2 GLN 99 1HB GLN 99 3.045 -0.377 7.257 566 HB3 GLN 99 2HB GLN 99 1.680 -0.982 8.180 567 HG2 GLN 99 1HG GLN 99 3.258 -2.200 9.204 568 HG3 GLN 99 2HG GLN 99 3.059 -3.268 7.814 569 HE21 GLN 99 1HE2 GLN 99 6.226 -2.671 6.526 570 HE22 GLN 99 2HE2 GLN 99 4.699 -3.461 6.351 571 H LEU 100 H LEU 100 -0.622 -1.029 6.320 572 HA LEU 100 HA LEU 100 -0.238 1.498 4.857 573 HB2 LEU 100 1HB LEU 100 -1.872 -0.101 3.858 574 HB3 LEU 100 2HB LEU 100 -2.775 -0.092 5.355 575 HG LEU 100 HG LEU 100 -3.670 1.299 3.396 576 HD11 LEU 100 1HD1 LEU 100 -3.268 2.616 6.075 577 HD12 LEU 100 2HD1 LEU 100 -4.573 1.516 5.629 578 HD13 LEU 100 3HD1 LEU 100 -4.453 3.098 4.862 579 HD21 LEU 100 1HD2 LEU 100 -1.645 3.297 4.349 580 HD22 LEU 100 2HD2 LEU 100 -2.752 3.420 2.979 581 HD23 LEU 100 3HD2 LEU 100 -1.407 2.287 2.927 582 H LEU 101 H LEU 101 -0.294 3.283 6.151 583 HA LEU 101 HA LEU 101 -1.332 2.863 8.874 584 HB2 LEU 101 1HB LEU 101 1.161 3.418 8.371 585 HB3 LEU 101 2HB LEU 101 0.580 5.050 8.127 586 HG LEU 101 HG LEU 101 1.535 4.590 10.398 587 HD11 LEU 101 1HD1 LEU 101 -1.358 5.424 10.345 588 HD12 LEU 101 2HD1 LEU 101 0.029 6.469 10.039 589 HD13 LEU 101 3HD1 LEU 101 -0.204 5.759 11.636 590 HD21 LEU 101 1HD2 LEU 101 0.240 3.338 12.002 591 HD22 LEU 101 2HD2 LEU 101 0.643 2.305 10.629 592 HD23 LEU 101 3HD2 LEU 101 -0.980 2.977 10.782 593 H SER 102 H SER 102 -3.282 3.686 9.106 594 HA SER 102 HA SER 102 -3.868 6.329 7.977 595 HB2 SER 102 1HB SER 102 -6.262 5.706 8.613 596 HB3 SER 102 2HB SER 102 -5.536 4.759 7.315 597 HG SER 102 HG SER 102 -6.147 4.017 9.948 598 HA PRO 103 HA PRO 103 -4.181 8.183 8.216 599 HB2 PRO 103 1HB PRO 103 -3.265 10.505 9.609 600 HB3 PRO 103 2HB PRO 103 -4.878 10.200 8.970 601 HG2 PRO 103 1HG PRO 103 -4.269 10.405 11.652 602 HG3 PRO 103 2HG PRO 103 -5.693 9.577 11.002 603 HD2 PRO 103 1HD PRO 103 -3.088 8.429 11.926 604 HD3 PRO 103 2HD PRO 103 -4.740 7.812 12.157 605 H GLY 104 H GLY 104 -2.491 8.600 6.868 606 HA2 GLY 104 1HA GLY 104 0.018 7.512 7.659 607 HA3 GLY 104 2HA GLY 104 -0.374 8.187 6.088 608 H GLN 105 H GLN 105 2.080 8.472 7.420 609 HA GLN 105 HA GLN 105 2.236 11.131 8.502 610 HB2 GLN 105 1HB GLN 105 3.783 9.174 9.047 611 HB3 GLN 105 2HB GLN 105 4.529 9.453 7.481 612 HG2 GLN 105 1HG GLN 105 5.033 11.777 8.203 613 HG3 GLN 105 2HG GLN 105 4.426 11.359 9.804 614 HE21 GLN 105 1HE2 GLN 105 8.097 10.164 8.572 615 HE22 GLN 105 2HE2 GLN 105 6.977 10.939 7.506 616 H HIS 106 H HIS 106 1.991 9.821 5.409 617 HA HIS 106 HA HIS 106 3.062 12.296 4.217 618 HB2 HIS 106 1HB HIS 106 3.012 9.537 2.970 619 HB3 HIS 106 2HB HIS 106 3.569 11.005 2.176 620 HD1 HIS 106 HD1 HIS 106 5.810 12.063 3.137 621 HD2 HIS 106 HD2 HIS 106 4.883 8.262 4.530 622 HE1 HIS 106 HE1 HIS 106 7.935 11.176 4.138 623 HE2 HIS 106 HE2 HIS 106 7.402 8.796 4.759 624 H GLY 107 H GLY 107 0.349 11.751 5.189 625 HA2 GLY 107 1HA GLY 107 -1.297 13.087 3.666 626 HA3 GLY 107 2HA GLY 107 -1.190 11.629 2.691 627 H GLN 108 H GLN 108 -3.496 11.446 3.011 628 HA GLN 108 HA GLN 108 -4.723 11.035 5.498 629 HB2 GLN 108 1HB GLN 108 -6.033 11.400 3.483 630 HB3 GLN 108 2HB GLN 108 -5.409 9.921 2.769 631 HG2 GLN 108 1HG GLN 108 -7.644 9.546 3.533 632 HG3 GLN 108 2HG GLN 108 -6.532 8.628 4.543 633 HE21 GLN 108 1HE2 GLN 108 -7.303 10.319 7.491 634 HE22 GLN 108 2HE2 GLN 108 -6.208 9.258 6.673 635 H VAL 109 H VAL 109 -3.265 8.772 3.224 636 HA VAL 109 HA VAL 109 -2.851 6.890 5.425 637 HB VAL 109 HB VAL 109 -3.285 4.997 3.833 638 HG11 VAL 109 1HG1 VAL 109 -4.899 5.600 5.546 639 HG12 VAL 109 2HG1 VAL 109 -5.707 5.039 4.083 640 HG13 VAL 109 3HG1 VAL 109 -5.642 6.764 4.448 641 HG21 VAL 109 1HG2 VAL 109 -4.698 5.433 1.872 642 HG22 VAL 109 2HG2 VAL 109 -3.123 6.214 1.736 643 HG23 VAL 109 3HG2 VAL 109 -4.546 7.167 2.161 644 H ASP 110 H ASP 110 -1.001 5.528 5.115 645 HA ASP 110 HA ASP 110 0.817 6.414 2.983 646 HB2 ASP 110 1HB ASP 110 1.292 7.696 5.053 647 HB3 ASP 110 2HB ASP 110 1.554 6.181 5.909 648 H ILE 111 H ILE 111 1.913 4.800 2.041 649 HA ILE 111 HA ILE 111 1.781 2.140 3.301 650 HB ILE 111 HB ILE 111 2.226 1.311 0.906 651 HG12 ILE 111 1HG1 ILE 111 1.216 4.100 0.312 652 HG13 ILE 111 2HG1 ILE 111 2.796 3.448 -0.110 653 HG21 ILE 111 1HG2 ILE 111 -0.099 1.153 0.431 654 HG22 ILE 111 2HG2 ILE 111 -0.449 2.584 1.395 655 HG23 ILE 111 3HG2 ILE 111 0.091 1.100 2.185 656 HD11 ILE 111 1HD1 ILE 111 1.281 3.521 -2.022 657 HD12 ILE 111 2HD1 ILE 111 0.163 2.454 -1.174 658 HD13 ILE 111 3HD1 ILE 111 1.764 1.871 -1.628 659 H PHE 112 H PHE 112 3.616 1.129 3.789 660 HA PHE 112 HA PHE 112 6.083 1.799 2.419 661 HB2 PHE 112 1HB PHE 112 7.263 2.095 4.671 662 HB3 PHE 112 2HB PHE 112 6.297 3.441 4.087 663 HD1 PHE 112 HD1 PHE 112 4.068 3.877 5.102 664 HD2 PHE 112 HD2 PHE 112 6.772 1.017 6.716 665 HE1 PHE 112 HE1 PHE 112 2.848 3.937 7.233 666 HE2 PHE 112 HE2 PHE 112 5.549 1.066 8.852 667 HZ PHE 112 HZ PHE 112 3.587 2.527 9.113 668 H SER 113 H SER 113 7.889 0.377 3.115 669 HA SER 113 HA SER 113 6.815 -2.311 3.629 670 HB2 SER 113 1HB SER 113 8.841 -3.004 2.192 671 HB3 SER 113 2HB SER 113 7.473 -2.254 1.369 672 HG SER 113 HG SER 113 8.600 -0.451 1.067 673 H LEU 114 H LEU 114 7.871 -3.667 4.951 674 HA LEU 114 HA LEU 114 9.457 -2.567 7.036 675 HB2 LEU 114 1HB LEU 114 8.070 -4.988 6.446 676 HB3 LEU 114 2HB LEU 114 9.682 -5.391 6.968 677 HG LEU 114 HG LEU 114 9.360 -4.549 9.115 678 HD11 LEU 114 1HD1 LEU 114 7.408 -3.171 9.757 679 HD12 LEU 114 2HD1 LEU 114 6.979 -3.055 8.052 680 HD13 LEU 114 3HD1 LEU 114 8.498 -2.372 8.627 681 HD21 LEU 114 1HD2 LEU 114 8.068 -6.586 8.693 682 HD22 LEU 114 2HD2 LEU 114 6.662 -5.599 8.284 683 HD23 LEU 114 3HD2 LEU 114 7.317 -5.568 9.922 684 H GLY 115 H GLY 115 10.085 -4.435 4.161 685 HA2 GLY 115 1HA GLY 115 12.042 -4.786 3.022 686 HA3 GLY 115 2HA GLY 115 12.847 -3.723 4.167 687 HA PRO 116 HA PRO 116 14.502 -7.974 4.822 688 HB2 PRO 116 1HB PRO 116 17.021 -6.539 5.201 689 HB3 PRO 116 2HB PRO 116 16.620 -7.790 4.023 690 HG2 PRO 116 1HG PRO 116 17.030 -5.208 3.322 691 HG3 PRO 116 2HG PRO 116 15.908 -6.271 2.453 692 HD2 PRO 116 1HD PRO 116 15.323 -4.164 4.501 693 HD3 PRO 116 2HD PRO 116 14.443 -4.545 3.004 694 H ASP 117 H ASP 117 15.036 -4.966 6.534 695 HA ASP 117 HA ASP 117 16.023 -6.281 8.909 696 HB2 ASP 117 1HB ASP 117 15.924 -3.846 9.775 697 HB3 ASP 117 2HB ASP 117 17.089 -4.243 8.517 698 H GLY 118 H GLY 118 12.982 -5.389 7.689 699 HA2 GLY 118 1HA GLY 118 10.899 -5.725 8.613 700 HA3 GLY 118 2HA GLY 118 11.693 -6.396 10.027 701 H VAL 119 H VAL 119 12.830 -3.289 9.207 702 HA VAL 119 HA VAL 119 11.453 -2.242 11.569 703 HB VAL 119 HB VAL 119 13.776 -1.035 10.059 704 HG11 VAL 119 1HG1 VAL 119 14.064 0.332 12.080 705 HG12 VAL 119 2HG1 VAL 119 12.603 -0.381 12.762 706 HG13 VAL 119 3HG1 VAL 119 12.503 0.616 11.311 707 HG21 VAL 119 1HG2 VAL 119 13.770 -2.656 12.604 708 HG22 VAL 119 2HG2 VAL 119 15.173 -1.865 11.885 709 HG23 VAL 119 3HG2 VAL 119 14.376 -3.191 11.037 710 HA PRO 120 HA PRO 120 8.868 0.064 8.706 711 HB2 PRO 120 1HB PRO 120 7.090 0.914 10.553 712 HB3 PRO 120 2HB PRO 120 7.067 -0.725 9.895 713 HG2 PRO 120 1HG PRO 120 8.113 0.256 12.510 714 HG3 PRO 120 2HG PRO 120 7.246 -1.244 12.135 715 HD2 PRO 120 1HD PRO 120 9.972 -1.070 12.473 716 HD3 PRO 120 2HD PRO 120 9.159 -2.333 11.528 717 H GLU 121 H GLU 121 8.744 2.159 8.147 718 HA GLU 121 HA GLU 121 9.062 4.407 8.109 719 HB2 GLU 121 1HB GLU 121 9.245 4.206 11.120 720 HB3 GLU 121 2HB GLU 121 9.054 5.689 10.198 721 HG2 GLU 121 1HG GLU 121 6.875 5.011 9.458 722 HG3 GLU 121 2HG GLU 121 7.069 3.430 10.217 723 H SER 122 H SER 122 11.224 2.359 8.218 724 HA SER 122 HA SER 122 13.481 3.848 9.277 725 HB2 SER 122 1HB SER 122 14.550 1.635 8.150 726 HB3 SER 122 2HB SER 122 13.861 1.656 9.775 727 HG SER 122 HG SER 122 13.025 0.318 7.573 728 H ASN 123 H ASN 123 15.516 3.602 7.697 729 HA ASN 123 HA ASN 123 14.903 5.347 5.515 730 HB2 ASN 123 1HB ASN 123 17.491 4.024 6.349 731 HB3 ASN 123 2HB ASN 123 17.360 5.202 5.047 732 HD21 ASN 123 1HD2 ASN 123 17.209 7.979 7.134 733 HD22 ASN 123 2HD2 ASN 123 17.061 7.348 5.529 734 H ASP 124 H ASP 124 15.086 1.975 5.864 735 HA ASP 124 HA ASP 124 15.650 1.420 3.063 736 HB2 ASP 124 1HB ASP 124 15.486 -0.901 3.670 737 HB3 ASP 124 2HB ASP 124 16.360 -0.098 4.976 738 H ASP 125 H ASP 125 12.990 2.243 4.963 739 HA ASP 125 HA ASP 125 10.997 0.535 3.953 740 HB2 ASP 125 1HB ASP 125 10.993 3.134 5.428 741 HB3 ASP 125 2HB ASP 125 9.490 2.540 4.736 742 H ILE 126 H ILE 126 10.635 0.381 1.858 743 HA ILE 126 HA ILE 126 10.700 2.677 0.109 744 HB ILE 126 HB ILE 126 9.917 -0.197 -0.393 745 HG12 ILE 126 1HG1 ILE 126 12.297 0.128 0.094 746 HG13 ILE 126 2HG1 ILE 126 12.055 -0.332 -1.586 747 HG21 ILE 126 1HG2 ILE 126 9.781 0.267 -2.712 748 HG22 ILE 126 2HG2 ILE 126 10.383 1.912 -2.487 749 HG23 ILE 126 3HG2 ILE 126 8.783 1.470 -1.890 750 HD11 ILE 126 1HD1 ILE 126 12.308 2.027 -2.238 751 HD12 ILE 126 2HD1 ILE 126 13.736 1.381 -1.431 752 HD13 ILE 126 3HD1 ILE 126 12.628 2.436 -0.553 753 H GLY 127 H GLY 127 9.087 4.072 0.316 754 HA2 GLY 127 1HA GLY 127 6.340 3.010 0.475 755 HA3 GLY 127 2HA GLY 127 6.844 4.564 1.124 756 H ASN 128 H ASN 128 4.706 4.624 -0.478 757 HA ASN 128 HA ASN 128 5.302 4.841 -3.243 758 HB2 ASN 128 1HB ASN 128 3.092 5.876 -3.479 759 HB3 ASN 128 2HB ASN 128 3.014 4.437 -2.475 760 HD21 ASN 128 1HD2 ASN 128 1.099 7.376 -1.065 761 HD22 ASN 128 2HD2 ASN 128 1.218 6.737 -2.666 762 H TRP 129 H TRP 129 5.164 7.147 -0.601 763 HA TRP 129 HA TRP 129 5.630 9.461 -2.175 764 HB2 TRP 129 1HB TRP 129 4.755 9.348 0.220 765 HB3 TRP 129 2HB TRP 129 6.417 9.064 0.717 766 HD1 TRP 129 HD1 TRP 129 4.112 11.800 -0.613 767 HE1 TRP 129 HE1 TRP 129 5.254 14.084 -0.274 768 HE3 TRP 129 HE3 TRP 129 8.728 10.188 0.888 769 HZ2 TRP 129 HZ2 TRP 129 7.769 15.064 0.530 770 HZ3 TRP 129 HZ3 TRP 129 10.444 11.866 1.425 771 HH2 TRP 129 HH2 TRP 129 9.974 14.253 1.246 772 H THR 130 H THR 130 7.639 6.996 -0.795 773 HA THR 130 HA THR 130 10.120 8.371 -0.971 774 HB THR 130 HB THR 130 9.833 5.378 -1.024 775 HG1 THR 130 HG1 THR 130 9.226 7.192 1.057 776 HG21 THR 130 1HG2 THR 130 12.092 6.319 -1.162 777 HG22 THR 130 2HG2 THR 130 11.847 5.473 0.366 778 HG23 THR 130 3HG2 THR 130 11.804 7.235 0.318 779 H ILE 131 H ILE 131 8.363 6.163 -3.121 780 HA ILE 131 HA ILE 131 10.606 5.923 -4.895 781 HB ILE 131 HB ILE 131 9.087 4.035 -4.646 782 HG12 ILE 131 1HG1 ILE 131 8.706 3.549 -7.065 783 HG13 ILE 131 2HG1 ILE 131 9.105 5.225 -7.428 784 HG21 ILE 131 1HG2 ILE 131 7.003 5.239 -4.304 785 HG22 ILE 131 2HG2 ILE 131 6.846 4.051 -5.596 786 HG23 ILE 131 3HG2 ILE 131 7.018 5.761 -5.988 787 HD11 ILE 131 1HD1 ILE 131 11.349 4.890 -6.555 788 HD12 ILE 131 2HD1 ILE 131 10.986 3.732 -7.835 789 HD13 ILE 131 3HD1 ILE 131 10.951 3.221 -6.147 790 H GLY 132 H GLY 132 7.534 7.739 -4.966 791 HA2 GLY 132 1HA GLY 132 8.463 9.922 -6.294 792 HA3 GLY 132 2HA GLY 132 8.142 8.788 -7.591 793 H PHE 133 H PHE 133 5.955 8.348 -5.032 794 HA PHE 133 HA PHE 133 3.918 9.817 -6.525 795 HB2 PHE 133 1HB PHE 133 3.667 7.826 -4.261 796 HB3 PHE 133 2HB PHE 133 2.304 8.636 -5.024 797 HD1 PHE 133 HD1 PHE 133 1.760 8.159 -7.393 798 HD2 PHE 133 HD2 PHE 133 4.713 5.952 -5.270 799 HE1 PHE 133 HE1 PHE 133 1.643 6.378 -9.088 800 HE2 PHE 133 HE2 PHE 133 4.605 4.170 -6.963 801 HZ PHE 133 HZ PHE 133 3.069 4.382 -8.875 802 H HIS 134 H HIS 134 4.943 11.849 -5.808 803 HA HIS 134 HA HIS 134 4.652 12.497 -2.978 804 HB2 HIS 134 1HB HIS 134 5.760 14.141 -5.266 805 HB3 HIS 134 2HB HIS 134 5.755 14.632 -3.579 806 HD1 HIS 134 HD1 HIS 134 7.635 12.628 -6.038 807 HD2 HIS 134 HD2 HIS 134 7.538 13.140 -1.917 808 HE1 HIS 134 HE1 HIS 134 9.746 11.571 -5.173 809 HE2 HIS 134 HE2 HIS 134 9.568 11.730 -2.669 810 H HIS 135 H HIS 135 2.819 12.684 -5.779 811 HA HIS 135 HA HIS 135 1.399 15.104 -4.952 812 HB2 HIS 135 1HB HIS 135 1.102 13.418 -7.448 813 HB3 HIS 135 2HB HIS 135 0.231 14.910 -7.121 814 HD1 HIS 135 HD1 HIS 135 2.514 14.100 -9.385 815 HD2 HIS 135 HD2 HIS 135 2.783 16.766 -6.208 816 HE1 HIS 135 HE1 HIS 135 4.340 15.711 -10.007 817 HE2 HIS 135 HE2 HIS 135 4.614 17.186 -7.984 818 H HIS 136 H HIS 136 -0.921 15.102 -4.805 819 HA HIS 136 HA HIS 136 -2.058 12.475 -4.130 820 HB2 HIS 136 1HB HIS 136 -1.460 13.799 -2.086 821 HB3 HIS 136 2HB HIS 136 -2.575 15.051 -2.616 822 HD1 HIS 136 HD1 HIS 136 -2.485 11.589 -1.177 823 HD2 HIS 136 HD2 HIS 136 -5.270 14.513 -2.155 824 HE1 HIS 136 HE1 HIS 136 -4.649 10.827 -0.156 825 HE2 HIS 136 HE2 HIS 136 -6.236 12.748 -0.540 826 H HIS 137 H HIS 137 -2.528 13.067 -6.553 827 HA HIS 137 HA HIS 137 -5.254 14.190 -6.578 828 HB2 HIS 137 1HB HIS 137 -3.106 14.517 -8.678 829 HB3 HIS 137 2HB HIS 137 -4.804 14.861 -8.971 830 HD1 HIS 137 HD1 HIS 137 -1.842 16.585 -8.285 831 HD2 HIS 137 HD2 HIS 137 -5.699 16.819 -6.761 832 HE1 HIS 137 HE1 HIS 137 -2.037 18.889 -7.296 833 HE2 HIS 137 HE2 HIS 137 -4.411 19.042 -6.466 834 H HIS 138 H HIS 138 -4.223 11.441 -6.267 835 HA HIS 138 HA HIS 138 -4.593 10.123 -8.785 836 HB2 HIS 138 1HB HIS 138 -4.237 9.112 -5.975 837 HB3 HIS 138 2HB HIS 138 -4.577 8.027 -7.315 838 HD1 HIS 138 HD1 HIS 138 -2.613 7.217 -8.593 839 HD2 HIS 138 HD2 HIS 138 -1.740 10.622 -6.379 840 HE1 HIS 138 HE1 HIS 138 -0.151 7.593 -8.885 841 HE2 HIS 138 HE2 HIS 138 0.294 9.790 -7.743 842 H HIS 139 H HIS 139 -6.341 9.207 -9.603 843 HA HIS 139 HA HIS 139 -8.515 8.151 -8.205 844 HB2 HIS 139 1HB HIS 139 -8.778 10.746 -7.858 845 HB3 HIS 139 2HB HIS 139 -9.370 10.716 -9.515 846 HD1 HIS 139 HD1 HIS 139 -11.824 10.480 -9.671 847 HD2 HIS 139 HD2 HIS 139 -10.320 8.743 -6.210 848 HE1 HIS 139 HE1 HIS 139 -13.834 9.680 -8.390 849 HE2 HIS 139 HE2 HIS 139 -12.902 8.840 -6.205 850 H LYS 140 H LYS 140 -6.690 7.897 -10.529 851 HA LYS 140 HA LYS 140 -8.466 6.812 -12.434 852 HB2 LYS 140 1HB LYS 140 -7.912 8.280 -14.355 853 HB3 LYS 140 2HB LYS 140 -8.864 9.092 -13.129 854 HG2 LYS 140 1HG LYS 140 -5.879 9.385 -13.266 855 HG3 LYS 140 2HG LYS 140 -6.965 10.395 -14.217 856 HD2 LYS 140 1HD LYS 140 -8.057 11.151 -12.162 857 HD3 LYS 140 2HD LYS 140 -6.978 10.133 -11.210 858 HE2 LYS 140 1HE LYS 140 -6.174 12.399 -11.155 859 HE3 LYS 140 2HE LYS 140 -5.058 11.415 -12.100 860 HZ1 LYS 140 1HZ LYS 140 -5.951 12.299 -14.108 861 HZ2 LYS 140 2HZ LYS 140 -5.574 13.598 -13.098 862 HZ3 LYS 140 3HZ LYS 140 -7.181 13.111 -13.284 Start of MODEL 8 1 H1 MET 25 1H MET 25 25.906 -5.290 -1.041 2 H2 MET 25 2H MET 25 27.553 -5.033 -0.765 3 H3 MET 25 3H MET 25 26.814 -4.378 -2.142 4 HA MET 25 HA MET 25 26.152 -3.654 0.649 5 HB2 MET 25 1HB MET 25 27.293 -1.511 0.168 6 HB3 MET 25 2HB MET 25 28.388 -2.882 0.135 7 HG2 MET 25 1HG MET 25 28.358 -2.876 -2.293 8 HG3 MET 25 2HG MET 25 27.207 -1.543 -2.289 9 HE1 MET 25 1HE MET 25 30.366 -2.095 0.036 10 HE2 MET 25 2HE MET 25 31.590 -1.215 -0.876 11 HE3 MET 25 3HE MET 25 30.874 -2.678 -1.548 12 H GLY 26 H GLY 26 23.996 -4.283 -0.521 13 HA2 GLY 26 1HA GLY 26 21.927 -3.443 -1.078 14 HA3 GLY 26 2HA GLY 26 22.618 -1.829 -0.992 15 H ASN 27 H ASN 27 24.038 -4.230 -3.042 16 HA ASN 27 HA ASN 27 23.644 -2.526 -5.329 17 HB2 ASN 27 1HB ASN 27 24.958 -5.245 -5.125 18 HB3 ASN 27 2HB ASN 27 25.020 -4.181 -6.526 19 HD21 ASN 27 1HD2 ASN 27 27.508 -2.110 -5.257 20 HD22 ASN 27 2HD2 ASN 27 26.313 -2.368 -6.478 21 H LYS 28 H LYS 28 22.612 -5.757 -4.318 22 HA LYS 28 HA LYS 28 20.972 -6.072 -6.687 23 HB2 LYS 28 1HB LYS 28 20.378 -8.250 -5.754 24 HB3 LYS 28 2HB LYS 28 22.119 -8.024 -5.748 25 HG2 LYS 28 1HG LYS 28 22.097 -7.566 -3.380 26 HG3 LYS 28 2HG LYS 28 20.334 -7.638 -3.353 27 HD2 LYS 28 1HD LYS 28 20.428 -9.988 -4.058 28 HD3 LYS 28 2HD LYS 28 22.190 -9.909 -4.054 29 HE2 LYS 28 1HE LYS 28 22.203 -9.485 -1.674 30 HE3 LYS 28 2HE LYS 28 20.442 -9.425 -1.646 31 HZ1 LYS 28 1HZ LYS 28 22.056 -11.808 -2.378 32 HZ2 LYS 28 2HZ LYS 28 20.370 -11.739 -2.277 33 HZ3 LYS 28 3HZ LYS 28 21.309 -11.562 -0.882 34 H GLU 29 H GLU 29 20.677 -4.725 -3.618 35 HA GLU 29 HA GLU 29 18.054 -5.283 -2.874 36 HB2 GLU 29 1HB GLU 29 19.746 -4.173 -1.443 37 HB3 GLU 29 2HB GLU 29 19.590 -2.720 -2.421 38 HG2 GLU 29 1HG GLU 29 17.160 -2.683 -1.793 39 HG3 GLU 29 2HG GLU 29 17.518 -3.973 -0.642 40 H LYS 30 H LYS 30 19.318 -3.016 -5.220 41 HA LYS 30 HA LYS 30 17.100 -1.308 -5.383 42 HB2 LYS 30 1HB LYS 30 19.178 -1.991 -7.459 43 HB3 LYS 30 2HB LYS 30 17.998 -0.701 -7.632 44 HG2 LYS 30 1HG LYS 30 18.916 0.285 -5.511 45 HG3 LYS 30 2HG LYS 30 20.213 -0.906 -5.614 46 HD2 LYS 30 1HD LYS 30 19.542 1.128 -7.738 47 HD3 LYS 30 2HD LYS 30 20.849 1.277 -6.565 48 HE2 LYS 30 1HE LYS 30 21.894 -0.736 -7.469 49 HE3 LYS 30 2HE LYS 30 20.575 -0.908 -8.627 50 HZ1 LYS 30 1HZ LYS 30 22.557 0.143 -9.582 51 HZ2 LYS 30 2HZ LYS 30 22.405 1.425 -8.490 52 HZ3 LYS 30 3HZ LYS 30 21.205 1.152 -9.650 53 H ALA 31 H ALA 31 17.913 -4.202 -7.294 54 HA ALA 31 HA ALA 31 15.630 -4.095 -8.946 55 HB1 ALA 31 1HB ALA 31 17.578 -5.442 -9.511 56 HB2 ALA 31 2HB ALA 31 16.121 -6.435 -9.468 57 HB3 ALA 31 3HB ALA 31 17.267 -6.491 -8.130 58 H ASP 32 H ASP 32 16.234 -5.617 -5.821 59 HA ASP 32 HA ASP 32 13.771 -7.018 -5.709 60 HB2 ASP 32 1HB ASP 32 15.833 -6.309 -3.645 61 HB3 ASP 32 2HB ASP 32 14.320 -7.082 -3.186 62 H ARG 33 H ARG 33 14.782 -3.840 -4.509 63 HA ARG 33 HA ARG 33 12.372 -3.359 -3.107 64 HB2 ARG 33 1HB ARG 33 13.031 -1.049 -2.941 65 HB3 ARG 33 2HB ARG 33 14.415 -2.081 -2.634 66 HG2 ARG 33 1HG ARG 33 15.190 -1.658 -4.935 67 HG3 ARG 33 2HG ARG 33 13.842 -0.538 -5.150 68 HD2 ARG 33 1HD ARG 33 16.047 -0.310 -3.105 69 HD3 ARG 33 2HD ARG 33 15.884 0.657 -4.568 70 HE ARG 33 HE ARG 33 13.884 1.638 -3.598 71 HH11 ARG 33 1HH1 ARG 33 15.977 -0.126 -1.416 72 HH12 ARG 33 2HH1 ARG 33 15.434 0.720 -0.005 73 HH21 ARG 33 1HH2 ARG 33 13.183 2.777 -1.721 74 HH22 ARG 33 2HH2 ARG 33 13.869 2.371 -0.179 75 H GLN 34 H GLN 34 13.311 -2.839 -6.460 76 HA GLN 34 HA GLN 34 11.106 -1.321 -7.276 77 HB2 GLN 34 1HB GLN 34 12.614 -3.427 -8.823 78 HB3 GLN 34 2HB GLN 34 11.491 -2.272 -9.528 79 HG2 GLN 34 1HG GLN 34 14.118 -1.686 -8.195 80 HG3 GLN 34 2HG GLN 34 13.702 -1.491 -9.894 81 HE21 GLN 34 1HE2 GLN 34 13.569 1.738 -7.942 82 HE22 GLN 34 2HE2 GLN 34 14.718 0.445 -7.984 83 H LYS 35 H LYS 35 11.441 -4.778 -6.731 84 HA LYS 35 HA LYS 35 8.927 -5.614 -7.721 85 HB2 LYS 35 1HB LYS 35 10.422 -6.789 -5.367 86 HB3 LYS 35 2HB LYS 35 9.249 -7.606 -6.390 87 HG2 LYS 35 1HG LYS 35 10.750 -7.611 -8.239 88 HG3 LYS 35 2HG LYS 35 11.886 -6.557 -7.389 89 HD2 LYS 35 1HD LYS 35 12.165 -8.347 -5.679 90 HD3 LYS 35 2HD LYS 35 11.158 -9.397 -6.677 91 HE2 LYS 35 1HE LYS 35 12.748 -9.246 -8.495 92 HE3 LYS 35 2HE LYS 35 13.734 -8.112 -7.574 93 HZ1 LYS 35 1HZ LYS 35 14.172 -9.834 -5.951 94 HZ2 LYS 35 2HZ LYS 35 14.616 -10.367 -7.498 95 HZ3 LYS 35 3HZ LYS 35 13.183 -10.924 -6.795 96 H VAL 36 H VAL 36 10.022 -4.401 -4.622 97 HA VAL 36 HA VAL 36 7.652 -4.652 -3.161 98 HB VAL 36 HB VAL 36 9.948 -2.707 -2.960 99 HG11 VAL 36 1HG1 VAL 36 7.719 -3.032 -0.960 100 HG12 VAL 36 2HG1 VAL 36 7.880 -1.674 -2.074 101 HG13 VAL 36 3HG1 VAL 36 9.110 -1.950 -0.842 102 HG21 VAL 36 1HG2 VAL 36 10.486 -5.007 -2.437 103 HG22 VAL 36 2HG2 VAL 36 9.130 -5.093 -1.311 104 HG23 VAL 36 3HG2 VAL 36 10.497 -4.036 -0.965 105 H VAL 37 H VAL 37 8.907 -1.961 -5.102 106 HA VAL 37 HA VAL 37 6.808 -0.173 -4.677 107 HB VAL 37 HB VAL 37 8.440 -0.412 -7.211 108 HG11 VAL 37 1HG1 VAL 37 6.994 1.934 -5.983 109 HG12 VAL 37 2HG1 VAL 37 6.508 1.055 -7.431 110 HG13 VAL 37 3HG1 VAL 37 8.004 1.990 -7.428 111 HG21 VAL 37 1HG2 VAL 37 9.038 1.115 -4.679 112 HG22 VAL 37 2HG2 VAL 37 9.963 1.208 -6.178 113 HG23 VAL 37 3HG2 VAL 37 9.905 -0.303 -5.269 114 H SER 38 H SER 38 7.135 -2.806 -7.002 115 HA SER 38 HA SER 38 4.920 -2.169 -8.611 116 HB2 SER 38 1HB SER 38 6.693 -3.807 -9.222 117 HB3 SER 38 2HB SER 38 6.042 -4.920 -8.022 118 HG SER 38 HG SER 38 4.833 -5.565 -9.618 119 H ASP 39 H ASP 39 5.170 -4.332 -5.767 120 HA ASP 39 HA ASP 39 2.379 -4.912 -5.791 121 HB2 ASP 39 1HB ASP 39 4.412 -5.196 -3.579 122 HB3 ASP 39 2HB ASP 39 2.750 -5.761 -3.471 123 H LEU 40 H LEU 40 4.404 -2.527 -4.294 124 HA LEU 40 HA LEU 40 2.630 -1.469 -2.421 125 HB2 LEU 40 1HB LEU 40 5.114 -1.080 -2.696 126 HB3 LEU 40 2HB LEU 40 4.712 0.068 -3.954 127 HG LEU 40 HG LEU 40 3.550 1.472 -2.344 128 HD11 LEU 40 1HD1 LEU 40 2.683 -0.199 -0.834 129 HD12 LEU 40 2HD1 LEU 40 3.694 0.929 0.069 130 HD13 LEU 40 3HD1 LEU 40 4.318 -0.664 -0.356 131 HD21 LEU 40 1HD2 LEU 40 5.492 2.143 -1.018 132 HD22 LEU 40 2HD2 LEU 40 5.938 1.796 -2.688 133 HD23 LEU 40 3HD2 LEU 40 6.290 0.623 -1.419 134 H VAL 41 H VAL 41 3.219 -0.496 -5.813 135 HA VAL 41 HA VAL 41 1.252 1.514 -5.837 136 HB VAL 41 HB VAL 41 1.268 1.414 -8.267 137 HG11 VAL 41 1HG1 VAL 41 3.035 2.631 -7.146 138 HG12 VAL 41 2HG1 VAL 41 3.648 1.883 -8.621 139 HG13 VAL 41 3HG1 VAL 41 4.013 1.166 -7.052 140 HG21 VAL 41 1HG2 VAL 41 1.365 -0.984 -8.612 141 HG22 VAL 41 2HG2 VAL 41 3.000 -1.030 -7.954 142 HG23 VAL 41 3HG2 VAL 41 2.682 -0.183 -9.468 143 H ALA 42 H ALA 42 1.043 -1.978 -6.390 144 HA ALA 42 HA ALA 42 -1.654 -2.106 -7.173 145 HB1 ALA 42 1HB ALA 42 0.058 -4.026 -5.614 146 HB2 ALA 42 2HB ALA 42 -0.413 -4.110 -7.310 147 HB3 ALA 42 3HB ALA 42 -1.614 -4.388 -6.043 148 H LEU 43 H LEU 43 -0.188 -1.954 -3.946 149 HA LEU 43 HA LEU 43 -2.531 -2.163 -2.423 150 HB2 LEU 43 1HB LEU 43 0.172 -1.009 -1.986 151 HB3 LEU 43 2HB LEU 43 -1.096 -0.473 -0.903 152 HG LEU 43 HG LEU 43 -1.519 -2.795 -0.230 153 HD11 LEU 43 1HD1 LEU 43 -0.131 -4.596 -0.934 154 HD12 LEU 43 2HD1 LEU 43 0.890 -3.513 -1.881 155 HD13 LEU 43 3HD1 LEU 43 -0.777 -3.809 -2.375 156 HD21 LEU 43 1HD2 LEU 43 0.514 -3.101 1.054 157 HD22 LEU 43 2HD2 LEU 43 0.071 -1.394 0.999 158 HD23 LEU 43 3HD2 LEU 43 1.379 -1.998 -0.017 159 H GLU 44 H GLU 44 -0.860 0.660 -3.717 160 HA GLU 44 HA GLU 44 -2.618 2.615 -2.742 161 HB2 GLU 44 1HB GLU 44 -0.334 3.027 -3.609 162 HB3 GLU 44 2HB GLU 44 -0.914 2.692 -5.232 163 HG2 GLU 44 1HG GLU 44 -2.478 4.590 -5.022 164 HG3 GLU 44 2HG GLU 44 -1.771 4.949 -3.445 165 H GLY 45 H GLY 45 -2.606 0.729 -5.720 166 HA2 GLY 45 1HA GLY 45 -4.702 2.047 -7.054 167 HA3 GLY 45 2HA GLY 45 -4.219 0.377 -7.312 168 H ALA 46 H ALA 46 -4.720 -0.561 -4.676 169 HA ALA 46 HA ALA 46 -7.510 -1.063 -4.787 170 HB1 ALA 46 1HB ALA 46 -5.910 -2.642 -3.799 171 HB2 ALA 46 2HB ALA 46 -7.195 -2.223 -2.667 172 HB3 ALA 46 3HB ALA 46 -5.595 -1.501 -2.493 173 H LEU 47 H LEU 47 -5.486 1.108 -2.906 174 HA LEU 47 HA LEU 47 -7.443 2.186 -1.210 175 HB2 LEU 47 1HB LEU 47 -4.795 3.088 -2.241 176 HB3 LEU 47 2HB LEU 47 -5.818 4.277 -1.465 177 HG LEU 47 HG LEU 47 -5.735 3.138 0.618 178 HD11 LEU 47 1HD1 LEU 47 -6.010 0.857 -0.137 179 HD12 LEU 47 2HD1 LEU 47 -4.610 0.986 0.927 180 HD13 LEU 47 3HD1 LEU 47 -4.382 0.863 -0.816 181 HD21 LEU 47 1HD2 LEU 47 -3.354 3.081 1.093 182 HD22 LEU 47 2HD2 LEU 47 -3.746 4.443 0.044 183 HD23 LEU 47 3HD2 LEU 47 -2.998 2.998 -0.632 184 H ASP 48 H ASP 48 -6.417 3.106 -4.474 185 HA ASP 48 HA ASP 48 -8.055 5.366 -4.781 186 HB2 ASP 48 1HB ASP 48 -6.838 3.422 -6.714 187 HB3 ASP 48 2HB ASP 48 -7.976 4.636 -7.290 188 H MET 49 H MET 49 -8.663 1.955 -5.507 189 HA MET 49 HA MET 49 -11.232 2.310 -6.604 190 HB2 MET 49 1HB MET 49 -10.077 -0.101 -5.187 191 HB3 MET 49 2HB MET 49 -11.545 -0.104 -6.155 192 HG2 MET 49 1HG MET 49 -8.763 0.480 -7.141 193 HG3 MET 49 2HG MET 49 -9.682 -1.001 -7.410 194 HE1 MET 49 1HE MET 49 -8.311 0.683 -9.748 195 HE2 MET 49 2HE MET 49 -9.586 0.653 -10.966 196 HE3 MET 49 3HE MET 49 -9.230 -0.797 -10.028 197 H TYR 50 H TYR 50 -10.093 1.806 -3.328 198 HA TYR 50 HA TYR 50 -12.597 1.411 -2.102 199 HB2 TYR 50 1HB TYR 50 -10.020 1.282 -1.260 200 HB3 TYR 50 2HB TYR 50 -10.514 2.809 -0.540 201 HD1 TYR 50 HD1 TYR 50 -10.796 -0.781 -0.422 202 HD2 TYR 50 HD2 TYR 50 -12.407 2.853 1.085 203 HE1 TYR 50 HE1 TYR 50 -11.867 -2.026 1.401 204 HE2 TYR 50 HE2 TYR 50 -13.493 1.615 2.919 205 HH TYR 50 HH TYR 50 -14.225 -0.611 3.467 206 H LYS 51 H LYS 51 -10.657 4.327 -2.663 207 HA LYS 51 HA LYS 51 -12.471 6.075 -1.340 208 HB2 LYS 51 1HB LYS 51 -10.119 6.676 -1.631 209 HB3 LYS 51 2HB LYS 51 -10.331 6.710 -3.378 210 HG2 LYS 51 1HG LYS 51 -11.798 8.590 -3.232 211 HG3 LYS 51 2HG LYS 51 -11.834 8.487 -1.472 212 HD2 LYS 51 1HD LYS 51 -9.453 9.022 -1.390 213 HD3 LYS 51 2HD LYS 51 -9.410 9.110 -3.152 214 HE2 LYS 51 1HE LYS 51 -11.171 10.836 -1.420 215 HE3 LYS 51 2HE LYS 51 -9.576 11.323 -1.993 216 HZ1 LYS 51 1HZ LYS 51 -11.354 12.169 -3.406 217 HZ2 LYS 51 2HZ LYS 51 -11.868 10.592 -3.733 218 HZ3 LYS 51 3HZ LYS 51 -10.348 11.113 -4.259 219 H LEU 52 H LEU 52 -12.144 4.970 -4.661 220 HA LEU 52 HA LEU 52 -13.940 6.815 -5.803 221 HB2 LEU 52 1HB LEU 52 -12.422 5.401 -7.121 222 HB3 LEU 52 2HB LEU 52 -13.325 3.979 -6.643 223 HG LEU 52 HG LEU 52 -14.817 6.141 -8.048 224 HD11 LEU 52 1HD1 LEU 52 -14.121 5.294 -10.224 225 HD12 LEU 52 2HD1 LEU 52 -12.964 4.215 -9.444 226 HD13 LEU 52 3HD1 LEU 52 -12.749 5.963 -9.341 227 HD21 LEU 52 1HD2 LEU 52 -14.864 3.128 -8.217 228 HD22 LEU 52 2HD2 LEU 52 -15.988 4.230 -9.012 229 HD23 LEU 52 3HD2 LEU 52 -15.955 4.121 -7.252 230 H ASP 53 H ASP 53 -14.430 3.606 -4.396 231 HA ASP 53 HA ASP 53 -17.237 3.597 -4.948 232 HB2 ASP 53 1HB ASP 53 -15.981 1.508 -4.847 233 HB3 ASP 53 2HB ASP 53 -15.593 1.805 -3.155 234 H ASN 54 H ASN 54 -15.297 4.150 -2.011 235 HA ASN 54 HA ASN 54 -17.803 4.605 -0.545 236 HB2 ASN 54 1HB ASN 54 -15.023 3.991 0.455 237 HB3 ASN 54 2HB ASN 54 -16.387 4.362 1.505 238 HD21 ASN 54 1HD2 ASN 54 -15.993 0.718 -0.204 239 HD22 ASN 54 2HD2 ASN 54 -14.938 2.029 -0.596 240 H SER 55 H SER 55 -15.659 6.415 -2.151 241 HA SER 55 HA SER 55 -15.093 8.604 -2.191 242 HB2 SER 55 1HB SER 55 -17.419 8.862 -0.278 243 HB3 SER 55 2HB SER 55 -16.662 10.196 -1.150 244 HG SER 55 HG SER 55 -18.575 8.543 -1.992 245 H ARG 56 H ARG 56 -13.769 6.901 -0.277 246 HA ARG 56 HA ARG 56 -12.430 8.903 1.256 247 HB2 ARG 56 1HB ARG 56 -12.916 8.028 3.475 248 HB3 ARG 56 2HB ARG 56 -14.416 8.494 2.688 249 HG2 ARG 56 1HG ARG 56 -15.160 6.495 3.342 250 HG3 ARG 56 2HG ARG 56 -14.210 5.859 2.000 251 HD2 ARG 56 1HD ARG 56 -13.505 4.558 3.786 252 HD3 ARG 56 2HD ARG 56 -12.267 5.810 3.704 253 HE ARG 56 HE ARG 56 -14.411 6.489 5.477 254 HH11 ARG 56 1HH1 ARG 56 -11.343 4.825 5.214 255 HH12 ARG 56 2HH1 ARG 56 -11.104 4.715 6.931 256 HH21 ARG 56 1HH2 ARG 56 -14.088 6.373 7.735 257 HH22 ARG 56 2HH2 ARG 56 -12.656 5.622 8.363 258 H TYR 57 H TYR 57 -10.421 8.182 1.960 259 HA TYR 57 HA TYR 57 -9.425 5.799 0.745 260 HB2 TYR 57 1HB TYR 57 -8.251 7.944 2.472 261 HB3 TYR 57 2HB TYR 57 -7.363 6.440 2.244 262 HD1 TYR 57 HD1 TYR 57 -7.378 5.670 -0.365 263 HD2 TYR 57 HD2 TYR 57 -7.644 9.668 1.061 264 HE1 TYR 57 HE1 TYR 57 -6.502 6.481 -2.509 265 HE2 TYR 57 HE2 TYR 57 -6.766 10.495 -1.082 266 HH TYR 57 HH TYR 57 -5.456 9.710 -2.966 267 HA PRO 58 HA PRO 58 -10.337 2.908 3.876 268 HB2 PRO 58 1HB PRO 58 -8.404 1.067 3.405 269 HB3 PRO 58 2HB PRO 58 -9.787 1.301 2.328 270 HG2 PRO 58 1HG PRO 58 -6.982 2.295 2.072 271 HG3 PRO 58 2HG PRO 58 -8.053 1.628 0.826 272 HD2 PRO 58 1HD PRO 58 -7.623 4.291 1.143 273 HD3 PRO 58 2HD PRO 58 -9.146 3.627 0.524 274 H THR 59 H THR 59 -9.861 2.488 5.957 275 HA THR 59 HA THR 59 -7.593 3.709 7.186 276 HB THR 59 HB THR 59 -9.232 1.669 8.631 277 HG1 THR 59 HG1 THR 59 -11.048 2.742 8.330 278 HG21 THR 59 1HG2 THR 59 -8.235 4.444 9.309 279 HG22 THR 59 2HG2 THR 59 -7.531 2.923 9.854 280 HG23 THR 59 3HG2 THR 59 -9.136 3.396 10.402 281 H THR 60 H THR 60 -6.482 2.090 8.938 282 HA THR 60 HA THR 60 -4.451 0.946 7.505 283 HB THR 60 HB THR 60 -5.318 0.256 10.313 284 HG1 THR 60 HG1 THR 60 -4.111 2.011 10.916 285 HG21 THR 60 1HG2 THR 60 -2.960 -0.284 10.696 286 HG22 THR 60 2HG2 THR 60 -2.609 0.022 8.995 287 HG23 THR 60 3HG2 THR 60 -3.656 -1.322 9.452 288 H GLU 61 H GLU 61 -7.213 -0.752 8.981 289 HA GLU 61 HA GLU 61 -6.251 -3.337 8.225 290 HB2 GLU 61 1HB GLU 61 -7.697 -3.136 10.148 291 HB3 GLU 61 2HB GLU 61 -8.963 -2.403 9.174 292 HG2 GLU 61 1HG GLU 61 -9.292 -4.473 7.973 293 HG3 GLU 61 2HG GLU 61 -7.949 -5.216 8.837 294 H GLN 62 H GLN 62 -8.406 -0.985 6.793 295 HA GLN 62 HA GLN 62 -9.735 -2.828 5.076 296 HB2 GLN 62 1HB GLN 62 -9.619 0.161 4.725 297 HB3 GLN 62 2HB GLN 62 -10.877 -0.939 4.182 298 HG2 GLN 62 1HG GLN 62 -11.436 -1.403 6.539 299 HG3 GLN 62 2HG GLN 62 -10.234 -0.208 7.028 300 HE21 GLN 62 1HE2 GLN 62 -13.890 0.917 5.755 301 HE22 GLN 62 2HE2 GLN 62 -13.385 -0.734 5.749 302 H GLY 63 H GLY 63 -7.070 -0.530 4.630 303 HA2 GLY 63 1HA GLY 63 -7.105 -0.577 1.806 304 HA3 GLY 63 2HA GLY 63 -5.762 -0.049 2.799 305 H LEU 64 H LEU 64 -4.969 -2.320 4.069 306 HA LEU 64 HA LEU 64 -3.468 -3.641 2.115 307 HB2 LEU 64 1HB LEU 64 -3.579 -3.541 4.909 308 HB3 LEU 64 2HB LEU 64 -3.811 -5.231 4.504 309 HG LEU 64 HG LEU 64 -1.711 -5.185 3.201 310 HD11 LEU 64 1HD1 LEU 64 -1.512 -2.377 4.278 311 HD12 LEU 64 2HD1 LEU 64 -1.677 -2.846 2.589 312 HD13 LEU 64 3HD1 LEU 64 -0.203 -3.252 3.472 313 HD21 LEU 64 1HD2 LEU 64 -1.464 -4.247 6.057 314 HD22 LEU 64 2HD2 LEU 64 -0.209 -5.066 5.128 315 HD23 LEU 64 3HD2 LEU 64 -1.705 -5.911 5.528 316 H GLN 65 H GLN 65 -6.444 -4.567 3.755 317 HA GLN 65 HA GLN 65 -6.510 -7.200 2.670 318 HB2 GLN 65 1HB GLN 65 -8.573 -5.508 4.063 319 HB3 GLN 65 2HB GLN 65 -8.904 -7.142 3.505 320 HG2 GLN 65 1HG GLN 65 -6.693 -6.431 5.415 321 HG3 GLN 65 2HG GLN 65 -8.297 -6.968 5.909 322 HE21 GLN 65 1HE2 GLN 65 -5.551 -9.611 4.517 323 HE22 GLN 65 2HE2 GLN 65 -5.285 -7.903 4.444 324 H ALA 66 H ALA 66 -7.359 -4.138 1.414 325 HA ALA 66 HA ALA 66 -9.755 -4.686 0.108 326 HB1 ALA 66 1HB ALA 66 -7.652 -2.675 -0.656 327 HB2 ALA 66 2HB ALA 66 -8.943 -2.435 0.520 328 HB3 ALA 66 3HB ALA 66 -9.334 -2.668 -1.184 329 H LEU 67 H LEU 67 -6.460 -5.382 -0.978 330 HA LEU 67 HA LEU 67 -7.529 -5.977 -3.621 331 HB2 LEU 67 1HB LEU 67 -5.094 -6.498 -4.187 332 HB3 LEU 67 2HB LEU 67 -5.570 -4.836 -3.949 333 HG LEU 67 HG LEU 67 -4.476 -4.761 -1.801 334 HD11 LEU 67 1HD1 LEU 67 -3.808 -7.674 -2.210 335 HD12 LEU 67 2HD1 LEU 67 -4.955 -7.038 -1.030 336 HD13 LEU 67 3HD1 LEU 67 -3.241 -6.652 -0.891 337 HD21 LEU 67 1HD2 LEU 67 -3.116 -4.386 -3.804 338 HD22 LEU 67 2HD2 LEU 67 -2.734 -6.108 -3.864 339 HD23 LEU 67 3HD2 LEU 67 -2.172 -5.126 -2.511 340 H VAL 68 H VAL 68 -7.279 -7.687 -0.828 341 HA VAL 68 HA VAL 68 -6.860 -10.192 -2.324 342 HB VAL 68 HB VAL 68 -5.046 -9.934 -0.758 343 HG11 VAL 68 1HG1 VAL 68 -6.061 -8.395 0.820 344 HG12 VAL 68 2HG1 VAL 68 -5.398 -9.797 1.660 345 HG13 VAL 68 3HG1 VAL 68 -7.137 -9.668 1.395 346 HG21 VAL 68 1HG2 VAL 68 -5.308 -11.977 0.575 347 HG22 VAL 68 2HG2 VAL 68 -5.876 -12.190 -1.081 348 HG23 VAL 68 3HG2 VAL 68 -7.037 -11.972 0.229 349 H SER 69 H SER 69 -8.698 -8.657 0.283 350 HA SER 69 HA SER 69 -10.997 -10.284 -0.349 351 HB2 SER 69 1HB SER 69 -11.245 -11.076 2.025 352 HB3 SER 69 2HB SER 69 -9.886 -11.805 1.168 353 HG SER 69 HG SER 69 -9.473 -9.463 2.661 354 H ALA 70 H ALA 70 -12.800 -9.115 -0.043 355 HA ALA 70 HA ALA 70 -12.699 -6.397 0.496 356 HB1 ALA 70 1HB ALA 70 -15.091 -8.215 0.741 357 HB2 ALA 70 2HB ALA 70 -14.508 -7.475 -0.750 358 HB3 ALA 70 3HB ALA 70 -15.129 -6.461 0.553 359 HA PRO 71 HA PRO 71 -12.331 -6.408 4.965 360 HB2 PRO 71 1HB PRO 71 -12.897 -3.530 4.614 361 HB3 PRO 71 2HB PRO 71 -11.516 -4.319 5.382 362 HG2 PRO 71 1HG PRO 71 -11.272 -3.120 3.011 363 HG3 PRO 71 2HG PRO 71 -10.406 -4.624 3.374 364 HD2 PRO 71 1HD PRO 71 -12.902 -4.217 1.768 365 HD3 PRO 71 2HD PRO 71 -11.508 -5.268 1.441 366 H SER 72 H SER 72 -13.801 -6.629 6.512 367 HA SER 72 HA SER 72 -16.581 -6.037 5.942 368 HB2 SER 72 1HB SER 72 -15.337 -7.291 8.404 369 HB3 SER 72 2HB SER 72 -17.050 -7.288 7.979 370 HG SER 72 HG SER 72 -15.007 -8.446 6.378 371 H ALA 73 H ALA 73 -13.942 -4.541 7.366 372 HA ALA 73 HA ALA 73 -15.168 -2.993 9.379 373 HB1 ALA 73 1HB ALA 73 -12.743 -3.251 9.199 374 HB2 ALA 73 2HB ALA 73 -13.205 -1.549 9.183 375 HB3 ALA 73 3HB ALA 73 -12.759 -2.357 7.681 376 H GLU 74 H GLU 74 -16.210 -1.061 9.310 377 HA GLU 74 HA GLU 74 -17.357 -0.288 6.794 378 HB2 GLU 74 1HB GLU 74 -18.637 1.329 8.098 379 HB3 GLU 74 2HB GLU 74 -18.692 -0.256 8.855 380 HG2 GLU 74 1HG GLU 74 -16.956 0.471 10.442 381 HG3 GLU 74 2HG GLU 74 -16.984 2.073 9.705 382 HA PRO 75 HA PRO 75 -18.214 1.355 5.698 383 HB2 PRO 75 1HB PRO 75 -16.996 2.405 3.271 384 HB3 PRO 75 2HB PRO 75 -18.387 3.017 4.168 385 HG2 PRO 75 1HG PRO 75 -16.016 4.330 4.053 386 HG3 PRO 75 2HG PRO 75 -17.108 4.428 5.447 387 HD2 PRO 75 1HD PRO 75 -14.633 2.773 5.092 388 HD3 PRO 75 2HD PRO 75 -15.176 3.696 6.510 389 H HIS 76 H HIS 76 -18.725 -0.480 4.687 390 HA HIS 76 HA HIS 76 -16.727 -2.419 4.169 391 HB2 HIS 76 1HB HIS 76 -19.135 -2.785 4.952 392 HB3 HIS 76 2HB HIS 76 -19.607 -2.562 3.273 393 HD1 HIS 76 HD1 HIS 76 -18.867 -5.133 5.593 394 HD2 HIS 76 HD2 HIS 76 -18.084 -4.552 1.554 395 HE1 HIS 76 HE1 HIS 76 -18.365 -7.413 4.664 396 HE2 HIS 76 HE2 HIS 76 -18.116 -7.058 2.186 397 H ALA 77 H ALA 77 -15.670 -2.889 2.349 398 HA ALA 77 HA ALA 77 -15.768 -1.211 0.098 399 HB1 ALA 77 1HB ALA 77 -14.556 -3.960 0.344 400 HB2 ALA 77 2HB ALA 77 -13.764 -2.438 0.751 401 HB3 ALA 77 3HB ALA 77 -14.205 -2.782 -0.922 402 H ARG 78 H ARG 78 -16.933 -1.245 -1.698 403 HA ARG 78 HA ARG 78 -18.443 -3.680 -2.360 404 HB2 ARG 78 1HB ARG 78 -19.198 -0.788 -2.791 405 HB3 ARG 78 2HB ARG 78 -20.064 -2.144 -3.493 406 HG2 ARG 78 1HG ARG 78 -19.728 -1.615 -0.550 407 HG3 ARG 78 2HG ARG 78 -21.179 -1.295 -1.502 408 HD2 ARG 78 1HD ARG 78 -19.920 -3.985 -0.985 409 HD3 ARG 78 2HD ARG 78 -21.420 -3.377 -0.291 410 HE ARG 78 HE ARG 78 -21.841 -3.246 -2.979 411 HH11 ARG 78 1HH1 ARG 78 -20.921 -5.776 -0.747 412 HH12 ARG 78 2HH1 ARG 78 -21.618 -7.049 -1.696 413 HH21 ARG 78 1HH2 ARG 78 -22.764 -4.924 -4.245 414 HH22 ARG 78 2HH2 ARG 78 -22.656 -6.567 -3.692 415 H ASN 79 H ASN 79 -18.936 -3.848 -4.719 416 HA ASN 79 HA ASN 79 -18.274 -4.044 -6.880 417 HB2 ASN 79 1HB ASN 79 -17.865 -1.351 -6.293 418 HB3 ASN 79 2HB ASN 79 -16.337 -1.869 -6.998 419 HD21 ASN 79 1HD2 ASN 79 -19.687 -1.550 -9.256 420 HD22 ASN 79 2HD2 ASN 79 -19.729 -1.399 -7.532 421 H TYR 80 H TYR 80 -16.920 -5.346 -4.762 422 HA TYR 80 HA TYR 80 -14.092 -5.325 -5.446 423 HB2 TYR 80 1HB TYR 80 -13.873 -6.860 -3.497 424 HB3 TYR 80 2HB TYR 80 -14.633 -5.329 -3.080 425 HD1 TYR 80 HD1 TYR 80 -15.067 -8.937 -3.294 426 HD2 TYR 80 HD2 TYR 80 -17.058 -5.240 -2.604 427 HE1 TYR 80 HE1 TYR 80 -16.968 -10.149 -2.312 428 HE2 TYR 80 HE2 TYR 80 -18.963 -6.442 -1.624 429 HH TYR 80 HH TYR 80 -18.823 -9.766 -0.808 430 HA PRO 81 HA PRO 81 -14.567 -8.969 -7.969 431 HB2 PRO 81 1HB PRO 81 -11.955 -9.557 -8.291 432 HB3 PRO 81 2HB PRO 81 -12.723 -8.199 -9.118 433 HG2 PRO 81 1HG PRO 81 -11.016 -8.202 -6.663 434 HG3 PRO 81 2HG PRO 81 -11.006 -7.075 -8.031 435 HD2 PRO 81 1HD PRO 81 -12.227 -6.544 -5.645 436 HD3 PRO 81 2HD PRO 81 -12.753 -5.849 -7.191 437 H GLU 82 H GLU 82 -14.812 -11.081 -7.526 438 HA GLU 82 HA GLU 82 -14.299 -12.112 -4.943 439 HB2 GLU 82 1HB GLU 82 -14.971 -13.553 -7.517 440 HB3 GLU 82 2HB GLU 82 -14.995 -14.284 -5.916 441 HG2 GLU 82 1HG GLU 82 -16.730 -12.702 -5.226 442 HG3 GLU 82 2HG GLU 82 -16.715 -11.994 -6.840 443 H GLY 83 H GLY 83 -12.519 -12.980 -4.126 444 HA2 GLY 83 1HA GLY 83 -10.512 -14.202 -4.137 445 HA3 GLY 83 2HA GLY 83 -10.478 -14.095 -5.892 446 H GLY 84 H GLY 84 -11.221 -11.097 -5.169 447 HA2 GLY 84 1HA GLY 84 -10.091 -9.132 -4.714 448 HA3 GLY 84 2HA GLY 84 -8.733 -10.084 -4.134 449 H TYR 85 H TYR 85 -7.749 -8.161 -5.373 450 HA TYR 85 HA TYR 85 -7.527 -8.610 -8.232 451 HB2 TYR 85 1HB TYR 85 -6.083 -6.673 -6.402 452 HB3 TYR 85 2HB TYR 85 -5.916 -6.715 -8.152 453 HD1 TYR 85 HD1 TYR 85 -7.712 -5.318 -5.428 454 HD2 TYR 85 HD2 TYR 85 -8.091 -6.389 -9.522 455 HE1 TYR 85 HE1 TYR 85 -9.635 -3.802 -5.638 456 HE2 TYR 85 HE2 TYR 85 -10.012 -4.873 -9.748 457 HH TYR 85 HH TYR 85 -10.824 -2.572 -7.380 458 H ILE 86 H ILE 86 -5.899 -9.328 -5.282 459 HA ILE 86 HA ILE 86 -4.204 -11.211 -6.734 460 HB ILE 86 HB ILE 86 -2.725 -9.330 -6.290 461 HG12 ILE 86 1HG1 ILE 86 -2.173 -11.588 -4.352 462 HG13 ILE 86 2HG1 ILE 86 -1.823 -11.622 -6.077 463 HG21 ILE 86 1HG2 ILE 86 -2.238 -8.567 -4.010 464 HG22 ILE 86 2HG2 ILE 86 -3.506 -9.629 -3.395 465 HG23 ILE 86 3HG2 ILE 86 -3.921 -8.285 -4.459 466 HD11 ILE 86 1HD1 ILE 86 -0.240 -9.795 -5.797 467 HD12 ILE 86 2HD1 ILE 86 0.170 -11.164 -4.765 468 HD13 ILE 86 3HD1 ILE 86 -0.603 -9.739 -4.072 469 H ARG 87 H ARG 87 -4.037 -13.176 -5.684 470 HA ARG 87 HA ARG 87 -6.260 -13.677 -3.984 471 HB2 ARG 87 1HB ARG 87 -4.049 -15.583 -4.744 472 HB3 ARG 87 2HB ARG 87 -5.641 -16.009 -4.139 473 HG2 ARG 87 1HG ARG 87 -6.660 -15.070 -6.155 474 HG3 ARG 87 2HG ARG 87 -5.056 -14.658 -6.765 475 HD2 ARG 87 1HD ARG 87 -6.099 -17.421 -6.169 476 HD3 ARG 87 2HD ARG 87 -5.822 -16.727 -7.766 477 HE ARG 87 HE ARG 87 -3.389 -16.548 -6.810 478 HH11 ARG 87 1HH1 ARG 87 -5.670 -19.179 -6.446 479 HH12 ARG 87 2HH1 ARG 87 -4.442 -20.393 -6.282 480 HH21 ARG 87 1HH2 ARG 87 -1.768 -18.149 -6.601 481 HH22 ARG 87 2HH2 ARG 87 -2.223 -19.802 -6.350 482 H ARG 88 H ARG 88 -2.931 -13.064 -3.376 483 HA ARG 88 HA ARG 88 -3.369 -13.679 -0.537 484 HB2 ARG 88 1HB ARG 88 -0.816 -14.214 -2.065 485 HB3 ARG 88 2HB ARG 88 -1.063 -14.478 -0.347 486 HG2 ARG 88 1HG ARG 88 -2.720 -16.197 -0.843 487 HG3 ARG 88 2HG ARG 88 -2.489 -15.922 -2.572 488 HD2 ARG 88 1HD ARG 88 -0.387 -16.860 -0.625 489 HD3 ARG 88 2HD ARG 88 -1.224 -17.864 -1.807 490 HE ARG 88 HE ARG 88 -0.152 -16.057 -3.413 491 HH11 ARG 88 1HH1 ARG 88 1.275 -17.713 -0.680 492 HH12 ARG 88 2HH1 ARG 88 2.883 -17.670 -1.334 493 HH21 ARG 88 1HH2 ARG 88 1.961 -15.998 -4.273 494 HH22 ARG 88 2HH2 ARG 88 3.273 -16.694 -3.375 495 H LEU 89 H LEU 89 -2.184 -12.377 0.919 496 HA LEU 89 HA LEU 89 -1.748 -9.705 0.190 497 HB2 LEU 89 1HB LEU 89 -0.963 -11.361 2.565 498 HB3 LEU 89 2HB LEU 89 -0.407 -9.706 2.413 499 HG LEU 89 HG LEU 89 -3.330 -10.428 2.312 500 HD11 LEU 89 1HD1 LEU 89 -1.734 -9.563 4.718 501 HD12 LEU 89 2HD1 LEU 89 -2.376 -11.185 4.452 502 HD13 LEU 89 3HD1 LEU 89 -3.476 -9.821 4.652 503 HD21 LEU 89 1HD2 LEU 89 -3.583 -8.057 2.920 504 HD22 LEU 89 2HD2 LEU 89 -2.738 -8.264 1.387 505 HD23 LEU 89 3HD2 LEU 89 -1.830 -7.865 2.847 506 HA PRO 90 HA PRO 90 2.204 -10.172 -1.835 507 HB2 PRO 90 1HB PRO 90 2.740 -7.486 -1.992 508 HB3 PRO 90 2HB PRO 90 1.716 -8.357 -3.137 509 HG2 PRO 90 1HG PRO 90 0.938 -6.663 -0.805 510 HG3 PRO 90 2HG PRO 90 0.194 -6.769 -2.412 511 HD2 PRO 90 1HD PRO 90 -0.862 -7.986 -0.246 512 HD3 PRO 90 2HD PRO 90 -0.983 -8.682 -1.876 513 H GLN 91 H GLN 91 4.354 -10.030 -1.230 514 HA GLN 91 HA GLN 91 4.954 -8.813 1.363 515 HB2 GLN 91 1HB GLN 91 5.377 -11.706 0.625 516 HB3 GLN 91 2HB GLN 91 6.256 -10.927 1.932 517 HG2 GLN 91 1HG GLN 91 4.194 -10.475 3.102 518 HG3 GLN 91 2HG GLN 91 3.257 -11.144 1.767 519 HE21 GLN 91 1HE2 GLN 91 3.842 -13.598 4.583 520 HE22 GLN 91 2HE2 GLN 91 3.408 -11.919 4.592 521 H ASP 92 H ASP 92 7.037 -8.156 1.626 522 HA ASP 92 HA ASP 92 8.591 -7.469 -0.590 523 HB2 ASP 92 1HB ASP 92 9.510 -7.857 2.275 524 HB3 ASP 92 2HB ASP 92 10.381 -6.971 1.033 525 HA PRO 93 HA PRO 93 10.567 -11.197 -1.804 526 HB2 PRO 93 1HB PRO 93 12.986 -10.171 -2.625 527 HB3 PRO 93 2HB PRO 93 11.505 -10.134 -3.587 528 HG2 PRO 93 1HG PRO 93 12.709 -7.993 -1.880 529 HG3 PRO 93 2HG PRO 93 11.959 -7.861 -3.483 530 HD2 PRO 93 1HD PRO 93 10.633 -7.156 -1.270 531 HD3 PRO 93 2HD PRO 93 9.808 -7.961 -2.622 532 H TRP 94 H TRP 94 11.983 -9.110 0.554 533 HA TRP 94 HA TRP 94 14.051 -10.954 1.343 534 HB2 TRP 94 1HB TRP 94 13.035 -8.459 2.720 535 HB3 TRP 94 2HB TRP 94 14.505 -9.339 3.132 536 HD1 TRP 94 HD1 TRP 94 16.413 -9.413 1.088 537 HE1 TRP 94 HE1 TRP 94 17.053 -7.561 -0.575 538 HE3 TRP 94 HE3 TRP 94 12.242 -6.498 1.497 539 HZ2 TRP 94 HZ2 TRP 94 15.936 -5.166 -1.569 540 HZ3 TRP 94 HZ3 TRP 94 12.106 -4.440 0.160 541 HH2 TRP 94 HH2 TRP 94 13.915 -3.788 -1.342 542 H GLY 95 H GLY 95 10.731 -10.647 1.924 543 HA2 GLY 95 1HA GLY 95 9.623 -12.483 3.026 544 HA3 GLY 95 2HA GLY 95 10.966 -12.560 4.153 545 H SER 96 H SER 96 9.702 -9.447 3.327 546 HA SER 96 HA SER 96 8.561 -9.261 6.024 547 HB2 SER 96 1HB SER 96 9.355 -7.018 4.154 548 HB3 SER 96 2HB SER 96 8.872 -6.869 5.840 549 HG SER 96 HG SER 96 11.275 -7.039 5.077 550 H ASP 97 H ASP 97 6.606 -7.877 6.252 551 HA ASP 97 HA ASP 97 4.752 -8.343 4.007 552 HB2 ASP 97 1HB ASP 97 4.237 -7.935 6.961 553 HB3 ASP 97 2HB ASP 97 2.970 -8.045 5.746 554 H TYR 98 H TYR 98 3.473 -6.700 3.238 555 HA TYR 98 HA TYR 98 4.498 -4.050 3.422 556 HB2 TYR 98 1HB TYR 98 2.023 -5.204 2.128 557 HB3 TYR 98 2HB TYR 98 2.417 -3.490 2.052 558 HD1 TYR 98 HD1 TYR 98 4.000 -6.807 1.387 559 HD2 TYR 98 HD2 TYR 98 3.602 -2.749 0.191 560 HE1 TYR 98 HE1 TYR 98 5.405 -7.257 -0.570 561 HE2 TYR 98 HE2 TYR 98 5.017 -3.189 -1.776 562 HH TYR 98 HH TYR 98 5.721 -6.266 -2.871 563 H GLN 99 H GLN 99 3.561 -2.214 4.342 564 HA GLN 99 HA GLN 99 1.392 -2.747 6.255 565 HB2 GLN 99 1HB GLN 99 3.954 -1.234 6.694 566 HB3 GLN 99 2HB GLN 99 2.542 -0.991 7.713 567 HG2 GLN 99 1HG GLN 99 4.000 -3.591 7.300 568 HG3 GLN 99 2HG GLN 99 4.109 -2.550 8.719 569 HE21 GLN 99 1HE2 GLN 99 1.645 -5.379 9.137 570 HE22 GLN 99 2HE2 GLN 99 3.245 -5.323 8.487 571 H LEU 100 H LEU 100 -0.139 -1.260 6.480 572 HA LEU 100 HA LEU 100 0.138 1.302 5.054 573 HB2 LEU 100 1HB LEU 100 -1.580 0.101 3.919 574 HB3 LEU 100 2HB LEU 100 -2.269 -0.474 5.426 575 HG LEU 100 HG LEU 100 -2.758 2.007 5.925 576 HD11 LEU 100 1HD1 LEU 100 -1.393 2.957 4.148 577 HD12 LEU 100 2HD1 LEU 100 -3.086 3.421 3.980 578 HD13 LEU 100 3HD1 LEU 100 -2.408 2.169 2.940 579 HD21 LEU 100 1HD2 LEU 100 -4.231 0.537 3.761 580 HD22 LEU 100 2HD2 LEU 100 -4.861 1.902 4.683 581 HD23 LEU 100 3HD2 LEU 100 -4.479 0.387 5.500 582 H LEU 101 H LEU 101 -0.361 3.128 6.253 583 HA LEU 101 HA LEU 101 -1.698 2.652 8.812 584 HB2 LEU 101 1HB LEU 101 0.823 2.923 9.044 585 HB3 LEU 101 2HB LEU 101 0.603 4.579 8.523 586 HG LEU 101 HG LEU 101 0.807 4.134 11.035 587 HD11 LEU 101 1HD1 LEU 101 0.089 6.273 10.137 588 HD12 LEU 101 2HD1 LEU 101 -0.819 5.866 11.592 589 HD13 LEU 101 3HD1 LEU 101 -1.566 5.676 10.006 590 HD21 LEU 101 1HD2 LEU 101 -1.207 3.488 12.199 591 HD22 LEU 101 2HD2 LEU 101 -0.737 2.213 11.075 592 HD23 LEU 101 3HD2 LEU 101 -2.065 3.301 10.671 593 H SER 102 H SER 102 -3.563 3.631 8.654 594 HA SER 102 HA SER 102 -3.693 6.321 7.467 595 HB2 SER 102 1HB SER 102 -5.226 4.475 6.606 596 HB3 SER 102 2HB SER 102 -6.023 4.526 8.177 597 HG SER 102 HG SER 102 -6.744 5.917 6.220 598 HA PRO 103 HA PRO 103 -4.530 8.223 7.628 599 HB2 PRO 103 1HB PRO 103 -3.776 10.580 8.684 600 HB3 PRO 103 2HB PRO 103 -5.447 10.010 8.778 601 HG2 PRO 103 1HG PRO 103 -3.297 9.928 10.856 602 HG3 PRO 103 2HG PRO 103 -5.011 10.345 11.035 603 HD2 PRO 103 1HD PRO 103 -3.976 7.897 11.669 604 HD3 PRO 103 2HD PRO 103 -5.656 8.150 11.165 605 H GLY 104 H GLY 104 -2.836 8.953 6.363 606 HA2 GLY 104 1HA GLY 104 -0.395 7.629 6.796 607 HA3 GLY 104 2HA GLY 104 -0.722 8.784 5.516 608 H GLN 105 H GLN 105 1.629 8.316 7.171 609 HA GLN 105 HA GLN 105 1.962 10.541 8.936 610 HB2 GLN 105 1HB GLN 105 3.210 8.489 9.275 611 HB3 GLN 105 2HB GLN 105 3.913 8.609 7.673 612 HG2 GLN 105 1HG GLN 105 5.123 10.615 8.344 613 HG3 GLN 105 2HG GLN 105 4.412 10.506 9.954 614 HE21 GLN 105 1HE2 GLN 105 7.381 8.865 10.800 615 HE22 GLN 105 2HE2 GLN 105 6.478 10.337 10.877 616 H HIS 106 H HIS 106 2.730 9.800 5.591 617 HA HIS 106 HA HIS 106 4.012 12.437 5.273 618 HB2 HIS 106 1HB HIS 106 4.095 10.099 3.355 619 HB3 HIS 106 2HB HIS 106 5.085 11.550 3.304 620 HD1 HIS 106 HD1 HIS 106 4.869 8.175 4.779 621 HD2 HIS 106 HD2 HIS 106 7.188 11.603 5.257 622 HE1 HIS 106 HE1 HIS 106 6.881 7.462 6.114 623 HE2 HIS 106 HE2 HIS 106 8.311 9.522 6.316 624 H GLY 107 H GLY 107 1.568 10.251 3.981 625 HA2 GLY 107 1HA GLY 107 0.402 12.547 2.515 626 HA3 GLY 107 2HA GLY 107 0.361 10.902 1.895 627 H GLN 108 H GLN 108 -1.965 11.099 1.789 628 HA GLN 108 HA GLN 108 -3.480 11.506 4.185 629 HB2 GLN 108 1HB GLN 108 -4.414 12.012 1.961 630 HB3 GLN 108 2HB GLN 108 -4.331 10.307 1.541 631 HG2 GLN 108 1HG GLN 108 -6.589 10.963 2.151 632 HG3 GLN 108 2HG GLN 108 -5.941 9.778 3.283 633 HE21 GLN 108 1HE2 GLN 108 -6.033 11.902 6.052 634 HE22 GLN 108 2HE2 GLN 108 -5.441 10.419 5.383 635 H VAL 109 H VAL 109 -2.499 8.730 2.272 636 HA VAL 109 HA VAL 109 -2.798 7.049 4.651 637 HB VAL 109 HB VAL 109 -3.376 5.157 2.930 638 HG11 VAL 109 1HG1 VAL 109 -4.812 5.883 4.778 639 HG12 VAL 109 2HG1 VAL 109 -5.741 5.481 3.334 640 HG13 VAL 109 3HG1 VAL 109 -5.458 7.171 3.759 641 HG21 VAL 109 1HG2 VAL 109 -4.378 7.613 1.491 642 HG22 VAL 109 2HG2 VAL 109 -4.816 5.952 1.093 643 HG23 VAL 109 3HG2 VAL 109 -3.145 6.489 0.916 644 H ASP 110 H ASP 110 -0.944 6.034 5.095 645 HA ASP 110 HA ASP 110 1.146 6.204 3.051 646 HB2 ASP 110 1HB ASP 110 1.106 6.572 5.935 647 HB3 ASP 110 2HB ASP 110 2.405 5.506 5.410 648 H ILE 111 H ILE 111 1.551 4.479 1.956 649 HA ILE 111 HA ILE 111 1.449 1.860 3.278 650 HB ILE 111 HB ILE 111 1.620 0.953 0.919 651 HG12 ILE 111 1HG1 ILE 111 0.932 3.814 0.208 652 HG13 ILE 111 2HG1 ILE 111 2.455 3.008 -0.149 653 HG21 ILE 111 1HG2 ILE 111 -0.761 1.275 0.441 654 HG22 ILE 111 2HG2 ILE 111 -0.813 2.585 1.620 655 HG23 ILE 111 3HG2 ILE 111 -0.470 0.938 2.149 656 HD11 ILE 111 1HD1 ILE 111 -0.244 2.274 -1.247 657 HD12 ILE 111 2HD1 ILE 111 1.264 1.421 -1.579 658 HD13 ILE 111 3HD1 ILE 111 1.059 3.091 -2.109 659 H PHE 112 H PHE 112 3.307 0.863 3.727 660 HA PHE 112 HA PHE 112 5.693 1.432 2.190 661 HB2 PHE 112 1HB PHE 112 7.014 1.952 4.282 662 HB3 PHE 112 2HB PHE 112 5.914 3.214 3.746 663 HD1 PHE 112 HD1 PHE 112 3.947 3.783 5.038 664 HD2 PHE 112 HD2 PHE 112 6.620 0.733 6.334 665 HE1 PHE 112 HE1 PHE 112 2.942 3.862 7.282 666 HE2 PHE 112 HE2 PHE 112 5.616 0.806 8.579 667 HZ PHE 112 HZ PHE 112 3.774 2.371 9.054 668 H SER 113 H SER 113 7.252 -0.100 2.332 669 HA SER 113 HA SER 113 6.462 -2.600 3.615 670 HB2 SER 113 1HB SER 113 8.472 -1.926 1.474 671 HB3 SER 113 2HB SER 113 8.342 -3.529 2.196 672 HG SER 113 HG SER 113 6.804 -3.873 0.852 673 H LEU 114 H LEU 114 7.907 -3.824 4.817 674 HA LEU 114 HA LEU 114 9.475 -2.283 6.651 675 HB2 LEU 114 1HB LEU 114 8.740 -5.156 6.367 676 HB3 LEU 114 2HB LEU 114 10.022 -4.712 7.466 677 HG LEU 114 HG LEU 114 8.557 -3.523 8.880 678 HD11 LEU 114 1HD1 LEU 114 6.517 -3.717 6.680 679 HD12 LEU 114 2HD1 LEU 114 7.307 -2.258 7.282 680 HD13 LEU 114 3HD1 LEU 114 6.179 -3.139 8.312 681 HD21 LEU 114 1HD2 LEU 114 6.831 -5.154 9.442 682 HD22 LEU 114 2HD2 LEU 114 8.363 -5.947 9.078 683 HD23 LEU 114 3HD2 LEU 114 7.066 -5.946 7.884 684 H GLY 115 H GLY 115 10.071 -4.137 3.805 685 HA2 GLY 115 1HA GLY 115 11.939 -4.125 2.481 686 HA3 GLY 115 2HA GLY 115 12.648 -2.955 3.581 687 HA PRO 116 HA PRO 116 15.196 -6.768 3.799 688 HB2 PRO 116 1HB PRO 116 17.358 -4.835 4.250 689 HB3 PRO 116 2HB PRO 116 17.204 -6.070 2.999 690 HG2 PRO 116 1HG PRO 116 16.988 -3.449 2.439 691 HG3 PRO 116 2HG PRO 116 16.041 -4.676 1.576 692 HD2 PRO 116 1HD PRO 116 15.201 -2.866 3.815 693 HD3 PRO 116 2HD PRO 116 14.319 -3.303 2.336 694 H ASP 117 H ASP 117 14.810 -4.059 5.962 695 HA ASP 117 HA ASP 117 16.291 -5.361 8.087 696 HB2 ASP 117 1HB ASP 117 15.757 -3.410 9.440 697 HB3 ASP 117 2HB ASP 117 16.349 -2.894 7.867 698 H GLY 118 H GLY 118 13.113 -5.379 6.886 699 HA2 GLY 118 1HA GLY 118 11.318 -6.666 7.521 700 HA3 GLY 118 2HA GLY 118 12.345 -7.374 8.761 701 H VAL 119 H VAL 119 12.442 -4.105 9.199 702 HA VAL 119 HA VAL 119 10.208 -4.195 11.110 703 HB VAL 119 HB VAL 119 12.865 -2.801 11.505 704 HG11 VAL 119 1HG1 VAL 119 12.105 -2.437 13.792 705 HG12 VAL 119 2HG1 VAL 119 10.567 -3.211 13.413 706 HG13 VAL 119 3HG1 VAL 119 11.004 -1.689 12.634 707 HG21 VAL 119 1HG2 VAL 119 13.134 -5.217 11.604 708 HG22 VAL 119 2HG2 VAL 119 11.811 -5.329 12.763 709 HG23 VAL 119 3HG2 VAL 119 13.304 -4.506 13.209 710 HA PRO 120 HA PRO 120 8.928 -0.430 9.071 711 HB2 PRO 120 1HB PRO 120 6.900 0.183 10.748 712 HB3 PRO 120 2HB PRO 120 6.776 -1.103 9.543 713 HG2 PRO 120 1HG PRO 120 7.303 -1.298 12.475 714 HG3 PRO 120 2HG PRO 120 6.289 -2.325 11.448 715 HD2 PRO 120 1HD PRO 120 8.817 -2.997 12.253 716 HD3 PRO 120 2HD PRO 120 8.064 -3.597 10.764 717 H GLU 121 H GLU 121 8.785 1.834 9.602 718 HA GLU 121 HA GLU 121 9.538 3.768 10.531 719 HB2 GLU 121 1HB GLU 121 9.941 2.198 13.088 720 HB3 GLU 121 2HB GLU 121 9.923 3.948 12.931 721 HG2 GLU 121 1HG GLU 121 7.604 2.089 12.472 722 HG3 GLU 121 2HG GLU 121 7.839 3.152 13.857 723 H SER 122 H SER 122 11.178 1.605 9.346 724 HA SER 122 HA SER 122 13.787 1.919 10.578 725 HB2 SER 122 1HB SER 122 13.122 0.515 7.988 726 HB3 SER 122 2HB SER 122 14.526 0.264 9.020 727 HG SER 122 HG SER 122 12.618 -1.274 9.090 728 H ASN 123 H ASN 123 15.672 2.507 9.112 729 HA ASN 123 HA ASN 123 15.215 4.783 7.469 730 HB2 ASN 123 1HB ASN 123 17.572 2.869 7.523 731 HB3 ASN 123 2HB ASN 123 17.540 4.388 6.637 732 HD21 ASN 123 1HD2 ASN 123 19.114 5.792 9.387 733 HD22 ASN 123 2HD2 ASN 123 19.204 5.321 7.724 734 H ASP 124 H ASP 124 15.375 1.368 6.980 735 HA ASP 124 HA ASP 124 14.826 1.605 4.131 736 HB2 ASP 124 1HB ASP 124 15.375 -0.818 5.864 737 HB3 ASP 124 2HB ASP 124 15.011 -0.888 4.144 738 H ASP 125 H ASP 125 12.841 2.685 5.035 739 HA ASP 125 HA ASP 125 10.732 0.626 5.085 740 HB2 ASP 125 1HB ASP 125 10.973 3.225 6.474 741 HB3 ASP 125 2HB ASP 125 9.396 2.889 5.764 742 H ILE 126 H ILE 126 10.232 0.305 3.035 743 HA ILE 126 HA ILE 126 10.605 2.384 1.075 744 HB ILE 126 HB ILE 126 9.525 -0.410 0.700 745 HG12 ILE 126 1HG1 ILE 126 12.332 0.643 0.269 746 HG13 ILE 126 2HG1 ILE 126 11.831 -0.317 1.657 747 HG21 ILE 126 1HG2 ILE 126 9.006 1.306 -1.064 748 HG22 ILE 126 2HG2 ILE 126 9.909 -0.104 -1.623 749 HG23 ILE 126 3HG2 ILE 126 10.744 1.428 -1.348 750 HD11 ILE 126 1HD1 ILE 126 11.317 -2.186 0.200 751 HD12 ILE 126 2HD1 ILE 126 12.984 -1.657 -0.018 752 HD13 ILE 126 3HD1 ILE 126 11.760 -1.223 -1.209 753 H GLY 127 H GLY 127 9.105 3.923 1.204 754 HA2 GLY 127 1HA GLY 127 6.271 3.136 1.253 755 HA3 GLY 127 2HA GLY 127 6.899 4.722 1.690 756 H ASN 128 H ASN 128 4.798 4.137 -0.224 757 HA ASN 128 HA ASN 128 5.865 4.368 -2.846 758 HB2 ASN 128 1HB ASN 128 3.412 3.772 -1.977 759 HB3 ASN 128 2HB ASN 128 3.167 5.493 -2.269 760 HD21 ASN 128 1HD2 ASN 128 2.345 4.574 -5.525 761 HD22 ASN 128 2HD2 ASN 128 1.792 5.188 -4.007 762 H TRP 129 H TRP 129 5.033 6.606 -0.337 763 HA TRP 129 HA TRP 129 5.216 8.989 -1.886 764 HB2 TRP 129 1HB TRP 129 4.007 8.835 0.274 765 HB3 TRP 129 2HB TRP 129 5.534 8.566 1.100 766 HD1 TRP 129 HD1 TRP 129 3.402 11.311 -0.441 767 HE1 TRP 129 HE1 TRP 129 4.374 13.598 0.229 768 HE3 TRP 129 HE3 TRP 129 7.782 9.747 1.690 769 HZ2 TRP 129 HZ2 TRP 129 6.687 14.604 1.487 770 HZ3 TRP 129 HZ3 TRP 129 9.316 11.437 2.603 771 HH2 TRP 129 HH2 TRP 129 8.778 13.817 2.501 772 H THR 130 H THR 130 7.521 6.947 -0.220 773 HA THR 130 HA THR 130 9.583 8.963 -0.250 774 HB THR 130 HB THR 130 11.051 7.178 0.661 775 HG1 THR 130 HG1 THR 130 10.269 5.288 -0.098 776 HG21 THR 130 1HG2 THR 130 8.395 7.470 2.062 777 HG22 THR 130 2HG2 THR 130 9.753 8.588 2.176 778 HG23 THR 130 3HG2 THR 130 9.904 6.951 2.814 779 H ILE 131 H ILE 131 8.647 6.175 -2.167 780 HA ILE 131 HA ILE 131 11.060 6.106 -3.699 781 HB ILE 131 HB ILE 131 9.540 4.137 -3.435 782 HG12 ILE 131 1HG1 ILE 131 9.721 3.379 -5.809 783 HG13 ILE 131 2HG1 ILE 131 10.167 5.020 -6.259 784 HG21 ILE 131 1HG2 ILE 131 7.411 5.293 -3.723 785 HG22 ILE 131 2HG2 ILE 131 7.572 3.947 -4.850 786 HG23 ILE 131 3HG2 ILE 131 7.807 5.601 -5.413 787 HD11 ILE 131 1HD1 ILE 131 12.166 4.872 -4.900 788 HD12 ILE 131 2HD1 ILE 131 12.104 3.551 -6.065 789 HD13 ILE 131 3HD1 ILE 131 11.706 3.253 -4.373 790 H GLY 132 H GLY 132 8.163 8.002 -3.831 791 HA2 GLY 132 1HA GLY 132 9.033 10.105 -5.127 792 HA3 GLY 132 2HA GLY 132 8.897 9.004 -6.486 793 H PHE 133 H PHE 133 6.434 7.809 -5.106 794 HA PHE 133 HA PHE 133 4.571 9.483 -6.492 795 HB2 PHE 133 1HB PHE 133 4.173 7.042 -4.760 796 HB3 PHE 133 2HB PHE 133 2.864 7.868 -5.595 797 HD1 PHE 133 HD1 PHE 133 5.914 5.865 -6.040 798 HD2 PHE 133 HD2 PHE 133 2.514 7.586 -7.928 799 HE1 PHE 133 HE1 PHE 133 6.341 4.500 -8.041 800 HE2 PHE 133 HE2 PHE 133 2.935 6.225 -9.934 801 HZ PHE 133 HZ PHE 133 4.848 4.677 -9.990 802 H HIS 134 H HIS 134 5.007 11.434 -5.264 803 HA HIS 134 HA HIS 134 4.129 11.656 -2.544 804 HB2 HIS 134 1HB HIS 134 4.586 13.803 -4.634 805 HB3 HIS 134 2HB HIS 134 4.349 14.092 -2.914 806 HD1 HIS 134 HD1 HIS 134 6.937 13.505 -5.391 807 HD2 HIS 134 HD2 HIS 134 6.520 12.949 -1.292 808 HE1 HIS 134 HE1 HIS 134 9.271 13.210 -4.507 809 HE2 HIS 134 HE2 HIS 134 8.990 12.782 -2.043 810 H HIS 135 H HIS 135 2.743 11.990 -5.695 811 HA HIS 135 HA HIS 135 0.104 11.779 -4.589 812 HB2 HIS 135 1HB HIS 135 -0.791 13.740 -5.876 813 HB3 HIS 135 2HB HIS 135 0.227 14.174 -4.513 814 HD1 HIS 135 HD1 HIS 135 2.499 15.307 -5.046 815 HD2 HIS 135 HD2 HIS 135 0.175 14.492 -8.390 816 HE1 HIS 135 HE1 HIS 135 3.557 16.588 -6.931 817 HE2 HIS 135 HE2 HIS 135 2.261 15.898 -8.980 818 H HIS 136 H HIS 136 -0.231 9.907 -5.645 819 HA HIS 136 HA HIS 136 0.590 9.336 -8.269 820 HB2 HIS 136 1HB HIS 136 -0.895 7.409 -8.171 821 HB3 HIS 136 2HB HIS 136 -0.020 7.580 -6.657 822 HD1 HIS 136 HD1 HIS 136 -1.391 7.928 -4.546 823 HD2 HIS 136 HD2 HIS 136 -3.669 7.943 -8.016 824 HE1 HIS 136 HE1 HIS 136 -3.784 7.830 -3.783 825 HE2 HIS 136 HE2 HIS 136 -5.102 7.523 -5.913 826 H HIS 137 H HIS 137 -0.642 9.159 -10.209 827 HA HIS 137 HA HIS 137 -3.115 10.606 -10.446 828 HB2 HIS 137 1HB HIS 137 -2.102 12.401 -11.900 829 HB3 HIS 137 2HB HIS 137 -1.680 12.520 -10.195 830 HD1 HIS 137 HD1 HIS 137 0.792 12.019 -9.541 831 HD2 HIS 137 HD2 HIS 137 0.030 11.850 -13.627 832 HE1 HIS 137 HE1 HIS 137 3.046 11.984 -10.651 833 HE2 HIS 137 HE2 HIS 137 2.556 12.018 -13.120 834 H HIS 138 H HIS 138 -3.957 10.577 -12.595 835 HA HIS 138 HA HIS 138 -2.438 8.918 -14.502 836 HB2 HIS 138 1HB HIS 138 -5.397 8.937 -13.923 837 HB3 HIS 138 2HB HIS 138 -4.756 8.318 -15.438 838 HD1 HIS 138 HD1 HIS 138 -5.861 7.116 -12.333 839 HD2 HIS 138 HD2 HIS 138 -2.579 6.254 -14.733 840 HE1 HIS 138 HE1 HIS 138 -5.076 4.838 -11.611 841 HE2 HIS 138 HE2 HIS 138 -3.187 4.275 -13.181 842 H HIS 139 H HIS 139 -2.545 11.830 -14.071 843 HA HIS 139 HA HIS 139 -3.309 12.578 -16.809 844 HB2 HIS 139 1HB HIS 139 -3.755 14.136 -14.266 845 HB3 HIS 139 2HB HIS 139 -3.732 14.911 -15.843 846 HD1 HIS 139 HD1 HIS 139 -5.914 13.149 -13.522 847 HD2 HIS 139 HD2 HIS 139 -5.869 13.976 -17.592 848 HE1 HIS 139 HE1 HIS 139 -8.262 12.749 -14.319 849 HE2 HIS 139 HE2 HIS 139 -8.170 13.094 -16.810 850 H LYS 140 H LYS 140 -1.901 13.953 -17.873 851 HA LYS 140 HA LYS 140 0.511 14.781 -16.438 852 HB2 LYS 140 1HB LYS 140 0.976 12.616 -17.562 853 HB3 LYS 140 2HB LYS 140 0.536 13.341 -19.099 854 HG2 LYS 140 1HG LYS 140 2.404 14.866 -18.963 855 HG3 LYS 140 2HG LYS 140 2.813 14.262 -17.355 856 HD2 LYS 140 1HD LYS 140 3.159 12.013 -18.353 857 HD3 LYS 140 2HD LYS 140 2.887 12.717 -19.945 858 HE2 LYS 140 1HE LYS 140 4.821 14.133 -19.695 859 HE3 LYS 140 2HE LYS 140 5.046 13.592 -18.032 860 HZ1 LYS 140 1HZ LYS 140 6.562 12.475 -19.549 861 HZ2 LYS 140 2HZ LYS 140 5.261 11.874 -20.446 862 HZ3 LYS 140 3HZ LYS 140 5.495 11.365 -18.851 Start of MODEL 9 1 H1 MET 25 1H MET 25 30.706 -3.863 -8.631 2 H2 MET 25 2H MET 25 30.247 -5.486 -8.741 3 H3 MET 25 3H MET 25 30.106 -4.666 -7.271 4 HA MET 25 HA MET 25 28.419 -3.252 -8.116 5 HB2 MET 25 1HB MET 25 27.534 -3.523 -10.374 6 HB3 MET 25 2HB MET 25 29.239 -3.111 -10.432 7 HG2 MET 25 1HG MET 25 29.808 -5.418 -10.891 8 HG3 MET 25 2HG MET 25 28.113 -5.882 -10.757 9 HE1 MET 25 1HE MET 25 26.522 -4.114 -13.855 10 HE2 MET 25 2HE MET 25 26.658 -3.423 -12.240 11 HE3 MET 25 3HE MET 25 26.237 -5.124 -12.439 12 H GLY 26 H GLY 26 26.149 -4.187 -9.051 13 HA2 GLY 26 1HA GLY 26 25.221 -6.651 -9.091 14 HA3 GLY 26 2HA GLY 26 25.645 -6.531 -7.386 15 H ASN 27 H ASN 27 24.710 -4.722 -6.185 16 HA ASN 27 HA ASN 27 22.933 -3.579 -5.385 17 HB2 ASN 27 1HB ASN 27 23.158 -2.753 -8.206 18 HB3 ASN 27 2HB ASN 27 21.613 -2.399 -7.439 19 HD21 ASN 27 1HD2 ASN 27 24.973 -0.382 -6.394 20 HD22 ASN 27 2HD2 ASN 27 25.032 -1.771 -7.426 21 H LYS 28 H LYS 28 22.243 -6.064 -5.256 22 HA LYS 28 HA LYS 28 19.899 -6.840 -6.600 23 HB2 LYS 28 1HB LYS 28 19.483 -8.311 -4.666 24 HB3 LYS 28 2HB LYS 28 21.161 -8.399 -5.186 25 HG2 LYS 28 1HG LYS 28 21.793 -6.883 -3.375 26 HG3 LYS 28 2HG LYS 28 20.113 -6.818 -2.849 27 HD2 LYS 28 1HD LYS 28 20.131 -9.150 -2.307 28 HD3 LYS 28 2HD LYS 28 21.733 -9.350 -3.019 29 HE2 LYS 28 1HE LYS 28 21.057 -7.668 -0.610 30 HE3 LYS 28 2HE LYS 28 21.856 -9.240 -0.585 31 HZ1 LYS 28 1HZ LYS 28 23.457 -7.461 -0.391 32 HZ2 LYS 28 2HZ LYS 28 22.925 -6.768 -1.840 33 HZ3 LYS 28 3HZ LYS 28 23.685 -8.279 -1.852 34 H GLU 29 H GLU 29 20.530 -4.637 -4.012 35 HA GLU 29 HA GLU 29 18.066 -4.217 -2.858 36 HB2 GLU 29 1HB GLU 29 20.050 -3.134 -2.030 37 HB3 GLU 29 2HB GLU 29 20.267 -2.266 -3.543 38 HG2 GLU 29 1HG GLU 29 18.032 -1.164 -3.049 39 HG3 GLU 29 2HG GLU 29 18.193 -1.828 -1.422 40 H LYS 30 H LYS 30 19.350 -2.887 -5.879 41 HA LYS 30 HA LYS 30 17.172 -1.122 -6.318 42 HB2 LYS 30 1HB LYS 30 19.213 -2.225 -8.251 43 HB3 LYS 30 2HB LYS 30 18.075 -0.939 -8.626 44 HG2 LYS 30 1HG LYS 30 20.278 -0.855 -6.574 45 HG3 LYS 30 2HG LYS 30 20.219 0.015 -8.109 46 HD2 LYS 30 1HD LYS 30 18.202 1.211 -7.294 47 HD3 LYS 30 2HD LYS 30 18.388 0.396 -5.741 48 HE2 LYS 30 1HE LYS 30 20.421 2.225 -7.011 49 HE3 LYS 30 2HE LYS 30 19.309 2.674 -5.720 50 HZ1 LYS 30 1HZ LYS 30 20.349 1.034 -4.283 51 HZ2 LYS 30 2HZ LYS 30 21.504 2.123 -4.872 52 HZ3 LYS 30 3HZ LYS 30 21.405 0.571 -5.530 53 H ALA 31 H ALA 31 17.916 -4.398 -7.386 54 HA ALA 31 HA ALA 31 15.715 -4.668 -9.147 55 HB1 ALA 31 1HB ALA 31 16.175 -7.058 -9.055 56 HB2 ALA 31 2HB ALA 31 17.222 -6.817 -7.657 57 HB3 ALA 31 3HB ALA 31 17.674 -6.145 -9.223 58 H ASP 32 H ASP 32 16.197 -5.465 -5.735 59 HA ASP 32 HA ASP 32 13.692 -6.695 -5.327 60 HB2 ASP 32 1HB ASP 32 15.704 -5.458 -3.467 61 HB3 ASP 32 2HB ASP 32 14.164 -6.059 -2.862 62 H ARG 33 H ARG 33 14.776 -3.345 -4.773 63 HA ARG 33 HA ARG 33 12.325 -2.488 -3.672 64 HB2 ARG 33 1HB ARG 33 13.090 -0.195 -4.059 65 HB3 ARG 33 2HB ARG 33 14.333 -1.185 -3.314 66 HG2 ARG 33 1HG ARG 33 15.380 -1.453 -5.540 67 HG3 ARG 33 2HG ARG 33 14.185 -0.329 -6.192 68 HD2 ARG 33 1HD ARG 33 15.952 0.381 -3.868 69 HD3 ARG 33 2HD ARG 33 16.458 0.625 -5.535 70 HE ARG 33 HE ARG 33 14.483 2.093 -5.768 71 HH11 ARG 33 1HH1 ARG 33 15.663 1.430 -2.532 72 HH12 ARG 33 2HH1 ARG 33 15.190 2.978 -1.915 73 HH21 ARG 33 1HH2 ARG 33 13.874 4.124 -4.960 74 HH22 ARG 33 2HH2 ARG 33 14.178 4.519 -3.296 75 H GLN 34 H GLN 34 13.456 -2.637 -7.019 76 HA GLN 34 HA GLN 34 11.340 -1.227 -8.204 77 HB2 GLN 34 1HB GLN 34 12.971 -3.553 -9.231 78 HB3 GLN 34 2HB GLN 34 11.798 -2.691 -10.216 79 HG2 GLN 34 1HG GLN 34 13.058 -0.641 -9.985 80 HG3 GLN 34 2HG GLN 34 14.200 -1.438 -8.903 81 HE21 GLN 34 1HE2 GLN 34 14.470 -1.882 -12.923 82 HE22 GLN 34 2HE2 GLN 34 13.130 -1.078 -12.185 83 H LYS 35 H LYS 35 11.609 -4.603 -7.199 84 HA LYS 35 HA LYS 35 9.038 -5.415 -8.095 85 HB2 LYS 35 1HB LYS 35 10.797 -7.038 -7.598 86 HB3 LYS 35 2HB LYS 35 10.819 -6.533 -5.915 87 HG2 LYS 35 1HG LYS 35 9.636 -8.603 -6.088 88 HG3 LYS 35 2HG LYS 35 8.485 -7.327 -5.693 89 HD2 LYS 35 1HD LYS 35 7.906 -7.188 -8.110 90 HD3 LYS 35 2HD LYS 35 8.953 -8.581 -8.395 91 HE2 LYS 35 1HE LYS 35 6.536 -8.522 -6.594 92 HE3 LYS 35 2HE LYS 35 6.601 -9.234 -8.204 93 HZ1 LYS 35 1HZ LYS 35 8.219 -10.116 -5.873 94 HZ2 LYS 35 2HZ LYS 35 8.230 -10.817 -7.413 95 HZ3 LYS 35 3HZ LYS 35 6.838 -10.893 -6.459 96 H VAL 36 H VAL 36 10.277 -4.087 -5.084 97 HA VAL 36 HA VAL 36 7.968 -4.329 -3.510 98 HB VAL 36 HB VAL 36 10.162 -2.248 -3.421 99 HG11 VAL 36 1HG1 VAL 36 8.087 -2.876 -1.322 100 HG12 VAL 36 2HG1 VAL 36 8.138 -1.417 -2.313 101 HG13 VAL 36 3HG1 VAL 36 9.429 -1.744 -1.157 102 HG21 VAL 36 1HG2 VAL 36 10.925 -4.537 -3.062 103 HG22 VAL 36 2HG2 VAL 36 9.717 -4.747 -1.794 104 HG23 VAL 36 3HG2 VAL 36 11.033 -3.592 -1.578 105 H VAL 37 H VAL 37 9.103 -1.659 -5.556 106 HA VAL 37 HA VAL 37 6.961 0.086 -5.111 107 HB VAL 37 HB VAL 37 8.653 -0.166 -7.607 108 HG11 VAL 37 1HG1 VAL 37 6.610 1.109 -8.015 109 HG12 VAL 37 2HG1 VAL 37 8.024 2.162 -8.032 110 HG13 VAL 37 3HG1 VAL 37 6.964 2.134 -6.624 111 HG21 VAL 37 1HG2 VAL 37 8.986 1.565 -5.158 112 HG22 VAL 37 2HG2 VAL 37 9.965 1.669 -6.622 113 HG23 VAL 37 3HG2 VAL 37 10.014 0.211 -5.630 114 H SER 38 H SER 38 7.331 -2.587 -7.385 115 HA SER 38 HA SER 38 5.103 -2.029 -8.997 116 HB2 SER 38 1HB SER 38 6.934 -3.672 -9.505 117 HB3 SER 38 2HB SER 38 6.207 -4.767 -8.332 118 HG SER 38 HG SER 38 4.691 -5.247 -9.716 119 H ASP 39 H ASP 39 5.372 -4.133 -6.115 120 HA ASP 39 HA ASP 39 2.578 -4.673 -6.048 121 HB2 ASP 39 1HB ASP 39 4.819 -5.097 -4.105 122 HB3 ASP 39 2HB ASP 39 3.152 -5.300 -3.574 123 H LEU 40 H LEU 40 4.633 -2.228 -4.684 124 HA LEU 40 HA LEU 40 2.883 -1.108 -2.802 125 HB2 LEU 40 1HB LEU 40 5.387 -0.715 -3.171 126 HB3 LEU 40 2HB LEU 40 4.913 0.423 -4.414 127 HG LEU 40 HG LEU 40 3.666 1.713 -2.676 128 HD11 LEU 40 1HD1 LEU 40 5.041 -0.217 -0.810 129 HD12 LEU 40 2HD1 LEU 40 3.304 -0.053 -1.057 130 HD13 LEU 40 3HD1 LEU 40 4.216 1.262 -0.318 131 HD21 LEU 40 1HD2 LEU 40 6.610 1.285 -2.176 132 HD22 LEU 40 2HD2 LEU 40 5.669 2.692 -1.680 133 HD23 LEU 40 3HD2 LEU 40 5.912 2.353 -3.393 134 H VAL 41 H VAL 41 3.408 -0.293 -6.248 135 HA VAL 41 HA VAL 41 1.487 1.782 -6.298 136 HB VAL 41 HB VAL 41 1.515 1.638 -8.729 137 HG11 VAL 41 1HG1 VAL 41 3.317 2.831 -7.634 138 HG12 VAL 41 2HG1 VAL 41 3.904 2.036 -9.096 139 HG13 VAL 41 3HG1 VAL 41 4.253 1.340 -7.512 140 HG21 VAL 41 1HG2 VAL 41 1.542 -0.753 -9.054 141 HG22 VAL 41 2HG2 VAL 41 3.152 -0.862 -8.343 142 HG23 VAL 41 3HG2 VAL 41 2.921 -0.028 -9.878 143 H ALA 42 H ALA 42 1.247 -1.705 -6.826 144 HA ALA 42 HA ALA 42 -1.440 -1.790 -7.640 145 HB1 ALA 42 1HB ALA 42 0.025 -3.745 -7.728 146 HB2 ALA 42 2HB ALA 42 -1.447 -4.097 -6.821 147 HB3 ALA 42 3HB ALA 42 0.067 -3.800 -5.966 148 H LEU 43 H LEU 43 0.025 -1.612 -4.434 149 HA LEU 43 HA LEU 43 -2.317 -1.804 -2.892 150 HB2 LEU 43 1HB LEU 43 0.285 -0.370 -2.404 151 HB3 LEU 43 2HB LEU 43 -0.989 -0.458 -1.203 152 HG LEU 43 HG LEU 43 0.468 -2.827 -2.373 153 HD11 LEU 43 1HD1 LEU 43 0.678 -1.436 0.288 154 HD12 LEU 43 2HD1 LEU 43 1.920 -1.529 -0.960 155 HD13 LEU 43 3HD1 LEU 43 1.427 -2.987 -0.100 156 HD21 LEU 43 1HD2 LEU 43 -1.575 -2.623 -0.163 157 HD22 LEU 43 2HD2 LEU 43 -0.669 -4.073 -0.589 158 HD23 LEU 43 3HD2 LEU 43 -1.811 -3.380 -1.738 159 H GLU 44 H GLU 44 -0.622 1.053 -4.165 160 HA GLU 44 HA GLU 44 -2.425 3.013 -3.326 161 HB2 GLU 44 1HB GLU 44 -0.685 2.844 -5.792 162 HB3 GLU 44 2HB GLU 44 -1.600 4.281 -5.365 163 HG2 GLU 44 1HG GLU 44 0.356 3.049 -3.469 164 HG3 GLU 44 2HG GLU 44 0.863 4.180 -4.720 165 H GLY 45 H GLY 45 -2.476 0.881 -6.131 166 HA2 GLY 45 1HA GLY 45 -4.717 1.972 -7.441 167 HA3 GLY 45 2HA GLY 45 -4.164 0.307 -7.570 168 H ALA 46 H ALA 46 -4.456 -0.543 -4.955 169 HA ALA 46 HA ALA 46 -7.208 -1.104 -4.762 170 HB1 ALA 46 1HB ALA 46 -6.665 -2.047 -2.548 171 HB2 ALA 46 2HB ALA 46 -5.051 -1.347 -2.662 172 HB3 ALA 46 3HB ALA 46 -5.558 -2.592 -3.802 173 H LEU 47 H LEU 47 -5.154 1.286 -3.176 174 HA LEU 47 HA LEU 47 -7.073 2.404 -1.461 175 HB2 LEU 47 1HB LEU 47 -4.795 3.803 -2.874 176 HB3 LEU 47 2HB LEU 47 -5.623 4.375 -1.434 177 HG LEU 47 HG LEU 47 -3.771 2.018 -1.690 178 HD11 LEU 47 1HD1 LEU 47 -3.662 4.525 -0.030 179 HD12 LEU 47 2HD1 LEU 47 -2.683 4.168 -1.452 180 HD13 LEU 47 3HD1 LEU 47 -2.487 3.211 0.016 181 HD21 LEU 47 1HD2 LEU 47 -5.609 1.321 -0.302 182 HD22 LEU 47 2HD2 LEU 47 -5.483 2.795 0.658 183 HD23 LEU 47 3HD2 LEU 47 -4.181 1.605 0.693 184 H ASP 48 H ASP 48 -6.193 3.208 -4.812 185 HA ASP 48 HA ASP 48 -8.000 5.329 -5.159 186 HB2 ASP 48 1HB ASP 48 -6.820 3.379 -7.139 187 HB3 ASP 48 2HB ASP 48 -7.885 4.688 -7.630 188 H MET 49 H MET 49 -8.358 1.856 -5.731 189 HA MET 49 HA MET 49 -10.958 2.055 -6.838 190 HB2 MET 49 1HB MET 49 -9.501 -0.309 -5.645 191 HB3 MET 49 2HB MET 49 -11.050 -0.420 -6.470 192 HG2 MET 49 1HG MET 49 -10.021 0.465 -8.509 193 HG3 MET 49 2HG MET 49 -8.469 0.547 -7.681 194 HE1 MET 49 1HE MET 49 -8.513 -2.157 -5.951 195 HE2 MET 49 2HE MET 49 -7.120 -1.564 -6.855 196 HE3 MET 49 3HE MET 49 -7.663 -3.229 -7.062 197 H TYR 50 H TYR 50 -9.777 1.453 -3.567 198 HA TYR 50 HA TYR 50 -12.325 0.947 -2.440 199 HB2 TYR 50 1HB TYR 50 -10.317 0.309 -1.232 200 HB3 TYR 50 2HB TYR 50 -9.787 1.987 -1.157 201 HD1 TYR 50 HD1 TYR 50 -12.059 -0.518 0.248 202 HD2 TYR 50 HD2 TYR 50 -10.856 3.560 0.363 203 HE1 TYR 50 HE1 TYR 50 -13.252 -0.228 2.382 204 HE2 TYR 50 HE2 TYR 50 -12.035 3.854 2.490 205 HH TYR 50 HH TYR 50 -13.110 1.328 4.375 206 H LYS 51 H LYS 51 -10.370 3.905 -2.723 207 HA LYS 51 HA LYS 51 -12.187 5.598 -1.385 208 HB2 LYS 51 1HB LYS 51 -9.854 6.234 -1.788 209 HB3 LYS 51 2HB LYS 51 -10.157 6.289 -3.519 210 HG2 LYS 51 1HG LYS 51 -11.783 8.091 -3.162 211 HG3 LYS 51 2HG LYS 51 -11.420 8.058 -1.438 212 HD2 LYS 51 1HD LYS 51 -9.090 8.639 -1.931 213 HD3 LYS 51 2HD LYS 51 -9.478 8.695 -3.653 214 HE2 LYS 51 1HE LYS 51 -10.739 10.416 -1.525 215 HE3 LYS 51 2HE LYS 51 -9.451 10.931 -2.615 216 HZ1 LYS 51 1HZ LYS 51 -11.670 11.632 -3.352 217 HZ2 LYS 51 2HZ LYS 51 -12.140 10.014 -3.484 218 HZ3 LYS 51 3HZ LYS 51 -10.918 10.625 -4.480 219 H LEU 52 H LEU 52 -11.944 4.560 -4.729 220 HA LEU 52 HA LEU 52 -13.871 6.288 -5.837 221 HB2 LEU 52 1HB LEU 52 -12.317 4.138 -6.701 222 HB3 LEU 52 2HB LEU 52 -13.966 3.601 -6.917 223 HG LEU 52 HG LEU 52 -13.234 4.543 -8.969 224 HD11 LEU 52 1HD1 LEU 52 -15.032 6.514 -7.578 225 HD12 LEU 52 2HD1 LEU 52 -15.540 5.020 -8.366 226 HD13 LEU 52 3HD1 LEU 52 -14.847 6.331 -9.322 227 HD21 LEU 52 1HD2 LEU 52 -11.379 5.876 -8.144 228 HD22 LEU 52 2HD2 LEU 52 -12.506 7.012 -7.402 229 HD23 LEU 52 3HD2 LEU 52 -12.441 6.854 -9.159 230 H ASP 53 H ASP 53 -14.104 3.141 -4.297 231 HA ASP 53 HA ASP 53 -16.891 2.842 -4.836 232 HB2 ASP 53 1HB ASP 53 -15.323 0.926 -4.600 233 HB3 ASP 53 2HB ASP 53 -15.175 1.292 -2.885 234 H ASN 54 H ASN 54 -15.016 3.831 -1.985 235 HA ASN 54 HA ASN 54 -17.567 4.214 -0.547 236 HB2 ASN 54 1HB ASN 54 -14.869 3.448 0.572 237 HB3 ASN 54 2HB ASN 54 -16.277 3.841 1.553 238 HD21 ASN 54 1HD2 ASN 54 -15.905 0.240 -0.231 239 HD22 ASN 54 2HD2 ASN 54 -14.776 1.517 -0.494 240 H SER 55 H SER 55 -15.639 6.053 -2.156 241 HA SER 55 HA SER 55 -15.385 8.303 -2.228 242 HB2 SER 55 1HB SER 55 -16.733 8.403 0.471 243 HB3 SER 55 2HB SER 55 -16.520 9.743 -0.653 244 HG SER 55 HG SER 55 -17.729 7.652 -1.871 245 H ARG 56 H ARG 56 -14.521 6.845 0.881 246 HA ARG 56 HA ARG 56 -12.462 8.921 1.212 247 HB2 ARG 56 1HB ARG 56 -12.549 8.142 3.661 248 HB3 ARG 56 2HB ARG 56 -13.895 9.088 3.048 249 HG2 ARG 56 1HG ARG 56 -14.872 7.381 4.313 250 HG3 ARG 56 2HG ARG 56 -15.069 6.872 2.637 251 HD2 ARG 56 1HD ARG 56 -14.392 4.979 3.941 252 HD3 ARG 56 2HD ARG 56 -13.049 5.450 2.895 253 HE ARG 56 HE ARG 56 -11.802 5.891 4.747 254 HH11 ARG 56 1HH1 ARG 56 -15.182 5.836 5.708 255 HH12 ARG 56 2HH1 ARG 56 -14.828 5.920 7.404 256 HH21 ARG 56 1HH2 ARG 56 -11.343 5.996 6.975 257 HH22 ARG 56 2HH2 ARG 56 -12.646 5.996 8.124 258 H TYR 57 H TYR 57 -10.653 8.080 2.763 259 HA TYR 57 HA TYR 57 -9.389 5.872 1.364 260 HB2 TYR 57 1HB TYR 57 -8.442 8.024 3.219 261 HB3 TYR 57 2HB TYR 57 -7.441 6.601 2.946 262 HD1 TYR 57 HD1 TYR 57 -6.664 6.083 0.628 263 HD2 TYR 57 HD2 TYR 57 -8.567 9.760 1.606 264 HE1 TYR 57 HE1 TYR 57 -5.771 7.082 -1.431 265 HE2 TYR 57 HE2 TYR 57 -7.683 10.770 -0.452 266 HH TYR 57 HH TYR 57 -6.306 8.937 -2.955 267 HA PRO 58 HA PRO 58 -10.244 2.857 4.380 268 HB2 PRO 58 1HB PRO 58 -8.283 1.088 3.875 269 HB3 PRO 58 2HB PRO 58 -9.591 1.394 2.726 270 HG2 PRO 58 1HG PRO 58 -6.792 2.458 2.743 271 HG3 PRO 58 2HG PRO 58 -7.740 1.826 1.382 272 HD2 PRO 58 1HD PRO 58 -7.437 4.481 1.876 273 HD3 PRO 58 2HD PRO 58 -8.879 3.798 1.101 274 H THR 59 H THR 59 -9.714 2.079 6.372 275 HA THR 59 HA THR 59 -7.546 3.277 7.823 276 HB THR 59 HB THR 59 -9.099 0.976 8.915 277 HG1 THR 59 HG1 THR 59 -10.803 2.612 9.375 278 HG21 THR 59 1HG2 THR 59 -7.514 2.111 10.361 279 HG22 THR 59 2HG2 THR 59 -9.155 2.435 10.915 280 HG23 THR 59 3HG2 THR 59 -8.271 3.665 10.012 281 H THR 60 H THR 60 -6.341 1.498 9.349 282 HA THR 60 HA THR 60 -4.337 0.517 7.740 283 HB THR 60 HB THR 60 -3.874 0.899 10.045 284 HG1 THR 60 HG1 THR 60 -2.737 -0.865 8.992 285 HG21 THR 60 1HG2 THR 60 -4.783 -0.487 11.851 286 HG22 THR 60 2HG2 THR 60 -5.805 -1.329 10.687 287 HG23 THR 60 3HG2 THR 60 -6.057 0.387 11.002 288 H GLU 61 H GLU 61 -7.059 -1.335 9.086 289 HA GLU 61 HA GLU 61 -6.080 -3.840 8.114 290 HB2 GLU 61 1HB GLU 61 -7.720 -3.374 10.058 291 HB3 GLU 61 2HB GLU 61 -8.950 -3.259 8.807 292 HG2 GLU 61 1HG GLU 61 -9.031 -5.460 9.649 293 HG3 GLU 61 2HG GLU 61 -8.262 -5.554 8.064 294 H GLN 62 H GLN 62 -8.320 -1.415 7.004 295 HA GLN 62 HA GLN 62 -9.552 -2.990 4.982 296 HB2 GLN 62 1HB GLN 62 -9.510 0.004 5.383 297 HB3 GLN 62 2HB GLN 62 -10.602 -0.869 4.315 298 HG2 GLN 62 1HG GLN 62 -11.714 -1.891 6.127 299 HG3 GLN 62 2HG GLN 62 -10.464 -1.394 7.267 300 HE21 GLN 62 1HE2 GLN 62 -12.676 1.132 8.169 301 HE22 GLN 62 2HE2 GLN 62 -11.932 -0.367 8.598 302 H GLY 63 H GLY 63 -6.855 -0.733 5.047 303 HA2 GLY 63 1HA GLY 63 -6.725 -0.195 2.289 304 HA3 GLY 63 2HA GLY 63 -5.394 -0.037 3.420 305 H LEU 64 H LEU 64 -4.910 -2.581 4.207 306 HA LEU 64 HA LEU 64 -3.563 -3.635 1.942 307 HB2 LEU 64 1HB LEU 64 -3.604 -4.101 4.780 308 HB3 LEU 64 2HB LEU 64 -3.528 -5.607 3.882 309 HG LEU 64 HG LEU 64 -1.304 -4.757 4.444 310 HD11 LEU 64 1HD1 LEU 64 -0.315 -4.867 2.199 311 HD12 LEU 64 2HD1 LEU 64 -1.930 -4.720 1.508 312 HD13 LEU 64 3HD1 LEU 64 -1.511 -6.130 2.478 313 HD21 LEU 64 1HD2 LEU 64 -2.052 -2.415 2.717 314 HD22 LEU 64 2HD2 LEU 64 -0.435 -2.750 3.335 315 HD23 LEU 64 3HD2 LEU 64 -1.748 -2.380 4.454 316 H GLN 65 H GLN 65 -6.551 -4.436 3.582 317 HA GLN 65 HA GLN 65 -6.872 -6.983 2.373 318 HB2 GLN 65 1HB GLN 65 -8.603 -5.189 3.983 319 HB3 GLN 65 2HB GLN 65 -9.387 -6.438 3.023 320 HG2 GLN 65 1HG GLN 65 -7.742 -8.055 4.114 321 HG3 GLN 65 2HG GLN 65 -7.424 -6.753 5.260 322 HE21 GLN 65 1HE2 GLN 65 -10.213 -9.125 6.281 323 HE22 GLN 65 2HE2 GLN 65 -8.671 -9.414 5.559 324 H ALA 66 H ALA 66 -7.442 -3.789 1.260 325 HA ALA 66 HA ALA 66 -9.674 -4.162 -0.375 326 HB1 ALA 66 1HB ALA 66 -7.389 -2.229 -0.699 327 HB2 ALA 66 2HB ALA 66 -8.865 -1.967 0.227 328 HB3 ALA 66 3HB ALA 66 -8.941 -2.120 -1.528 329 H LEU 67 H LEU 67 -6.445 -5.266 -0.844 330 HA LEU 67 HA LEU 67 -6.871 -5.678 -3.701 331 HB2 LEU 67 1HB LEU 67 -4.543 -5.844 -1.884 332 HB3 LEU 67 2HB LEU 67 -4.546 -6.915 -3.269 333 HG LEU 67 HG LEU 67 -4.485 -3.916 -3.238 334 HD11 LEU 67 1HD1 LEU 67 -2.463 -4.376 -4.648 335 HD12 LEU 67 2HD1 LEU 67 -2.665 -6.087 -4.246 336 HD13 LEU 67 3HD1 LEU 67 -2.351 -4.910 -2.970 337 HD21 LEU 67 1HD2 LEU 67 -4.541 -4.036 -5.710 338 HD22 LEU 67 2HD2 LEU 67 -6.065 -4.520 -4.970 339 HD23 LEU 67 3HD2 LEU 67 -4.959 -5.745 -5.591 340 H VAL 68 H VAL 68 -7.150 -7.455 -0.736 341 HA VAL 68 HA VAL 68 -6.913 -9.985 -2.214 342 HB VAL 68 HB VAL 68 -5.321 -9.887 -0.424 343 HG11 VAL 68 1HG1 VAL 68 -7.631 -9.405 1.454 344 HG12 VAL 68 2HG1 VAL 68 -6.394 -8.233 0.998 345 HG13 VAL 68 3HG1 VAL 68 -5.949 -9.667 1.922 346 HG21 VAL 68 1HG2 VAL 68 -7.609 -11.712 0.299 347 HG22 VAL 68 2HG2 VAL 68 -5.949 -11.873 0.873 348 HG23 VAL 68 3HG2 VAL 68 -6.310 -12.060 -0.843 349 H SER 69 H SER 69 -8.950 -8.391 0.230 350 HA SER 69 HA SER 69 -11.274 -9.799 -0.735 351 HB2 SER 69 1HB SER 69 -10.262 -10.303 2.080 352 HB3 SER 69 2HB SER 69 -11.824 -10.826 1.452 353 HG SER 69 HG SER 69 -9.853 -11.623 -0.203 354 H ALA 70 H ALA 70 -13.170 -8.744 -0.153 355 HA ALA 70 HA ALA 70 -13.025 -6.035 0.469 356 HB1 ALA 70 1HB ALA 70 -15.444 -6.118 0.746 357 HB2 ALA 70 2HB ALA 70 -15.385 -7.878 0.841 358 HB3 ALA 70 3HB ALA 70 -14.944 -7.059 -0.658 359 HA PRO 71 HA PRO 71 -12.023 -6.157 4.819 360 HB2 PRO 71 1HB PRO 71 -13.217 -3.429 4.546 361 HB3 PRO 71 2HB PRO 71 -11.708 -3.923 5.331 362 HG2 PRO 71 1HG PRO 71 -11.638 -2.763 2.958 363 HG3 PRO 71 2HG PRO 71 -10.588 -4.154 3.298 364 HD2 PRO 71 1HD PRO 71 -13.115 -4.031 1.710 365 HD3 PRO 71 2HD PRO 71 -11.638 -4.972 1.414 366 H SER 72 H SER 72 -13.194 -6.799 6.526 367 HA SER 72 HA SER 72 -16.089 -6.533 6.422 368 HB2 SER 72 1HB SER 72 -15.847 -7.989 8.575 369 HB3 SER 72 2HB SER 72 -15.544 -8.714 6.997 370 HG SER 72 HG SER 72 -13.411 -8.724 7.378 371 H ALA 73 H ALA 73 -14.730 -4.200 6.720 372 HA ALA 73 HA ALA 73 -15.701 -3.320 9.333 373 HB1 ALA 73 1HB ALA 73 -13.077 -2.474 8.095 374 HB2 ALA 73 2HB ALA 73 -13.264 -3.500 9.518 375 HB3 ALA 73 3HB ALA 73 -13.781 -1.817 9.572 376 H GLU 74 H GLU 74 -16.876 -1.476 9.192 377 HA GLU 74 HA GLU 74 -17.714 -0.677 6.599 378 HB2 GLU 74 1HB GLU 74 -18.327 0.450 9.328 379 HB3 GLU 74 2HB GLU 74 -19.112 0.973 7.845 380 HG2 GLU 74 1HG GLU 74 -19.199 -1.792 9.030 381 HG3 GLU 74 2HG GLU 74 -20.505 -0.607 9.029 382 HA PRO 75 HA PRO 75 -18.566 0.885 5.486 383 HB2 PRO 75 1HB PRO 75 -17.881 1.944 3.110 384 HB3 PRO 75 2HB PRO 75 -18.515 2.927 4.436 385 HG2 PRO 75 1HG PRO 75 -15.698 2.578 3.510 386 HG3 PRO 75 2HG PRO 75 -16.522 4.044 4.070 387 HD2 PRO 75 1HD PRO 75 -14.830 2.519 5.616 388 HD3 PRO 75 2HD PRO 75 -16.091 3.585 6.262 389 H HIS 76 H HIS 76 -18.891 -1.007 4.551 390 HA HIS 76 HA HIS 76 -16.782 -2.796 3.948 391 HB2 HIS 76 1HB HIS 76 -19.056 -3.444 4.755 392 HB3 HIS 76 2HB HIS 76 -19.701 -3.006 3.180 393 HD1 HIS 76 HD1 HIS 76 -17.426 -5.531 4.814 394 HD2 HIS 76 HD2 HIS 76 -19.476 -4.953 1.247 395 HE1 HIS 76 HE1 HIS 76 -17.242 -7.708 3.569 396 HE2 HIS 76 HE2 HIS 76 -18.704 -7.405 1.542 397 H ALA 77 H ALA 77 -15.690 -3.095 2.115 398 HA ALA 77 HA ALA 77 -15.993 -1.468 -0.151 399 HB1 ALA 77 1HB ALA 77 -14.304 -2.877 -1.182 400 HB2 ALA 77 2HB ALA 77 -14.550 -4.108 0.055 401 HB3 ALA 77 3HB ALA 77 -13.875 -2.539 0.497 402 H ARG 78 H ARG 78 -17.276 -1.597 -1.864 403 HA ARG 78 HA ARG 78 -18.812 -4.078 -2.264 404 HB2 ARG 78 1HB ARG 78 -19.463 -1.240 -3.079 405 HB3 ARG 78 2HB ARG 78 -20.456 -2.643 -3.439 406 HG2 ARG 78 1HG ARG 78 -19.806 -1.611 -0.687 407 HG3 ARG 78 2HG ARG 78 -21.327 -1.376 -1.548 408 HD2 ARG 78 1HD ARG 78 -20.151 -4.012 -0.668 409 HD3 ARG 78 2HD ARG 78 -21.524 -3.185 0.061 410 HE ARG 78 HE ARG 78 -21.943 -3.676 -2.713 411 HH11 ARG 78 1HH1 ARG 78 -22.096 -5.148 0.461 412 HH12 ARG 78 2HH1 ARG 78 -23.204 -6.390 -0.029 413 HH21 ARG 78 1HH2 ARG 78 -23.404 -5.297 -3.361 414 HH22 ARG 78 2HH2 ARG 78 -23.964 -6.461 -2.201 415 H ASN 79 H ASN 79 -19.421 -4.536 -4.520 416 HA ASN 79 HA ASN 79 -18.917 -5.032 -6.675 417 HB2 ASN 79 1HB ASN 79 -17.519 -2.351 -6.644 418 HB3 ASN 79 2HB ASN 79 -17.938 -3.267 -8.086 419 HD21 ASN 79 1HD2 ASN 79 -20.687 -0.996 -6.175 420 HD22 ASN 79 2HD2 ASN 79 -19.086 -1.217 -5.553 421 H TYR 80 H TYR 80 -17.249 -6.043 -4.675 422 HA TYR 80 HA TYR 80 -14.527 -5.822 -5.702 423 HB2 TYR 80 1HB TYR 80 -13.840 -6.938 -3.666 424 HB3 TYR 80 2HB TYR 80 -14.949 -5.637 -3.243 425 HD1 TYR 80 HD1 TYR 80 -14.299 -9.174 -3.075 426 HD2 TYR 80 HD2 TYR 80 -17.339 -6.226 -2.660 427 HE1 TYR 80 HE1 TYR 80 -15.673 -10.778 -1.823 428 HE2 TYR 80 HE2 TYR 80 -18.723 -7.825 -1.405 429 HH TYR 80 HH TYR 80 -18.959 -10.265 -1.156 430 HA PRO 81 HA PRO 81 -14.879 -9.748 -7.780 431 HB2 PRO 81 1HB PRO 81 -12.227 -10.281 -8.052 432 HB3 PRO 81 2HB PRO 81 -13.074 -9.097 -9.054 433 HG2 PRO 81 1HG PRO 81 -11.328 -8.668 -6.669 434 HG3 PRO 81 2HG PRO 81 -11.420 -7.737 -8.174 435 HD2 PRO 81 1HD PRO 81 -12.599 -6.951 -5.845 436 HD3 PRO 81 2HD PRO 81 -13.219 -6.513 -7.449 437 H GLU 82 H GLU 82 -15.082 -11.809 -7.066 438 HA GLU 82 HA GLU 82 -14.443 -12.494 -4.395 439 HB2 GLU 82 1HB GLU 82 -15.231 -14.249 -6.725 440 HB3 GLU 82 2HB GLU 82 -15.119 -14.797 -5.057 441 HG2 GLU 82 1HG GLU 82 -16.813 -13.022 -4.484 442 HG3 GLU 82 2HG GLU 82 -17.037 -12.800 -6.219 443 H GLY 83 H GLY 83 -12.634 -13.282 -3.541 444 HA2 GLY 83 1HA GLY 83 -10.572 -14.422 -3.518 445 HA3 GLY 83 2HA GLY 83 -10.607 -14.474 -5.277 446 H GLY 84 H GLY 84 -11.474 -11.485 -4.873 447 HA2 GLY 84 1HA GLY 84 -10.486 -9.422 -4.629 448 HA3 GLY 84 2HA GLY 84 -9.108 -10.211 -3.879 449 H TYR 85 H TYR 85 -7.979 -8.552 -5.123 450 HA TYR 85 HA TYR 85 -7.651 -9.119 -7.963 451 HB2 TYR 85 1HB TYR 85 -6.522 -6.994 -6.133 452 HB3 TYR 85 2HB TYR 85 -6.043 -7.165 -7.824 453 HD1 TYR 85 HD1 TYR 85 -7.678 -6.749 -9.621 454 HD2 TYR 85 HD2 TYR 85 -8.646 -6.025 -5.542 455 HE1 TYR 85 HE1 TYR 85 -9.614 -5.412 -10.325 456 HE2 TYR 85 HE2 TYR 85 -10.587 -4.688 -6.237 457 HH TYR 85 HH TYR 85 -11.728 -4.656 -9.475 458 H ILE 86 H ILE 86 -6.210 -9.675 -4.911 459 HA ILE 86 HA ILE 86 -4.311 -11.490 -6.172 460 HB ILE 86 HB ILE 86 -2.979 -9.497 -5.754 461 HG12 ILE 86 1HG1 ILE 86 -2.417 -11.636 -3.693 462 HG13 ILE 86 2HG1 ILE 86 -1.940 -11.691 -5.386 463 HG21 ILE 86 1HG2 ILE 86 -2.811 -8.365 -3.713 464 HG22 ILE 86 2HG2 ILE 86 -3.581 -9.682 -2.823 465 HG23 ILE 86 3HG2 ILE 86 -4.538 -8.679 -3.912 466 HD11 ILE 86 1HD1 ILE 86 -0.084 -11.065 -3.947 467 HD12 ILE 86 2HD1 ILE 86 -0.998 -9.674 -3.363 468 HD13 ILE 86 3HD1 ILE 86 -0.506 -9.757 -5.054 469 H ARG 87 H ARG 87 -3.972 -13.339 -4.964 470 HA ARG 87 HA ARG 87 -6.230 -14.030 -3.396 471 HB2 ARG 87 1HB ARG 87 -3.716 -15.543 -4.069 472 HB3 ARG 87 2HB ARG 87 -5.059 -16.244 -3.177 473 HG2 ARG 87 1HG ARG 87 -6.535 -15.904 -5.060 474 HG3 ARG 87 2HG ARG 87 -5.243 -15.098 -5.954 475 HD2 ARG 87 1HD ARG 87 -5.518 -17.427 -6.658 476 HD3 ARG 87 2HD ARG 87 -3.933 -17.140 -5.944 477 HE ARG 87 HE ARG 87 -5.825 -18.080 -4.025 478 HH11 ARG 87 1HH1 ARG 87 -3.674 -19.098 -6.586 479 HH12 ARG 87 2HH1 ARG 87 -3.471 -20.701 -5.952 480 HH21 ARG 87 1HH2 ARG 87 -5.550 -20.171 -3.169 481 HH22 ARG 87 2HH2 ARG 87 -4.543 -21.313 -4.002 482 H ARG 88 H ARG 88 -3.009 -13.043 -2.559 483 HA ARG 88 HA ARG 88 -3.712 -13.402 0.276 484 HB2 ARG 88 1HB ARG 88 -1.053 -13.971 -1.037 485 HB3 ARG 88 2HB ARG 88 -1.257 -13.810 0.699 486 HG2 ARG 88 1HG ARG 88 -2.737 -15.724 0.735 487 HG3 ARG 88 2HG ARG 88 -2.635 -15.859 -1.023 488 HD2 ARG 88 1HD ARG 88 -1.164 -17.465 0.104 489 HD3 ARG 88 2HD ARG 88 -0.256 -16.316 -0.874 490 HE ARG 88 HE ARG 88 -0.527 -15.626 1.929 491 HH11 ARG 88 1HH1 ARG 88 1.414 -17.190 -0.521 492 HH12 ARG 88 2HH1 ARG 88 2.886 -17.095 0.396 493 HH21 ARG 88 1HH2 ARG 88 1.411 -15.489 3.147 494 HH22 ARG 88 2HH2 ARG 88 2.884 -16.130 2.488 495 H LEU 89 H LEU 89 -2.413 -11.981 1.713 496 HA LEU 89 HA LEU 89 -2.379 -9.303 0.871 497 HB2 LEU 89 1HB LEU 89 -1.170 -10.731 3.228 498 HB3 LEU 89 2HB LEU 89 -0.890 -9.021 2.971 499 HG LEU 89 HG LEU 89 -2.660 -9.347 4.591 500 HD11 LEU 89 1HD1 LEU 89 -3.735 -8.342 1.967 501 HD12 LEU 89 2HD1 LEU 89 -2.815 -7.410 3.146 502 HD13 LEU 89 3HD1 LEU 89 -4.419 -8.014 3.558 503 HD21 LEU 89 1HD2 LEU 89 -4.073 -10.881 2.419 504 HD22 LEU 89 2HD2 LEU 89 -4.810 -10.361 3.934 505 HD23 LEU 89 3HD2 LEU 89 -3.482 -11.518 3.952 506 HA PRO 90 HA PRO 90 1.345 -9.313 -1.543 507 HB2 PRO 90 1HB PRO 90 1.740 -6.585 -1.498 508 HB3 PRO 90 2HB PRO 90 0.664 -7.424 -2.617 509 HG2 PRO 90 1HG PRO 90 0.015 -5.989 -0.079 510 HG3 PRO 90 2HG PRO 90 -0.873 -6.014 -1.614 511 HD2 PRO 90 1HD PRO 90 -1.658 -7.469 0.505 512 HD3 PRO 90 2HD PRO 90 -1.848 -8.064 -1.158 513 H GLN 91 H GLN 91 3.430 -9.491 -1.061 514 HA GLN 91 HA GLN 91 4.405 -8.314 1.454 515 HB2 GLN 91 1HB GLN 91 4.908 -11.110 0.409 516 HB3 GLN 91 2HB GLN 91 5.714 -10.402 1.801 517 HG2 GLN 91 1HG GLN 91 3.648 -10.280 3.010 518 HG3 GLN 91 2HG GLN 91 2.739 -10.797 1.591 519 HE21 GLN 91 1HE2 GLN 91 3.451 -13.605 4.021 520 HE22 GLN 91 2HE2 GLN 91 2.903 -11.981 4.255 521 H ASP 92 H ASP 92 6.544 -7.653 1.457 522 HA ASP 92 HA ASP 92 7.751 -7.141 -1.089 523 HB2 ASP 92 1HB ASP 92 9.640 -6.204 0.235 524 HB3 ASP 92 2HB ASP 92 8.086 -5.514 0.671 525 HA PRO 93 HA PRO 93 10.064 -10.702 -1.957 526 HB2 PRO 93 1HB PRO 93 12.496 -9.003 -2.164 527 HB3 PRO 93 2HB PRO 93 11.789 -10.110 -3.345 528 HG2 PRO 93 1HG PRO 93 11.530 -7.486 -3.637 529 HG3 PRO 93 2HG PRO 93 10.183 -8.577 -4.016 530 HD2 PRO 93 1HD PRO 93 10.596 -6.829 -1.628 531 HD3 PRO 93 2HD PRO 93 9.102 -7.199 -2.515 532 H TRP 94 H TRP 94 11.143 -8.712 0.668 533 HA TRP 94 HA TRP 94 13.172 -10.564 1.546 534 HB2 TRP 94 1HB TRP 94 11.943 -8.167 2.920 535 HB3 TRP 94 2HB TRP 94 13.302 -9.098 3.547 536 HD1 TRP 94 HD1 TRP 94 15.563 -9.094 1.906 537 HE1 TRP 94 HE1 TRP 94 16.516 -7.167 0.491 538 HE3 TRP 94 HE3 TRP 94 11.402 -6.144 1.661 539 HZ2 TRP 94 HZ2 TRP 94 15.618 -4.711 -0.580 540 HZ3 TRP 94 HZ3 TRP 94 11.531 -4.019 0.432 541 HH2 TRP 94 HH2 TRP 94 13.597 -3.317 -0.667 542 H GLY 95 H GLY 95 9.789 -10.012 2.069 543 HA2 GLY 95 1HA GLY 95 8.592 -12.096 2.650 544 HA3 GLY 95 2HA GLY 95 9.796 -12.329 3.907 545 H SER 96 H SER 96 8.828 -9.082 3.510 546 HA SER 96 HA SER 96 7.274 -9.315 5.988 547 HB2 SER 96 1HB SER 96 8.383 -6.800 4.733 548 HB3 SER 96 2HB SER 96 7.787 -7.008 6.380 549 HG SER 96 HG SER 96 10.190 -7.869 5.218 550 H ASP 97 H ASP 97 5.218 -8.452 6.173 551 HA ASP 97 HA ASP 97 3.793 -8.188 3.657 552 HB2 ASP 97 1HB ASP 97 1.766 -8.366 4.986 553 HB3 ASP 97 2HB ASP 97 2.886 -9.633 5.429 554 H TYR 98 H TYR 98 2.959 -6.367 2.863 555 HA TYR 98 HA TYR 98 3.973 -3.891 3.691 556 HB2 TYR 98 1HB TYR 98 1.702 -4.604 1.843 557 HB3 TYR 98 2HB TYR 98 2.209 -2.942 2.121 558 HD1 TYR 98 HD1 TYR 98 2.842 -5.985 0.327 559 HD2 TYR 98 HD2 TYR 98 4.580 -2.291 1.515 560 HE1 TYR 98 HE1 TYR 98 4.553 -6.238 -1.417 561 HE2 TYR 98 HE2 TYR 98 6.297 -2.535 -0.226 562 HH TYR 98 HH TYR 98 6.060 -4.734 -2.738 563 H GLN 99 H GLN 99 3.075 -2.161 4.740 564 HA GLN 99 HA GLN 99 0.697 -2.804 6.353 565 HB2 GLN 99 1HB GLN 99 3.098 -1.140 7.128 566 HB3 GLN 99 2HB GLN 99 1.697 -1.457 8.142 567 HG2 GLN 99 1HG GLN 99 3.538 -3.593 7.086 568 HG3 GLN 99 2HG GLN 99 3.681 -2.844 8.681 569 HE21 GLN 99 1HE2 GLN 99 1.735 -6.069 8.653 570 HE22 GLN 99 2HE2 GLN 99 3.223 -5.588 7.910 571 H LEU 100 H LEU 100 -0.898 -1.336 6.468 572 HA LEU 100 HA LEU 100 -0.491 1.257 5.126 573 HB2 LEU 100 1HB LEU 100 -2.135 -0.270 4.039 574 HB3 LEU 100 2HB LEU 100 -3.062 -0.296 5.521 575 HG LEU 100 HG LEU 100 -3.858 1.203 3.577 576 HD11 LEU 100 1HD1 LEU 100 -3.580 2.335 6.352 577 HD12 LEU 100 2HD1 LEU 100 -4.867 1.276 5.775 578 HD13 LEU 100 3HD1 LEU 100 -4.704 2.905 5.119 579 HD21 LEU 100 1HD2 LEU 100 -1.491 2.198 3.398 580 HD22 LEU 100 2HD2 LEU 100 -1.989 3.213 4.751 581 HD23 LEU 100 3HD2 LEU 100 -2.882 3.260 3.231 582 H LEU 101 H LEU 101 -0.518 2.968 6.452 583 HA LEU 101 HA LEU 101 -1.845 2.620 9.061 584 HB2 LEU 101 1HB LEU 101 0.716 2.786 8.977 585 HB3 LEU 101 2HB LEU 101 0.479 4.466 8.549 586 HG LEU 101 HG LEU 101 0.987 4.011 10.974 587 HD11 LEU 101 1HD1 LEU 101 0.006 6.119 10.284 588 HD12 LEU 101 2HD1 LEU 101 -0.653 5.603 11.836 589 HD13 LEU 101 3HD1 LEU 101 -1.609 5.413 10.366 590 HD21 LEU 101 1HD2 LEU 101 -1.842 2.972 11.013 591 HD22 LEU 101 2HD2 LEU 101 -0.779 3.191 12.402 592 HD23 LEU 101 3HD2 LEU 101 -0.391 1.983 11.178 593 H SER 102 H SER 102 -3.667 3.709 9.078 594 HA SER 102 HA SER 102 -3.774 6.384 7.868 595 HB2 SER 102 1HB SER 102 -5.512 4.816 7.103 596 HB3 SER 102 2HB SER 102 -6.016 4.548 8.769 597 HG SER 102 HG SER 102 -6.077 7.064 7.442 598 HA PRO 103 HA PRO 103 -4.321 8.317 8.039 599 HB2 PRO 103 1HB PRO 103 -3.108 10.490 9.547 600 HB3 PRO 103 2HB PRO 103 -4.663 10.458 8.715 601 HG2 PRO 103 1HG PRO 103 -4.453 10.564 11.412 602 HG3 PRO 103 2HG PRO 103 -5.796 9.749 10.589 603 HD2 PRO 103 1HD PRO 103 -3.309 8.562 11.783 604 HD3 PRO 103 2HD PRO 103 -4.996 8.010 11.917 605 H GLY 104 H GLY 104 -2.609 8.972 6.697 606 HA2 GLY 104 1HA GLY 104 -0.255 7.471 7.013 607 HA3 GLY 104 2HA GLY 104 -0.526 8.703 5.791 608 H GLN 105 H GLN 105 1.832 7.997 7.428 609 HA GLN 105 HA GLN 105 2.259 10.185 9.240 610 HB2 GLN 105 1HB GLN 105 3.302 7.942 9.527 611 HB3 GLN 105 2HB GLN 105 4.252 8.228 8.078 612 HG2 GLN 105 1HG GLN 105 5.324 10.140 9.165 613 HG3 GLN 105 2HG GLN 105 4.380 9.830 10.622 614 HE21 GLN 105 1HE2 GLN 105 7.151 8.049 11.753 615 HE22 GLN 105 2HE2 GLN 105 6.178 9.479 11.886 616 H HIS 106 H HIS 106 2.716 9.566 5.874 617 HA HIS 106 HA HIS 106 4.224 12.097 5.618 618 HB2 HIS 106 1HB HIS 106 4.285 9.744 3.720 619 HB3 HIS 106 2HB HIS 106 5.246 11.211 3.600 620 HD1 HIS 106 HD1 HIS 106 5.230 7.845 5.019 621 HD2 HIS 106 HD2 HIS 106 7.274 11.412 5.679 622 HE1 HIS 106 HE1 HIS 106 7.275 7.227 6.359 623 HE2 HIS 106 HE2 HIS 106 8.407 9.418 6.877 624 H GLY 107 H GLY 107 1.386 10.375 4.864 625 HA2 GLY 107 1HA GLY 107 0.438 12.621 3.259 626 HA3 GLY 107 2HA GLY 107 0.424 11.039 2.493 627 H GLN 108 H GLN 108 -1.813 10.989 2.285 628 HA GLN 108 HA GLN 108 -3.551 11.371 4.530 629 HB2 GLN 108 1HB GLN 108 -4.258 11.753 2.178 630 HB3 GLN 108 2HB GLN 108 -4.121 10.026 1.880 631 HG2 GLN 108 1HG GLN 108 -6.424 10.620 2.232 632 HG3 GLN 108 2HG GLN 108 -5.856 9.610 3.562 633 HE21 GLN 108 1HE2 GLN 108 -6.300 12.041 6.021 634 HE22 GLN 108 2HE2 GLN 108 -5.623 10.505 5.602 635 H VAL 109 H VAL 109 -2.373 8.566 2.729 636 HA VAL 109 HA VAL 109 -2.558 6.971 5.166 637 HB VAL 109 HB VAL 109 -3.352 4.992 3.769 638 HG11 VAL 109 1HG1 VAL 109 -4.758 6.071 5.440 639 HG12 VAL 109 2HG1 VAL 109 -5.703 5.516 4.059 640 HG13 VAL 109 3HG1 VAL 109 -5.312 7.229 4.229 641 HG21 VAL 109 1HG2 VAL 109 -4.715 5.509 1.800 642 HG22 VAL 109 2HG2 VAL 109 -3.027 5.957 1.562 643 HG23 VAL 109 3HG2 VAL 109 -4.228 7.200 1.914 644 H ASP 110 H ASP 110 -0.758 5.803 5.466 645 HA ASP 110 HA ASP 110 1.218 5.898 3.300 646 HB2 ASP 110 1HB ASP 110 1.381 6.161 6.225 647 HB3 ASP 110 2HB ASP 110 2.655 5.186 5.501 648 H ILE 111 H ILE 111 1.628 4.133 2.233 649 HA ILE 111 HA ILE 111 1.438 1.526 3.583 650 HB ILE 111 HB ILE 111 1.718 0.606 1.220 651 HG12 ILE 111 1HG1 ILE 111 1.037 3.465 0.502 652 HG13 ILE 111 2HG1 ILE 111 2.565 2.657 0.178 653 HG21 ILE 111 1HG2 ILE 111 -0.612 0.763 0.699 654 HG22 ILE 111 2HG2 ILE 111 -0.777 2.219 1.676 655 HG23 ILE 111 3HG2 ILE 111 -0.431 0.672 2.452 656 HD11 ILE 111 1HD1 ILE 111 1.271 2.737 -1.822 657 HD12 ILE 111 2HD1 ILE 111 -0.115 2.001 -1.017 658 HD13 ILE 111 3HD1 ILE 111 1.359 1.065 -1.273 659 H PHE 112 H PHE 112 3.302 0.497 4.084 660 HA PHE 112 HA PHE 112 5.749 1.281 2.697 661 HB2 PHE 112 1HB PHE 112 6.925 1.512 4.923 662 HB3 PHE 112 2HB PHE 112 5.805 2.803 4.515 663 HD1 PHE 112 HD1 PHE 112 3.794 3.151 5.776 664 HD2 PHE 112 HD2 PHE 112 6.406 -0.081 6.698 665 HE1 PHE 112 HE1 PHE 112 2.645 2.840 7.927 666 HE2 PHE 112 HE2 PHE 112 5.256 -0.399 8.848 667 HZ PHE 112 HZ PHE 112 3.373 1.064 9.466 668 H SER 113 H SER 113 7.469 -0.125 2.887 669 HA SER 113 HA SER 113 6.779 -2.865 3.647 670 HB2 SER 113 1HB SER 113 7.588 -2.798 1.426 671 HB3 SER 113 2HB SER 113 8.859 -1.647 1.835 672 HG SER 113 HG SER 113 8.717 -4.412 2.493 673 H LEU 114 H LEU 114 7.887 -3.977 5.179 674 HA LEU 114 HA LEU 114 9.322 -2.455 7.131 675 HB2 LEU 114 1HB LEU 114 8.845 -5.428 6.917 676 HB3 LEU 114 2HB LEU 114 9.637 -4.656 8.270 677 HG LEU 114 HG LEU 114 7.429 -5.100 8.966 678 HD11 LEU 114 1HD1 LEU 114 6.456 -2.907 9.357 679 HD12 LEU 114 2HD1 LEU 114 7.519 -2.211 8.134 680 HD13 LEU 114 3HD1 LEU 114 8.203 -2.895 9.608 681 HD21 LEU 114 1HD2 LEU 114 6.468 -5.507 6.742 682 HD22 LEU 114 2HD2 LEU 114 6.401 -3.765 6.470 683 HD23 LEU 114 3HD2 LEU 114 5.439 -4.498 7.752 684 H GLY 115 H GLY 115 10.145 -4.319 4.380 685 HA2 GLY 115 1HA GLY 115 12.145 -4.630 3.323 686 HA3 GLY 115 2HA GLY 115 12.814 -3.423 4.407 687 HA PRO 116 HA PRO 116 14.888 -7.473 5.304 688 HB2 PRO 116 1HB PRO 116 17.289 -5.808 5.444 689 HB3 PRO 116 2HB PRO 116 16.968 -7.218 4.433 690 HG2 PRO 116 1HG PRO 116 17.145 -4.714 3.425 691 HG3 PRO 116 2HG PRO 116 16.096 -5.957 2.721 692 HD2 PRO 116 1HD PRO 116 15.388 -3.672 4.517 693 HD3 PRO 116 2HD PRO 116 14.510 -4.308 3.109 694 H ASP 117 H ASP 117 14.910 -4.305 6.733 695 HA ASP 117 HA ASP 117 16.325 -5.111 9.113 696 HB2 ASP 117 1HB ASP 117 15.999 -2.824 9.847 697 HB3 ASP 117 2HB ASP 117 16.491 -2.813 8.157 698 H GLY 118 H GLY 118 13.105 -5.202 8.036 699 HA2 GLY 118 1HA GLY 118 11.243 -6.094 9.046 700 HA3 GLY 118 2HA GLY 118 12.243 -6.465 10.439 701 H VAL 119 H VAL 119 12.710 -3.272 9.984 702 HA VAL 119 HA VAL 119 10.667 -2.657 12.002 703 HB VAL 119 HB VAL 119 13.305 -1.252 11.532 704 HG11 VAL 119 1HG1 VAL 119 11.592 0.176 12.536 705 HG12 VAL 119 2HG1 VAL 119 12.887 -0.182 13.679 706 HG13 VAL 119 3HG1 VAL 119 11.341 -1.019 13.809 707 HG21 VAL 119 1HG2 VAL 119 13.687 -3.515 12.322 708 HG22 VAL 119 2HG2 VAL 119 12.549 -3.265 13.645 709 HG23 VAL 119 3HG2 VAL 119 14.056 -2.351 13.594 710 HA PRO 120 HA PRO 120 9.010 0.323 9.106 711 HB2 PRO 120 1HB PRO 120 7.102 1.308 10.739 712 HB3 PRO 120 2HB PRO 120 6.954 -0.272 9.961 713 HG2 PRO 120 1HG PRO 120 7.747 0.394 12.760 714 HG3 PRO 120 2HG PRO 120 6.709 -0.915 12.171 715 HD2 PRO 120 1HD PRO 120 9.340 -1.242 12.866 716 HD3 PRO 120 2HD PRO 120 8.489 -2.275 11.703 717 H GLU 121 H GLU 121 9.120 2.520 8.817 718 HA GLU 121 HA GLU 121 9.850 4.662 9.050 719 HB2 GLU 121 1HB GLU 121 9.930 4.017 12.000 720 HB3 GLU 121 2HB GLU 121 10.251 5.606 11.323 721 HG2 GLU 121 1HG GLU 121 7.995 5.720 10.454 722 HG3 GLU 121 2HG GLU 121 7.667 4.093 11.053 723 H SER 122 H SER 122 11.572 2.115 9.063 724 HA SER 122 HA SER 122 14.093 3.125 10.066 725 HB2 SER 122 1HB SER 122 14.570 0.808 8.590 726 HB3 SER 122 2HB SER 122 14.327 0.900 10.336 727 HG SER 122 HG SER 122 12.688 -0.118 8.405 728 H ASN 123 H ASN 123 16.038 2.742 8.417 729 HA ASN 123 HA ASN 123 15.697 4.509 6.237 730 HB2 ASN 123 1HB ASN 123 17.856 2.480 6.832 731 HB3 ASN 123 2HB ASN 123 17.910 3.556 5.440 732 HD21 ASN 123 1HD2 ASN 123 19.744 4.921 8.428 733 HD22 ASN 123 2HD2 ASN 123 19.717 3.357 7.692 734 H ASP 124 H ASP 124 15.732 1.018 6.483 735 HA ASP 124 HA ASP 124 15.003 0.698 3.696 736 HB2 ASP 124 1HB ASP 124 15.403 -1.342 5.900 737 HB3 ASP 124 2HB ASP 124 15.002 -1.736 4.234 738 H ASP 125 H ASP 125 13.195 2.148 4.442 739 HA ASP 125 HA ASP 125 10.860 0.402 4.841 740 HB2 ASP 125 1HB ASP 125 11.610 2.838 6.293 741 HB3 ASP 125 2HB ASP 125 9.971 2.872 5.651 742 H ILE 126 H ILE 126 10.461 0.205 2.686 743 HA ILE 126 HA ILE 126 10.457 2.545 0.983 744 HB ILE 126 HB ILE 126 9.747 -0.317 0.329 745 HG12 ILE 126 1HG1 ILE 126 12.302 1.230 -0.177 746 HG13 ILE 126 2HG1 ILE 126 12.095 0.000 1.066 747 HG21 ILE 126 1HG2 ILE 126 10.425 1.927 -1.565 748 HG22 ILE 126 2HG2 ILE 126 8.776 1.460 -1.156 749 HG23 ILE 126 3HG2 ILE 126 9.840 0.308 -1.970 750 HD11 ILE 126 1HD1 ILE 126 13.260 -0.872 -0.882 751 HD12 ILE 126 2HD1 ILE 126 11.885 -0.448 -1.902 752 HD13 ILE 126 3HD1 ILE 126 11.709 -1.679 -0.652 753 H GLY 127 H GLY 127 8.781 3.847 1.315 754 HA2 GLY 127 1HA GLY 127 6.084 2.653 1.211 755 HA3 GLY 127 2HA GLY 127 6.467 4.130 2.087 756 H ASN 128 H ASN 128 4.437 4.370 0.442 757 HA ASN 128 HA ASN 128 4.965 4.871 -2.258 758 HB2 ASN 128 1HB ASN 128 2.872 6.305 -2.176 759 HB3 ASN 128 2HB ASN 128 2.690 4.636 -1.659 760 HD21 ASN 128 1HD2 ASN 128 0.824 6.084 0.933 761 HD22 ASN 128 2HD2 ASN 128 0.766 5.278 -0.606 762 H TRP 129 H TRP 129 5.272 6.949 0.540 763 HA TRP 129 HA TRP 129 5.872 9.304 -0.989 764 HB2 TRP 129 1HB TRP 129 4.841 9.456 1.227 765 HB3 TRP 129 2HB TRP 129 6.247 8.684 1.950 766 HD1 TRP 129 HD1 TRP 129 5.089 12.010 0.464 767 HE1 TRP 129 HE1 TRP 129 6.748 13.848 1.160 768 HE3 TRP 129 HE3 TRP 129 8.679 9.085 2.632 769 HZ2 TRP 129 HZ2 TRP 129 9.247 14.036 2.455 770 HZ3 TRP 129 HZ3 TRP 129 10.673 10.174 3.578 771 HH2 TRP 129 HH2 TRP 129 10.949 12.598 3.490 772 H THR 130 H THR 130 7.683 6.696 0.453 773 HA THR 130 HA THR 130 10.201 7.942 0.613 774 HB THR 130 HB THR 130 9.842 5.004 0.085 775 HG1 THR 130 HG1 THR 130 9.609 6.139 2.672 776 HG21 THR 130 1HG2 THR 130 11.725 6.575 1.849 777 HG22 THR 130 2HG2 THR 130 12.128 5.843 0.296 778 HG23 THR 130 3HG2 THR 130 11.710 4.821 1.672 779 H ILE 131 H ILE 131 8.730 5.902 -1.893 780 HA ILE 131 HA ILE 131 10.925 6.379 -3.710 781 HB ILE 131 HB ILE 131 9.795 4.226 -3.797 782 HG12 ILE 131 1HG1 ILE 131 9.275 4.136 -6.235 783 HG13 ILE 131 2HG1 ILE 131 9.329 5.896 -6.276 784 HG21 ILE 131 1HG2 ILE 131 7.588 4.823 -3.086 785 HG22 ILE 131 2HG2 ILE 131 7.484 4.049 -4.666 786 HG23 ILE 131 3HG2 ILE 131 7.340 5.802 -4.531 787 HD11 ILE 131 1HD1 ILE 131 11.401 4.874 -7.081 788 HD12 ILE 131 2HD1 ILE 131 11.624 4.105 -5.510 789 HD13 ILE 131 3HD1 ILE 131 11.666 5.862 -5.644 790 H GLY 132 H GLY 132 7.770 7.634 -3.038 791 HA2 GLY 132 1HA GLY 132 6.914 9.700 -3.462 792 HA3 GLY 132 2HA GLY 132 8.473 10.139 -4.131 793 H PHE 133 H PHE 133 6.260 7.611 -5.298 794 HA PHE 133 HA PHE 133 6.534 8.679 -7.947 795 HB2 PHE 133 1HB PHE 133 4.972 6.802 -8.594 796 HB3 PHE 133 2HB PHE 133 6.488 6.320 -7.850 797 HD1 PHE 133 HD1 PHE 133 3.188 7.388 -6.432 798 HD2 PHE 133 HD2 PHE 133 6.194 4.390 -6.688 799 HE1 PHE 133 HE1 PHE 133 1.952 6.015 -4.812 800 HE2 PHE 133 HE2 PHE 133 4.964 3.014 -5.066 801 HZ PHE 133 HZ PHE 133 2.841 3.824 -4.124 802 H HIS 134 H HIS 134 4.763 9.844 -5.548 803 HA HIS 134 HA HIS 134 2.253 10.226 -6.909 804 HB2 HIS 134 1HB HIS 134 3.407 11.518 -4.433 805 HB3 HIS 134 2HB HIS 134 1.823 11.914 -5.080 806 HD1 HIS 134 HD1 HIS 134 2.602 10.490 -2.267 807 HD2 HIS 134 HD2 HIS 134 0.908 8.738 -5.633 808 HE1 HIS 134 HE1 HIS 134 1.407 8.439 -1.433 809 HE2 HIS 134 HE2 HIS 134 0.255 7.479 -3.467 810 H HIS 135 H HIS 135 5.286 11.915 -6.581 811 HA HIS 135 HA HIS 135 4.260 14.033 -8.333 812 HB2 HIS 135 1HB HIS 135 6.376 15.239 -7.820 813 HB3 HIS 135 2HB HIS 135 5.401 14.928 -6.393 814 HD1 HIS 135 HD1 HIS 135 6.431 13.502 -4.554 815 HD2 HIS 135 HD2 HIS 135 8.789 13.739 -7.970 816 HE1 HIS 135 HE1 HIS 135 8.665 12.545 -3.909 817 HE2 HIS 135 HE2 HIS 135 9.979 12.480 -6.051 818 H HIS 136 H HIS 136 5.003 14.284 -10.376 819 HA HIS 136 HA HIS 136 6.829 12.173 -11.315 820 HB2 HIS 136 1HB HIS 136 4.551 13.524 -12.773 821 HB3 HIS 136 2HB HIS 136 5.694 12.423 -13.530 822 HD1 HIS 136 HD1 HIS 136 5.252 9.948 -13.290 823 HD2 HIS 136 HD2 HIS 136 2.812 12.272 -10.858 824 HE1 HIS 136 HE1 HIS 136 3.543 8.370 -12.341 825 HE2 HIS 136 HE2 HIS 136 1.951 9.847 -11.066 826 H HIS 137 H HIS 137 8.222 12.693 -13.078 827 HA HIS 137 HA HIS 137 8.769 15.570 -13.381 828 HB2 HIS 137 1HB HIS 137 10.799 13.336 -13.113 829 HB3 HIS 137 2HB HIS 137 11.191 15.000 -13.522 830 HD1 HIS 137 HD1 HIS 137 11.457 12.912 -10.773 831 HD2 HIS 137 HD2 HIS 137 9.852 16.719 -11.260 832 HE1 HIS 137 HE1 HIS 137 11.447 13.944 -8.481 833 HE2 HIS 137 HE2 HIS 137 10.639 16.304 -8.833 834 H HIS 138 H HIS 138 10.313 15.856 -15.359 835 HA HIS 138 HA HIS 138 10.601 15.773 -17.604 836 HB2 HIS 138 1HB HIS 138 9.839 12.856 -17.334 837 HB3 HIS 138 2HB HIS 138 10.619 13.593 -18.729 838 HD1 HIS 138 HD1 HIS 138 11.449 11.551 -16.020 839 HD2 HIS 138 HD2 HIS 138 13.206 14.933 -17.682 840 HE1 HIS 138 HE1 HIS 138 13.844 11.510 -15.261 841 HE2 HIS 138 HE2 HIS 138 14.911 13.519 -16.341 842 H HIS 139 H HIS 139 8.768 17.171 -17.767 843 HA HIS 139 HA HIS 139 6.164 16.108 -18.306 844 HB2 HIS 139 1HB HIS 139 6.545 18.354 -17.290 845 HB3 HIS 139 2HB HIS 139 7.230 18.897 -18.817 846 HD1 HIS 139 HD1 HIS 139 3.980 18.011 -17.185 847 HD2 HIS 139 HD2 HIS 139 5.363 19.474 -20.819 848 HE1 HIS 139 HE1 HIS 139 1.940 18.835 -18.399 849 HE2 HIS 139 HE2 HIS 139 2.782 19.553 -20.661 850 H LYS 140 H LYS 140 6.264 14.744 -20.052 851 HA LYS 140 HA LYS 140 7.305 15.814 -22.575 852 HB2 LYS 140 1HB LYS 140 6.566 13.005 -21.747 853 HB3 LYS 140 2HB LYS 140 7.028 13.448 -23.383 854 HG2 LYS 140 1HG LYS 140 9.214 14.184 -22.556 855 HG3 LYS 140 2HG LYS 140 8.747 13.699 -20.924 856 HD2 LYS 140 1HD LYS 140 8.557 11.400 -21.605 857 HD3 LYS 140 2HD LYS 140 8.824 11.835 -23.294 858 HE2 LYS 140 1HE LYS 140 10.824 12.231 -21.072 859 HE3 LYS 140 2HE LYS 140 10.823 10.871 -22.193 860 HZ1 LYS 140 1HZ LYS 140 11.080 12.471 -24.020 861 HZ2 LYS 140 2HZ LYS 140 12.370 12.534 -22.931 862 HZ3 LYS 140 3HZ LYS 140 11.183 13.733 -22.901 Start of MODEL 10 1 H1 MET 25 1H MET 25 25.691 -1.928 -0.990 2 H2 MET 25 2H MET 25 24.068 -1.680 -1.378 3 H3 MET 25 3H MET 25 25.076 -0.358 -1.084 4 HA MET 25 HA MET 25 24.679 -0.610 -3.434 5 HB2 MET 25 1HB MET 25 26.859 0.259 -2.637 6 HB3 MET 25 2HB MET 25 27.498 -1.376 -2.638 7 HG2 MET 25 1HG MET 25 27.210 -1.507 -5.046 8 HG3 MET 25 2HG MET 25 26.518 0.114 -5.061 9 HE1 MET 25 1HE MET 25 28.302 0.814 -6.941 10 HE2 MET 25 2HE MET 25 28.959 -0.821 -6.888 11 HE3 MET 25 3HE MET 25 30.039 0.567 -6.761 12 H GLY 26 H GLY 26 23.370 -2.320 -4.028 13 HA2 GLY 26 1HA GLY 26 24.804 -4.676 -4.988 14 HA3 GLY 26 2HA GLY 26 23.484 -4.941 -3.859 15 H ASN 27 H ASN 27 24.071 -5.347 -6.900 16 HA ASN 27 HA ASN 27 22.059 -3.876 -8.261 17 HB2 ASN 27 1HB ASN 27 23.965 -4.867 -9.448 18 HB3 ASN 27 2HB ASN 27 23.409 -6.481 -9.016 19 HD21 ASN 27 1HD2 ASN 27 21.721 -4.439 -12.088 20 HD22 ASN 27 2HD2 ASN 27 22.828 -3.680 -10.998 21 H LYS 28 H LYS 28 22.122 -6.925 -6.553 22 HA LYS 28 HA LYS 28 19.635 -7.918 -7.477 23 HB2 LYS 28 1HB LYS 28 21.411 -9.278 -6.354 24 HB3 LYS 28 2HB LYS 28 20.995 -8.495 -4.838 25 HG2 LYS 28 1HG LYS 28 19.945 -10.639 -4.907 26 HG3 LYS 28 2HG LYS 28 18.700 -9.399 -5.051 27 HD2 LYS 28 1HD LYS 28 18.206 -11.142 -6.616 28 HD3 LYS 28 2HD LYS 28 18.750 -9.732 -7.524 29 HE2 LYS 28 1HE LYS 28 20.984 -10.725 -7.704 30 HE3 LYS 28 2HE LYS 28 20.427 -12.134 -6.806 31 HZ1 LYS 28 1HZ LYS 28 18.830 -12.569 -8.581 32 HZ2 LYS 28 2HZ LYS 28 20.415 -12.563 -9.169 33 HZ3 LYS 28 3HZ LYS 28 19.407 -11.236 -9.445 34 H GLU 29 H GLU 29 20.570 -5.770 -4.877 35 HA GLU 29 HA GLU 29 18.190 -5.671 -3.401 36 HB2 GLU 29 1HB GLU 29 20.362 -4.644 -2.730 37 HB3 GLU 29 2HB GLU 29 20.122 -3.405 -3.952 38 HG2 GLU 29 1HG GLU 29 19.507 -2.498 -1.844 39 HG3 GLU 29 2HG GLU 29 18.034 -2.742 -2.782 40 H LYS 30 H LYS 30 19.207 -3.974 -6.303 41 HA LYS 30 HA LYS 30 17.079 -2.181 -6.536 42 HB2 LYS 30 1HB LYS 30 18.650 -3.545 -8.730 43 HB3 LYS 30 2HB LYS 30 17.642 -2.120 -8.938 44 HG2 LYS 30 1HG LYS 30 19.097 -0.872 -7.417 45 HG3 LYS 30 2HG LYS 30 20.112 -2.303 -7.226 46 HD2 LYS 30 1HD LYS 30 20.663 -2.263 -9.588 47 HD3 LYS 30 2HD LYS 30 19.581 -0.894 -9.840 48 HE2 LYS 30 1HE LYS 30 20.968 0.441 -8.289 49 HE3 LYS 30 2HE LYS 30 22.075 -0.924 -8.146 50 HZ1 LYS 30 1HZ LYS 30 22.490 -0.772 -10.531 51 HZ2 LYS 30 2HZ LYS 30 22.882 0.674 -9.747 52 HZ3 LYS 30 3HZ LYS 30 21.455 0.558 -10.642 53 H ALA 31 H ALA 31 17.457 -5.492 -7.731 54 HA ALA 31 HA ALA 31 14.998 -5.647 -9.094 55 HB1 ALA 31 1HB ALA 31 15.348 -8.062 -9.081 56 HB2 ALA 31 2HB ALA 31 16.625 -7.876 -7.879 57 HB3 ALA 31 3HB ALA 31 16.834 -7.207 -9.497 58 H ASP 32 H ASP 32 15.918 -6.472 -5.771 59 HA ASP 32 HA ASP 32 13.461 -7.635 -5.023 60 HB2 ASP 32 1HB ASP 32 15.703 -6.390 -3.465 61 HB3 ASP 32 2HB ASP 32 14.218 -6.862 -2.650 62 H ARG 33 H ARG 33 14.655 -4.302 -4.684 63 HA ARG 33 HA ARG 33 12.312 -3.447 -3.340 64 HB2 ARG 33 1HB ARG 33 13.127 -1.181 -3.580 65 HB3 ARG 33 2HB ARG 33 14.413 -2.252 -3.052 66 HG2 ARG 33 1HG ARG 33 15.294 -2.304 -5.333 67 HG3 ARG 33 2HG ARG 33 14.008 -1.205 -5.842 68 HD2 ARG 33 1HD ARG 33 14.813 0.480 -4.285 69 HD3 ARG 33 2HD ARG 33 16.072 -0.619 -3.732 70 HE ARG 33 HE ARG 33 16.005 0.141 -6.556 71 HH11 ARG 33 1HH1 ARG 33 17.544 0.324 -3.412 72 HH12 ARG 33 2HH1 ARG 33 19.011 1.012 -4.032 73 HH21 ARG 33 1HH2 ARG 33 17.927 1.063 -7.371 74 HH22 ARG 33 2HH2 ARG 33 19.227 1.438 -6.282 75 H GLN 34 H GLN 34 13.260 -3.476 -6.733 76 HA GLN 34 HA GLN 34 11.189 -1.886 -7.750 77 HB2 GLN 34 1HB GLN 34 12.706 -4.199 -8.940 78 HB3 GLN 34 2HB GLN 34 11.472 -3.331 -9.845 79 HG2 GLN 34 1HG GLN 34 12.725 -1.265 -9.605 80 HG3 GLN 34 2HG GLN 34 13.946 -2.103 -8.650 81 HE21 GLN 34 1HE2 GLN 34 13.875 -2.401 -12.695 82 HE22 GLN 34 2HE2 GLN 34 12.581 -1.668 -11.814 83 H LYS 35 H LYS 35 11.265 -5.301 -6.883 84 HA LYS 35 HA LYS 35 8.647 -5.939 -7.778 85 HB2 LYS 35 1HB LYS 35 10.440 -7.600 -7.180 86 HB3 LYS 35 2HB LYS 35 10.156 -7.213 -5.488 87 HG2 LYS 35 1HG LYS 35 7.777 -7.907 -5.818 88 HG3 LYS 35 2HG LYS 35 8.234 -8.478 -7.423 89 HD2 LYS 35 1HD LYS 35 9.950 -9.924 -6.329 90 HD3 LYS 35 2HD LYS 35 9.279 -9.449 -4.769 91 HE2 LYS 35 1HE LYS 35 7.075 -10.314 -5.526 92 HE3 LYS 35 2HE LYS 35 7.857 -10.907 -6.990 93 HZ1 LYS 35 1HZ LYS 35 7.715 -12.689 -5.443 94 HZ2 LYS 35 2HZ LYS 35 8.396 -11.763 -4.204 95 HZ3 LYS 35 3HZ LYS 35 9.340 -12.228 -5.524 96 H VAL 36 H VAL 36 9.967 -4.705 -4.773 97 HA VAL 36 HA VAL 36 7.659 -4.806 -3.188 98 HB VAL 36 HB VAL 36 9.994 -2.885 -3.117 99 HG11 VAL 36 1HG1 VAL 36 8.120 -1.853 -1.992 100 HG12 VAL 36 2HG1 VAL 36 9.305 -2.397 -0.802 101 HG13 VAL 36 3HG1 VAL 36 7.829 -3.327 -1.066 102 HG21 VAL 36 1HG2 VAL 36 10.585 -5.223 -2.759 103 HG22 VAL 36 2HG2 VAL 36 9.377 -5.338 -1.480 104 HG23 VAL 36 3HG2 VAL 36 10.776 -4.284 -1.279 105 H VAL 37 H VAL 37 8.936 -2.222 -5.259 106 HA VAL 37 HA VAL 37 6.928 -0.339 -4.758 107 HB VAL 37 HB VAL 37 8.549 -0.685 -7.285 108 HG11 VAL 37 1HG1 VAL 37 8.072 1.690 -7.670 109 HG12 VAL 37 2HG1 VAL 37 7.027 1.708 -6.250 110 HG13 VAL 37 3HG1 VAL 37 6.594 0.727 -7.650 111 HG21 VAL 37 1HG2 VAL 37 9.979 -0.424 -5.354 112 HG22 VAL 37 2HG2 VAL 37 9.041 0.968 -4.812 113 HG23 VAL 37 3HG2 VAL 37 9.984 1.066 -6.299 114 H SER 38 H SER 38 7.068 -2.991 -7.097 115 HA SER 38 HA SER 38 4.775 -2.303 -8.564 116 HB2 SER 38 1HB SER 38 5.939 -5.039 -8.023 117 HB3 SER 38 2HB SER 38 4.773 -4.658 -9.292 118 HG SER 38 HG SER 38 6.566 -2.958 -9.772 119 H ASP 39 H ASP 39 5.118 -4.369 -5.666 120 HA ASP 39 HA ASP 39 2.322 -4.872 -5.453 121 HB2 ASP 39 1HB ASP 39 4.653 -5.200 -3.609 122 HB3 ASP 39 2HB ASP 39 3.027 -5.272 -2.942 123 H LEU 40 H LEU 40 4.483 -2.412 -4.283 124 HA LEU 40 HA LEU 40 2.813 -1.136 -2.431 125 HB2 LEU 40 1HB LEU 40 5.280 -0.820 -2.764 126 HB3 LEU 40 2HB LEU 40 4.912 0.139 -4.181 127 HG LEU 40 HG LEU 40 3.676 1.733 -2.712 128 HD11 LEU 40 1HD1 LEU 40 3.139 0.269 -0.871 129 HD12 LEU 40 2HD1 LEU 40 4.123 1.610 -0.290 130 HD13 LEU 40 3HD1 LEU 40 4.851 0.023 -0.525 131 HD21 LEU 40 1HD2 LEU 40 5.696 2.742 -1.768 132 HD22 LEU 40 2HD2 LEU 40 5.970 2.158 -3.411 133 HD23 LEU 40 3HD2 LEU 40 6.572 1.235 -2.033 134 H VAL 41 H VAL 41 3.314 -0.473 -5.908 135 HA VAL 41 HA VAL 41 1.443 1.639 -6.028 136 HB VAL 41 HB VAL 41 1.433 1.399 -8.442 137 HG11 VAL 41 1HG1 VAL 41 3.299 2.555 -7.410 138 HG12 VAL 41 2HG1 VAL 41 3.824 1.698 -8.859 139 HG13 VAL 41 3HG1 VAL 41 4.182 1.034 -7.266 140 HG21 VAL 41 1HG2 VAL 41 1.366 -1.013 -8.658 141 HG22 VAL 41 2HG2 VAL 41 3.000 -1.137 -8.005 142 HG23 VAL 41 3HG2 VAL 41 2.730 -0.356 -9.562 143 H ALA 42 H ALA 42 1.103 -1.857 -6.378 144 HA ALA 42 HA ALA 42 -1.603 -1.914 -7.131 145 HB1 ALA 42 1HB ALA 42 -0.273 -3.923 -7.197 146 HB2 ALA 42 2HB ALA 42 -1.635 -4.176 -6.105 147 HB3 ALA 42 3HB ALA 42 -0.026 -3.864 -5.451 148 H LEU 43 H LEU 43 -0.066 -1.731 -3.937 149 HA LEU 43 HA LEU 43 -2.396 -1.804 -2.369 150 HB2 LEU 43 1HB LEU 43 0.233 -0.397 -1.890 151 HB3 LEU 43 2HB LEU 43 -1.014 -0.583 -0.672 152 HG LEU 43 HG LEU 43 0.499 -2.841 -1.984 153 HD11 LEU 43 1HD1 LEU 43 1.910 -1.545 -0.511 154 HD12 LEU 43 2HD1 LEU 43 1.508 -3.084 0.250 155 HD13 LEU 43 3HD1 LEU 43 0.686 -1.608 0.757 156 HD21 LEU 43 1HD2 LEU 43 -1.756 -3.507 -1.357 157 HD22 LEU 43 2HD2 LEU 43 -1.523 -2.834 0.256 158 HD23 LEU 43 3HD2 LEU 43 -0.574 -4.226 -0.264 159 H GLU 44 H GLU 44 -0.569 0.942 -3.663 160 HA GLU 44 HA GLU 44 -2.237 2.969 -2.657 161 HB2 GLU 44 1HB GLU 44 0.106 3.205 -3.564 162 HB3 GLU 44 2HB GLU 44 -0.566 3.055 -5.176 163 HG2 GLU 44 1HG GLU 44 -1.535 5.181 -3.310 164 HG3 GLU 44 2HG GLU 44 -0.051 5.392 -4.236 165 H GLY 45 H GLY 45 -2.235 1.171 -5.686 166 HA2 GLY 45 1HA GLY 45 -4.332 2.532 -6.970 167 HA3 GLY 45 2HA GLY 45 -3.839 0.876 -7.292 168 H ALA 46 H ALA 46 -4.362 -0.331 -4.860 169 HA ALA 46 HA ALA 46 -7.132 -0.798 -4.975 170 HB1 ALA 46 1HB ALA 46 -6.827 -2.171 -3.030 171 HB2 ALA 46 2HB ALA 46 -5.296 -1.378 -2.658 172 HB3 ALA 46 3HB ALA 46 -5.440 -2.382 -4.098 173 H LEU 47 H LEU 47 -5.179 1.235 -2.863 174 HA LEU 47 HA LEU 47 -7.204 2.099 -1.117 175 HB2 LEU 47 1HB LEU 47 -4.545 3.122 -1.977 176 HB3 LEU 47 2HB LEU 47 -5.609 4.241 -1.152 177 HG LEU 47 HG LEU 47 -5.521 3.046 0.857 178 HD11 LEU 47 1HD1 LEU 47 -4.369 0.707 -0.657 179 HD12 LEU 47 2HD1 LEU 47 -5.998 0.817 0.010 180 HD13 LEU 47 3HD1 LEU 47 -4.604 0.787 1.088 181 HD21 LEU 47 1HD2 LEU 47 -3.159 2.746 1.318 182 HD22 LEU 47 2HD2 LEU 47 -3.419 4.176 0.320 183 HD23 LEU 47 3HD2 LEU 47 -2.814 2.690 -0.410 184 H ASP 48 H ASP 48 -6.018 3.476 -4.157 185 HA ASP 48 HA ASP 48 -7.802 5.644 -4.295 186 HB2 ASP 48 1HB ASP 48 -5.888 5.651 -5.710 187 HB3 ASP 48 2HB ASP 48 -6.310 4.095 -6.410 188 H MET 49 H MET 49 -8.072 2.312 -5.462 189 HA MET 49 HA MET 49 -10.555 2.633 -6.782 190 HB2 MET 49 1HB MET 49 -9.297 0.167 -5.568 191 HB3 MET 49 2HB MET 49 -10.725 0.152 -6.595 192 HG2 MET 49 1HG MET 49 -9.450 1.024 -8.448 193 HG3 MET 49 2HG MET 49 -8.021 1.172 -7.428 194 HE1 MET 49 1HE MET 49 -6.466 -0.190 -9.001 195 HE2 MET 49 2HE MET 49 -7.784 -0.278 -10.168 196 HE3 MET 49 3HE MET 49 -6.902 -1.738 -9.724 197 H TYR 50 H TYR 50 -9.705 1.647 -3.493 198 HA TYR 50 HA TYR 50 -12.329 1.165 -2.592 199 HB2 TYR 50 1HB TYR 50 -10.426 0.381 -1.306 200 HB3 TYR 50 2HB TYR 50 -9.856 2.030 -1.073 201 HD1 TYR 50 HD1 TYR 50 -10.991 3.529 0.490 202 HD2 TYR 50 HD2 TYR 50 -12.246 -0.511 0.033 203 HE1 TYR 50 HE1 TYR 50 -12.281 3.705 2.566 204 HE2 TYR 50 HE2 TYR 50 -13.545 -0.340 2.117 205 HH TYR 50 HH TYR 50 -13.761 0.935 4.055 206 H LYS 51 H LYS 51 -10.345 4.096 -2.668 207 HA LYS 51 HA LYS 51 -12.173 5.728 -1.242 208 HB2 LYS 51 1HB LYS 51 -9.771 6.293 -1.600 209 HB3 LYS 51 2HB LYS 51 -10.132 6.604 -3.294 210 HG2 LYS 51 1HG LYS 51 -11.769 8.335 -2.548 211 HG3 LYS 51 2HG LYS 51 -11.179 8.097 -0.904 212 HD2 LYS 51 1HD LYS 51 -8.925 8.726 -1.629 213 HD3 LYS 51 2HD LYS 51 -9.529 8.974 -3.268 214 HE2 LYS 51 1HE LYS 51 -11.076 10.692 -2.394 215 HE3 LYS 51 2HE LYS 51 -10.359 10.488 -0.796 216 HZ1 LYS 51 1HZ LYS 51 -9.064 11.531 -3.251 217 HZ2 LYS 51 2HZ LYS 51 -8.187 11.090 -1.871 218 HZ3 LYS 51 3HZ LYS 51 -9.320 12.341 -1.791 219 H LEU 52 H LEU 52 -11.819 4.942 -4.653 220 HA LEU 52 HA LEU 52 -13.675 6.803 -5.655 221 HB2 LEU 52 1HB LEU 52 -12.138 5.517 -7.074 222 HB3 LEU 52 2HB LEU 52 -12.992 4.041 -6.671 223 HG LEU 52 HG LEU 52 -15.032 4.997 -7.763 224 HD11 LEU 52 1HD1 LEU 52 -13.098 7.114 -8.693 225 HD12 LEU 52 2HD1 LEU 52 -14.457 7.357 -7.596 226 HD13 LEU 52 3HD1 LEU 52 -14.749 6.896 -9.273 227 HD21 LEU 52 1HD2 LEU 52 -13.556 3.414 -8.905 228 HD22 LEU 52 2HD2 LEU 52 -12.584 4.758 -9.508 229 HD23 LEU 52 3HD2 LEU 52 -14.258 4.577 -10.027 230 H ASP 53 H ASP 53 -14.045 3.547 -4.369 231 HA ASP 53 HA ASP 53 -16.846 3.384 -4.950 232 HB2 ASP 53 1HB ASP 53 -15.410 1.387 -4.852 233 HB3 ASP 53 2HB ASP 53 -15.141 1.669 -3.137 234 H ASN 54 H ASN 54 -14.946 3.992 -2.011 235 HA ASN 54 HA ASN 54 -17.460 4.207 -0.500 236 HB2 ASN 54 1HB ASN 54 -14.644 3.677 0.459 237 HB3 ASN 54 2HB ASN 54 -16.046 3.842 1.513 238 HD21 ASN 54 1HD2 ASN 54 -15.402 0.445 -0.597 239 HD22 ASN 54 2HD2 ASN 54 -14.475 1.874 -0.877 240 H SER 55 H SER 55 -15.259 6.179 -1.922 241 HA SER 55 HA SER 55 -14.889 8.409 -1.857 242 HB2 SER 55 1HB SER 55 -17.172 8.460 0.115 243 HB3 SER 55 2HB SER 55 -16.560 9.834 -0.805 244 HG SER 55 HG SER 55 -17.084 8.441 -2.715 245 H ARG 56 H ARG 56 -13.391 6.722 -0.021 246 HA ARG 56 HA ARG 56 -12.161 8.768 1.507 247 HB2 ARG 56 1HB ARG 56 -12.677 8.120 3.729 248 HB3 ARG 56 2HB ARG 56 -14.210 8.255 2.886 249 HG2 ARG 56 1HG ARG 56 -14.682 6.252 3.741 250 HG3 ARG 56 2HG ARG 56 -13.542 5.601 2.559 251 HD2 ARG 56 1HD ARG 56 -11.722 5.920 4.200 252 HD3 ARG 56 2HD ARG 56 -12.916 6.451 5.380 253 HE ARG 56 HE ARG 56 -13.316 3.809 4.231 254 HH11 ARG 56 1HH1 ARG 56 -12.133 5.740 6.905 255 HH12 ARG 56 2HH1 ARG 56 -12.073 4.402 8.007 256 HH21 ARG 56 1HH2 ARG 56 -13.209 2.044 5.668 257 HH22 ARG 56 2HH2 ARG 56 -12.687 2.299 7.306 258 H TYR 57 H TYR 57 -10.365 7.873 2.881 259 HA TYR 57 HA TYR 57 -9.077 5.720 1.418 260 HB2 TYR 57 1HB TYR 57 -8.098 7.589 3.580 261 HB3 TYR 57 2HB TYR 57 -7.105 6.330 2.855 262 HD1 TYR 57 HD1 TYR 57 -8.103 9.710 2.643 263 HD2 TYR 57 HD2 TYR 57 -6.891 6.404 0.262 264 HE1 TYR 57 HE1 TYR 57 -7.472 11.252 0.837 265 HE2 TYR 57 HE2 TYR 57 -6.252 7.932 -1.552 266 HH TYR 57 HH TYR 57 -5.871 11.217 -1.149 267 HA PRO 58 HA PRO 58 -10.250 2.632 4.294 268 HB2 PRO 58 1HB PRO 58 -8.457 0.712 3.673 269 HB3 PRO 58 2HB PRO 58 -9.777 1.162 2.586 270 HG2 PRO 58 1HG PRO 58 -6.904 2.010 2.522 271 HG3 PRO 58 2HG PRO 58 -7.941 1.484 1.184 272 HD2 PRO 58 1HD PRO 58 -7.435 4.096 1.696 273 HD3 PRO 58 2HD PRO 58 -8.977 3.538 1.016 274 H THR 59 H THR 59 -9.714 1.729 6.249 275 HA THR 59 HA THR 59 -7.571 2.952 7.707 276 HB THR 59 HB THR 59 -8.448 1.389 9.548 277 HG1 THR 59 HG1 THR 59 -10.542 0.529 9.083 278 HG21 THR 59 1HG2 THR 59 -10.268 3.415 8.247 279 HG22 THR 59 2HG2 THR 59 -9.053 3.726 9.489 280 HG23 THR 59 3HG2 THR 59 -10.484 2.771 9.874 281 H THR 60 H THR 60 -6.349 1.294 9.294 282 HA THR 60 HA THR 60 -4.405 0.135 7.712 283 HB THR 60 HB THR 60 -4.006 0.789 10.036 284 HG1 THR 60 HG1 THR 60 -2.600 -0.747 9.039 285 HG21 THR 60 1HG2 THR 60 -5.579 -1.683 10.761 286 HG22 THR 60 2HG2 THR 60 -6.075 -0.016 11.049 287 HG23 THR 60 3HG2 THR 60 -4.669 -0.673 11.884 288 H GLU 61 H GLU 61 -7.234 -1.424 9.161 289 HA GLU 61 HA GLU 61 -6.448 -4.073 8.420 290 HB2 GLU 61 1HB GLU 61 -8.060 -3.488 10.263 291 HB3 GLU 61 2HB GLU 61 -9.226 -3.040 9.028 292 HG2 GLU 61 1HG GLU 61 -9.765 -5.224 9.766 293 HG3 GLU 61 2HG GLU 61 -9.077 -5.369 8.149 294 H GLN 62 H GLN 62 -8.616 -1.631 7.085 295 HA GLN 62 HA GLN 62 -9.650 -3.344 5.057 296 HB2 GLN 62 1HB GLN 62 -9.855 -0.349 5.360 297 HB3 GLN 62 2HB GLN 62 -10.810 -1.333 4.258 298 HG2 GLN 62 1HG GLN 62 -11.739 -2.544 6.191 299 HG3 GLN 62 2HG GLN 62 -10.834 -1.479 7.263 300 HE21 GLN 62 1HE2 GLN 62 -13.775 0.375 7.442 301 HE22 GLN 62 2HE2 GLN 62 -12.667 -0.688 8.239 302 H GLY 63 H GLY 63 -7.001 -1.086 5.224 303 HA2 GLY 63 1HA GLY 63 -6.742 -0.525 2.477 304 HA3 GLY 63 2HA GLY 63 -5.461 -0.397 3.669 305 H LEU 64 H LEU 64 -5.049 -2.957 4.454 306 HA LEU 64 HA LEU 64 -3.613 -4.021 2.246 307 HB2 LEU 64 1HB LEU 64 -3.740 -4.436 5.070 308 HB3 LEU 64 2HB LEU 64 -3.847 -5.991 4.266 309 HG LEU 64 HG LEU 64 -1.753 -5.473 3.045 310 HD11 LEU 64 1HD1 LEU 64 -1.912 -3.035 3.083 311 HD12 LEU 64 2HD1 LEU 64 -0.376 -3.590 3.752 312 HD13 LEU 64 3HD1 LEU 64 -1.665 -3.044 4.829 313 HD21 LEU 64 1HD2 LEU 64 -1.689 -6.772 5.099 314 HD22 LEU 64 2HD2 LEU 64 -1.576 -5.291 6.050 315 HD23 LEU 64 3HD2 LEU 64 -0.260 -5.747 4.967 316 H GLN 65 H GLN 65 -6.707 -4.727 3.696 317 HA GLN 65 HA GLN 65 -7.071 -7.249 2.413 318 HB2 GLN 65 1HB GLN 65 -8.906 -5.372 3.869 319 HB3 GLN 65 2HB GLN 65 -9.529 -6.797 3.048 320 HG2 GLN 65 1HG GLN 65 -7.427 -6.829 5.201 321 HG3 GLN 65 2HG GLN 65 -9.142 -7.152 5.451 322 HE21 GLN 65 1HE2 GLN 65 -9.052 -10.407 4.192 323 HE22 GLN 65 2HE2 GLN 65 -10.032 -9.059 4.650 324 H ALA 66 H ALA 66 -7.469 -3.992 1.375 325 HA ALA 66 HA ALA 66 -9.815 -4.180 -0.121 326 HB1 ALA 66 1HB ALA 66 -8.802 -2.066 0.550 327 HB2 ALA 66 2HB ALA 66 -9.123 -2.110 -1.183 328 HB3 ALA 66 3HB ALA 66 -7.479 -2.338 -0.586 329 H LEU 67 H LEU 67 -6.575 -5.165 -1.004 330 HA LEU 67 HA LEU 67 -7.487 -5.482 -3.765 331 HB2 LEU 67 1HB LEU 67 -5.205 -5.598 -4.481 332 HB3 LEU 67 2HB LEU 67 -5.455 -4.164 -3.518 333 HG LEU 67 HG LEU 67 -4.171 -6.660 -2.422 334 HD11 LEU 67 1HD1 LEU 67 -2.826 -5.898 -4.270 335 HD12 LEU 67 2HD1 LEU 67 -2.035 -5.447 -2.760 336 HD13 LEU 67 3HD1 LEU 67 -2.908 -4.229 -3.694 337 HD21 LEU 67 1HD2 LEU 67 -4.306 -3.796 -1.481 338 HD22 LEU 67 2HD2 LEU 67 -3.239 -5.017 -0.789 339 HD23 LEU 67 3HD2 LEU 67 -4.985 -5.217 -0.687 340 H VAL 68 H VAL 68 -7.335 -7.327 -1.064 341 HA VAL 68 HA VAL 68 -6.754 -9.747 -2.643 342 HB VAL 68 HB VAL 68 -5.087 -9.566 -0.930 343 HG11 VAL 68 1HG1 VAL 68 -5.628 -9.481 1.455 344 HG12 VAL 68 2HG1 VAL 68 -7.340 -9.340 1.058 345 HG13 VAL 68 3HG1 VAL 68 -6.219 -8.058 0.599 346 HG21 VAL 68 1HG2 VAL 68 -5.883 -11.811 -1.363 347 HG22 VAL 68 2HG2 VAL 68 -7.161 -11.616 -0.164 348 HG23 VAL 68 3HG2 VAL 68 -5.471 -11.636 0.343 349 H SER 69 H SER 69 -8.814 -8.432 -0.063 350 HA SER 69 HA SER 69 -11.039 -10.017 -0.982 351 HB2 SER 69 1HB SER 69 -9.831 -11.602 0.512 352 HB3 SER 69 2HB SER 69 -9.971 -10.438 1.826 353 HG SER 69 HG SER 69 -11.847 -11.274 2.197 354 H ALA 70 H ALA 70 -12.905 -8.944 -0.603 355 HA ALA 70 HA ALA 70 -12.861 -6.263 0.088 356 HB1 ALA 70 1HB ALA 70 -15.291 -6.372 0.128 357 HB2 ALA 70 2HB ALA 70 -15.221 -8.132 0.216 358 HB3 ALA 70 3HB ALA 70 -14.645 -7.298 -1.227 359 HA PRO 71 HA PRO 71 -12.381 -6.440 4.528 360 HB2 PRO 71 1HB PRO 71 -13.326 -3.637 4.257 361 HB3 PRO 71 2HB PRO 71 -11.883 -4.267 5.060 362 HG2 PRO 71 1HG PRO 71 -11.701 -3.005 2.721 363 HG3 PRO 71 2HG PRO 71 -10.685 -4.413 3.082 364 HD2 PRO 71 1HD PRO 71 -13.124 -4.223 1.371 365 HD3 PRO 71 2HD PRO 71 -11.643 -5.171 1.127 366 H SER 72 H SER 72 -13.757 -6.924 6.101 367 HA SER 72 HA SER 72 -16.591 -6.839 5.621 368 HB2 SER 72 1HB SER 72 -15.126 -7.658 8.140 369 HB3 SER 72 2HB SER 72 -16.773 -8.088 7.677 370 HG SER 72 HG SER 72 -15.590 -9.007 5.715 371 H ALA 73 H ALA 73 -14.222 -4.963 7.254 372 HA ALA 73 HA ALA 73 -15.927 -3.612 9.081 373 HB1 ALA 73 1HB ALA 73 -13.268 -2.760 7.943 374 HB2 ALA 73 2HB ALA 73 -13.502 -3.745 9.387 375 HB3 ALA 73 3HB ALA 73 -14.060 -2.074 9.361 376 H GLU 74 H GLU 74 -17.024 -1.735 8.880 377 HA GLU 74 HA GLU 74 -17.758 -0.914 6.232 378 HB2 GLU 74 1HB GLU 74 -18.544 0.274 8.894 379 HB3 GLU 74 2HB GLU 74 -19.348 0.543 7.353 380 HG2 GLU 74 1HG GLU 74 -20.034 -1.766 7.261 381 HG3 GLU 74 2HG GLU 74 -19.136 -2.122 8.736 382 HA PRO 75 HA PRO 75 -18.665 0.876 5.205 383 HB2 PRO 75 1HB PRO 75 -17.132 2.050 3.008 384 HB3 PRO 75 2HB PRO 75 -18.676 2.565 3.692 385 HG2 PRO 75 1HG PRO 75 -16.402 3.988 4.013 386 HG3 PRO 75 2HG PRO 75 -17.681 3.942 5.240 387 HD2 PRO 75 1HD PRO 75 -15.089 2.443 5.147 388 HD3 PRO 75 2HD PRO 75 -15.880 3.241 6.524 389 H HIS 76 H HIS 76 -19.039 -0.896 4.032 390 HA HIS 76 HA HIS 76 -16.899 -2.745 3.610 391 HB2 HIS 76 1HB HIS 76 -19.309 -3.284 4.288 392 HB3 HIS 76 2HB HIS 76 -19.730 -3.031 2.600 393 HD1 HIS 76 HD1 HIS 76 -18.751 -5.606 4.888 394 HD2 HIS 76 HD2 HIS 76 -18.144 -4.876 0.840 395 HE1 HIS 76 HE1 HIS 76 -18.075 -7.814 3.896 396 HE2 HIS 76 HE2 HIS 76 -17.813 -7.371 1.433 397 H ALA 77 H ALA 77 -15.702 -2.975 1.847 398 HA ALA 77 HA ALA 77 -15.860 -1.268 -0.358 399 HB1 ALA 77 1HB ALA 77 -13.795 -2.383 0.340 400 HB2 ALA 77 2HB ALA 77 -14.142 -2.666 -1.367 401 HB3 ALA 77 3HB ALA 77 -14.461 -3.932 -0.182 402 H ARG 78 H ARG 78 -17.149 -1.251 -2.048 403 HA ARG 78 HA ARG 78 -18.420 -3.769 -2.891 404 HB2 ARG 78 1HB ARG 78 -19.359 -0.908 -3.165 405 HB3 ARG 78 2HB ARG 78 -20.124 -2.263 -3.982 406 HG2 ARG 78 1HG ARG 78 -19.856 -1.958 -0.997 407 HG3 ARG 78 2HG ARG 78 -21.309 -1.612 -1.938 408 HD2 ARG 78 1HD ARG 78 -21.408 -3.938 -2.654 409 HD3 ARG 78 2HD ARG 78 -19.937 -4.292 -1.753 410 HE ARG 78 HE ARG 78 -21.813 -3.196 0.014 411 HH11 ARG 78 1HH1 ARG 78 -21.357 -6.067 -1.922 412 HH12 ARG 78 2HH1 ARG 78 -22.231 -7.100 -0.837 413 HH21 ARG 78 1HH2 ARG 78 -22.987 -4.550 1.447 414 HH22 ARG 78 2HH2 ARG 78 -23.168 -6.236 1.070 415 H ASN 79 H ASN 79 -18.892 -3.838 -5.262 416 HA ASN 79 HA ASN 79 -18.146 -3.954 -7.399 417 HB2 ASN 79 1HB ASN 79 -16.914 -1.257 -6.777 418 HB3 ASN 79 2HB ASN 79 -17.074 -1.952 -8.386 419 HD21 ASN 79 1HD2 ASN 79 -20.173 -0.095 -6.599 420 HD22 ASN 79 2HD2 ASN 79 -18.649 -0.310 -5.805 421 H TYR 80 H TYR 80 -16.725 -5.349 -5.552 422 HA TYR 80 HA TYR 80 -13.902 -4.954 -6.277 423 HB2 TYR 80 1HB TYR 80 -13.324 -6.180 -4.289 424 HB3 TYR 80 2HB TYR 80 -14.528 -4.983 -3.825 425 HD1 TYR 80 HD1 TYR 80 -13.721 -8.499 -4.011 426 HD2 TYR 80 HD2 TYR 80 -16.897 -5.725 -3.435 427 HE1 TYR 80 HE1 TYR 80 -15.104 -10.290 -3.058 428 HE2 TYR 80 HE2 TYR 80 -18.288 -7.512 -2.475 429 HH TYR 80 HH TYR 80 -18.390 -10.057 -2.667 430 HA PRO 81 HA PRO 81 -14.170 -8.801 -8.556 431 HB2 PRO 81 1HB PRO 81 -11.528 -9.336 -8.787 432 HB3 PRO 81 2HB PRO 81 -12.319 -8.063 -9.722 433 HG2 PRO 81 1HG PRO 81 -10.640 -7.850 -7.262 434 HG3 PRO 81 2HG PRO 81 -10.672 -6.803 -8.691 435 HD2 PRO 81 1HD PRO 81 -11.925 -6.210 -6.322 436 HD3 PRO 81 2HD PRO 81 -12.436 -5.581 -7.900 437 H GLU 82 H GLU 82 -14.392 -10.900 -7.936 438 HA GLU 82 HA GLU 82 -13.858 -11.696 -5.273 439 HB2 GLU 82 1HB GLU 82 -14.592 -13.294 -7.725 440 HB3 GLU 82 2HB GLU 82 -14.412 -14.008 -6.129 441 HG2 GLU 82 1HG GLU 82 -16.141 -12.308 -5.354 442 HG3 GLU 82 2HG GLU 82 -16.451 -12.022 -7.067 443 H GLY 83 H GLY 83 -12.068 -12.477 -4.375 444 HA2 GLY 83 1HA GLY 83 -10.024 -13.645 -4.304 445 HA3 GLY 83 2HA GLY 83 -9.995 -13.656 -6.064 446 H GLY 84 H GLY 84 -10.876 -10.646 -5.421 447 HA2 GLY 84 1HA GLY 84 -9.841 -8.608 -5.295 448 HA3 GLY 84 2HA GLY 84 -8.518 -9.404 -4.457 449 H TYR 85 H TYR 85 -7.198 -7.899 -5.660 450 HA TYR 85 HA TYR 85 -6.780 -8.619 -8.466 451 HB2 TYR 85 1HB TYR 85 -5.685 -6.371 -6.769 452 HB3 TYR 85 2HB TYR 85 -5.172 -6.675 -8.425 453 HD1 TYR 85 HD1 TYR 85 -7.720 -5.227 -6.300 454 HD2 TYR 85 HD2 TYR 85 -6.836 -6.458 -10.274 455 HE1 TYR 85 HE1 TYR 85 -9.612 -3.889 -7.130 456 HE2 TYR 85 HE2 TYR 85 -8.720 -5.124 -11.115 457 HH TYR 85 HH TYR 85 -10.851 -4.223 -10.270 458 H ILE 86 H ILE 86 -5.614 -9.149 -5.327 459 HA ILE 86 HA ILE 86 -3.589 -10.938 -6.444 460 HB ILE 86 HB ILE 86 -2.328 -9.004 -5.634 461 HG12 ILE 86 1HG1 ILE 86 -2.057 -11.348 -3.739 462 HG13 ILE 86 2HG1 ILE 86 -1.385 -11.279 -5.364 463 HG21 ILE 86 1HG2 ILE 86 -2.339 -8.371 -3.265 464 HG22 ILE 86 2HG2 ILE 86 -3.654 -9.511 -2.976 465 HG23 ILE 86 3HG2 ILE 86 -3.908 -8.119 -4.028 466 HD11 ILE 86 1HD1 ILE 86 0.049 -9.439 -4.712 467 HD12 ILE 86 2HD1 ILE 86 0.291 -10.826 -3.651 468 HD13 ILE 86 3HD1 ILE 86 -0.653 -9.444 -3.094 469 H ARG 87 H ARG 87 -3.532 -12.907 -5.443 470 HA ARG 87 HA ARG 87 -5.984 -13.604 -4.163 471 HB2 ARG 87 1HB ARG 87 -3.564 -15.325 -4.702 472 HB3 ARG 87 2HB ARG 87 -5.173 -15.900 -4.291 473 HG2 ARG 87 1HG ARG 87 -6.031 -14.888 -6.373 474 HG3 ARG 87 2HG ARG 87 -4.382 -14.422 -6.790 475 HD2 ARG 87 1HD ARG 87 -5.010 -16.485 -7.918 476 HD3 ARG 87 2HD ARG 87 -3.708 -16.769 -6.764 477 HE ARG 87 HE ARG 87 -6.293 -17.239 -5.634 478 HH11 ARG 87 1HH1 ARG 87 -3.780 -18.654 -7.615 479 HH12 ARG 87 2HH1 ARG 87 -4.242 -20.287 -7.261 480 HH21 ARG 87 1HH2 ARG 87 -6.889 -19.380 -5.142 481 HH22 ARG 87 2HH2 ARG 87 -6.015 -20.703 -5.853 482 H ARG 88 H ARG 88 -2.850 -12.830 -2.995 483 HA ARG 88 HA ARG 88 -3.666 -13.709 -0.313 484 HB2 ARG 88 1HB ARG 88 -1.331 -14.332 0.169 485 HB3 ARG 88 2HB ARG 88 -2.003 -15.295 -1.140 486 HG2 ARG 88 1HG ARG 88 -0.841 -13.920 -2.772 487 HG3 ARG 88 2HG ARG 88 -0.200 -12.908 -1.478 488 HD2 ARG 88 1HD ARG 88 0.338 -15.856 -1.813 489 HD3 ARG 88 2HD ARG 88 1.430 -14.564 -2.301 490 HE ARG 88 HE ARG 88 0.611 -14.680 0.502 491 HH11 ARG 88 1HH1 ARG 88 3.091 -15.143 -1.923 492 HH12 ARG 88 2HH1 ARG 88 4.375 -15.275 -0.767 493 HH21 ARG 88 1HH2 ARG 88 2.297 -14.839 2.029 494 HH22 ARG 88 2HH2 ARG 88 3.922 -15.112 1.487 495 H LEU 89 H LEU 89 -2.811 -12.461 1.421 496 HA LEU 89 HA LEU 89 -2.548 -9.719 1.079 497 HB2 LEU 89 1HB LEU 89 -1.622 -11.580 3.249 498 HB3 LEU 89 2HB LEU 89 -1.309 -9.858 3.336 499 HG LEU 89 HG LEU 89 -4.092 -10.983 3.051 500 HD11 LEU 89 1HD1 LEU 89 -3.097 -11.831 5.116 501 HD12 LEU 89 2HD1 LEU 89 -4.336 -10.622 5.454 502 HD13 LEU 89 3HD1 LEU 89 -2.629 -10.191 5.569 503 HD21 LEU 89 1HD2 LEU 89 -3.016 -8.301 3.916 504 HD22 LEU 89 2HD2 LEU 89 -4.719 -8.763 3.889 505 HD23 LEU 89 3HD2 LEU 89 -3.807 -8.659 2.382 506 HA PRO 90 HA PRO 90 1.293 -9.580 -1.076 507 HB2 PRO 90 1HB PRO 90 1.766 -6.886 -0.653 508 HB3 PRO 90 2HB PRO 90 0.770 -7.550 -1.951 509 HG2 PRO 90 1HG PRO 90 -0.056 -6.399 0.676 510 HG3 PRO 90 2HG PRO 90 -0.826 -6.242 -0.913 511 HD2 PRO 90 1HD PRO 90 -1.791 -7.895 0.970 512 HD3 PRO 90 2HD PRO 90 -1.857 -8.307 -0.758 513 H GLN 91 H GLN 91 3.283 -10.014 -0.480 514 HA GLN 91 HA GLN 91 4.323 -8.902 2.032 515 HB2 GLN 91 1HB GLN 91 4.479 -11.752 1.061 516 HB3 GLN 91 2HB GLN 91 5.621 -11.105 2.228 517 HG2 GLN 91 1HG GLN 91 3.700 -10.553 3.705 518 HG3 GLN 91 2HG GLN 91 2.640 -11.384 2.562 519 HE21 GLN 91 1HE2 GLN 91 3.117 -14.171 4.610 520 HE22 GLN 91 2HE2 GLN 91 2.047 -12.918 4.079 521 H ASP 92 H ASP 92 6.354 -8.129 1.921 522 HA ASP 92 HA ASP 92 7.634 -7.663 -0.538 523 HB2 ASP 92 1HB ASP 92 8.845 -7.704 2.240 524 HB3 ASP 92 2HB ASP 92 9.585 -6.986 0.814 525 HA PRO 93 HA PRO 93 9.762 -11.372 -1.596 526 HB2 PRO 93 1HB PRO 93 12.304 -10.332 -2.082 527 HB3 PRO 93 2HB PRO 93 10.984 -10.417 -3.249 528 HG2 PRO 93 1HG PRO 93 11.874 -8.127 -1.553 529 HG3 PRO 93 2HG PRO 93 11.292 -8.128 -3.230 530 HD2 PRO 93 1HD PRO 93 9.711 -7.339 -1.231 531 HD3 PRO 93 2HD PRO 93 9.062 -8.291 -2.584 532 H TRP 94 H TRP 94 11.009 -9.317 0.916 533 HA TRP 94 HA TRP 94 12.926 -11.239 1.888 534 HB2 TRP 94 1HB TRP 94 11.890 -8.734 3.230 535 HB3 TRP 94 2HB TRP 94 13.326 -9.649 3.683 536 HD1 TRP 94 HD1 TRP 94 15.287 -9.738 1.634 537 HE1 TRP 94 HE1 TRP 94 16.036 -7.811 0.097 538 HE3 TRP 94 HE3 TRP 94 11.235 -6.663 2.156 539 HZ2 TRP 94 HZ2 TRP 94 15.041 -5.320 -0.769 540 HZ3 TRP 94 HZ3 TRP 94 11.215 -4.524 0.943 541 HH2 TRP 94 HH2 TRP 94 13.080 -3.867 -0.490 542 H GLY 95 H GLY 95 9.573 -10.688 2.272 543 HA2 GLY 95 1HA GLY 95 8.237 -12.424 3.265 544 HA3 GLY 95 2HA GLY 95 9.530 -12.706 4.420 545 H SER 96 H SER 96 8.667 -9.434 3.731 546 HA SER 96 HA SER 96 7.498 -9.237 6.406 547 HB2 SER 96 1HB SER 96 7.916 -6.716 5.949 548 HB3 SER 96 2HB SER 96 9.308 -7.753 6.262 549 HG SER 96 HG SER 96 8.414 -6.626 3.831 550 H ASP 97 H ASP 97 5.524 -8.294 6.773 551 HA ASP 97 HA ASP 97 3.658 -8.298 4.547 552 HB2 ASP 97 1HB ASP 97 3.183 -7.700 7.481 553 HB3 ASP 97 2HB ASP 97 1.942 -7.989 6.269 554 H TYR 98 H TYR 98 2.973 -6.520 3.511 555 HA TYR 98 HA TYR 98 4.193 -4.032 3.823 556 HB2 TYR 98 1HB TYR 98 1.672 -4.878 2.413 557 HB3 TYR 98 2HB TYR 98 2.232 -3.209 2.385 558 HD1 TYR 98 HD1 TYR 98 4.135 -2.567 1.056 559 HD2 TYR 98 HD2 TYR 98 3.000 -6.651 1.355 560 HE1 TYR 98 HE1 TYR 98 5.663 -3.125 -0.789 561 HE2 TYR 98 HE2 TYR 98 4.522 -7.219 -0.484 562 HH TYR 98 HH TYR 98 6.923 -5.165 -1.552 563 H GLN 99 H GLN 99 3.412 -2.008 4.552 564 HA GLN 99 HA GLN 99 1.509 -2.317 6.780 565 HB2 GLN 99 1HB GLN 99 3.668 -0.217 6.519 566 HB3 GLN 99 2HB GLN 99 2.657 -0.522 7.920 567 HG2 GLN 99 1HG GLN 99 4.588 -1.521 8.583 568 HG3 GLN 99 2HG GLN 99 3.785 -2.891 7.817 569 HE21 GLN 99 1HE2 GLN 99 6.158 -3.254 5.295 570 HE22 GLN 99 2HE2 GLN 99 4.657 -3.766 5.974 571 H LEU 100 H LEU 100 -0.203 -1.013 6.921 572 HA LEU 100 HA LEU 100 -0.347 1.370 5.206 573 HB2 LEU 100 1HB LEU 100 -1.675 -0.493 4.217 574 HB3 LEU 100 2HB LEU 100 -2.592 -0.605 5.703 575 HG LEU 100 HG LEU 100 -3.635 0.609 3.674 576 HD11 LEU 100 1HD1 LEU 100 -4.769 2.243 5.134 577 HD12 LEU 100 2HD1 LEU 100 -3.600 1.877 6.403 578 HD13 LEU 100 3HD1 LEU 100 -4.697 0.622 5.827 579 HD21 LEU 100 1HD2 LEU 100 -3.146 2.966 3.492 580 HD22 LEU 100 2HD2 LEU 100 -1.695 2.017 3.183 581 HD23 LEU 100 3HD2 LEU 100 -1.901 2.830 4.731 582 H LEU 101 H LEU 101 -0.718 3.135 6.413 583 HA LEU 101 HA LEU 101 -2.087 2.788 8.995 584 HB2 LEU 101 1HB LEU 101 0.485 2.902 9.077 585 HB3 LEU 101 2HB LEU 101 0.301 4.585 8.637 586 HG LEU 101 HG LEU 101 0.656 4.149 11.080 587 HD11 LEU 101 1HD1 LEU 101 -0.969 5.761 11.844 588 HD12 LEU 101 2HD1 LEU 101 -1.951 5.497 10.403 589 HD13 LEU 101 3HD1 LEU 101 -0.354 6.233 10.260 590 HD21 LEU 101 1HD2 LEU 101 -2.153 3.063 10.954 591 HD22 LEU 101 2HD2 LEU 101 -1.187 3.318 12.406 592 HD23 LEU 101 3HD2 LEU 101 -0.696 2.106 11.224 593 H SER 102 H SER 102 -3.894 3.936 8.860 594 HA SER 102 HA SER 102 -3.808 6.600 7.618 595 HB2 SER 102 1HB SER 102 -6.302 6.425 7.609 596 HB3 SER 102 2HB SER 102 -5.510 5.170 6.657 597 HG SER 102 HG SER 102 -5.848 4.410 9.246 598 HA PRO 103 HA PRO 103 -4.264 8.546 7.709 599 HB2 PRO 103 1HB PRO 103 -3.178 10.752 9.221 600 HB3 PRO 103 2HB PRO 103 -4.696 10.686 8.325 601 HG2 PRO 103 1HG PRO 103 -4.534 10.869 11.052 602 HG3 PRO 103 2HG PRO 103 -5.913 10.174 10.183 603 HD2 PRO 103 1HD PRO 103 -3.635 8.789 11.544 604 HD3 PRO 103 2HD PRO 103 -5.358 8.359 11.510 605 H GLY 104 H GLY 104 -2.349 9.103 6.585 606 HA2 GLY 104 1HA GLY 104 -0.161 7.489 7.541 607 HA3 GLY 104 2HA GLY 104 -0.265 8.287 5.979 608 H GLN 105 H GLN 105 2.005 8.107 7.705 609 HA GLN 105 HA GLN 105 2.458 10.782 8.705 610 HB2 GLN 105 1HB GLN 105 3.507 8.543 9.526 611 HB3 GLN 105 2HB GLN 105 4.587 8.716 8.156 612 HG2 GLN 105 1HG GLN 105 4.288 10.865 10.226 613 HG3 GLN 105 2HG GLN 105 5.396 9.514 10.432 614 HE21 GLN 105 1HE2 GLN 105 7.783 10.709 8.186 615 HE22 GLN 105 2HE2 GLN 105 7.191 9.337 9.069 616 H HIS 106 H HIS 106 3.369 8.795 5.924 617 HA HIS 106 HA HIS 106 4.746 11.054 4.688 618 HB2 HIS 106 1HB HIS 106 4.388 8.242 3.639 619 HB3 HIS 106 2HB HIS 106 5.456 9.476 2.983 620 HD1 HIS 106 HD1 HIS 106 7.405 10.270 4.774 621 HD2 HIS 106 HD2 HIS 106 5.581 6.592 5.405 622 HE1 HIS 106 HE1 HIS 106 8.951 8.999 6.295 623 HE2 HIS 106 HE2 HIS 106 7.697 6.883 6.854 624 H GLY 107 H GLY 107 1.609 10.068 4.851 625 HA2 GLY 107 1HA GLY 107 0.790 11.707 2.676 626 HA3 GLY 107 2HA GLY 107 0.635 10.008 2.257 627 H GLN 108 H GLN 108 -1.705 10.659 2.100 628 HA GLN 108 HA GLN 108 -3.144 11.116 4.530 629 HB2 GLN 108 1HB GLN 108 -3.993 10.217 1.783 630 HB3 GLN 108 2HB GLN 108 -5.129 10.328 3.117 631 HG2 GLN 108 1HG GLN 108 -3.548 12.556 1.871 632 HG3 GLN 108 2HG GLN 108 -5.290 12.307 1.804 633 HE21 GLN 108 1HE2 GLN 108 -5.150 12.992 5.568 634 HE22 GLN 108 2HE2 GLN 108 -5.218 11.482 4.725 635 H VAL 109 H VAL 109 -2.599 8.336 2.461 636 HA VAL 109 HA VAL 109 -2.864 6.617 4.830 637 HB VAL 109 HB VAL 109 -3.172 4.798 2.908 638 HG11 VAL 109 1HG1 VAL 109 -5.373 6.547 3.984 639 HG12 VAL 109 2HG1 VAL 109 -4.691 5.116 4.755 640 HG13 VAL 109 3HG1 VAL 109 -5.599 4.958 3.254 641 HG21 VAL 109 1HG2 VAL 109 -3.032 6.348 1.050 642 HG22 VAL 109 2HG2 VAL 109 -4.357 7.302 1.716 643 HG23 VAL 109 3HG2 VAL 109 -4.655 5.663 1.137 644 H ASP 110 H ASP 110 -1.022 5.696 5.403 645 HA ASP 110 HA ASP 110 1.277 6.143 3.666 646 HB2 ASP 110 1HB ASP 110 0.999 6.677 6.257 647 HB3 ASP 110 2HB ASP 110 1.555 5.016 6.407 648 H ILE 111 H ILE 111 1.796 4.547 2.337 649 HA ILE 111 HA ILE 111 1.725 1.803 3.396 650 HB ILE 111 HB ILE 111 1.909 1.104 0.956 651 HG12 ILE 111 1HG1 ILE 111 0.979 3.948 0.507 652 HG13 ILE 111 2HG1 ILE 111 2.567 3.321 0.079 653 HG21 ILE 111 1HG2 ILE 111 -0.151 0.925 2.307 654 HG22 ILE 111 2HG2 ILE 111 -0.465 1.189 0.592 655 HG23 ILE 111 3HG2 ILE 111 -0.628 2.524 1.731 656 HD11 ILE 111 1HD1 ILE 111 1.110 3.451 -1.853 657 HD12 ILE 111 2HD1 ILE 111 -0.056 2.391 -1.061 658 HD13 ILE 111 3HD1 ILE 111 1.541 1.779 -1.494 659 H PHE 112 H PHE 112 3.615 0.913 3.795 660 HA PHE 112 HA PHE 112 5.944 1.615 2.238 661 HB2 PHE 112 1HB PHE 112 7.302 2.260 4.211 662 HB3 PHE 112 2HB PHE 112 6.011 3.398 3.861 663 HD1 PHE 112 HD1 PHE 112 3.861 3.200 5.258 664 HD2 PHE 112 HD2 PHE 112 7.552 1.373 6.333 665 HE1 PHE 112 HE1 PHE 112 3.108 3.057 7.596 666 HE2 PHE 112 HE2 PHE 112 6.803 1.222 8.668 667 HZ PHE 112 HZ PHE 112 4.577 2.065 9.304 668 H SER 113 H SER 113 7.815 0.307 2.773 669 HA SER 113 HA SER 113 7.104 -2.239 4.073 670 HB2 SER 113 1HB SER 113 9.030 -1.745 1.789 671 HB3 SER 113 2HB SER 113 8.709 -3.309 2.537 672 HG SER 113 HG SER 113 7.207 -3.455 1.092 673 H LEU 114 H LEU 114 8.501 -3.082 5.524 674 HA LEU 114 HA LEU 114 10.253 -1.403 6.938 675 HB2 LEU 114 1HB LEU 114 10.106 -4.419 6.918 676 HB3 LEU 114 2HB LEU 114 11.034 -3.479 8.058 677 HG LEU 114 HG LEU 114 9.223 -3.905 9.343 678 HD11 LEU 114 1HD1 LEU 114 9.319 -1.496 9.155 679 HD12 LEU 114 2HD1 LEU 114 7.660 -2.049 9.385 680 HD13 LEU 114 3HD1 LEU 114 8.207 -1.547 7.786 681 HD21 LEU 114 1HD2 LEU 114 8.118 -5.287 7.658 682 HD22 LEU 114 2HD2 LEU 114 7.432 -3.837 6.926 683 HD23 LEU 114 3HD2 LEU 114 6.973 -4.298 8.563 684 H GLY 115 H GLY 115 10.727 -3.608 4.305 685 HA2 GLY 115 1HA GLY 115 12.627 -3.882 2.975 686 HA3 GLY 115 2HA GLY 115 13.548 -2.931 4.140 687 HA PRO 116 HA PRO 116 14.519 -7.475 4.714 688 HB2 PRO 116 1HB PRO 116 17.226 -7.190 4.642 689 HB3 PRO 116 2HB PRO 116 16.244 -7.463 3.198 690 HG2 PRO 116 1HG PRO 116 17.392 -4.917 4.258 691 HG3 PRO 116 2HG PRO 116 17.273 -5.481 2.583 692 HD2 PRO 116 1HD PRO 116 15.570 -3.658 3.668 693 HD3 PRO 116 2HD PRO 116 15.095 -4.770 2.372 694 H ASP 117 H ASP 117 15.231 -4.511 6.195 695 HA ASP 117 HA ASP 117 16.685 -5.635 8.450 696 HB2 ASP 117 1HB ASP 117 16.644 -3.146 9.143 697 HB3 ASP 117 2HB ASP 117 17.596 -3.597 7.730 698 H GLY 118 H GLY 118 13.448 -4.888 7.648 699 HA2 GLY 118 1HA GLY 118 11.534 -5.170 8.907 700 HA3 GLY 118 2HA GLY 118 12.550 -5.715 10.230 701 H VAL 119 H VAL 119 13.536 -2.675 9.082 702 HA VAL 119 HA VAL 119 12.529 -1.503 11.566 703 HB VAL 119 HB VAL 119 14.582 -0.374 9.662 704 HG11 VAL 119 1HG1 VAL 119 15.178 1.082 11.541 705 HG12 VAL 119 2HG1 VAL 119 13.866 0.390 12.492 706 HG13 VAL 119 3HG1 VAL 119 13.504 1.324 11.042 707 HG21 VAL 119 1HG2 VAL 119 15.308 -2.507 10.641 708 HG22 VAL 119 2HG2 VAL 119 14.994 -1.864 12.253 709 HG23 VAL 119 3HG2 VAL 119 16.255 -1.149 11.249 710 HA PRO 120 HA PRO 120 9.527 0.766 9.062 711 HB2 PRO 120 1HB PRO 120 8.277 1.507 11.550 712 HB3 PRO 120 2HB PRO 120 7.690 0.388 10.320 713 HG2 PRO 120 1HG PRO 120 8.495 -0.356 12.840 714 HG3 PRO 120 2HG PRO 120 8.471 -1.434 11.434 715 HD2 PRO 120 1HD PRO 120 10.772 -0.005 12.693 716 HD3 PRO 120 2HD PRO 120 10.702 -1.624 11.963 717 H GLU 121 H GLU 121 9.327 2.891 8.579 718 HA GLU 121 HA GLU 121 9.584 5.139 8.604 719 HB2 GLU 121 1HB GLU 121 9.493 4.598 11.552 720 HB3 GLU 121 2HB GLU 121 9.797 6.223 10.949 721 HG2 GLU 121 1HG GLU 121 7.389 4.539 10.296 722 HG3 GLU 121 2HG GLU 121 7.438 5.859 11.466 723 H SER 122 H SER 122 11.831 3.465 8.251 724 HA SER 122 HA SER 122 13.987 5.162 9.296 725 HB2 SER 122 1HB SER 122 15.318 3.085 8.294 726 HB3 SER 122 2HB SER 122 14.591 3.024 9.902 727 HG SER 122 HG SER 122 14.117 1.398 7.911 728 H ASN 123 H ASN 123 15.886 5.364 7.654 729 HA ASN 123 HA ASN 123 14.940 6.440 5.205 730 HB2 ASN 123 1HB ASN 123 17.253 6.723 4.586 731 HB3 ASN 123 2HB ASN 123 17.109 7.081 6.302 732 HD21 ASN 123 1HD2 ASN 123 19.413 4.024 4.997 733 HD22 ASN 123 2HD2 ASN 123 18.422 4.951 3.921 734 H ASP 124 H ASP 124 16.045 3.335 6.228 735 HA ASP 124 HA ASP 124 15.997 2.187 3.572 736 HB2 ASP 124 1HB ASP 124 16.429 0.035 4.851 737 HB3 ASP 124 2HB ASP 124 17.668 1.276 5.013 738 H ASP 125 H ASP 125 13.660 3.299 3.933 739 HA ASP 125 HA ASP 125 11.832 1.018 4.302 740 HB2 ASP 125 1HB ASP 125 11.630 3.819 5.291 741 HB3 ASP 125 2HB ASP 125 10.157 3.084 4.677 742 H ILE 126 H ILE 126 10.457 0.647 2.627 743 HA ILE 126 HA ILE 126 10.759 2.416 0.302 744 HB ILE 126 HB ILE 126 9.562 -0.359 0.372 745 HG12 ILE 126 1HG1 ILE 126 11.949 -0.430 0.962 746 HG13 ILE 126 2HG1 ILE 126 11.671 -1.127 -0.629 747 HG21 ILE 126 1HG2 ILE 126 8.845 1.182 -1.464 748 HG22 ILE 126 2HG2 ILE 126 9.647 -0.292 -2.009 749 HG23 ILE 126 3HG2 ILE 126 10.529 1.238 -1.992 750 HD11 ILE 126 1HD1 ILE 126 12.443 0.960 -1.660 751 HD12 ILE 126 2HD1 ILE 126 13.670 0.228 -0.625 752 HD13 ILE 126 3HD1 ILE 126 12.754 1.622 -0.055 753 H GLY 127 H GLY 127 9.279 3.994 0.453 754 HA2 GLY 127 1HA GLY 127 6.490 3.195 1.022 755 HA3 GLY 127 2HA GLY 127 7.182 4.710 1.589 756 H ASN 128 H ASN 128 4.827 4.494 0.006 757 HA ASN 128 HA ASN 128 5.330 4.851 -2.742 758 HB2 ASN 128 1HB ASN 128 3.072 5.717 -2.924 759 HB3 ASN 128 2HB ASN 128 3.084 4.336 -1.838 760 HD21 ASN 128 1HD2 ASN 128 1.103 7.301 -0.555 761 HD22 ASN 128 2HD2 ASN 128 1.223 6.607 -2.135 762 H TRP 129 H TRP 129 5.186 7.126 -0.074 763 HA TRP 129 HA TRP 129 5.409 9.478 -1.637 764 HB2 TRP 129 1HB TRP 129 4.594 9.599 0.628 765 HB3 TRP 129 2HB TRP 129 6.074 8.880 1.247 766 HD1 TRP 129 HD1 TRP 129 4.707 12.191 -0.123 767 HE1 TRP 129 HE1 TRP 129 6.316 14.079 0.557 768 HE3 TRP 129 HE3 TRP 129 8.477 9.366 1.868 769 HZ2 TRP 129 HZ2 TRP 129 8.853 14.333 1.771 770 HZ3 TRP 129 HZ3 TRP 129 10.462 10.510 2.766 771 HH2 TRP 129 HH2 TRP 129 10.644 12.945 2.716 772 H THR 130 H THR 130 7.709 7.184 -0.405 773 HA THR 130 HA THR 130 9.984 8.901 -0.719 774 HB THR 130 HB THR 130 10.071 5.903 -0.427 775 HG1 THR 130 HG1 THR 130 10.257 7.190 1.935 776 HG21 THR 130 1HG2 THR 130 12.194 7.082 -0.831 777 HG22 THR 130 2HG2 THR 130 12.138 6.374 0.783 778 HG23 THR 130 3HG2 THR 130 11.882 8.106 0.570 779 H ILE 131 H ILE 131 8.390 6.399 -2.607 780 HA ILE 131 HA ILE 131 10.559 6.333 -4.526 781 HB ILE 131 HB ILE 131 9.438 4.240 -3.944 782 HG12 ILE 131 1HG1 ILE 131 8.985 3.428 -6.259 783 HG13 ILE 131 2HG1 ILE 131 9.044 5.097 -6.816 784 HG21 ILE 131 1HG2 ILE 131 7.216 4.990 -3.503 785 HG22 ILE 131 2HG2 ILE 131 7.154 3.797 -4.801 786 HG23 ILE 131 3HG2 ILE 131 7.010 5.516 -5.173 787 HD11 ILE 131 1HD1 ILE 131 11.312 3.614 -5.507 788 HD12 ILE 131 2HD1 ILE 131 11.365 5.264 -6.129 789 HD13 ILE 131 3HD1 ILE 131 11.134 3.910 -7.237 790 H GLY 132 H GLY 132 7.321 7.707 -4.285 791 HA2 GLY 132 1HA GLY 132 7.232 9.885 -5.527 792 HA3 GLY 132 2HA GLY 132 7.808 8.976 -6.913 793 H PHE 133 H PHE 133 5.344 7.972 -4.584 794 HA PHE 133 HA PHE 133 3.295 8.343 -6.655 795 HB2 PHE 133 1HB PHE 133 3.717 5.878 -4.958 796 HB3 PHE 133 2HB PHE 133 2.240 6.194 -5.865 797 HD1 PHE 133 HD1 PHE 133 2.554 6.662 -8.403 798 HD2 PHE 133 HD2 PHE 133 5.425 4.696 -5.960 799 HE1 PHE 133 HE1 PHE 133 3.560 5.653 -10.405 800 HE2 PHE 133 HE2 PHE 133 6.443 3.687 -7.958 801 HZ PHE 133 HZ PHE 133 5.509 4.164 -10.186 802 H HIS 134 H HIS 134 3.711 10.202 -4.778 803 HA HIS 134 HA HIS 134 1.618 9.776 -2.758 804 HB2 HIS 134 1HB HIS 134 3.733 10.527 -1.829 805 HB3 HIS 134 2HB HIS 134 3.796 11.872 -2.957 806 HD1 HIS 134 HD1 HIS 134 3.543 13.909 -1.572 807 HD2 HIS 134 HD2 HIS 134 0.885 10.921 -0.426 808 HE1 HIS 134 HE1 HIS 134 2.079 14.945 0.191 809 HE2 HIS 134 HE2 HIS 134 0.523 13.104 0.922 810 H HIS 135 H HIS 135 2.427 11.496 -5.637 811 HA HIS 135 HA HIS 135 0.233 13.397 -5.290 812 HB2 HIS 135 1HB HIS 135 2.315 13.148 -7.473 813 HB3 HIS 135 2HB HIS 135 1.082 14.401 -7.402 814 HD1 HIS 135 HD1 HIS 135 4.399 14.485 -7.099 815 HD2 HIS 135 HD2 HIS 135 1.459 15.290 -4.268 816 HE1 HIS 135 HE1 HIS 135 5.493 15.959 -5.381 817 HE2 HIS 135 HE2 HIS 135 3.687 16.473 -3.706 818 H HIS 136 H HIS 136 -0.896 11.045 -5.363 819 HA HIS 136 HA HIS 136 -2.096 10.912 -8.030 820 HB2 HIS 136 1HB HIS 136 -0.465 9.073 -7.891 821 HB3 HIS 136 2HB HIS 136 -1.237 8.500 -6.417 822 HD1 HIS 136 HD1 HIS 136 -3.015 6.782 -6.707 823 HD2 HIS 136 HD2 HIS 136 -2.261 8.887 -10.223 824 HE1 HIS 136 HE1 HIS 136 -4.411 5.674 -8.482 825 HE2 HIS 136 HE2 HIS 136 -3.788 6.837 -10.625 826 H HIS 137 H HIS 137 -4.151 11.446 -7.737 827 HA HIS 137 HA HIS 137 -5.918 9.885 -6.233 828 HB2 HIS 137 1HB HIS 137 -6.635 11.442 -4.490 829 HB3 HIS 137 2HB HIS 137 -4.935 11.045 -4.288 830 HD1 HIS 137 HD1 HIS 137 -7.098 13.809 -4.067 831 HD2 HIS 137 HD2 HIS 137 -3.299 13.259 -5.657 832 HE1 HIS 137 HE1 HIS 137 -6.093 16.104 -4.219 833 HE2 HIS 137 HE2 HIS 137 -3.892 15.762 -5.387 834 H HIS 138 H HIS 138 -7.567 9.893 -7.593 835 HA HIS 138 HA HIS 138 -8.455 12.480 -8.693 836 HB2 HIS 138 1HB HIS 138 -8.611 9.718 -9.906 837 HB3 HIS 138 2HB HIS 138 -9.522 11.090 -10.525 838 HD1 HIS 138 HD1 HIS 138 -6.281 9.444 -10.731 839 HD2 HIS 138 HD2 HIS 138 -7.814 13.215 -11.555 840 HE1 HIS 138 HE1 HIS 138 -4.589 10.545 -12.220 841 HE2 HIS 138 HE2 HIS 138 -5.631 12.747 -12.863 842 H HIS 139 H HIS 139 -10.563 13.039 -8.469 843 HA HIS 139 HA HIS 139 -12.124 11.472 -6.591 844 HB2 HIS 139 1HB HIS 139 -11.890 13.994 -6.474 845 HB3 HIS 139 2HB HIS 139 -12.903 14.077 -7.909 846 HD1 HIS 139 HD1 HIS 139 -15.300 14.426 -7.401 847 HD2 HIS 139 HD2 HIS 139 -13.334 12.479 -4.303 848 HE1 HIS 139 HE1 HIS 139 -17.018 14.131 -5.593 849 HE2 HIS 139 HE2 HIS 139 -15.847 12.819 -3.793 850 H LYS 140 H LYS 140 -11.976 12.134 -9.971 851 HA LYS 140 HA LYS 140 -13.784 9.956 -10.453 852 HB2 LYS 140 1HB LYS 140 -15.159 11.217 -12.120 853 HB3 LYS 140 2HB LYS 140 -15.445 11.685 -10.452 854 HG2 LYS 140 1HG LYS 140 -14.319 13.726 -10.721 855 HG3 LYS 140 2HG LYS 140 -13.586 13.214 -12.240 856 HD2 LYS 140 1HD LYS 140 -15.405 14.791 -12.638 857 HD3 LYS 140 2HD LYS 140 -15.787 13.205 -13.306 858 HE2 LYS 140 1HE LYS 140 -17.737 14.118 -12.211 859 HE3 LYS 140 2HE LYS 140 -17.150 12.723 -11.309 860 HZ1 LYS 140 1HZ LYS 140 -16.161 14.165 -9.700 861 HZ2 LYS 140 2HZ LYS 140 -17.777 14.617 -9.891 862 HZ3 LYS 140 3HZ LYS 140 -16.551 15.541 -10.598 Start of MODEL 11 1 H1 MET 25 1H MET 25 28.373 -10.461 -6.476 2 H2 MET 25 2H MET 25 27.307 -10.728 -5.195 3 H3 MET 25 3H MET 25 27.058 -9.426 -6.242 4 HA MET 25 HA MET 25 26.647 -10.917 -8.073 5 HB2 MET 25 1HB MET 25 26.954 -13.067 -5.967 6 HB3 MET 25 2HB MET 25 26.347 -13.335 -7.594 7 HG2 MET 25 1HG MET 25 29.107 -12.423 -6.826 8 HG3 MET 25 2HG MET 25 28.650 -13.999 -7.466 9 HE1 MET 25 1HE MET 25 30.696 -12.462 -10.421 10 HE2 MET 25 2HE MET 25 30.518 -13.837 -9.331 11 HE3 MET 25 3HE MET 25 31.013 -12.268 -8.698 12 H GLY 26 H GLY 26 25.485 -11.930 -4.844 13 HA2 GLY 26 1HA GLY 26 22.740 -11.722 -5.737 14 HA3 GLY 26 2HA GLY 26 23.291 -12.196 -4.135 15 H ASN 27 H ASN 27 21.863 -10.862 -3.045 16 HA ASN 27 HA ASN 27 21.079 -8.961 -2.067 17 HB2 ASN 27 1HB ASN 27 23.890 -8.010 -2.669 18 HB3 ASN 27 2HB ASN 27 22.768 -7.198 -1.584 19 HD21 ASN 27 1HD2 ASN 27 24.854 -10.445 -0.389 20 HD22 ASN 27 2HD2 ASN 27 24.921 -9.854 -2.015 21 H LYS 28 H LYS 28 20.164 -9.154 -4.564 22 HA LYS 28 HA LYS 28 20.822 -6.782 -6.086 23 HB2 LYS 28 1HB LYS 28 18.828 -8.988 -6.633 24 HB3 LYS 28 2HB LYS 28 19.240 -7.692 -7.750 25 HG2 LYS 28 1HG LYS 28 21.585 -8.492 -7.731 26 HG3 LYS 28 2HG LYS 28 21.070 -9.854 -6.737 27 HD2 LYS 28 1HD LYS 28 19.583 -10.608 -8.499 28 HD3 LYS 28 2HD LYS 28 20.005 -9.205 -9.483 29 HE2 LYS 28 1HE LYS 28 21.853 -11.424 -8.618 30 HE3 LYS 28 2HE LYS 28 21.237 -11.141 -10.246 31 HZ1 LYS 28 1HZ LYS 28 23.476 -10.308 -10.045 32 HZ2 LYS 28 2HZ LYS 28 23.052 -9.346 -8.720 33 HZ3 LYS 28 3HZ LYS 28 22.417 -9.009 -10.249 34 H GLU 29 H GLU 29 20.075 -5.476 -4.199 35 HA GLU 29 HA GLU 29 17.399 -5.226 -3.462 36 HB2 GLU 29 1HB GLU 29 19.260 -4.146 -2.264 37 HB3 GLU 29 2HB GLU 29 19.495 -3.052 -3.619 38 HG2 GLU 29 1HG GLU 29 17.261 -2.132 -3.262 39 HG3 GLU 29 2HG GLU 29 17.030 -3.228 -1.901 40 H LYS 30 H LYS 30 19.144 -3.990 -6.231 41 HA LYS 30 HA LYS 30 17.365 -2.087 -7.193 42 HB2 LYS 30 1HB LYS 30 19.587 -2.523 -8.169 43 HB3 LYS 30 2HB LYS 30 19.018 -4.067 -8.778 44 HG2 LYS 30 1HG LYS 30 19.048 -2.496 -10.577 45 HG3 LYS 30 2HG LYS 30 17.368 -2.852 -10.175 46 HD2 LYS 30 1HD LYS 30 17.209 -0.778 -8.915 47 HD3 LYS 30 2HD LYS 30 18.908 -0.431 -9.243 48 HE2 LYS 30 1HE LYS 30 18.400 -0.380 -11.657 49 HE3 LYS 30 2HE LYS 30 16.699 -0.651 -11.283 50 HZ1 LYS 30 1HZ LYS 30 16.642 1.431 -10.096 51 HZ2 LYS 30 2HZ LYS 30 17.207 1.693 -11.665 52 HZ3 LYS 30 3HZ LYS 30 18.288 1.682 -10.368 53 H ALA 31 H ALA 31 17.442 -5.574 -7.823 54 HA ALA 31 HA ALA 31 15.048 -5.569 -9.370 55 HB1 ALA 31 1HB ALA 31 16.759 -7.280 -9.671 56 HB2 ALA 31 2HB ALA 31 15.209 -8.003 -9.244 57 HB3 ALA 31 3HB ALA 31 16.479 -7.860 -8.028 58 H ASP 32 H ASP 32 15.850 -6.351 -6.018 59 HA ASP 32 HA ASP 32 13.365 -7.493 -5.366 60 HB2 ASP 32 1HB ASP 32 15.531 -6.320 -3.634 61 HB3 ASP 32 2HB ASP 32 14.083 -7.074 -2.972 62 H ARG 33 H ARG 33 14.567 -4.162 -4.870 63 HA ARG 33 HA ARG 33 12.175 -3.396 -3.543 64 HB2 ARG 33 1HB ARG 33 12.926 -1.121 -3.630 65 HB3 ARG 33 2HB ARG 33 14.261 -2.161 -3.181 66 HG2 ARG 33 1HG ARG 33 15.188 -1.968 -5.419 67 HG3 ARG 33 2HG ARG 33 13.818 -0.962 -5.906 68 HD2 ARG 33 1HD ARG 33 14.421 0.715 -4.267 69 HD3 ARG 33 2HD ARG 33 15.729 -0.299 -3.668 70 HE ARG 33 HE ARG 33 16.272 0.073 -6.330 71 HH11 ARG 33 1HH1 ARG 33 15.778 2.162 -3.563 72 HH12 ARG 33 2HH1 ARG 33 16.834 3.405 -4.152 73 HH21 ARG 33 1HH2 ARG 33 17.674 1.707 -7.100 74 HH22 ARG 33 2HH2 ARG 33 17.918 3.144 -6.159 75 H GLN 34 H GLN 34 13.171 -3.355 -6.916 76 HA GLN 34 HA GLN 34 11.035 -1.865 -7.940 77 HB2 GLN 34 1HB GLN 34 12.718 -4.059 -9.104 78 HB3 GLN 34 2HB GLN 34 11.388 -3.359 -10.017 79 HG2 GLN 34 1HG GLN 34 13.743 -1.852 -8.901 80 HG3 GLN 34 2HG GLN 34 13.513 -2.320 -10.585 81 HE21 GLN 34 1HE2 GLN 34 12.412 1.224 -9.837 82 HE22 GLN 34 2HE2 GLN 34 13.813 0.323 -9.374 83 H LYS 35 H LYS 35 11.230 -5.281 -7.050 84 HA LYS 35 HA LYS 35 8.651 -6.066 -7.890 85 HB2 LYS 35 1HB LYS 35 10.082 -7.015 -5.399 86 HB3 LYS 35 2HB LYS 35 8.837 -7.872 -6.291 87 HG2 LYS 35 1HG LYS 35 10.313 -8.293 -8.105 88 HG3 LYS 35 2HG LYS 35 11.535 -7.206 -7.437 89 HD2 LYS 35 1HD LYS 35 11.685 -8.692 -5.448 90 HD3 LYS 35 2HD LYS 35 10.584 -9.810 -6.251 91 HE2 LYS 35 1HE LYS 35 12.162 -10.199 -8.008 92 HE3 LYS 35 2HE LYS 35 13.223 -8.927 -7.400 93 HZ1 LYS 35 1HZ LYS 35 13.691 -10.205 -5.460 94 HZ2 LYS 35 2HZ LYS 35 13.931 -11.209 -6.802 95 HZ3 LYS 35 3HZ LYS 35 12.531 -11.376 -5.867 96 H VAL 36 H VAL 36 9.873 -4.651 -4.923 97 HA VAL 36 HA VAL 36 7.516 -4.677 -3.415 98 HB VAL 36 HB VAL 36 9.920 -2.856 -3.293 99 HG11 VAL 36 1HG1 VAL 36 8.174 -1.646 -2.245 100 HG12 VAL 36 2HG1 VAL 36 9.129 -2.383 -0.957 101 HG13 VAL 36 3HG1 VAL 36 7.581 -3.087 -1.420 102 HG21 VAL 36 1HG2 VAL 36 9.114 -5.226 -1.615 103 HG22 VAL 36 2HG2 VAL 36 10.564 -4.246 -1.399 104 HG23 VAL 36 3HG2 VAL 36 10.366 -5.217 -2.858 105 H VAL 37 H VAL 37 8.916 -2.129 -5.470 106 HA VAL 37 HA VAL 37 6.950 -0.190 -5.020 107 HB VAL 37 HB VAL 37 8.565 -0.611 -7.543 108 HG11 VAL 37 1HG1 VAL 37 8.184 1.790 -7.921 109 HG12 VAL 37 2HG1 VAL 37 7.116 1.827 -6.518 110 HG13 VAL 37 3HG1 VAL 37 6.681 0.868 -7.932 111 HG21 VAL 37 1HG2 VAL 37 10.103 1.039 -6.590 112 HG22 VAL 37 2HG2 VAL 37 9.983 -0.396 -5.572 113 HG23 VAL 37 3HG2 VAL 37 9.139 1.082 -5.114 114 H SER 38 H SER 38 7.077 -2.844 -7.343 115 HA SER 38 HA SER 38 4.803 -2.202 -8.843 116 HB2 SER 38 1HB SER 38 6.423 -3.948 -9.488 117 HB3 SER 38 2HB SER 38 5.879 -4.946 -8.142 118 HG SER 38 HG SER 38 4.723 -5.676 -9.825 119 H ASP 39 H ASP 39 5.131 -4.190 -5.912 120 HA ASP 39 HA ASP 39 2.356 -4.739 -5.659 121 HB2 ASP 39 1HB ASP 39 4.593 -4.803 -3.631 122 HB3 ASP 39 2HB ASP 39 2.946 -5.300 -3.269 123 H LEU 40 H LEU 40 4.466 -2.216 -4.533 124 HA LEU 40 HA LEU 40 2.810 -0.964 -2.669 125 HB2 LEU 40 1HB LEU 40 5.278 -0.584 -3.209 126 HB3 LEU 40 2HB LEU 40 4.725 0.447 -4.511 127 HG LEU 40 HG LEU 40 3.572 1.874 -2.823 128 HD11 LEU 40 1HD1 LEU 40 5.035 0.088 -0.882 129 HD12 LEU 40 2HD1 LEU 40 3.287 0.250 -1.050 130 HD13 LEU 40 3HD1 LEU 40 4.245 1.610 -0.467 131 HD21 LEU 40 1HD2 LEU 40 5.636 2.901 -1.988 132 HD22 LEU 40 2HD2 LEU 40 5.758 2.469 -3.694 133 HD23 LEU 40 3HD2 LEU 40 6.536 1.465 -2.471 134 H VAL 41 H VAL 41 3.139 -0.449 -6.177 135 HA VAL 41 HA VAL 41 1.199 1.581 -6.412 136 HB VAL 41 HB VAL 41 1.780 -0.507 -8.509 137 HG11 VAL 41 1HG1 VAL 41 0.766 2.318 -8.737 138 HG12 VAL 41 2HG1 VAL 41 -0.178 0.847 -8.970 139 HG13 VAL 41 3HG1 VAL 41 1.128 1.244 -10.088 140 HG21 VAL 41 1HG2 VAL 41 3.481 1.023 -9.384 141 HG22 VAL 41 2HG2 VAL 41 3.879 0.490 -7.751 142 HG23 VAL 41 3HG2 VAL 41 3.213 2.102 -8.015 143 H ALA 42 H ALA 42 0.961 -1.944 -6.418 144 HA ALA 42 HA ALA 42 -1.795 -2.105 -7.021 145 HB1 ALA 42 1HB ALA 42 -0.036 -4.003 -5.472 146 HB2 ALA 42 2HB ALA 42 -0.386 -4.057 -7.199 147 HB3 ALA 42 3HB ALA 42 -1.669 -4.370 -6.026 148 H LEU 43 H LEU 43 -0.044 -1.773 -3.967 149 HA LEU 43 HA LEU 43 -2.249 -2.075 -2.235 150 HB2 LEU 43 1HB LEU 43 0.277 -0.456 -1.869 151 HB3 LEU 43 2HB LEU 43 -0.847 -0.858 -0.586 152 HG LEU 43 HG LEU 43 0.804 -2.839 -2.156 153 HD11 LEU 43 1HD1 LEU 43 2.177 -1.544 -0.666 154 HD12 LEU 43 2HD1 LEU 43 1.942 -3.154 0.019 155 HD13 LEU 43 3HD1 LEU 43 1.031 -1.784 0.654 156 HD21 LEU 43 1HD2 LEU 43 -0.007 -4.468 -0.517 157 HD22 LEU 43 2HD2 LEU 43 -1.328 -3.791 -1.471 158 HD23 LEU 43 3HD2 LEU 43 -1.059 -3.238 0.181 159 H GLU 44 H GLU 44 -0.713 0.845 -3.553 160 HA GLU 44 HA GLU 44 -2.635 2.635 -2.469 161 HB2 GLU 44 1HB GLU 44 -0.312 3.243 -3.259 162 HB3 GLU 44 2HB GLU 44 -0.910 3.104 -4.905 163 HG2 GLU 44 1HG GLU 44 -2.497 4.883 -4.516 164 HG3 GLU 44 2HG GLU 44 -2.014 4.976 -2.824 165 H GLY 45 H GLY 45 -2.340 0.855 -5.457 166 HA2 GLY 45 1HA GLY 45 -4.421 1.942 -6.942 167 HA3 GLY 45 2HA GLY 45 -3.890 0.272 -7.026 168 H ALA 46 H ALA 46 -4.488 -0.733 -4.600 169 HA ALA 46 HA ALA 46 -7.244 -1.212 -4.646 170 HB1 ALA 46 1HB ALA 46 -6.923 -2.331 -2.531 171 HB2 ALA 46 2HB ALA 46 -5.378 -1.509 -2.296 172 HB3 ALA 46 3HB ALA 46 -5.563 -2.681 -3.597 173 H LEU 47 H LEU 47 -5.316 0.991 -2.648 174 HA LEU 47 HA LEU 47 -7.358 2.005 -1.042 175 HB2 LEU 47 1HB LEU 47 -4.950 3.490 -2.093 176 HB3 LEU 47 2HB LEU 47 -5.873 3.901 -0.658 177 HG LEU 47 HG LEU 47 -4.077 1.513 -1.060 178 HD11 LEU 47 1HD1 LEU 47 -2.939 3.624 -0.585 179 HD12 LEU 47 2HD1 LEU 47 -2.790 2.485 0.754 180 HD13 LEU 47 3HD1 LEU 47 -3.927 3.828 0.861 181 HD21 LEU 47 1HD2 LEU 47 -6.034 0.826 0.184 182 HD22 LEU 47 2HD2 LEU 47 -5.824 2.180 1.296 183 HD23 LEU 47 3HD2 LEU 47 -4.620 0.894 1.234 184 H ASP 48 H ASP 48 -6.182 3.025 -4.202 185 HA ASP 48 HA ASP 48 -7.799 5.307 -4.500 186 HB2 ASP 48 1HB ASP 48 -5.824 4.817 -5.910 187 HB3 ASP 48 2HB ASP 48 -6.700 3.485 -6.656 188 H MET 49 H MET 49 -8.282 1.932 -5.448 189 HA MET 49 HA MET 49 -10.761 2.356 -6.743 190 HB2 MET 49 1HB MET 49 -9.527 -0.139 -5.575 191 HB3 MET 49 2HB MET 49 -11.037 -0.130 -6.479 192 HG2 MET 49 1HG MET 49 -9.871 0.760 -8.426 193 HG3 MET 49 2HG MET 49 -8.359 0.756 -7.520 194 HE1 MET 49 1HE MET 49 -10.694 -3.043 -8.708 195 HE2 MET 49 2HE MET 49 -11.211 -1.400 -9.083 196 HE3 MET 49 3HE MET 49 -11.229 -1.970 -7.415 197 H TYR 50 H TYR 50 -9.929 1.359 -3.453 198 HA TYR 50 HA TYR 50 -12.572 0.947 -2.574 199 HB2 TYR 50 1HB TYR 50 -10.671 0.109 -1.306 200 HB3 TYR 50 2HB TYR 50 -10.106 1.751 -1.015 201 HD1 TYR 50 HD1 TYR 50 -12.671 -0.745 -0.138 202 HD2 TYR 50 HD2 TYR 50 -11.111 3.126 0.673 203 HE1 TYR 50 HE1 TYR 50 -14.005 -0.642 1.929 204 HE2 TYR 50 HE2 TYR 50 -12.433 3.234 2.734 205 HH TYR 50 HH TYR 50 -14.414 0.507 3.804 206 H LYS 51 H LYS 51 -10.482 3.812 -2.517 207 HA LYS 51 HA LYS 51 -12.361 5.477 -1.178 208 HB2 LYS 51 1HB LYS 51 -9.970 6.007 -1.213 209 HB3 LYS 51 2HB LYS 51 -10.034 6.231 -2.957 210 HG2 LYS 51 1HG LYS 51 -11.648 8.084 -2.604 211 HG3 LYS 51 2HG LYS 51 -11.406 7.904 -0.867 212 HD2 LYS 51 1HD LYS 51 -9.064 8.435 -1.098 213 HD3 LYS 51 2HD LYS 51 -9.222 8.492 -2.853 214 HE2 LYS 51 1HE LYS 51 -10.595 10.324 -0.893 215 HE3 LYS 51 2HE LYS 51 -9.196 10.733 -1.881 216 HZ1 LYS 51 1HZ LYS 51 -11.153 11.586 -2.916 217 HZ2 LYS 51 2HZ LYS 51 -11.926 10.084 -2.852 218 HZ3 LYS 51 3HZ LYS 51 -10.588 10.304 -3.859 219 H LEU 52 H LEU 52 -11.768 4.728 -4.560 220 HA LEU 52 HA LEU 52 -13.329 6.769 -5.690 221 HB2 LEU 52 1HB LEU 52 -11.805 5.315 -6.970 222 HB3 LEU 52 2HB LEU 52 -12.875 3.957 -6.691 223 HG LEU 52 HG LEU 52 -14.643 5.108 -7.982 224 HD11 LEU 52 1HD1 LEU 52 -12.480 7.138 -8.514 225 HD12 LEU 52 2HD1 LEU 52 -13.971 7.406 -7.611 226 HD13 LEU 52 3HD1 LEU 52 -14.036 7.060 -9.338 227 HD21 LEU 52 1HD2 LEU 52 -12.019 4.771 -9.430 228 HD22 LEU 52 2HD2 LEU 52 -13.615 4.799 -10.180 229 HD23 LEU 52 3HD2 LEU 52 -13.184 3.495 -9.074 230 H ASP 53 H ASP 53 -14.152 3.511 -4.628 231 HA ASP 53 HA ASP 53 -16.913 3.737 -5.344 232 HB2 ASP 53 1HB ASP 53 -15.873 1.576 -5.410 233 HB3 ASP 53 2HB ASP 53 -15.390 1.700 -3.723 234 H ASN 54 H ASN 54 -15.141 3.862 -2.251 235 HA ASN 54 HA ASN 54 -17.677 4.232 -0.836 236 HB2 ASN 54 1HB ASN 54 -14.883 3.734 0.196 237 HB3 ASN 54 2HB ASN 54 -16.287 3.977 1.229 238 HD21 ASN 54 1HD2 ASN 54 -15.650 0.452 -0.646 239 HD22 ASN 54 2HD2 ASN 54 -14.700 1.852 -0.995 240 H SER 55 H SER 55 -15.346 6.168 -2.182 241 HA SER 55 HA SER 55 -14.950 8.393 -2.142 242 HB2 SER 55 1HB SER 55 -17.360 8.482 -0.330 243 HB3 SER 55 2HB SER 55 -16.618 9.882 -1.106 244 HG SER 55 HG SER 55 -18.154 7.822 -2.210 245 H ARG 56 H ARG 56 -13.831 6.561 -0.035 246 HA ARG 56 HA ARG 56 -12.517 8.622 1.457 247 HB2 ARG 56 1HB ARG 56 -13.069 7.675 3.702 248 HB3 ARG 56 2HB ARG 56 -14.432 8.432 2.895 249 HG2 ARG 56 1HG ARG 56 -15.412 6.543 3.721 250 HG3 ARG 56 2HG ARG 56 -14.947 5.989 2.114 251 HD2 ARG 56 1HD ARG 56 -14.354 4.294 3.697 252 HD3 ARG 56 2HD ARG 56 -12.874 5.048 3.106 253 HE ARG 56 HE ARG 56 -13.390 6.450 5.348 254 HH11 ARG 56 1HH1 ARG 56 -13.226 3.006 4.717 255 HH12 ARG 56 2HH1 ARG 56 -12.655 2.612 6.310 256 HH21 ARG 56 1HH2 ARG 56 -12.648 5.941 7.435 257 HH22 ARG 56 2HH2 ARG 56 -12.359 4.285 7.869 258 H TYR 57 H TYR 57 -10.604 7.919 2.457 259 HA TYR 57 HA TYR 57 -9.429 5.602 1.261 260 HB2 TYR 57 1HB TYR 57 -8.492 7.796 3.039 261 HB3 TYR 57 2HB TYR 57 -7.558 6.306 3.028 262 HD1 TYR 57 HD1 TYR 57 -7.700 9.453 1.659 263 HD2 TYR 57 HD2 TYR 57 -7.200 5.403 0.469 264 HE1 TYR 57 HE1 TYR 57 -6.517 10.200 -0.363 265 HE2 TYR 57 HE2 TYR 57 -6.020 6.136 -1.560 266 HH TYR 57 HH TYR 57 -5.779 8.061 -2.961 267 HA PRO 58 HA PRO 58 -10.410 2.678 4.391 268 HB2 PRO 58 1HB PRO 58 -8.096 1.081 3.783 269 HB3 PRO 58 2HB PRO 58 -9.771 0.807 3.304 270 HG2 PRO 58 1HG PRO 58 -7.739 1.460 1.571 271 HG3 PRO 58 2HG PRO 58 -9.461 1.728 1.257 272 HD2 PRO 58 1HD PRO 58 -7.365 3.662 2.117 273 HD3 PRO 58 2HD PRO 58 -8.765 3.902 1.053 274 H THR 59 H THR 59 -9.664 1.715 6.357 275 HA THR 59 HA THR 59 -7.522 3.144 7.671 276 HB THR 59 HB THR 59 -8.130 1.728 9.640 277 HG1 THR 59 HG1 THR 59 -10.435 0.754 8.993 278 HG21 THR 59 1HG2 THR 59 -10.440 3.144 8.305 279 HG22 THR 59 2HG2 THR 59 -9.192 3.906 9.290 280 HG23 THR 59 3HG2 THR 59 -10.317 2.763 10.022 281 H THR 60 H THR 60 -6.113 1.529 9.162 282 HA THR 60 HA THR 60 -4.201 0.505 7.476 283 HB THR 60 HB THR 60 -3.682 1.066 9.766 284 HG1 THR 60 HG1 THR 60 -2.226 -0.358 8.945 285 HG21 THR 60 1HG2 THR 60 -5.734 0.319 10.853 286 HG22 THR 60 2HG2 THR 60 -4.316 -0.379 11.637 287 HG23 THR 60 3HG2 THR 60 -5.293 -1.361 10.547 288 H GLU 61 H GLU 61 -6.821 -1.310 9.061 289 HA GLU 61 HA GLU 61 -5.927 -3.841 8.090 290 HB2 GLU 61 1HB GLU 61 -7.320 -3.706 10.076 291 HB3 GLU 61 2HB GLU 61 -8.613 -2.952 9.155 292 HG2 GLU 61 1HG GLU 61 -8.798 -5.022 7.810 293 HG3 GLU 61 2HG GLU 61 -7.596 -5.767 8.862 294 H GLN 62 H GLN 62 -8.351 -1.490 7.031 295 HA GLN 62 HA GLN 62 -9.498 -3.167 5.055 296 HB2 GLN 62 1HB GLN 62 -9.566 -0.150 5.177 297 HB3 GLN 62 2HB GLN 62 -10.675 -1.189 4.296 298 HG2 GLN 62 1HG GLN 62 -11.469 -2.116 6.426 299 HG3 GLN 62 2HG GLN 62 -10.382 -1.026 7.287 300 HE21 GLN 62 1HE2 GLN 62 -13.920 0.278 5.834 301 HE22 GLN 62 2HE2 GLN 62 -13.343 -1.324 5.539 302 H GLY 63 H GLY 63 -6.807 -0.940 5.060 303 HA2 GLY 63 1HA GLY 63 -6.655 -0.544 2.255 304 HA3 GLY 63 2HA GLY 63 -5.365 -0.256 3.408 305 H LEU 64 H LEU 64 -4.846 -2.731 4.398 306 HA LEU 64 HA LEU 64 -3.309 -3.851 2.291 307 HB2 LEU 64 1HB LEU 64 -3.456 -4.074 5.132 308 HB3 LEU 64 2HB LEU 64 -3.482 -5.688 4.446 309 HG LEU 64 HG LEU 64 -1.404 -5.163 3.203 310 HD11 LEU 64 1HD1 LEU 64 -1.501 -2.602 4.791 311 HD12 LEU 64 2HD1 LEU 64 -1.623 -2.758 3.040 312 HD13 LEU 64 3HD1 LEU 64 -0.116 -3.172 3.857 313 HD21 LEU 64 1HD2 LEU 64 0.081 -5.262 5.134 314 HD22 LEU 64 2HD2 LEU 64 -1.320 -6.310 5.357 315 HD23 LEU 64 3HD2 LEU 64 -1.240 -4.755 6.187 316 H GLN 65 H GLN 65 -6.302 -4.798 3.876 317 HA GLN 65 HA GLN 65 -6.422 -7.369 2.654 318 HB2 GLN 65 1HB GLN 65 -8.468 -5.700 4.099 319 HB3 GLN 65 2HB GLN 65 -8.843 -7.280 3.427 320 HG2 GLN 65 1HG GLN 65 -6.730 -6.722 5.499 321 HG3 GLN 65 2HG GLN 65 -8.334 -7.381 5.817 322 HE21 GLN 65 1HE2 GLN 65 -5.696 -10.058 5.530 323 HE22 GLN 65 2HE2 GLN 65 -5.748 -8.554 6.381 324 H ALA 66 H ALA 66 -7.204 -4.218 1.536 325 HA ALA 66 HA ALA 66 -9.576 -4.688 0.144 326 HB1 ALA 66 1HB ALA 66 -9.133 -2.606 -1.017 327 HB2 ALA 66 2HB ALA 66 -7.452 -2.652 -0.487 328 HB3 ALA 66 3HB ALA 66 -8.744 -2.463 0.698 329 H LEU 67 H LEU 67 -6.314 -5.483 -0.798 330 HA LEU 67 HA LEU 67 -7.265 -5.924 -3.530 331 HB2 LEU 67 1HB LEU 67 -4.931 -6.064 -4.237 332 HB3 LEU 67 2HB LEU 67 -5.331 -4.530 -3.509 333 HG LEU 67 HG LEU 67 -3.946 -6.676 -1.926 334 HD11 LEU 67 1HD1 LEU 67 -2.615 -6.342 -3.921 335 HD12 LEU 67 2HD1 LEU 67 -1.826 -5.571 -2.544 336 HD13 LEU 67 3HD1 LEU 67 -2.704 -4.588 -3.721 337 HD21 LEU 67 1HD2 LEU 67 -3.106 -4.737 -0.673 338 HD22 LEU 67 2HD2 LEU 67 -4.865 -4.791 -0.674 339 HD23 LEU 67 3HD2 LEU 67 -4.020 -3.662 -1.730 340 H VAL 68 H VAL 68 -6.960 -7.675 -0.780 341 HA VAL 68 HA VAL 68 -6.458 -10.112 -2.358 342 HB VAL 68 HB VAL 68 -4.696 -9.926 -0.742 343 HG11 VAL 68 1HG1 VAL 68 -5.693 -8.438 0.872 344 HG12 VAL 68 2HG1 VAL 68 -5.125 -9.900 1.681 345 HG13 VAL 68 3HG1 VAL 68 -6.846 -9.684 1.354 346 HG21 VAL 68 1HG2 VAL 68 -6.710 -11.979 0.159 347 HG22 VAL 68 2HG2 VAL 68 -4.980 -12.009 0.502 348 HG23 VAL 68 3HG2 VAL 68 -5.553 -12.164 -1.159 349 H SER 69 H SER 69 -8.430 -8.692 0.222 350 HA SER 69 HA SER 69 -10.692 -10.273 -0.632 351 HB2 SER 69 1HB SER 69 -9.684 -10.533 2.217 352 HB3 SER 69 2HB SER 69 -11.149 -11.264 1.562 353 HG SER 69 HG SER 69 -9.146 -11.975 -0.012 354 H ALA 70 H ALA 70 -12.503 -9.064 -0.429 355 HA ALA 70 HA ALA 70 -12.365 -6.361 0.195 356 HB1 ALA 70 1HB ALA 70 -14.808 -8.120 0.164 357 HB2 ALA 70 2HB ALA 70 -14.091 -7.312 -1.229 358 HB3 ALA 70 3HB ALA 70 -14.804 -6.359 0.073 359 HA PRO 71 HA PRO 71 -12.173 -6.435 4.650 360 HB2 PRO 71 1HB PRO 71 -13.035 -3.614 4.288 361 HB3 PRO 71 2HB PRO 71 -11.652 -4.263 5.176 362 HG2 PRO 71 1HG PRO 71 -11.314 -3.051 2.832 363 HG3 PRO 71 2HG PRO 71 -10.362 -4.484 3.263 364 HD2 PRO 71 1HD PRO 71 -12.711 -4.246 1.431 365 HD3 PRO 71 2HD PRO 71 -11.245 -5.236 1.269 366 H SER 72 H SER 72 -13.640 -6.884 6.165 367 HA SER 72 HA SER 72 -16.451 -6.564 5.564 368 HB2 SER 72 1HB SER 72 -16.634 -7.740 7.868 369 HB3 SER 72 2HB SER 72 -15.981 -8.655 6.511 370 HG SER 72 HG SER 72 -14.614 -7.503 8.701 371 H ALA 73 H ALA 73 -14.024 -4.887 7.255 372 HA ALA 73 HA ALA 73 -15.590 -3.514 9.168 373 HB1 ALA 73 1HB ALA 73 -13.752 -1.909 9.232 374 HB2 ALA 73 2HB ALA 73 -13.083 -2.601 7.754 375 HB3 ALA 73 3HB ALA 73 -13.136 -3.562 9.232 376 H GLU 74 H GLU 74 -16.775 -1.665 9.032 377 HA GLU 74 HA GLU 74 -17.751 -0.974 6.418 378 HB2 GLU 74 1HB GLU 74 -19.274 0.554 7.627 379 HB3 GLU 74 2HB GLU 74 -19.339 -1.090 8.238 380 HG2 GLU 74 1HG GLU 74 -17.637 0.996 9.547 381 HG3 GLU 74 2HG GLU 74 -19.351 0.838 9.917 382 HA PRO 75 HA PRO 75 -18.732 0.643 5.306 383 HB2 PRO 75 1HB PRO 75 -17.353 1.802 3.001 384 HB3 PRO 75 2HB PRO 75 -18.903 2.253 3.716 385 HG2 PRO 75 1HG PRO 75 -16.721 3.836 3.883 386 HG3 PRO 75 2HG PRO 75 -17.948 3.766 5.161 387 HD2 PRO 75 1HD PRO 75 -15.268 2.430 5.035 388 HD3 PRO 75 2HD PRO 75 -16.053 3.251 6.401 389 H HIS 76 H HIS 76 -19.023 -1.206 4.199 390 HA HIS 76 HA HIS 76 -16.794 -2.923 3.717 391 HB2 HIS 76 1HB HIS 76 -19.200 -3.574 4.393 392 HB3 HIS 76 2HB HIS 76 -19.595 -3.374 2.691 393 HD1 HIS 76 HD1 HIS 76 -18.904 -5.949 4.932 394 HD2 HIS 76 HD2 HIS 76 -17.501 -5.064 1.117 395 HE1 HIS 76 HE1 HIS 76 -18.002 -8.113 4.023 396 HE2 HIS 76 HE2 HIS 76 -17.250 -7.578 1.680 397 H ALA 77 H ALA 77 -15.662 -3.180 1.906 398 HA ALA 77 HA ALA 77 -15.805 -1.375 -0.212 399 HB1 ALA 77 1HB ALA 77 -14.144 -2.772 -1.306 400 HB2 ALA 77 2HB ALA 77 -14.501 -4.094 -0.193 401 HB3 ALA 77 3HB ALA 77 -13.778 -2.604 0.412 402 H ARG 78 H ARG 78 -17.087 -1.250 -1.921 403 HA ARG 78 HA ARG 78 -18.493 -3.675 -2.822 404 HB2 ARG 78 1HB ARG 78 -19.319 -0.776 -3.089 405 HB3 ARG 78 2HB ARG 78 -20.195 -2.140 -3.767 406 HG2 ARG 78 1HG ARG 78 -19.725 -1.609 -0.840 407 HG3 ARG 78 2HG ARG 78 -21.238 -1.375 -1.718 408 HD2 ARG 78 1HD ARG 78 -19.808 -3.995 -1.269 409 HD3 ARG 78 2HD ARG 78 -21.290 -3.462 -0.477 410 HE ARG 78 HE ARG 78 -21.907 -3.363 -3.121 411 HH11 ARG 78 1HH1 ARG 78 -20.624 -5.863 -1.030 412 HH12 ARG 78 2HH1 ARG 78 -21.338 -7.161 -1.937 413 HH21 ARG 78 1HH2 ARG 78 -22.853 -5.072 -4.304 414 HH22 ARG 78 2HH2 ARG 78 -22.613 -6.712 -3.784 415 H ASN 79 H ASN 79 -18.998 -3.684 -5.167 416 HA ASN 79 HA ASN 79 -18.278 -3.832 -7.307 417 HB2 ASN 79 1HB ASN 79 -17.297 -1.030 -6.726 418 HB3 ASN 79 2HB ASN 79 -17.366 -1.748 -8.332 419 HD21 ASN 79 1HD2 ASN 79 -20.662 -0.218 -6.596 420 HD22 ASN 79 2HD2 ASN 79 -19.117 -0.224 -5.813 421 H TYR 80 H TYR 80 -16.610 -4.955 -5.368 422 HA TYR 80 HA TYR 80 -13.887 -4.363 -6.257 423 HB2 TYR 80 1HB TYR 80 -13.176 -5.697 -4.335 424 HB3 TYR 80 2HB TYR 80 -14.333 -4.476 -3.818 425 HD1 TYR 80 HD1 TYR 80 -13.649 -8.025 -4.107 426 HD2 TYR 80 HD2 TYR 80 -16.663 -5.148 -3.247 427 HE1 TYR 80 HE1 TYR 80 -15.023 -9.780 -3.074 428 HE2 TYR 80 HE2 TYR 80 -18.044 -6.895 -2.209 429 HH TYR 80 HH TYR 80 -16.833 -9.933 -1.382 430 HA PRO 81 HA PRO 81 -13.814 -8.191 -8.587 431 HB2 PRO 81 1HB PRO 81 -11.126 -8.497 -8.759 432 HB3 PRO 81 2HB PRO 81 -12.007 -7.314 -9.731 433 HG2 PRO 81 1HG PRO 81 -10.419 -6.906 -7.234 434 HG3 PRO 81 2HG PRO 81 -10.491 -5.902 -8.693 435 HD2 PRO 81 1HD PRO 81 -11.858 -5.328 -6.401 436 HD3 PRO 81 2HD PRO 81 -12.410 -4.842 -8.017 437 H GLU 82 H GLU 82 -13.789 -10.319 -7.953 438 HA GLU 82 HA GLU 82 -13.514 -10.874 -5.194 439 HB2 GLU 82 1HB GLU 82 -13.750 -12.776 -7.530 440 HB3 GLU 82 2HB GLU 82 -13.899 -13.235 -5.839 441 HG2 GLU 82 1HG GLU 82 -15.789 -11.562 -5.692 442 HG3 GLU 82 2HG GLU 82 -15.725 -11.482 -7.453 443 H GLY 83 H GLY 83 -11.796 -11.377 -4.047 444 HA2 GLY 83 1HA GLY 83 -9.700 -12.254 -3.545 445 HA3 GLY 83 2HA GLY 83 -9.504 -12.700 -5.235 446 H GLY 84 H GLY 84 -10.562 -9.571 -5.112 447 HA2 GLY 84 1HA GLY 84 -9.567 -7.536 -5.441 448 HA3 GLY 84 2HA GLY 84 -8.252 -8.117 -4.432 449 H TYR 85 H TYR 85 -6.355 -8.211 -5.355 450 HA TYR 85 HA TYR 85 -6.167 -8.823 -8.216 451 HB2 TYR 85 1HB TYR 85 -4.922 -6.484 -6.783 452 HB3 TYR 85 2HB TYR 85 -4.256 -7.110 -8.287 453 HD1 TYR 85 HD1 TYR 85 -5.778 -7.188 -10.322 454 HD2 TYR 85 HD2 TYR 85 -6.732 -4.962 -6.818 455 HE1 TYR 85 HE1 TYR 85 -7.376 -5.845 -11.614 456 HE2 TYR 85 HE2 TYR 85 -8.333 -3.619 -8.107 457 HH TYR 85 HH TYR 85 -9.396 -4.484 -11.201 458 H ILE 86 H ILE 86 -5.307 -9.570 -5.127 459 HA ILE 86 HA ILE 86 -3.142 -11.262 -6.101 460 HB ILE 86 HB ILE 86 -1.980 -9.324 -5.169 461 HG12 ILE 86 1HG1 ILE 86 -1.772 -11.697 -3.308 462 HG13 ILE 86 2HG1 ILE 86 -1.021 -11.596 -4.896 463 HG21 ILE 86 1HG2 ILE 86 -2.141 -8.782 -2.770 464 HG22 ILE 86 2HG2 ILE 86 -3.485 -9.916 -2.629 465 HG23 ILE 86 3HG2 ILE 86 -3.642 -8.483 -3.646 466 HD11 ILE 86 1HD1 ILE 86 -0.429 -9.815 -2.546 467 HD12 ILE 86 2HD1 ILE 86 0.322 -9.705 -4.137 468 HD13 ILE 86 3HD1 ILE 86 0.579 -11.135 -3.138 469 H ARG 87 H ARG 87 -3.087 -13.258 -5.104 470 HA ARG 87 HA ARG 87 -5.626 -13.992 -4.001 471 HB2 ARG 87 1HB ARG 87 -3.183 -15.643 -4.637 472 HB3 ARG 87 2HB ARG 87 -4.713 -16.312 -4.087 473 HG2 ARG 87 1HG ARG 87 -5.811 -15.299 -6.064 474 HG3 ARG 87 2HG ARG 87 -4.221 -14.785 -6.632 475 HD2 ARG 87 1HD ARG 87 -4.976 -17.645 -6.062 476 HD3 ARG 87 2HD ARG 87 -5.055 -16.901 -7.654 477 HE ARG 87 HE ARG 87 -2.468 -16.646 -6.460 478 HH11 ARG 87 1HH1 ARG 87 -4.576 -18.818 -8.220 479 HH12 ARG 87 2HH1 ARG 87 -3.270 -19.709 -8.935 480 HH21 ARG 87 1HH2 ARG 87 -0.748 -17.811 -7.409 481 HH22 ARG 87 2HH2 ARG 87 -1.095 -19.138 -8.474 482 H ARG 88 H ARG 88 -2.518 -13.324 -2.675 483 HA ARG 88 HA ARG 88 -3.564 -14.110 -0.041 484 HB2 ARG 88 1HB ARG 88 -0.742 -14.498 -1.048 485 HB3 ARG 88 2HB ARG 88 -1.225 -14.679 0.631 486 HG2 ARG 88 1HG ARG 88 -2.905 -16.413 -0.258 487 HG3 ARG 88 2HG ARG 88 -1.911 -16.399 -1.719 488 HD2 ARG 88 1HD ARG 88 -1.214 -18.171 -0.185 489 HD3 ARG 88 2HD ARG 88 0.058 -16.965 -0.392 490 HE ARG 88 HE ARG 88 -1.657 -16.456 1.857 491 HH11 ARG 88 1HH1 ARG 88 1.184 -18.193 0.787 492 HH12 ARG 88 2HH1 ARG 88 1.880 -18.284 2.371 493 HH21 ARG 88 1HH2 ARG 88 -0.756 -16.579 3.941 494 HH22 ARG 88 2HH2 ARG 88 0.772 -17.364 4.171 495 H LEU 89 H LEU 89 -2.276 -13.018 1.755 496 HA LEU 89 HA LEU 89 -2.333 -10.242 1.508 497 HB2 LEU 89 1HB LEU 89 -1.178 -12.142 3.490 498 HB3 LEU 89 2HB LEU 89 -0.665 -10.471 3.569 499 HG LEU 89 HG LEU 89 -2.474 -10.894 5.135 500 HD11 LEU 89 1HD1 LEU 89 -3.400 -9.202 2.820 501 HD12 LEU 89 2HD1 LEU 89 -2.301 -8.684 4.098 502 HD13 LEU 89 3HD1 LEU 89 -3.970 -9.102 4.484 503 HD21 LEU 89 1HD2 LEU 89 -4.726 -11.453 4.346 504 HD22 LEU 89 2HD2 LEU 89 -3.571 -12.741 4.008 505 HD23 LEU 89 3HD2 LEU 89 -4.095 -11.666 2.712 506 HA PRO 90 HA PRO 90 1.342 -9.574 -0.853 507 HB2 PRO 90 1HB PRO 90 1.451 -6.875 -0.615 508 HB3 PRO 90 2HB PRO 90 0.293 -7.699 -1.663 509 HG2 PRO 90 1HG PRO 90 -0.103 -6.597 1.095 510 HG3 PRO 90 2HG PRO 90 -1.156 -6.456 -0.326 511 HD2 PRO 90 1HD PRO 90 -1.624 -8.247 1.639 512 HD3 PRO 90 2HD PRO 90 -2.008 -8.588 -0.061 513 H GLN 91 H GLN 91 3.320 -9.965 -0.196 514 HA GLN 91 HA GLN 91 4.413 -8.491 2.106 515 HB2 GLN 91 1HB GLN 91 4.947 -11.387 1.418 516 HB3 GLN 91 2HB GLN 91 5.689 -10.490 2.732 517 HG2 GLN 91 1HG GLN 91 3.540 -10.274 3.834 518 HG3 GLN 91 2HG GLN 91 2.762 -11.106 2.495 519 HE21 GLN 91 1HE2 GLN 91 5.407 -13.528 4.348 520 HE22 GLN 91 2HE2 GLN 91 5.868 -12.033 3.618 521 H ASP 92 H ASP 92 6.622 -7.965 1.950 522 HA ASP 92 HA ASP 92 7.591 -7.593 -0.708 523 HB2 ASP 92 1HB ASP 92 9.616 -6.655 0.359 524 HB3 ASP 92 2HB ASP 92 8.146 -5.955 1.014 525 HA PRO 93 HA PRO 93 9.683 -11.276 -1.681 526 HB2 PRO 93 1HB PRO 93 12.114 -10.324 -2.588 527 HB3 PRO 93 2HB PRO 93 10.628 -10.368 -3.542 528 HG2 PRO 93 1HG PRO 93 11.834 -8.097 -2.008 529 HG3 PRO 93 2HG PRO 93 11.080 -8.089 -3.615 530 HD2 PRO 93 1HD PRO 93 9.751 -7.211 -1.487 531 HD3 PRO 93 2HD PRO 93 8.929 -8.164 -2.737 532 H TRP 94 H TRP 94 11.074 -9.128 0.607 533 HA TRP 94 HA TRP 94 13.263 -10.851 1.329 534 HB2 TRP 94 1HB TRP 94 12.147 -8.397 2.697 535 HB3 TRP 94 2HB TRP 94 13.642 -9.218 3.137 536 HD1 TRP 94 HD1 TRP 94 15.430 -9.399 0.877 537 HE1 TRP 94 HE1 TRP 94 16.097 -7.459 -0.677 538 HE3 TRP 94 HE3 TRP 94 11.498 -6.263 1.768 539 HZ2 TRP 94 HZ2 TRP 94 15.089 -4.931 -1.420 540 HZ3 TRP 94 HZ3 TRP 94 11.425 -4.102 0.597 541 HH2 TRP 94 HH2 TRP 94 13.183 -3.450 -0.965 542 H GLY 95 H GLY 95 9.961 -10.326 2.306 543 HA2 GLY 95 1HA GLY 95 8.984 -12.463 3.151 544 HA3 GLY 95 2HA GLY 95 10.326 -12.501 4.282 545 H SER 96 H SER 96 9.321 -9.327 3.912 546 HA SER 96 HA SER 96 7.883 -9.527 6.465 547 HB2 SER 96 1HB SER 96 9.070 -7.085 5.132 548 HB3 SER 96 2HB SER 96 8.422 -7.176 6.769 549 HG SER 96 HG SER 96 10.881 -7.555 6.083 550 H ASP 97 H ASP 97 6.020 -8.144 6.805 551 HA ASP 97 HA ASP 97 4.270 -8.154 4.471 552 HB2 ASP 97 1HB ASP 97 3.692 -7.589 7.393 553 HB3 ASP 97 2HB ASP 97 2.480 -7.682 6.122 554 H TYR 98 H TYR 98 3.444 -6.317 3.525 555 HA TYR 98 HA TYR 98 4.739 -3.825 3.995 556 HB2 TYR 98 1HB TYR 98 2.171 -4.319 2.477 557 HB3 TYR 98 2HB TYR 98 3.164 -2.876 2.388 558 HD1 TYR 98 HD1 TYR 98 2.354 -5.799 0.736 559 HD2 TYR 98 HD2 TYR 98 5.732 -3.431 1.746 560 HE1 TYR 98 HE1 TYR 98 3.590 -6.774 -1.152 561 HE2 TYR 98 HE2 TYR 98 6.982 -4.401 -0.137 562 HH TYR 98 HH TYR 98 5.436 -6.412 -2.531 563 H GLN 99 H GLN 99 3.464 -1.800 4.453 564 HA GLN 99 HA GLN 99 1.441 -2.315 6.521 565 HB2 GLN 99 1HB GLN 99 3.821 -0.473 6.766 566 HB3 GLN 99 2HB GLN 99 2.483 -0.528 7.905 567 HG2 GLN 99 1HG GLN 99 4.341 -2.810 7.275 568 HG3 GLN 99 2HG GLN 99 4.413 -1.778 8.703 569 HE21 GLN 99 1HE2 GLN 99 2.508 -5.020 9.224 570 HE22 GLN 99 2HE2 GLN 99 3.982 -4.686 8.386 571 H LEU 100 H LEU 100 -0.100 -0.789 6.808 572 HA LEU 100 HA LEU 100 -0.059 1.600 5.106 573 HB2 LEU 100 1HB LEU 100 -1.458 -0.160 4.048 574 HB3 LEU 100 2HB LEU 100 -2.408 -0.274 5.510 575 HG LEU 100 HG LEU 100 -3.309 1.055 3.448 576 HD11 LEU 100 1HD1 LEU 100 -4.504 0.904 5.530 577 HD12 LEU 100 2HD1 LEU 100 -4.543 2.567 4.948 578 HD13 LEU 100 3HD1 LEU 100 -3.454 2.119 6.260 579 HD21 LEU 100 1HD2 LEU 100 -2.764 3.347 3.345 580 HD22 LEU 100 2HD2 LEU 100 -1.234 2.471 3.334 581 HD23 LEU 100 3HD2 LEU 100 -1.789 3.257 4.809 582 H LEU 101 H LEU 101 -0.357 3.367 6.339 583 HA LEU 101 HA LEU 101 -1.654 2.980 8.957 584 HB2 LEU 101 1HB LEU 101 0.852 3.319 8.979 585 HB3 LEU 101 2HB LEU 101 0.575 4.925 8.341 586 HG LEU 101 HG LEU 101 1.002 4.685 10.856 587 HD11 LEU 101 1HD1 LEU 101 0.229 6.753 9.871 588 HD12 LEU 101 2HD1 LEU 101 -0.579 6.466 11.414 589 HD13 LEU 101 3HD1 LEU 101 -1.436 6.168 9.901 590 HD21 LEU 101 1HD2 LEU 101 -0.919 4.169 12.240 591 HD22 LEU 101 2HD2 LEU 101 -0.517 2.790 11.216 592 HD23 LEU 101 3HD2 LEU 101 -1.886 3.823 10.806 593 H SER 102 H SER 102 -3.574 3.896 8.886 594 HA SER 102 HA SER 102 -3.890 6.503 7.576 595 HB2 SER 102 1HB SER 102 -6.048 4.588 8.489 596 HB3 SER 102 2HB SER 102 -6.258 6.023 7.483 597 HG SER 102 HG SER 102 -6.175 4.310 6.095 598 HA PRO 103 HA PRO 103 -4.537 8.293 7.592 599 HB2 PRO 103 1HB PRO 103 -4.096 10.805 8.434 600 HB3 PRO 103 2HB PRO 103 -5.711 10.090 8.462 601 HG2 PRO 103 1HG PRO 103 -3.780 10.504 10.695 602 HG3 PRO 103 2HG PRO 103 -5.543 10.669 10.690 603 HD2 PRO 103 1HD PRO 103 -4.157 8.469 11.645 604 HD3 PRO 103 2HD PRO 103 -5.859 8.461 11.145 605 H GLY 104 H GLY 104 -2.748 8.928 6.405 606 HA2 GLY 104 1HA GLY 104 -0.296 7.890 7.354 607 HA3 GLY 104 2HA GLY 104 -0.541 8.728 5.832 608 H GLN 105 H GLN 105 1.740 8.925 7.413 609 HA GLN 105 HA GLN 105 1.646 11.581 8.620 610 HB2 GLN 105 1HB GLN 105 2.892 9.829 9.787 611 HB3 GLN 105 2HB GLN 105 3.873 9.543 8.357 612 HG2 GLN 105 1HG GLN 105 4.793 11.811 8.560 613 HG3 GLN 105 2HG GLN 105 3.820 12.065 10.008 614 HE21 GLN 105 1HE2 GLN 105 7.269 9.952 10.150 615 HE22 GLN 105 2HE2 GLN 105 6.587 10.485 8.653 616 H HIS 106 H HIS 106 2.966 9.802 5.899 617 HA HIS 106 HA HIS 106 4.345 12.062 4.762 618 HB2 HIS 106 1HB HIS 106 3.532 9.425 3.511 619 HB3 HIS 106 2HB HIS 106 4.585 10.616 2.763 620 HD1 HIS 106 HD1 HIS 106 6.949 10.983 3.997 621 HD2 HIS 106 HD2 HIS 106 4.783 7.624 5.135 622 HE1 HIS 106 HE1 HIS 106 8.610 9.442 5.080 623 HE2 HIS 106 HE2 HIS 106 7.243 7.500 5.918 624 H GLY 107 H GLY 107 1.465 10.183 3.844 625 HA2 GLY 107 1HA GLY 107 0.404 12.636 2.572 626 HA3 GLY 107 2HA GLY 107 0.217 11.047 1.843 627 H GLN 108 H GLN 108 -2.065 11.226 1.876 628 HA GLN 108 HA GLN 108 -3.483 11.595 4.328 629 HB2 GLN 108 1HB GLN 108 -4.432 12.055 2.051 630 HB3 GLN 108 2HB GLN 108 -4.497 10.320 1.782 631 HG2 GLN 108 1HG GLN 108 -6.666 11.233 2.440 632 HG3 GLN 108 2HG GLN 108 -6.061 10.059 3.608 633 HE21 GLN 108 1HE2 GLN 108 -5.872 12.306 6.265 634 HE22 GLN 108 2HE2 GLN 108 -5.472 10.738 5.650 635 H VAL 109 H VAL 109 -2.370 8.861 2.459 636 HA VAL 109 HA VAL 109 -2.654 7.171 4.828 637 HB VAL 109 HB VAL 109 -3.147 5.228 3.217 638 HG11 VAL 109 1HG1 VAL 109 -5.309 7.273 3.677 639 HG12 VAL 109 2HG1 VAL 109 -4.752 6.084 4.855 640 HG13 VAL 109 3HG1 VAL 109 -5.543 5.551 3.373 641 HG21 VAL 109 1HG2 VAL 109 -2.736 6.371 1.124 642 HG22 VAL 109 2HG2 VAL 109 -4.007 7.541 1.484 643 HG23 VAL 109 3HG2 VAL 109 -4.420 5.851 1.195 644 H ASP 110 H ASP 110 -0.863 5.988 5.230 645 HA ASP 110 HA ASP 110 1.352 6.346 3.330 646 HB2 ASP 110 1HB ASP 110 1.245 6.024 6.311 647 HB3 ASP 110 2HB ASP 110 2.724 5.659 5.434 648 H ILE 111 H ILE 111 1.708 4.634 2.077 649 HA ILE 111 HA ILE 111 1.655 1.976 3.335 650 HB ILE 111 HB ILE 111 1.966 1.142 0.934 651 HG12 ILE 111 1HG1 ILE 111 0.984 3.936 0.328 652 HG13 ILE 111 2HG1 ILE 111 2.588 3.311 -0.043 653 HG21 ILE 111 1HG2 ILE 111 -0.128 0.964 2.233 654 HG22 ILE 111 2HG2 ILE 111 -0.388 1.118 0.496 655 HG23 ILE 111 3HG2 ILE 111 -0.641 2.508 1.549 656 HD11 ILE 111 1HD1 ILE 111 -0.012 2.332 -1.192 657 HD12 ILE 111 2HD1 ILE 111 1.582 1.661 -1.540 658 HD13 ILE 111 3HD1 ILE 111 1.200 3.316 -2.010 659 H PHE 112 H PHE 112 3.506 1.011 3.786 660 HA PHE 112 HA PHE 112 5.910 1.719 2.325 661 HB2 PHE 112 1HB PHE 112 7.176 2.048 4.491 662 HB3 PHE 112 2HB PHE 112 6.083 3.348 4.040 663 HD1 PHE 112 HD1 PHE 112 3.946 3.634 5.250 664 HD2 PHE 112 HD2 PHE 112 6.875 0.808 6.490 665 HE1 PHE 112 HE1 PHE 112 2.884 3.515 7.466 666 HE2 PHE 112 HE2 PHE 112 5.814 0.679 8.705 667 HZ PHE 112 HZ PHE 112 3.818 2.032 9.195 668 H SER 113 H SER 113 7.724 0.327 2.854 669 HA SER 113 HA SER 113 6.765 -2.376 3.509 670 HB2 SER 113 1HB SER 113 9.048 -1.731 1.649 671 HB3 SER 113 2HB SER 113 8.125 -3.231 1.771 672 HG SER 113 HG SER 113 7.076 -0.730 0.921 673 H LEU 114 H LEU 114 7.741 -3.365 5.117 674 HA LEU 114 HA LEU 114 9.498 -2.015 6.826 675 HB2 LEU 114 1HB LEU 114 8.965 -4.978 6.723 676 HB3 LEU 114 2HB LEU 114 9.584 -4.076 8.089 677 HG LEU 114 HG LEU 114 6.813 -3.853 6.915 678 HD11 LEU 114 1HD1 LEU 114 6.105 -4.772 9.071 679 HD12 LEU 114 2HD1 LEU 114 7.795 -4.957 9.542 680 HD13 LEU 114 3HD1 LEU 114 7.148 -5.890 8.193 681 HD21 LEU 114 1HD2 LEU 114 7.532 -1.692 7.704 682 HD22 LEU 114 2HD2 LEU 114 8.084 -2.395 9.223 683 HD23 LEU 114 3HD2 LEU 114 6.365 -2.376 8.835 684 H GLY 115 H GLY 115 10.060 -4.447 4.351 685 HA2 GLY 115 1HA GLY 115 12.032 -4.702 3.136 686 HA3 GLY 115 2HA GLY 115 12.867 -3.705 4.318 687 HA PRO 116 HA PRO 116 14.088 -8.160 4.886 688 HB2 PRO 116 1HB PRO 116 16.780 -7.038 5.173 689 HB3 PRO 116 2HB PRO 116 16.200 -8.275 4.056 690 HG2 PRO 116 1HG PRO 116 16.900 -5.792 3.243 691 HG3 PRO 116 2HG PRO 116 15.636 -6.739 2.439 692 HD2 PRO 116 1HD PRO 116 15.369 -4.483 4.383 693 HD3 PRO 116 2HD PRO 116 14.401 -4.846 2.940 694 H ASP 117 H ASP 117 14.534 -5.228 6.606 695 HA ASP 117 HA ASP 117 15.527 -6.568 9.003 696 HB2 ASP 117 1HB ASP 117 15.545 -4.126 9.850 697 HB3 ASP 117 2HB ASP 117 16.720 -4.595 8.625 698 H GLY 118 H GLY 118 12.583 -5.562 7.657 699 HA2 GLY 118 1HA GLY 118 10.448 -5.739 8.501 700 HA3 GLY 118 2HA GLY 118 11.142 -6.397 9.972 701 H VAL 119 H VAL 119 12.517 -3.405 9.139 702 HA VAL 119 HA VAL 119 11.205 -2.259 11.482 703 HB VAL 119 HB VAL 119 13.627 -1.286 9.964 704 HG11 VAL 119 1HG1 VAL 119 12.490 -0.374 12.604 705 HG12 VAL 119 2HG1 VAL 119 12.468 0.538 11.096 706 HG13 VAL 119 3HG1 VAL 119 14.003 0.178 11.887 707 HG21 VAL 119 1HG2 VAL 119 13.414 -2.739 12.597 708 HG22 VAL 119 2HG2 VAL 119 14.900 -2.135 11.865 709 HG23 VAL 119 3HG2 VAL 119 13.993 -3.428 11.082 710 HA PRO 120 HA PRO 120 8.699 0.255 8.735 711 HB2 PRO 120 1HB PRO 120 7.036 1.179 10.628 712 HB3 PRO 120 2HB PRO 120 6.941 -0.484 10.041 713 HG2 PRO 120 1HG PRO 120 8.216 0.573 12.531 714 HG3 PRO 120 2HG PRO 120 7.197 -0.863 12.321 715 HD2 PRO 120 1HD PRO 120 9.923 -0.958 12.449 716 HD3 PRO 120 2HD PRO 120 8.945 -2.142 11.559 717 H GLU 121 H GLU 121 8.454 2.438 8.308 718 HA GLU 121 HA GLU 121 8.822 4.680 8.339 719 HB2 GLU 121 1HB GLU 121 9.069 4.174 11.303 720 HB3 GLU 121 2HB GLU 121 9.118 5.780 10.591 721 HG2 GLU 121 1HG GLU 121 6.823 3.849 10.356 722 HG3 GLU 121 2HG GLU 121 6.910 5.202 11.485 723 H SER 122 H SER 122 11.066 2.605 8.350 724 HA SER 122 HA SER 122 13.314 4.125 9.359 725 HB2 SER 122 1HB SER 122 14.372 1.941 8.152 726 HB3 SER 122 2HB SER 122 13.751 1.940 9.803 727 HG SER 122 HG SER 122 12.877 0.513 7.744 728 H ASN 123 H ASN 123 15.339 4.061 7.806 729 HA ASN 123 HA ASN 123 14.665 5.484 5.419 730 HB2 ASN 123 1HB ASN 123 17.286 4.361 6.420 731 HB3 ASN 123 2HB ASN 123 17.137 5.239 4.902 732 HD21 ASN 123 1HD2 ASN 123 17.173 7.191 8.439 733 HD22 ASN 123 2HD2 ASN 123 17.166 5.464 8.346 734 H ASP 124 H ASP 124 15.663 2.217 6.182 735 HA ASP 124 HA ASP 124 15.295 1.356 3.435 736 HB2 ASP 124 1HB ASP 124 15.908 -0.271 5.917 737 HB3 ASP 124 2HB ASP 124 15.869 -0.895 4.275 738 H ASP 125 H ASP 125 13.176 2.459 3.890 739 HA ASP 125 HA ASP 125 11.180 0.333 4.228 740 HB2 ASP 125 1HB ASP 125 11.346 2.882 5.707 741 HB3 ASP 125 2HB ASP 125 9.780 2.571 4.972 742 H ILE 126 H ILE 126 10.437 0.095 2.203 743 HA ILE 126 HA ILE 126 10.606 2.240 0.298 744 HB ILE 126 HB ILE 126 9.253 -0.439 -0.042 745 HG12 ILE 126 1HG1 ILE 126 11.618 -0.733 0.548 746 HG13 ILE 126 2HG1 ILE 126 11.340 -1.158 -1.136 747 HG21 ILE 126 1HG2 ILE 126 8.600 1.312 -1.656 748 HG22 ILE 126 2HG2 ILE 126 9.460 -0.029 -2.414 749 HG23 ILE 126 3HG2 ILE 126 10.295 1.497 -2.108 750 HD11 ILE 126 1HD1 ILE 126 12.243 1.006 -1.825 751 HD12 ILE 126 2HD1 ILE 126 13.407 0.078 -0.879 752 HD13 ILE 126 3HD1 ILE 126 12.533 1.418 -0.136 753 H GLY 127 H GLY 127 9.246 3.872 0.598 754 HA2 GLY 127 1HA GLY 127 6.408 3.271 1.116 755 HA3 GLY 127 2HA GLY 127 7.218 4.775 1.534 756 H ASN 128 H ASN 128 4.808 4.606 0.067 757 HA ASN 128 HA ASN 128 5.278 4.864 -2.719 758 HB2 ASN 128 1HB ASN 128 3.002 5.810 -2.820 759 HB3 ASN 128 2HB ASN 128 3.055 4.329 -1.875 760 HD21 ASN 128 1HD2 ASN 128 1.013 6.997 -0.209 761 HD22 ASN 128 2HD2 ASN 128 1.049 6.365 -1.826 762 H TRP 129 H TRP 129 5.100 7.151 -0.071 763 HA TRP 129 HA TRP 129 5.244 9.513 -1.601 764 HB2 TRP 129 1HB TRP 129 4.507 9.427 0.752 765 HB3 TRP 129 2HB TRP 129 6.135 8.985 1.244 766 HD1 TRP 129 HD1 TRP 129 4.082 11.971 0.025 767 HE1 TRP 129 HE1 TRP 129 5.379 14.130 0.544 768 HE3 TRP 129 HE3 TRP 129 8.481 9.914 1.614 769 HZ2 TRP 129 HZ2 TRP 129 7.925 14.864 1.504 770 HZ3 TRP 129 HZ3 TRP 129 10.296 11.415 2.321 771 HH2 TRP 129 HH2 TRP 129 10.020 13.839 2.265 772 H THR 130 H THR 130 7.652 7.277 -0.452 773 HA THR 130 HA THR 130 9.843 9.084 -0.947 774 HB THR 130 HB THR 130 11.198 6.935 -0.446 775 HG1 THR 130 HG1 THR 130 9.332 5.542 -0.741 776 HG21 THR 130 1HG2 THR 130 9.392 8.087 1.680 777 HG22 THR 130 2HG2 THR 130 10.904 8.807 1.128 778 HG23 THR 130 3HG2 THR 130 10.918 7.247 1.951 779 H ILE 131 H ILE 131 8.214 6.482 -2.638 780 HA ILE 131 HA ILE 131 10.371 6.178 -4.542 781 HB ILE 131 HB ILE 131 8.920 4.243 -3.901 782 HG12 ILE 131 1HG1 ILE 131 8.662 3.363 -6.206 783 HG13 ILE 131 2HG1 ILE 131 8.962 4.979 -6.833 784 HG21 ILE 131 1HG2 ILE 131 6.839 5.632 -5.580 785 HG22 ILE 131 2HG2 ILE 131 6.782 5.428 -3.831 786 HG23 ILE 131 3HG2 ILE 131 6.713 4.016 -4.885 787 HD11 ILE 131 1HD1 ILE 131 10.937 3.541 -6.945 788 HD12 ILE 131 2HD1 ILE 131 10.899 3.368 -5.191 789 HD13 ILE 131 3HD1 ILE 131 11.198 4.948 -5.913 790 H GLY 132 H GLY 132 7.394 7.974 -4.289 791 HA2 GLY 132 1HA GLY 132 7.888 10.003 -5.917 792 HA3 GLY 132 2HA GLY 132 7.520 8.758 -7.099 793 H PHE 133 H PHE 133 5.482 7.452 -5.597 794 HA PHE 133 HA PHE 133 3.293 9.048 -6.477 795 HB2 PHE 133 1HB PHE 133 3.390 6.444 -4.949 796 HB3 PHE 133 2HB PHE 133 1.908 7.174 -5.551 797 HD1 PHE 133 HD1 PHE 133 1.550 7.386 -7.993 798 HD2 PHE 133 HD2 PHE 133 4.832 5.222 -6.367 799 HE1 PHE 133 HE1 PHE 133 1.861 6.245 -10.150 800 HE2 PHE 133 HE2 PHE 133 5.152 4.078 -8.523 801 HZ PHE 133 HZ PHE 133 3.664 4.588 -10.416 802 H HIS 134 H HIS 134 2.963 10.897 -5.297 803 HA HIS 134 HA HIS 134 2.133 10.452 -2.526 804 HB2 HIS 134 1HB HIS 134 3.243 12.492 -1.763 805 HB3 HIS 134 2HB HIS 134 4.404 11.336 -2.393 806 HD1 HIS 134 HD1 HIS 134 5.275 11.911 -4.926 807 HD2 HIS 134 HD2 HIS 134 3.457 14.984 -2.787 808 HE1 HIS 134 HE1 HIS 134 6.005 14.042 -6.042 809 HE2 HIS 134 HE2 HIS 134 4.814 15.878 -4.798 810 H HIS 135 H HIS 135 0.066 10.893 -2.474 811 HA HIS 135 HA HIS 135 -1.163 12.794 -4.251 812 HB2 HIS 135 1HB HIS 135 -2.220 11.076 -2.010 813 HB3 HIS 135 2HB HIS 135 -3.227 12.279 -2.804 814 HD1 HIS 135 HD1 HIS 135 -3.481 11.904 -5.496 815 HD2 HIS 135 HD2 HIS 135 -2.187 8.656 -3.245 816 HE1 HIS 135 HE1 HIS 135 -3.879 9.882 -6.935 817 HE2 HIS 135 HE2 HIS 135 -2.941 7.954 -5.619 818 H HIS 136 H HIS 136 0.087 14.656 -3.587 819 HA HIS 136 HA HIS 136 -0.674 15.762 -0.977 820 HB2 HIS 136 1HB HIS 136 1.745 15.694 -1.577 821 HB3 HIS 136 2HB HIS 136 1.408 16.771 -2.924 822 HD1 HIS 136 HD1 HIS 136 1.848 19.142 -2.426 823 HD2 HIS 136 HD2 HIS 136 0.875 17.009 1.002 824 HE1 HIS 136 HE1 HIS 136 2.062 20.780 -0.530 825 HE2 HIS 136 HE2 HIS 136 1.633 19.420 1.548 826 H HIS 137 H HIS 137 -1.422 15.946 -4.269 827 HA HIS 137 HA HIS 137 -2.469 18.666 -4.115 828 HB2 HIS 137 1HB HIS 137 -2.432 16.640 -6.362 829 HB3 HIS 137 2HB HIS 137 -3.197 18.219 -6.487 830 HD1 HIS 137 HD1 HIS 137 -0.487 16.882 -7.908 831 HD2 HIS 137 HD2 HIS 137 -0.807 20.065 -5.257 832 HE1 HIS 137 HE1 HIS 137 1.567 18.272 -8.274 833 HE2 HIS 137 HE2 HIS 137 1.455 20.059 -6.506 834 H HIS 138 H HIS 138 -3.540 16.663 -2.369 835 HA HIS 138 HA HIS 138 -6.012 15.695 -3.452 836 HB2 HIS 138 1HB HIS 138 -4.816 14.421 -1.737 837 HB3 HIS 138 2HB HIS 138 -4.991 15.754 -0.603 838 HD1 HIS 138 HD1 HIS 138 -7.078 13.165 -2.408 839 HD2 HIS 138 HD2 HIS 138 -7.326 15.760 0.830 840 HE1 HIS 138 HE1 HIS 138 -9.204 12.558 -1.212 841 HE2 HIS 138 HE2 HIS 138 -9.411 14.244 0.643 842 H HIS 139 H HIS 139 -7.268 17.376 -4.086 843 HA HIS 139 HA HIS 139 -8.517 18.891 -1.926 844 HB2 HIS 139 1HB HIS 139 -8.438 20.997 -3.135 845 HB3 HIS 139 2HB HIS 139 -6.799 20.400 -2.917 846 HD1 HIS 139 HD1 HIS 139 -5.488 19.736 -5.033 847 HD2 HIS 139 HD2 HIS 139 -9.348 21.078 -5.792 848 HE1 HIS 139 HE1 HIS 139 -5.601 20.111 -7.517 849 HE2 HIS 139 HE2 HIS 139 -7.886 21.088 -7.924 850 H LYS 140 H LYS 140 -10.685 19.424 -2.350 851 HA LYS 140 HA LYS 140 -11.806 17.911 -4.594 852 HB2 LYS 140 1HB LYS 140 -12.544 17.332 -2.275 853 HB3 LYS 140 2HB LYS 140 -13.233 18.945 -2.138 854 HG2 LYS 140 1HG LYS 140 -14.819 18.497 -3.853 855 HG3 LYS 140 2HG LYS 140 -14.032 16.974 -4.261 856 HD2 LYS 140 1HD LYS 140 -16.031 16.551 -2.964 857 HD3 LYS 140 2HD LYS 140 -14.605 16.102 -2.031 858 HE2 LYS 140 1HE LYS 140 -14.742 18.214 -0.805 859 HE3 LYS 140 2HE LYS 140 -16.158 18.674 -1.749 860 HZ1 LYS 140 1HZ LYS 140 -16.785 17.780 0.401 861 HZ2 LYS 140 2HZ LYS 140 -15.979 16.331 0.068 862 HZ3 LYS 140 3HZ LYS 140 -17.335 16.772 -0.837 Start of MODEL 12 1 H1 MET 25 1H MET 25 14.386 -15.150 -7.533 2 H2 MET 25 2H MET 25 14.951 -16.701 -7.906 3 H3 MET 25 3H MET 25 14.908 -15.500 -9.099 4 HA MET 25 HA MET 25 16.597 -15.467 -6.672 5 HB2 MET 25 1HB MET 25 18.476 -15.796 -8.173 6 HB3 MET 25 2HB MET 25 17.324 -17.108 -8.384 7 HG2 MET 25 1HG MET 25 16.477 -16.072 -10.404 8 HG3 MET 25 2HG MET 25 17.564 -14.703 -10.178 9 HE1 MET 25 1HE MET 25 18.551 -14.923 -12.587 10 HE2 MET 25 2HE MET 25 17.423 -16.241 -12.898 11 HE3 MET 25 3HE MET 25 19.133 -16.437 -13.279 12 H GLY 26 H GLY 26 17.851 -13.629 -6.394 13 HA2 GLY 26 1HA GLY 26 17.831 -11.510 -8.333 14 HA3 GLY 26 2HA GLY 26 16.810 -11.177 -6.941 15 H ASN 27 H ASN 27 19.472 -10.106 -8.013 16 HA ASN 27 HA ASN 27 20.742 -10.025 -5.377 17 HB2 ASN 27 1HB ASN 27 22.983 -10.228 -6.382 18 HB3 ASN 27 2HB ASN 27 22.019 -11.675 -6.643 19 HD21 ASN 27 1HD2 ASN 27 21.990 -11.420 -10.122 20 HD22 ASN 27 2HD2 ASN 27 21.293 -12.156 -8.717 21 H LYS 28 H LYS 28 19.116 -8.279 -7.306 22 HA LYS 28 HA LYS 28 20.910 -5.947 -7.176 23 HB2 LYS 28 1HB LYS 28 19.296 -6.972 -9.386 24 HB3 LYS 28 2HB LYS 28 18.959 -5.285 -9.028 25 HG2 LYS 28 1HG LYS 28 20.663 -5.471 -10.732 26 HG3 LYS 28 2HG LYS 28 21.334 -4.759 -9.266 27 HD2 LYS 28 1HD LYS 28 22.266 -6.947 -8.649 28 HD3 LYS 28 2HD LYS 28 21.619 -7.633 -10.139 29 HE2 LYS 28 1HE LYS 28 23.964 -7.124 -10.424 30 HE3 LYS 28 2HE LYS 28 22.995 -6.049 -11.431 31 HZ1 LYS 28 1HZ LYS 28 24.779 -4.876 -10.287 32 HZ2 LYS 28 2HZ LYS 28 24.150 -5.341 -8.789 33 HZ3 LYS 28 3HZ LYS 28 23.266 -4.308 -9.793 34 H GLU 29 H GLU 29 20.294 -4.691 -5.572 35 HA GLU 29 HA GLU 29 17.878 -4.846 -4.198 36 HB2 GLU 29 1HB GLU 29 19.903 -3.859 -3.238 37 HB3 GLU 29 2HB GLU 29 19.793 -2.515 -4.363 38 HG2 GLU 29 1HG GLU 29 17.628 -1.895 -3.354 39 HG3 GLU 29 2HG GLU 29 17.838 -3.192 -2.180 40 H LYS 30 H LYS 30 18.794 -2.919 -6.970 41 HA LYS 30 HA LYS 30 16.624 -1.147 -6.988 42 HB2 LYS 30 1HB LYS 30 18.062 -2.307 -9.379 43 HB3 LYS 30 2HB LYS 30 17.063 -0.861 -9.373 44 HG2 LYS 30 1HG LYS 30 18.858 -0.249 -7.441 45 HG3 LYS 30 2HG LYS 30 19.842 -1.244 -8.516 46 HD2 LYS 30 1HD LYS 30 18.265 1.215 -9.266 47 HD3 LYS 30 2HD LYS 30 20.019 1.077 -9.166 48 HE2 LYS 30 1HE LYS 30 20.058 -0.453 -11.016 49 HE3 LYS 30 2HE LYS 30 18.296 -0.522 -11.051 50 HZ1 LYS 30 1HZ LYS 30 19.959 1.868 -11.624 51 HZ2 LYS 30 2HZ LYS 30 18.267 1.835 -11.619 52 HZ3 LYS 30 3HZ LYS 30 19.127 0.938 -12.765 53 H ALA 31 H ALA 31 17.007 -4.398 -8.308 54 HA ALA 31 HA ALA 31 14.410 -4.515 -9.463 55 HB1 ALA 31 1HB ALA 31 16.217 -5.949 -10.249 56 HB2 ALA 31 2HB ALA 31 14.845 -6.910 -9.700 57 HB3 ALA 31 3HB ALA 31 16.275 -6.752 -8.680 58 H ASP 32 H ASP 32 15.800 -5.465 -6.354 59 HA ASP 32 HA ASP 32 13.561 -6.778 -5.287 60 HB2 ASP 32 1HB ASP 32 15.791 -5.233 -3.967 61 HB3 ASP 32 2HB ASP 32 14.513 -6.001 -3.035 62 H ARG 33 H ARG 33 14.515 -3.349 -5.108 63 HA ARG 33 HA ARG 33 12.190 -2.612 -3.652 64 HB2 ARG 33 1HB ARG 33 12.810 -0.310 -4.026 65 HB3 ARG 33 2HB ARG 33 14.220 -1.245 -3.569 66 HG2 ARG 33 1HG ARG 33 14.891 -1.324 -5.943 67 HG3 ARG 33 2HG ARG 33 13.507 -0.299 -6.335 68 HD2 ARG 33 1HD ARG 33 14.391 1.416 -4.790 69 HD3 ARG 33 2HD ARG 33 15.805 0.403 -4.514 70 HE ARG 33 HE ARG 33 15.294 1.077 -7.282 71 HH11 ARG 33 1HH1 ARG 33 16.946 1.937 -4.323 72 HH12 ARG 33 2HH1 ARG 33 18.144 2.905 -5.122 73 HH21 ARG 33 1HH2 ARG 33 16.858 2.371 -8.341 74 HH22 ARG 33 2HH2 ARG 33 18.096 3.156 -7.409 75 H GLN 34 H GLN 34 12.944 -2.714 -7.103 76 HA GLN 34 HA GLN 34 10.583 -1.474 -7.999 77 HB2 GLN 34 1HB GLN 34 12.409 -3.505 -9.253 78 HB3 GLN 34 2HB GLN 34 10.962 -2.943 -10.077 79 HG2 GLN 34 1HG GLN 34 13.220 -1.199 -9.125 80 HG3 GLN 34 2HG GLN 34 12.953 -1.723 -10.787 81 HE21 GLN 34 1HE2 GLN 34 11.545 1.711 -10.039 82 HE22 GLN 34 2HE2 GLN 34 13.046 0.961 -9.617 83 H LYS 35 H LYS 35 11.259 -4.808 -7.056 84 HA LYS 35 HA LYS 35 8.728 -5.904 -7.634 85 HB2 LYS 35 1HB LYS 35 10.526 -7.380 -7.068 86 HB3 LYS 35 2HB LYS 35 10.801 -6.561 -5.538 87 HG2 LYS 35 1HG LYS 35 9.718 -8.741 -5.258 88 HG3 LYS 35 2HG LYS 35 8.724 -7.412 -4.659 89 HD2 LYS 35 1HD LYS 35 7.422 -7.469 -6.743 90 HD3 LYS 35 2HD LYS 35 8.400 -8.832 -7.301 91 HE2 LYS 35 1HE LYS 35 7.592 -10.227 -5.553 92 HE3 LYS 35 2HE LYS 35 6.829 -8.863 -4.734 93 HZ1 LYS 35 1HZ LYS 35 5.261 -8.671 -6.514 94 HZ2 LYS 35 2HZ LYS 35 5.249 -10.264 -5.953 95 HZ3 LYS 35 3HZ LYS 35 6.031 -9.884 -7.402 96 H VAL 36 H VAL 36 9.990 -4.222 -4.805 97 HA VAL 36 HA VAL 36 7.702 -4.324 -3.194 98 HB VAL 36 HB VAL 36 9.794 -2.141 -3.369 99 HG11 VAL 36 1HG1 VAL 36 7.737 -1.420 -2.225 100 HG12 VAL 36 2HG1 VAL 36 9.125 -1.505 -1.138 101 HG13 VAL 36 3HG1 VAL 36 7.903 -2.778 -1.111 102 HG21 VAL 36 1HG2 VAL 36 9.625 -4.543 -1.555 103 HG22 VAL 36 2HG2 VAL 36 10.849 -3.276 -1.483 104 HG23 VAL 36 3HG2 VAL 36 10.754 -4.333 -2.892 105 H VAL 37 H VAL 37 8.748 -1.970 -5.625 106 HA VAL 37 HA VAL 37 6.622 -0.167 -5.402 107 HB VAL 37 HB VAL 37 8.260 -0.855 -7.850 108 HG11 VAL 37 1HG1 VAL 37 7.589 1.341 -8.707 109 HG12 VAL 37 2HG1 VAL 37 6.535 1.560 -7.311 110 HG13 VAL 37 3HG1 VAL 37 6.196 0.283 -8.477 111 HG21 VAL 37 1HG2 VAL 37 8.586 1.349 -5.816 112 HG22 VAL 37 2HG2 VAL 37 9.572 1.120 -7.259 113 HG23 VAL 37 3HG2 VAL 37 9.607 -0.081 -5.967 114 H SER 38 H SER 38 6.916 -3.145 -7.289 115 HA SER 38 HA SER 38 4.604 -2.807 -8.851 116 HB2 SER 38 1HB SER 38 6.338 -4.477 -9.365 117 HB3 SER 38 2HB SER 38 5.898 -5.381 -7.918 118 HG SER 38 HG SER 38 3.985 -4.782 -9.913 119 H ASP 39 H ASP 39 5.075 -4.499 -5.749 120 HA ASP 39 HA ASP 39 2.306 -5.101 -5.464 121 HB2 ASP 39 1HB ASP 39 4.558 -5.064 -3.455 122 HB3 ASP 39 2HB ASP 39 2.916 -5.573 -3.068 123 H LEU 40 H LEU 40 4.374 -2.472 -4.536 124 HA LEU 40 HA LEU 40 2.728 -1.117 -2.736 125 HB2 LEU 40 1HB LEU 40 5.170 -0.721 -3.333 126 HB3 LEU 40 2HB LEU 40 4.586 0.177 -4.716 127 HG LEU 40 HG LEU 40 3.395 1.705 -3.132 128 HD11 LEU 40 1HD1 LEU 40 4.159 1.682 -0.785 129 HD12 LEU 40 2HD1 LEU 40 4.986 0.156 -1.091 130 HD13 LEU 40 3HD1 LEU 40 3.229 0.246 -1.212 131 HD21 LEU 40 1HD2 LEU 40 5.469 2.858 -2.422 132 HD22 LEU 40 2HD2 LEU 40 5.493 2.359 -4.112 133 HD23 LEU 40 3HD2 LEU 40 6.388 1.434 -2.907 134 H VAL 41 H VAL 41 2.993 -0.799 -6.282 135 HA VAL 41 HA VAL 41 1.002 1.196 -6.490 136 HB VAL 41 HB VAL 41 0.881 0.732 -8.865 137 HG11 VAL 41 1HG1 VAL 41 2.722 2.083 -8.097 138 HG12 VAL 41 2HG1 VAL 41 3.242 1.083 -9.454 139 HG13 VAL 41 3HG1 VAL 41 3.697 0.642 -7.808 140 HG21 VAL 41 1HG2 VAL 41 2.201 -1.053 -9.903 141 HG22 VAL 41 2HG2 VAL 41 0.935 -1.689 -8.853 142 HG23 VAL 41 3HG2 VAL 41 2.610 -1.669 -8.302 143 H ALA 42 H ALA 42 0.848 -2.341 -6.521 144 HA ALA 42 HA ALA 42 -1.897 -2.602 -7.069 145 HB1 ALA 42 1HB ALA 42 -0.087 -4.283 -5.338 146 HB2 ALA 42 2HB ALA 42 -0.500 -4.555 -7.030 147 HB3 ALA 42 3HB ALA 42 -1.732 -4.739 -5.776 148 H LEU 43 H LEU 43 -0.168 -2.108 -4.013 149 HA LEU 43 HA LEU 43 -2.385 -2.089 -2.291 150 HB2 LEU 43 1HB LEU 43 0.234 -0.597 -2.101 151 HB3 LEU 43 2HB LEU 43 -0.920 -0.729 -0.790 152 HG LEU 43 HG LEU 43 0.519 -3.063 -2.047 153 HD11 LEU 43 1HD1 LEU 43 1.769 -3.093 0.078 154 HD12 LEU 43 2HD1 LEU 43 0.984 -1.578 0.529 155 HD13 LEU 43 3HD1 LEU 43 2.063 -1.630 -0.862 156 HD21 LEU 43 1HD2 LEU 43 -0.346 -4.318 -0.151 157 HD22 LEU 43 2HD2 LEU 43 -1.670 -3.630 -1.090 158 HD23 LEU 43 3HD2 LEU 43 -1.190 -2.884 0.433 159 H GLU 44 H GLU 44 -0.736 0.579 -3.957 160 HA GLU 44 HA GLU 44 -2.358 2.635 -2.924 161 HB2 GLU 44 1HB GLU 44 -0.130 2.945 -4.026 162 HB3 GLU 44 2HB GLU 44 -0.902 2.620 -5.572 163 HG2 GLU 44 1HG GLU 44 -2.428 4.555 -5.101 164 HG3 GLU 44 2HG GLU 44 -1.402 4.929 -3.719 165 H GLY 45 H GLY 45 -2.549 0.726 -5.897 166 HA2 GLY 45 1HA GLY 45 -4.775 2.010 -7.035 167 HA3 GLY 45 2HA GLY 45 -4.274 0.356 -7.357 168 H ALA 46 H ALA 46 -4.546 -0.663 -4.737 169 HA ALA 46 HA ALA 46 -7.300 -1.262 -4.634 170 HB1 ALA 46 1HB ALA 46 -5.521 -2.728 -3.744 171 HB2 ALA 46 2HB ALA 46 -6.803 -2.422 -2.573 172 HB3 ALA 46 3HB ALA 46 -5.260 -1.578 -2.434 173 H LEU 47 H LEU 47 -5.266 0.938 -2.766 174 HA LEU 47 HA LEU 47 -7.231 1.910 -1.012 175 HB2 LEU 47 1HB LEU 47 -4.590 2.862 -1.993 176 HB3 LEU 47 2HB LEU 47 -5.622 4.032 -1.200 177 HG LEU 47 HG LEU 47 -5.550 2.860 0.859 178 HD11 LEU 47 1HD1 LEU 47 -5.856 0.593 0.081 179 HD12 LEU 47 2HD1 LEU 47 -4.441 0.685 1.130 180 HD13 LEU 47 3HD1 LEU 47 -4.235 0.587 -0.618 181 HD21 LEU 47 1HD2 LEU 47 -2.823 2.748 -0.417 182 HD22 LEU 47 2HD2 LEU 47 -3.147 2.719 1.315 183 HD23 LEU 47 3HD2 LEU 47 -3.553 4.149 0.368 184 H ASP 48 H ASP 48 -6.116 3.167 -4.145 185 HA ASP 48 HA ASP 48 -7.827 5.394 -4.216 186 HB2 ASP 48 1HB ASP 48 -6.260 3.888 -6.248 187 HB3 ASP 48 2HB ASP 48 -7.522 4.969 -6.830 188 H MET 49 H MET 49 -8.287 2.082 -5.380 189 HA MET 49 HA MET 49 -10.832 2.613 -6.538 190 HB2 MET 49 1HB MET 49 -9.529 0.021 -5.710 191 HB3 MET 49 2HB MET 49 -11.085 0.110 -6.526 192 HG2 MET 49 1HG MET 49 -8.453 1.089 -7.609 193 HG3 MET 49 2HG MET 49 -9.302 -0.376 -8.096 194 HE1 MET 49 1HE MET 49 -9.035 0.476 -10.638 195 HE2 MET 49 2HE MET 49 -8.259 1.956 -10.073 196 HE3 MET 49 3HE MET 49 -9.615 2.045 -11.197 197 H TYR 50 H TYR 50 -9.774 1.448 -3.380 198 HA TYR 50 HA TYR 50 -12.333 0.883 -2.339 199 HB2 TYR 50 1HB TYR 50 -10.068 0.295 -1.311 200 HB3 TYR 50 2HB TYR 50 -10.013 1.956 -0.729 201 HD1 TYR 50 HD1 TYR 50 -11.647 2.724 0.980 202 HD2 TYR 50 HD2 TYR 50 -11.467 -1.335 -0.277 203 HE1 TYR 50 HE1 TYR 50 -12.943 2.058 2.963 204 HE2 TYR 50 HE2 TYR 50 -12.765 -2.009 1.694 205 HH TYR 50 HH TYR 50 -14.518 0.046 3.554 206 H LYS 51 H LYS 51 -10.382 3.824 -2.430 207 HA LYS 51 HA LYS 51 -12.223 5.462 -1.025 208 HB2 LYS 51 1HB LYS 51 -9.868 6.093 -1.292 209 HB3 LYS 51 2HB LYS 51 -10.094 6.236 -3.031 210 HG2 LYS 51 1HG LYS 51 -11.753 8.026 -2.620 211 HG3 LYS 51 2HG LYS 51 -11.378 7.932 -0.901 212 HD2 LYS 51 1HD LYS 51 -9.029 8.479 -1.418 213 HD3 LYS 51 2HD LYS 51 -9.467 8.640 -3.120 214 HE2 LYS 51 1HE LYS 51 -10.570 10.280 -0.846 215 HE3 LYS 51 2HE LYS 51 -9.365 10.817 -2.014 216 HZ1 LYS 51 1HZ LYS 51 -12.187 10.087 -2.591 217 HZ2 LYS 51 2HZ LYS 51 -11.035 10.480 -3.767 218 HZ3 LYS 51 3HZ LYS 51 -11.512 11.639 -2.632 219 H LEU 52 H LEU 52 -11.886 4.537 -4.388 220 HA LEU 52 HA LEU 52 -13.608 6.482 -5.480 221 HB2 LEU 52 1HB LEU 52 -12.072 5.079 -6.813 222 HB3 LEU 52 2HB LEU 52 -13.057 3.675 -6.451 223 HG LEU 52 HG LEU 52 -14.945 4.707 -7.668 224 HD11 LEU 52 1HD1 LEU 52 -14.495 6.662 -9.099 225 HD12 LEU 52 2HD1 LEU 52 -12.926 6.847 -8.318 226 HD13 LEU 52 3HD1 LEU 52 -14.406 7.044 -7.381 227 HD21 LEU 52 1HD2 LEU 52 -13.460 3.159 -8.811 228 HD22 LEU 52 2HD2 LEU 52 -12.377 4.486 -9.233 229 HD23 LEU 52 3HD2 LEU 52 -14.003 4.424 -9.913 230 H ASP 53 H ASP 53 -14.198 3.156 -4.391 231 HA ASP 53 HA ASP 53 -17.014 3.321 -4.889 232 HB2 ASP 53 1HB ASP 53 -15.908 1.182 -5.073 233 HB3 ASP 53 2HB ASP 53 -15.366 1.274 -3.401 234 H ASN 54 H ASN 54 -14.976 3.681 -2.023 235 HA ASN 54 HA ASN 54 -17.404 3.881 -0.370 236 HB2 ASN 54 1HB ASN 54 -14.555 3.312 0.465 237 HB3 ASN 54 2HB ASN 54 -15.938 3.391 1.551 238 HD21 ASN 54 1HD2 ASN 54 -15.236 0.119 -0.720 239 HD22 ASN 54 2HD2 ASN 54 -14.325 1.575 -0.906 240 H SER 55 H SER 55 -15.646 5.958 -1.966 241 HA SER 55 HA SER 55 -15.544 8.219 -1.895 242 HB2 SER 55 1HB SER 55 -16.816 8.035 0.840 243 HB3 SER 55 2HB SER 55 -16.704 9.476 -0.170 244 HG SER 55 HG SER 55 -17.821 7.766 -1.723 245 H ARG 56 H ARG 56 -14.507 6.664 1.133 246 HA ARG 56 HA ARG 56 -12.322 8.635 1.245 247 HB2 ARG 56 1HB ARG 56 -12.320 8.291 3.708 248 HB3 ARG 56 2HB ARG 56 -13.801 9.004 3.096 249 HG2 ARG 56 1HG ARG 56 -14.618 7.473 4.600 250 HG3 ARG 56 2HG ARG 56 -14.655 6.535 3.106 251 HD2 ARG 56 1HD ARG 56 -12.576 5.461 3.680 252 HD3 ARG 56 2HD ARG 56 -12.408 6.475 5.112 253 HE ARG 56 HE ARG 56 -14.710 5.288 5.646 254 HH11 ARG 56 1HH1 ARG 56 -11.737 3.970 4.378 255 HH12 ARG 56 2HH1 ARG 56 -11.990 2.390 5.066 256 HH21 ARG 56 1HH2 ARG 56 -15.028 3.214 6.594 257 HH22 ARG 56 2HH2 ARG 56 -13.857 1.965 6.316 258 H TYR 57 H TYR 57 -10.364 7.849 2.423 259 HA TYR 57 HA TYR 57 -9.397 5.506 1.122 260 HB2 TYR 57 1HB TYR 57 -8.239 7.487 3.046 261 HB3 TYR 57 2HB TYR 57 -7.373 5.993 2.712 262 HD1 TYR 57 HD1 TYR 57 -7.642 9.331 1.797 263 HD2 TYR 57 HD2 TYR 57 -7.210 5.465 0.075 264 HE1 TYR 57 HE1 TYR 57 -6.650 10.341 -0.215 265 HE2 TYR 57 HE2 TYR 57 -6.221 6.464 -1.940 266 HH TYR 57 HH TYR 57 -5.136 9.659 -2.059 267 HA PRO 58 HA PRO 58 -10.165 2.418 4.213 268 HB2 PRO 58 1HB PRO 58 -8.223 0.652 3.580 269 HB3 PRO 58 2HB PRO 58 -9.645 0.898 2.558 270 HG2 PRO 58 1HG PRO 58 -6.881 2.009 2.267 271 HG3 PRO 58 2HG PRO 58 -7.940 1.315 1.024 272 HD2 PRO 58 1HD PRO 58 -7.651 3.985 1.379 273 HD3 PRO 58 2HD PRO 58 -9.165 3.256 0.811 274 H THR 59 H THR 59 -9.429 1.723 6.192 275 HA THR 59 HA THR 59 -7.210 3.196 7.322 276 HB THR 59 HB THR 59 -7.956 2.128 9.470 277 HG1 THR 59 HG1 THR 59 -10.081 1.119 9.328 278 HG21 THR 59 1HG2 THR 59 -10.088 3.593 7.910 279 HG22 THR 59 2HG2 THR 59 -8.752 4.347 8.779 280 HG23 THR 59 3HG2 THR 59 -9.994 3.462 9.665 281 H THR 60 H THR 60 -6.060 1.698 9.159 282 HA THR 60 HA THR 60 -4.050 0.452 7.775 283 HB THR 60 HB THR 60 -3.754 1.237 10.046 284 HG1 THR 60 HG1 THR 60 -2.347 -0.423 9.294 285 HG21 THR 60 1HG2 THR 60 -4.589 -0.041 11.972 286 HG22 THR 60 2HG2 THR 60 -5.486 -1.092 10.877 287 HG23 THR 60 3HG2 THR 60 -5.906 0.616 11.001 288 H GLU 61 H GLU 61 -6.909 -1.114 9.186 289 HA GLU 61 HA GLU 61 -6.013 -3.765 8.548 290 HB2 GLU 61 1HB GLU 61 -7.542 -3.465 10.385 291 HB3 GLU 61 2HB GLU 61 -8.702 -2.650 9.349 292 HG2 GLU 61 1HG GLU 61 -9.008 -4.751 8.095 293 HG3 GLU 61 2HG GLU 61 -7.924 -5.552 9.235 294 H GLN 62 H GLN 62 -8.200 -1.419 7.122 295 HA GLN 62 HA GLN 62 -9.325 -3.206 5.216 296 HB2 GLN 62 1HB GLN 62 -9.360 -0.191 5.371 297 HB3 GLN 62 2HB GLN 62 -10.363 -1.158 4.300 298 HG2 GLN 62 1HG GLN 62 -11.629 -2.015 6.062 299 HG3 GLN 62 2HG GLN 62 -10.428 -1.552 7.268 300 HE21 GLN 62 1HE2 GLN 62 -12.591 1.088 7.985 301 HE22 GLN 62 2HE2 GLN 62 -11.959 -0.445 8.482 302 H GLY 63 H GLY 63 -6.574 -1.049 5.187 303 HA2 GLY 63 1HA GLY 63 -6.426 -0.489 2.449 304 HA3 GLY 63 2HA GLY 63 -5.065 -0.475 3.556 305 H LEU 64 H LEU 64 -4.699 -3.064 4.230 306 HA LEU 64 HA LEU 64 -3.585 -4.160 1.850 307 HB2 LEU 64 1HB LEU 64 -3.599 -4.852 4.704 308 HB3 LEU 64 2HB LEU 64 -3.474 -6.223 3.619 309 HG LEU 64 HG LEU 64 -1.519 -5.059 2.531 310 HD11 LEU 64 1HD1 LEU 64 -1.707 -3.292 4.964 311 HD12 LEU 64 2HD1 LEU 64 -1.990 -2.791 3.297 312 HD13 LEU 64 3HD1 LEU 64 -0.382 -3.319 3.798 313 HD21 LEU 64 1HD2 LEU 64 -1.177 -6.895 4.045 314 HD22 LEU 64 2HD2 LEU 64 -1.339 -5.827 5.437 315 HD23 LEU 64 3HD2 LEU 64 0.041 -5.658 4.352 316 H GLN 65 H GLN 65 -6.512 -4.729 3.649 317 HA GLN 65 HA GLN 65 -7.097 -7.274 2.547 318 HB2 GLN 65 1HB GLN 65 -8.794 -5.213 3.939 319 HB3 GLN 65 2HB GLN 65 -9.442 -6.750 3.382 320 HG2 GLN 65 1HG GLN 65 -7.175 -6.420 5.334 321 HG3 GLN 65 2HG GLN 65 -8.846 -6.795 5.755 322 HE21 GLN 65 1HE2 GLN 65 -6.623 -9.851 5.430 323 HE22 GLN 65 2HE2 GLN 65 -6.339 -8.308 6.154 324 H ALA 66 H ALA 66 -7.523 -4.061 1.388 325 HA ALA 66 HA ALA 66 -9.826 -4.360 -0.157 326 HB1 ALA 66 1HB ALA 66 -7.503 -2.497 -0.589 327 HB2 ALA 66 2HB ALA 66 -8.908 -2.199 0.433 328 HB3 ALA 66 3HB ALA 66 -9.102 -2.336 -1.316 329 H LEU 67 H LEU 67 -6.590 -5.479 -0.830 330 HA LEU 67 HA LEU 67 -7.390 -5.902 -3.612 331 HB2 LEU 67 1HB LEU 67 -4.959 -6.453 -4.016 332 HB3 LEU 67 2HB LEU 67 -5.372 -4.787 -3.699 333 HG LEU 67 HG LEU 67 -4.481 -4.973 -1.428 334 HD11 LEU 67 1HD1 LEU 67 -3.256 -6.955 -0.715 335 HD12 LEU 67 2HD1 LEU 67 -3.731 -7.792 -2.192 336 HD13 LEU 67 3HD1 LEU 67 -4.952 -7.338 -1.005 337 HD21 LEU 67 1HD2 LEU 67 -2.641 -5.940 -3.612 338 HD22 LEU 67 2HD2 LEU 67 -2.110 -5.306 -2.055 339 HD23 LEU 67 3HD2 LEU 67 -2.986 -4.264 -3.176 340 H VAL 68 H VAL 68 -7.495 -7.645 -0.841 341 HA VAL 68 HA VAL 68 -7.043 -10.134 -2.345 342 HB VAL 68 HB VAL 68 -5.262 -9.971 -0.742 343 HG11 VAL 68 1HG1 VAL 68 -5.650 -9.861 1.670 344 HG12 VAL 68 2HG1 VAL 68 -7.378 -9.663 1.379 345 HG13 VAL 68 3HG1 VAL 68 -6.246 -8.421 0.843 346 HG21 VAL 68 1HG2 VAL 68 -5.609 -12.031 0.539 347 HG22 VAL 68 2HG2 VAL 68 -6.174 -12.192 -1.124 348 HG23 VAL 68 3HG2 VAL 68 -7.335 -11.956 0.183 349 H SER 69 H SER 69 -8.845 -8.734 0.398 350 HA SER 69 HA SER 69 -11.191 -10.207 -0.432 351 HB2 SER 69 1HB SER 69 -11.409 -10.925 2.112 352 HB3 SER 69 2HB SER 69 -10.525 -11.924 0.959 353 HG SER 69 HG SER 69 -9.325 -9.952 2.629 354 H ALA 70 H ALA 70 -12.975 -9.050 -0.096 355 HA ALA 70 HA ALA 70 -12.787 -6.338 0.428 356 HB1 ALA 70 1HB ALA 70 -15.248 -8.069 0.567 357 HB2 ALA 70 2HB ALA 70 -14.574 -7.344 -0.892 358 HB3 ALA 70 3HB ALA 70 -15.223 -6.315 0.384 359 HA PRO 71 HA PRO 71 -12.564 -6.164 4.910 360 HB2 PRO 71 1HB PRO 71 -13.335 -3.357 4.277 361 HB3 PRO 71 2HB PRO 71 -12.022 -3.960 5.295 362 HG2 PRO 71 1HG PRO 71 -11.494 -2.983 2.889 363 HG3 PRO 71 2HG PRO 71 -10.653 -4.432 3.473 364 HD2 PRO 71 1HD PRO 71 -12.915 -4.212 1.524 365 HD3 PRO 71 2HD PRO 71 -11.491 -5.276 1.490 366 H SER 72 H SER 72 -14.053 -6.147 6.543 367 HA SER 72 HA SER 72 -16.846 -6.092 5.692 368 HB2 SER 72 1HB SER 72 -15.966 -8.099 6.875 369 HB3 SER 72 2HB SER 72 -15.643 -7.094 8.286 370 HG SER 72 HG SER 72 -18.007 -6.556 8.068 371 H ALA 73 H ALA 73 -14.734 -3.931 6.842 372 HA ALA 73 HA ALA 73 -16.418 -2.668 8.829 373 HB1 ALA 73 1HB ALA 73 -13.979 -2.594 9.058 374 HB2 ALA 73 2HB ALA 73 -14.668 -0.974 8.935 375 HB3 ALA 73 3HB ALA 73 -13.866 -1.701 7.542 376 H GLU 74 H GLU 74 -17.829 -1.068 8.466 377 HA GLU 74 HA GLU 74 -18.554 -0.440 5.757 378 HB2 GLU 74 1HB GLU 74 -20.052 -0.779 7.883 379 HB3 GLU 74 2HB GLU 74 -19.701 0.916 8.178 380 HG2 GLU 74 1HG GLU 74 -21.813 0.697 7.057 381 HG3 GLU 74 2HG GLU 74 -20.652 1.480 5.989 382 HA PRO 75 HA PRO 75 -19.463 1.211 4.427 383 HB2 PRO 75 1HB PRO 75 -17.632 2.279 2.407 384 HB3 PRO 75 2HB PRO 75 -19.317 2.697 2.723 385 HG2 PRO 75 1HG PRO 75 -17.265 4.369 3.282 386 HG3 PRO 75 2HG PRO 75 -18.763 4.340 4.230 387 HD2 PRO 75 1HD PRO 75 -16.091 3.165 4.861 388 HD3 PRO 75 2HD PRO 75 -17.262 3.955 5.936 389 H HIS 76 H HIS 76 -19.536 -0.725 3.647 390 HA HIS 76 HA HIS 76 -17.248 -2.438 3.535 391 HB2 HIS 76 1HB HIS 76 -19.710 -2.991 4.125 392 HB3 HIS 76 2HB HIS 76 -19.970 -3.042 2.388 393 HD1 HIS 76 HD1 HIS 76 -19.386 -5.216 5.072 394 HD2 HIS 76 HD2 HIS 76 -17.893 -4.983 1.198 395 HE1 HIS 76 HE1 HIS 76 -18.507 -7.514 4.545 396 HE2 HIS 76 HE2 HIS 76 -17.806 -7.395 2.130 397 H ALA 77 H ALA 77 -16.017 -2.938 1.816 398 HA ALA 77 HA ALA 77 -16.035 -1.456 -0.535 399 HB1 ALA 77 1HB ALA 77 -14.824 -4.183 -0.100 400 HB2 ALA 77 2HB ALA 77 -14.070 -2.644 0.313 401 HB3 ALA 77 3HB ALA 77 -14.393 -3.041 -1.373 402 H ARG 78 H ARG 78 -17.163 -1.540 -2.338 403 HA ARG 78 HA ARG 78 -18.702 -3.980 -2.942 404 HB2 ARG 78 1HB ARG 78 -19.321 -1.175 -3.882 405 HB3 ARG 78 2HB ARG 78 -20.334 -2.602 -4.057 406 HG2 ARG 78 1HG ARG 78 -19.665 -1.136 -1.518 407 HG3 ARG 78 2HG ARG 78 -21.233 -1.248 -2.313 408 HD2 ARG 78 1HD ARG 78 -19.714 -3.561 -1.117 409 HD3 ARG 78 2HD ARG 78 -21.053 -2.717 -0.345 410 HE ARG 78 HE ARG 78 -22.308 -3.474 -2.475 411 HH11 ARG 78 1HH1 ARG 78 -19.817 -5.295 -0.835 412 HH12 ARG 78 2HH1 ARG 78 -20.497 -6.839 -1.230 413 HH21 ARG 78 1HH2 ARG 78 -23.209 -5.504 -3.015 414 HH22 ARG 78 2HH2 ARG 78 -22.424 -6.959 -2.477 415 H ASN 79 H ASN 79 -19.145 -4.223 -5.320 416 HA ASN 79 HA ASN 79 -18.340 -4.852 -7.321 417 HB2 ASN 79 1HB ASN 79 -17.530 -3.152 -8.806 418 HB3 ASN 79 2HB ASN 79 -18.771 -2.452 -7.784 419 HD21 ASN 79 1HD2 ASN 79 -16.711 -0.001 -6.439 420 HD22 ASN 79 2HD2 ASN 79 -18.251 -0.780 -6.440 421 H TYR 80 H TYR 80 -16.756 -5.580 -5.099 422 HA TYR 80 HA TYR 80 -13.991 -5.356 -5.855 423 HB2 TYR 80 1HB TYR 80 -13.611 -6.894 -3.928 424 HB3 TYR 80 2HB TYR 80 -14.522 -5.451 -3.497 425 HD1 TYR 80 HD1 TYR 80 -14.640 -9.087 -3.860 426 HD2 TYR 80 HD2 TYR 80 -16.888 -5.606 -2.907 427 HE1 TYR 80 HE1 TYR 80 -16.404 -10.496 -2.889 428 HE2 TYR 80 HE2 TYR 80 -18.657 -7.008 -1.935 429 HH TYR 80 HH TYR 80 -18.225 -10.306 -1.253 430 HA PRO 81 HA PRO 81 -13.957 -8.994 -8.431 431 HB2 PRO 81 1HB PRO 81 -11.279 -9.301 -8.617 432 HB3 PRO 81 2HB PRO 81 -12.140 -8.017 -9.469 433 HG2 PRO 81 1HG PRO 81 -10.572 -7.887 -6.928 434 HG3 PRO 81 2HG PRO 81 -10.615 -6.738 -8.278 435 HD2 PRO 81 1HD PRO 81 -12.002 -6.388 -5.950 436 HD3 PRO 81 2HD PRO 81 -12.521 -5.723 -7.511 437 H GLU 82 H GLU 82 -13.953 -11.157 -8.050 438 HA GLU 82 HA GLU 82 -13.633 -12.140 -5.427 439 HB2 GLU 82 1HB GLU 82 -13.628 -13.803 -7.948 440 HB3 GLU 82 2HB GLU 82 -14.061 -14.329 -6.329 441 HG2 GLU 82 1HG GLU 82 -16.119 -14.083 -7.300 442 HG3 GLU 82 2HG GLU 82 -15.911 -12.510 -6.531 443 H GLY 83 H GLY 83 -11.892 -12.793 -4.366 444 HA2 GLY 83 1HA GLY 83 -9.778 -13.707 -4.015 445 HA3 GLY 83 2HA GLY 83 -9.555 -13.817 -5.757 446 H GLY 84 H GLY 84 -10.721 -10.809 -5.090 447 HA2 GLY 84 1HA GLY 84 -9.800 -8.719 -4.888 448 HA3 GLY 84 2HA GLY 84 -8.384 -9.474 -4.172 449 H TYR 85 H TYR 85 -7.237 -7.819 -5.392 450 HA TYR 85 HA TYR 85 -7.049 -8.239 -8.265 451 HB2 TYR 85 1HB TYR 85 -5.521 -6.351 -6.452 452 HB3 TYR 85 2HB TYR 85 -5.453 -6.363 -8.211 453 HD1 TYR 85 HD1 TYR 85 -7.723 -6.017 -9.444 454 HD2 TYR 85 HD2 TYR 85 -7.052 -4.965 -5.377 455 HE1 TYR 85 HE1 TYR 85 -9.640 -4.481 -9.530 456 HE2 TYR 85 HE2 TYR 85 -8.969 -3.426 -5.453 457 HH TYR 85 HH TYR 85 -10.264 -2.172 -7.122 458 H ILE 86 H ILE 86 -5.519 -9.118 -5.331 459 HA ILE 86 HA ILE 86 -3.767 -10.905 -6.833 460 HB ILE 86 HB ILE 86 -2.271 -9.114 -6.208 461 HG12 ILE 86 1HG1 ILE 86 -1.943 -11.500 -4.374 462 HG13 ILE 86 2HG1 ILE 86 -1.387 -11.382 -6.039 463 HG21 ILE 86 1HG2 ILE 86 -3.549 -8.086 -4.436 464 HG22 ILE 86 2HG2 ILE 86 -1.919 -8.448 -3.872 465 HG23 ILE 86 3HG2 ILE 86 -3.268 -9.478 -3.390 466 HD11 ILE 86 1HD1 ILE 86 0.442 -11.084 -4.477 467 HD12 ILE 86 2HD1 ILE 86 -0.397 -9.721 -3.736 468 HD13 ILE 86 3HD1 ILE 86 0.161 -9.611 -5.405 469 H ARG 87 H ARG 87 -3.629 -12.902 -5.954 470 HA ARG 87 HA ARG 87 -5.892 -13.703 -4.520 471 HB2 ARG 87 1HB ARG 87 -4.813 -15.134 -6.148 472 HB3 ARG 87 2HB ARG 87 -3.363 -15.215 -5.163 473 HG2 ARG 87 1HG ARG 87 -4.595 -16.395 -3.426 474 HG3 ARG 87 2HG ARG 87 -6.062 -16.293 -4.401 475 HD2 ARG 87 1HD ARG 87 -4.987 -18.485 -4.595 476 HD3 ARG 87 2HD ARG 87 -5.030 -17.635 -6.139 477 HE ARG 87 HE ARG 87 -2.587 -17.009 -5.078 478 HH11 ARG 87 1HH1 ARG 87 -4.272 -19.984 -5.815 479 HH12 ARG 87 2HH1 ARG 87 -2.828 -20.864 -6.197 480 HH21 ARG 87 1HH2 ARG 87 -0.667 -18.162 -5.586 481 HH22 ARG 87 2HH2 ARG 87 -0.776 -19.827 -6.060 482 H ARG 88 H ARG 88 -2.682 -12.940 -3.412 483 HA ARG 88 HA ARG 88 -3.537 -13.562 -0.675 484 HB2 ARG 88 1HB ARG 88 -0.853 -14.248 -1.894 485 HB3 ARG 88 2HB ARG 88 -1.226 -14.359 -0.180 486 HG2 ARG 88 1HG ARG 88 -2.880 -16.068 -0.615 487 HG3 ARG 88 2HG ARG 88 -2.619 -15.910 -2.353 488 HD2 ARG 88 1HD ARG 88 -0.291 -16.626 -2.050 489 HD3 ARG 88 2HD ARG 88 -0.579 -16.810 -0.321 490 HE ARG 88 HE ARG 88 -2.399 -18.456 -1.162 491 HH11 ARG 88 1HH1 ARG 88 0.762 -17.967 -2.579 492 HH12 ARG 88 2HH1 ARG 88 0.882 -19.585 -3.190 493 HH21 ARG 88 1HH2 ARG 88 -2.244 -20.592 -1.963 494 HH22 ARG 88 2HH2 ARG 88 -0.830 -21.082 -2.840 495 H LEU 89 H LEU 89 -2.354 -12.369 0.955 496 HA LEU 89 HA LEU 89 -1.968 -9.663 0.411 497 HB2 LEU 89 1HB LEU 89 -0.972 -11.398 2.665 498 HB3 LEU 89 2HB LEU 89 -0.750 -9.659 2.632 499 HG LEU 89 HG LEU 89 -3.477 -10.937 2.494 500 HD11 LEU 89 1HD1 LEU 89 -2.402 -11.630 4.569 501 HD12 LEU 89 2HD1 LEU 89 -3.672 -10.448 4.881 502 HD13 LEU 89 3HD1 LEU 89 -1.979 -9.955 4.920 503 HD21 LEU 89 1HD2 LEU 89 -4.181 -8.702 3.252 504 HD22 LEU 89 2HD2 LEU 89 -3.342 -8.646 1.700 505 HD23 LEU 89 3HD2 LEU 89 -2.502 -8.166 3.174 506 HA PRO 90 HA PRO 90 1.986 -9.899 -1.623 507 HB2 PRO 90 1HB PRO 90 2.389 -7.209 -1.812 508 HB3 PRO 90 2HB PRO 90 1.330 -8.110 -2.901 509 HG2 PRO 90 1HG PRO 90 0.626 -6.455 -0.512 510 HG3 PRO 90 2HG PRO 90 -0.187 -6.558 -2.084 511 HD2 PRO 90 1HD PRO 90 -1.098 -7.846 0.116 512 HD3 PRO 90 2HD PRO 90 -1.300 -8.497 -1.524 513 H GLN 91 H GLN 91 4.123 -9.635 -1.071 514 HA GLN 91 HA GLN 91 4.771 -8.285 1.442 515 HB2 GLN 91 1HB GLN 91 5.391 -11.172 0.800 516 HB3 GLN 91 2HB GLN 91 6.194 -10.272 2.076 517 HG2 GLN 91 1HG GLN 91 4.060 -9.956 3.208 518 HG3 GLN 91 2HG GLN 91 3.239 -10.842 1.921 519 HE21 GLN 91 1HE2 GLN 91 3.540 -13.612 4.009 520 HE22 GLN 91 2HE2 GLN 91 2.496 -12.420 3.318 521 H ASP 92 H ASP 92 6.783 -7.384 1.448 522 HA ASP 92 HA ASP 92 8.141 -7.016 -1.000 523 HB2 ASP 92 1HB ASP 92 9.926 -5.970 0.418 524 HB3 ASP 92 2HB ASP 92 8.317 -5.320 0.700 525 HA PRO 93 HA PRO 93 10.657 -10.484 -1.626 526 HB2 PRO 93 1HB PRO 93 13.121 -9.333 -2.135 527 HB3 PRO 93 2HB PRO 93 11.812 -9.499 -3.306 528 HG2 PRO 93 1HG PRO 93 12.560 -7.142 -1.624 529 HG3 PRO 93 2HG PRO 93 12.065 -7.191 -3.328 530 HD2 PRO 93 1HD PRO 93 10.347 -6.444 -1.442 531 HD3 PRO 93 2HD PRO 93 9.813 -7.469 -2.790 532 H TRP 94 H TRP 94 11.557 -8.312 0.917 533 HA TRP 94 HA TRP 94 13.644 -10.002 1.963 534 HB2 TRP 94 1HB TRP 94 12.161 -7.679 3.220 535 HB3 TRP 94 2HB TRP 94 13.546 -8.496 3.938 536 HD1 TRP 94 HD1 TRP 94 15.917 -8.260 2.538 537 HE1 TRP 94 HE1 TRP 94 16.799 -6.286 1.133 538 HE3 TRP 94 HE3 TRP 94 11.510 -5.793 1.773 539 HZ2 TRP 94 HZ2 TRP 94 15.749 -3.988 -0.129 540 HZ3 TRP 94 HZ3 TRP 94 11.534 -3.713 0.463 541 HH2 TRP 94 HH2 TRP 94 13.611 -2.830 -0.468 542 H GLY 95 H GLY 95 10.209 -9.684 2.263 543 HA2 GLY 95 1HA GLY 95 8.993 -11.696 2.872 544 HA3 GLY 95 2HA GLY 95 10.229 -12.011 4.080 545 H SER 96 H SER 96 9.155 -8.752 3.734 546 HA SER 96 HA SER 96 7.944 -8.949 6.389 547 HB2 SER 96 1HB SER 96 8.339 -6.338 4.991 548 HB3 SER 96 2HB SER 96 8.534 -6.736 6.698 549 HG SER 96 HG SER 96 10.294 -7.185 4.542 550 H ASP 97 H ASP 97 5.898 -8.035 6.846 551 HA ASP 97 HA ASP 97 4.001 -8.212 4.642 552 HB2 ASP 97 1HB ASP 97 3.570 -7.753 7.607 553 HB3 ASP 97 2HB ASP 97 2.289 -7.979 6.423 554 H TYR 98 H TYR 98 3.347 -6.476 3.549 555 HA TYR 98 HA TYR 98 4.261 -3.894 3.969 556 HB2 TYR 98 1HB TYR 98 1.903 -4.956 2.436 557 HB3 TYR 98 2HB TYR 98 2.251 -3.231 2.499 558 HD1 TYR 98 HD1 TYR 98 4.477 -2.417 1.631 559 HD2 TYR 98 HD2 TYR 98 3.082 -6.380 0.981 560 HE1 TYR 98 HE1 TYR 98 6.083 -2.675 -0.212 561 HE2 TYR 98 HE2 TYR 98 4.687 -6.650 -0.858 562 HH TYR 98 HH TYR 98 5.980 -5.355 -2.375 563 H GLN 99 H GLN 99 3.478 -2.087 4.931 564 HA GLN 99 HA GLN 99 1.248 -2.532 6.799 565 HB2 GLN 99 1HB GLN 99 3.648 -0.716 7.084 566 HB3 GLN 99 2HB GLN 99 2.324 -0.828 8.236 567 HG2 GLN 99 1HG GLN 99 4.171 -3.081 7.486 568 HG3 GLN 99 2HG GLN 99 4.295 -2.098 8.944 569 HE21 GLN 99 1HE2 GLN 99 2.412 -5.349 9.451 570 HE22 GLN 99 2HE2 GLN 99 3.863 -4.989 8.576 571 H LEU 100 H LEU 100 -0.403 -1.152 6.829 572 HA LEU 100 HA LEU 100 -0.209 1.302 5.208 573 HB2 LEU 100 1HB LEU 100 -1.764 -0.438 4.295 574 HB3 LEU 100 2HB LEU 100 -2.675 -0.361 5.787 575 HG LEU 100 HG LEU 100 -3.536 0.899 3.682 576 HD11 LEU 100 1HD1 LEU 100 -4.532 2.655 5.070 577 HD12 LEU 100 2HD1 LEU 100 -3.405 2.255 6.366 578 HD13 LEU 100 3HD1 LEU 100 -4.604 1.072 5.845 579 HD21 LEU 100 1HD2 LEU 100 -1.713 3.029 4.748 580 HD22 LEU 100 2HD2 LEU 100 -2.731 3.076 3.307 581 HD23 LEU 100 3HD2 LEU 100 -1.314 2.033 3.352 582 H LEU 101 H LEU 101 -0.336 3.112 6.406 583 HA LEU 101 HA LEU 101 -1.514 2.844 9.091 584 HB2 LEU 101 1HB LEU 101 1.055 3.008 8.862 585 HB3 LEU 101 2HB LEU 101 0.774 4.687 8.459 586 HG LEU 101 HG LEU 101 1.411 4.225 10.851 587 HD11 LEU 101 1HD1 LEU 101 -0.180 5.796 11.807 588 HD12 LEU 101 2HD1 LEU 101 -1.247 5.576 10.420 589 HD13 LEU 101 3HD1 LEU 101 0.340 6.317 10.204 590 HD21 LEU 101 1HD2 LEU 101 -0.260 3.363 12.361 591 HD22 LEU 101 2HD2 LEU 101 0.073 2.172 11.104 592 HD23 LEU 101 3HD2 LEU 101 -1.395 3.145 11.031 593 H SER 102 H SER 102 -3.344 3.925 9.106 594 HA SER 102 HA SER 102 -3.417 6.642 7.999 595 HB2 SER 102 1HB SER 102 -5.932 6.352 8.538 596 HB3 SER 102 2HB SER 102 -5.276 5.437 7.182 597 HG SER 102 HG SER 102 -6.021 4.542 9.748 598 HA PRO 103 HA PRO 103 -3.997 8.686 8.337 599 HB2 PRO 103 1HB PRO 103 -2.382 10.586 9.869 600 HB3 PRO 103 2HB PRO 103 -3.981 10.808 9.157 601 HG2 PRO 103 1HG PRO 103 -3.600 10.677 11.823 602 HG3 PRO 103 2HG PRO 103 -5.068 10.055 11.045 603 HD2 PRO 103 1HD PRO 103 -2.649 8.557 11.997 604 HD3 PRO 103 2HD PRO 103 -4.370 8.151 12.186 605 H GLY 104 H GLY 104 -2.530 8.849 6.744 606 HA2 GLY 104 1HA GLY 104 -0.196 7.318 6.868 607 HA3 GLY 104 2HA GLY 104 -0.621 8.421 5.569 608 H GLN 105 H GLN 105 1.925 7.756 6.961 609 HA GLN 105 HA GLN 105 2.835 9.869 8.533 610 HB2 GLN 105 1HB GLN 105 4.061 7.775 8.295 611 HB3 GLN 105 2HB GLN 105 4.346 8.107 6.594 612 HG2 GLN 105 1HG GLN 105 6.341 8.548 7.865 613 HG3 GLN 105 2HG GLN 105 5.704 10.058 7.217 614 HE21 GLN 105 1HE2 GLN 105 5.073 11.501 10.327 615 HE22 GLN 105 2HE2 GLN 105 4.805 11.566 8.618 616 H HIS 106 H HIS 106 2.594 9.534 5.032 617 HA HIS 106 HA HIS 106 3.592 12.300 4.781 618 HB2 HIS 106 1HB HIS 106 3.764 10.123 2.686 619 HB3 HIS 106 2HB HIS 106 4.460 11.736 2.589 620 HD1 HIS 106 HD1 HIS 106 6.569 12.202 4.096 621 HD2 HIS 106 HD2 HIS 106 5.271 8.252 4.063 622 HE1 HIS 106 HE1 HIS 106 8.459 10.861 5.071 623 HE2 HIS 106 HE2 HIS 106 7.674 8.468 4.999 624 H GLY 107 H GLY 107 0.771 11.186 5.116 625 HA2 GLY 107 1HA GLY 107 -0.619 13.011 3.589 626 HA3 GLY 107 2HA GLY 107 -0.536 11.563 2.599 627 H GLN 108 H GLN 108 -2.751 11.184 2.656 628 HA GLN 108 HA GLN 108 -4.242 11.042 5.081 629 HB2 GLN 108 1HB GLN 108 -4.722 10.406 2.223 630 HB3 GLN 108 2HB GLN 108 -5.740 9.578 3.393 631 HG2 GLN 108 1HG GLN 108 -5.400 12.532 3.574 632 HG3 GLN 108 2HG GLN 108 -6.480 11.849 2.361 633 HE21 GLN 108 1HE2 GLN 108 -7.558 10.637 6.082 634 HE22 GLN 108 2HE2 GLN 108 -6.007 10.268 5.423 635 H VAL 109 H VAL 109 -2.787 8.636 2.961 636 HA VAL 109 HA VAL 109 -2.710 6.756 5.206 637 HB VAL 109 HB VAL 109 -3.159 4.901 3.492 638 HG11 VAL 109 1HG1 VAL 109 -5.585 5.051 3.781 639 HG12 VAL 109 2HG1 VAL 109 -5.409 6.727 4.305 640 HG13 VAL 109 3HG1 VAL 109 -4.712 5.422 5.267 641 HG21 VAL 109 1HG2 VAL 109 -4.328 7.240 1.993 642 HG22 VAL 109 2HG2 VAL 109 -4.624 5.544 1.611 643 HG23 VAL 109 3HG2 VAL 109 -2.996 6.210 1.466 644 H ASP 110 H ASP 110 -0.925 5.336 5.141 645 HA ASP 110 HA ASP 110 1.042 5.982 3.044 646 HB2 ASP 110 1HB ASP 110 1.298 6.911 5.552 647 HB3 ASP 110 2HB ASP 110 2.063 5.339 5.753 648 H ILE 111 H ILE 111 1.649 4.267 1.970 649 HA ILE 111 HA ILE 111 1.503 1.624 3.249 650 HB ILE 111 HB ILE 111 1.767 0.806 0.826 651 HG12 ILE 111 1HG1 ILE 111 0.907 3.658 0.287 652 HG13 ILE 111 2HG1 ILE 111 2.460 2.952 -0.143 653 HG21 ILE 111 1HG2 ILE 111 -0.608 0.919 0.408 654 HG22 ILE 111 2HG2 ILE 111 -0.771 2.256 1.543 655 HG23 ILE 111 3HG2 ILE 111 -0.314 0.654 2.127 656 HD11 ILE 111 1HD1 ILE 111 0.986 3.097 -2.062 657 HD12 ILE 111 2HD1 ILE 111 -0.213 2.109 -1.228 658 HD13 ILE 111 3HD1 ILE 111 1.349 1.418 -1.667 659 H PHE 112 H PHE 112 3.351 0.640 3.753 660 HA PHE 112 HA PHE 112 5.737 1.113 2.182 661 HB2 PHE 112 1HB PHE 112 7.097 1.702 4.194 662 HB3 PHE 112 2HB PHE 112 5.934 2.936 3.731 663 HD1 PHE 112 HD1 PHE 112 6.875 0.484 6.261 664 HD2 PHE 112 HD2 PHE 112 3.993 3.401 5.118 665 HE1 PHE 112 HE1 PHE 112 5.987 0.502 8.554 666 HE2 PHE 112 HE2 PHE 112 3.100 3.422 7.410 667 HZ PHE 112 HZ PHE 112 4.096 1.971 9.131 668 H SER 113 H SER 113 7.420 -0.358 2.579 669 HA SER 113 HA SER 113 6.624 -2.811 3.973 670 HB2 SER 113 1HB SER 113 8.591 -3.795 2.765 671 HB3 SER 113 2HB SER 113 7.374 -3.132 1.675 672 HG SER 113 HG SER 113 8.665 -1.335 1.356 673 H LEU 114 H LEU 114 8.211 -3.814 5.407 674 HA LEU 114 HA LEU 114 9.251 -1.888 7.230 675 HB2 LEU 114 1HB LEU 114 9.467 -4.890 7.129 676 HB3 LEU 114 2HB LEU 114 10.210 -3.931 8.389 677 HG LEU 114 HG LEU 114 8.184 -4.784 9.275 678 HD11 LEU 114 1HD1 LEU 114 6.939 -2.798 9.823 679 HD12 LEU 114 2HD1 LEU 114 7.640 -1.942 8.449 680 HD13 LEU 114 3HD1 LEU 114 8.664 -2.435 9.800 681 HD21 LEU 114 1HD2 LEU 114 7.093 -5.383 7.177 682 HD22 LEU 114 2HD2 LEU 114 6.764 -3.681 6.860 683 HD23 LEU 114 3HD2 LEU 114 6.009 -4.483 8.237 684 H GLY 115 H GLY 115 10.515 -3.486 4.511 685 HA2 GLY 115 1HA GLY 115 12.500 -3.085 3.414 686 HA3 GLY 115 2HA GLY 115 12.977 -2.031 4.736 687 HA PRO 116 HA PRO 116 15.513 -5.957 4.819 688 HB2 PRO 116 1HB PRO 116 17.773 -4.108 5.029 689 HB3 PRO 116 2HB PRO 116 17.497 -5.407 3.866 690 HG2 PRO 116 1HG PRO 116 17.386 -2.791 3.183 691 HG3 PRO 116 2HG PRO 116 16.399 -4.032 2.390 692 HD2 PRO 116 1HD PRO 116 15.629 -2.048 4.493 693 HD3 PRO 116 2HD PRO 116 14.707 -2.608 3.081 694 H ASP 117 H ASP 117 15.268 -3.077 6.719 695 HA ASP 117 HA ASP 117 16.904 -4.199 8.868 696 HB2 ASP 117 1HB ASP 117 17.557 -2.058 8.979 697 HB3 ASP 117 2HB ASP 117 16.250 -1.544 7.920 698 H GLY 118 H GLY 118 13.631 -3.825 7.993 699 HA2 GLY 118 1HA GLY 118 11.834 -4.898 8.931 700 HA3 GLY 118 2HA GLY 118 12.879 -5.441 10.222 701 H VAL 119 H VAL 119 13.293 -2.169 10.414 702 HA VAL 119 HA VAL 119 11.067 -2.009 12.314 703 HB VAL 119 HB VAL 119 13.484 -1.414 12.982 704 HG11 VAL 119 1HG1 VAL 119 14.047 0.081 11.164 705 HG12 VAL 119 2HG1 VAL 119 14.114 0.935 12.705 706 HG13 VAL 119 3HG1 VAL 119 12.739 1.168 11.627 707 HG21 VAL 119 1HG2 VAL 119 11.226 0.475 13.613 708 HG22 VAL 119 2HG2 VAL 119 12.705 0.288 14.556 709 HG23 VAL 119 3HG2 VAL 119 11.570 -1.056 14.419 710 HA PRO 120 HA PRO 120 8.740 0.415 9.471 711 HB2 PRO 120 1HB PRO 120 6.719 1.101 11.138 712 HB3 PRO 120 2HB PRO 120 6.892 -0.516 10.449 713 HG2 PRO 120 1HG PRO 120 7.622 0.472 13.170 714 HG3 PRO 120 2HG PRO 120 6.873 -1.063 12.698 715 HD2 PRO 120 1HD PRO 120 9.520 -0.804 13.295 716 HD3 PRO 120 2HD PRO 120 8.887 -2.025 12.176 717 H GLU 121 H GLU 121 8.042 2.521 9.075 718 HA GLU 121 HA GLU 121 7.988 4.788 9.139 719 HB2 GLU 121 1HB GLU 121 8.653 4.465 12.068 720 HB3 GLU 121 2HB GLU 121 8.187 5.973 11.297 721 HG2 GLU 121 1HG GLU 121 6.000 5.102 10.806 722 HG3 GLU 121 2HG GLU 121 6.459 3.513 11.421 723 H SER 122 H SER 122 10.525 3.060 8.978 724 HA SER 122 HA SER 122 12.529 5.088 9.604 725 HB2 SER 122 1HB SER 122 13.991 3.006 8.809 726 HB3 SER 122 2HB SER 122 13.313 3.097 10.436 727 HG SER 122 HG SER 122 12.859 1.259 8.563 728 H ASN 123 H ASN 123 14.426 5.050 7.912 729 HA ASN 123 HA ASN 123 13.299 6.003 5.447 730 HB2 ASN 123 1HB ASN 123 15.592 6.595 4.840 731 HB3 ASN 123 2HB ASN 123 15.235 7.128 6.478 732 HD21 ASN 123 1HD2 ASN 123 18.569 5.349 6.122 733 HD22 ASN 123 2HD2 ASN 123 17.785 6.522 5.120 734 H ASP 124 H ASP 124 14.697 3.051 6.546 735 HA ASP 124 HA ASP 124 15.255 1.983 3.924 736 HB2 ASP 124 1HB ASP 124 15.814 -0.047 5.038 737 HB3 ASP 124 2HB ASP 124 16.362 1.239 6.113 738 H ASP 125 H ASP 125 12.507 2.549 5.753 739 HA ASP 125 HA ASP 125 10.909 0.319 4.974 740 HB2 ASP 125 1HB ASP 125 10.329 3.019 6.162 741 HB3 ASP 125 2HB ASP 125 9.015 1.998 5.593 742 H ILE 126 H ILE 126 11.113 0.088 2.772 743 HA ILE 126 HA ILE 126 10.857 2.206 0.922 744 HB ILE 126 HB ILE 126 10.442 -0.745 0.428 745 HG12 ILE 126 1HG1 ILE 126 12.647 -0.306 1.407 746 HG13 ILE 126 2HG1 ILE 126 12.799 -0.765 -0.285 747 HG21 ILE 126 1HG2 ILE 126 11.015 -0.200 -1.898 748 HG22 ILE 126 2HG2 ILE 126 11.078 1.510 -1.470 749 HG23 ILE 126 3HG2 ILE 126 9.554 0.629 -1.363 750 HD11 ILE 126 1HD1 ILE 126 12.968 2.029 0.821 751 HD12 ILE 126 2HD1 ILE 126 13.087 1.591 -0.883 752 HD13 ILE 126 3HD1 ILE 126 14.313 1.039 0.257 753 H GLY 127 H GLY 127 9.068 3.366 0.828 754 HA2 GLY 127 1HA GLY 127 6.521 1.945 0.498 755 HA3 GLY 127 2HA GLY 127 6.651 3.270 1.645 756 H ASN 128 H ASN 128 4.951 4.249 0.438 757 HA ASN 128 HA ASN 128 5.053 4.740 -2.327 758 HB2 ASN 128 1HB ASN 128 3.042 4.843 -0.752 759 HB3 ASN 128 2HB ASN 128 3.589 6.460 -0.332 760 HD21 ASN 128 1HD2 ASN 128 1.690 5.720 -3.841 761 HD22 ASN 128 2HD2 ASN 128 2.176 4.454 -2.761 762 H TRP 129 H TRP 129 6.228 6.632 0.413 763 HA TRP 129 HA TRP 129 6.593 8.983 -1.199 764 HB2 TRP 129 1HB TRP 129 6.020 8.962 1.276 765 HB3 TRP 129 2HB TRP 129 7.710 8.556 1.562 766 HD1 TRP 129 HD1 TRP 129 5.567 11.382 0.046 767 HE1 TRP 129 HE1 TRP 129 6.877 13.588 0.236 768 HE3 TRP 129 HE3 TRP 129 9.967 9.554 1.903 769 HZ2 TRP 129 HZ2 TRP 129 9.435 14.440 1.065 770 HZ3 TRP 129 HZ3 TRP 129 11.795 11.134 2.369 771 HH2 TRP 129 HH2 TRP 129 11.533 13.525 1.957 772 H THR 130 H THR 130 8.663 6.339 -0.140 773 HA THR 130 HA THR 130 11.099 7.726 -0.612 774 HB THR 130 HB THR 130 10.854 5.613 0.791 775 HG1 THR 130 HG1 THR 130 12.926 6.085 0.541 776 HG21 THR 130 1HG2 THR 130 11.249 3.487 -0.433 777 HG22 THR 130 2HG2 THR 130 10.949 4.343 -1.943 778 HG23 THR 130 3HG2 THR 130 9.664 4.190 -0.747 779 H ILE 131 H ILE 131 8.978 5.794 -2.635 780 HA ILE 131 HA ILE 131 10.798 6.006 -4.888 781 HB ILE 131 HB ILE 131 9.487 3.936 -4.585 782 HG12 ILE 131 1HG1 ILE 131 8.595 3.788 -6.922 783 HG13 ILE 131 2HG1 ILE 131 8.859 5.522 -7.080 784 HG21 ILE 131 1HG2 ILE 131 7.089 3.897 -5.041 785 HG22 ILE 131 2HG2 ILE 131 7.084 5.656 -5.162 786 HG23 ILE 131 3HG2 ILE 131 7.465 4.879 -3.624 787 HD11 ILE 131 1HD1 ILE 131 10.995 3.472 -6.532 788 HD12 ILE 131 2HD1 ILE 131 11.243 5.204 -6.755 789 HD13 ILE 131 3HD1 ILE 131 10.656 4.219 -8.094 790 H GLY 132 H GLY 132 7.764 7.385 -3.735 791 HA2 GLY 132 1HA GLY 132 6.815 9.415 -4.180 792 HA3 GLY 132 2HA GLY 132 8.337 9.871 -4.923 793 H PHE 133 H PHE 133 5.240 8.288 -5.499 794 HA PHE 133 HA PHE 133 5.510 8.313 -8.352 795 HB2 PHE 133 1HB PHE 133 3.018 8.134 -6.639 796 HB3 PHE 133 2HB PHE 133 3.096 7.813 -8.368 797 HD1 PHE 133 HD1 PHE 133 3.277 6.401 -5.139 798 HD2 PHE 133 HD2 PHE 133 4.738 5.943 -9.107 799 HE1 PHE 133 HE1 PHE 133 3.807 4.046 -4.668 800 HE2 PHE 133 HE2 PHE 133 5.270 3.588 -8.644 801 HZ PHE 133 HZ PHE 133 4.805 2.636 -6.422 802 H HIS 134 H HIS 134 4.591 10.520 -5.895 803 HA HIS 134 HA HIS 134 4.276 12.604 -7.942 804 HB2 HIS 134 1HB HIS 134 2.674 12.293 -5.396 805 HB3 HIS 134 2HB HIS 134 2.714 13.776 -6.341 806 HD1 HIS 134 HD1 HIS 134 1.004 10.564 -6.075 807 HD2 HIS 134 HD2 HIS 134 1.600 13.445 -9.010 808 HE1 HIS 134 HE1 HIS 134 -0.726 10.099 -7.839 809 HE2 HIS 134 HE2 HIS 134 -0.447 11.952 -9.526 810 H HIS 135 H HIS 135 6.397 13.246 -7.744 811 HA HIS 135 HA HIS 135 7.667 13.622 -5.214 812 HB2 HIS 135 1HB HIS 135 8.438 14.473 -8.007 813 HB3 HIS 135 2HB HIS 135 9.445 14.768 -6.596 814 HD1 HIS 135 HD1 HIS 135 9.039 12.431 -9.248 815 HD2 HIS 135 HD2 HIS 135 10.033 12.142 -5.224 816 HE1 HIS 135 HE1 HIS 135 10.194 10.215 -8.995 817 HE2 HIS 135 HE2 HIS 135 10.647 9.993 -6.527 818 H HIS 136 H HIS 136 6.582 15.059 -3.955 819 HA HIS 136 HA HIS 136 5.717 17.622 -4.911 820 HB2 HIS 136 1HB HIS 136 6.076 16.664 -2.059 821 HB3 HIS 136 2HB HIS 136 5.173 18.085 -2.571 822 HD1 HIS 136 HD1 HIS 136 4.612 14.770 -1.512 823 HD2 HIS 136 HD2 HIS 136 2.979 17.161 -4.495 824 HE1 HIS 136 HE1 HIS 136 2.390 13.730 -2.071 825 HE2 HIS 136 HE2 HIS 136 1.467 15.129 -3.954 826 H HIS 137 H HIS 137 7.265 18.998 -5.574 827 HA HIS 137 HA HIS 137 9.908 18.846 -4.435 828 HB2 HIS 137 1HB HIS 137 8.777 20.588 -6.629 829 HB3 HIS 137 2HB HIS 137 10.467 20.589 -6.138 830 HD1 HIS 137 HD1 HIS 137 9.175 19.672 -8.974 831 HD2 HIS 137 HD2 HIS 137 10.719 17.248 -5.972 832 HE1 HIS 137 HE1 HIS 137 9.815 17.522 -10.106 833 HE2 HIS 137 HE2 HIS 137 10.836 16.103 -8.288 834 H HIS 138 H HIS 138 10.864 20.190 -3.087 835 HA HIS 138 HA HIS 138 9.617 22.768 -2.472 836 HB2 HIS 138 1HB HIS 138 8.895 21.107 -0.754 837 HB3 HIS 138 2HB HIS 138 10.586 20.812 -0.369 838 HD1 HIS 138 HD1 HIS 138 7.819 23.241 0.153 839 HD2 HIS 138 HD2 HIS 138 11.851 22.878 1.097 840 HE1 HIS 138 HE1 HIS 138 8.272 25.013 1.876 841 HE2 HIS 138 HE2 HIS 138 10.675 24.675 2.540 842 H HIS 139 H HIS 139 11.262 23.806 -3.597 843 HA HIS 139 HA HIS 139 14.008 23.364 -2.671 844 HB2 HIS 139 1HB HIS 139 12.891 24.763 -5.097 845 HB3 HIS 139 2HB HIS 139 14.576 24.918 -4.617 846 HD1 HIS 139 HD1 HIS 139 16.060 22.765 -4.805 847 HD2 HIS 139 HD2 HIS 139 12.228 22.403 -6.378 848 HE1 HIS 139 HE1 HIS 139 16.108 20.699 -6.234 849 HE2 HIS 139 HE2 HIS 139 13.828 20.592 -7.298 850 H LYS 140 H LYS 140 15.164 24.899 -1.635 851 HA LYS 140 HA LYS 140 13.928 27.528 -1.258 852 HB2 LYS 140 1HB LYS 140 13.459 26.114 0.731 853 HB3 LYS 140 2HB LYS 140 15.189 25.885 0.950 854 HG2 LYS 140 1HG LYS 140 14.334 27.573 2.469 855 HG3 LYS 140 2HG LYS 140 15.466 28.283 1.317 856 HD2 LYS 140 1HD LYS 140 13.579 29.082 -0.033 857 HD3 LYS 140 2HD LYS 140 12.455 28.387 1.137 858 HE2 LYS 140 1HE LYS 140 14.486 30.537 1.718 859 HE3 LYS 140 2HE LYS 140 12.764 30.802 1.457 860 HZ1 LYS 140 1HZ LYS 140 12.307 29.430 3.401 861 HZ2 LYS 140 2HZ LYS 140 13.287 30.751 3.801 862 HZ3 LYS 140 3HZ LYS 140 13.965 29.210 3.655 Start of MODEL 13 1 H1 MET 25 1H MET 25 30.122 -9.961 -9.773 2 H2 MET 25 2H MET 25 29.824 -11.283 -8.763 3 H3 MET 25 3H MET 25 29.620 -9.710 -8.178 4 HA MET 25 HA MET 25 27.795 -9.326 -9.654 5 HB2 MET 25 1HB MET 25 28.633 -10.822 -11.465 6 HB3 MET 25 2HB MET 25 28.177 -12.209 -10.489 7 HG2 MET 25 1HG MET 25 25.836 -11.456 -10.556 8 HG3 MET 25 2HG MET 25 26.317 -10.117 -11.595 9 HE1 MET 25 1HE MET 25 24.005 -12.045 -12.439 10 HE2 MET 25 2HE MET 25 24.417 -12.384 -14.120 11 HE3 MET 25 3HE MET 25 24.609 -10.753 -13.479 12 H GLY 26 H GLY 26 26.697 -9.055 -7.781 13 HA2 GLY 26 1HA GLY 26 25.098 -11.235 -6.846 14 HA3 GLY 26 2HA GLY 26 26.364 -10.808 -5.702 15 H ASN 27 H ASN 27 23.803 -10.604 -4.926 16 HA ASN 27 HA ASN 27 22.325 -9.235 -3.905 17 HB2 ASN 27 1HB ASN 27 24.236 -8.037 -2.986 18 HB3 ASN 27 2HB ASN 27 24.375 -7.080 -4.458 19 HD21 ASN 27 1HD2 ASN 27 21.563 -6.210 -1.654 20 HD22 ASN 27 2HD2 ASN 27 22.449 -7.693 -1.614 21 H LYS 28 H LYS 28 20.607 -9.329 -5.176 22 HA LYS 28 HA LYS 28 20.523 -7.727 -7.622 23 HB2 LYS 28 1HB LYS 28 19.964 -10.246 -7.489 24 HB3 LYS 28 2HB LYS 28 18.467 -9.740 -6.729 25 HG2 LYS 28 1HG LYS 28 18.025 -10.101 -9.029 26 HG3 LYS 28 2HG LYS 28 17.999 -8.358 -8.753 27 HD2 LYS 28 1HD LYS 28 20.240 -8.152 -9.653 28 HD3 LYS 28 2HD LYS 28 20.349 -9.902 -9.846 29 HE2 LYS 28 1HE LYS 28 18.326 -8.141 -11.221 30 HE3 LYS 28 2HE LYS 28 19.827 -8.702 -11.953 31 HZ1 LYS 28 1HZ LYS 28 17.628 -10.442 -10.976 32 HZ2 LYS 28 2HZ LYS 28 19.064 -10.976 -11.691 33 HZ3 LYS 28 3HZ LYS 28 17.951 -10.080 -12.593 34 H GLU 29 H GLU 29 20.455 -6.163 -5.478 35 HA GLU 29 HA GLU 29 18.136 -5.730 -4.030 36 HB2 GLU 29 1HB GLU 29 20.257 -4.660 -3.498 37 HB3 GLU 29 2HB GLU 29 20.185 -3.723 -4.982 38 HG2 GLU 29 1HG GLU 29 18.048 -2.711 -4.087 39 HG3 GLU 29 2HG GLU 29 18.452 -3.467 -2.544 40 H LYS 30 H LYS 30 18.963 -4.535 -7.251 41 HA LYS 30 HA LYS 30 16.914 -2.592 -7.364 42 HB2 LYS 30 1HB LYS 30 18.438 -3.988 -9.563 43 HB3 LYS 30 2HB LYS 30 17.252 -2.733 -9.870 44 HG2 LYS 30 1HG LYS 30 19.416 -1.738 -9.926 45 HG3 LYS 30 2HG LYS 30 18.604 -1.190 -8.460 46 HD2 LYS 30 1HD LYS 30 19.836 -2.929 -7.188 47 HD3 LYS 30 2HD LYS 30 20.709 -3.343 -8.664 48 HE2 LYS 30 1HE LYS 30 20.714 -0.630 -7.345 49 HE3 LYS 30 2HE LYS 30 21.981 -1.842 -7.169 50 HZ1 LYS 30 1HZ LYS 30 22.363 -1.714 -9.561 51 HZ2 LYS 30 2HZ LYS 30 22.573 -0.205 -8.826 52 HZ3 LYS 30 3HZ LYS 30 21.167 -0.528 -9.705 53 H ALA 31 H ALA 31 17.043 -6.003 -8.170 54 HA ALA 31 HA ALA 31 14.429 -6.112 -9.304 55 HB1 ALA 31 1HB ALA 31 16.113 -7.835 -9.753 56 HB2 ALA 31 2HB ALA 31 14.628 -8.524 -9.097 57 HB3 ALA 31 3HB ALA 31 16.044 -8.333 -8.063 58 H ASP 32 H ASP 32 15.751 -6.544 -6.052 59 HA ASP 32 HA ASP 32 13.438 -7.508 -4.777 60 HB2 ASP 32 1HB ASP 32 15.737 -5.834 -3.752 61 HB3 ASP 32 2HB ASP 32 14.427 -6.372 -2.707 62 H ARG 33 H ARG 33 14.641 -4.209 -5.209 63 HA ARG 33 HA ARG 33 12.463 -3.058 -3.822 64 HB2 ARG 33 1HB ARG 33 13.283 -0.891 -4.758 65 HB3 ARG 33 2HB ARG 33 14.461 -1.806 -3.834 66 HG2 ARG 33 1HG ARG 33 15.619 -2.457 -5.796 67 HG3 ARG 33 2HG ARG 33 14.324 -1.850 -6.836 68 HD2 ARG 33 1HD ARG 33 15.315 0.135 -6.890 69 HD3 ARG 33 2HD ARG 33 15.101 0.256 -5.148 70 HE ARG 33 HE ARG 33 17.323 -1.046 -5.109 71 HH11 ARG 33 1HH1 ARG 33 16.431 1.291 -7.556 72 HH12 ARG 33 2HH1 ARG 33 18.036 1.931 -7.716 73 HH21 ARG 33 1HH2 ARG 33 19.444 -0.191 -5.295 74 HH22 ARG 33 2HH2 ARG 33 19.739 1.097 -6.434 75 H GLN 34 H GLN 34 13.077 -3.669 -7.249 76 HA GLN 34 HA GLN 34 10.884 -2.248 -8.273 77 HB2 GLN 34 1HB GLN 34 12.400 -4.641 -9.272 78 HB3 GLN 34 2HB GLN 34 11.008 -4.020 -10.148 79 HG2 GLN 34 1HG GLN 34 12.090 -1.865 -10.392 80 HG3 GLN 34 2HG GLN 34 13.469 -2.431 -9.452 81 HE21 GLN 34 1HE2 GLN 34 13.966 -2.661 -13.205 82 HE22 GLN 34 2HE2 GLN 34 13.276 -1.427 -12.211 83 H LYS 35 H LYS 35 11.109 -5.488 -6.903 84 HA LYS 35 HA LYS 35 8.427 -6.248 -7.461 85 HB2 LYS 35 1HB LYS 35 10.329 -7.166 -5.297 86 HB3 LYS 35 2HB LYS 35 8.783 -7.926 -5.645 87 HG2 LYS 35 1HG LYS 35 9.532 -8.574 -7.833 88 HG3 LYS 35 2HG LYS 35 11.038 -7.678 -7.621 89 HD2 LYS 35 1HD LYS 35 11.670 -9.156 -5.787 90 HD3 LYS 35 2HD LYS 35 10.153 -10.038 -5.964 91 HE2 LYS 35 1HE LYS 35 12.281 -9.798 -8.087 92 HE3 LYS 35 2HE LYS 35 12.061 -11.189 -7.028 93 HZ1 LYS 35 1HZ LYS 35 9.861 -11.512 -7.966 94 HZ2 LYS 35 2HZ LYS 35 11.032 -11.540 -9.184 95 HZ3 LYS 35 3HZ LYS 35 10.062 -10.172 -8.975 96 H VAL 36 H VAL 36 10.015 -4.643 -4.768 97 HA VAL 36 HA VAL 36 7.834 -4.462 -3.019 98 HB VAL 36 HB VAL 36 10.287 -2.744 -3.382 99 HG11 VAL 36 1HG1 VAL 36 8.799 -1.179 -2.467 100 HG12 VAL 36 2HG1 VAL 36 9.668 -1.838 -1.077 101 HG13 VAL 36 3HG1 VAL 36 8.031 -2.389 -1.435 102 HG21 VAL 36 1HG2 VAL 36 10.625 -4.997 -2.504 103 HG22 VAL 36 2HG2 VAL 36 9.463 -4.680 -1.214 104 HG23 VAL 36 3HG2 VAL 36 10.977 -3.777 -1.283 105 H VAL 37 H VAL 37 8.992 -2.208 -5.504 106 HA VAL 37 HA VAL 37 7.030 -0.239 -5.091 107 HB VAL 37 HB VAL 37 8.526 -0.863 -7.643 108 HG11 VAL 37 1HG1 VAL 37 7.080 1.642 -6.783 109 HG12 VAL 37 2HG1 VAL 37 6.578 0.537 -8.062 110 HG13 VAL 37 3HG1 VAL 37 8.062 1.474 -8.238 111 HG21 VAL 37 1HG2 VAL 37 10.042 -0.431 -5.801 112 HG22 VAL 37 2HG2 VAL 37 9.162 1.042 -5.394 113 HG23 VAL 37 3HG2 VAL 37 10.042 0.933 -6.918 114 H SER 38 H SER 38 7.049 -3.133 -7.114 115 HA SER 38 HA SER 38 4.776 -2.525 -8.651 116 HB2 SER 38 1HB SER 38 6.437 -4.358 -9.128 117 HB3 SER 38 2HB SER 38 5.690 -5.295 -7.834 118 HG SER 38 HG SER 38 4.605 -5.958 -9.581 119 H ASP 39 H ASP 39 5.070 -4.370 -5.605 120 HA ASP 39 HA ASP 39 2.261 -4.782 -5.345 121 HB2 ASP 39 1HB ASP 39 4.485 -4.892 -3.302 122 HB3 ASP 39 2HB ASP 39 2.811 -5.285 -2.932 123 H LEU 40 H LEU 40 4.487 -2.306 -4.336 124 HA LEU 40 HA LEU 40 2.851 -0.962 -2.491 125 HB2 LEU 40 1HB LEU 40 5.287 -0.697 -2.714 126 HB3 LEU 40 2HB LEU 40 5.053 0.122 -4.242 127 HG LEU 40 HG LEU 40 3.884 1.948 -3.068 128 HD11 LEU 40 1HD1 LEU 40 3.997 2.049 -0.615 129 HD12 LEU 40 2HD1 LEU 40 4.636 0.405 -0.587 130 HD13 LEU 40 3HD1 LEU 40 3.001 0.707 -1.177 131 HD21 LEU 40 1HD2 LEU 40 6.236 2.176 -3.500 132 HD22 LEU 40 2HD2 LEU 40 6.633 1.230 -2.065 133 HD23 LEU 40 3HD2 LEU 40 5.891 2.820 -1.895 134 H VAL 41 H VAL 41 3.381 -0.384 -5.975 135 HA VAL 41 HA VAL 41 1.570 1.785 -6.130 136 HB VAL 41 HB VAL 41 1.607 1.530 -8.544 137 HG11 VAL 41 1HG1 VAL 41 3.517 2.589 -7.425 138 HG12 VAL 41 2HG1 VAL 41 3.982 1.793 -8.928 139 HG13 VAL 41 3HG1 VAL 41 4.339 1.029 -7.379 140 HG21 VAL 41 1HG2 VAL 41 2.858 -0.290 -9.625 141 HG22 VAL 41 2HG2 VAL 41 1.451 -0.882 -8.742 142 HG23 VAL 41 3HG2 VAL 41 3.066 -1.063 -8.054 143 H ALA 42 H ALA 42 1.173 -1.699 -6.488 144 HA ALA 42 HA ALA 42 -1.518 -1.699 -7.307 145 HB1 ALA 42 1HB ALA 42 -0.113 -3.696 -7.396 146 HB2 ALA 42 2HB ALA 42 -1.587 -3.998 -6.475 147 HB3 ALA 42 3HB ALA 42 -0.058 -3.743 -5.634 148 H LEU 43 H LEU 43 -0.009 -1.517 -4.123 149 HA LEU 43 HA LEU 43 -2.304 -1.716 -2.533 150 HB2 LEU 43 1HB LEU 43 0.291 -0.239 -2.133 151 HB3 LEU 43 2HB LEU 43 -0.960 -0.273 -0.906 152 HG LEU 43 HG LEU 43 0.456 -2.707 -1.991 153 HD11 LEU 43 1HD1 LEU 43 0.771 -1.184 0.588 154 HD12 LEU 43 2HD1 LEU 43 1.965 -1.328 -0.701 155 HD13 LEU 43 3HD1 LEU 43 1.511 -2.749 0.241 156 HD21 LEU 43 1HD2 LEU 43 -0.641 -3.893 -0.189 157 HD22 LEU 43 2HD2 LEU 43 -1.854 -3.115 -1.204 158 HD23 LEU 43 3HD2 LEU 43 -1.422 -2.409 0.351 159 H GLU 44 H GLU 44 -0.709 1.152 -3.898 160 HA GLU 44 HA GLU 44 -2.545 3.048 -2.935 161 HB2 GLU 44 1HB GLU 44 -0.333 3.611 -3.935 162 HB3 GLU 44 2HB GLU 44 -0.970 3.173 -5.516 163 HG2 GLU 44 1HG GLU 44 -2.778 4.920 -5.069 164 HG3 GLU 44 2HG GLU 44 -1.737 5.474 -3.759 165 H GLY 45 H GLY 45 -2.528 1.033 -5.824 166 HA2 GLY 45 1HA GLY 45 -4.739 2.110 -7.145 167 HA3 GLY 45 2HA GLY 45 -4.236 0.427 -7.231 168 H ALA 46 H ALA 46 -4.601 -0.425 -4.662 169 HA ALA 46 HA ALA 46 -7.373 -0.886 -4.520 170 HB1 ALA 46 1HB ALA 46 -6.904 -1.911 -2.336 171 HB2 ALA 46 2HB ALA 46 -5.277 -1.235 -2.373 172 HB3 ALA 46 3HB ALA 46 -5.758 -2.443 -3.563 173 H LEU 47 H LEU 47 -5.271 1.410 -2.860 174 HA LEU 47 HA LEU 47 -7.169 2.435 -1.038 175 HB2 LEU 47 1HB LEU 47 -4.836 3.889 -2.287 176 HB3 LEU 47 2HB LEU 47 -5.611 4.270 -0.760 177 HG LEU 47 HG LEU 47 -3.894 1.878 -1.397 178 HD11 LEU 47 1HD1 LEU 47 -3.521 4.132 0.562 179 HD12 LEU 47 2HD1 LEU 47 -2.697 3.971 -0.988 180 HD13 LEU 47 3HD1 LEU 47 -2.415 2.787 0.288 181 HD21 LEU 47 1HD2 LEU 47 -5.720 1.171 0.020 182 HD22 LEU 47 2HD2 LEU 47 -5.393 2.497 1.138 183 HD23 LEU 47 3HD2 LEU 47 -4.208 1.206 0.925 184 H ASP 48 H ASP 48 -6.107 3.625 -4.216 185 HA ASP 48 HA ASP 48 -7.760 5.896 -4.292 186 HB2 ASP 48 1HB ASP 48 -5.813 5.479 -5.801 187 HB3 ASP 48 2HB ASP 48 -6.769 4.267 -6.644 188 H MET 49 H MET 49 -8.246 2.601 -5.488 189 HA MET 49 HA MET 49 -10.800 3.132 -6.606 190 HB2 MET 49 1HB MET 49 -9.511 0.513 -5.836 191 HB3 MET 49 2HB MET 49 -11.017 0.657 -6.736 192 HG2 MET 49 1HG MET 49 -9.814 1.874 -8.504 193 HG3 MET 49 2HG MET 49 -8.313 1.645 -7.611 194 HE1 MET 49 1HE MET 49 -7.889 -0.756 -10.667 195 HE2 MET 49 2HE MET 49 -7.176 0.570 -9.747 196 HE3 MET 49 3HE MET 49 -8.673 0.823 -10.647 197 H TYR 50 H TYR 50 -9.701 1.952 -3.487 198 HA TYR 50 HA TYR 50 -12.169 1.249 -2.386 199 HB2 TYR 50 1HB TYR 50 -9.692 1.149 -1.431 200 HB3 TYR 50 2HB TYR 50 -10.162 2.678 -0.701 201 HD1 TYR 50 HD1 TYR 50 -12.028 2.732 0.961 202 HD2 TYR 50 HD2 TYR 50 -10.534 -0.914 -0.633 203 HE1 TYR 50 HE1 TYR 50 -13.108 1.494 2.791 204 HE2 TYR 50 HE2 TYR 50 -11.607 -2.158 1.183 205 HH TYR 50 HH TYR 50 -13.946 -0.842 3.204 206 H LYS 51 H LYS 51 -10.494 4.386 -2.497 207 HA LYS 51 HA LYS 51 -12.566 5.824 -1.191 208 HB2 LYS 51 1HB LYS 51 -10.310 6.746 -1.323 209 HB3 LYS 51 2HB LYS 51 -10.417 6.815 -3.079 210 HG2 LYS 51 1HG LYS 51 -12.272 8.413 -2.886 211 HG3 LYS 51 2HG LYS 51 -12.107 8.371 -1.133 212 HD2 LYS 51 1HD LYS 51 -9.857 9.277 -1.305 213 HD3 LYS 51 2HD LYS 51 -9.974 9.268 -3.069 214 HE2 LYS 51 1HE LYS 51 -11.786 10.866 -2.992 215 HE3 LYS 51 2HE LYS 51 -11.804 10.803 -1.230 216 HZ1 LYS 51 1HZ LYS 51 -9.613 11.773 -1.191 217 HZ2 LYS 51 2HZ LYS 51 -10.659 12.767 -2.071 218 HZ3 LYS 51 3HZ LYS 51 -9.540 11.789 -2.881 219 H LEU 52 H LEU 52 -11.968 4.924 -4.514 220 HA LEU 52 HA LEU 52 -13.755 6.705 -5.747 221 HB2 LEU 52 1HB LEU 52 -12.025 5.360 -6.906 222 HB3 LEU 52 2HB LEU 52 -12.972 3.919 -6.605 223 HG LEU 52 HG LEU 52 -14.797 4.882 -7.997 224 HD11 LEU 52 1HD1 LEU 52 -14.284 7.235 -7.761 225 HD12 LEU 52 2HD1 LEU 52 -14.245 6.778 -9.463 226 HD13 LEU 52 3HD1 LEU 52 -12.738 7.005 -8.577 227 HD21 LEU 52 1HD2 LEU 52 -12.106 4.620 -9.330 228 HD22 LEU 52 2HD2 LEU 52 -13.671 4.490 -10.133 229 HD23 LEU 52 3HD2 LEU 52 -13.198 3.296 -8.926 230 H ASP 53 H ASP 53 -14.209 3.327 -4.703 231 HA ASP 53 HA ASP 53 -17.017 3.381 -5.316 232 HB2 ASP 53 1HB ASP 53 -15.612 1.321 -5.465 233 HB3 ASP 53 2HB ASP 53 -15.507 1.319 -3.705 234 H ASN 54 H ASN 54 -15.099 3.476 -2.336 235 HA ASN 54 HA ASN 54 -17.535 3.420 -0.723 236 HB2 ASN 54 1HB ASN 54 -14.633 3.317 0.122 237 HB3 ASN 54 2HB ASN 54 -16.016 3.115 1.190 238 HD21 ASN 54 1HD2 ASN 54 -14.719 0.082 -1.162 239 HD22 ASN 54 2HD2 ASN 54 -14.108 1.690 -1.331 240 H SER 55 H SER 55 -15.745 5.745 -2.155 241 HA SER 55 HA SER 55 -15.797 8.004 -2.036 242 HB2 SER 55 1HB SER 55 -17.638 7.647 0.333 243 HB3 SER 55 2HB SER 55 -17.424 9.117 -0.617 244 HG SER 55 HG SER 55 -18.031 7.442 -2.414 245 H ARG 56 H ARG 56 -14.188 6.137 0.009 246 HA ARG 56 HA ARG 56 -12.700 8.322 1.140 247 HB2 ARG 56 1HB ARG 56 -13.035 7.788 3.470 248 HB3 ARG 56 2HB ARG 56 -14.597 8.103 2.731 249 HG2 ARG 56 1HG ARG 56 -15.307 6.180 3.571 250 HG3 ARG 56 2HG ARG 56 -14.198 5.349 2.476 251 HD2 ARG 56 1HD ARG 56 -13.792 4.600 4.728 252 HD3 ARG 56 2HD ARG 56 -12.416 5.563 4.180 253 HE ARG 56 HE ARG 56 -14.492 6.924 5.722 254 HH11 ARG 56 1HH1 ARG 56 -11.271 5.557 5.626 255 HH12 ARG 56 2HH1 ARG 56 -10.784 6.288 7.124 256 HH21 ARG 56 1HH2 ARG 56 -13.848 7.899 7.679 257 HH22 ARG 56 2HH2 ARG 56 -12.248 7.617 8.293 258 H TYR 57 H TYR 57 -10.760 7.633 2.201 259 HA TYR 57 HA TYR 57 -9.599 5.302 1.018 260 HB2 TYR 57 1HB TYR 57 -8.600 7.382 2.946 261 HB3 TYR 57 2HB TYR 57 -7.636 5.968 2.551 262 HD1 TYR 57 HD1 TYR 57 -7.129 5.563 0.057 263 HD2 TYR 57 HD2 TYR 57 -8.508 9.273 1.605 264 HE1 TYR 57 HE1 TYR 57 -6.230 6.715 -1.922 265 HE2 TYR 57 HE2 TYR 57 -7.621 10.436 -0.370 266 HH TYR 57 HH TYR 57 -6.515 8.767 -3.154 267 HA PRO 58 HA PRO 58 -10.387 2.371 4.214 268 HB2 PRO 58 1HB PRO 58 -8.336 0.665 3.800 269 HB3 PRO 58 2HB PRO 58 -9.699 0.795 2.682 270 HG2 PRO 58 1HG PRO 58 -6.961 1.985 2.493 271 HG3 PRO 58 2HG PRO 58 -7.936 1.218 1.226 272 HD2 PRO 58 1HD PRO 58 -7.721 3.913 1.513 273 HD3 PRO 58 2HD PRO 58 -9.160 3.120 0.848 274 H THR 59 H THR 59 -9.666 1.661 6.239 275 HA THR 59 HA THR 59 -7.589 3.255 7.469 276 HB THR 59 HB THR 59 -8.302 2.007 9.552 277 HG1 THR 59 HG1 THR 59 -9.847 0.531 9.408 278 HG21 THR 59 1HG2 THR 59 -10.446 3.491 8.028 279 HG22 THR 59 2HG2 THR 59 -9.178 4.228 9.007 280 HG23 THR 59 3HG2 THR 59 -10.415 3.229 9.771 281 H THR 60 H THR 60 -6.307 1.798 9.241 282 HA THR 60 HA THR 60 -4.274 0.667 7.777 283 HB THR 60 HB THR 60 -3.954 1.467 10.054 284 HG1 THR 60 HG1 THR 60 -2.455 -0.061 9.213 285 HG21 THR 60 1HG2 THR 60 -4.607 0.116 11.984 286 HG22 THR 60 2HG2 THR 60 -5.440 -1.014 10.917 287 HG23 THR 60 3HG2 THR 60 -6.018 0.646 11.069 288 H GLU 61 H GLU 61 -6.995 -1.047 9.306 289 HA GLU 61 HA GLU 61 -5.957 -3.629 8.615 290 HB2 GLU 61 1HB GLU 61 -8.753 -2.813 9.423 291 HB3 GLU 61 2HB GLU 61 -8.169 -4.467 9.310 292 HG2 GLU 61 1HG GLU 61 -7.244 -2.348 11.229 293 HG3 GLU 61 2HG GLU 61 -8.194 -3.785 11.601 294 H GLN 62 H GLN 62 -8.332 -1.424 7.270 295 HA GLN 62 HA GLN 62 -9.348 -3.270 5.353 296 HB2 GLN 62 1HB GLN 62 -9.629 -0.263 5.402 297 HB3 GLN 62 2HB GLN 62 -10.654 -1.401 4.536 298 HG2 GLN 62 1HG GLN 62 -11.434 -2.333 6.634 299 HG3 GLN 62 2HG GLN 62 -10.362 -1.262 7.530 300 HE21 GLN 62 1HE2 GLN 62 -13.281 0.740 5.525 301 HE22 GLN 62 2HE2 GLN 62 -12.232 -0.354 4.695 302 H GLY 63 H GLY 63 -6.716 -1.005 5.373 303 HA2 GLY 63 1HA GLY 63 -6.606 -0.433 2.612 304 HA3 GLY 63 2HA GLY 63 -5.285 -0.245 3.750 305 H LEU 64 H LEU 64 -4.698 -2.803 4.500 306 HA LEU 64 HA LEU 64 -3.322 -3.745 2.192 307 HB2 LEU 64 1HB LEU 64 -3.627 -4.873 4.942 308 HB3 LEU 64 2HB LEU 64 -2.713 -5.690 3.698 309 HG LEU 64 HG LEU 64 -1.002 -4.600 4.647 310 HD11 LEU 64 1HD1 LEU 64 -2.132 -2.282 3.132 311 HD12 LEU 64 2HD1 LEU 64 -1.212 -3.612 2.431 312 HD13 LEU 64 3HD1 LEU 64 -0.443 -2.521 3.586 313 HD21 LEU 64 1HD2 LEU 64 -1.199 -2.510 5.942 314 HD22 LEU 64 2HD2 LEU 64 -2.249 -3.794 6.539 315 HD23 LEU 64 3HD2 LEU 64 -2.924 -2.481 5.575 316 H GLN 65 H GLN 65 -6.253 -4.675 3.837 317 HA GLN 65 HA GLN 65 -6.563 -7.193 2.545 318 HB2 GLN 65 1HB GLN 65 -8.421 -5.410 4.095 319 HB3 GLN 65 2HB GLN 65 -8.993 -6.885 3.329 320 HG2 GLN 65 1HG GLN 65 -6.791 -6.738 5.375 321 HG3 GLN 65 2HG GLN 65 -8.466 -7.178 5.708 322 HE21 GLN 65 1HE2 GLN 65 -5.880 -9.857 4.137 323 HE22 GLN 65 2HE2 GLN 65 -5.443 -8.202 4.396 324 H ALA 66 H ALA 66 -7.234 -3.944 1.614 325 HA ALA 66 HA ALA 66 -9.499 -4.286 0.016 326 HB1 ALA 66 1HB ALA 66 -8.717 -2.108 0.741 327 HB2 ALA 66 2HB ALA 66 -8.873 -2.157 -1.016 328 HB3 ALA 66 3HB ALA 66 -7.280 -2.270 -0.268 329 H LEU 67 H LEU 67 -6.211 -5.138 -0.618 330 HA LEU 67 HA LEU 67 -6.605 -5.261 -3.486 331 HB2 LEU 67 1HB LEU 67 -4.328 -5.571 -1.645 332 HB3 LEU 67 2HB LEU 67 -4.261 -6.511 -3.120 333 HG LEU 67 HG LEU 67 -4.365 -3.514 -2.864 334 HD11 LEU 67 1HD1 LEU 67 -2.297 -5.408 -3.970 335 HD12 LEU 67 2HD1 LEU 67 -2.206 -4.570 -2.421 336 HD13 LEU 67 3HD1 LEU 67 -2.174 -3.647 -3.923 337 HD21 LEU 67 1HD2 LEU 67 -5.715 -4.200 -4.783 338 HD22 LEU 67 2HD2 LEU 67 -4.397 -5.219 -5.355 339 HD23 LEU 67 3HD2 LEU 67 -4.203 -3.467 -5.311 340 H VAL 68 H VAL 68 -7.110 -7.381 -0.834 341 HA VAL 68 HA VAL 68 -6.882 -9.692 -2.649 342 HB VAL 68 HB VAL 68 -5.029 -9.839 -1.157 343 HG11 VAL 68 1HG1 VAL 68 -5.816 -8.367 0.610 344 HG12 VAL 68 2HG1 VAL 68 -5.220 -9.897 1.256 345 HG13 VAL 68 3HG1 VAL 68 -6.957 -9.605 1.138 346 HG21 VAL 68 1HG2 VAL 68 -5.463 -11.968 -0.019 347 HG22 VAL 68 2HG2 VAL 68 -6.116 -11.944 -1.658 348 HG23 VAL 68 3HG2 VAL 68 -7.194 -11.739 -0.276 349 H SER 69 H SER 69 -8.503 -8.557 0.327 350 HA SER 69 HA SER 69 -10.866 -10.053 -0.487 351 HB2 SER 69 1HB SER 69 -9.562 -11.579 0.993 352 HB3 SER 69 2HB SER 69 -9.635 -10.364 2.267 353 HG SER 69 HG SER 69 -11.320 -11.685 2.682 354 H ALA 70 H ALA 70 -12.682 -8.944 -0.085 355 HA ALA 70 HA ALA 70 -12.554 -6.234 0.536 356 HB1 ALA 70 1HB ALA 70 -14.355 -7.213 -0.776 357 HB2 ALA 70 2HB ALA 70 -14.996 -6.298 0.589 358 HB3 ALA 70 3HB ALA 70 -14.947 -8.059 0.653 359 HA PRO 71 HA PRO 71 -12.093 -6.325 4.985 360 HB2 PRO 71 1HB PRO 71 -13.044 -3.533 4.541 361 HB3 PRO 71 2HB PRO 71 -11.666 -4.115 5.486 362 HG2 PRO 71 1HG PRO 71 -11.265 -3.001 3.123 363 HG3 PRO 71 2HG PRO 71 -10.349 -4.447 3.591 364 HD2 PRO 71 1HD PRO 71 -12.692 -4.201 1.749 365 HD3 PRO 71 2HD PRO 71 -11.240 -5.213 1.600 366 H SER 72 H SER 72 -13.494 -6.806 6.538 367 HA SER 72 HA SER 72 -16.323 -6.678 6.043 368 HB2 SER 72 1HB SER 72 -14.866 -7.505 8.566 369 HB3 SER 72 2HB SER 72 -16.532 -7.892 8.132 370 HG SER 72 HG SER 72 -15.721 -9.594 7.219 371 H ALA 73 H ALA 73 -13.981 -4.680 7.475 372 HA ALA 73 HA ALA 73 -15.680 -3.270 9.287 373 HB1 ALA 73 1HB ALA 73 -13.240 -3.342 9.562 374 HB2 ALA 73 2HB ALA 73 -13.836 -1.685 9.449 375 HB3 ALA 73 3HB ALA 73 -13.052 -2.435 8.060 376 H GLU 74 H GLU 74 -16.608 -1.246 9.028 377 HA GLU 74 HA GLU 74 -17.599 -0.672 6.400 378 HB2 GLU 74 1HB GLU 74 -18.930 -0.474 8.512 379 HB3 GLU 74 2HB GLU 74 -17.924 0.883 8.979 380 HG2 GLU 74 1HG GLU 74 -19.520 0.906 6.440 381 HG3 GLU 74 2HG GLU 74 -20.222 1.364 7.986 382 HA PRO 75 HA PRO 75 -18.210 0.711 5.019 383 HB2 PRO 75 1HB PRO 75 -17.419 1.522 2.583 384 HB3 PRO 75 2HB PRO 75 -18.041 2.652 3.792 385 HG2 PRO 75 1HG PRO 75 -15.217 2.093 2.995 386 HG3 PRO 75 2HG PRO 75 -15.991 3.641 3.378 387 HD2 PRO 75 1HD PRO 75 -14.419 2.215 5.129 388 HD3 PRO 75 2HD PRO 75 -15.659 3.384 5.620 389 H HIS 76 H HIS 76 -18.538 -1.291 4.321 390 HA HIS 76 HA HIS 76 -16.512 -3.165 3.794 391 HB2 HIS 76 1HB HIS 76 -19.016 -3.556 4.380 392 HB3 HIS 76 2HB HIS 76 -19.297 -3.385 2.648 393 HD1 HIS 76 HD1 HIS 76 -18.579 -5.857 5.148 394 HD2 HIS 76 HD2 HIS 76 -17.685 -5.378 1.117 395 HE1 HIS 76 HE1 HIS 76 -17.928 -8.142 4.322 396 HE2 HIS 76 HE2 HIS 76 -17.573 -7.857 1.847 397 H ALA 77 H ALA 77 -15.220 -3.303 2.061 398 HA ALA 77 HA ALA 77 -15.411 -1.695 -0.199 399 HB1 ALA 77 1HB ALA 77 -14.063 -4.382 0.041 400 HB2 ALA 77 2HB ALA 77 -13.352 -2.825 0.461 401 HB3 ALA 77 3HB ALA 77 -13.760 -3.184 -1.217 402 H ARG 78 H ARG 78 -16.761 -1.714 -1.850 403 HA ARG 78 HA ARG 78 -18.335 -4.118 -2.358 404 HB2 ARG 78 1HB ARG 78 -19.651 -2.230 -1.573 405 HB3 ARG 78 2HB ARG 78 -18.927 -1.178 -2.781 406 HG2 ARG 78 1HG ARG 78 -21.067 -1.727 -3.572 407 HG3 ARG 78 2HG ARG 78 -19.907 -2.673 -4.507 408 HD2 ARG 78 1HD ARG 78 -20.322 -4.538 -2.818 409 HD3 ARG 78 2HD ARG 78 -21.715 -3.596 -2.297 410 HE ARG 78 HE ARG 78 -22.145 -3.750 -4.926 411 HH11 ARG 78 1HH1 ARG 78 -21.277 -6.210 -2.594 412 HH12 ARG 78 2HH1 ARG 78 -22.085 -7.486 -3.447 413 HH21 ARG 78 1HH2 ARG 78 -23.199 -5.422 -6.061 414 HH22 ARG 78 2HH2 ARG 78 -23.185 -7.035 -5.426 415 H ASN 79 H ASN 79 -18.780 -4.631 -4.584 416 HA ASN 79 HA ASN 79 -18.322 -4.883 -6.789 417 HB2 ASN 79 1HB ASN 79 -17.373 -2.039 -6.455 418 HB3 ASN 79 2HB ASN 79 -17.323 -2.873 -8.005 419 HD21 ASN 79 1HD2 ASN 79 -20.528 -0.915 -7.286 420 HD22 ASN 79 2HD2 ASN 79 -18.890 -0.552 -6.854 421 H TYR 80 H TYR 80 -16.636 -6.029 -5.024 422 HA TYR 80 HA TYR 80 -13.926 -5.487 -5.991 423 HB2 TYR 80 1HB TYR 80 -13.138 -6.735 -4.062 424 HB3 TYR 80 2HB TYR 80 -14.282 -5.507 -3.535 425 HD1 TYR 80 HD1 TYR 80 -13.491 -9.014 -3.591 426 HD2 TYR 80 HD2 TYR 80 -16.642 -6.226 -2.951 427 HE1 TYR 80 HE1 TYR 80 -14.771 -10.742 -2.406 428 HE2 TYR 80 HE2 TYR 80 -17.930 -7.950 -1.760 429 HH TYR 80 HH TYR 80 -18.052 -10.420 -1.659 430 HA PRO 81 HA PRO 81 -14.020 -9.141 -8.499 431 HB2 PRO 81 1HB PRO 81 -11.324 -9.530 -8.689 432 HB3 PRO 81 2HB PRO 81 -12.194 -8.301 -9.609 433 HG2 PRO 81 1HG PRO 81 -10.585 -8.016 -7.109 434 HG3 PRO 81 2HG PRO 81 -10.659 -6.949 -8.525 435 HD2 PRO 81 1HD PRO 81 -11.975 -6.421 -6.217 436 HD3 PRO 81 2HD PRO 81 -12.586 -5.926 -7.807 437 H GLU 82 H GLU 82 -14.024 -11.323 -8.156 438 HA GLU 82 HA GLU 82 -13.594 -12.371 -5.576 439 HB2 GLU 82 1HB GLU 82 -13.740 -13.865 -8.206 440 HB3 GLU 82 2HB GLU 82 -13.859 -14.595 -6.613 441 HG2 GLU 82 1HG GLU 82 -16.058 -14.459 -7.301 442 HG3 GLU 82 2HG GLU 82 -15.874 -13.036 -6.278 443 H GLY 83 H GLY 83 -11.795 -12.995 -4.601 444 HA2 GLY 83 1HA GLY 83 -9.616 -13.823 -4.380 445 HA3 GLY 83 2HA GLY 83 -9.450 -13.787 -6.133 446 H GLY 84 H GLY 84 -10.810 -10.943 -5.177 447 HA2 GLY 84 1HA GLY 84 -10.049 -8.807 -4.870 448 HA3 GLY 84 2HA GLY 84 -8.569 -9.496 -4.218 449 H TYR 85 H TYR 85 -7.535 -7.725 -5.301 450 HA TYR 85 HA TYR 85 -7.320 -7.892 -8.199 451 HB2 TYR 85 1HB TYR 85 -5.960 -6.106 -6.164 452 HB3 TYR 85 2HB TYR 85 -5.755 -5.971 -7.913 453 HD1 TYR 85 HD1 TYR 85 -7.746 -5.021 -5.089 454 HD2 TYR 85 HD2 TYR 85 -7.828 -5.476 -9.316 455 HE1 TYR 85 HE1 TYR 85 -9.725 -3.569 -5.199 456 HE2 TYR 85 HE2 TYR 85 -9.804 -4.019 -9.439 457 HH TYR 85 HH TYR 85 -11.665 -3.326 -7.940 458 H ILE 86 H ILE 86 -5.632 -8.677 -5.287 459 HA ILE 86 HA ILE 86 -3.887 -10.447 -6.827 460 HB ILE 86 HB ILE 86 -2.431 -8.624 -6.268 461 HG12 ILE 86 1HG1 ILE 86 -1.990 -10.872 -4.292 462 HG13 ILE 86 2HG1 ILE 86 -1.468 -10.857 -5.973 463 HG21 ILE 86 1HG2 ILE 86 -3.754 -7.563 -4.556 464 HG22 ILE 86 2HG2 ILE 86 -2.105 -7.810 -3.984 465 HG23 ILE 86 3HG2 ILE 86 -3.401 -8.873 -3.430 466 HD11 ILE 86 1HD1 ILE 86 -0.507 -9.005 -3.803 467 HD12 ILE 86 2HD1 ILE 86 0.005 -8.964 -5.492 468 HD13 ILE 86 3HD1 ILE 86 0.379 -10.367 -4.490 469 H ARG 87 H ARG 87 -3.985 -12.467 -6.079 470 HA ARG 87 HA ARG 87 -6.083 -13.083 -4.296 471 HB2 ARG 87 1HB ARG 87 -4.002 -14.810 -5.622 472 HB3 ARG 87 2HB ARG 87 -5.294 -15.462 -4.623 473 HG2 ARG 87 1HG ARG 87 -6.953 -14.491 -6.136 474 HG3 ARG 87 2HG ARG 87 -5.652 -13.843 -7.138 475 HD2 ARG 87 1HD ARG 87 -6.079 -16.770 -6.548 476 HD3 ARG 87 2HD ARG 87 -6.615 -15.953 -8.015 477 HE ARG 87 HE ARG 87 -4.079 -15.385 -8.171 478 HH11 ARG 87 1HH1 ARG 87 -5.517 -18.403 -7.135 479 HH12 ARG 87 2HH1 ARG 87 -4.157 -19.364 -7.621 480 HH21 ARG 87 1HH2 ARG 87 -2.292 -16.647 -8.823 481 HH22 ARG 87 2HH2 ARG 87 -2.324 -18.364 -8.583 482 H ARG 88 H ARG 88 -2.790 -12.500 -3.716 483 HA ARG 88 HA ARG 88 -3.004 -13.690 -1.039 484 HB2 ARG 88 1HB ARG 88 -1.668 -15.152 -2.486 485 HB3 ARG 88 2HB ARG 88 -0.649 -13.796 -2.929 486 HG2 ARG 88 1HG ARG 88 -0.800 -14.397 -0.051 487 HG3 ARG 88 2HG ARG 88 -0.003 -15.605 -1.061 488 HD2 ARG 88 1HD ARG 88 0.677 -12.674 -0.858 489 HD3 ARG 88 2HD ARG 88 1.630 -14.025 -0.243 490 HE ARG 88 HE ARG 88 1.588 -14.659 -2.792 491 HH11 ARG 88 1HH1 ARG 88 1.984 -11.487 -1.364 492 HH12 ARG 88 2HH1 ARG 88 2.982 -10.892 -2.657 493 HH21 ARG 88 1HH2 ARG 88 2.882 -13.871 -4.506 494 HH22 ARG 88 2HH2 ARG 88 3.479 -12.246 -4.447 495 H LEU 89 H LEU 89 -1.961 -12.528 0.601 496 HA LEU 89 HA LEU 89 -1.938 -9.775 0.442 497 HB2 LEU 89 1HB LEU 89 -0.799 -11.767 2.333 498 HB3 LEU 89 2HB LEU 89 -0.248 -10.118 2.471 499 HG LEU 89 HG LEU 89 -2.064 -10.626 4.037 500 HD11 LEU 89 1HD1 LEU 89 -2.825 -8.648 1.898 501 HD12 LEU 89 2HD1 LEU 89 -1.745 -8.348 3.261 502 HD13 LEU 89 3HD1 LEU 89 -3.453 -8.689 3.545 503 HD21 LEU 89 1HD2 LEU 89 -4.372 -10.866 3.112 504 HD22 LEU 89 2HD2 LEU 89 -3.324 -12.260 2.857 505 HD23 LEU 89 3HD2 LEU 89 -3.643 -11.144 1.529 506 HA PRO 90 HA PRO 90 1.899 -9.009 -1.780 507 HB2 PRO 90 1HB PRO 90 1.890 -6.301 -1.173 508 HB3 PRO 90 2HB PRO 90 1.124 -7.024 -2.590 509 HG2 PRO 90 1HG PRO 90 -0.084 -6.159 -0.014 510 HG3 PRO 90 2HG PRO 90 -0.754 -6.085 -1.651 511 HD2 PRO 90 1HD PRO 90 -1.524 -7.941 0.151 512 HD3 PRO 90 2HD PRO 90 -1.466 -8.277 -1.592 513 H GLN 91 H GLN 91 3.819 -9.372 -0.904 514 HA GLN 91 HA GLN 91 4.419 -8.285 1.751 515 HB2 GLN 91 1HB GLN 91 4.852 -11.159 0.900 516 HB3 GLN 91 2HB GLN 91 5.424 -10.454 2.406 517 HG2 GLN 91 1HG GLN 91 3.067 -10.008 3.039 518 HG3 GLN 91 2HG GLN 91 2.556 -10.832 1.569 519 HE21 GLN 91 1HE2 GLN 91 2.608 -13.092 4.599 520 HE22 GLN 91 2HE2 GLN 91 2.042 -11.472 4.379 521 H ASP 92 H ASP 92 6.547 -7.771 2.097 522 HA ASP 92 HA ASP 92 8.169 -7.053 -0.048 523 HB2 ASP 92 1HB ASP 92 9.169 -7.763 2.722 524 HB3 ASP 92 2HB ASP 92 9.943 -6.703 1.550 525 HA PRO 93 HA PRO 93 10.069 -10.811 -1.468 526 HB2 PRO 93 1HB PRO 93 12.544 -9.186 -1.702 527 HB3 PRO 93 2HB PRO 93 11.704 -10.139 -2.929 528 HG2 PRO 93 1HG PRO 93 11.577 -7.480 -2.945 529 HG3 PRO 93 2HG PRO 93 10.163 -8.465 -3.361 530 HD2 PRO 93 1HD PRO 93 10.772 -6.995 -0.830 531 HD3 PRO 93 2HD PRO 93 9.224 -7.194 -1.676 532 H TRP 94 H TRP 94 11.376 -8.915 1.115 533 HA TRP 94 HA TRP 94 13.329 -10.860 1.932 534 HB2 TRP 94 1HB TRP 94 12.280 -8.356 3.250 535 HB3 TRP 94 2HB TRP 94 13.527 -9.378 3.958 536 HD1 TRP 94 HD1 TRP 94 15.901 -9.486 2.630 537 HE1 TRP 94 HE1 TRP 94 17.048 -7.747 1.121 538 HE3 TRP 94 HE3 TRP 94 11.862 -6.544 1.576 539 HZ2 TRP 94 HZ2 TRP 94 16.332 -5.433 -0.330 540 HZ3 TRP 94 HZ3 TRP 94 12.174 -4.587 0.122 541 HH2 TRP 94 HH2 TRP 94 14.364 -4.042 -0.813 542 H GLY 95 H GLY 95 9.979 -10.533 2.302 543 HA2 GLY 95 1HA GLY 95 8.752 -12.379 3.229 544 HA3 GLY 95 2HA GLY 95 10.035 -12.587 4.411 545 H SER 96 H SER 96 8.982 -9.370 3.774 546 HA SER 96 HA SER 96 7.793 -9.270 6.446 547 HB2 SER 96 1HB SER 96 8.606 -6.967 4.656 548 HB3 SER 96 2HB SER 96 8.203 -6.888 6.371 549 HG SER 96 HG SER 96 10.567 -7.080 5.510 550 H ASP 97 H ASP 97 5.861 -7.908 6.744 551 HA ASP 97 HA ASP 97 4.031 -8.146 4.448 552 HB2 ASP 97 1HB ASP 97 3.210 -9.484 6.224 553 HB3 ASP 97 2HB ASP 97 3.562 -8.247 7.428 554 H TYR 98 H TYR 98 3.322 -6.351 3.533 555 HA TYR 98 HA TYR 98 4.369 -3.847 4.070 556 HB2 TYR 98 1HB TYR 98 1.978 -4.726 2.482 557 HB3 TYR 98 2HB TYR 98 2.392 -3.021 2.626 558 HD1 TYR 98 HD1 TYR 98 3.595 -6.297 1.425 559 HD2 TYR 98 HD2 TYR 98 4.161 -2.087 1.338 560 HE1 TYR 98 HE1 TYR 98 5.176 -6.557 -0.433 561 HE2 TYR 98 HE2 TYR 98 5.746 -2.336 -0.526 562 HH TYR 98 HH TYR 98 6.044 -5.166 -2.310 563 H GLN 99 H GLN 99 3.571 -1.945 4.893 564 HA GLN 99 HA GLN 99 1.402 -2.280 6.854 565 HB2 GLN 99 1HB GLN 99 3.921 -0.647 6.902 566 HB3 GLN 99 2HB GLN 99 2.549 -0.209 7.910 567 HG2 GLN 99 1HG GLN 99 3.859 -2.912 7.958 568 HG3 GLN 99 2HG GLN 99 4.297 -1.588 9.036 569 HE21 GLN 99 1HE2 GLN 99 1.759 -3.923 10.539 570 HE22 GLN 99 2HE2 GLN 99 3.236 -4.196 9.682 571 H LEU 100 H LEU 100 -0.258 -0.932 6.859 572 HA LEU 100 HA LEU 100 -0.170 1.493 5.203 573 HB2 LEU 100 1HB LEU 100 -1.499 -0.233 4.047 574 HB3 LEU 100 2HB LEU 100 -2.467 -0.462 5.483 575 HG LEU 100 HG LEU 100 -3.409 0.913 3.482 576 HD11 LEU 100 1HD1 LEU 100 -3.619 1.963 6.296 577 HD12 LEU 100 2HD1 LEU 100 -4.544 0.618 5.626 578 HD13 LEU 100 3HD1 LEU 100 -4.766 2.247 4.986 579 HD21 LEU 100 1HD2 LEU 100 -2.954 3.220 3.446 580 HD22 LEU 100 2HD2 LEU 100 -1.384 2.419 3.454 581 HD23 LEU 100 3HD2 LEU 100 -2.014 3.138 4.932 582 H LEU 101 H LEU 101 -0.542 3.240 6.435 583 HA LEU 101 HA LEU 101 -2.010 2.827 8.955 584 HB2 LEU 101 1HB LEU 101 0.486 3.059 9.208 585 HB3 LEU 101 2HB LEU 101 0.342 4.681 8.570 586 HG LEU 101 HG LEU 101 0.530 4.390 11.111 587 HD11 LEU 101 1HD1 LEU 101 -0.052 6.505 10.064 588 HD12 LEU 101 2HD1 LEU 101 -0.974 6.260 11.547 589 HD13 LEU 101 3HD1 LEU 101 -1.743 6.009 9.980 590 HD21 LEU 101 1HD2 LEU 101 -1.554 3.988 12.299 591 HD22 LEU 101 2HD2 LEU 101 -1.103 2.585 11.329 592 HD23 LEU 101 3HD2 LEU 101 -2.377 3.669 10.771 593 H SER 102 H SER 102 -3.875 3.833 8.774 594 HA SER 102 HA SER 102 -3.966 6.496 7.546 595 HB2 SER 102 1HB SER 102 -6.321 4.767 8.316 596 HB3 SER 102 2HB SER 102 -6.306 6.153 7.224 597 HG SER 102 HG SER 102 -6.280 4.350 5.943 598 HA PRO 103 HA PRO 103 -4.457 8.367 7.658 599 HB2 PRO 103 1HB PRO 103 -3.691 10.697 9.103 600 HB3 PRO 103 2HB PRO 103 -5.221 10.401 8.279 601 HG2 PRO 103 1HG PRO 103 -4.887 10.651 11.026 602 HG3 PRO 103 2HG PRO 103 -6.285 9.923 10.223 603 HD2 PRO 103 1HD PRO 103 -3.942 8.613 11.514 604 HD3 PRO 103 2HD PRO 103 -5.636 8.087 11.445 605 H GLY 104 H GLY 104 -2.600 8.622 6.552 606 HA2 GLY 104 1HA GLY 104 -0.242 7.538 7.677 607 HA3 GLY 104 2HA GLY 104 -0.397 8.230 6.073 608 H GLN 105 H GLN 105 1.919 8.545 7.343 609 HA GLN 105 HA GLN 105 1.897 11.183 8.611 610 HB2 GLN 105 1HB GLN 105 3.187 9.349 9.665 611 HB3 GLN 105 2HB GLN 105 4.169 9.225 8.214 612 HG2 GLN 105 1HG GLN 105 5.353 10.439 9.922 613 HG3 GLN 105 2HG GLN 105 4.981 11.504 8.570 614 HE21 GLN 105 1HE2 GLN 105 4.255 13.043 11.945 615 HE22 GLN 105 2HE2 GLN 105 5.590 12.113 11.364 616 H HIS 106 H HIS 106 2.817 9.513 5.707 617 HA HIS 106 HA HIS 106 4.140 11.885 4.630 618 HB2 HIS 106 1HB HIS 106 3.668 9.161 3.401 619 HB3 HIS 106 2HB HIS 106 4.589 10.461 2.656 620 HD1 HIS 106 HD1 HIS 106 6.767 11.237 4.162 621 HD2 HIS 106 HD2 HIS 106 5.176 7.464 4.876 622 HE1 HIS 106 HE1 HIS 106 8.586 9.942 5.317 623 HE2 HIS 106 HE2 HIS 106 7.655 7.617 5.587 624 H GLY 107 H GLY 107 1.025 10.792 4.924 625 HA2 GLY 107 1HA GLY 107 -0.098 12.761 3.276 626 HA3 GLY 107 2HA GLY 107 -0.088 11.249 2.379 627 H GLN 108 H GLN 108 -2.375 11.184 2.367 628 HA GLN 108 HA GLN 108 -3.892 11.175 4.789 629 HB2 GLN 108 1HB GLN 108 -4.935 11.803 2.680 630 HB3 GLN 108 2HB GLN 108 -4.594 10.218 2.007 631 HG2 GLN 108 1HG GLN 108 -6.916 10.381 2.628 632 HG3 GLN 108 2HG GLN 108 -6.096 9.203 3.650 633 HE21 GLN 108 1HE2 GLN 108 -6.652 10.917 6.631 634 HE22 GLN 108 2HE2 GLN 108 -5.804 9.643 5.822 635 H VAL 109 H VAL 109 -2.730 8.672 2.587 636 HA VAL 109 HA VAL 109 -3.011 6.725 4.774 637 HB VAL 109 HB VAL 109 -3.273 5.010 2.822 638 HG11 VAL 109 1HG1 VAL 109 -5.692 5.162 2.963 639 HG12 VAL 109 2HG1 VAL 109 -5.566 6.804 3.597 640 HG13 VAL 109 3HG1 VAL 109 -4.958 5.443 4.541 641 HG21 VAL 109 1HG2 VAL 109 -2.912 6.535 0.982 642 HG22 VAL 109 2HG2 VAL 109 -4.257 7.542 1.517 643 HG23 VAL 109 3HG2 VAL 109 -4.560 5.912 0.918 644 H ASP 110 H ASP 110 -1.139 5.770 5.289 645 HA ASP 110 HA ASP 110 1.136 6.278 3.507 646 HB2 ASP 110 1HB ASP 110 0.872 6.681 6.208 647 HB3 ASP 110 2HB ASP 110 1.697 5.127 6.148 648 H ILE 111 H ILE 111 1.562 4.663 2.162 649 HA ILE 111 HA ILE 111 1.506 1.920 3.223 650 HB ILE 111 HB ILE 111 1.651 1.265 0.740 651 HG12 ILE 111 1HG1 ILE 111 0.525 4.051 0.409 652 HG13 ILE 111 2HG1 ILE 111 2.145 3.561 -0.067 653 HG21 ILE 111 1HG2 ILE 111 -0.911 2.525 1.675 654 HG22 ILE 111 2HG2 ILE 111 -0.317 0.950 2.201 655 HG23 ILE 111 3HG2 ILE 111 -0.730 1.218 0.508 656 HD11 ILE 111 1HD1 ILE 111 1.239 2.020 -1.688 657 HD12 ILE 111 2HD1 ILE 111 0.596 3.641 -1.955 658 HD13 ILE 111 3HD1 ILE 111 -0.404 2.415 -1.175 659 H PHE 112 H PHE 112 3.388 0.975 3.533 660 HA PHE 112 HA PHE 112 5.645 1.596 1.839 661 HB2 PHE 112 1HB PHE 112 7.137 2.070 3.793 662 HB3 PHE 112 2HB PHE 112 5.942 3.321 3.480 663 HD1 PHE 112 HD1 PHE 112 4.130 3.727 5.025 664 HD2 PHE 112 HD2 PHE 112 7.017 0.692 5.773 665 HE1 PHE 112 HE1 PHE 112 3.383 3.602 7.365 666 HE2 PHE 112 HE2 PHE 112 6.276 0.561 8.109 667 HZ PHE 112 HZ PHE 112 4.458 2.015 8.913 668 H SER 113 H SER 113 7.357 0.135 2.024 669 HA SER 113 HA SER 113 6.594 -2.491 3.026 670 HB2 SER 113 1HB SER 113 8.739 -3.151 1.824 671 HB3 SER 113 2HB SER 113 7.475 -2.474 0.795 672 HG SER 113 HG SER 113 8.602 -0.670 0.547 673 H LEU 114 H LEU 114 8.231 -3.747 4.240 674 HA LEU 114 HA LEU 114 9.365 -1.977 6.291 675 HB2 LEU 114 1HB LEU 114 8.469 -4.849 6.406 676 HB3 LEU 114 2HB LEU 114 9.363 -4.079 7.700 677 HG LEU 114 HG LEU 114 7.026 -4.099 8.264 678 HD11 LEU 114 1HD1 LEU 114 8.322 -2.123 8.912 679 HD12 LEU 114 2HD1 LEU 114 6.619 -1.747 8.648 680 HD13 LEU 114 3HD1 LEU 114 7.819 -1.317 7.427 681 HD21 LEU 114 1HD2 LEU 114 5.386 -2.840 6.872 682 HD22 LEU 114 2HD2 LEU 114 5.992 -4.318 6.129 683 HD23 LEU 114 3HD2 LEU 114 6.609 -2.750 5.608 684 H GLY 115 H GLY 115 10.212 -4.080 3.787 685 HA2 GLY 115 1HA GLY 115 12.270 -4.569 2.916 686 HA3 GLY 115 2HA GLY 115 12.928 -3.357 4.003 687 HA PRO 116 HA PRO 116 14.793 -7.380 5.191 688 HB2 PRO 116 1HB PRO 116 17.080 -5.690 5.899 689 HB3 PRO 116 2HB PRO 116 16.998 -7.052 4.780 690 HG2 PRO 116 1HG PRO 116 17.301 -4.515 3.927 691 HG3 PRO 116 2HG PRO 116 16.396 -5.725 2.998 692 HD2 PRO 116 1HD PRO 116 15.370 -3.538 4.769 693 HD3 PRO 116 2HD PRO 116 14.767 -4.081 3.187 694 H ASP 117 H ASP 117 14.754 -4.299 6.950 695 HA ASP 117 HA ASP 117 15.447 -5.612 9.428 696 HB2 ASP 117 1HB ASP 117 15.106 -3.328 10.438 697 HB3 ASP 117 2HB ASP 117 16.355 -3.436 9.210 698 H GLY 118 H GLY 118 12.565 -4.948 7.753 699 HA2 GLY 118 1HA GLY 118 10.444 -5.686 8.256 700 HA3 GLY 118 2HA GLY 118 11.093 -6.379 9.730 701 H VAL 119 H VAL 119 11.985 -3.206 9.839 702 HA VAL 119 HA VAL 119 9.674 -2.666 11.570 703 HB VAL 119 HB VAL 119 11.159 -1.111 12.822 704 HG11 VAL 119 1HG1 VAL 119 12.066 -3.979 12.636 705 HG12 VAL 119 2HG1 VAL 119 10.763 -3.350 13.643 706 HG13 VAL 119 3HG1 VAL 119 12.431 -2.880 13.965 707 HG21 VAL 119 1HG2 VAL 119 13.576 -1.268 12.524 708 HG22 VAL 119 2HG2 VAL 119 12.793 -0.656 11.068 709 HG23 VAL 119 3HG2 VAL 119 13.341 -2.329 11.136 710 HA PRO 120 HA PRO 120 8.513 0.730 9.048 711 HB2 PRO 120 1HB PRO 120 6.774 1.905 10.725 712 HB3 PRO 120 2HB PRO 120 6.443 0.327 9.998 713 HG2 PRO 120 1HG PRO 120 7.491 0.961 12.732 714 HG3 PRO 120 2HG PRO 120 6.216 -0.180 12.262 715 HD2 PRO 120 1HD PRO 120 8.769 -0.953 12.779 716 HD3 PRO 120 2HD PRO 120 7.724 -1.793 11.615 717 H GLU 121 H GLU 121 8.723 2.964 8.823 718 HA GLU 121 HA GLU 121 9.702 4.994 9.007 719 HB2 GLU 121 1HB GLU 121 9.564 4.445 11.977 720 HB3 GLU 121 2HB GLU 121 9.861 6.013 11.239 721 HG2 GLU 121 1HG GLU 121 7.650 5.955 10.209 722 HG3 GLU 121 2HG GLU 121 7.352 4.375 10.932 723 H SER 122 H SER 122 11.248 2.518 8.888 724 HA SER 122 HA SER 122 13.744 3.153 10.236 725 HB2 SER 122 1HB SER 122 14.116 0.908 8.640 726 HB3 SER 122 2HB SER 122 13.700 0.903 10.353 727 HG SER 122 HG SER 122 12.184 0.181 8.206 728 H ASN 123 H ASN 123 15.774 2.743 8.822 729 HA ASN 123 HA ASN 123 15.875 4.554 6.658 730 HB2 ASN 123 1HB ASN 123 17.900 3.974 7.873 731 HB3 ASN 123 2HB ASN 123 17.728 2.281 7.429 732 HD21 ASN 123 1HD2 ASN 123 19.160 2.627 4.267 733 HD22 ASN 123 2HD2 ASN 123 18.274 1.613 5.359 734 H ASP 124 H ASP 124 15.516 1.090 6.886 735 HA ASP 124 HA ASP 124 15.219 0.884 3.999 736 HB2 ASP 124 1HB ASP 124 15.650 -1.238 6.108 737 HB3 ASP 124 2HB ASP 124 15.367 -1.583 4.404 738 H ASP 125 H ASP 125 13.270 2.066 4.378 739 HA ASP 125 HA ASP 125 11.101 0.117 4.213 740 HB2 ASP 125 1HB ASP 125 11.005 2.664 5.838 741 HB3 ASP 125 2HB ASP 125 9.549 1.858 5.262 742 H ILE 126 H ILE 126 10.465 0.244 2.165 743 HA ILE 126 HA ILE 126 10.863 2.707 0.669 744 HB ILE 126 HB ILE 126 9.876 -0.011 -0.203 745 HG12 ILE 126 1HG1 ILE 126 12.256 0.052 0.398 746 HG13 ILE 126 2HG1 ILE 126 12.040 -0.198 -1.331 747 HG21 ILE 126 1HG2 ILE 126 9.819 0.722 -2.432 748 HG22 ILE 126 2HG2 ILE 126 10.632 2.239 -2.037 749 HG23 ILE 126 3HG2 ILE 126 8.973 1.967 -1.506 750 HD11 ILE 126 1HD1 ILE 126 13.851 1.338 -0.912 751 HD12 ILE 126 2HD1 ILE 126 12.783 2.389 0.015 752 HD13 ILE 126 3HD1 ILE 126 12.524 2.174 -1.716 753 H GLY 127 H GLY 127 9.364 4.193 1.053 754 HA2 GLY 127 1HA GLY 127 6.567 3.399 1.346 755 HA3 GLY 127 2HA GLY 127 7.237 4.986 1.697 756 H ASN 128 H ASN 128 4.900 4.464 0.161 757 HA ASN 128 HA ASN 128 5.408 4.587 -2.618 758 HB2 ASN 128 1HB ASN 128 3.237 3.963 -1.572 759 HB3 ASN 128 2HB ASN 128 3.002 5.648 -1.125 760 HD21 ASN 128 1HD2 ASN 128 1.121 5.817 -4.060 761 HD22 ASN 128 2HD2 ASN 128 1.111 5.725 -2.327 762 H TRP 129 H TRP 129 5.316 7.005 -0.120 763 HA TRP 129 HA TRP 129 5.413 9.235 -1.931 764 HB2 TRP 129 1HB TRP 129 4.491 9.428 0.363 765 HB3 TRP 129 2HB TRP 129 6.089 9.094 1.019 766 HD1 TRP 129 HD1 TRP 129 4.257 11.803 -1.047 767 HE1 TRP 129 HE1 TRP 129 5.445 14.052 -0.647 768 HE3 TRP 129 HE3 TRP 129 8.172 10.159 1.802 769 HZ2 TRP 129 HZ2 TRP 129 7.731 15.001 0.704 770 HZ3 TRP 129 HZ3 TRP 129 9.815 11.804 2.609 771 HH2 TRP 129 HH2 TRP 129 9.596 14.174 2.070 772 H THR 130 H THR 130 7.644 7.012 -0.572 773 HA THR 130 HA THR 130 9.979 8.677 -0.792 774 HB THR 130 HB THR 130 9.966 5.682 -0.469 775 HG1 THR 130 HG1 THR 130 9.795 7.511 1.701 776 HG21 THR 130 1HG2 THR 130 11.793 7.853 0.571 777 HG22 THR 130 2HG2 THR 130 12.145 6.756 -0.764 778 HG23 THR 130 3HG2 THR 130 11.973 6.125 0.875 779 H ILE 131 H ILE 131 8.330 6.302 -2.764 780 HA ILE 131 HA ILE 131 10.560 5.882 -4.526 781 HB ILE 131 HB ILE 131 8.917 4.102 -4.191 782 HG12 ILE 131 1HG1 ILE 131 8.508 3.522 -6.574 783 HG13 ILE 131 2HG1 ILE 131 8.977 5.157 -7.028 784 HG21 ILE 131 1HG2 ILE 131 6.679 4.256 -5.180 785 HG22 ILE 131 2HG2 ILE 131 6.982 5.951 -5.565 786 HG23 ILE 131 3HG2 ILE 131 6.923 5.426 -3.882 787 HD11 ILE 131 1HD1 ILE 131 10.752 3.155 -5.653 788 HD12 ILE 131 2HD1 ILE 131 11.214 4.771 -6.183 789 HD13 ILE 131 3HD1 ILE 131 10.778 3.544 -7.373 790 H GLY 132 H GLY 132 7.984 8.177 -4.312 791 HA2 GLY 132 1HA GLY 132 8.714 10.239 -5.590 792 HA3 GLY 132 2HA GLY 132 8.726 9.179 -6.987 793 H PHE 133 H PHE 133 6.206 8.042 -5.317 794 HA PHE 133 HA PHE 133 4.335 9.580 -6.904 795 HB2 PHE 133 1HB PHE 133 3.987 7.135 -5.168 796 HB3 PHE 133 2HB PHE 133 2.650 7.938 -5.981 797 HD1 PHE 133 HD1 PHE 133 2.845 8.218 -8.534 798 HD2 PHE 133 HD2 PHE 133 5.182 5.481 -6.268 799 HE1 PHE 133 HE1 PHE 133 3.292 6.916 -10.573 800 HE2 PHE 133 HE2 PHE 133 5.636 4.174 -8.301 801 HZ PHE 133 HZ PHE 133 4.690 4.893 -10.460 802 H HIS 134 H HIS 134 2.219 10.192 -5.843 803 HA HIS 134 HA HIS 134 1.185 11.750 -4.573 804 HB2 HIS 134 1HB HIS 134 2.717 10.309 -2.414 805 HB3 HIS 134 2HB HIS 134 1.600 11.625 -2.062 806 HD1 HIS 134 HD1 HIS 134 -0.873 11.091 -2.071 807 HD2 HIS 134 HD2 HIS 134 1.479 7.980 -3.496 808 HE1 HIS 134 HE1 HIS 134 -2.422 9.128 -2.303 809 HE2 HIS 134 HE2 HIS 134 -1.025 7.361 -3.430 810 H HIS 135 H HIS 135 3.633 12.428 -5.875 811 HA HIS 135 HA HIS 135 4.869 14.407 -4.132 812 HB2 HIS 135 1HB HIS 135 6.132 12.933 -5.829 813 HB3 HIS 135 2HB HIS 135 5.438 13.971 -7.067 814 HD1 HIS 135 HD1 HIS 135 7.939 13.966 -4.275 815 HD2 HIS 135 HD2 HIS 135 6.591 16.500 -7.285 816 HE1 HIS 135 HE1 HIS 135 9.603 15.852 -4.371 817 HE2 HIS 135 HE2 HIS 135 8.750 17.395 -6.173 818 H HIS 136 H HIS 136 2.420 15.085 -4.160 819 HA HIS 136 HA HIS 136 0.854 16.649 -4.617 820 HB2 HIS 136 1HB HIS 136 2.859 18.162 -4.417 821 HB3 HIS 136 2HB HIS 136 3.011 18.094 -6.168 822 HD1 HIS 136 HD1 HIS 136 0.990 19.616 -3.437 823 HD2 HIS 136 HD2 HIS 136 1.056 19.543 -7.591 824 HE1 HIS 136 HE1 HIS 136 -0.560 21.456 -4.172 825 HE2 HIS 136 HE2 HIS 136 -0.644 21.265 -6.684 826 H HIS 137 H HIS 137 -0.013 14.838 -5.944 827 HA HIS 137 HA HIS 137 -0.125 15.632 -8.777 828 HB2 HIS 137 1HB HIS 137 -0.291 13.412 -9.473 829 HB3 HIS 137 2HB HIS 137 0.871 13.308 -8.161 830 HD1 HIS 137 HD1 HIS 137 -2.155 11.815 -9.397 831 HD2 HIS 137 HD2 HIS 137 -0.442 12.357 -5.650 832 HE1 HIS 137 HE1 HIS 137 -3.315 10.178 -7.883 833 HE2 HIS 137 HE2 HIS 137 -2.156 10.414 -5.665 834 H HIS 138 H HIS 138 -2.137 15.741 -9.766 835 HA HIS 138 HA HIS 138 -4.514 15.175 -8.216 836 HB2 HIS 138 1HB HIS 138 -5.382 17.507 -8.431 837 HB3 HIS 138 2HB HIS 138 -4.017 17.358 -7.334 838 HD1 HIS 138 HD1 HIS 138 -5.200 19.242 -10.233 839 HD2 HIS 138 HD2 HIS 138 -1.515 18.322 -8.520 840 HE1 HIS 138 HE1 HIS 138 -3.569 20.897 -11.190 841 HE2 HIS 138 HE2 HIS 138 -1.341 20.298 -10.179 842 H HIS 139 H HIS 139 -6.053 14.463 -9.507 843 HA HIS 139 HA HIS 139 -5.906 14.867 -12.375 844 HB2 HIS 139 1HB HIS 139 -7.785 13.337 -10.580 845 HB3 HIS 139 2HB HIS 139 -8.146 13.583 -12.285 846 HD1 HIS 139 HD1 HIS 139 -7.533 11.597 -13.602 847 HD2 HIS 139 HD2 HIS 139 -4.899 12.211 -10.448 848 HE1 HIS 139 HE1 HIS 139 -5.853 9.735 -13.750 849 HE2 HIS 139 HE2 HIS 139 -4.346 10.056 -11.761 850 H LYS 140 H LYS 140 -7.214 16.395 -9.691 851 HA LYS 140 HA LYS 140 -8.820 18.145 -11.429 852 HB2 LYS 140 1HB LYS 140 -10.192 16.923 -9.757 853 HB3 LYS 140 2HB LYS 140 -9.208 17.603 -8.472 854 HG2 LYS 140 1HG LYS 140 -9.946 19.857 -9.141 855 HG3 LYS 140 2HG LYS 140 -10.989 19.127 -10.362 856 HD2 LYS 140 1HD LYS 140 -12.219 17.944 -8.625 857 HD3 LYS 140 2HD LYS 140 -11.151 18.613 -7.392 858 HE2 LYS 140 1HE LYS 140 -11.898 20.870 -7.976 859 HE3 LYS 140 2HE LYS 140 -12.969 20.196 -9.202 860 HZ1 LYS 140 1HZ LYS 140 -14.176 20.689 -7.182 861 HZ2 LYS 140 2HZ LYS 140 -13.144 19.698 -6.279 862 HZ3 LYS 140 3HZ LYS 140 -14.161 19.021 -7.449 Start of MODEL 14 1 H1 MET 25 1H MET 25 26.796 -0.670 -4.022 2 H2 MET 25 2H MET 25 25.492 -1.411 -4.802 3 H3 MET 25 3H MET 25 26.750 -2.350 -4.180 4 HA MET 25 HA MET 25 26.198 -1.704 -1.945 5 HB2 MET 25 1HB MET 25 25.298 0.508 -2.421 6 HB3 MET 25 2HB MET 25 23.948 -0.199 -3.296 7 HG2 MET 25 1HG MET 25 23.136 -1.222 -1.240 8 HG3 MET 25 2HG MET 25 24.497 -0.536 -0.356 9 HE1 MET 25 1HE MET 25 21.387 1.526 0.912 10 HE2 MET 25 2HE MET 25 22.705 0.450 1.376 11 HE3 MET 25 3HE MET 25 21.362 -0.166 0.414 12 H GLY 26 H GLY 26 23.541 -2.165 -4.294 13 HA2 GLY 26 1HA GLY 26 23.309 -4.934 -3.466 14 HA3 GLY 26 2HA GLY 26 21.943 -3.912 -3.037 15 H ASN 27 H ASN 27 23.883 -5.084 -5.746 16 HA ASN 27 HA ASN 27 22.300 -4.066 -7.824 17 HB2 ASN 27 1HB ASN 27 24.047 -6.524 -7.694 18 HB3 ASN 27 2HB ASN 27 23.244 -6.004 -9.171 19 HD21 ASN 27 1HD2 ASN 27 25.443 -3.376 -9.831 20 HD22 ASN 27 2HD2 ASN 27 23.918 -4.105 -10.184 21 H LYS 28 H LYS 28 22.067 -7.084 -6.008 22 HA LYS 28 HA LYS 28 19.785 -8.001 -7.499 23 HB2 LYS 28 1HB LYS 28 20.962 -8.972 -4.890 24 HB3 LYS 28 2HB LYS 28 19.681 -9.784 -5.779 25 HG2 LYS 28 1HG LYS 28 22.491 -9.312 -6.753 26 HG3 LYS 28 2HG LYS 28 21.832 -10.840 -6.173 27 HD2 LYS 28 1HD LYS 28 20.905 -9.311 -8.606 28 HD3 LYS 28 2HD LYS 28 21.882 -10.778 -8.610 29 HE2 LYS 28 1HE LYS 28 19.061 -10.516 -7.579 30 HE3 LYS 28 2HE LYS 28 19.547 -11.282 -9.088 31 HZ1 LYS 28 1HZ LYS 28 20.779 -12.925 -7.810 32 HZ2 LYS 28 2HZ LYS 28 19.149 -12.914 -7.365 33 HZ3 LYS 28 3HZ LYS 28 20.302 -12.194 -6.365 34 H GLU 29 H GLU 29 20.367 -6.294 -4.504 35 HA GLU 29 HA GLU 29 17.826 -6.544 -3.346 36 HB2 GLU 29 1HB GLU 29 20.070 -5.558 -2.408 37 HB3 GLU 29 2HB GLU 29 19.445 -4.040 -3.036 38 HG2 GLU 29 1HG GLU 29 18.856 -4.178 -0.740 39 HG3 GLU 29 2HG GLU 29 17.384 -4.412 -1.688 40 H LYS 30 H LYS 30 19.142 -4.242 -5.676 41 HA LYS 30 HA LYS 30 17.017 -2.434 -5.746 42 HB2 LYS 30 1HB LYS 30 18.925 -3.265 -7.926 43 HB3 LYS 30 2HB LYS 30 17.781 -1.940 -8.090 44 HG2 LYS 30 1HG LYS 30 18.858 -0.904 -6.064 45 HG3 LYS 30 2HG LYS 30 20.108 -2.143 -6.199 46 HD2 LYS 30 1HD LYS 30 19.366 -0.172 -8.357 47 HD3 LYS 30 2HD LYS 30 20.755 -0.026 -7.282 48 HE2 LYS 30 1HE LYS 30 21.705 -2.061 -8.177 49 HE3 LYS 30 2HE LYS 30 20.278 -2.318 -9.179 50 HZ1 LYS 30 1HZ LYS 30 22.200 -0.071 -9.416 51 HZ2 LYS 30 2HZ LYS 30 20.796 -0.249 -10.344 52 HZ3 LYS 30 3HZ LYS 30 22.047 -1.374 -10.480 53 H ALA 31 H ALA 31 17.465 -5.484 -7.464 54 HA ALA 31 HA ALA 31 15.234 -5.231 -9.174 55 HB1 ALA 31 1HB ALA 31 17.038 -6.834 -9.580 56 HB2 ALA 31 2HB ALA 31 15.466 -7.632 -9.537 57 HB3 ALA 31 3HB ALA 31 16.551 -7.746 -8.151 58 H ASP 32 H ASP 32 15.640 -6.740 -5.993 59 HA ASP 32 HA ASP 32 12.984 -7.724 -5.851 60 HB2 ASP 32 1HB ASP 32 15.095 -7.311 -3.744 61 HB3 ASP 32 2HB ASP 32 13.503 -7.972 -3.376 62 H ARG 33 H ARG 33 14.506 -4.762 -4.611 63 HA ARG 33 HA ARG 33 12.192 -3.906 -3.237 64 HB2 ARG 33 1HB ARG 33 13.194 -1.639 -3.244 65 HB3 ARG 33 2HB ARG 33 14.254 -2.890 -2.619 66 HG2 ARG 33 1HG ARG 33 15.494 -2.911 -4.690 67 HG3 ARG 33 2HG ARG 33 14.396 -1.710 -5.382 68 HD2 ARG 33 1HD ARG 33 16.045 -1.272 -2.899 69 HD3 ARG 33 2HD ARG 33 16.550 -0.777 -4.512 70 HE ARG 33 HE ARG 33 14.493 0.636 -4.531 71 HH11 ARG 33 1HH1 ARG 33 15.913 -0.324 -1.466 72 HH12 ARG 33 2HH1 ARG 33 15.336 1.078 -0.626 73 HH21 ARG 33 1HH2 ARG 33 13.768 2.494 -3.418 74 HH22 ARG 33 2HH2 ARG 33 14.139 2.679 -1.730 75 H GLN 34 H GLN 34 13.219 -3.506 -6.590 76 HA GLN 34 HA GLN 34 11.174 -1.720 -7.346 77 HB2 GLN 34 1HB GLN 34 12.647 -3.816 -8.935 78 HB3 GLN 34 2HB GLN 34 11.495 -2.696 -9.650 79 HG2 GLN 34 1HG GLN 34 14.046 -1.966 -8.230 80 HG3 GLN 34 2HG GLN 34 13.756 -1.909 -9.967 81 HE21 GLN 34 1HE2 GLN 34 12.046 1.129 -9.922 82 HE22 GLN 34 2HE2 GLN 34 12.437 -0.300 -10.814 83 H LYS 35 H LYS 35 11.186 -5.210 -6.904 84 HA LYS 35 HA LYS 35 8.579 -5.730 -7.883 85 HB2 LYS 35 1HB LYS 35 9.991 -7.115 -5.592 86 HB3 LYS 35 2HB LYS 35 8.657 -7.757 -6.539 87 HG2 LYS 35 1HG LYS 35 10.042 -7.936 -8.485 88 HG3 LYS 35 2HG LYS 35 11.367 -7.102 -7.669 89 HD2 LYS 35 1HD LYS 35 11.398 -8.956 -5.995 90 HD3 LYS 35 2HD LYS 35 10.219 -9.803 -6.994 91 HE2 LYS 35 1HE LYS 35 11.765 -9.907 -8.829 92 HE3 LYS 35 2HE LYS 35 12.923 -8.896 -7.965 93 HZ1 LYS 35 1HZ LYS 35 12.040 -11.601 -7.113 94 HZ2 LYS 35 2HZ LYS 35 13.192 -10.636 -6.325 95 HZ3 LYS 35 3HZ LYS 35 13.507 -11.248 -7.875 96 H VAL 36 H VAL 36 9.874 -4.724 -4.795 97 HA VAL 36 HA VAL 36 7.530 -4.637 -3.275 98 HB VAL 36 HB VAL 36 10.100 -3.069 -3.142 99 HG11 VAL 36 1HG1 VAL 36 9.332 -2.396 -0.839 100 HG12 VAL 36 2HG1 VAL 36 7.707 -2.867 -1.339 101 HG13 VAL 36 3HG1 VAL 36 8.552 -1.570 -2.187 102 HG21 VAL 36 1HG2 VAL 36 10.229 -5.434 -2.584 103 HG22 VAL 36 2HG2 VAL 36 8.945 -5.232 -1.391 104 HG23 VAL 36 3HG2 VAL 36 10.500 -4.433 -1.158 105 H VAL 37 H VAL 37 9.091 -2.133 -5.261 106 HA VAL 37 HA VAL 37 7.244 -0.078 -4.837 107 HB VAL 37 HB VAL 37 8.833 -0.644 -7.351 108 HG11 VAL 37 1HG1 VAL 37 7.019 0.925 -7.773 109 HG12 VAL 37 2HG1 VAL 37 8.577 1.749 -7.814 110 HG13 VAL 37 3HG1 VAL 37 7.533 1.908 -6.402 111 HG21 VAL 37 1HG2 VAL 37 10.255 -0.445 -5.380 112 HG22 VAL 37 2HG2 VAL 37 9.485 1.088 -4.966 113 HG23 VAL 37 3HG2 VAL 37 10.451 0.954 -6.436 114 H SER 38 H SER 38 7.225 -2.754 -7.126 115 HA SER 38 HA SER 38 4.979 -1.961 -8.621 116 HB2 SER 38 1HB SER 38 5.999 -4.757 -8.059 117 HB3 SER 38 2HB SER 38 4.907 -4.297 -9.368 118 HG SER 38 HG SER 38 7.644 -3.663 -9.024 119 H ASP 39 H ASP 39 5.258 -4.033 -5.736 120 HA ASP 39 HA ASP 39 2.457 -4.492 -5.528 121 HB2 ASP 39 1HB ASP 39 4.625 -4.656 -3.428 122 HB3 ASP 39 2HB ASP 39 2.971 -5.219 -3.209 123 H LEU 40 H LEU 40 4.649 -2.075 -4.307 124 HA LEU 40 HA LEU 40 2.994 -0.814 -2.445 125 HB2 LEU 40 1HB LEU 40 5.434 -0.473 -2.713 126 HB3 LEU 40 2HB LEU 40 5.123 0.428 -4.182 127 HG LEU 40 HG LEU 40 3.846 2.089 -2.824 128 HD11 LEU 40 1HD1 LEU 40 4.202 2.071 -0.385 129 HD12 LEU 40 2HD1 LEU 40 4.941 0.474 -0.524 130 HD13 LEU 40 3HD1 LEU 40 3.243 0.700 -0.941 131 HD21 LEU 40 1HD2 LEU 40 6.156 2.485 -3.463 132 HD22 LEU 40 2HD2 LEU 40 6.714 1.606 -2.041 133 HD23 LEU 40 3HD2 LEU 40 5.841 3.126 -1.850 134 H VAL 41 H VAL 41 3.463 -0.128 -5.919 135 HA VAL 41 HA VAL 41 1.593 1.986 -5.994 136 HB VAL 41 HB VAL 41 1.542 1.776 -8.404 137 HG11 VAL 41 1HG1 VAL 41 3.457 2.875 -7.391 138 HG12 VAL 41 2HG1 VAL 41 3.915 2.051 -8.881 139 HG13 VAL 41 3HG1 VAL 41 4.315 1.336 -7.320 140 HG21 VAL 41 1HG2 VAL 41 2.772 0.011 -9.579 141 HG22 VAL 41 2HG2 VAL 41 1.419 -0.631 -8.647 142 HG23 VAL 41 3HG2 VAL 41 3.067 -0.795 -8.040 143 H ALA 42 H ALA 42 1.250 -1.505 -6.363 144 HA ALA 42 HA ALA 42 -1.483 -1.527 -7.062 145 HB1 ALA 42 1HB ALA 42 -1.487 -3.845 -6.288 146 HB2 ALA 42 2HB ALA 42 0.076 -3.592 -5.511 147 HB3 ALA 42 3HB ALA 42 -0.059 -3.504 -7.267 148 H LEU 43 H LEU 43 0.171 -1.401 -3.936 149 HA LEU 43 HA LEU 43 -2.063 -1.619 -2.255 150 HB2 LEU 43 1HB LEU 43 0.499 -0.057 -1.916 151 HB3 LEU 43 2HB LEU 43 -0.685 -0.257 -0.640 152 HG LEU 43 HG LEU 43 0.868 -2.493 -1.944 153 HD11 LEU 43 1HD1 LEU 43 2.308 -1.130 -0.581 154 HD12 LEU 43 2HD1 LEU 43 1.954 -2.628 0.279 155 HD13 LEU 43 3HD1 LEU 43 1.131 -1.137 0.732 156 HD21 LEU 43 1HD2 LEU 43 -0.065 -3.855 -0.119 157 HD22 LEU 43 2HD2 LEU 43 -1.313 -3.243 -1.200 158 HD23 LEU 43 3HD2 LEU 43 -1.065 -2.487 0.373 159 H GLU 44 H GLU 44 -0.506 1.229 -3.653 160 HA GLU 44 HA GLU 44 -2.312 3.147 -2.643 161 HB2 GLU 44 1HB GLU 44 0.025 3.436 -3.710 162 HB3 GLU 44 2HB GLU 44 -0.811 3.386 -5.250 163 HG2 GLU 44 1HG GLU 44 -1.582 5.346 -3.121 164 HG3 GLU 44 2HG GLU 44 -0.246 5.662 -4.224 165 H GLY 45 H GLY 45 -2.282 1.188 -5.579 166 HA2 GLY 45 1HA GLY 45 -4.554 2.277 -6.831 167 HA3 GLY 45 2HA GLY 45 -3.969 0.629 -7.029 168 H ALA 46 H ALA 46 -4.244 -0.347 -4.462 169 HA ALA 46 HA ALA 46 -6.960 -1.014 -4.261 170 HB1 ALA 46 1HB ALA 46 -6.361 -2.293 -2.434 171 HB2 ALA 46 2HB ALA 46 -5.205 -1.094 -1.847 172 HB3 ALA 46 3HB ALA 46 -4.801 -2.099 -3.231 173 H LEU 47 H LEU 47 -5.003 1.334 -2.487 174 HA LEU 47 HA LEU 47 -6.950 2.343 -0.769 175 HB2 LEU 47 1HB LEU 47 -4.698 3.865 -2.078 176 HB3 LEU 47 2HB LEU 47 -5.504 4.293 -0.576 177 HG LEU 47 HG LEU 47 -3.675 1.948 -1.069 178 HD11 LEU 47 1HD1 LEU 47 -3.394 4.340 0.734 179 HD12 LEU 47 2HD1 LEU 47 -2.568 4.113 -0.807 180 HD13 LEU 47 3HD1 LEU 47 -2.232 3.029 0.543 181 HD21 LEU 47 1HD2 LEU 47 -5.183 2.675 1.430 182 HD22 LEU 47 2HD2 LEU 47 -3.959 1.413 1.289 183 HD23 LEU 47 3HD2 LEU 47 -5.477 1.273 0.402 184 H ASP 48 H ASP 48 -5.966 3.437 -3.984 185 HA ASP 48 HA ASP 48 -7.754 5.587 -4.201 186 HB2 ASP 48 1HB ASP 48 -5.862 5.383 -5.704 187 HB3 ASP 48 2HB ASP 48 -6.489 3.867 -6.345 188 H MET 49 H MET 49 -8.078 2.178 -5.077 189 HA MET 49 HA MET 49 -10.565 2.522 -6.393 190 HB2 MET 49 1HB MET 49 -9.122 0.080 -5.387 191 HB3 MET 49 2HB MET 49 -10.720 -0.013 -6.118 192 HG2 MET 49 1HG MET 49 -9.824 1.058 -8.146 193 HG3 MET 49 2HG MET 49 -8.222 1.045 -7.411 194 HE1 MET 49 1HE MET 49 -11.244 -1.154 -8.523 195 HE2 MET 49 2HE MET 49 -10.879 -1.860 -6.949 196 HE3 MET 49 3HE MET 49 -10.586 -2.785 -8.422 197 H TYR 50 H TYR 50 -9.697 1.601 -3.094 198 HA TYR 50 HA TYR 50 -12.331 0.966 -2.288 199 HB2 TYR 50 1HB TYR 50 -10.373 0.291 -0.966 200 HB3 TYR 50 2HB TYR 50 -10.026 1.980 -0.607 201 HD1 TYR 50 HD1 TYR 50 -11.269 3.174 1.057 202 HD2 TYR 50 HD2 TYR 50 -12.338 -0.818 0.051 203 HE1 TYR 50 HE1 TYR 50 -12.719 3.075 3.031 204 HE2 TYR 50 HE2 TYR 50 -13.800 -0.925 2.030 205 HH TYR 50 HH TYR 50 -14.034 0.183 4.215 206 H LYS 51 H LYS 51 -10.462 3.979 -2.196 207 HA LYS 51 HA LYS 51 -12.522 5.518 -0.980 208 HB2 LYS 51 1HB LYS 51 -10.171 6.249 -0.969 209 HB3 LYS 51 2HB LYS 51 -10.224 6.445 -2.716 210 HG2 LYS 51 1HG LYS 51 -11.943 8.170 -2.467 211 HG3 LYS 51 2HG LYS 51 -11.869 7.983 -0.716 212 HD2 LYS 51 1HD LYS 51 -9.514 8.667 -0.753 213 HD3 LYS 51 2HD LYS 51 -9.609 8.872 -2.504 214 HE2 LYS 51 1HE LYS 51 -11.276 10.370 -0.486 215 HE3 LYS 51 2HE LYS 51 -9.832 11.002 -1.272 216 HZ1 LYS 51 1HZ LYS 51 -12.341 10.191 -2.634 217 HZ2 LYS 51 2HZ LYS 51 -10.952 10.756 -3.412 218 HZ3 LYS 51 3HZ LYS 51 -11.819 11.777 -2.377 219 H LEU 52 H LEU 52 -11.730 4.674 -4.275 220 HA LEU 52 HA LEU 52 -13.303 6.542 -5.629 221 HB2 LEU 52 1HB LEU 52 -11.648 5.066 -6.702 222 HB3 LEU 52 2HB LEU 52 -12.681 3.686 -6.388 223 HG LEU 52 HG LEU 52 -14.409 4.711 -7.869 224 HD11 LEU 52 1HD1 LEU 52 -12.195 6.657 -8.500 225 HD12 LEU 52 2HD1 LEU 52 -13.716 7.036 -7.694 226 HD13 LEU 52 3HD1 LEU 52 -13.717 6.510 -9.376 227 HD21 LEU 52 1HD2 LEU 52 -11.703 4.213 -9.097 228 HD22 LEU 52 2HD2 LEU 52 -13.242 4.179 -9.955 229 HD23 LEU 52 3HD2 LEU 52 -12.907 2.990 -8.696 230 H ASP 53 H ASP 53 -14.116 3.255 -4.523 231 HA ASP 53 HA ASP 53 -16.840 3.529 -5.396 232 HB2 ASP 53 1HB ASP 53 -15.595 1.350 -5.369 233 HB3 ASP 53 2HB ASP 53 -15.713 1.373 -3.611 234 H ASN 54 H ASN 54 -15.206 3.540 -2.226 235 HA ASN 54 HA ASN 54 -17.830 3.890 -0.956 236 HB2 ASN 54 1HB ASN 54 -15.205 2.853 0.042 237 HB3 ASN 54 2HB ASN 54 -16.417 3.435 1.179 238 HD21 ASN 54 1HD2 ASN 54 -16.735 -0.253 0.453 239 HD22 ASN 54 2HD2 ASN 54 -15.367 0.743 0.794 240 H SER 55 H SER 55 -15.679 5.934 -2.121 241 HA SER 55 HA SER 55 -15.570 8.191 -1.949 242 HB2 SER 55 1HB SER 55 -17.461 7.922 0.391 243 HB3 SER 55 2HB SER 55 -17.098 9.401 -0.497 244 HG SER 55 HG SER 55 -17.832 7.532 -2.244 245 H ARG 56 H ARG 56 -14.397 6.162 0.451 246 HA ARG 56 HA ARG 56 -12.873 8.372 1.615 247 HB2 ARG 56 1HB ARG 56 -13.249 7.614 3.881 248 HB3 ARG 56 2HB ARG 56 -14.793 7.934 3.107 249 HG2 ARG 56 1HG ARG 56 -15.408 5.948 3.902 250 HG3 ARG 56 2HG ARG 56 -14.421 5.262 2.611 251 HD2 ARG 56 1HD ARG 56 -12.494 5.201 4.130 252 HD3 ARG 56 2HD ARG 56 -13.497 5.862 5.420 253 HE ARG 56 HE ARG 56 -14.073 3.259 4.159 254 HH11 ARG 56 1HH1 ARG 56 -13.666 5.257 7.008 255 HH12 ARG 56 2HH1 ARG 56 -14.032 3.969 8.110 256 HH21 ARG 56 1HH2 ARG 56 -14.548 1.569 5.610 257 HH22 ARG 56 2HH2 ARG 56 -14.557 1.883 7.321 258 H TYR 57 H TYR 57 -10.846 7.847 2.413 259 HA TYR 57 HA TYR 57 -9.547 5.614 1.235 260 HB2 TYR 57 1HB TYR 57 -8.743 7.814 3.083 261 HB3 TYR 57 2HB TYR 57 -7.697 6.406 2.964 262 HD1 TYR 57 HD1 TYR 57 -7.486 5.667 0.289 263 HD2 TYR 57 HD2 TYR 57 -7.999 9.600 1.828 264 HE1 TYR 57 HE1 TYR 57 -6.426 6.585 -1.726 265 HE2 TYR 57 HE2 TYR 57 -6.941 10.529 -0.188 266 HH TYR 57 HH TYR 57 -6.346 8.647 -2.986 267 HA PRO 58 HA PRO 58 -10.296 2.534 4.273 268 HB2 PRO 58 1HB PRO 58 -8.307 0.820 3.694 269 HB3 PRO 58 2HB PRO 58 -9.660 1.083 2.586 270 HG2 PRO 58 1HG PRO 58 -6.907 2.270 2.529 271 HG3 PRO 58 2HG PRO 58 -7.837 1.562 1.196 272 HD2 PRO 58 1HD PRO 58 -7.685 4.229 1.603 273 HD3 PRO 58 2HD PRO 58 -9.133 3.453 0.932 274 H THR 59 H THR 59 -9.540 1.683 6.213 275 HA THR 59 HA THR 59 -7.474 3.175 7.555 276 HB THR 59 HB THR 59 -8.086 1.625 9.480 277 HG1 THR 59 HG1 THR 59 -9.618 0.145 9.171 278 HG21 THR 59 1HG2 THR 59 -10.300 3.246 8.213 279 HG22 THR 59 2HG2 THR 59 -9.036 3.871 9.272 280 HG23 THR 59 3HG2 THR 59 -10.233 2.740 9.902 281 H THR 60 H THR 60 -6.051 1.634 9.095 282 HA THR 60 HA THR 60 -4.045 0.670 7.474 283 HB THR 60 HB THR 60 -3.678 1.300 9.811 284 HG1 THR 60 HG1 THR 60 -2.058 0.051 8.979 285 HG21 THR 60 1HG2 THR 60 -4.195 -0.249 11.635 286 HG22 THR 60 2HG2 THR 60 -5.026 -1.312 10.500 287 HG23 THR 60 3HG2 THR 60 -5.663 0.299 10.826 288 H GLU 61 H GLU 61 -6.666 -1.184 8.993 289 HA GLU 61 HA GLU 61 -5.659 -3.714 8.111 290 HB2 GLU 61 1HB GLU 61 -7.139 -3.403 10.102 291 HB3 GLU 61 2HB GLU 61 -8.456 -2.998 9.012 292 HG2 GLU 61 1HG GLU 61 -8.798 -5.236 9.558 293 HG3 GLU 61 2HG GLU 61 -8.071 -5.274 7.953 294 H GLN 62 H GLN 62 -8.150 -1.466 7.000 295 HA GLN 62 HA GLN 62 -9.285 -3.241 5.106 296 HB2 GLN 62 1HB GLN 62 -9.498 -0.247 5.404 297 HB3 GLN 62 2HB GLN 62 -10.438 -1.186 4.252 298 HG2 GLN 62 1HG GLN 62 -11.418 -2.453 6.110 299 HG3 GLN 62 2HG GLN 62 -10.501 -1.470 7.247 300 HE21 GLN 62 1HE2 GLN 62 -12.640 1.266 7.115 301 HE22 GLN 62 2HE2 GLN 62 -11.111 0.632 7.631 302 H GLY 63 H GLY 63 -6.699 -0.888 4.914 303 HA2 GLY 63 1HA GLY 63 -6.668 -0.524 2.122 304 HA3 GLY 63 2HA GLY 63 -5.300 -0.291 3.193 305 H LEU 64 H LEU 64 -4.798 -2.787 4.125 306 HA LEU 64 HA LEU 64 -3.463 -3.977 1.924 307 HB2 LEU 64 1HB LEU 64 -3.570 -4.316 4.788 308 HB3 LEU 64 2HB LEU 64 -3.443 -5.854 3.948 309 HG LEU 64 HG LEU 64 -1.259 -5.008 4.544 310 HD11 LEU 64 1HD1 LEU 64 -1.457 -6.306 2.498 311 HD12 LEU 64 2HD1 LEU 64 -0.173 -5.104 2.381 312 HD13 LEU 64 3HD1 LEU 64 -1.719 -4.822 1.584 313 HD21 LEU 64 1HD2 LEU 64 -0.365 -2.954 3.604 314 HD22 LEU 64 2HD2 LEU 64 -1.786 -2.635 4.606 315 HD23 LEU 64 3HD2 LEU 64 -1.925 -2.621 2.849 316 H GLN 65 H GLN 65 -6.479 -4.623 3.556 317 HA GLN 65 HA GLN 65 -6.859 -7.245 2.509 318 HB2 GLN 65 1HB GLN 65 -8.752 -5.271 3.774 319 HB3 GLN 65 2HB GLN 65 -9.248 -6.876 3.256 320 HG2 GLN 65 1HG GLN 65 -7.065 -6.330 5.249 321 HG3 GLN 65 2HG GLN 65 -8.734 -6.705 5.671 322 HE21 GLN 65 1HE2 GLN 65 -8.455 -10.129 5.091 323 HE22 GLN 65 2HE2 GLN 65 -9.507 -8.785 5.360 324 H ALA 66 H ALA 66 -7.526 -4.053 1.304 325 HA ALA 66 HA ALA 66 -9.710 -4.599 -0.361 326 HB1 ALA 66 1HB ALA 66 -7.572 -2.504 -0.702 327 HB2 ALA 66 2HB ALA 66 -9.045 -2.344 0.254 328 HB3 ALA 66 3HB ALA 66 -9.146 -2.513 -1.498 329 H LEU 67 H LEU 67 -6.396 -5.416 -0.770 330 HA LEU 67 HA LEU 67 -6.620 -5.719 -3.653 331 HB2 LEU 67 1HB LEU 67 -4.435 -5.807 -1.666 332 HB3 LEU 67 2HB LEU 67 -4.238 -6.804 -3.099 333 HG LEU 67 HG LEU 67 -4.861 -3.880 -3.288 334 HD11 LEU 67 1HD1 LEU 67 -2.835 -4.167 -1.930 335 HD12 LEU 67 2HD1 LEU 67 -2.478 -3.465 -3.508 336 HD13 LEU 67 3HD1 LEU 67 -2.138 -5.169 -3.202 337 HD21 LEU 67 1HD2 LEU 67 -3.635 -4.237 -5.464 338 HD22 LEU 67 2HD2 LEU 67 -5.207 -5.024 -5.322 339 HD23 LEU 67 3HD2 LEU 67 -3.727 -5.971 -5.124 340 H VAL 68 H VAL 68 -7.421 -7.596 -0.992 341 HA VAL 68 HA VAL 68 -7.006 -10.064 -2.532 342 HB VAL 68 HB VAL 68 -5.300 -10.129 -0.895 343 HG11 VAL 68 1HG1 VAL 68 -5.672 -9.859 1.500 344 HG12 VAL 68 2HG1 VAL 68 -7.370 -9.491 1.197 345 HG13 VAL 68 3HG1 VAL 68 -6.113 -8.401 0.611 346 HG21 VAL 68 1HG2 VAL 68 -5.934 -12.057 0.499 347 HG22 VAL 68 2HG2 VAL 68 -6.445 -12.239 -1.179 348 HG23 VAL 68 3HG2 VAL 68 -7.622 -11.795 0.058 349 H SER 69 H SER 69 -8.797 -8.711 0.246 350 HA SER 69 HA SER 69 -11.125 -10.269 -0.557 351 HB2 SER 69 1HB SER 69 -11.380 -11.087 1.821 352 HB3 SER 69 2HB SER 69 -10.033 -11.803 0.934 353 HG SER 69 HG SER 69 -9.843 -9.617 2.745 354 H ALA 70 H ALA 70 -13.039 -9.332 0.004 355 HA ALA 70 HA ALA 70 -13.098 -6.573 0.360 356 HB1 ALA 70 1HB ALA 70 -14.927 -7.863 -0.638 357 HB2 ALA 70 2HB ALA 70 -15.497 -6.813 0.658 358 HB3 ALA 70 3HB ALA 70 -15.305 -8.541 0.946 359 HA PRO 71 HA PRO 71 -12.274 -6.174 4.754 360 HB2 PRO 71 1HB PRO 71 -13.484 -3.514 4.180 361 HB3 PRO 71 2HB PRO 71 -11.965 -3.910 4.993 362 HG2 PRO 71 1HG PRO 71 -11.962 -2.961 2.510 363 HG3 PRO 71 2HG PRO 71 -10.827 -4.233 2.998 364 HD2 PRO 71 1HD PRO 71 -13.335 -4.442 1.388 365 HD3 PRO 71 2HD PRO 71 -11.796 -5.309 1.201 366 H SER 72 H SER 72 -13.541 -6.531 6.478 367 HA SER 72 HA SER 72 -16.391 -6.757 6.058 368 HB2 SER 72 1HB SER 72 -16.248 -7.633 8.487 369 HB3 SER 72 2HB SER 72 -15.499 -8.596 7.213 370 HG SER 72 HG SER 72 -14.272 -8.034 9.274 371 H ALA 73 H ALA 73 -14.201 -4.496 7.316 372 HA ALA 73 HA ALA 73 -15.910 -3.187 9.175 373 HB1 ALA 73 1HB ALA 73 -13.552 -2.089 7.645 374 HB2 ALA 73 2HB ALA 73 -13.475 -2.903 9.208 375 HB3 ALA 73 3HB ALA 73 -14.308 -1.355 9.061 376 H GLU 74 H GLU 74 -17.365 -1.607 8.878 377 HA GLU 74 HA GLU 74 -18.425 -1.244 6.241 378 HB2 GLU 74 1HB GLU 74 -20.085 0.227 7.481 379 HB3 GLU 74 2HB GLU 74 -20.034 -1.465 7.953 380 HG2 GLU 74 1HG GLU 74 -18.551 -0.804 9.854 381 HG3 GLU 74 2HG GLU 74 -18.846 0.878 9.418 382 HA PRO 75 HA PRO 75 -19.619 0.150 5.002 383 HB2 PRO 75 1HB PRO 75 -18.958 1.052 2.538 384 HB3 PRO 75 2HB PRO 75 -19.831 2.036 3.717 385 HG2 PRO 75 1HG PRO 75 -16.919 2.051 3.027 386 HG3 PRO 75 2HG PRO 75 -18.012 3.421 3.300 387 HD2 PRO 75 1HD PRO 75 -16.288 2.519 5.189 388 HD3 PRO 75 2HD PRO 75 -17.854 3.252 5.588 389 H HIS 76 H HIS 76 -19.633 -1.855 4.287 390 HA HIS 76 HA HIS 76 -17.274 -3.350 3.799 391 HB2 HIS 76 1HB HIS 76 -19.592 -4.171 4.614 392 HB3 HIS 76 2HB HIS 76 -20.040 -4.173 2.910 393 HD1 HIS 76 HD1 HIS 76 -18.584 -6.262 5.465 394 HD2 HIS 76 HD2 HIS 76 -18.298 -5.972 1.331 395 HE1 HIS 76 HE1 HIS 76 -17.625 -8.454 4.701 396 HE2 HIS 76 HE2 HIS 76 -17.670 -8.331 2.188 397 H ALA 77 H ALA 77 -16.164 -3.641 1.951 398 HA ALA 77 HA ALA 77 -16.795 -2.225 -0.411 399 HB1 ALA 77 1HB ALA 77 -14.891 -4.543 -0.084 400 HB2 ALA 77 2HB ALA 77 -14.499 -2.851 0.226 401 HB3 ALA 77 3HB ALA 77 -14.907 -3.378 -1.406 402 H ARG 78 H ARG 78 -18.188 -2.720 -1.981 403 HA ARG 78 HA ARG 78 -19.245 -5.438 -2.110 404 HB2 ARG 78 1HB ARG 78 -20.807 -3.616 -1.481 405 HB3 ARG 78 2HB ARG 78 -20.441 -2.803 -2.997 406 HG2 ARG 78 1HG ARG 78 -22.478 -3.901 -3.330 407 HG3 ARG 78 2HG ARG 78 -21.238 -4.858 -4.144 408 HD2 ARG 78 1HD ARG 78 -21.143 -6.354 -2.177 409 HD3 ARG 78 2HD ARG 78 -22.447 -5.425 -1.444 410 HE ARG 78 HE ARG 78 -23.495 -6.161 -3.822 411 HH11 ARG 78 1HH1 ARG 78 -21.990 -7.927 -1.208 412 HH12 ARG 78 2HH1 ARG 78 -22.871 -9.388 -1.512 413 HH21 ARG 78 1HH2 ARG 78 -24.676 -8.074 -4.219 414 HH22 ARG 78 2HH2 ARG 78 -24.398 -9.474 -3.234 415 H ASN 79 H ASN 79 -19.868 -6.164 -4.314 416 HA ASN 79 HA ASN 79 -19.240 -6.815 -6.378 417 HB2 ASN 79 1HB ASN 79 -19.283 -5.098 -8.131 418 HB3 ASN 79 2HB ASN 79 -20.624 -4.929 -7.013 419 HD21 ASN 79 1HD2 ASN 79 -19.773 -1.715 -5.995 420 HD22 ASN 79 2HD2 ASN 79 -20.782 -3.100 -5.767 421 H TYR 80 H TYR 80 -17.169 -6.847 -4.657 422 HA TYR 80 HA TYR 80 -14.809 -5.721 -5.899 423 HB2 TYR 80 1HB TYR 80 -13.624 -6.766 -4.018 424 HB3 TYR 80 2HB TYR 80 -15.015 -5.860 -3.430 425 HD1 TYR 80 HD1 TYR 80 -13.429 -9.095 -3.633 426 HD2 TYR 80 HD2 TYR 80 -17.095 -7.117 -2.754 427 HE1 TYR 80 HE1 TYR 80 -14.242 -11.114 -2.495 428 HE2 TYR 80 HE2 TYR 80 -17.915 -9.133 -1.614 429 HH TYR 80 HH TYR 80 -15.918 -11.678 -0.718 430 HA PRO 81 HA PRO 81 -13.888 -9.294 -8.384 431 HB2 PRO 81 1HB PRO 81 -11.159 -9.088 -8.434 432 HB3 PRO 81 2HB PRO 81 -12.232 -8.082 -9.411 433 HG2 PRO 81 1HG PRO 81 -10.862 -7.441 -6.838 434 HG3 PRO 81 2HG PRO 81 -11.084 -6.425 -8.272 435 HD2 PRO 81 1HD PRO 81 -12.615 -6.173 -6.056 436 HD3 PRO 81 2HD PRO 81 -13.238 -5.856 -7.688 437 H GLU 82 H GLU 82 -13.535 -11.425 -7.963 438 HA GLU 82 HA GLU 82 -13.092 -12.269 -5.300 439 HB2 GLU 82 1HB GLU 82 -13.054 -13.844 -7.877 440 HB3 GLU 82 2HB GLU 82 -13.005 -14.563 -6.274 441 HG2 GLU 82 1HG GLU 82 -15.185 -13.452 -5.794 442 HG3 GLU 82 2HG GLU 82 -15.238 -12.959 -7.486 443 H GLY 83 H GLY 83 -11.272 -12.603 -4.223 444 HA2 GLY 83 1HA GLY 83 -9.041 -13.046 -3.812 445 HA3 GLY 83 2HA GLY 83 -8.843 -13.439 -5.516 446 H GLY 84 H GLY 84 -10.385 -10.495 -5.110 447 HA2 GLY 84 1HA GLY 84 -9.769 -8.332 -5.499 448 HA3 GLY 84 2HA GLY 84 -8.364 -8.691 -4.509 449 H TYR 85 H TYR 85 -6.570 -8.185 -5.458 450 HA TYR 85 HA TYR 85 -6.276 -8.628 -8.357 451 HB2 TYR 85 1HB TYR 85 -5.094 -6.580 -6.498 452 HB3 TYR 85 2HB TYR 85 -4.309 -6.972 -8.028 453 HD1 TYR 85 HD1 TYR 85 -7.062 -5.192 -6.440 454 HD2 TYR 85 HD2 TYR 85 -5.485 -6.535 -10.161 455 HE1 TYR 85 HE1 TYR 85 -8.542 -3.639 -7.630 456 HE2 TYR 85 HE2 TYR 85 -6.961 -4.978 -11.354 457 HH TYR 85 HH TYR 85 -8.697 -2.504 -9.754 458 H ILE 86 H ILE 86 -5.311 -9.461 -5.236 459 HA ILE 86 HA ILE 86 -3.352 -11.338 -6.280 460 HB ILE 86 HB ILE 86 -1.893 -9.579 -5.645 461 HG12 ILE 86 1HG1 ILE 86 -2.004 -11.527 -3.336 462 HG13 ILE 86 2HG1 ILE 86 -1.204 -11.806 -4.876 463 HG21 ILE 86 1HG2 ILE 86 -3.319 -8.138 -4.409 464 HG22 ILE 86 2HG2 ILE 86 -1.952 -8.548 -3.367 465 HG23 ILE 86 3HG2 ILE 86 -3.511 -9.335 -3.123 466 HD11 ILE 86 1HD1 ILE 86 -0.472 -9.680 -2.878 467 HD12 ILE 86 2HD1 ILE 86 0.341 -9.984 -4.414 468 HD13 ILE 86 3HD1 ILE 86 0.383 -11.201 -3.139 469 H ARG 87 H ARG 87 -3.525 -13.296 -5.288 470 HA ARG 87 HA ARG 87 -6.009 -13.798 -4.092 471 HB2 ARG 87 1HB ARG 87 -4.792 -15.408 -5.508 472 HB3 ARG 87 2HB ARG 87 -3.617 -15.636 -4.220 473 HG2 ARG 87 1HG ARG 87 -5.313 -16.571 -2.782 474 HG3 ARG 87 2HG ARG 87 -6.558 -16.240 -3.988 475 HD2 ARG 87 1HD ARG 87 -4.193 -18.059 -4.407 476 HD3 ARG 87 2HD ARG 87 -5.811 -18.602 -3.966 477 HE ARG 87 HE ARG 87 -6.056 -17.049 -6.261 478 HH11 ARG 87 1HH1 ARG 87 -4.527 -20.048 -5.309 479 HH12 ARG 87 2HH1 ARG 87 -4.693 -20.777 -6.874 480 HH21 ARG 87 1HH2 ARG 87 -6.273 -17.998 -8.322 481 HH22 ARG 87 2HH2 ARG 87 -5.684 -19.608 -8.592 482 H ARG 88 H ARG 88 -2.942 -13.139 -2.643 483 HA ARG 88 HA ARG 88 -4.258 -13.332 -0.028 484 HB2 ARG 88 1HB ARG 88 -1.412 -14.117 -0.673 485 HB3 ARG 88 2HB ARG 88 -2.004 -13.863 0.961 486 HG2 ARG 88 1HG ARG 88 -3.725 -15.650 0.475 487 HG3 ARG 88 2HG ARG 88 -2.802 -16.003 -0.989 488 HD2 ARG 88 1HD ARG 88 -2.133 -17.488 0.815 489 HD3 ARG 88 2HD ARG 88 -0.808 -16.408 0.381 490 HE ARG 88 HE ARG 88 -2.515 -15.613 2.610 491 HH11 ARG 88 1HH1 ARG 88 0.529 -16.989 1.546 492 HH12 ARG 88 2HH1 ARG 88 1.328 -16.704 3.060 493 HH21 ARG 88 1HH2 ARG 88 -1.464 -15.235 4.600 494 HH22 ARG 88 2HH2 ARG 88 0.192 -15.718 4.796 495 H LEU 89 H LEU 89 -3.120 -11.885 1.598 496 HA LEU 89 HA LEU 89 -2.899 -9.296 0.543 497 HB2 LEU 89 1HB LEU 89 -2.611 -8.534 2.696 498 HB3 LEU 89 2HB LEU 89 -3.523 -10.005 2.917 499 HG LEU 89 HG LEU 89 -1.950 -9.915 4.653 500 HD11 LEU 89 1HD1 LEU 89 -0.498 -11.844 4.296 501 HD12 LEU 89 2HD1 LEU 89 -0.838 -11.776 2.567 502 HD13 LEU 89 3HD1 LEU 89 -2.135 -12.133 3.707 503 HD21 LEU 89 1HD2 LEU 89 -0.098 -9.040 2.511 504 HD22 LEU 89 2HD2 LEU 89 0.550 -9.762 3.993 505 HD23 LEU 89 3HD2 LEU 89 -0.436 -8.300 4.080 506 HA PRO 90 HA PRO 90 1.044 -9.356 -1.291 507 HB2 PRO 90 1HB PRO 90 1.543 -6.655 -1.240 508 HB3 PRO 90 2HB PRO 90 0.507 -7.454 -2.426 509 HG2 PRO 90 1HG PRO 90 -0.245 -5.975 0.057 510 HG3 PRO 90 2HG PRO 90 -1.016 -5.953 -1.539 511 HD2 PRO 90 1HD PRO 90 -2.029 -7.366 0.513 512 HD3 PRO 90 2HD PRO 90 -2.136 -7.941 -1.164 513 H GLN 91 H GLN 91 3.085 -9.577 -0.639 514 HA GLN 91 HA GLN 91 3.917 -8.363 1.905 515 HB2 GLN 91 1HB GLN 91 4.389 -11.243 1.102 516 HB3 GLN 91 2HB GLN 91 4.995 -10.471 2.559 517 HG2 GLN 91 1HG GLN 91 2.704 -10.155 3.342 518 HG3 GLN 91 2HG GLN 91 2.100 -10.933 1.880 519 HE21 GLN 91 1HE2 GLN 91 1.982 -13.840 3.771 520 HE22 GLN 91 2HE2 GLN 91 1.109 -12.577 2.980 521 H ASP 92 H ASP 92 6.140 -7.965 2.085 522 HA ASP 92 HA ASP 92 7.617 -7.318 -0.191 523 HB2 ASP 92 1HB ASP 92 8.696 -8.141 2.522 524 HB3 ASP 92 2HB ASP 92 9.593 -7.291 1.277 525 HA PRO 93 HA PRO 93 9.279 -11.208 -1.688 526 HB2 PRO 93 1HB PRO 93 11.833 -9.721 -1.979 527 HB3 PRO 93 2HB PRO 93 10.919 -10.632 -3.185 528 HG2 PRO 93 1HG PRO 93 10.942 -7.966 -3.214 529 HG3 PRO 93 2HG PRO 93 9.472 -8.876 -3.610 530 HD2 PRO 93 1HD PRO 93 10.185 -7.429 -1.092 531 HD3 PRO 93 2HD PRO 93 8.619 -7.551 -1.921 532 H TRP 94 H TRP 94 10.635 -9.337 0.861 533 HA TRP 94 HA TRP 94 12.515 -11.339 1.727 534 HB2 TRP 94 1HB TRP 94 11.561 -8.834 3.127 535 HB3 TRP 94 2HB TRP 94 12.941 -9.821 3.599 536 HD1 TRP 94 HD1 TRP 94 14.920 -10.005 1.560 537 HE1 TRP 94 HE1 TRP 94 15.807 -8.099 0.062 538 HE3 TRP 94 HE3 TRP 94 11.079 -6.683 2.102 539 HZ2 TRP 94 HZ2 TRP 94 14.982 -5.547 -0.774 540 HZ3 TRP 94 HZ3 TRP 94 11.201 -4.533 0.915 541 HH2 TRP 94 HH2 TRP 94 13.118 -3.976 -0.490 542 H GLY 95 H GLY 95 9.168 -10.853 2.090 543 HA2 GLY 95 1HA GLY 95 7.904 -12.730 2.895 544 HA3 GLY 95 2HA GLY 95 9.168 -13.030 4.072 545 H SER 96 H SER 96 8.389 -9.731 3.865 546 HA SER 96 HA SER 96 6.864 -9.964 6.358 547 HB2 SER 96 1HB SER 96 7.461 -7.423 6.447 548 HB3 SER 96 2HB SER 96 8.722 -8.611 6.772 549 HG SER 96 HG SER 96 8.272 -7.078 4.426 550 H ASP 97 H ASP 97 4.880 -8.983 6.627 551 HA ASP 97 HA ASP 97 3.322 -8.499 4.261 552 HB2 ASP 97 1HB ASP 97 2.543 -7.932 7.133 553 HB3 ASP 97 2HB ASP 97 1.461 -8.197 5.772 554 H TYR 98 H TYR 98 2.895 -6.526 3.308 555 HA TYR 98 HA TYR 98 4.358 -4.242 4.061 556 HB2 TYR 98 1HB TYR 98 1.882 -4.382 2.338 557 HB3 TYR 98 2HB TYR 98 2.901 -2.969 2.508 558 HD1 TYR 98 HD1 TYR 98 2.329 -5.919 0.633 559 HD2 TYR 98 HD2 TYR 98 5.388 -3.241 1.855 560 HE1 TYR 98 HE1 TYR 98 3.741 -6.698 -1.222 561 HE2 TYR 98 HE2 TYR 98 6.813 -4.017 0.008 562 HH TYR 98 HH TYR 98 5.616 -6.045 -2.524 563 H GLN 99 H GLN 99 3.367 -2.103 4.560 564 HA GLN 99 HA GLN 99 1.275 -2.427 6.601 565 HB2 GLN 99 1HB GLN 99 3.950 -1.081 6.878 566 HB3 GLN 99 2HB GLN 99 2.602 -0.684 7.933 567 HG2 GLN 99 1HG GLN 99 3.780 -3.432 7.597 568 HG3 GLN 99 2HG GLN 99 4.149 -2.321 8.916 569 HE21 GLN 99 1HE2 GLN 99 1.460 -4.807 9.810 570 HE22 GLN 99 2HE2 GLN 99 3.001 -4.973 9.045 571 H LEU 100 H LEU 100 -0.194 -0.883 6.745 572 HA LEU 100 HA LEU 100 0.199 1.611 5.233 573 HB2 LEU 100 1HB LEU 100 -1.526 0.391 4.101 574 HB3 LEU 100 2HB LEU 100 -2.307 -0.023 5.618 575 HG LEU 100 HG LEU 100 -2.606 2.530 5.910 576 HD11 LEU 100 1HD1 LEU 100 -1.142 3.183 4.069 577 HD12 LEU 100 2HD1 LEU 100 -2.783 3.791 3.866 578 HD13 LEU 100 3HD1 LEU 100 -2.240 2.402 2.929 579 HD21 LEU 100 1HD2 LEU 100 -4.714 2.468 4.771 580 HD22 LEU 100 2HD2 LEU 100 -4.403 0.912 5.538 581 HD23 LEU 100 3HD2 LEU 100 -4.183 1.099 3.798 582 H LEU 101 H LEU 101 -0.317 3.499 6.324 583 HA LEU 101 HA LEU 101 -1.557 3.141 8.959 584 HB2 LEU 101 1HB LEU 101 0.929 3.568 9.050 585 HB3 LEU 101 2HB LEU 101 0.628 5.133 8.329 586 HG LEU 101 HG LEU 101 0.989 5.047 10.847 587 HD11 LEU 101 1HD1 LEU 101 -0.670 6.770 11.296 588 HD12 LEU 101 2HD1 LEU 101 -1.515 6.346 9.808 589 HD13 LEU 101 3HD1 LEU 101 0.115 7.015 9.735 590 HD21 LEU 101 1HD2 LEU 101 -1.842 4.021 10.785 591 HD22 LEU 101 2HD2 LEU 101 -0.930 4.491 12.221 592 HD23 LEU 101 3HD2 LEU 101 -0.425 3.092 11.274 593 H SER 102 H SER 102 -3.501 3.972 8.813 594 HA SER 102 HA SER 102 -3.869 6.577 7.510 595 HB2 SER 102 1HB SER 102 -6.028 4.681 8.451 596 HB3 SER 102 2HB SER 102 -6.194 6.037 7.336 597 HG SER 102 HG SER 102 -6.069 4.281 6.041 598 HA PRO 103 HA PRO 103 -4.474 8.405 7.592 599 HB2 PRO 103 1HB PRO 103 -3.919 10.850 8.972 600 HB3 PRO 103 2HB PRO 103 -5.407 10.392 8.145 601 HG2 PRO 103 1HG PRO 103 -5.166 10.751 10.872 602 HG3 PRO 103 2HG PRO 103 -6.437 9.801 10.084 603 HD2 PRO 103 1HD PRO 103 -3.920 8.877 11.409 604 HD3 PRO 103 2HD PRO 103 -5.539 8.145 11.422 605 H GLY 104 H GLY 104 -2.653 8.750 6.452 606 HA2 GLY 104 1HA GLY 104 -0.195 7.974 7.647 607 HA3 GLY 104 2HA GLY 104 -0.418 8.505 5.987 608 H GLN 105 H GLN 105 1.853 9.226 7.017 609 HA GLN 105 HA GLN 105 1.587 11.875 8.230 610 HB2 GLN 105 1HB GLN 105 3.209 10.212 9.157 611 HB3 GLN 105 2HB GLN 105 4.086 10.274 7.636 612 HG2 GLN 105 1HG GLN 105 5.160 11.640 9.330 613 HG3 GLN 105 2HG GLN 105 4.572 12.630 7.995 614 HE21 GLN 105 1HE2 GLN 105 2.329 14.470 9.914 615 HE22 GLN 105 2HE2 GLN 105 2.881 14.041 8.333 616 H HIS 106 H HIS 106 2.396 10.266 5.278 617 HA HIS 106 HA HIS 106 3.325 12.767 4.047 618 HB2 HIS 106 1HB HIS 106 3.291 9.959 2.909 619 HB3 HIS 106 2HB HIS 106 4.062 11.365 2.185 620 HD1 HIS 106 HD1 HIS 106 4.539 8.727 4.760 621 HD2 HIS 106 HD2 HIS 106 6.484 12.170 3.448 622 HE1 HIS 106 HE1 HIS 106 6.851 8.628 5.749 623 HE2 HIS 106 HE2 HIS 106 8.047 10.649 4.834 624 H GLY 107 H GLY 107 0.493 12.037 4.788 625 HA2 GLY 107 1HA GLY 107 -1.038 13.306 3.031 626 HA3 GLY 107 2HA GLY 107 -0.815 11.772 2.198 627 H GLN 108 H GLN 108 -3.112 11.431 2.367 628 HA GLN 108 HA GLN 108 -4.342 11.187 4.934 629 HB2 GLN 108 1HB GLN 108 -5.166 10.431 2.152 630 HB3 GLN 108 2HB GLN 108 -6.117 9.916 3.537 631 HG2 GLN 108 1HG GLN 108 -5.399 12.793 3.176 632 HG3 GLN 108 2HG GLN 108 -6.751 12.084 2.300 633 HE21 GLN 108 1HE2 GLN 108 -7.257 11.709 6.318 634 HE22 GLN 108 2HE2 GLN 108 -5.880 11.033 5.526 635 H VAL 109 H VAL 109 -2.795 8.966 2.715 636 HA VAL 109 HA VAL 109 -2.931 6.900 4.795 637 HB VAL 109 HB VAL 109 -3.025 5.253 2.762 638 HG11 VAL 109 1HG1 VAL 109 -4.711 5.402 4.517 639 HG12 VAL 109 2HG1 VAL 109 -5.457 5.170 2.936 640 HG13 VAL 109 3HG1 VAL 109 -5.461 6.766 3.687 641 HG21 VAL 109 1HG2 VAL 109 -4.446 6.114 0.928 642 HG22 VAL 109 2HG2 VAL 109 -2.861 6.884 0.990 643 HG23 VAL 109 3HG2 VAL 109 -4.279 7.736 1.600 644 H ASP 110 H ASP 110 -1.024 6.005 5.250 645 HA ASP 110 HA ASP 110 1.223 6.628 3.451 646 HB2 ASP 110 1HB ASP 110 0.947 7.066 6.182 647 HB3 ASP 110 2HB ASP 110 1.952 5.625 6.090 648 H ILE 111 H ILE 111 1.755 4.975 2.196 649 HA ILE 111 HA ILE 111 1.639 2.264 3.321 650 HB ILE 111 HB ILE 111 2.048 1.582 0.869 651 HG12 ILE 111 1HG1 ILE 111 0.972 4.378 0.444 652 HG13 ILE 111 2HG1 ILE 111 2.600 3.836 0.055 653 HG21 ILE 111 1HG2 ILE 111 -0.006 1.103 2.009 654 HG22 ILE 111 2HG2 ILE 111 -0.371 1.674 0.380 655 HG23 ILE 111 3HG2 ILE 111 -0.575 2.753 1.760 656 HD11 ILE 111 1HD1 ILE 111 0.063 2.812 -1.188 657 HD12 ILE 111 2HD1 ILE 111 1.699 2.282 -1.584 658 HD13 ILE 111 3HD1 ILE 111 1.203 3.941 -1.921 659 H PHE 112 H PHE 112 3.446 1.252 3.789 660 HA PHE 112 HA PHE 112 5.911 1.985 2.444 661 HB2 PHE 112 1HB PHE 112 7.104 2.149 4.659 662 HB3 PHE 112 2HB PHE 112 6.031 3.489 4.279 663 HD1 PHE 112 HD1 PHE 112 3.834 3.668 5.431 664 HD2 PHE 112 HD2 PHE 112 6.758 0.790 6.564 665 HE1 PHE 112 HE1 PHE 112 2.703 3.377 7.596 666 HE2 PHE 112 HE2 PHE 112 5.628 0.492 8.728 667 HZ PHE 112 HZ PHE 112 3.599 1.787 9.247 668 H SER 113 H SER 113 7.505 0.457 2.533 669 HA SER 113 HA SER 113 6.575 -2.225 3.281 670 HB2 SER 113 1HB SER 113 8.848 -1.567 1.414 671 HB3 SER 113 2HB SER 113 7.887 -3.045 1.494 672 HG SER 113 HG SER 113 7.125 -0.499 0.522 673 H LEU 114 H LEU 114 7.840 -3.524 4.519 674 HA LEU 114 HA LEU 114 9.235 -2.155 6.546 675 HB2 LEU 114 1HB LEU 114 8.899 -5.082 5.953 676 HB3 LEU 114 2HB LEU 114 9.818 -4.509 7.328 677 HG LEU 114 HG LEU 114 7.643 -5.114 8.101 678 HD11 LEU 114 1HD1 LEU 114 6.836 -3.045 9.051 679 HD12 LEU 114 2HD1 LEU 114 7.741 -2.115 7.856 680 HD13 LEU 114 3HD1 LEU 114 8.601 -3.073 9.062 681 HD21 LEU 114 1HD2 LEU 114 6.496 -5.015 5.926 682 HD22 LEU 114 2HD2 LEU 114 6.485 -3.253 6.035 683 HD23 LEU 114 3HD2 LEU 114 5.593 -4.216 7.212 684 H GLY 115 H GLY 115 10.305 -4.002 3.778 685 HA2 GLY 115 1HA GLY 115 12.425 -3.920 2.802 686 HA3 GLY 115 2HA GLY 115 13.015 -3.051 4.214 687 HA PRO 116 HA PRO 116 14.374 -7.549 4.217 688 HB2 PRO 116 1HB PRO 116 17.045 -7.066 4.430 689 HB3 PRO 116 2HB PRO 116 16.200 -7.198 2.886 690 HG2 PRO 116 1HG PRO 116 17.050 -4.757 4.381 691 HG3 PRO 116 2HG PRO 116 17.101 -5.081 2.639 692 HD2 PRO 116 1HD PRO 116 15.177 -3.560 3.814 693 HD3 PRO 116 2HD PRO 116 14.890 -4.513 2.347 694 H ASP 117 H ASP 117 14.702 -4.843 6.282 695 HA ASP 117 HA ASP 117 16.057 -6.362 8.380 696 HB2 ASP 117 1HB ASP 117 16.373 -4.284 9.520 697 HB3 ASP 117 2HB ASP 117 16.713 -3.978 7.822 698 H GLY 118 H GLY 118 12.930 -5.639 7.376 699 HA2 GLY 118 1HA GLY 118 10.894 -6.211 8.290 700 HA3 GLY 118 2HA GLY 118 11.757 -6.910 9.650 701 H VAL 119 H VAL 119 12.744 -3.746 9.152 702 HA VAL 119 HA VAL 119 11.049 -2.880 11.397 703 HB VAL 119 HB VAL 119 13.826 -1.923 10.678 704 HG11 VAL 119 1HG1 VAL 119 13.752 -0.719 12.800 705 HG12 VAL 119 2HG1 VAL 119 12.092 -1.257 13.056 706 HG13 VAL 119 3HG1 VAL 119 12.471 -0.173 11.717 707 HG21 VAL 119 1HG2 VAL 119 14.527 -3.065 12.726 708 HG22 VAL 119 2HG2 VAL 119 13.840 -4.194 11.559 709 HG23 VAL 119 3HG2 VAL 119 12.887 -3.672 12.949 710 HA PRO 120 HA PRO 120 9.393 0.019 8.470 711 HB2 PRO 120 1HB PRO 120 7.537 1.085 10.093 712 HB3 PRO 120 2HB PRO 120 7.381 -0.550 9.438 713 HG2 PRO 120 1HG PRO 120 8.302 0.324 12.147 714 HG3 PRO 120 2HG PRO 120 7.213 -1.007 11.711 715 HD2 PRO 120 1HD PRO 120 9.859 -1.350 12.297 716 HD3 PRO 120 2HD PRO 120 8.944 -2.425 11.220 717 H GLU 121 H GLU 121 9.325 2.215 8.097 718 HA GLU 121 HA GLU 121 9.913 4.398 8.185 719 HB2 GLU 121 1HB GLU 121 9.754 3.892 11.155 720 HB3 GLU 121 2HB GLU 121 10.033 5.482 10.455 721 HG2 GLU 121 1HG GLU 121 7.621 3.764 9.909 722 HG3 GLU 121 2HG GLU 121 7.680 5.083 11.076 723 H SER 122 H SER 122 11.872 2.221 8.154 724 HA SER 122 HA SER 122 14.211 3.517 9.326 725 HB2 SER 122 1HB SER 122 15.129 1.185 8.328 726 HB3 SER 122 2HB SER 122 14.399 1.327 9.927 727 HG SER 122 HG SER 122 13.546 -0.095 7.825 728 H ASN 123 H ASN 123 16.272 3.214 7.856 729 HA ASN 123 HA ASN 123 15.846 4.838 5.575 730 HB2 ASN 123 1HB ASN 123 17.938 4.998 6.742 731 HB3 ASN 123 2HB ASN 123 18.270 3.287 6.495 732 HD21 ASN 123 1HD2 ASN 123 18.976 5.997 3.546 733 HD22 ASN 123 2HD2 ASN 123 18.040 6.411 4.941 734 H ASP 124 H ASP 124 16.145 1.407 6.021 735 HA ASP 124 HA ASP 124 16.600 0.741 3.273 736 HB2 ASP 124 1HB ASP 124 16.314 -1.549 3.986 737 HB3 ASP 124 2HB ASP 124 17.246 -0.704 5.222 738 H ASP 125 H ASP 125 13.874 1.605 5.097 739 HA ASP 125 HA ASP 125 11.870 -0.050 4.041 740 HB2 ASP 125 1HB ASP 125 11.915 2.580 5.452 741 HB3 ASP 125 2HB ASP 125 10.413 2.036 4.719 742 H ILE 126 H ILE 126 10.554 0.092 2.308 743 HA ILE 126 HA ILE 126 11.122 2.231 0.369 744 HB ILE 126 HB ILE 126 9.781 -0.443 -0.102 745 HG12 ILE 126 1HG1 ILE 126 11.897 -0.680 -1.626 746 HG13 ILE 126 2HG1 ILE 126 12.580 0.541 -0.558 747 HG21 ILE 126 1HG2 ILE 126 10.618 1.622 -2.128 748 HG22 ILE 126 2HG2 ILE 126 8.968 1.396 -1.549 749 HG23 ILE 126 3HG2 ILE 126 9.774 0.101 -2.438 750 HD11 ILE 126 1HD1 ILE 126 12.213 -0.923 1.353 751 HD12 ILE 126 2HD1 ILE 126 13.209 -1.703 0.125 752 HD13 ILE 126 3HD1 ILE 126 11.509 -2.141 0.289 753 H GLY 127 H GLY 127 9.736 3.873 0.716 754 HA2 GLY 127 1HA GLY 127 6.904 3.181 1.188 755 HA3 GLY 127 2HA GLY 127 7.672 4.650 1.772 756 H ASN 128 H ASN 128 5.358 4.892 0.417 757 HA ASN 128 HA ASN 128 5.564 5.187 -2.373 758 HB2 ASN 128 1HB ASN 128 3.425 5.146 -1.084 759 HB3 ASN 128 2HB ASN 128 3.781 6.769 -0.508 760 HD21 ASN 128 1HD2 ASN 128 1.797 7.826 -3.177 761 HD22 ASN 128 2HD2 ASN 128 1.931 7.612 -1.468 762 H TRP 129 H TRP 129 6.367 7.330 0.270 763 HA TRP 129 HA TRP 129 6.873 9.612 -1.404 764 HB2 TRP 129 1HB TRP 129 6.199 9.650 1.058 765 HB3 TRP 129 2HB TRP 129 7.863 9.196 1.416 766 HD1 TRP 129 HD1 TRP 129 9.698 11.067 1.254 767 HE1 TRP 129 HE1 TRP 129 9.605 13.607 0.882 768 HE3 TRP 129 HE3 TRP 129 4.820 11.499 -0.215 769 HZ2 TRP 129 HZ2 TRP 129 7.715 15.547 0.083 770 HZ3 TRP 129 HZ3 TRP 129 3.948 13.734 -0.762 771 HH2 TRP 129 HH2 TRP 129 5.367 15.714 -0.615 772 H THR 130 H THR 130 8.593 6.815 -0.440 773 HA THR 130 HA THR 130 11.244 7.823 -0.766 774 HB THR 130 HB THR 130 10.401 4.939 -1.048 775 HG1 THR 130 HG1 THR 130 10.965 6.320 1.385 776 HG21 THR 130 1HG2 THR 130 12.918 6.262 -0.027 777 HG22 THR 130 2HG2 THR 130 12.732 5.393 -1.551 778 HG23 THR 130 3HG2 THR 130 12.610 4.526 -0.021 779 H ILE 131 H ILE 131 9.024 5.913 -2.780 780 HA ILE 131 HA ILE 131 10.801 6.006 -5.045 781 HB ILE 131 HB ILE 131 9.381 4.056 -4.746 782 HG12 ILE 131 1HG1 ILE 131 8.341 3.955 -7.014 783 HG13 ILE 131 2HG1 ILE 131 8.653 5.678 -7.194 784 HG21 ILE 131 1HG2 ILE 131 6.934 4.214 -5.117 785 HG22 ILE 131 2HG2 ILE 131 7.084 5.972 -5.052 786 HG23 ILE 131 3HG2 ILE 131 7.491 4.998 -3.638 787 HD11 ILE 131 1HD1 ILE 131 10.738 3.537 -6.825 788 HD12 ILE 131 2HD1 ILE 131 11.050 5.262 -7.015 789 HD13 ILE 131 3HD1 ILE 131 10.329 4.346 -8.338 790 H GLY 132 H GLY 132 8.159 7.869 -3.801 791 HA2 GLY 132 1HA GLY 132 7.946 10.148 -4.183 792 HA3 GLY 132 2HA GLY 132 9.007 9.994 -5.570 793 H PHE 133 H PHE 133 5.958 8.254 -4.933 794 HA PHE 133 HA PHE 133 4.951 9.208 -7.477 795 HB2 PHE 133 1HB PHE 133 3.967 7.218 -5.472 796 HB3 PHE 133 2HB PHE 133 2.841 7.888 -6.648 797 HD1 PHE 133 HD1 PHE 133 5.422 5.485 -6.062 798 HD2 PHE 133 HD2 PHE 133 3.386 7.654 -9.099 799 HE1 PHE 133 HE1 PHE 133 6.206 3.864 -7.737 800 HE2 PHE 133 HE2 PHE 133 4.160 6.034 -10.781 801 HZ PHE 133 HZ PHE 133 5.574 4.136 -10.101 802 H HIS 134 H HIS 134 5.272 11.409 -6.405 803 HA HIS 134 HA HIS 134 2.612 12.339 -5.662 804 HB2 HIS 134 1HB HIS 134 3.952 12.050 -3.549 805 HB3 HIS 134 2HB HIS 134 5.085 13.245 -4.172 806 HD1 HIS 134 HD1 HIS 134 1.950 12.914 -2.332 807 HD2 HIS 134 HD2 HIS 134 3.887 15.885 -4.494 808 HE1 HIS 134 HE1 HIS 134 0.807 15.057 -1.704 809 HE2 HIS 134 HE2 HIS 134 1.837 16.791 -3.209 810 H HIS 135 H HIS 135 2.416 13.237 -7.692 811 HA HIS 135 HA HIS 135 4.472 14.933 -8.767 812 HB2 HIS 135 1HB HIS 135 2.725 15.413 -10.553 813 HB3 HIS 135 2HB HIS 135 3.263 13.747 -10.406 814 HD1 HIS 135 HD1 HIS 135 1.424 12.135 -10.556 815 HD2 HIS 135 HD2 HIS 135 0.144 15.741 -8.934 816 HE1 HIS 135 HE1 HIS 135 -1.050 11.868 -10.179 817 HE2 HIS 135 HE2 HIS 135 -1.809 14.068 -9.215 818 H HIS 136 H HIS 136 4.490 17.108 -8.986 819 HA HIS 136 HA HIS 136 2.328 18.677 -7.811 820 HB2 HIS 136 1HB HIS 136 3.998 18.235 -6.005 821 HB3 HIS 136 2HB HIS 136 5.228 19.004 -6.997 822 HD1 HIS 136 HD1 HIS 136 2.201 19.786 -4.917 823 HD2 HIS 136 HD2 HIS 136 5.213 21.785 -6.969 824 HE1 HIS 136 HE1 HIS 136 2.057 22.181 -4.165 825 HE2 HIS 136 HE2 HIS 136 3.969 23.344 -5.323 826 H HIS 137 H HIS 137 2.076 19.002 -10.157 827 HA HIS 137 HA HIS 137 4.090 20.423 -11.613 828 HB2 HIS 137 1HB HIS 137 1.202 19.785 -12.162 829 HB3 HIS 137 2HB HIS 137 2.113 20.856 -13.215 830 HD1 HIS 137 HD1 HIS 137 3.549 19.787 -14.957 831 HD2 HIS 137 HD2 HIS 137 2.277 17.084 -12.069 832 HE1 HIS 137 HE1 HIS 137 4.244 17.524 -15.797 833 HE2 HIS 137 HE2 HIS 137 3.660 15.942 -13.925 834 H HIS 138 H HIS 138 1.335 21.300 -9.668 835 HA HIS 138 HA HIS 138 1.268 24.034 -10.542 836 HB2 HIS 138 1HB HIS 138 -0.029 22.706 -8.153 837 HB3 HIS 138 2HB HIS 138 -0.351 24.348 -8.696 838 HD1 HIS 138 HD1 HIS 138 -1.454 20.918 -9.137 839 HD2 HIS 138 HD2 HIS 138 -1.554 24.415 -11.373 840 HE1 HIS 138 HE1 HIS 138 -3.184 20.530 -10.916 841 HE2 HIS 138 HE2 HIS 138 -3.075 22.581 -12.372 842 H HIS 139 H HIS 139 3.394 24.704 -10.234 843 HA HIS 139 HA HIS 139 4.458 24.669 -7.512 844 HB2 HIS 139 1HB HIS 139 6.574 25.450 -8.597 845 HB3 HIS 139 2HB HIS 139 6.001 23.896 -9.184 846 HD1 HIS 139 HD1 HIS 139 5.142 23.797 -11.646 847 HD2 HIS 139 HD2 HIS 139 6.647 27.497 -10.488 848 HE1 HIS 139 HE1 HIS 139 5.459 25.096 -13.773 849 HE2 HIS 139 HE2 HIS 139 6.212 27.381 -13.034 850 H LYS 140 H LYS 140 2.324 26.304 -7.690 851 HA LYS 140 HA LYS 140 3.150 29.026 -8.192 852 HB2 LYS 140 1HB LYS 140 0.839 28.288 -8.652 853 HB3 LYS 140 2HB LYS 140 0.617 27.944 -6.944 854 HG2 LYS 140 1HG LYS 140 0.899 30.305 -6.418 855 HG3 LYS 140 2HG LYS 140 1.170 30.660 -8.125 856 HD2 LYS 140 1HD LYS 140 -1.116 31.189 -7.546 857 HD3 LYS 140 2HD LYS 140 -1.093 29.796 -8.627 858 HE2 LYS 140 1HE LYS 140 -1.286 28.321 -6.639 859 HE3 LYS 140 2HE LYS 140 -1.449 29.758 -5.633 860 HZ1 LYS 140 1HZ LYS 140 -3.288 28.907 -7.801 861 HZ2 LYS 140 2HZ LYS 140 -3.432 30.344 -6.924 862 HZ3 LYS 140 3HZ LYS 140 -3.602 28.857 -6.143 Start of MODEL 15 1 H1 MET 25 1H MET 25 26.749 -13.320 -4.971 2 H2 MET 25 2H MET 25 27.356 -13.850 -6.459 3 H3 MET 25 3H MET 25 26.567 -14.933 -5.430 4 HA MET 25 HA MET 25 25.324 -12.606 -6.764 5 HB2 MET 25 1HB MET 25 25.122 -15.577 -7.282 6 HB3 MET 25 2HB MET 25 24.011 -14.395 -7.957 7 HG2 MET 25 1HG MET 25 25.863 -13.314 -9.120 8 HG3 MET 25 2HG MET 25 26.980 -14.488 -8.435 9 HE1 MET 25 1HE MET 25 25.243 -17.195 -8.599 10 HE2 MET 25 2HE MET 25 26.956 -17.053 -8.992 11 HE3 MET 25 3HE MET 25 25.850 -17.815 -10.134 12 H GLY 26 H GLY 26 22.967 -12.587 -6.514 13 HA2 GLY 26 1HA GLY 26 21.063 -13.626 -5.303 14 HA3 GLY 26 2HA GLY 26 22.155 -13.782 -3.936 15 H ASN 27 H ASN 27 23.338 -11.124 -4.516 16 HA ASN 27 HA ASN 27 21.301 -9.577 -3.111 17 HB2 ASN 27 1HB ASN 27 23.656 -9.740 -2.235 18 HB3 ASN 27 2HB ASN 27 24.187 -8.843 -3.651 19 HD21 ASN 27 1HD2 ASN 27 23.618 -6.651 -0.643 20 HD22 ASN 27 2HD2 ASN 27 24.412 -8.172 -0.849 21 H LYS 28 H LYS 28 19.965 -9.273 -4.982 22 HA LYS 28 HA LYS 28 21.034 -7.226 -6.808 23 HB2 LYS 28 1HB LYS 28 20.280 -9.357 -7.891 24 HB3 LYS 28 2HB LYS 28 18.657 -9.036 -7.296 25 HG2 LYS 28 1HG LYS 28 18.554 -6.993 -8.607 26 HG3 LYS 28 2HG LYS 28 20.206 -7.257 -9.169 27 HD2 LYS 28 1HD LYS 28 17.944 -9.190 -9.648 28 HD3 LYS 28 2HD LYS 28 18.416 -7.930 -10.788 29 HE2 LYS 28 1HE LYS 28 20.650 -8.895 -10.938 30 HE3 LYS 28 2HE LYS 28 20.195 -10.147 -9.783 31 HZ1 LYS 28 1HZ LYS 28 18.891 -9.737 -12.417 32 HZ2 LYS 28 2HZ LYS 28 18.595 -10.997 -11.330 33 HZ3 LYS 28 3HZ LYS 28 20.090 -10.885 -12.108 34 H GLU 29 H GLU 29 20.651 -5.742 -5.099 35 HA GLU 29 HA GLU 29 18.312 -5.299 -3.695 36 HB2 GLU 29 1HB GLU 29 20.568 -4.281 -3.284 37 HB3 GLU 29 2HB GLU 29 20.261 -3.185 -4.621 38 HG2 GLU 29 1HG GLU 29 19.786 -2.012 -2.631 39 HG3 GLU 29 2HG GLU 29 18.239 -2.390 -3.387 40 H LYS 30 H LYS 30 19.250 -4.064 -6.878 41 HA LYS 30 HA LYS 30 17.219 -2.156 -7.144 42 HB2 LYS 30 1HB LYS 30 19.149 -2.212 -8.643 43 HB3 LYS 30 2HB LYS 30 18.605 -3.748 -9.308 44 HG2 LYS 30 1HG LYS 30 16.588 -2.663 -10.165 45 HG3 LYS 30 2HG LYS 30 17.141 -1.123 -9.507 46 HD2 LYS 30 1HD LYS 30 19.073 -1.157 -10.970 47 HD3 LYS 30 2HD LYS 30 18.615 -2.752 -11.575 48 HE2 LYS 30 1HE LYS 30 16.547 -1.821 -12.476 49 HE3 LYS 30 2HE LYS 30 16.983 -0.231 -11.857 50 HZ1 LYS 30 1HZ LYS 30 17.478 -0.448 -14.209 51 HZ2 LYS 30 2HZ LYS 30 18.499 -1.760 -13.900 52 HZ3 LYS 30 3HZ LYS 30 18.897 -0.224 -13.321 53 H ALA 31 H ALA 31 17.263 -5.604 -7.933 54 HA ALA 31 HA ALA 31 14.748 -5.577 -9.268 55 HB1 ALA 31 1HB ALA 31 16.420 -7.319 -9.675 56 HB2 ALA 31 2HB ALA 31 14.869 -7.999 -9.180 57 HB3 ALA 31 3HB ALA 31 16.200 -7.906 -8.026 58 H ASP 32 H ASP 32 15.782 -6.291 -5.970 59 HA ASP 32 HA ASP 32 13.306 -7.232 -5.020 60 HB2 ASP 32 1HB ASP 32 15.533 -5.829 -3.529 61 HB3 ASP 32 2HB ASP 32 14.161 -6.611 -2.757 62 H ARG 33 H ARG 33 14.730 -3.972 -5.009 63 HA ARG 33 HA ARG 33 12.536 -2.824 -3.648 64 HB2 ARG 33 1HB ARG 33 13.475 -0.637 -4.302 65 HB3 ARG 33 2HB ARG 33 14.645 -1.703 -3.542 66 HG2 ARG 33 1HG ARG 33 15.618 -2.215 -5.702 67 HG3 ARG 33 2HG ARG 33 14.400 -1.217 -6.504 68 HD2 ARG 33 1HD ARG 33 16.389 -0.219 -4.470 69 HD3 ARG 33 2HD ARG 33 16.570 -0.062 -6.218 70 HE ARG 33 HE ARG 33 14.406 1.233 -6.098 71 HH11 ARG 33 1HH1 ARG 33 16.615 1.095 -3.377 72 HH12 ARG 33 2HH1 ARG 33 16.142 2.643 -2.759 73 HH21 ARG 33 1HH2 ARG 33 13.790 3.268 -5.279 74 HH22 ARG 33 2HH2 ARG 33 14.547 3.885 -3.844 75 H GLN 34 H GLN 34 13.263 -3.199 -7.091 76 HA GLN 34 HA GLN 34 11.137 -1.603 -8.041 77 HB2 GLN 34 1HB GLN 34 12.544 -3.961 -9.290 78 HB3 GLN 34 2HB GLN 34 11.327 -3.012 -10.128 79 HG2 GLN 34 1HG GLN 34 13.924 -1.941 -9.048 80 HG3 GLN 34 2HG GLN 34 13.620 -2.379 -10.726 81 HE21 GLN 34 1HE2 GLN 34 12.920 0.978 -11.251 82 HE22 GLN 34 2HE2 GLN 34 13.978 -0.360 -11.535 83 H LYS 35 H LYS 35 11.322 -4.960 -7.026 84 HA LYS 35 HA LYS 35 8.690 -5.710 -7.757 85 HB2 LYS 35 1HB LYS 35 10.452 -7.342 -7.177 86 HB3 LYS 35 2HB LYS 35 10.439 -6.759 -5.519 87 HG2 LYS 35 1HG LYS 35 9.201 -8.778 -5.569 88 HG3 LYS 35 2HG LYS 35 8.043 -7.460 -5.383 89 HD2 LYS 35 1HD LYS 35 7.563 -7.554 -7.787 90 HD3 LYS 35 2HD LYS 35 8.710 -8.883 -7.958 91 HE2 LYS 35 1HE LYS 35 6.550 -9.854 -7.843 92 HE3 LYS 35 2HE LYS 35 7.327 -10.153 -6.291 93 HZ1 LYS 35 1HZ LYS 35 5.289 -8.081 -6.881 94 HZ2 LYS 35 2HZ LYS 35 6.105 -8.214 -5.406 95 HZ3 LYS 35 3HZ LYS 35 5.084 -9.457 -5.928 96 H VAL 36 H VAL 36 10.110 -4.240 -4.903 97 HA VAL 36 HA VAL 36 7.864 -4.218 -3.228 98 HB VAL 36 HB VAL 36 10.146 -2.235 -3.418 99 HG11 VAL 36 1HG1 VAL 36 8.131 -1.321 -2.271 100 HG12 VAL 36 2HG1 VAL 36 9.556 -1.446 -1.242 101 HG13 VAL 36 3HG1 VAL 36 8.261 -2.636 -1.104 102 HG21 VAL 36 1HG2 VAL 36 9.707 -4.589 -1.586 103 HG22 VAL 36 2HG2 VAL 36 11.058 -3.457 -1.502 104 HG23 VAL 36 3HG2 VAL 36 10.869 -4.502 -2.910 105 H VAL 37 H VAL 37 9.010 -1.890 -5.636 106 HA VAL 37 HA VAL 37 7.009 0.039 -5.334 107 HB VAL 37 HB VAL 37 8.507 -0.732 -7.848 108 HG11 VAL 37 1HG1 VAL 37 6.526 0.574 -8.383 109 HG12 VAL 37 2HG1 VAL 37 7.982 1.541 -8.620 110 HG13 VAL 37 3HG1 VAL 37 6.984 1.787 -7.188 111 HG21 VAL 37 1HG2 VAL 37 9.995 -0.113 -6.022 112 HG22 VAL 37 2HG2 VAL 37 9.090 1.380 -5.774 113 HG23 VAL 37 3HG2 VAL 37 9.988 1.133 -7.271 114 H SER 38 H SER 38 7.097 -2.914 -7.266 115 HA SER 38 HA SER 38 4.761 -2.480 -8.753 116 HB2 SER 38 1HB SER 38 6.459 -4.215 -9.274 117 HB3 SER 38 2HB SER 38 5.928 -5.130 -7.863 118 HG SER 38 HG SER 38 4.466 -5.953 -9.104 119 H ASP 39 H ASP 39 5.230 -4.192 -5.651 120 HA ASP 39 HA ASP 39 2.453 -4.718 -5.293 121 HB2 ASP 39 1HB ASP 39 4.735 -4.613 -3.317 122 HB3 ASP 39 2HB ASP 39 3.093 -5.046 -2.866 123 H LEU 40 H LEU 40 4.604 -2.117 -4.412 124 HA LEU 40 HA LEU 40 2.994 -0.731 -2.602 125 HB2 LEU 40 1HB LEU 40 5.417 -0.381 -3.090 126 HB3 LEU 40 2HB LEU 40 4.958 0.440 -4.566 127 HG LEU 40 HG LEU 40 3.731 2.113 -3.153 128 HD11 LEU 40 1HD1 LEU 40 5.162 0.656 -0.936 129 HD12 LEU 40 2HD1 LEU 40 3.418 0.811 -1.148 130 HD13 LEU 40 3HD1 LEU 40 4.390 2.234 -0.775 131 HD21 LEU 40 1HD2 LEU 40 6.697 1.782 -2.731 132 HD22 LEU 40 2HD2 LEU 40 5.791 3.267 -2.448 133 HD23 LEU 40 3HD2 LEU 40 5.911 2.604 -4.078 134 H VAL 41 H VAL 41 3.285 -0.345 -6.143 135 HA VAL 41 HA VAL 41 1.362 1.717 -6.321 136 HB VAL 41 HB VAL 41 1.249 1.286 -8.713 137 HG11 VAL 41 1HG1 VAL 41 3.133 2.561 -7.854 138 HG12 VAL 41 2HG1 VAL 41 3.602 1.616 -9.268 139 HG13 VAL 41 3HG1 VAL 41 4.061 1.074 -7.654 140 HG21 VAL 41 1HG2 VAL 41 2.930 -1.157 -8.169 141 HG22 VAL 41 2HG2 VAL 41 2.509 -0.523 -9.760 142 HG23 VAL 41 3HG2 VAL 41 1.248 -1.152 -8.699 143 H ALA 42 H ALA 42 1.104 -1.807 -6.445 144 HA ALA 42 HA ALA 42 -1.630 -1.986 -7.076 145 HB1 ALA 42 1HB ALA 42 -1.543 -4.201 -5.980 146 HB2 ALA 42 2HB ALA 42 0.066 -3.809 -5.374 147 HB3 ALA 42 3HB ALA 42 -0.212 -3.943 -7.111 148 H LEU 43 H LEU 43 0.024 -1.584 -3.965 149 HA LEU 43 HA LEU 43 -2.218 -1.736 -2.284 150 HB2 LEU 43 1HB LEU 43 0.507 -0.582 -2.092 151 HB3 LEU 43 2HB LEU 43 -0.685 0.076 -0.990 152 HG LEU 43 HG LEU 43 -1.121 -2.154 -0.085 153 HD11 LEU 43 1HD1 LEU 43 0.308 -4.032 -0.679 154 HD12 LEU 43 2HD1 LEU 43 1.075 -3.056 -1.933 155 HD13 LEU 43 3HD1 LEU 43 -0.634 -3.474 -2.063 156 HD21 LEU 43 1HD2 LEU 43 1.804 -1.446 -0.120 157 HD22 LEU 43 2HD2 LEU 43 0.975 -2.419 1.097 158 HD23 LEU 43 3HD2 LEU 43 0.580 -0.708 0.914 159 H GLU 44 H GLU 44 -0.671 1.039 -3.817 160 HA GLU 44 HA GLU 44 -2.409 3.003 -2.803 161 HB2 GLU 44 1HB GLU 44 -0.114 3.279 -3.849 162 HB3 GLU 44 2HB GLU 44 -0.893 3.105 -5.410 163 HG2 GLU 44 1HG GLU 44 -1.742 5.211 -3.458 164 HG3 GLU 44 2HG GLU 44 -0.384 5.455 -4.551 165 H GLY 45 H GLY 45 -2.497 0.992 -5.688 166 HA2 GLY 45 1HA GLY 45 -4.720 2.203 -6.943 167 HA3 GLY 45 2HA GLY 45 -4.165 0.556 -7.202 168 H ALA 46 H ALA 46 -4.489 -0.511 -4.657 169 HA ALA 46 HA ALA 46 -7.216 -1.152 -4.557 170 HB1 ALA 46 1HB ALA 46 -6.723 -2.341 -2.566 171 HB2 ALA 46 2HB ALA 46 -5.319 -1.326 -2.229 172 HB3 ALA 46 3HB ALA 46 -5.288 -2.446 -3.586 173 H LEU 47 H LEU 47 -5.303 1.158 -2.711 174 HA LEU 47 HA LEU 47 -7.282 2.079 -0.964 175 HB2 LEU 47 1HB LEU 47 -4.733 3.165 -2.048 176 HB3 LEU 47 2HB LEU 47 -5.818 4.291 -1.259 177 HG LEU 47 HG LEU 47 -5.615 3.185 0.830 178 HD11 LEU 47 1HD1 LEU 47 -4.186 0.969 -0.627 179 HD12 LEU 47 2HD1 LEU 47 -5.782 0.881 0.122 180 HD13 LEU 47 3HD1 LEU 47 -4.349 1.099 1.125 181 HD21 LEU 47 1HD2 LEU 47 -2.921 3.211 -0.516 182 HD22 LEU 47 2HD2 LEU 47 -3.204 3.235 1.222 183 HD23 LEU 47 3HD2 LEU 47 -3.725 4.593 0.227 184 H ASP 48 H ASP 48 -6.476 3.056 -4.263 185 HA ASP 48 HA ASP 48 -8.248 5.273 -4.352 186 HB2 ASP 48 1HB ASP 48 -6.381 5.016 -5.947 187 HB3 ASP 48 2HB ASP 48 -7.183 3.613 -6.649 188 H MET 49 H MET 49 -8.602 1.850 -5.058 189 HA MET 49 HA MET 49 -11.126 2.064 -6.325 190 HB2 MET 49 1HB MET 49 -10.400 0.008 -6.871 191 HB3 MET 49 2HB MET 49 -9.266 -0.030 -5.531 192 HG2 MET 49 1HG MET 49 -10.725 -1.855 -5.250 193 HG3 MET 49 2HG MET 49 -11.167 -0.636 -4.057 194 HE1 MET 49 1HE MET 49 -13.494 -1.883 -3.634 195 HE2 MET 49 2HE MET 49 -13.050 -3.107 -4.823 196 HE3 MET 49 3HE MET 49 -14.619 -2.310 -4.923 197 H TYR 50 H TYR 50 -10.060 1.399 -3.010 198 HA TYR 50 HA TYR 50 -12.645 0.989 -1.950 199 HB2 TYR 50 1HB TYR 50 -10.600 0.275 -0.770 200 HB3 TYR 50 2HB TYR 50 -10.153 1.962 -0.530 201 HD1 TYR 50 HD1 TYR 50 -12.640 -0.628 0.379 202 HD2 TYR 50 HD2 TYR 50 -11.077 3.231 1.249 203 HE1 TYR 50 HE1 TYR 50 -13.940 -0.576 2.468 204 HE2 TYR 50 HE2 TYR 50 -12.367 3.291 3.336 205 HH TYR 50 HH TYR 50 -14.053 0.505 4.541 206 H LYS 51 H LYS 51 -10.647 3.881 -2.353 207 HA LYS 51 HA LYS 51 -12.425 5.613 -0.965 208 HB2 LYS 51 1HB LYS 51 -10.047 6.175 -1.357 209 HB3 LYS 51 2HB LYS 51 -10.383 6.332 -3.076 210 HG2 LYS 51 1HG LYS 51 -11.907 8.171 -2.634 211 HG3 LYS 51 2HG LYS 51 -11.636 7.996 -0.901 212 HD2 LYS 51 1HD LYS 51 -9.267 8.536 -1.228 213 HD3 LYS 51 2HD LYS 51 -9.556 8.732 -2.958 214 HE2 LYS 51 1HE LYS 51 -10.892 10.342 -0.784 215 HE3 LYS 51 2HE LYS 51 -9.505 10.881 -1.730 216 HZ1 LYS 51 1HZ LYS 51 -10.835 10.788 -3.718 217 HZ2 LYS 51 2HZ LYS 51 -11.621 11.747 -2.572 218 HZ3 LYS 51 3HZ LYS 51 -12.159 10.174 -2.865 219 H LEU 52 H LEU 52 -12.206 4.529 -4.302 220 HA LEU 52 HA LEU 52 -14.035 6.431 -5.337 221 HB2 LEU 52 1HB LEU 52 -12.474 5.096 -6.724 222 HB3 LEU 52 2HB LEU 52 -13.411 3.661 -6.362 223 HG LEU 52 HG LEU 52 -15.357 4.655 -7.516 224 HD11 LEU 52 1HD1 LEU 52 -15.046 6.661 -8.885 225 HD12 LEU 52 2HD1 LEU 52 -13.432 6.872 -8.204 226 HD13 LEU 52 3HD1 LEU 52 -14.853 7.007 -7.167 227 HD21 LEU 52 1HD2 LEU 52 -13.847 3.190 -8.738 228 HD22 LEU 52 2HD2 LEU 52 -12.829 4.566 -9.156 229 HD23 LEU 52 3HD2 LEU 52 -14.472 4.462 -9.789 230 H ASP 53 H ASP 53 -14.391 3.196 -3.987 231 HA ASP 53 HA ASP 53 -17.203 3.061 -4.502 232 HB2 ASP 53 1HB ASP 53 -15.759 1.052 -4.381 233 HB3 ASP 53 2HB ASP 53 -15.540 1.344 -2.659 234 H ASN 54 H ASN 54 -15.237 3.760 -1.620 235 HA ASN 54 HA ASN 54 -17.746 4.163 -0.126 236 HB2 ASN 54 1HB ASN 54 -15.020 3.419 0.945 237 HB3 ASN 54 2HB ASN 54 -16.476 3.640 1.911 238 HD21 ASN 54 1HD2 ASN 54 -15.845 0.230 -0.165 239 HD22 ASN 54 2HD2 ASN 54 -14.799 1.595 -0.313 240 H SER 55 H SER 55 -15.523 5.937 -1.624 241 HA SER 55 HA SER 55 -15.140 8.162 -1.676 242 HB2 SER 55 1HB SER 55 -17.120 8.345 0.593 243 HB3 SER 55 2HB SER 55 -16.607 9.660 -0.463 244 HG SER 55 HG SER 55 -17.887 8.949 -1.993 245 H ARG 56 H ARG 56 -13.897 6.282 0.588 246 HA ARG 56 HA ARG 56 -12.360 8.456 1.754 247 HB2 ARG 56 1HB ARG 56 -12.719 7.799 4.038 248 HB3 ARG 56 2HB ARG 56 -14.278 8.089 3.287 249 HG2 ARG 56 1HG ARG 56 -14.873 6.137 4.195 250 HG3 ARG 56 2HG ARG 56 -13.933 5.398 2.895 251 HD2 ARG 56 1HD ARG 56 -11.968 5.343 4.326 252 HD3 ARG 56 2HD ARG 56 -12.865 6.140 5.614 253 HE ARG 56 HE ARG 56 -13.721 3.511 4.610 254 HH11 ARG 56 1HH1 ARG 56 -12.583 5.551 7.220 255 HH12 ARG 56 2HH1 ARG 56 -12.860 4.354 8.445 256 HH21 ARG 56 1HH2 ARG 56 -14.084 1.939 6.205 257 HH22 ARG 56 2HH2 ARG 56 -13.737 2.301 7.868 258 H TYR 57 H TYR 57 -10.542 7.562 3.143 259 HA TYR 57 HA TYR 57 -9.291 5.426 1.613 260 HB2 TYR 57 1HB TYR 57 -8.297 7.594 3.413 261 HB3 TYR 57 2HB TYR 57 -7.293 6.175 3.150 262 HD1 TYR 57 HD1 TYR 57 -7.118 5.504 0.547 263 HD2 TYR 57 HD2 TYR 57 -7.898 9.408 2.041 264 HE1 TYR 57 HE1 TYR 57 -6.242 6.467 -1.533 265 HE2 TYR 57 HE2 TYR 57 -7.023 10.384 -0.040 266 HH TYR 57 HH TYR 57 -6.467 8.560 -2.831 267 HA PRO 58 HA PRO 58 -9.925 2.352 4.663 268 HB2 PRO 58 1HB PRO 58 -7.978 0.622 3.963 269 HB3 PRO 58 2HB PRO 58 -9.412 0.889 2.963 270 HG2 PRO 58 1HG PRO 58 -6.652 2.006 2.672 271 HG3 PRO 58 2HG PRO 58 -7.733 1.361 1.423 272 HD2 PRO 58 1HD PRO 58 -7.419 4.018 1.881 273 HD3 PRO 58 2HD PRO 58 -8.932 3.314 1.280 274 H THR 59 H THR 59 -9.016 1.285 6.474 275 HA THR 59 HA THR 59 -6.820 2.669 7.770 276 HB THR 59 HB THR 59 -7.371 1.218 9.713 277 HG1 THR 59 HG1 THR 59 -9.205 -0.136 9.550 278 HG21 THR 59 1HG2 THR 59 -9.754 2.624 8.500 279 HG22 THR 59 2HG2 THR 59 -8.481 3.388 9.452 280 HG23 THR 59 3HG2 THR 59 -9.556 2.208 10.203 281 H THR 60 H THR 60 -5.407 0.964 9.160 282 HA THR 60 HA THR 60 -3.541 -0.097 7.446 283 HB THR 60 HB THR 60 -4.145 -1.081 10.245 284 HG1 THR 60 HG1 THR 60 -2.478 1.033 9.301 285 HG21 THR 60 1HG2 THR 60 -2.615 -2.563 9.043 286 HG22 THR 60 2HG2 THR 60 -1.764 -1.679 10.311 287 HG23 THR 60 3HG2 THR 60 -1.596 -1.185 8.627 288 H GLU 61 H GLU 61 -6.193 -1.821 9.041 289 HA GLU 61 HA GLU 61 -5.481 -4.372 7.982 290 HB2 GLU 61 1HB GLU 61 -6.750 -4.046 10.084 291 HB3 GLU 61 2HB GLU 61 -8.102 -3.424 9.151 292 HG2 GLU 61 1HG GLU 61 -8.332 -5.583 8.041 293 HG3 GLU 61 2HG GLU 61 -6.974 -6.206 8.979 294 H GLN 62 H GLN 62 -7.869 -1.909 7.146 295 HA GLN 62 HA GLN 62 -9.209 -3.399 5.161 296 HB2 GLN 62 1HB GLN 62 -8.977 -0.411 5.514 297 HB3 GLN 62 2HB GLN 62 -10.115 -1.213 4.441 298 HG2 GLN 62 1HG GLN 62 -11.268 -2.192 6.280 299 HG3 GLN 62 2HG GLN 62 -10.035 -1.637 7.414 300 HE21 GLN 62 1HE2 GLN 62 -12.194 0.999 8.096 301 HE22 GLN 62 2HE2 GLN 62 -11.474 -0.471 8.646 302 H GLY 63 H GLY 63 -6.525 -1.096 5.010 303 HA2 GLY 63 1HA GLY 63 -6.425 -0.823 2.215 304 HA3 GLY 63 2HA GLY 63 -5.085 -0.541 3.314 305 H LEU 64 H LEU 64 -4.715 -3.066 4.354 306 HA LEU 64 HA LEU 64 -3.239 -4.307 2.271 307 HB2 LEU 64 1HB LEU 64 -3.561 -4.594 5.128 308 HB3 LEU 64 2HB LEU 64 -3.483 -6.162 4.343 309 HG LEU 64 HG LEU 64 -1.346 -5.471 3.282 310 HD11 LEU 64 1HD1 LEU 64 -0.199 -3.483 4.153 311 HD12 LEU 64 2HD1 LEU 64 -1.657 -3.053 5.056 312 HD13 LEU 64 3HD1 LEU 64 -1.682 -3.065 3.293 313 HD21 LEU 64 1HD2 LEU 64 -1.439 -5.305 6.292 314 HD22 LEU 64 2HD2 LEU 64 -0.005 -5.650 5.324 315 HD23 LEU 64 3HD2 LEU 64 -1.358 -6.782 5.333 316 H GLN 65 H GLN 65 -6.294 -5.087 3.875 317 HA GLN 65 HA GLN 65 -6.604 -7.587 2.541 318 HB2 GLN 65 1HB GLN 65 -8.579 -5.858 4.026 319 HB3 GLN 65 2HB GLN 65 -8.977 -7.434 3.360 320 HG2 GLN 65 1HG GLN 65 -6.855 -6.907 5.427 321 HG3 GLN 65 2HG GLN 65 -8.476 -7.507 5.760 322 HE21 GLN 65 1HE2 GLN 65 -7.489 -10.550 3.732 323 HE22 GLN 65 2HE2 GLN 65 -8.527 -9.214 3.377 324 H ALA 66 H ALA 66 -7.216 -4.335 1.608 325 HA ALA 66 HA ALA 66 -9.586 -4.612 0.156 326 HB1 ALA 66 1HB ALA 66 -9.054 -2.476 -0.846 327 HB2 ALA 66 2HB ALA 66 -7.376 -2.626 -0.323 328 HB3 ALA 66 3HB ALA 66 -8.661 -2.464 0.874 329 H LEU 67 H LEU 67 -6.293 -5.307 -0.843 330 HA LEU 67 HA LEU 67 -7.221 -5.530 -3.595 331 HB2 LEU 67 1HB LEU 67 -4.883 -5.738 -4.278 332 HB3 LEU 67 2HB LEU 67 -5.226 -4.249 -3.440 333 HG LEU 67 HG LEU 67 -3.902 -6.588 -2.078 334 HD11 LEU 67 1HD1 LEU 67 -2.647 -4.273 -3.561 335 HD12 LEU 67 2HD1 LEU 67 -2.548 -5.980 -3.997 336 HD13 LEU 67 3HD1 LEU 67 -1.776 -5.403 -2.520 337 HD21 LEU 67 1HD2 LEU 67 -4.771 -4.963 -0.532 338 HD22 LEU 67 2HD2 LEU 67 -4.094 -3.637 -1.473 339 HD23 LEU 67 3HD2 LEU 67 -3.024 -4.753 -0.625 340 H VAL 68 H VAL 68 -7.101 -7.514 -1.025 341 HA VAL 68 HA VAL 68 -6.770 -9.846 -2.798 342 HB VAL 68 HB VAL 68 -5.059 -9.834 -1.051 343 HG11 VAL 68 1HG1 VAL 68 -5.646 -10.115 1.305 344 HG12 VAL 68 2HG1 VAL 68 -7.350 -9.902 0.903 345 HG13 VAL 68 3HG1 VAL 68 -6.215 -8.573 0.664 346 HG21 VAL 68 1HG2 VAL 68 -7.143 -11.972 -0.646 347 HG22 VAL 68 2HG2 VAL 68 -5.463 -12.070 -0.121 348 HG23 VAL 68 3HG2 VAL 68 -5.844 -11.981 -1.840 349 H SER 69 H SER 69 -8.846 -8.127 -0.659 350 HA SER 69 HA SER 69 -11.066 -9.902 -1.174 351 HB2 SER 69 1HB SER 69 -11.507 -10.192 1.304 352 HB3 SER 69 2HB SER 69 -10.104 -11.077 0.699 353 HG SER 69 HG SER 69 -9.314 -8.640 1.411 354 H ALA 70 H ALA 70 -13.109 -8.976 -0.328 355 HA ALA 70 HA ALA 70 -13.128 -6.108 -0.207 356 HB1 ALA 70 1HB ALA 70 -15.349 -8.045 0.442 357 HB2 ALA 70 2HB ALA 70 -15.009 -7.386 -1.160 358 HB3 ALA 70 3HB ALA 70 -15.517 -6.313 0.145 359 HA PRO 71 HA PRO 71 -12.090 -5.912 4.162 360 HB2 PRO 71 1HB PRO 71 -13.191 -3.173 3.840 361 HB3 PRO 71 2HB PRO 71 -11.629 -3.690 4.486 362 HG2 PRO 71 1HG PRO 71 -11.805 -2.579 2.068 363 HG3 PRO 71 2HG PRO 71 -10.685 -3.919 2.381 364 HD2 PRO 71 1HD PRO 71 -13.335 -3.946 0.994 365 HD3 PRO 71 2HD PRO 71 -11.847 -4.836 0.606 366 H SER 72 H SER 72 -13.257 -6.305 5.938 367 HA SER 72 HA SER 72 -16.127 -6.470 5.687 368 HB2 SER 72 1HB SER 72 -14.417 -7.112 8.098 369 HB3 SER 72 2HB SER 72 -16.050 -7.686 7.763 370 HG SER 72 HG SER 72 -13.667 -8.680 6.935 371 H ALA 73 H ALA 73 -13.760 -4.475 7.278 372 HA ALA 73 HA ALA 73 -15.468 -3.200 9.127 373 HB1 ALA 73 1HB ALA 73 -13.030 -3.144 9.313 374 HB2 ALA 73 2HB ALA 73 -13.714 -1.518 9.302 375 HB3 ALA 73 3HB ALA 73 -12.940 -2.159 7.853 376 H GLU 74 H GLU 74 -17.021 -1.800 8.813 377 HA GLU 74 HA GLU 74 -17.799 -1.038 6.195 378 HB2 GLU 74 1HB GLU 74 -18.857 -0.072 8.857 379 HB3 GLU 74 2HB GLU 74 -19.674 0.058 7.303 380 HG2 GLU 74 1HG GLU 74 -19.801 -2.365 7.149 381 HG3 GLU 74 2HG GLU 74 -18.953 -2.515 8.686 382 HA PRO 75 HA PRO 75 -19.195 0.698 5.292 383 HB2 PRO 75 1HB PRO 75 -17.883 2.024 3.032 384 HB3 PRO 75 2HB PRO 75 -19.470 2.329 3.741 385 HG2 PRO 75 1HG PRO 75 -17.427 4.064 4.008 386 HG3 PRO 75 2HG PRO 75 -18.644 3.832 5.278 387 HD2 PRO 75 1HD PRO 75 -15.863 2.733 5.092 388 HD3 PRO 75 2HD PRO 75 -16.717 3.407 6.497 389 H HIS 76 H HIS 76 -19.426 -1.116 4.160 390 HA HIS 76 HA HIS 76 -17.111 -2.704 3.589 391 HB2 HIS 76 1HB HIS 76 -19.330 -3.549 4.496 392 HB3 HIS 76 2HB HIS 76 -19.980 -3.328 2.877 393 HD1 HIS 76 HD1 HIS 76 -18.135 -5.684 4.962 394 HD2 HIS 76 HD2 HIS 76 -18.749 -5.071 0.901 395 HE1 HIS 76 HE1 HIS 76 -17.407 -7.811 3.843 396 HE2 HIS 76 HE2 HIS 76 -18.014 -7.495 1.420 397 H ALA 77 H ALA 77 -16.084 -2.917 1.720 398 HA ALA 77 HA ALA 77 -16.613 -1.295 -0.507 399 HB1 ALA 77 1HB ALA 77 -14.386 -2.175 0.050 400 HB2 ALA 77 2HB ALA 77 -14.842 -2.524 -1.619 401 HB3 ALA 77 3HB ALA 77 -14.930 -3.795 -0.399 402 H ARG 78 H ARG 78 -17.959 -1.496 -2.146 403 HA ARG 78 HA ARG 78 -19.213 -4.117 -2.625 404 HB2 ARG 78 1HB ARG 78 -20.130 -1.320 -3.299 405 HB3 ARG 78 2HB ARG 78 -20.942 -2.771 -3.867 406 HG2 ARG 78 1HG ARG 78 -20.588 -1.935 -0.996 407 HG3 ARG 78 2HG ARG 78 -22.078 -1.855 -1.939 408 HD2 ARG 78 1HD ARG 78 -21.986 -4.314 -2.212 409 HD3 ARG 78 2HD ARG 78 -20.564 -4.348 -1.172 410 HE ARG 78 HE ARG 78 -22.940 -3.115 -0.048 411 HH11 ARG 78 1HH1 ARG 78 -21.010 -6.025 -0.358 412 HH12 ARG 78 2HH1 ARG 78 -21.646 -6.750 1.087 413 HH21 ARG 78 1HH2 ARG 78 -23.784 -4.075 1.835 414 HH22 ARG 78 2HH2 ARG 78 -23.215 -5.637 2.336 415 H ASN 79 H ASN 79 -19.620 -4.744 -4.826 416 HA ASN 79 HA ASN 79 -18.984 -5.212 -6.953 417 HB2 ASN 79 1HB ASN 79 -18.385 -2.263 -6.874 418 HB3 ASN 79 2HB ASN 79 -18.062 -3.220 -8.312 419 HD21 ASN 79 1HD2 ASN 79 -21.996 -3.290 -7.290 420 HD22 ASN 79 2HD2 ASN 79 -20.778 -3.794 -6.172 421 H TYR 80 H TYR 80 -17.228 -6.023 -5.053 422 HA TYR 80 HA TYR 80 -14.557 -5.159 -5.811 423 HB2 TYR 80 1HB TYR 80 -13.767 -6.463 -3.946 424 HB3 TYR 80 2HB TYR 80 -15.178 -5.558 -3.409 425 HD1 TYR 80 HD1 TYR 80 -17.377 -6.766 -3.177 426 HD2 TYR 80 HD2 TYR 80 -13.716 -8.825 -3.846 427 HE1 TYR 80 HE1 TYR 80 -18.413 -8.855 -2.395 428 HE2 TYR 80 HE2 TYR 80 -14.742 -10.918 -3.064 429 HH TYR 80 HH TYR 80 -18.125 -11.236 -2.580 430 HA PRO 81 HA PRO 81 -13.894 -8.551 -8.630 431 HB2 PRO 81 1HB PRO 81 -11.154 -8.490 -8.555 432 HB3 PRO 81 2HB PRO 81 -12.135 -7.377 -9.515 433 HG2 PRO 81 1HG PRO 81 -10.840 -6.953 -6.860 434 HG3 PRO 81 2HG PRO 81 -10.964 -5.844 -8.236 435 HD2 PRO 81 1HD PRO 81 -12.560 -5.653 -6.062 436 HD3 PRO 81 2HD PRO 81 -13.107 -5.210 -7.692 437 H GLU 82 H GLU 82 -13.628 -10.731 -8.358 438 HA GLU 82 HA GLU 82 -13.365 -11.780 -5.752 439 HB2 GLU 82 1HB GLU 82 -13.126 -13.204 -8.410 440 HB3 GLU 82 2HB GLU 82 -13.252 -14.003 -6.851 441 HG2 GLU 82 1HG GLU 82 -15.413 -14.110 -7.589 442 HG3 GLU 82 2HG GLU 82 -15.453 -12.629 -6.636 443 H GLY 83 H GLY 83 -11.631 -12.229 -4.587 444 HA2 GLY 83 1HA GLY 83 -9.437 -12.719 -4.052 445 HA3 GLY 83 2HA GLY 83 -9.125 -13.009 -5.757 446 H GLY 84 H GLY 84 -10.619 -10.039 -5.260 447 HA2 GLY 84 1HA GLY 84 -9.897 -7.873 -5.412 448 HA3 GLY 84 2HA GLY 84 -8.479 -8.383 -4.507 449 H TYR 85 H TYR 85 -6.635 -8.119 -5.484 450 HA TYR 85 HA TYR 85 -6.494 -8.360 -8.419 451 HB2 TYR 85 1HB TYR 85 -4.856 -6.473 -6.715 452 HB3 TYR 85 2HB TYR 85 -4.827 -6.594 -8.470 453 HD1 TYR 85 HD1 TYR 85 -7.008 -6.019 -9.716 454 HD2 TYR 85 HD2 TYR 85 -6.287 -4.974 -5.656 455 HE1 TYR 85 HE1 TYR 85 -8.755 -4.297 -9.850 456 HE2 TYR 85 HE2 TYR 85 -8.034 -3.255 -5.779 457 HH TYR 85 HH TYR 85 -9.119 -1.876 -7.574 458 H ILE 86 H ILE 86 -5.294 -9.137 -5.316 459 HA ILE 86 HA ILE 86 -3.221 -10.848 -6.496 460 HB ILE 86 HB ILE 86 -2.079 -8.883 -5.593 461 HG12 ILE 86 1HG1 ILE 86 -1.699 -11.277 -3.785 462 HG13 ILE 86 2HG1 ILE 86 -0.993 -11.094 -5.386 463 HG21 ILE 86 1HG2 ILE 86 -3.738 -8.157 -3.982 464 HG22 ILE 86 2HG2 ILE 86 -2.164 -8.336 -3.207 465 HG23 ILE 86 3HG2 ILE 86 -3.406 -9.566 -2.976 466 HD11 ILE 86 1HD1 ILE 86 0.602 -10.606 -3.600 467 HD12 ILE 86 2HD1 ILE 86 -0.446 -9.307 -3.027 468 HD13 ILE 86 3HD1 ILE 86 0.303 -9.201 -4.619 469 H ARG 87 H ARG 87 -3.033 -12.853 -5.530 470 HA ARG 87 HA ARG 87 -5.417 -13.748 -4.242 471 HB2 ARG 87 1HB ARG 87 -2.864 -15.232 -4.865 472 HB3 ARG 87 2HB ARG 87 -4.343 -15.980 -4.282 473 HG2 ARG 87 1HG ARG 87 -5.489 -15.083 -6.324 474 HG3 ARG 87 2HG ARG 87 -3.895 -14.606 -6.918 475 HD2 ARG 87 1HD ARG 87 -4.482 -16.751 -7.852 476 HD3 ARG 87 2HD ARG 87 -3.159 -16.959 -6.707 477 HE ARG 87 HE ARG 87 -5.979 -17.629 -6.149 478 HH11 ARG 87 1HH1 ARG 87 -2.552 -18.174 -5.651 479 HH12 ARG 87 2HH1 ARG 87 -2.795 -19.525 -4.596 480 HH21 ARG 87 1HH2 ARG 87 -6.292 -19.411 -4.769 481 HH22 ARG 87 2HH2 ARG 87 -4.920 -20.233 -4.094 482 H ARG 88 H ARG 88 -2.405 -12.660 -3.076 483 HA ARG 88 HA ARG 88 -3.003 -13.735 -0.402 484 HB2 ARG 88 1HB ARG 88 -0.317 -13.582 -1.782 485 HB3 ARG 88 2HB ARG 88 -0.518 -13.911 -0.070 486 HG2 ARG 88 1HG ARG 88 -1.611 -15.979 -0.516 487 HG3 ARG 88 2HG ARG 88 -1.704 -15.617 -2.242 488 HD2 ARG 88 1HD ARG 88 0.103 -17.216 -1.661 489 HD3 ARG 88 2HD ARG 88 0.681 -15.755 -2.457 490 HE ARG 88 HE ARG 88 0.766 -15.580 0.402 491 HH11 ARG 88 1HH1 ARG 88 2.478 -16.726 -2.429 492 HH12 ARG 88 2HH1 ARG 88 4.037 -16.653 -1.670 493 HH21 ARG 88 1HH2 ARG 88 2.822 -15.481 1.403 494 HH22 ARG 88 2HH2 ARG 88 4.231 -15.947 0.505 495 H LEU 89 H LEU 89 -2.187 -12.441 1.354 496 HA LEU 89 HA LEU 89 -2.362 -9.669 1.093 497 HB2 LEU 89 1HB LEU 89 -1.039 -11.398 3.177 498 HB3 LEU 89 2HB LEU 89 -1.107 -9.653 3.314 499 HG LEU 89 HG LEU 89 -3.539 -11.427 3.113 500 HD11 LEU 89 1HD1 LEU 89 -2.327 -11.871 5.180 501 HD12 LEU 89 2HD1 LEU 89 -3.824 -10.997 5.503 502 HD13 LEU 89 3HD1 LEU 89 -2.281 -10.144 5.534 503 HD21 LEU 89 1HD2 LEU 89 -3.204 -8.507 3.788 504 HD22 LEU 89 2HD2 LEU 89 -4.719 -9.407 3.864 505 HD23 LEU 89 3HD2 LEU 89 -3.914 -9.165 2.315 506 HA PRO 90 HA PRO 90 1.309 -8.780 -1.124 507 HB2 PRO 90 1HB PRO 90 1.555 -6.128 -0.426 508 HB3 PRO 90 2HB PRO 90 0.468 -6.739 -1.678 509 HG2 PRO 90 1HG PRO 90 -0.128 -6.037 1.169 510 HG3 PRO 90 2HG PRO 90 -1.076 -5.696 -0.291 511 HD2 PRO 90 1HD PRO 90 -1.734 -7.697 1.362 512 HD3 PRO 90 2HD PRO 90 -1.916 -7.857 -0.399 513 H GLN 91 H GLN 91 3.261 -9.370 -0.596 514 HA GLN 91 HA GLN 91 4.485 -8.340 1.871 515 HB2 GLN 91 1HB GLN 91 4.568 -11.131 0.740 516 HB3 GLN 91 2HB GLN 91 5.790 -10.547 1.861 517 HG2 GLN 91 1HG GLN 91 4.064 -10.132 3.529 518 HG3 GLN 91 2HG GLN 91 2.835 -10.707 2.404 519 HE21 GLN 91 1HE2 GLN 91 3.178 -13.744 4.072 520 HE22 GLN 91 2HE2 GLN 91 2.226 -12.319 3.837 521 H ASP 92 H ASP 92 6.545 -7.638 1.708 522 HA ASP 92 HA ASP 92 7.597 -7.083 -0.874 523 HB2 ASP 92 1HB ASP 92 9.582 -6.199 0.341 524 HB3 ASP 92 2HB ASP 92 8.064 -5.521 0.906 525 HA PRO 93 HA PRO 93 9.965 -10.551 -2.134 526 HB2 PRO 93 1HB PRO 93 12.402 -8.848 -1.797 527 HB3 PRO 93 2HB PRO 93 11.937 -9.888 -3.149 528 HG2 PRO 93 1HG PRO 93 11.618 -7.255 -3.300 529 HG3 PRO 93 2HG PRO 93 10.405 -8.359 -3.972 530 HD2 PRO 93 1HD PRO 93 10.288 -6.687 -1.523 531 HD3 PRO 93 2HD PRO 93 8.976 -7.229 -2.585 532 H TRP 94 H TRP 94 11.162 -8.791 0.678 533 HA TRP 94 HA TRP 94 12.895 -10.919 1.537 534 HB2 TRP 94 1HB TRP 94 11.996 -8.462 3.052 535 HB3 TRP 94 2HB TRP 94 13.376 -9.489 3.437 536 HD1 TRP 94 HD1 TRP 94 15.376 -9.513 1.468 537 HE1 TRP 94 HE1 TRP 94 16.225 -7.555 0.026 538 HE3 TRP 94 HE3 TRP 94 11.404 -6.337 1.988 539 HZ2 TRP 94 HZ2 TRP 94 15.331 -5.006 -0.777 540 HZ3 TRP 94 HZ3 TRP 94 11.480 -4.157 0.850 541 HH2 TRP 94 HH2 TRP 94 13.405 -3.507 -0.504 542 H GLY 95 H GLY 95 9.584 -10.077 1.996 543 HA2 GLY 95 1HA GLY 95 8.171 -11.979 2.551 544 HA3 GLY 95 2HA GLY 95 9.366 -12.448 3.744 545 H SER 96 H SER 96 8.598 -9.084 3.520 546 HA SER 96 HA SER 96 7.130 -9.344 6.053 547 HB2 SER 96 1HB SER 96 8.237 -6.796 4.878 548 HB3 SER 96 2HB SER 96 7.772 -7.118 6.549 549 HG SER 96 HG SER 96 10.144 -7.503 5.336 550 H ASP 97 H ASP 97 5.048 -8.799 6.203 551 HA ASP 97 HA ASP 97 3.490 -8.183 3.895 552 HB2 ASP 97 1HB ASP 97 2.713 -7.943 6.816 553 HB3 ASP 97 2HB ASP 97 1.609 -8.014 5.449 554 H TYR 98 H TYR 98 2.988 -6.216 3.069 555 HA TYR 98 HA TYR 98 4.345 -3.904 3.919 556 HB2 TYR 98 1HB TYR 98 1.928 -4.180 2.139 557 HB3 TYR 98 2HB TYR 98 2.752 -2.660 2.421 558 HD1 TYR 98 HD1 TYR 98 4.728 -2.095 1.265 559 HD2 TYR 98 HD2 TYR 98 3.176 -6.040 0.983 560 HE1 TYR 98 HE1 TYR 98 6.307 -2.579 -0.556 561 HE2 TYR 98 HE2 TYR 98 4.752 -6.536 -0.835 562 HH TYR 98 HH TYR 98 6.061 -5.357 -2.516 563 H GLN 99 H GLN 99 3.168 -1.809 4.383 564 HA GLN 99 HA GLN 99 1.074 -2.286 6.380 565 HB2 GLN 99 1HB GLN 99 3.545 -0.590 6.759 566 HB3 GLN 99 2HB GLN 99 2.185 -0.646 7.874 567 HG2 GLN 99 1HG GLN 99 3.942 -2.975 7.140 568 HG3 GLN 99 2HG GLN 99 4.051 -2.030 8.624 569 HE21 GLN 99 1HE2 GLN 99 1.983 -5.204 8.935 570 HE22 GLN 99 2HE2 GLN 99 3.474 -4.893 8.119 571 H LEU 100 H LEU 100 -0.504 -0.881 6.438 572 HA LEU 100 HA LEU 100 -0.269 1.626 4.913 573 HB2 LEU 100 1HB LEU 100 -1.855 -0.001 3.921 574 HB3 LEU 100 2HB LEU 100 -2.712 -0.096 5.442 575 HG LEU 100 HG LEU 100 -3.773 1.290 3.586 576 HD11 LEU 100 1HD1 LEU 100 -4.585 3.010 5.104 577 HD12 LEU 100 2HD1 LEU 100 -3.285 2.635 6.235 578 HD13 LEU 100 3HD1 LEU 100 -4.531 1.433 5.891 579 HD21 LEU 100 1HD2 LEU 100 -2.998 3.500 3.211 580 HD22 LEU 100 2HD2 LEU 100 -1.647 2.405 2.941 581 HD23 LEU 100 3HD2 LEU 100 -1.741 3.334 4.434 582 H LEU 101 H LEU 101 -0.361 3.407 6.220 583 HA LEU 101 HA LEU 101 -1.545 2.983 8.884 584 HB2 LEU 101 1HB LEU 101 1.012 3.116 8.704 585 HB3 LEU 101 2HB LEU 101 0.778 4.818 8.369 586 HG LEU 101 HG LEU 101 1.363 4.244 10.748 587 HD11 LEU 101 1HD1 LEU 101 -0.228 5.805 11.741 588 HD12 LEU 101 2HD1 LEU 101 -1.250 5.678 10.310 589 HD13 LEU 101 3HD1 LEU 101 0.360 6.386 10.185 590 HD21 LEU 101 1HD2 LEU 101 -1.467 3.207 10.837 591 HD22 LEU 101 2HD2 LEU 101 -0.353 3.353 12.196 592 HD23 LEU 101 3HD2 LEU 101 -0.017 2.208 10.898 593 H SER 102 H SER 102 -3.362 4.084 8.987 594 HA SER 102 HA SER 102 -3.381 6.866 8.048 595 HB2 SER 102 1HB SER 102 -5.221 5.279 7.303 596 HB3 SER 102 2HB SER 102 -5.755 5.240 8.981 597 HG SER 102 HG SER 102 -6.554 6.924 7.257 598 HA PRO 103 HA PRO 103 -4.107 8.821 8.482 599 HB2 PRO 103 1HB PRO 103 -2.922 11.003 9.551 600 HB3 PRO 103 2HB PRO 103 -4.612 10.595 9.864 601 HG2 PRO 103 1HG PRO 103 -2.202 10.127 11.573 602 HG3 PRO 103 2HG PRO 103 -3.816 10.691 12.043 603 HD2 PRO 103 1HD PRO 103 -2.988 8.118 12.359 604 HD3 PRO 103 2HD PRO 103 -4.682 8.567 12.088 605 H GLY 104 H GLY 104 -2.678 9.091 6.887 606 HA2 GLY 104 1HA GLY 104 -0.254 7.694 6.981 607 HA3 GLY 104 2HA GLY 104 -0.774 8.749 5.680 608 H GLN 105 H GLN 105 1.819 8.239 7.131 609 HA GLN 105 HA GLN 105 2.576 10.621 8.438 610 HB2 GLN 105 1HB GLN 105 3.797 8.476 8.609 611 HB3 GLN 105 2HB GLN 105 4.285 8.635 6.930 612 HG2 GLN 105 1HG GLN 105 5.543 10.651 7.483 613 HG3 GLN 105 2HG GLN 105 5.041 10.502 9.167 614 HE21 GLN 105 1HE2 GLN 105 8.435 8.984 8.510 615 HE22 GLN 105 2HE2 GLN 105 7.725 10.487 8.028 616 H HIS 106 H HIS 106 2.080 9.828 5.137 617 HA HIS 106 HA HIS 106 3.287 12.391 4.342 618 HB2 HIS 106 1HB HIS 106 3.296 9.833 2.723 619 HB3 HIS 106 2HB HIS 106 3.940 11.385 2.197 620 HD1 HIS 106 HD1 HIS 106 4.884 8.300 3.845 621 HD2 HIS 106 HD2 HIS 106 6.216 12.246 3.870 622 HE1 HIS 106 HE1 HIS 106 7.217 8.229 4.797 623 HE2 HIS 106 HE2 HIS 106 8.055 10.602 4.650 624 H GLY 107 H GLY 107 0.534 11.798 5.078 625 HA2 GLY 107 1HA GLY 107 -0.962 13.297 3.454 626 HA3 GLY 107 2HA GLY 107 -0.938 11.778 2.566 627 H GLN 108 H GLN 108 -3.189 11.481 2.829 628 HA GLN 108 HA GLN 108 -4.375 11.376 5.434 629 HB2 GLN 108 1HB GLN 108 -5.718 11.854 3.423 630 HB3 GLN 108 2HB GLN 108 -5.371 10.242 2.811 631 HG2 GLN 108 1HG GLN 108 -7.593 10.346 3.775 632 HG3 GLN 108 2HG GLN 108 -6.561 9.257 4.698 633 HE21 GLN 108 1HE2 GLN 108 -6.700 11.118 7.651 634 HE22 GLN 108 2HE2 GLN 108 -5.922 9.842 6.776 635 H VAL 109 H VAL 109 -3.121 9.028 3.145 636 HA VAL 109 HA VAL 109 -2.850 7.110 5.350 637 HB VAL 109 HB VAL 109 -3.173 5.276 3.620 638 HG11 VAL 109 1HG1 VAL 109 -4.813 5.769 5.364 639 HG12 VAL 109 2HG1 VAL 109 -5.580 5.229 3.872 640 HG13 VAL 109 3HG1 VAL 109 -5.585 6.942 4.298 641 HG21 VAL 109 1HG2 VAL 109 -4.441 7.541 2.092 642 HG22 VAL 109 2HG2 VAL 109 -4.591 5.831 1.689 643 HG23 VAL 109 3HG2 VAL 109 -3.016 6.620 1.612 644 H ASP 110 H ASP 110 -1.026 5.709 5.158 645 HA ASP 110 HA ASP 110 0.955 6.551 3.151 646 HB2 ASP 110 1HB ASP 110 1.334 7.648 5.382 647 HB3 ASP 110 2HB ASP 110 1.575 6.046 6.068 648 H ILE 111 H ILE 111 1.701 4.876 2.041 649 HA ILE 111 HA ILE 111 1.535 2.194 3.235 650 HB ILE 111 HB ILE 111 1.834 1.377 0.859 651 HG12 ILE 111 1HG1 ILE 111 1.219 4.271 0.220 652 HG13 ILE 111 2HG1 ILE 111 2.728 3.433 -0.123 653 HG21 ILE 111 1HG2 ILE 111 -0.316 1.341 1.980 654 HG22 ILE 111 2HG2 ILE 111 -0.507 1.709 0.267 655 HG23 ILE 111 3HG2 ILE 111 -0.626 2.998 1.462 656 HD11 ILE 111 1HD1 ILE 111 1.431 3.599 -2.129 657 HD12 ILE 111 2HD1 ILE 111 0.037 2.865 -1.337 658 HD13 ILE 111 3HD1 ILE 111 1.492 1.909 -1.623 659 H PHE 112 H PHE 112 3.333 1.087 3.666 660 HA PHE 112 HA PHE 112 5.819 1.697 2.301 661 HB2 PHE 112 1HB PHE 112 7.055 2.035 4.442 662 HB3 PHE 112 2HB PHE 112 5.925 3.328 4.064 663 HD1 PHE 112 HD1 PHE 112 6.827 0.730 6.406 664 HD2 PHE 112 HD2 PHE 112 3.787 3.497 5.310 665 HE1 PHE 112 HE1 PHE 112 5.805 0.483 8.629 666 HE2 PHE 112 HE2 PHE 112 2.760 3.255 7.529 667 HZ PHE 112 HZ PHE 112 3.770 1.747 9.194 668 H SER 113 H SER 113 7.531 0.183 2.803 669 HA SER 113 HA SER 113 6.540 -2.389 3.842 670 HB2 SER 113 1HB SER 113 8.394 -3.393 2.472 671 HB3 SER 113 2HB SER 113 7.163 -2.577 1.509 672 HG SER 113 HG SER 113 8.536 -0.844 1.245 673 H LEU 114 H LEU 114 8.018 -3.628 5.126 674 HA LEU 114 HA LEU 114 9.339 -1.903 7.020 675 HB2 LEU 114 1HB LEU 114 9.057 -4.908 6.993 676 HB3 LEU 114 2HB LEU 114 9.685 -3.965 8.323 677 HG LEU 114 HG LEU 114 7.507 -4.468 8.973 678 HD11 LEU 114 1HD1 LEU 114 6.272 -2.377 8.932 679 HD12 LEU 114 2HD1 LEU 114 7.324 -1.775 7.650 680 HD13 LEU 114 3HD1 LEU 114 7.985 -2.110 9.250 681 HD21 LEU 114 1HD2 LEU 114 5.561 -4.404 7.602 682 HD22 LEU 114 2HD2 LEU 114 6.798 -5.324 6.746 683 HD23 LEU 114 3HD2 LEU 114 6.451 -3.660 6.277 684 H GLY 115 H GLY 115 10.208 -3.894 4.392 685 HA2 GLY 115 1HA GLY 115 12.261 -4.104 3.359 686 HA3 GLY 115 2HA GLY 115 12.990 -3.205 4.685 687 HA PRO 116 HA PRO 116 14.138 -7.719 4.990 688 HB2 PRO 116 1HB PRO 116 16.850 -6.665 5.303 689 HB3 PRO 116 2HB PRO 116 16.242 -7.859 4.157 690 HG2 PRO 116 1HG PRO 116 16.994 -5.371 3.410 691 HG3 PRO 116 2HG PRO 116 15.713 -6.276 2.584 692 HD2 PRO 116 1HD PRO 116 15.486 -4.057 4.574 693 HD3 PRO 116 2HD PRO 116 14.505 -4.379 3.129 694 H ASP 117 H ASP 117 14.788 -4.828 6.822 695 HA ASP 117 HA ASP 117 15.853 -6.325 9.080 696 HB2 ASP 117 1HB ASP 117 16.596 -4.307 9.933 697 HB3 ASP 117 2HB ASP 117 16.653 -4.004 8.205 698 H GLY 118 H GLY 118 12.850 -5.232 7.981 699 HA2 GLY 118 1HA GLY 118 10.771 -5.689 8.843 700 HA3 GLY 118 2HA GLY 118 11.559 -6.455 10.210 701 H VAL 119 H VAL 119 12.615 -3.235 9.735 702 HA VAL 119 HA VAL 119 11.016 -2.476 12.070 703 HB VAL 119 HB VAL 119 13.464 -1.152 10.900 704 HG11 VAL 119 1HG1 VAL 119 11.982 0.508 11.918 705 HG12 VAL 119 2HG1 VAL 119 13.435 0.275 12.890 706 HG13 VAL 119 3HG1 VAL 119 11.910 -0.455 13.394 707 HG21 VAL 119 1HG2 VAL 119 14.549 -1.930 12.956 708 HG22 VAL 119 2HG2 VAL 119 13.916 -3.277 12.009 709 HG23 VAL 119 3HG2 VAL 119 13.051 -2.724 13.442 710 HA PRO 120 HA PRO 120 8.415 -0.033 9.371 711 HB2 PRO 120 1HB PRO 120 6.583 0.586 11.250 712 HB3 PRO 120 2HB PRO 120 6.673 -1.017 10.513 713 HG2 PRO 120 1HG PRO 120 7.694 -0.090 13.162 714 HG3 PRO 120 2HG PRO 120 6.869 -1.603 12.747 715 HD2 PRO 120 1HD PRO 120 9.576 -1.384 13.059 716 HD3 PRO 120 2HD PRO 120 8.800 -2.596 12.021 717 H GLU 121 H GLU 121 8.007 2.108 9.025 718 HA GLU 121 HA GLU 121 8.162 4.367 9.156 719 HB2 GLU 121 1HB GLU 121 8.196 3.817 12.129 720 HB3 GLU 121 2HB GLU 121 8.066 5.423 11.425 721 HG2 GLU 121 1HG GLU 121 5.964 4.841 10.390 722 HG3 GLU 121 2HG GLU 121 6.108 3.180 10.964 723 H SER 122 H SER 122 10.487 2.663 8.969 724 HA SER 122 HA SER 122 12.574 4.163 10.344 725 HB2 SER 122 1HB SER 122 13.870 2.132 9.192 726 HB3 SER 122 2HB SER 122 13.001 1.945 10.717 727 HG SER 122 HG SER 122 12.567 0.643 8.455 728 H ASN 123 H ASN 123 14.701 4.270 8.974 729 HA ASN 123 HA ASN 123 14.265 5.817 6.630 730 HB2 ASN 123 1HB ASN 123 16.271 6.112 8.017 731 HB3 ASN 123 2HB ASN 123 16.785 4.472 7.643 732 HD21 ASN 123 1HD2 ASN 123 18.812 5.931 5.228 733 HD22 ASN 123 2HD2 ASN 123 18.711 5.146 6.766 734 H ASP 124 H ASP 124 15.273 2.499 7.222 735 HA ASP 124 HA ASP 124 15.078 1.832 4.406 736 HB2 ASP 124 1HB ASP 124 16.892 0.786 5.663 737 HB3 ASP 124 2HB ASP 124 15.747 0.115 6.813 738 H ASP 125 H ASP 125 12.890 2.739 4.773 739 HA ASP 125 HA ASP 125 11.026 0.473 4.923 740 HB2 ASP 125 1HB ASP 125 10.875 3.063 6.369 741 HB3 ASP 125 2HB ASP 125 9.389 2.517 5.605 742 H ILE 126 H ILE 126 11.017 0.290 2.696 743 HA ILE 126 HA ILE 126 10.922 2.547 0.959 744 HB ILE 126 HB ILE 126 10.340 -0.354 0.343 745 HG12 ILE 126 1HG1 ILE 126 12.890 1.244 0.029 746 HG13 ILE 126 2HG1 ILE 126 12.601 0.016 1.258 747 HG21 ILE 126 1HG2 ILE 126 11.050 1.905 -1.527 748 HG22 ILE 126 2HG2 ILE 126 9.440 1.214 -1.330 749 HG23 ILE 126 3HG2 ILE 126 10.749 0.225 -1.976 750 HD11 ILE 126 1HD1 ILE 126 13.944 -0.859 -0.555 751 HD12 ILE 126 2HD1 ILE 126 12.685 -0.440 -1.715 752 HD13 ILE 126 3HD1 ILE 126 12.382 -1.673 -0.490 753 H GLY 127 H GLY 127 9.196 3.811 0.863 754 HA2 GLY 127 1HA GLY 127 6.570 2.504 0.623 755 HA3 GLY 127 2HA GLY 127 6.796 3.870 1.703 756 H ASN 128 H ASN 128 5.094 4.825 0.484 757 HA ASN 128 HA ASN 128 5.184 5.262 -2.288 758 HB2 ASN 128 1HB ASN 128 3.354 6.853 -1.900 759 HB3 ASN 128 2HB ASN 128 3.107 5.362 -1.001 760 HD21 ASN 128 1HD2 ASN 128 3.379 6.857 2.180 761 HD22 ASN 128 2HD2 ASN 128 3.478 5.378 1.275 762 H TRP 129 H TRP 129 6.369 7.183 0.413 763 HA TRP 129 HA TRP 129 6.919 9.488 -1.225 764 HB2 TRP 129 1HB TRP 129 6.360 9.510 1.264 765 HB3 TRP 129 2HB TRP 129 8.007 8.947 1.534 766 HD1 TRP 129 HD1 TRP 129 9.958 10.701 1.270 767 HE1 TRP 129 HE1 TRP 129 9.991 13.254 0.995 768 HE3 TRP 129 HE3 TRP 129 5.026 11.468 0.174 769 HZ2 TRP 129 HZ2 TRP 129 8.168 15.328 0.405 770 HZ3 TRP 129 HZ3 TRP 129 4.251 13.767 -0.231 771 HH2 TRP 129 HH2 TRP 129 5.792 15.659 -0.117 772 H THR 130 H THR 130 8.592 6.638 -0.200 773 HA THR 130 HA THR 130 11.250 7.406 -0.461 774 HB THR 130 HB THR 130 10.112 4.712 -1.227 775 HG1 THR 130 HG1 THR 130 10.888 5.714 1.334 776 HG21 THR 130 1HG2 THR 130 12.466 5.004 -1.812 777 HG22 THR 130 2HG2 THR 130 12.294 3.871 -0.471 778 HG23 THR 130 3HG2 THR 130 12.820 5.525 -0.164 779 H ILE 131 H ILE 131 9.069 6.035 -2.923 780 HA ILE 131 HA ILE 131 11.044 6.636 -4.979 781 HB ILE 131 HB ILE 131 9.948 4.461 -5.109 782 HG12 ILE 131 1HG1 ILE 131 9.077 6.298 -7.352 783 HG13 ILE 131 2HG1 ILE 131 10.672 5.570 -7.192 784 HG21 ILE 131 1HG2 ILE 131 7.561 4.277 -5.650 785 HG22 ILE 131 2HG2 ILE 131 7.393 6.021 -5.444 786 HG23 ILE 131 3HG2 ILE 131 7.832 5.009 -4.068 787 HD11 ILE 131 1HD1 ILE 131 9.322 4.379 -8.812 788 HD12 ILE 131 2HD1 ILE 131 8.085 4.087 -7.589 789 HD13 ILE 131 3HD1 ILE 131 9.680 3.353 -7.422 790 H GLY 132 H GLY 132 8.048 7.818 -3.709 791 HA2 GLY 132 1HA GLY 132 7.081 9.886 -3.974 792 HA3 GLY 132 2HA GLY 132 8.387 10.307 -5.071 793 H PHE 133 H PHE 133 6.170 7.575 -5.436 794 HA PHE 133 HA PHE 133 5.563 8.540 -8.097 795 HB2 PHE 133 1HB PHE 133 4.726 6.407 -8.590 796 HB3 PHE 133 2HB PHE 133 6.061 6.088 -7.495 797 HD1 PHE 133 HD1 PHE 133 2.630 5.543 -8.178 798 HD2 PHE 133 HD2 PHE 133 5.462 5.711 -5.009 799 HE1 PHE 133 HE1 PHE 133 1.113 4.230 -6.758 800 HE2 PHE 133 HE2 PHE 133 3.949 4.396 -3.586 801 HZ PHE 133 HZ PHE 133 1.774 3.654 -4.459 802 H HIS 134 H HIS 134 3.791 9.567 -8.686 803 HA HIS 134 HA HIS 134 1.231 9.162 -7.566 804 HB2 HIS 134 1HB HIS 134 0.851 11.343 -6.517 805 HB3 HIS 134 2HB HIS 134 2.143 10.485 -5.688 806 HD1 HIS 134 HD1 HIS 134 1.355 13.658 -7.292 807 HD2 HIS 134 HD2 HIS 134 4.794 11.513 -6.375 808 HE1 HIS 134 HE1 HIS 134 3.243 15.305 -7.463 809 HE2 HIS 134 HE2 HIS 134 5.305 14.010 -6.814 810 H HIS 135 H HIS 135 -0.292 9.853 -8.975 811 HA HIS 135 HA HIS 135 -1.204 10.643 -10.902 812 HB2 HIS 135 1HB HIS 135 -0.477 12.827 -9.720 813 HB3 HIS 135 2HB HIS 135 0.850 12.852 -10.871 814 HD1 HIS 135 HD1 HIS 135 0.370 13.871 -13.114 815 HD2 HIS 135 HD2 HIS 135 -3.089 13.004 -10.979 816 HE1 HIS 135 HE1 HIS 135 -1.509 14.884 -14.435 817 HE2 HIS 135 HE2 HIS 135 -3.562 14.509 -13.028 818 H HIS 136 H HIS 136 1.073 8.798 -10.920 819 HA HIS 136 HA HIS 136 2.393 9.450 -13.462 820 HB2 HIS 136 1HB HIS 136 3.791 8.846 -11.453 821 HB3 HIS 136 2HB HIS 136 3.066 7.245 -11.495 822 HD1 HIS 136 HD1 HIS 136 3.964 5.589 -13.212 823 HD2 HIS 136 HD2 HIS 136 5.616 9.386 -13.559 824 HE1 HIS 136 HE1 HIS 136 5.911 5.338 -14.784 825 HE2 HIS 136 HE2 HIS 136 6.819 7.672 -15.074 826 H HIS 137 H HIS 137 0.235 8.986 -14.439 827 HA HIS 137 HA HIS 137 -0.012 6.112 -15.005 828 HB2 HIS 137 1HB HIS 137 -2.308 8.022 -14.514 829 HB3 HIS 137 2HB HIS 137 -2.478 6.367 -15.083 830 HD1 HIS 137 HD1 HIS 137 -2.276 4.496 -13.349 831 HD2 HIS 137 HD2 HIS 137 -1.641 8.291 -11.787 832 HE1 HIS 137 HE1 HIS 137 -2.315 4.213 -10.853 833 HE2 HIS 137 HE2 HIS 137 -2.142 6.554 -9.942 834 H HIS 138 H HIS 138 1.428 7.846 -16.576 835 HA HIS 138 HA HIS 138 -0.263 8.809 -18.724 836 HB2 HIS 138 1HB HIS 138 2.709 8.834 -18.247 837 HB3 HIS 138 2HB HIS 138 2.032 9.271 -19.809 838 HD1 HIS 138 HD1 HIS 138 3.558 11.428 -18.517 839 HD2 HIS 138 HD2 HIS 138 -0.461 10.812 -17.667 840 HE1 HIS 138 HE1 HIS 138 2.712 13.623 -17.639 841 HE2 HIS 138 HE2 HIS 138 0.331 13.170 -16.957 842 H HIS 139 H HIS 139 -1.051 7.438 -20.165 843 HA HIS 139 HA HIS 139 0.756 5.499 -21.380 844 HB2 HIS 139 1HB HIS 139 -1.070 3.742 -21.295 845 HB3 HIS 139 2HB HIS 139 -0.262 4.085 -19.772 846 HD1 HIS 139 HD1 HIS 139 -1.712 4.709 -17.839 847 HD2 HIS 139 HD2 HIS 139 -3.735 4.921 -21.464 848 HE1 HIS 139 HE1 HIS 139 -4.121 5.111 -17.246 849 HE2 HIS 139 HE2 HIS 139 -5.341 5.135 -19.449 850 H LYS 140 H LYS 140 -0.338 7.997 -22.249 851 HA LYS 140 HA LYS 140 -1.833 7.038 -24.596 852 HB2 LYS 140 1HB LYS 140 -2.043 9.725 -23.228 853 HB3 LYS 140 2HB LYS 140 -2.777 9.343 -24.779 854 HG2 LYS 140 1HG LYS 140 -4.136 7.613 -23.699 855 HG3 LYS 140 2HG LYS 140 -3.409 8.025 -22.146 856 HD2 LYS 140 1HD LYS 140 -4.266 10.340 -22.427 857 HD3 LYS 140 2HD LYS 140 -5.098 9.813 -23.890 858 HE2 LYS 140 1HE LYS 140 -6.371 8.186 -22.577 859 HE3 LYS 140 2HE LYS 140 -5.539 8.716 -21.115 860 HZ1 LYS 140 1HZ LYS 140 -7.664 9.775 -21.230 861 HZ2 LYS 140 2HZ LYS 140 -7.370 10.335 -22.799 862 HZ3 LYS 140 3HZ LYS 140 -6.480 10.950 -21.500
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