NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
471208 | 2kz4 | 16997 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 HT1 MET 1 6.716 -26.760 13.110 2 H2 MET 1 HT2 MET 1 6.148 -26.803 11.520 3 H3 MET 1 HT3 MET 1 5.425 -25.767 12.639 4 HA MET 1 HA MET 1 7.417 -24.473 12.816 5 HB2 MET 1 HB2 MET 1 8.523 -26.316 10.647 6 HB3 MET 1 HB1 MET 1 9.333 -24.887 11.283 7 HG2 MET 1 HG2 MET 1 10.334 -26.858 12.236 8 HG3 MET 1 HG1 MET 1 9.453 -26.018 13.512 9 HE1 MET 1 HE1 MET 1 9.469 -29.112 11.056 10 HE2 MET 1 HE2 MET 1 7.932 -28.358 10.624 11 HE3 MET 1 HE3 MET 1 7.951 -29.906 11.469 12 H ASN 2 HN ASN 2 6.432 -22.693 11.992 13 HA ASN 2 HA ASN 2 4.905 -22.649 9.606 14 HB2 ASN 2 HB2 ASN 2 6.009 -20.386 11.316 15 HB3 ASN 2 HB1 ASN 2 4.998 -20.104 9.903 16 HD21 ASN 2 HD21 ASN 2 4.518 -19.596 12.815 17 HD22 ASN 2 HD22 ASN 2 3.012 -20.367 13.153 18 H ILE 3 HN ILE 3 5.732 -22.976 7.676 19 HA ILE 3 HA ILE 3 8.515 -22.650 7.035 20 HB ILE 3 HB ILE 3 6.238 -23.377 5.132 21 HG12 ILE 3 HG12 ILE 3 6.239 -24.908 7.102 22 HG13 ILE 3 HG11 ILE 3 6.689 -25.754 5.627 23 HG21 ILE 3 HG21 ILE 3 8.320 -22.821 3.946 24 HG22 ILE 3 HG22 ILE 3 8.000 -24.550 3.816 25 HG23 ILE 3 HG23 ILE 3 9.225 -23.962 4.944 26 HD11 ILE 3 HD11 ILE 3 8.591 -24.809 7.774 27 HD12 ILE 3 HD12 ILE 3 9.036 -25.688 6.305 28 HD13 ILE 3 HD13 ILE 3 8.023 -26.459 7.525 29 H GLY 4 HN GLY 4 5.879 -20.519 6.942 30 HA2 GLY 4 HA2 GLY 4 6.615 -18.848 4.700 31 HA3 GLY 4 HA1 GLY 4 5.432 -18.494 5.953 32 H ARG 5 HN ARG 5 8.953 -19.147 6.127 33 HA ARG 5 HA ARG 5 9.456 -16.825 7.788 34 HB2 ARG 5 HB2 ARG 5 11.892 -17.621 7.637 35 HB3 ARG 5 HB1 ARG 5 10.763 -18.697 8.428 36 HG2 ARG 5 HG2 ARG 5 12.232 -20.056 7.147 37 HG3 ARG 5 HG1 ARG 5 10.674 -20.073 6.325 38 HD2 ARG 5 HD2 ARG 5 12.560 -19.929 4.739 39 HD3 ARG 5 HD1 ARG 5 11.521 -18.511 4.650 40 HE ARG 5 HE ARG 5 13.256 -17.384 6.094 41 HH11 ARG 5 HH11 ARG 5 14.189 -19.989 3.942 42 HH12 ARG 5 HH12 ARG 5 15.782 -19.363 3.687 43 HH21 ARG 5 HH21 ARG 5 15.355 -16.582 5.738 44 HH22 ARG 5 HH22 ARG 5 16.442 -17.450 4.701 45 H LEU 6 HN LEU 6 11.536 -15.540 7.086 46 HA LEU 6 HA LEU 6 10.552 -13.984 4.863 47 HB2 LEU 6 HB2 LEU 6 13.021 -13.486 6.580 48 HB3 LEU 6 HB1 LEU 6 12.203 -12.322 5.559 49 HG LEU 6 HG LEU 6 11.570 -11.679 7.712 50 HD11 LEU 6 HD11 LEU 6 9.614 -11.831 6.296 51 HD12 LEU 6 HD12 LEU 6 9.205 -12.109 7.984 52 HD13 LEU 6 HD13 LEU 6 9.298 -13.472 6.865 53 HD21 LEU 6 HD21 LEU 6 11.056 -14.547 8.541 54 HD22 LEU 6 HD22 LEU 6 10.911 -13.106 9.554 55 HD23 LEU 6 HD23 LEU 6 12.487 -13.592 8.941 56 H ARG 7 HN ARG 7 11.124 -14.493 2.830 57 HA ARG 7 HA ARG 7 13.864 -15.475 2.239 58 HB2 ARG 7 HB2 ARG 7 11.267 -16.000 0.718 59 HB3 ARG 7 HB1 ARG 7 12.868 -16.481 0.154 60 HG2 ARG 7 HG2 ARG 7 13.085 -17.873 2.267 61 HG3 ARG 7 HG1 ARG 7 11.379 -17.530 2.582 62 HD2 ARG 7 HD2 ARG 7 11.649 -19.711 1.464 63 HD3 ARG 7 HD1 ARG 7 10.773 -18.585 0.417 64 HE ARG 7 HE ARG 7 13.667 -18.746 0.039 65 HH11 ARG 7 HH11 ARG 7 10.550 -19.829 -1.143 66 HH12 ARG 7 HH12 ARG 7 11.174 -20.298 -2.691 67 HH21 ARG 7 HH21 ARG 7 14.456 -19.361 -2.012 68 HH22 ARG 7 HH22 ARG 7 13.365 -20.036 -3.179 69 H ASP 8 HN ASP 8 11.424 -13.035 1.436 70 HA ASP 8 HA ASP 8 12.897 -12.082 -0.902 71 HB2 ASP 8 HB2 ASP 8 9.984 -11.530 -0.135 72 HB3 ASP 8 HB1 ASP 8 10.759 -11.268 -1.693 73 H ARG 9 HN ARG 9 11.927 -9.531 -1.065 74 HA ARG 9 HA ARG 9 11.965 -8.223 1.573 75 HB2 ARG 9 HB2 ARG 9 13.642 -7.320 -0.803 76 HB3 ARG 9 HB1 ARG 9 13.302 -6.300 0.592 77 HG2 ARG 9 HG2 ARG 9 14.466 -8.004 2.036 78 HG3 ARG 9 HG1 ARG 9 14.917 -8.873 0.563 79 HD2 ARG 9 HD2 ARG 9 15.692 -6.017 1.263 80 HD3 ARG 9 HD1 ARG 9 16.745 -7.428 1.347 81 HE ARG 9 HE ARG 9 16.302 -7.617 -1.157 82 HH11 ARG 9 HH11 ARG 9 16.454 -4.525 0.493 83 HH12 ARG 9 HH12 ARG 9 16.900 -3.653 -0.936 84 HH21 ARG 9 HH21 ARG 9 16.919 -6.456 -3.016 85 HH22 ARG 9 HH22 ARG 9 17.170 -4.743 -2.915 86 H ILE 10 HN ILE 10 10.778 -6.361 1.702 87 HA ILE 10 HA ILE 10 9.149 -5.496 -0.627 88 HB ILE 10 HB ILE 10 7.310 -4.938 0.959 89 HG12 ILE 10 HG12 ILE 10 8.751 -6.596 3.079 90 HG13 ILE 10 HG11 ILE 10 8.830 -4.842 3.041 91 HG21 ILE 10 HG21 ILE 10 8.070 -7.865 0.909 92 HG22 ILE 10 HG22 ILE 10 7.170 -6.984 -0.324 93 HG23 ILE 10 HG23 ILE 10 6.466 -7.225 1.271 94 HD11 ILE 10 HD11 ILE 10 6.414 -4.718 3.349 95 HD12 ILE 10 HD12 ILE 10 7.215 -5.614 4.642 96 HD13 ILE 10 HD13 ILE 10 6.335 -6.485 3.387 97 H THR 11 HN THR 11 8.541 -3.272 -0.577 98 HA THR 11 HA THR 11 10.287 -1.546 1.066 99 HB THR 11 HB THR 11 9.222 -0.899 -1.732 100 HG1 THR 11 HG1 THR 11 11.777 -1.888 -0.912 101 HG21 THR 11 HG21 THR 11 11.404 0.382 -0.018 102 HG22 THR 11 HG22 THR 11 9.804 1.072 -0.315 103 HG23 THR 11 HG23 THR 11 10.943 0.886 -1.648 104 H ILE 12 HN ILE 12 9.220 -0.284 2.373 105 HA ILE 12 HA ILE 12 6.311 -0.110 2.383 106 HB ILE 12 HB ILE 12 8.252 1.234 4.324 107 HG12 ILE 12 HG12 ILE 12 8.712 -1.134 4.435 108 HG13 ILE 12 HG11 ILE 12 7.723 -0.739 5.834 109 HG21 ILE 12 HG21 ILE 12 6.321 1.279 5.888 110 HG22 ILE 12 HG22 ILE 12 5.284 0.608 4.625 111 HG23 ILE 12 HG23 ILE 12 5.998 2.211 4.424 112 HD11 ILE 12 HD11 ILE 12 6.800 -2.101 3.308 113 HD12 ILE 12 HD12 ILE 12 5.754 -1.654 4.660 114 HD13 ILE 12 HD13 ILE 12 7.044 -2.833 4.893 115 H GLN 13 HN GLN 13 5.358 1.330 1.114 116 HA GLN 13 HA GLN 13 6.594 3.933 0.543 117 HB2 GLN 13 HB2 GLN 13 4.246 2.569 -0.839 118 HB3 GLN 13 HB1 GLN 13 4.966 4.114 -1.303 119 HG2 GLN 13 HG2 GLN 13 7.144 2.858 -1.674 120 HG3 GLN 13 HG1 GLN 13 6.232 1.363 -1.446 121 HE21 GLN 13 HE21 GLN 13 7.672 2.352 -3.789 122 HE22 GLN 13 HE22 GLN 13 6.521 2.365 -5.076 123 H THR 14 HN THR 14 6.192 4.962 2.222 124 HA THR 14 HA THR 14 3.529 5.262 3.469 125 HB THR 14 HB THR 14 4.797 7.043 4.928 126 HG1 THR 14 HG1 THR 14 6.688 6.603 3.208 127 HG21 THR 14 HG21 THR 14 4.161 4.803 5.791 128 HG22 THR 14 HG22 THR 14 5.746 5.284 6.397 129 HG23 THR 14 HG23 THR 14 5.622 4.109 5.086 130 H LEU 15 HN LEU 15 2.316 7.387 3.413 131 HA LEU 15 HA LEU 15 2.714 8.576 0.750 132 HB2 LEU 15 HB2 LEU 15 0.552 7.487 1.126 133 HB3 LEU 15 HB1 LEU 15 0.297 8.403 2.600 134 HG LEU 15 HG LEU 15 0.088 10.500 1.258 135 HD11 LEU 15 HD11 LEU 15 -0.153 10.429 -1.178 136 HD12 LEU 15 HD12 LEU 15 0.291 8.721 -1.186 137 HD13 LEU 15 HD13 LEU 15 1.461 9.937 -0.675 138 HD21 LEU 15 HD21 LEU 15 -1.931 9.234 1.863 139 HD22 LEU 15 HD22 LEU 15 -1.821 8.317 0.359 140 HD23 LEU 15 HD23 LEU 15 -2.126 10.056 0.316 141 H LYS 16 HN LYS 16 3.990 10.375 0.955 142 HA LYS 16 HA LYS 16 3.827 12.194 3.178 143 HB2 LYS 16 HB2 LYS 16 5.948 11.538 2.003 144 HB3 LYS 16 HB1 LYS 16 5.374 12.340 0.550 145 HG2 LYS 16 HG2 LYS 16 5.470 14.506 1.647 146 HG3 LYS 16 HG1 LYS 16 5.859 13.744 3.196 147 HD2 LYS 16 HD2 LYS 16 8.006 12.924 2.264 148 HD3 LYS 16 HD1 LYS 16 7.604 13.642 0.699 149 HE2 LYS 16 HE2 LYS 16 9.180 15.065 1.937 150 HE3 LYS 16 HE1 LYS 16 7.635 15.885 1.714 151 HZ1 LYS 16 HZ1 LYS 16 8.471 14.497 4.205 152 HZ2 LYS 16 HZ2 LYS 16 7.041 15.374 3.976 153 HZ3 LYS 16 HZ3 LYS 16 8.533 16.164 3.949 154 H GLN 17 HN GLN 17 1.992 13.368 3.200 155 HA GLN 17 HA GLN 17 0.961 14.693 0.767 156 HB2 GLN 17 HB2 GLN 17 -0.300 14.301 3.525 157 HB3 GLN 17 HB1 GLN 17 -1.066 15.153 2.188 158 HG2 GLN 17 HG2 GLN 17 -1.077 13.064 0.865 159 HG3 GLN 17 HG1 GLN 17 -0.304 12.217 2.206 160 HE21 GLN 17 HE21 GLN 17 -3.267 13.698 1.072 161 HE22 GLN 17 HE22 GLN 17 -4.306 13.018 2.273 162 H THR 18 HN THR 18 2.544 16.256 0.633 163 HA THR 18 HA THR 18 3.069 18.064 2.897 164 HB THR 18 HB THR 18 4.481 17.870 0.193 165 HG1 THR 18 HG1 THR 18 4.868 16.663 2.677 166 HG21 THR 18 HG21 THR 18 4.654 20.158 1.131 167 HG22 THR 18 HG22 THR 18 6.209 19.327 1.211 168 HG23 THR 18 HG23 THR 18 5.221 19.487 2.662 169 H ARG 19 HN ARG 19 1.955 19.915 3.025 170 HA ARG 19 HA ARG 19 0.204 20.815 0.955 171 HB2 ARG 19 HB2 ARG 19 -0.154 20.955 3.481 172 HB3 ARG 19 HB1 ARG 19 0.990 22.290 3.501 173 HG2 ARG 19 HG2 ARG 19 -0.495 23.678 2.200 174 HG3 ARG 19 HG1 ARG 19 -1.566 22.316 1.861 175 HD2 ARG 19 HD2 ARG 19 -2.466 23.859 3.606 176 HD3 ARG 19 HD1 ARG 19 -2.253 22.204 4.187 177 HE ARG 19 HE ARG 19 0.064 23.707 4.759 178 HH11 ARG 19 HH11 ARG 19 -3.262 23.408 5.893 179 HH12 ARG 19 HH12 ARG 19 -2.881 24.002 7.479 180 HH21 ARG 19 HH21 ARG 19 0.535 24.430 6.807 181 HH22 ARG 19 HH22 ARG 19 -0.721 24.582 7.997 182 H ASP 20 HN ASP 20 0.284 23.329 0.461 183 HA ASP 20 HA ASP 20 2.997 23.961 -0.620 184 HB2 ASP 20 HB2 ASP 20 1.236 23.325 -2.364 185 HB3 ASP 20 HB1 ASP 20 0.318 24.747 -1.876 186 H ILE 21 HN ILE 21 3.462 26.364 -0.846 187 HA ILE 21 HA ILE 21 2.773 27.864 1.445 188 HB ILE 21 HB ILE 21 4.969 27.902 0.173 189 HG12 ILE 21 HG12 ILE 21 3.685 30.625 0.710 190 HG13 ILE 21 HG11 ILE 21 4.501 29.614 1.896 191 HG21 ILE 21 HG21 ILE 21 4.064 28.035 -2.100 192 HG22 ILE 21 HG22 ILE 21 5.209 29.344 -1.804 193 HG23 ILE 21 HG23 ILE 21 3.472 29.671 -1.794 194 HD11 ILE 21 HD11 ILE 21 6.608 29.918 0.657 195 HD12 ILE 21 HD12 ILE 21 5.913 31.431 1.234 196 HD13 ILE 21 HD13 ILE 21 5.765 30.989 -0.466 197 H THR 22 HN THR 22 0.548 27.250 -0.727 198 HA THR 22 HA THR 22 -0.829 29.776 -0.480 199 HB THR 22 HB THR 22 -1.765 29.458 -2.874 200 HG1 THR 22 HG1 THR 22 0.655 28.053 -3.356 201 HG21 THR 22 HG21 THR 22 -0.215 31.327 -2.373 202 HG22 THR 22 HG22 THR 22 0.053 30.695 -4.001 203 HG23 THR 22 HG23 THR 22 1.164 30.268 -2.697 204 H GLY 23 HN GLY 23 -0.703 26.392 -1.409 205 HA2 GLY 23 HA2 GLY 23 -1.469 24.945 0.403 206 HA3 GLY 23 HA1 GLY 23 -2.920 25.909 0.507 207 H GLU 24 HN GLU 24 -1.168 23.810 -1.883 208 HA GLU 24 HA GLU 24 -3.656 22.331 -2.236 209 HB2 GLU 24 HB2 GLU 24 -1.074 22.347 -3.893 210 HB3 GLU 24 HB1 GLU 24 -2.491 21.343 -4.214 211 HG2 GLU 24 HG2 GLU 24 -3.798 23.204 -4.871 212 HG3 GLU 24 HG1 GLU 24 -2.634 24.364 -4.226 213 H ILE 25 HN ILE 25 -3.369 19.974 -2.006 214 HA ILE 25 HA ILE 25 -1.211 19.212 -0.142 215 HB ILE 25 HB ILE 25 -3.751 17.712 -0.934 216 HG12 ILE 25 HG12 ILE 25 -4.204 19.754 0.413 217 HG13 ILE 25 HG11 ILE 25 -4.576 18.294 1.321 218 HG21 ILE 25 HG21 ILE 25 -1.986 16.121 -0.313 219 HG22 ILE 25 HG22 ILE 25 -3.228 16.167 0.937 220 HG23 ILE 25 HG23 ILE 25 -1.690 16.996 1.193 221 HD11 ILE 25 HD11 ILE 25 -2.102 20.002 1.657 222 HD12 ILE 25 HD12 ILE 25 -2.480 18.537 2.570 223 HD13 ILE 25 HD13 ILE 25 -3.509 19.958 2.720 224 H LEU 26 HN LEU 26 0.584 18.645 -1.206 225 HA LEU 26 HA LEU 26 0.584 17.329 -3.795 226 HB2 LEU 26 HB2 LEU 26 2.840 18.290 -1.980 227 HB3 LEU 26 HB1 LEU 26 3.134 17.406 -3.464 228 HG LEU 26 HG LEU 26 3.507 19.789 -3.797 229 HD11 LEU 26 HD11 LEU 26 1.049 18.856 -5.292 230 HD12 LEU 26 HD12 LEU 26 2.731 18.509 -5.699 231 HD13 LEU 26 HD13 LEU 26 2.135 20.163 -5.776 232 HD21 LEU 26 HD21 LEU 26 2.019 20.721 -2.089 233 HD22 LEU 26 HD22 LEU 26 0.604 20.270 -3.045 234 HD23 LEU 26 HD23 LEU 26 1.742 21.476 -3.657 235 H GLU 27 HN GLU 27 -0.347 15.371 -3.340 236 HA GLU 27 HA GLU 27 0.656 13.600 -1.279 237 HB2 GLU 27 HB2 GLU 27 -1.314 13.028 -3.546 238 HB3 GLU 27 HB1 GLU 27 -0.971 11.972 -2.166 239 HG2 GLU 27 HG2 GLU 27 -1.810 13.754 -0.646 240 HG3 GLU 27 HG1 GLU 27 -2.225 14.727 -2.051 241 H THR 28 HN THR 28 2.321 12.429 -1.529 242 HA THR 28 HA THR 28 3.248 11.287 -4.065 243 HB THR 28 HB THR 28 5.660 11.963 -3.436 244 HG1 THR 28 HG1 THR 28 4.182 13.396 -1.528 245 HG21 THR 28 HG21 THR 28 3.796 14.259 -4.180 246 HG22 THR 28 HG22 THR 28 4.518 13.102 -5.303 247 HG23 THR 28 HG23 THR 28 5.551 14.223 -4.418 248 H TRP 29 HN TRP 29 4.950 9.572 -3.571 249 HA TRP 29 HA TRP 29 4.204 8.259 -1.020 250 HB2 TRP 29 HB2 TRP 29 4.871 7.035 -3.749 251 HB3 TRP 29 HB1 TRP 29 4.676 6.096 -2.263 252 HD1 TRP 29 HD1 TRP 29 2.634 8.001 -4.876 253 HE1 TRP 29 HE1 TRP 29 0.140 7.536 -4.481 254 HE3 TRP 29 HE3 TRP 29 2.975 5.534 -0.423 255 HZ2 TRP 29 HZ2 TRP 29 -1.492 6.320 -2.519 256 HZ3 TRP 29 HZ3 TRP 29 0.909 4.761 0.668 257 HH2 TRP 29 HH2 TRP 29 -1.286 5.145 -0.361 258 H GLU 30 HN GLU 30 5.780 8.739 0.300 259 HA GLU 30 HA GLU 30 8.553 8.996 -0.518 260 HB2 GLU 30 HB2 GLU 30 9.060 9.351 1.899 261 HB3 GLU 30 HB1 GLU 30 7.909 10.494 1.232 262 HG2 GLU 30 HG2 GLU 30 6.069 9.391 2.362 263 HG3 GLU 30 HG1 GLU 30 7.136 8.106 2.922 264 H ASP 31 HN ASP 31 9.146 7.205 -1.331 265 HA ASP 31 HA ASP 31 8.687 4.554 -0.517 266 HB2 ASP 31 HB2 ASP 31 9.420 5.420 -2.803 267 HB3 ASP 31 HB1 ASP 31 11.030 5.672 -2.139 268 H GLY 32 HN GLY 32 9.928 3.227 1.062 269 HA2 GLY 32 HA2 GLY 32 11.394 5.077 2.875 270 HA3 GLY 32 HA1 GLY 32 10.062 4.074 3.419 271 H HIS 33 HN HIS 33 10.510 2.110 4.203 272 HA HIS 33 HA HIS 33 13.358 1.306 4.342 273 HB2 HIS 33 HB2 HIS 33 11.076 0.247 6.081 274 HB3 HIS 33 HB1 HIS 33 12.806 0.178 6.412 275 HD1 HIS 33 HD1 HIS 33 13.845 2.221 7.617 276 HD2 HIS 33 HD2 HIS 33 9.871 2.767 6.532 277 HE1 HIS 33 HE1 HIS 33 13.112 4.344 8.753 278 HE2 HIS 33 HE2 HIS 33 10.672 4.579 8.183 279 H THR 34 HN THR 34 14.014 -0.637 3.325 280 HA THR 34 HA THR 34 11.908 -2.374 2.249 281 HB THR 34 HB THR 34 14.835 -2.110 1.419 282 HG1 THR 34 HG1 THR 34 13.459 -0.279 0.908 283 HG21 THR 34 HG21 THR 34 12.533 -3.591 0.091 284 HG22 THR 34 HG22 THR 34 13.871 -4.356 0.951 285 HG23 THR 34 HG23 THR 34 14.190 -3.459 -0.531 286 H LEU 35 HN LEU 35 11.488 -3.806 3.946 287 HA LEU 35 HA LEU 35 13.765 -5.001 5.372 288 HB2 LEU 35 HB2 LEU 35 12.092 -5.644 7.084 289 HB3 LEU 35 HB1 LEU 35 12.214 -3.915 6.855 290 HG LEU 35 HG LEU 35 10.016 -5.356 5.363 291 HD11 LEU 35 HD11 LEU 35 8.491 -5.245 7.264 292 HD12 LEU 35 HD12 LEU 35 9.806 -4.728 8.323 293 HD13 LEU 35 HD13 LEU 35 9.830 -6.341 7.600 294 HD21 LEU 35 HD21 LEU 35 10.373 -2.947 5.042 295 HD22 LEU 35 HD22 LEU 35 10.121 -2.673 6.767 296 HD23 LEU 35 HD23 LEU 35 8.804 -3.286 5.764 297 H TRP 36 HN TRP 36 13.401 -7.136 6.214 298 HA TRP 36 HA TRP 36 13.161 -9.179 4.327 299 HB2 TRP 36 HB2 TRP 36 12.975 -9.381 7.356 300 HB3 TRP 36 HB1 TRP 36 13.181 -10.757 6.281 301 HD1 TRP 36 HD1 TRP 36 15.246 -9.078 8.574 302 HE1 TRP 36 HE1 TRP 36 17.713 -8.992 7.869 303 HE3 TRP 36 HE3 TRP 36 14.738 -10.138 3.573 304 HZ2 TRP 36 HZ2 TRP 36 19.247 -9.313 5.544 305 HZ3 TRP 36 HZ3 TRP 36 16.764 -10.223 2.190 306 HH2 TRP 36 HH2 TRP 36 18.979 -9.822 3.151 307 H ALA 37 HN ALA 37 11.533 -10.093 3.456 308 HA ALA 37 HA ALA 37 8.900 -10.430 4.790 309 HB1 ALA 37 HB1 ALA 37 7.706 -9.705 2.773 310 HB2 ALA 37 HB2 ALA 37 9.240 -9.369 1.962 311 HB3 ALA 37 HB3 ALA 37 8.757 -8.416 3.365 312 H SER 38 HN SER 38 7.478 -12.116 3.692 313 HA SER 38 HA SER 38 8.751 -13.672 1.568 314 HB2 SER 38 HB2 SER 38 8.668 -14.891 3.776 315 HB3 SER 38 HB1 SER 38 6.922 -14.659 3.814 316 HG SER 38 HG SER 38 8.018 -16.693 2.885 317 H VAL 39 HN VAL 39 7.634 -12.938 -0.230 318 HA VAL 39 HA VAL 39 4.915 -11.856 0.093 319 HB VAL 39 HB VAL 39 6.766 -11.657 -2.335 320 HG11 VAL 39 HG11 VAL 39 4.294 -10.038 -1.591 321 HG12 VAL 39 HG12 VAL 39 4.383 -11.266 -2.854 322 HG13 VAL 39 HG13 VAL 39 5.307 -9.776 -3.011 323 HG21 VAL 39 HG21 VAL 39 7.853 -10.614 -0.381 324 HG22 VAL 39 HG22 VAL 39 6.416 -9.625 -0.102 325 HG23 VAL 39 HG23 VAL 39 7.372 -9.400 -1.571 326 H ASN 40 HN ASN 40 3.492 -13.695 -0.034 327 HA ASN 40 HA ASN 40 3.794 -15.420 -2.426 328 HB2 ASN 40 HB2 ASN 40 2.764 -16.186 0.355 329 HB3 ASN 40 HB1 ASN 40 2.733 -17.233 -1.057 330 HD21 ASN 40 HD21 ASN 40 5.278 -15.168 0.391 331 HD22 ASN 40 HD22 ASN 40 6.439 -16.435 0.535 332 H MET 41 HN MET 41 2.100 -15.121 -3.784 333 HA MET 41 HA MET 41 -0.296 -13.728 -3.084 334 HB2 MET 41 HB2 MET 41 0.331 -15.490 -5.490 335 HB3 MET 41 HB1 MET 41 -1.113 -14.493 -5.338 336 HG2 MET 41 HG2 MET 41 0.296 -12.465 -5.275 337 HG3 MET 41 HG1 MET 41 1.741 -13.463 -5.422 338 HE1 MET 41 HE1 MET 41 -1.552 -12.225 -7.265 339 HE2 MET 41 HE2 MET 41 -1.724 -13.980 -7.297 340 HE3 MET 41 HE3 MET 41 -1.425 -13.094 -8.794 341 H VAL 42 HN VAL 42 -2.462 -14.640 -3.180 342 HA VAL 42 HA VAL 42 -2.747 -16.871 -1.406 343 HB VAL 42 HB VAL 42 -5.173 -16.432 -1.479 344 HG11 VAL 42 HG11 VAL 42 -3.537 -13.897 -1.190 345 HG12 VAL 42 HG12 VAL 42 -3.879 -15.086 0.066 346 HG13 VAL 42 HG13 VAL 42 -5.187 -14.105 -0.599 347 HG21 VAL 42 HG21 VAL 42 -6.139 -14.586 -2.848 348 HG22 VAL 42 HG22 VAL 42 -5.471 -15.868 -3.858 349 HG23 VAL 42 HG23 VAL 42 -4.577 -14.363 -3.639 350 H SER 43 HN SER 43 -4.011 -18.734 -1.772 351 HA SER 43 HA SER 43 -4.502 -19.588 -4.548 352 HB2 SER 43 HB2 SER 43 -4.979 -21.003 -1.868 353 HB3 SER 43 HB1 SER 43 -5.185 -21.728 -3.468 354 HG SER 43 HG SER 43 -2.767 -20.740 -3.465 355 H SER 44 HN SER 44 -6.849 -20.650 -4.726 356 HA SER 44 HA SER 44 -8.863 -18.699 -4.295 357 HB2 SER 44 HB2 SER 44 -9.189 -21.677 -4.891 358 HB3 SER 44 HB1 SER 44 -10.437 -20.440 -5.086 359 HG SER 44 HG SER 44 -9.645 -20.142 -6.989 360 H LYS 45 HN LYS 45 -7.519 -21.100 -2.223 361 HA LYS 45 HA LYS 45 -9.563 -21.979 -0.605 362 HB2 LYS 45 HB2 LYS 45 -7.160 -22.748 -0.627 363 HB3 LYS 45 HB1 LYS 45 -6.724 -21.300 0.273 364 HG2 LYS 45 HG2 LYS 45 -6.855 -23.161 1.790 365 HG3 LYS 45 HG1 LYS 45 -8.173 -22.050 2.138 366 HD2 LYS 45 HD2 LYS 45 -9.057 -24.267 2.304 367 HD3 LYS 45 HD1 LYS 45 -9.715 -23.577 0.823 368 HE2 LYS 45 HE2 LYS 45 -7.323 -25.448 0.919 369 HE3 LYS 45 HE1 LYS 45 -8.980 -25.984 0.650 370 HZ1 LYS 45 HZ1 LYS 45 -7.364 -24.218 -1.105 371 HZ2 LYS 45 HZ2 LYS 45 -9.010 -24.533 -1.343 372 HZ3 LYS 45 HZ3 LYS 45 -7.887 -25.788 -1.429 373 H GLU 46 HN GLU 46 -7.409 -19.195 0.151 374 HA GLU 46 HA GLU 46 -9.050 -18.420 2.420 375 HB2 GLU 46 HB2 GLU 46 -7.427 -16.439 2.589 376 HB3 GLU 46 HB1 GLU 46 -6.771 -18.045 2.863 377 HG2 GLU 46 HG2 GLU 46 -6.576 -16.915 0.094 378 HG3 GLU 46 HG1 GLU 46 -5.549 -16.207 1.331 379 H ALA 47 HN ALA 47 -8.992 -17.544 -0.934 380 HA ALA 47 HA ALA 47 -10.369 -15.029 -0.727 381 HB1 ALA 47 HB1 ALA 47 -9.147 -15.668 -2.777 382 HB2 ALA 47 HB2 ALA 47 -10.844 -15.346 -3.139 383 HB3 ALA 47 HB3 ALA 47 -10.266 -17.011 -3.033 384 H ILE 48 HN ILE 48 -11.539 -18.172 -1.842 385 HA ILE 48 HA ILE 48 -14.281 -18.011 -1.548 386 HB ILE 48 HB ILE 48 -12.530 -20.454 -1.033 387 HG12 ILE 48 HG12 ILE 48 -14.086 -19.666 -3.539 388 HG13 ILE 48 HG11 ILE 48 -12.351 -19.465 -3.329 389 HG21 ILE 48 HG21 ILE 48 -15.534 -20.427 -1.508 390 HG22 ILE 48 HG22 ILE 48 -14.728 -20.851 0.003 391 HG23 ILE 48 HG23 ILE 48 -14.520 -21.871 -1.419 392 HD11 ILE 48 HD11 ILE 48 -13.834 -22.094 -3.401 393 HD12 ILE 48 HD12 ILE 48 -12.093 -21.899 -3.179 394 HD13 ILE 48 HD13 ILE 48 -12.853 -21.401 -4.691 395 H SER 49 HN SER 49 -11.917 -18.691 1.007 396 HA SER 49 HA SER 49 -13.703 -19.291 3.127 397 HB2 SER 49 HB2 SER 49 -11.317 -19.846 3.260 398 HB3 SER 49 HB1 SER 49 -10.881 -18.139 3.215 399 HG SER 49 HG SER 49 -12.605 -19.136 5.211 400 H SER 50 HN SER 50 -12.145 -16.264 2.112 401 HA SER 50 HA SER 50 -13.398 -14.630 4.168 402 HB2 SER 50 HB2 SER 50 -11.088 -14.192 3.285 403 HB3 SER 50 HB1 SER 50 -11.777 -13.816 1.704 404 HG SER 50 HG SER 50 -13.011 -12.357 3.599 405 H GLY 51 HN GLY 51 -14.457 -15.939 1.274 406 HA2 GLY 51 HA2 GLY 51 -16.508 -15.784 0.249 407 HA3 GLY 51 HA1 GLY 51 -16.894 -14.388 1.244 408 H ALA 52 HN ALA 52 -16.134 -12.302 0.588 409 HA ALA 52 HA ALA 52 -15.044 -12.005 -2.131 410 HB1 ALA 52 HB1 ALA 52 -17.499 -12.061 -2.393 411 HB2 ALA 52 HB2 ALA 52 -16.847 -10.471 -2.798 412 HB3 ALA 52 HB3 ALA 52 -17.658 -10.727 -1.250 413 H GLU 53 HN GLU 53 -14.618 -11.297 0.985 414 HA GLU 53 HA GLU 53 -14.006 -8.474 0.876 415 HB2 GLU 53 HB2 GLU 53 -14.572 -9.521 3.026 416 HB3 GLU 53 HB1 GLU 53 -13.205 -10.617 2.885 417 HG2 GLU 53 HG2 GLU 53 -11.643 -8.735 3.081 418 HG3 GLU 53 HG1 GLU 53 -12.993 -7.604 3.141 419 H LEU 54 HN LEU 54 -11.979 -11.446 1.091 420 HA LEU 54 HA LEU 54 -9.845 -10.153 -0.449 421 HB2 LEU 54 HB2 LEU 54 -10.028 -12.985 0.671 422 HB3 LEU 54 HB1 LEU 54 -8.649 -12.349 -0.214 423 HG LEU 54 HG LEU 54 -9.610 -11.489 2.543 424 HD11 LEU 54 HD11 LEU 54 -8.347 -13.577 2.539 425 HD12 LEU 54 HD12 LEU 54 -7.418 -12.291 3.303 426 HD13 LEU 54 HD13 LEU 54 -7.019 -12.810 1.661 427 HD21 LEU 54 HD21 LEU 54 -8.907 -9.480 1.367 428 HD22 LEU 54 HD22 LEU 54 -7.397 -10.247 0.870 429 HD23 LEU 54 HD23 LEU 54 -7.699 -9.906 2.576 430 H ALA 55 HN ALA 55 -8.996 -11.389 -2.323 431 HA ALA 55 HA ALA 55 -11.097 -12.628 -3.982 432 HB1 ALA 55 HB1 ALA 55 -11.074 -10.219 -4.514 433 HB2 ALA 55 HB2 ALA 55 -10.473 -11.166 -5.875 434 HB3 ALA 55 HB3 ALA 55 -9.342 -10.289 -4.839 435 H ILE 56 HN ILE 56 -10.238 -13.790 -5.822 436 HA ILE 56 HA ILE 56 -7.823 -15.237 -5.339 437 HB ILE 56 HB ILE 56 -9.499 -15.023 -7.899 438 HG12 ILE 56 HG12 ILE 56 -9.559 -17.133 -5.685 439 HG13 ILE 56 HG11 ILE 56 -10.788 -15.904 -5.959 440 HG21 ILE 56 HG21 ILE 56 -7.386 -17.105 -7.190 441 HG22 ILE 56 HG22 ILE 56 -7.231 -15.845 -8.416 442 HG23 ILE 56 HG23 ILE 56 -8.421 -17.126 -8.620 443 HD11 ILE 56 HD11 ILE 56 -10.101 -18.186 -7.818 444 HD12 ILE 56 HD12 ILE 56 -11.320 -16.947 -8.130 445 HD13 ILE 56 HD13 ILE 56 -11.519 -18.061 -6.778 446 H GLY 57 HN GLY 57 -5.825 -14.419 -5.628 447 HA2 GLY 57 HA2 GLY 57 -4.145 -13.452 -7.104 448 HA3 GLY 57 HA1 GLY 57 -5.334 -12.267 -7.627 449 H THR 58 HN THR 58 -5.989 -12.423 -4.470 450 HA THR 58 HA THR 58 -4.713 -10.103 -3.570 451 HB THR 58 HB THR 58 -5.852 -12.473 -2.027 452 HG1 THR 58 HG1 THR 58 -7.034 -10.682 -3.387 453 HG21 THR 58 HG21 THR 58 -5.893 -11.079 0.005 454 HG22 THR 58 HG22 THR 58 -5.037 -9.788 -0.837 455 HG23 THR 58 HG23 THR 58 -4.230 -11.326 -0.530 456 H VAL 59 HN VAL 59 -2.713 -9.692 -2.782 457 HA VAL 59 HA VAL 59 -0.703 -11.824 -2.774 458 HB VAL 59 HB VAL 59 -0.350 -8.796 -2.682 459 HG11 VAL 59 HG11 VAL 59 1.727 -10.980 -3.158 460 HG12 VAL 59 HG12 VAL 59 1.609 -9.949 -1.730 461 HG13 VAL 59 HG13 VAL 59 2.020 -9.242 -3.293 462 HG21 VAL 59 HG21 VAL 59 -1.429 -9.499 -4.786 463 HG22 VAL 59 HG22 VAL 59 -0.154 -10.691 -5.066 464 HG23 VAL 59 HG23 VAL 59 0.229 -8.969 -5.092 465 H ARG 60 HN ARG 60 -0.395 -12.779 -0.827 466 HA ARG 60 HA ARG 60 -0.631 -11.279 1.684 467 HB2 ARG 60 HB2 ARG 60 0.103 -14.197 1.184 468 HB3 ARG 60 HB1 ARG 60 -0.097 -13.467 2.779 469 HG2 ARG 60 HG2 ARG 60 -2.455 -13.029 2.306 470 HG3 ARG 60 HG1 ARG 60 -2.266 -13.678 0.673 471 HD2 ARG 60 HD2 ARG 60 -3.294 -15.361 2.079 472 HD3 ARG 60 HD1 ARG 60 -1.660 -15.880 1.653 473 HE ARG 60 HE ARG 60 -1.801 -14.490 4.177 474 HH11 ARG 60 HH11 ARG 60 -1.942 -17.626 2.622 475 HH12 ARG 60 HH12 ARG 60 -1.791 -18.494 4.119 476 HH21 ARG 60 HH21 ARG 60 -1.608 -15.627 6.091 477 HH22 ARG 60 HH22 ARG 60 -1.586 -17.361 6.073 478 H ILE 61 HN ILE 61 1.060 -10.943 3.043 479 HA ILE 61 HA ILE 61 3.834 -11.190 2.063 480 HB ILE 61 HB ILE 61 2.514 -8.524 2.771 481 HG12 ILE 61 HG12 ILE 61 3.837 -9.318 0.130 482 HG13 ILE 61 HG11 ILE 61 2.112 -9.480 0.418 483 HG21 ILE 61 HG21 ILE 61 4.776 -8.578 3.708 484 HG22 ILE 61 HG22 ILE 61 4.731 -7.480 2.330 485 HG23 ILE 61 HG23 ILE 61 5.442 -9.085 2.156 486 HD11 ILE 61 HD11 ILE 61 3.662 -6.923 0.435 487 HD12 ILE 61 HD12 ILE 61 1.933 -7.079 0.726 488 HD13 ILE 61 HD13 ILE 61 2.609 -7.504 -0.846 489 H TRP 62 HN TRP 62 4.743 -12.195 3.641 490 HA TRP 62 HA TRP 62 3.881 -11.888 6.441 491 HB2 TRP 62 HB2 TRP 62 5.371 -14.081 4.928 492 HB3 TRP 62 HB1 TRP 62 5.295 -14.049 6.688 493 HD1 TRP 62 HD1 TRP 62 2.307 -13.392 4.239 494 HE1 TRP 62 HE1 TRP 62 0.474 -15.088 4.804 495 HE3 TRP 62 HE3 TRP 62 4.813 -16.138 7.729 496 HZ2 TRP 62 HZ2 TRP 62 0.141 -17.322 6.503 497 HZ3 TRP 62 HZ3 TRP 62 3.672 -18.031 8.791 498 HH2 TRP 62 HH2 TRP 62 1.380 -18.612 8.182 499 H ILE 63 HN ILE 63 5.074 -10.597 7.698 500 HA ILE 63 HA ILE 63 8.016 -10.446 7.344 501 HB ILE 63 HB ILE 63 7.990 -8.048 7.962 502 HG12 ILE 63 HG12 ILE 63 4.957 -8.100 7.611 503 HG13 ILE 63 HG11 ILE 63 5.756 -8.082 9.176 504 HG21 ILE 63 HG21 ILE 63 6.322 -8.606 5.486 505 HG22 ILE 63 HG22 ILE 63 8.084 -8.618 5.588 506 HG23 ILE 63 HG23 ILE 63 7.203 -7.111 5.825 507 HD11 ILE 63 HD11 ILE 63 5.941 -5.915 7.079 508 HD12 ILE 63 HD12 ILE 63 6.718 -5.886 8.667 509 HD13 ILE 63 HD13 ILE 63 4.957 -5.874 8.541 510 H ARG 64 HN ARG 64 9.140 -10.159 9.403 511 HA ARG 64 HA ARG 64 8.040 -10.961 11.807 512 HB2 ARG 64 HB2 ARG 64 10.249 -8.894 11.425 513 HB3 ARG 64 HB1 ARG 64 9.921 -9.763 12.924 514 HG2 ARG 64 HG2 ARG 64 10.451 -11.905 11.787 515 HG3 ARG 64 HG1 ARG 64 10.801 -11.018 10.302 516 HD2 ARG 64 HD2 ARG 64 12.298 -10.719 12.928 517 HD3 ARG 64 HD1 ARG 64 12.850 -11.645 11.531 518 HE ARG 64 HE ARG 64 12.324 -8.896 10.873 519 HH11 ARG 64 HH11 ARG 64 14.751 -11.066 12.205 520 HH12 ARG 64 HH12 ARG 64 16.062 -9.976 11.900 521 HH21 ARG 64 HH21 ARG 64 14.065 -7.487 10.492 522 HH22 ARG 64 HH22 ARG 64 15.674 -7.934 10.959 523 H TYR 65 HN TYR 65 7.556 -9.650 13.792 524 HA TYR 65 HA TYR 65 5.211 -8.193 13.319 525 HB2 TYR 65 HB2 TYR 65 5.676 -9.493 15.404 526 HB3 TYR 65 HB1 TYR 65 6.822 -8.256 15.908 527 HD1 TYR 65 HD1 TYR 65 5.996 -6.021 16.705 528 HD2 TYR 65 HD2 TYR 65 3.244 -9.061 15.480 529 HE1 TYR 65 HE1 TYR 65 4.142 -4.742 17.694 530 HE2 TYR 65 HE2 TYR 65 1.402 -7.785 16.482 531 HH TYR 65 HH TYR 65 1.061 -6.072 18.224 532 H ARG 66 HN ARG 66 5.080 -6.234 12.453 533 HA ARG 66 HA ARG 66 6.620 -4.008 13.595 534 HB2 ARG 66 HB2 ARG 66 7.803 -4.678 11.512 535 HB3 ARG 66 HB1 ARG 66 6.313 -4.490 10.590 536 HG2 ARG 66 HG2 ARG 66 6.300 -2.082 11.046 537 HG3 ARG 66 HG1 ARG 66 7.720 -2.245 12.083 538 HD2 ARG 66 HD2 ARG 66 9.077 -2.924 10.153 539 HD3 ARG 66 HD1 ARG 66 7.657 -2.848 9.105 540 HE ARG 66 HE ARG 66 7.578 -0.430 9.528 541 HH11 ARG 66 HH11 ARG 66 10.653 -2.019 10.164 542 HH12 ARG 66 HH12 ARG 66 11.569 -0.553 10.037 543 HH21 ARG 66 HH21 ARG 66 8.788 1.472 9.356 544 HH22 ARG 66 HH22 ARG 66 10.507 1.417 9.598 545 H LYS 67 HN LYS 67 4.993 -2.990 14.586 546 HA LYS 67 HA LYS 67 2.298 -2.748 13.536 547 HB2 LYS 67 HB2 LYS 67 1.830 -1.541 15.641 548 HB3 LYS 67 HB1 LYS 67 2.664 -3.062 15.942 549 HG2 LYS 67 HG2 LYS 67 4.777 -1.877 16.325 550 HG3 LYS 67 HG1 LYS 67 4.013 -0.335 15.927 551 HD2 LYS 67 HD2 LYS 67 2.504 -0.591 17.888 552 HD3 LYS 67 HD1 LYS 67 3.299 -2.120 18.285 553 HE2 LYS 67 HE2 LYS 67 4.166 -0.291 19.680 554 HE3 LYS 67 HE1 LYS 67 5.433 -0.928 18.633 555 HZ1 LYS 67 HZ1 LYS 67 5.109 0.953 17.150 556 HZ2 LYS 67 HZ2 LYS 67 5.455 1.482 18.714 557 HZ3 LYS 67 HZ3 LYS 67 3.871 1.559 18.138 558 H ASP 68 HN ASP 68 4.869 -1.299 12.420 559 HA ASP 68 HA ASP 68 4.123 1.522 12.462 560 HB2 ASP 68 HB2 ASP 68 6.486 1.054 12.656 561 HB3 ASP 68 HB1 ASP 68 6.450 -0.078 11.315 562 H ILE 69 HN ILE 69 3.791 -1.291 10.443 563 HA ILE 69 HA ILE 69 3.378 -0.028 7.912 564 HB ILE 69 HB ILE 69 2.278 -2.757 8.744 565 HG12 ILE 69 HG12 ILE 69 4.637 -2.808 9.329 566 HG13 ILE 69 HG11 ILE 69 4.427 -3.735 7.848 567 HG21 ILE 69 HG21 ILE 69 2.489 -3.293 6.328 568 HG22 ILE 69 HG22 ILE 69 3.061 -1.654 6.009 569 HG23 ILE 69 HG23 ILE 69 1.417 -1.918 6.600 570 HD11 ILE 69 HD11 ILE 69 5.558 -0.956 8.116 571 HD12 ILE 69 HD12 ILE 69 5.231 -1.761 6.579 572 HD13 ILE 69 HD13 ILE 69 6.415 -2.440 7.692 573 H ASN 70 HN ASN 70 1.521 0.853 7.102 574 HA ASN 70 HA ASN 70 -0.983 0.613 8.691 575 HB2 ASN 70 HB2 ASN 70 0.240 2.907 8.766 576 HB3 ASN 70 HB1 ASN 70 -0.188 3.076 7.062 577 HD21 ASN 70 HD21 ASN 70 -1.478 2.772 10.331 578 HD22 ASN 70 HD22 ASN 70 -3.031 3.450 9.985 579 H ALA 71 HN ALA 71 -2.948 0.953 7.390 580 HA ALA 71 HA ALA 71 -2.975 -0.697 5.081 581 HB1 ALA 71 HB1 ALA 71 -5.185 1.053 6.221 582 HB2 ALA 71 HB2 ALA 71 -4.846 -0.617 6.678 583 HB3 ALA 71 HB3 ALA 71 -5.397 -0.249 5.045 584 H THR 72 HN THR 72 -2.688 2.729 5.534 585 HA THR 72 HA THR 72 -3.393 3.497 2.832 586 HB THR 72 HB THR 72 -2.641 5.789 3.522 587 HG1 THR 72 HG1 THR 72 -2.328 5.041 6.183 588 HG21 THR 72 HG21 THR 72 -4.461 4.467 5.568 589 HG22 THR 72 HG22 THR 72 -4.971 5.121 4.009 590 HG23 THR 72 HG23 THR 72 -4.340 6.200 5.253 591 H SER 73 HN SER 73 -0.638 2.126 4.229 592 HA SER 73 HA SER 73 1.321 3.328 2.483 593 HB2 SER 73 HB2 SER 73 1.514 0.751 4.115 594 HB3 SER 73 HB1 SER 73 2.862 1.661 3.422 595 HG SER 73 HG SER 73 1.937 3.461 4.796 596 H ARG 74 HN ARG 74 2.380 2.190 0.752 597 HA ARG 74 HA ARG 74 0.906 -0.084 -0.455 598 HB2 ARG 74 HB2 ARG 74 2.474 2.175 -1.759 599 HB3 ARG 74 HB1 ARG 74 2.073 0.692 -2.628 600 HG2 ARG 74 HG2 ARG 74 -0.264 1.131 -2.501 601 HG3 ARG 74 HG1 ARG 74 -0.034 2.436 -1.332 602 HD2 ARG 74 HD2 ARG 74 -0.533 3.254 -3.625 603 HD3 ARG 74 HD1 ARG 74 1.007 3.832 -2.995 604 HE ARG 74 HE ARG 74 1.042 1.490 -4.760 605 HH11 ARG 74 HH11 ARG 74 1.632 4.924 -4.373 606 HH12 ARG 74 HH12 ARG 74 2.574 5.054 -5.817 607 HH21 ARG 74 HH21 ARG 74 2.267 1.689 -6.681 608 HH22 ARG 74 HH22 ARG 74 2.946 3.222 -7.109 609 H ILE 75 HN ILE 75 2.153 -1.792 -1.281 610 HA ILE 75 HA ILE 75 4.908 -1.961 -0.201 611 HB ILE 75 HB ILE 75 2.967 -4.245 -0.790 612 HG12 ILE 75 HG12 ILE 75 2.219 -2.942 1.191 613 HG13 ILE 75 HG11 ILE 75 2.773 -4.545 1.654 614 HG21 ILE 75 HG21 ILE 75 5.240 -4.964 -1.113 615 HG22 ILE 75 HG22 ILE 75 4.709 -5.601 0.440 616 HG23 ILE 75 HG23 ILE 75 5.763 -4.197 0.386 617 HD11 ILE 75 HD11 ILE 75 4.889 -3.570 2.421 618 HD12 ILE 75 HD12 ILE 75 3.489 -2.888 3.247 619 HD13 ILE 75 HD13 ILE 75 4.298 -1.967 1.980 620 H LYS 76 HN LYS 76 6.380 -1.790 -1.771 621 HA LYS 76 HA LYS 76 5.861 -2.935 -4.460 622 HB2 LYS 76 HB2 LYS 76 6.541 -0.589 -4.495 623 HB3 LYS 76 HB1 LYS 76 7.944 -0.940 -3.491 624 HG2 LYS 76 HG2 LYS 76 8.959 -2.257 -5.295 625 HG3 LYS 76 HG1 LYS 76 7.518 -2.037 -6.296 626 HD2 LYS 76 HD2 LYS 76 9.453 -0.514 -6.888 627 HD3 LYS 76 HD1 LYS 76 7.941 0.325 -6.539 628 HE2 LYS 76 HE2 LYS 76 8.711 0.894 -4.308 629 HE3 LYS 76 HE1 LYS 76 10.187 -0.043 -4.534 630 HZ1 LYS 76 HZ1 LYS 76 10.900 1.509 -6.201 631 HZ2 LYS 76 HZ2 LYS 76 10.489 2.349 -4.791 632 HZ3 LYS 76 HZ3 LYS 76 9.436 2.352 -6.110 633 H VAL 77 HN VAL 77 6.847 -4.811 -4.959 634 HA VAL 77 HA VAL 77 8.554 -6.099 -2.992 635 HB VAL 77 HB VAL 77 7.563 -7.082 -5.701 636 HG11 VAL 77 HG11 VAL 77 9.645 -8.263 -5.128 637 HG12 VAL 77 HG12 VAL 77 8.262 -9.348 -4.970 638 HG13 VAL 77 HG13 VAL 77 9.002 -8.647 -3.529 639 HG21 VAL 77 HG21 VAL 77 5.791 -6.722 -4.017 640 HG22 VAL 77 HG22 VAL 77 6.649 -7.777 -2.894 641 HG23 VAL 77 HG23 VAL 77 5.991 -8.434 -4.396 642 H SER 78 HN SER 78 10.486 -5.304 -2.874 643 HA SER 78 HA SER 78 12.140 -4.305 -4.961 644 HB2 SER 78 HB2 SER 78 12.391 -3.648 -2.574 645 HB3 SER 78 HB1 SER 78 12.984 -5.264 -2.197 646 HG SER 78 HG SER 78 14.295 -3.963 -4.264 647 H THR 79 HN THR 79 11.536 -7.449 -3.813 648 HA THR 79 HA THR 79 12.850 -8.766 -5.929 649 HB THR 79 HB THR 79 14.943 -8.280 -4.708 650 HG1 THR 79 HG1 THR 79 14.681 -10.275 -5.877 651 HG21 THR 79 HG21 THR 79 15.461 -9.311 -2.535 652 HG22 THR 79 HG22 THR 79 13.822 -9.954 -2.432 653 HG23 THR 79 HG23 THR 79 14.087 -8.211 -2.387 654 H GLY 80 HN GLY 80 12.019 -10.785 -6.201 655 HA2 GLY 80 HA2 GLY 80 11.171 -12.770 -4.665 656 HA3 GLY 80 HA1 GLY 80 9.887 -11.605 -4.367 657 HA PRO 81 HA PRO 81 8.597 -14.143 -8.085 658 HB2 PRO 81 HB2 PRO 81 5.992 -14.518 -7.347 659 HB3 PRO 81 HB1 PRO 81 7.302 -15.525 -6.711 660 HG2 PRO 81 HG2 PRO 81 5.977 -13.122 -5.443 661 HG3 PRO 81 HG1 PRO 81 6.335 -14.702 -4.712 662 HD2 PRO 81 HD2 PRO 81 7.942 -12.550 -4.318 663 HD3 PRO 81 HD1 PRO 81 8.603 -14.199 -4.424 664 H LEU 82 HN LEU 82 7.534 -11.214 -6.613 665 HA LEU 82 HA LEU 82 6.309 -10.209 -9.117 666 HB2 LEU 82 HB2 LEU 82 5.644 -9.493 -6.226 667 HB3 LEU 82 HB1 LEU 82 4.947 -8.712 -7.639 668 HG LEU 82 HG LEU 82 4.561 -11.648 -6.910 669 HD11 LEU 82 HD11 LEU 82 3.450 -10.199 -5.279 670 HD12 LEU 82 HD12 LEU 82 2.263 -11.025 -6.284 671 HD13 LEU 82 HD13 LEU 82 2.628 -9.322 -6.577 672 HD21 LEU 82 HD21 LEU 82 2.832 -11.660 -8.670 673 HD22 LEU 82 HD22 LEU 82 4.421 -11.282 -9.333 674 HD23 LEU 82 HD23 LEU 82 3.236 -9.992 -9.095 675 H ALA 83 HN ALA 83 9.096 -10.193 -8.550 676 HA ALA 83 HA ALA 83 10.091 -7.892 -7.245 677 HB1 ALA 83 HB1 ALA 83 12.228 -8.409 -8.341 678 HB2 ALA 83 HB2 ALA 83 11.412 -9.506 -9.456 679 HB3 ALA 83 HB3 ALA 83 11.467 -9.883 -7.734 680 H GLY 84 HN GLY 84 9.224 -5.951 -7.856 681 HA2 GLY 84 HA2 GLY 84 9.889 -4.036 -9.320 682 HA3 GLY 84 HA1 GLY 84 9.470 -5.046 -10.696 683 H ARG 85 HN ARG 85 7.167 -6.079 -8.926 684 HA ARG 85 HA ARG 85 5.130 -4.251 -9.870 685 HB2 ARG 85 HB2 ARG 85 4.944 -6.803 -8.217 686 HB3 ARG 85 HB1 ARG 85 3.562 -5.937 -8.877 687 HG2 ARG 85 HG2 ARG 85 5.743 -7.044 -10.667 688 HG3 ARG 85 HG1 ARG 85 4.396 -8.039 -10.123 689 HD2 ARG 85 HD2 ARG 85 3.915 -7.192 -12.345 690 HD3 ARG 85 HD1 ARG 85 2.807 -6.444 -11.199 691 HE ARG 85 HE ARG 85 5.116 -5.124 -12.508 692 HH11 ARG 85 HH11 ARG 85 2.124 -4.791 -10.699 693 HH12 ARG 85 HH12 ARG 85 1.914 -3.126 -11.136 694 HH21 ARG 85 HH21 ARG 85 4.818 -2.922 -13.027 695 HH22 ARG 85 HH22 ARG 85 3.424 -2.075 -12.439 696 H VAL 86 HN VAL 86 3.997 -2.766 -8.652 697 HA VAL 86 HA VAL 86 4.507 -2.622 -5.748 698 HB VAL 86 HB VAL 86 3.122 -0.470 -7.367 699 HG11 VAL 86 HG11 VAL 86 3.743 0.982 -5.448 700 HG12 VAL 86 HG12 VAL 86 4.490 -0.407 -4.655 701 HG13 VAL 86 HG13 VAL 86 2.750 -0.389 -4.945 702 HG21 VAL 86 HG21 VAL 86 5.250 0.768 -7.511 703 HG22 VAL 86 HG22 VAL 86 5.341 -0.763 -8.379 704 HG23 VAL 86 HG23 VAL 86 6.094 -0.607 -6.795 705 H LEU 87 HN LEU 87 3.125 -3.855 -4.827 706 HA LEU 87 HA LEU 87 0.285 -4.048 -5.460 707 HB2 LEU 87 HB2 LEU 87 1.639 -5.185 -2.973 708 HB3 LEU 87 HB1 LEU 87 0.103 -5.660 -3.678 709 HG LEU 87 HG LEU 87 1.593 -7.435 -4.150 710 HD11 LEU 87 HD11 LEU 87 1.453 -5.809 -6.699 711 HD12 LEU 87 HD12 LEU 87 0.219 -6.905 -6.075 712 HD13 LEU 87 HD13 LEU 87 1.779 -7.540 -6.582 713 HD21 LEU 87 HD21 LEU 87 3.709 -6.269 -3.667 714 HD22 LEU 87 HD22 LEU 87 3.648 -5.518 -5.264 715 HD23 LEU 87 HD23 LEU 87 3.788 -7.269 -5.114 716 H ASN 88 HN ASN 88 -1.387 -3.452 -3.888 717 HA ASN 88 HA ASN 88 -0.676 -1.188 -2.101 718 HB2 ASN 88 HB2 ASN 88 -3.341 -1.617 -3.532 719 HB3 ASN 88 HB1 ASN 88 -2.865 -0.208 -2.594 720 HD21 ASN 88 HD21 ASN 88 -0.123 -0.225 -3.927 721 HD22 ASN 88 HD22 ASN 88 -0.428 0.411 -5.501 722 H ILE 89 HN ILE 89 -1.852 -1.132 -0.034 723 HA ILE 89 HA ILE 89 -2.288 -3.865 0.942 724 HB ILE 89 HB ILE 89 -2.158 -1.231 2.481 725 HG12 ILE 89 HG12 ILE 89 -0.060 -3.425 2.210 726 HG13 ILE 89 HG11 ILE 89 -0.001 -1.866 1.393 727 HG21 ILE 89 HG21 ILE 89 -2.192 -4.068 3.587 728 HG22 ILE 89 HG22 ILE 89 -3.504 -2.894 3.708 729 HG23 ILE 89 HG23 ILE 89 -1.976 -2.592 4.534 730 HD11 ILE 89 HD11 ILE 89 1.470 -1.861 3.295 731 HD12 ILE 89 HD12 ILE 89 0.159 -2.339 4.370 732 HD13 ILE 89 HD13 ILE 89 0.132 -0.746 3.596 733 H ILE 90 HN ILE 90 -4.249 -4.685 1.198 734 HA ILE 90 HA ILE 90 -6.636 -2.940 1.056 735 HB ILE 90 HB ILE 90 -7.887 -5.037 0.379 736 HG12 ILE 90 HG12 ILE 90 -5.106 -6.215 -0.050 737 HG13 ILE 90 HG11 ILE 90 -6.186 -6.698 1.241 738 HG21 ILE 90 HG21 ILE 90 -7.162 -4.955 -1.969 739 HG22 ILE 90 HG22 ILE 90 -5.664 -4.151 -1.493 740 HG23 ILE 90 HG23 ILE 90 -7.215 -3.337 -1.262 741 HD11 ILE 90 HD11 ILE 90 -6.673 -7.054 -1.715 742 HD12 ILE 90 HD12 ILE 90 -7.784 -7.546 -0.429 743 HD13 ILE 90 HD13 ILE 90 -6.195 -8.302 -0.566 744 H GLY 91 HN GLY 91 -8.182 -3.042 2.579 745 HA2 GLY 91 HA2 GLY 91 -9.247 -3.521 4.565 746 HA3 GLY 91 HA1 GLY 91 -8.296 -4.997 4.686 747 H GLN 92 HN GLN 92 -6.675 -5.043 6.166 748 HA GLN 92 HA GLN 92 -5.326 -2.647 7.105 749 HB2 GLN 92 HB2 GLN 92 -5.906 -2.981 9.476 750 HB3 GLN 92 HB1 GLN 92 -7.360 -2.694 8.526 751 HG2 GLN 92 HG2 GLN 92 -7.840 -5.136 8.551 752 HG3 GLN 92 HG1 GLN 92 -6.382 -5.392 9.512 753 HE21 GLN 92 HE21 GLN 92 -9.682 -4.246 9.557 754 HE22 GLN 92 HE22 GLN 92 -9.817 -4.106 11.273 755 HA PRO 93 HA PRO 93 -2.072 -5.830 7.505 756 HB2 PRO 93 HB2 PRO 93 -0.285 -4.441 9.090 757 HB3 PRO 93 HB1 PRO 93 -0.455 -4.175 7.350 758 HG2 PRO 93 HG2 PRO 93 -1.674 -2.624 9.626 759 HG3 PRO 93 HG1 PRO 93 -0.865 -2.007 8.167 760 HD2 PRO 93 HD2 PRO 93 -3.558 -2.069 8.352 761 HD3 PRO 93 HD1 PRO 93 -2.746 -2.418 6.810 762 H LEU 94 HN LEU 94 -2.883 -7.460 8.691 763 HA LEU 94 HA LEU 94 -3.908 -7.112 11.387 764 HB2 LEU 94 HB2 LEU 94 -5.047 -8.437 9.496 765 HB3 LEU 94 HB1 LEU 94 -3.815 -9.659 9.706 766 HG LEU 94 HG LEU 94 -6.071 -10.169 10.741 767 HD11 LEU 94 HD11 LEU 94 -3.789 -10.184 12.714 768 HD12 LEU 94 HD12 LEU 94 -4.085 -11.390 11.459 769 HD13 LEU 94 HD13 LEU 94 -5.247 -11.184 12.770 770 HD21 LEU 94 HD21 LEU 94 -6.686 -9.127 12.869 771 HD22 LEU 94 HD22 LEU 94 -6.627 -7.942 11.566 772 HD23 LEU 94 HD23 LEU 94 -5.311 -8.022 12.742 773 HA PRO 95 HA PRO 95 0.155 -8.531 13.022 774 HB2 PRO 95 HB2 PRO 95 -0.411 -8.211 15.694 775 HB3 PRO 95 HB1 PRO 95 0.001 -6.860 14.629 776 HG2 PRO 95 HG2 PRO 95 -2.720 -7.780 15.543 777 HG3 PRO 95 HG1 PRO 95 -2.072 -6.130 15.436 778 HD2 PRO 95 HD2 PRO 95 -3.705 -7.176 13.516 779 HD3 PRO 95 HD1 PRO 95 -2.437 -5.988 13.136 780 H ASP 96 HN ASP 96 0.801 -10.605 13.378 781 HA ASP 96 HA ASP 96 -0.787 -12.851 13.714 782 HB2 ASP 96 HB2 ASP 96 1.533 -13.034 13.058 783 HB3 ASP 96 HB1 ASP 96 2.085 -12.308 14.562 784 H ALA 97 HN ALA 97 -1.549 -14.015 15.474 785 HA ALA 97 HA ALA 97 -2.455 -12.591 17.721 786 HB1 ALA 97 HB1 ALA 97 -3.369 -14.746 18.476 787 HB2 ALA 97 HB2 ALA 97 -2.352 -15.603 17.314 788 HB3 ALA 97 HB3 ALA 97 -3.630 -14.528 16.744 789 H ALA 98 HN ALA 98 0.300 -14.799 17.361 790 HA ALA 98 HA ALA 98 0.999 -14.709 20.202 791 HB1 ALA 98 HB1 ALA 98 2.833 -16.236 19.593 792 HB2 ALA 98 HB2 ALA 98 2.460 -16.023 17.879 793 HB3 ALA 98 HB3 ALA 98 1.297 -16.820 18.941 794 H ARG 99 HN ARG 99 1.442 -12.666 17.593 795 HA ARG 99 HA ARG 99 2.578 -10.761 17.239 796 HB2 ARG 99 HB2 ARG 99 3.072 -11.136 20.184 797 HB3 ARG 99 HB1 ARG 99 4.033 -9.923 19.359 798 HG2 ARG 99 HG2 ARG 99 2.067 -8.923 20.438 799 HG3 ARG 99 HG1 ARG 99 2.021 -8.712 18.692 800 HD2 ARG 99 HD2 ARG 99 0.417 -10.617 18.545 801 HD3 ARG 99 HD1 ARG 99 0.412 -10.713 20.306 802 HE ARG 99 HE ARG 99 -0.416 -8.342 20.247 803 HH11 ARG 99 HH11 ARG 99 -1.174 -10.509 17.587 804 HH12 ARG 99 HH12 ARG 99 -2.575 -9.611 17.110 805 HH21 ARG 99 HH21 ARG 99 -2.210 -7.193 19.612 806 HH22 ARG 99 HH22 ARG 99 -3.171 -7.732 18.273 807 H THR 100 HN THR 100 3.799 -13.436 16.735 808 HA THR 100 HA THR 100 6.687 -13.029 16.948 809 HB THR 100 HB THR 100 6.872 -15.251 15.870 810 HG1 THR 100 HG1 THR 100 4.032 -15.374 15.820 811 HG21 THR 100 HG21 THR 100 5.700 -16.621 17.572 812 HG22 THR 100 HG22 THR 100 4.749 -15.215 18.050 813 HG23 THR 100 HG23 THR 100 6.495 -15.230 18.308 814 H ARG 101 HN ARG 101 4.234 -12.121 14.787 815 HA ARG 101 HA ARG 101 6.036 -11.167 12.782 816 HB2 ARG 101 HB2 ARG 101 5.341 -12.535 10.893 817 HB3 ARG 101 HB1 ARG 101 5.923 -13.606 12.165 818 HG2 ARG 101 HG2 ARG 101 3.603 -14.130 12.797 819 HG3 ARG 101 HG1 ARG 101 3.007 -13.023 11.559 820 HD2 ARG 101 HD2 ARG 101 2.818 -15.232 10.714 821 HD3 ARG 101 HD1 ARG 101 4.129 -14.442 9.838 822 HE ARG 101 HE ARG 101 4.499 -16.439 12.012 823 HH11 ARG 101 HH11 ARG 101 5.749 -14.921 9.093 824 HH12 ARG 101 HH12 ARG 101 7.015 -16.082 8.885 825 HH21 ARG 101 HH21 ARG 101 6.213 -17.900 11.779 826 HH22 ARG 101 HH22 ARG 101 7.305 -17.761 10.443 827 H LEU 102 HN LEU 102 4.386 -10.749 10.673 828 HA LEU 102 HA LEU 102 1.934 -9.472 11.607 829 HB2 LEU 102 HB2 LEU 102 4.260 -7.953 11.324 830 HB3 LEU 102 HB1 LEU 102 3.586 -7.804 9.720 831 HG LEU 102 HG LEU 102 2.911 -5.880 10.940 832 HD11 LEU 102 HD11 LEU 102 0.481 -5.939 10.942 833 HD12 LEU 102 HD12 LEU 102 0.497 -7.706 10.912 834 HD13 LEU 102 HD13 LEU 102 1.127 -6.793 9.544 835 HD21 LEU 102 HD21 LEU 102 1.770 -5.929 13.117 836 HD22 LEU 102 HD22 LEU 102 3.366 -6.668 13.197 837 HD23 LEU 102 HD23 LEU 102 1.928 -7.689 13.165 838 H GLU 103 HN GLU 103 0.353 -10.029 10.235 839 HA GLU 103 HA GLU 103 0.881 -11.175 7.599 840 HB2 GLU 103 HB2 GLU 103 -0.773 -12.269 9.108 841 HB3 GLU 103 HB1 GLU 103 -1.717 -10.789 9.168 842 HG2 GLU 103 HG2 GLU 103 -2.852 -12.259 7.679 843 HG3 GLU 103 HG1 GLU 103 -2.086 -11.027 6.674 844 H ILE 104 HN ILE 104 1.543 -9.307 6.374 845 HA ILE 104 HA ILE 104 -0.296 -7.068 6.061 846 HB ILE 104 HB ILE 104 2.122 -7.730 4.305 847 HG12 ILE 104 HG12 ILE 104 2.963 -7.665 6.600 848 HG13 ILE 104 HG11 ILE 104 3.501 -6.233 5.734 849 HG21 ILE 104 HG21 ILE 104 0.740 -5.072 4.858 850 HG22 ILE 104 HG22 ILE 104 0.614 -6.023 3.376 851 HG23 ILE 104 HG23 ILE 104 2.159 -5.303 3.829 852 HD11 ILE 104 HD11 ILE 104 1.758 -4.929 6.859 853 HD12 ILE 104 HD12 ILE 104 2.880 -5.694 7.984 854 HD13 ILE 104 HD13 ILE 104 1.269 -6.375 7.749 855 H LEU 105 HN LEU 105 -2.011 -7.256 4.739 856 HA LEU 105 HA LEU 105 -1.920 -9.165 2.477 857 HB2 LEU 105 HB2 LEU 105 -4.459 -8.997 2.474 858 HB3 LEU 105 HB1 LEU 105 -3.744 -9.894 3.799 859 HG LEU 105 HG LEU 105 -4.594 -6.996 4.156 860 HD11 LEU 105 HD11 LEU 105 -6.745 -7.764 5.039 861 HD12 LEU 105 HD12 LEU 105 -6.367 -9.426 4.571 862 HD13 LEU 105 HD13 LEU 105 -6.571 -8.178 3.336 863 HD21 LEU 105 HD21 LEU 105 -4.209 -9.287 6.115 864 HD22 LEU 105 HD22 LEU 105 -4.785 -7.674 6.530 865 HD23 LEU 105 HD23 LEU 105 -3.157 -7.883 5.903 866 H CYS 106 HN CYS 106 -2.664 -8.497 0.574 867 HA CYS 106 HA CYS 106 -2.876 -5.693 -0.134 868 HB2 CYS 106 HB2 CYS 106 -0.356 -7.263 -0.873 869 HB3 CYS 106 HB1 CYS 106 -0.794 -5.695 -1.546 870 HG CYS 106 HG CYS 106 -0.870 -5.178 1.604 871 H ARG 107 HN ARG 107 -2.944 -5.499 -2.546 872 HA ARG 107 HA ARG 107 -3.244 -7.987 -4.068 873 HB2 ARG 107 HB2 ARG 107 -5.295 -7.365 -5.139 874 HB3 ARG 107 HB1 ARG 107 -5.600 -7.161 -3.418 875 HG2 ARG 107 HG2 ARG 107 -5.301 -4.713 -3.648 876 HG3 ARG 107 HG1 ARG 107 -4.932 -4.917 -5.363 877 HD2 ARG 107 HD2 ARG 107 -7.203 -5.883 -5.706 878 HD3 ARG 107 HD1 ARG 107 -7.574 -5.558 -4.010 879 HE ARG 107 HE ARG 107 -6.731 -3.176 -5.290 880 HH11 ARG 107 HH11 ARG 107 -9.525 -5.324 -5.089 881 HH12 ARG 107 HH12 ARG 107 -10.639 -4.104 -5.624 882 HH21 ARG 107 HH21 ARG 107 -8.197 -1.611 -5.965 883 HH22 ARG 107 HH22 ARG 107 -9.879 -1.998 -6.125 884 H GLU 108 HN GLU 108 -2.770 -7.643 -6.309 885 HA GLU 108 HA GLU 108 -0.952 -5.696 -7.016 886 HB2 GLU 108 HB2 GLU 108 -1.259 -7.770 -8.299 887 HB3 GLU 108 HB1 GLU 108 -2.849 -7.239 -8.830 888 HG2 GLU 108 HG2 GLU 108 -1.131 -6.973 -10.579 889 HG3 GLU 108 HG1 GLU 108 -1.894 -5.450 -10.124 890 H GLY 109 HN GLY 109 -1.048 -3.632 -7.568 891 HA2 GLY 109 HA2 GLY 109 -3.596 -2.196 -7.455 892 HA3 GLY 109 HA1 GLY 109 -1.980 -1.503 -7.424 893 H ALA 110 HN ALA 110 -3.769 -3.600 -9.676 894 HA ALA 110 HA ALA 110 -2.628 -2.774 -12.060 895 HB1 ALA 110 HB1 ALA 110 -3.966 -4.816 -11.761 896 HB2 ALA 110 HB2 ALA 110 -4.527 -3.871 -13.138 897 HB3 ALA 110 HB3 ALA 110 -5.435 -3.846 -11.622 898 H GLU 111 HN GLU 111 -2.453 -0.622 -12.435 899 HA GLU 111 HA GLU 111 -4.695 1.219 -12.032 900 HB2 GLU 111 HB2 GLU 111 -3.029 2.986 -12.189 901 HB3 GLU 111 HB1 GLU 111 -2.436 1.737 -11.104 902 HG2 GLU 111 HG2 GLU 111 -1.056 0.833 -13.018 903 HG3 GLU 111 HG1 GLU 111 -1.547 2.236 -13.960 904 H LYS 112 HN LYS 112 -3.666 -0.668 -14.546 905 HA LYS 112 HA LYS 112 -3.726 1.081 -16.782 906 HB2 LYS 112 HB2 LYS 112 -2.686 -1.139 -16.923 907 HB3 LYS 112 HB1 LYS 112 -4.231 -1.923 -16.611 908 HG2 LYS 112 HG2 LYS 112 -5.101 -1.074 -18.767 909 HG3 LYS 112 HG1 LYS 112 -3.560 -0.266 -19.077 910 HD2 LYS 112 HD2 LYS 112 -3.865 -3.280 -18.710 911 HD3 LYS 112 HD1 LYS 112 -3.875 -2.477 -20.283 912 HE2 LYS 112 HE2 LYS 112 -1.554 -2.366 -18.312 913 HE3 LYS 112 HE1 LYS 112 -1.660 -3.469 -19.685 914 HZ1 LYS 112 HZ1 LYS 112 -1.645 -0.505 -19.863 915 HZ2 LYS 112 HZ2 LYS 112 -1.727 -1.574 -21.170 916 HZ3 LYS 112 HZ3 LYS 112 -0.340 -1.528 -20.209 Start of MODEL 2 1 H1 MET 1 HT1 MET 1 9.108 -22.316 13.207 2 H2 MET 1 HT2 MET 1 10.301 -23.483 12.971 3 H3 MET 1 HT3 MET 1 8.675 -23.934 12.988 4 HA MET 1 HA MET 1 9.917 -22.143 11.009 5 HB2 MET 1 HB2 MET 1 9.767 -24.009 9.411 6 HB3 MET 1 HB1 MET 1 10.775 -24.452 10.780 7 HG2 MET 1 HG2 MET 1 7.896 -25.295 10.396 8 HG3 MET 1 HG1 MET 1 9.307 -26.287 10.029 9 HE1 MET 1 HE1 MET 1 8.359 -28.273 11.523 10 HE2 MET 1 HE2 MET 1 6.922 -27.329 11.922 11 HE3 MET 1 HE3 MET 1 7.865 -28.084 13.204 12 H ASN 2 HN ASN 2 8.502 -21.441 9.352 13 HA ASN 2 HA ASN 2 5.614 -21.961 9.607 14 HB2 ASN 2 HB2 ASN 2 6.013 -19.926 10.977 15 HB3 ASN 2 HB1 ASN 2 6.838 -19.155 9.628 16 HD21 ASN 2 HD21 ASN 2 3.722 -20.374 10.753 17 HD22 ASN 2 HD22 ASN 2 2.743 -19.370 9.741 18 H ILE 3 HN ILE 3 4.507 -21.807 7.685 19 HA ILE 3 HA ILE 3 5.914 -22.356 5.322 20 HB ILE 3 HB ILE 3 3.810 -22.430 4.126 21 HG12 ILE 3 HG12 ILE 3 2.748 -20.323 5.029 22 HG13 ILE 3 HG11 ILE 3 1.648 -21.690 4.986 23 HG21 ILE 3 HG21 ILE 3 3.468 -23.533 6.935 24 HG22 ILE 3 HG22 ILE 3 4.292 -24.315 5.586 25 HG23 ILE 3 HG23 ILE 3 2.554 -24.041 5.510 26 HD11 ILE 3 HD11 ILE 3 1.353 -20.349 6.975 27 HD12 ILE 3 HD12 ILE 3 3.035 -20.615 7.435 28 HD13 ILE 3 HD13 ILE 3 1.901 -21.969 7.393 29 H GLY 4 HN GLY 4 4.667 -19.336 6.558 30 HA2 GLY 4 HA2 GLY 4 5.351 -17.791 4.135 31 HA3 GLY 4 HA1 GLY 4 4.464 -17.222 5.548 32 H ARG 5 HN ARG 5 7.569 -18.907 5.239 33 HA ARG 5 HA ARG 5 8.906 -17.305 7.209 34 HB2 ARG 5 HB2 ARG 5 10.923 -18.635 6.568 35 HB3 ARG 5 HB1 ARG 5 9.520 -19.642 6.919 36 HG2 ARG 5 HG2 ARG 5 9.129 -19.991 4.515 37 HG3 ARG 5 HG1 ARG 5 10.480 -18.918 4.120 38 HD2 ARG 5 HD2 ARG 5 10.650 -21.573 5.590 39 HD3 ARG 5 HD1 ARG 5 11.162 -21.259 3.928 40 HE ARG 5 HE ARG 5 12.645 -19.478 5.213 41 HH11 ARG 5 HH11 ARG 5 12.129 -22.844 6.064 42 HH12 ARG 5 HH12 ARG 5 13.676 -23.002 6.835 43 HH21 ARG 5 HH21 ARG 5 14.620 -19.679 6.276 44 HH22 ARG 5 HH22 ARG 5 15.087 -21.209 6.954 45 H LEU 6 HN LEU 6 10.510 -15.719 6.925 46 HA LEU 6 HA LEU 6 9.938 -14.044 4.623 47 HB2 LEU 6 HB2 LEU 6 11.815 -13.354 6.904 48 HB3 LEU 6 HB1 LEU 6 10.973 -12.254 5.821 49 HG LEU 6 HG LEU 6 9.879 -13.802 8.185 50 HD11 LEU 6 HD11 LEU 6 9.072 -11.620 8.917 51 HD12 LEU 6 HD12 LEU 6 9.730 -10.868 7.462 52 HD13 LEU 6 HD13 LEU 6 10.812 -11.609 8.644 53 HD21 LEU 6 HD21 LEU 6 8.252 -14.258 6.464 54 HD22 LEU 6 HD22 LEU 6 8.179 -12.555 6.008 55 HD23 LEU 6 HD23 LEU 6 7.585 -13.076 7.588 56 H ARG 7 HN ARG 7 11.036 -14.447 2.809 57 HA ARG 7 HA ARG 7 13.972 -14.922 2.856 58 HB2 ARG 7 HB2 ARG 7 11.850 -16.244 1.125 59 HB3 ARG 7 HB1 ARG 7 13.577 -16.360 0.793 60 HG2 ARG 7 HG2 ARG 7 13.930 -17.515 2.927 61 HG3 ARG 7 HG1 ARG 7 12.211 -17.363 3.317 62 HD2 ARG 7 HD2 ARG 7 12.887 -19.619 2.419 63 HD3 ARG 7 HD1 ARG 7 11.607 -18.830 1.495 64 HE ARG 7 HE ARG 7 13.972 -18.104 0.269 65 HH11 ARG 7 HH11 ARG 7 12.380 -21.163 0.882 66 HH12 ARG 7 HH12 ARG 7 12.960 -21.883 -0.583 67 HH21 ARG 7 HH21 ARG 7 14.665 -19.025 -1.659 68 HH22 ARG 7 HH22 ARG 7 14.264 -20.677 -2.020 69 H ASP 8 HN ASP 8 11.469 -12.979 1.702 70 HA ASP 8 HA ASP 8 12.841 -12.049 -0.735 71 HB2 ASP 8 HB2 ASP 8 9.969 -11.501 0.181 72 HB3 ASP 8 HB1 ASP 8 10.671 -11.084 -1.381 73 H ARG 9 HN ARG 9 12.243 -9.561 -1.044 74 HA ARG 9 HA ARG 9 12.320 -8.075 1.505 75 HB2 ARG 9 HB2 ARG 9 14.103 -7.438 -0.887 76 HB3 ARG 9 HB1 ARG 9 13.911 -6.417 0.541 77 HG2 ARG 9 HG2 ARG 9 14.833 -8.296 1.925 78 HG3 ARG 9 HG1 ARG 9 15.154 -9.180 0.426 79 HD2 ARG 9 HD2 ARG 9 16.347 -6.524 1.285 80 HD3 ARG 9 HD1 ARG 9 17.178 -8.066 1.153 81 HE ARG 9 HE ARG 9 16.577 -7.897 -1.327 82 HH11 ARG 9 HH11 ARG 9 17.345 -5.096 0.648 83 HH12 ARG 9 HH12 ARG 9 17.864 -4.139 -0.704 84 HH21 ARG 9 HH21 ARG 9 17.230 -6.606 -3.100 85 HH22 ARG 9 HH22 ARG 9 17.790 -4.990 -2.816 86 H ILE 10 HN ILE 10 11.334 -6.081 1.465 87 HA ILE 10 HA ILE 10 9.977 -5.158 -0.992 88 HB ILE 10 HB ILE 10 7.812 -4.877 -0.026 89 HG12 ILE 10 HG12 ILE 10 8.260 -4.138 2.242 90 HG13 ILE 10 HG11 ILE 10 7.176 -5.512 2.335 91 HG21 ILE 10 HG21 ILE 10 7.050 -7.153 0.522 92 HG22 ILE 10 HG22 ILE 10 8.728 -7.655 0.746 93 HG23 ILE 10 HG23 ILE 10 8.173 -7.134 -0.846 94 HD11 ILE 10 HD11 ILE 10 8.700 -5.719 4.104 95 HD12 ILE 10 HD12 ILE 10 10.082 -5.365 3.075 96 HD13 ILE 10 HD13 ILE 10 9.228 -6.890 2.898 97 H THR 11 HN THR 11 9.760 -2.944 -1.091 98 HA THR 11 HA THR 11 10.914 -1.315 1.061 99 HB THR 11 HB THR 11 10.056 -0.324 -1.699 100 HG1 THR 11 HG1 THR 11 12.615 -1.401 -0.992 101 HG21 THR 11 HG21 THR 11 12.222 0.574 0.245 102 HG22 THR 11 HG22 THR 11 10.656 1.371 0.039 103 HG23 THR 11 HG23 THR 11 11.814 1.358 -1.292 104 H ILE 12 HN ILE 12 9.585 -0.180 2.362 105 HA ILE 12 HA ILE 12 6.697 -0.331 2.124 106 HB ILE 12 HB ILE 12 8.328 1.193 4.210 107 HG12 ILE 12 HG12 ILE 12 9.006 -1.182 4.242 108 HG13 ILE 12 HG11 ILE 12 8.090 -0.788 5.690 109 HG21 ILE 12 HG21 ILE 12 5.980 1.907 4.149 110 HG22 ILE 12 HG22 ILE 12 6.305 1.016 5.637 111 HG23 ILE 12 HG23 ILE 12 5.435 0.234 4.313 112 HD11 ILE 12 HD11 ILE 12 7.047 -2.275 3.284 113 HD12 ILE 12 HD12 ILE 12 6.127 -1.888 4.742 114 HD13 ILE 12 HD13 ILE 12 7.515 -2.968 4.834 115 H GLN 13 HN GLN 13 5.797 1.018 0.618 116 HA GLN 13 HA GLN 13 6.657 3.758 0.246 117 HB2 GLN 13 HB2 GLN 13 4.329 2.220 -0.972 118 HB3 GLN 13 HB1 GLN 13 4.582 3.941 -1.257 119 HG2 GLN 13 HG2 GLN 13 5.525 2.781 -3.110 120 HG3 GLN 13 HG1 GLN 13 6.866 3.384 -2.145 121 HE21 GLN 13 HE21 GLN 13 8.408 1.885 -2.683 122 HE22 GLN 13 HE22 GLN 13 8.263 0.189 -2.354 123 H THR 14 HN THR 14 6.411 4.796 2.055 124 HA THR 14 HA THR 14 3.913 4.977 3.551 125 HB THR 14 HB THR 14 5.216 6.835 4.781 126 HG1 THR 14 HG1 THR 14 6.821 6.571 2.693 127 HG21 THR 14 HG21 THR 14 6.498 4.073 4.675 128 HG22 THR 14 HG22 THR 14 5.123 4.533 5.681 129 HG23 THR 14 HG23 THR 14 6.703 5.259 5.974 130 H LEU 15 HN LEU 15 2.398 6.718 3.413 131 HA LEU 15 HA LEU 15 2.343 8.006 0.812 132 HB2 LEU 15 HB2 LEU 15 0.313 6.949 1.761 133 HB3 LEU 15 HB1 LEU 15 0.348 8.070 3.111 134 HG LEU 15 HG LEU 15 -0.051 9.967 1.513 135 HD11 LEU 15 HD11 LEU 15 0.881 9.021 -0.524 136 HD12 LEU 15 HD12 LEU 15 -0.789 9.505 -0.783 137 HD13 LEU 15 HD13 LEU 15 -0.388 7.799 -0.577 138 HD21 LEU 15 HD21 LEU 15 -2.149 7.777 1.427 139 HD22 LEU 15 HD22 LEU 15 -2.424 9.495 1.108 140 HD23 LEU 15 HD23 LEU 15 -1.928 8.967 2.714 141 H LYS 16 HN LYS 16 3.799 9.641 0.756 142 HA LYS 16 HA LYS 16 4.221 11.561 2.816 143 HB2 LYS 16 HB2 LYS 16 5.934 10.802 1.106 144 HB3 LYS 16 HB1 LYS 16 5.034 11.684 -0.124 145 HG2 LYS 16 HG2 LYS 16 5.442 13.791 1.107 146 HG3 LYS 16 HG1 LYS 16 6.344 12.889 2.328 147 HD2 LYS 16 HD2 LYS 16 7.928 12.163 0.469 148 HD3 LYS 16 HD1 LYS 16 7.097 13.315 -0.586 149 HE2 LYS 16 HE2 LYS 16 9.119 14.337 0.346 150 HE3 LYS 16 HE1 LYS 16 7.690 15.147 0.990 151 HZ1 LYS 16 HZ1 LYS 16 7.917 13.940 3.029 152 HZ2 LYS 16 HZ2 LYS 16 9.397 14.666 2.670 153 HZ3 LYS 16 HZ3 LYS 16 9.188 13.011 2.407 154 H GLN 17 HN GLN 17 2.316 12.600 3.274 155 HA GLN 17 HA GLN 17 0.738 13.935 1.185 156 HB2 GLN 17 HB2 GLN 17 0.258 13.764 4.205 157 HB3 GLN 17 HB1 GLN 17 -0.878 14.381 3.006 158 HG2 GLN 17 HG2 GLN 17 -0.990 12.106 1.994 159 HG3 GLN 17 HG1 GLN 17 0.095 11.520 3.257 160 HE21 GLN 17 HE21 GLN 17 -3.142 12.562 2.522 161 HE22 GLN 17 HE22 GLN 17 -3.860 12.092 4.020 162 H THR 18 HN THR 18 2.261 15.517 0.578 163 HA THR 18 HA THR 18 3.511 17.232 2.597 164 HB THR 18 HB THR 18 3.903 17.100 -0.426 165 HG1 THR 18 HG1 THR 18 5.261 15.931 1.784 166 HG21 THR 18 HG21 THR 18 4.546 19.327 0.470 167 HG22 THR 18 HG22 THR 18 5.968 18.408 -0.031 168 HG23 THR 18 HG23 THR 18 5.563 18.546 1.681 169 H ARG 19 HN ARG 19 2.707 19.187 3.095 170 HA ARG 19 HA ARG 19 0.443 20.286 1.691 171 HB2 ARG 19 HB2 ARG 19 0.638 20.340 4.153 172 HB3 ARG 19 HB1 ARG 19 2.045 21.388 4.031 173 HG2 ARG 19 HG2 ARG 19 0.745 23.245 3.323 174 HG3 ARG 19 HG1 ARG 19 -0.631 22.226 2.882 175 HD2 ARG 19 HD2 ARG 19 -1.019 23.516 4.970 176 HD3 ARG 19 HD1 ARG 19 -1.118 21.769 5.206 177 HE ARG 19 HE ARG 19 1.484 22.888 5.799 178 HH11 ARG 19 HH11 ARG 19 -1.691 22.235 7.175 179 HH12 ARG 19 HH12 ARG 19 -1.101 22.214 8.806 180 HH21 ARG 19 HH21 ARG 19 2.224 22.830 7.920 181 HH22 ARG 19 HH22 ARG 19 1.121 22.533 9.225 182 H ASP 20 HN ASP 20 0.380 22.450 0.795 183 HA ASP 20 HA ASP 20 2.860 23.085 -0.703 184 HB2 ASP 20 HB2 ASP 20 0.850 22.474 -2.065 185 HB3 ASP 20 HB1 ASP 20 -0.042 23.800 -1.335 186 H ILE 21 HN ILE 21 3.265 25.431 -1.124 187 HA ILE 21 HA ILE 21 3.299 27.055 1.125 188 HB ILE 21 HB ILE 21 4.858 27.162 -0.829 189 HG12 ILE 21 HG12 ILE 21 3.643 29.908 -0.251 190 HG13 ILE 21 HG11 ILE 21 4.679 29.048 0.877 191 HG21 ILE 21 HG21 ILE 21 3.221 27.016 -2.655 192 HG22 ILE 21 HG22 ILE 21 4.250 28.433 -2.859 193 HG23 ILE 21 HG23 ILE 21 2.602 28.624 -2.259 194 HD11 ILE 21 HD11 ILE 21 6.518 29.149 -0.720 195 HD12 ILE 21 HD12 ILE 21 5.897 30.755 -0.343 196 HD13 ILE 21 HD13 ILE 21 5.476 29.988 -1.872 197 H THR 22 HN THR 22 0.518 26.438 -0.777 198 HA THR 22 HA THR 22 -0.804 28.894 0.207 199 HB THR 22 HB THR 22 -2.365 28.805 -1.750 200 HG1 THR 22 HG1 THR 22 -0.740 26.640 -2.444 201 HG21 THR 22 HG21 THR 22 -0.415 30.347 -1.834 202 HG22 THR 22 HG22 THR 22 -0.860 29.767 -3.441 203 HG23 THR 22 HG23 THR 22 0.540 29.079 -2.611 204 H GLY 23 HN GLY 23 -0.570 25.525 0.199 205 HA2 GLY 23 HA2 GLY 23 -1.350 24.403 2.143 206 HA3 GLY 23 HA1 GLY 23 -2.746 25.452 2.186 207 H GLU 24 HN GLU 24 -1.486 23.389 -0.465 208 HA GLU 24 HA GLU 24 -3.944 21.793 -0.377 209 HB2 GLU 24 HB2 GLU 24 -1.853 22.304 -2.525 210 HB3 GLU 24 HB1 GLU 24 -2.938 20.929 -2.634 211 HG2 GLU 24 HG2 GLU 24 -3.632 22.889 -3.990 212 HG3 GLU 24 HG1 GLU 24 -4.853 22.334 -2.845 213 H ILE 25 HN ILE 25 -3.747 19.524 -0.242 214 HA ILE 25 HA ILE 25 -1.227 18.503 0.891 215 HB ILE 25 HB ILE 25 -4.030 17.280 0.894 216 HG12 ILE 25 HG12 ILE 25 -3.875 19.271 2.361 217 HG13 ILE 25 HG11 ILE 25 -4.040 17.809 3.325 218 HG21 ILE 25 HG21 ILE 25 -1.504 16.269 2.257 219 HG22 ILE 25 HG22 ILE 25 -2.345 15.500 0.912 220 HG23 ILE 25 HG23 ILE 25 -3.126 15.605 2.488 221 HD11 ILE 25 HD11 ILE 25 -2.463 19.328 4.333 222 HD12 ILE 25 HD12 ILE 25 -1.495 19.368 2.861 223 HD13 ILE 25 HD13 ILE 25 -1.618 17.874 3.797 224 H LEU 26 HN LEU 26 0.050 17.982 -0.809 225 HA LEU 26 HA LEU 26 -0.889 16.517 -3.139 226 HB2 LEU 26 HB2 LEU 26 1.934 17.443 -2.416 227 HB3 LEU 26 HB1 LEU 26 1.460 16.709 -3.936 228 HG LEU 26 HG LEU 26 1.648 18.992 -4.443 229 HD11 LEU 26 HD11 LEU 26 -0.582 19.777 -5.012 230 HD12 LEU 26 HD12 LEU 26 -1.307 18.597 -3.918 231 HD13 LEU 26 HD13 LEU 26 -0.411 18.054 -5.339 232 HD21 LEU 26 HD21 LEU 26 0.727 20.853 -3.139 233 HD22 LEU 26 HD22 LEU 26 1.856 19.893 -2.187 234 HD23 LEU 26 HD23 LEU 26 0.118 19.720 -1.925 235 H GLU 27 HN GLU 27 -1.337 14.461 -2.629 236 HA GLU 27 HA GLU 27 0.242 12.909 -0.740 237 HB2 GLU 27 HB2 GLU 27 -2.214 12.164 -2.382 238 HB3 GLU 27 HB1 GLU 27 -1.470 11.142 -1.151 239 HG2 GLU 27 HG2 GLU 27 -1.956 12.834 0.560 240 HG3 GLU 27 HG1 GLU 27 -2.686 13.872 -0.662 241 H THR 28 HN THR 28 1.926 11.810 -1.337 242 HA THR 28 HA THR 28 2.172 10.491 -3.967 243 HB THR 28 HB THR 28 4.656 11.090 -3.969 244 HG1 THR 28 HG1 THR 28 3.870 12.353 -1.647 245 HG21 THR 28 HG21 THR 28 2.776 13.483 -4.179 246 HG22 THR 28 HG22 THR 28 3.134 12.328 -5.467 247 HG23 THR 28 HG23 THR 28 4.405 13.388 -4.858 248 H TRP 29 HN TRP 29 4.254 8.966 -3.757 249 HA TRP 29 HA TRP 29 4.074 7.611 -1.118 250 HB2 TRP 29 HB2 TRP 29 4.403 6.326 -3.867 251 HB3 TRP 29 HB1 TRP 29 4.377 5.469 -2.328 252 HD1 TRP 29 HD1 TRP 29 2.061 7.034 -4.902 253 HE1 TRP 29 HE1 TRP 29 -0.371 6.518 -4.276 254 HE3 TRP 29 HE3 TRP 29 2.812 5.106 -0.238 255 HZ2 TRP 29 HZ2 TRP 29 -1.803 5.442 -2.107 256 HZ3 TRP 29 HZ3 TRP 29 0.857 4.366 1.054 257 HH2 TRP 29 HH2 TRP 29 -1.409 4.526 0.144 258 H GLU 30 HN GLU 30 5.890 8.077 -0.102 259 HA GLU 30 HA GLU 30 8.468 8.175 -1.543 260 HB2 GLU 30 HB2 GLU 30 9.471 9.131 0.453 261 HB3 GLU 30 HB1 GLU 30 8.035 10.053 0.034 262 HG2 GLU 30 HG2 GLU 30 6.805 9.176 1.870 263 HG3 GLU 30 HG1 GLU 30 7.983 7.898 2.155 264 H ASP 31 HN ASP 31 10.148 6.842 -1.006 265 HA ASP 31 HA ASP 31 9.512 4.153 -0.273 266 HB2 ASP 31 HB2 ASP 31 11.949 3.729 -0.614 267 HB3 ASP 31 HB1 ASP 31 11.245 4.618 -1.959 268 H GLY 32 HN GLY 32 10.019 3.046 1.598 269 HA2 GLY 32 HA2 GLY 32 10.675 4.633 4.004 270 HA3 GLY 32 HA1 GLY 32 9.752 3.134 3.957 271 H HIS 33 HN HIS 33 10.781 1.273 4.330 272 HA HIS 33 HA HIS 33 13.737 1.144 4.014 273 HB2 HIS 33 HB2 HIS 33 13.169 1.340 6.448 274 HB3 HIS 33 HB1 HIS 33 12.147 -0.087 6.324 275 HD1 HIS 33 HD1 HIS 33 15.782 0.922 5.949 276 HD2 HIS 33 HD2 HIS 33 13.521 -2.461 6.764 277 HE1 HIS 33 HE1 HIS 33 17.442 -0.881 6.434 278 HE2 HIS 33 HE2 HIS 33 16.065 -2.959 6.737 279 H THR 34 HN THR 34 14.531 -0.884 3.347 280 HA THR 34 HA THR 34 12.538 -2.670 2.160 281 HB THR 34 HB THR 34 15.512 -2.486 1.527 282 HG1 THR 34 HG1 THR 34 14.824 -0.602 0.754 283 HG21 THR 34 HG21 THR 34 14.405 -4.615 0.846 284 HG22 THR 34 HG22 THR 34 14.877 -3.646 -0.551 285 HG23 THR 34 HG23 THR 34 13.190 -3.677 -0.035 286 H LEU 35 HN LEU 35 12.009 -4.127 3.766 287 HA LEU 35 HA LEU 35 14.197 -5.451 5.279 288 HB2 LEU 35 HB2 LEU 35 12.558 -5.905 7.070 289 HB3 LEU 35 HB1 LEU 35 12.798 -4.189 6.807 290 HG LEU 35 HG LEU 35 10.401 -5.604 5.582 291 HD11 LEU 35 HD11 LEU 35 10.341 -6.186 7.967 292 HD12 LEU 35 HD12 LEU 35 9.053 -5.058 7.553 293 HD13 LEU 35 HD13 LEU 35 10.491 -4.479 8.400 294 HD21 LEU 35 HD21 LEU 35 10.845 -3.304 4.815 295 HD22 LEU 35 HD22 LEU 35 10.823 -2.726 6.481 296 HD23 LEU 35 HD23 LEU 35 9.353 -3.375 5.745 297 H TRP 36 HN TRP 36 13.582 -7.613 6.139 298 HA TRP 36 HA TRP 36 13.052 -9.491 4.148 299 HB2 TRP 36 HB2 TRP 36 12.927 -9.853 7.168 300 HB3 TRP 36 HB1 TRP 36 13.035 -11.158 5.989 301 HD1 TRP 36 HD1 TRP 36 15.236 -9.504 8.295 302 HE1 TRP 36 HE1 TRP 36 17.693 -9.606 7.556 303 HE3 TRP 36 HE3 TRP 36 14.575 -10.779 3.374 304 HZ2 TRP 36 HZ2 TRP 36 19.166 -10.135 5.215 305 HZ3 TRP 36 HZ3 TRP 36 16.555 -11.048 1.960 306 HH2 TRP 36 HH2 TRP 36 18.815 -10.740 2.852 307 H ALA 37 HN ALA 37 11.251 -10.083 3.259 308 HA ALA 37 HA ALA 37 8.764 -10.387 4.816 309 HB1 ALA 37 HB1 ALA 37 7.440 -9.630 2.852 310 HB2 ALA 37 HB2 ALA 37 8.948 -9.199 2.029 311 HB3 ALA 37 HB3 ALA 37 8.477 -8.367 3.509 312 H SER 38 HN SER 38 7.175 -11.889 3.712 313 HA SER 38 HA SER 38 8.331 -13.642 1.657 314 HB2 SER 38 HB2 SER 38 8.105 -14.748 3.911 315 HB3 SER 38 HB1 SER 38 6.379 -14.398 3.880 316 HG SER 38 HG SER 38 7.688 -16.441 2.798 317 H VAL 39 HN VAL 39 7.377 -12.761 -0.120 318 HA VAL 39 HA VAL 39 4.690 -11.619 -0.008 319 HB VAL 39 HB VAL 39 6.627 -11.706 -2.362 320 HG11 VAL 39 HG11 VAL 39 4.284 -11.182 -2.946 321 HG12 VAL 39 HG12 VAL 39 5.344 -9.803 -3.217 322 HG13 VAL 39 HG13 VAL 39 4.297 -9.842 -1.799 323 HG21 VAL 39 HG21 VAL 39 7.765 -10.627 -0.462 324 HG22 VAL 39 HG22 VAL 39 6.398 -9.531 -0.246 325 HG23 VAL 39 HG23 VAL 39 7.377 -9.443 -1.710 326 H ASN 40 HN ASN 40 3.347 -13.396 0.101 327 HA ASN 40 HA ASN 40 3.558 -15.567 -1.849 328 HB2 ASN 40 HB2 ASN 40 1.878 -15.220 0.677 329 HB3 ASN 40 HB1 ASN 40 1.817 -16.636 -0.369 330 HD21 ASN 40 HD21 ASN 40 3.805 -14.836 1.900 331 HD22 ASN 40 HD22 ASN 40 4.934 -16.108 2.212 332 H MET 41 HN MET 41 2.650 -14.997 -3.734 333 HA MET 41 HA MET 41 0.310 -13.367 -4.081 334 HB2 MET 41 HB2 MET 41 2.257 -13.902 -5.775 335 HB3 MET 41 HB1 MET 41 1.348 -15.359 -6.137 336 HG2 MET 41 HG2 MET 41 0.407 -12.506 -6.512 337 HG3 MET 41 HG1 MET 41 0.907 -13.630 -7.778 338 HE1 MET 41 HE1 MET 41 -2.909 -13.303 -8.483 339 HE2 MET 41 HE2 MET 41 -1.282 -13.196 -9.156 340 HE3 MET 41 HE3 MET 41 -1.820 -12.024 -7.945 341 H VAL 42 HN VAL 42 -1.817 -14.036 -3.894 342 HA VAL 42 HA VAL 42 -2.287 -16.569 -2.667 343 HB VAL 42 HB VAL 42 -4.566 -15.928 -2.345 344 HG11 VAL 42 HG11 VAL 42 -4.396 -13.701 -1.295 345 HG12 VAL 42 HG12 VAL 42 -2.877 -13.412 -2.150 346 HG13 VAL 42 HG13 VAL 42 -2.980 -14.696 -0.943 347 HG21 VAL 42 HG21 VAL 42 -5.206 -15.241 -4.596 348 HG22 VAL 42 HG22 VAL 42 -4.220 -13.784 -4.469 349 HG23 VAL 42 HG23 VAL 42 -5.648 -13.974 -3.449 350 H SER 43 HN SER 43 -3.146 -18.416 -3.439 351 HA SER 43 HA SER 43 -3.347 -18.774 -6.339 352 HB2 SER 43 HB2 SER 43 -3.271 -20.779 -4.041 353 HB3 SER 43 HB1 SER 43 -3.226 -21.193 -5.758 354 HG SER 43 HG SER 43 -1.343 -19.340 -5.169 355 H SER 44 HN SER 44 -5.035 -20.731 -6.801 356 HA SER 44 HA SER 44 -7.607 -19.593 -6.748 357 HB2 SER 44 HB2 SER 44 -8.362 -21.795 -7.698 358 HB3 SER 44 HB1 SER 44 -6.947 -21.139 -8.519 359 HG SER 44 HG SER 44 -5.673 -22.634 -7.537 360 H LYS 45 HN LYS 45 -6.153 -22.159 -4.815 361 HA LYS 45 HA LYS 45 -8.294 -23.009 -3.258 362 HB2 LYS 45 HB2 LYS 45 -6.179 -24.196 -3.184 363 HB3 LYS 45 HB1 LYS 45 -5.329 -22.771 -2.610 364 HG2 LYS 45 HG2 LYS 45 -5.555 -24.349 -0.793 365 HG3 LYS 45 HG1 LYS 45 -6.548 -22.931 -0.446 366 HD2 LYS 45 HD2 LYS 45 -8.564 -24.179 -1.200 367 HD3 LYS 45 HD1 LYS 45 -7.556 -25.598 -1.515 368 HE2 LYS 45 HE2 LYS 45 -7.975 -24.282 1.195 369 HE3 LYS 45 HE1 LYS 45 -8.722 -25.783 0.650 370 HZ1 LYS 45 HZ1 LYS 45 -5.814 -25.332 1.055 371 HZ2 LYS 45 HZ2 LYS 45 -6.503 -26.764 0.484 372 HZ3 LYS 45 HZ3 LYS 45 -6.833 -26.234 2.055 373 H GLU 46 HN GLU 46 -6.105 -20.239 -2.758 374 HA GLU 46 HA GLU 46 -7.032 -19.385 -0.243 375 HB2 GLU 46 HB2 GLU 46 -5.801 -17.773 -2.517 376 HB3 GLU 46 HB1 GLU 46 -6.051 -17.142 -0.889 377 HG2 GLU 46 HG2 GLU 46 -4.261 -19.464 -1.665 378 HG3 GLU 46 HG1 GLU 46 -3.727 -17.840 -1.239 379 H ALA 47 HN ALA 47 -7.904 -18.146 -3.506 380 HA ALA 47 HA ALA 47 -9.976 -16.433 -2.908 381 HB1 ALA 47 HB1 ALA 47 -9.019 -16.729 -5.160 382 HB2 ALA 47 HB2 ALA 47 -10.781 -16.841 -5.208 383 HB3 ALA 47 HB3 ALA 47 -9.800 -18.306 -5.293 384 H ILE 48 HN ILE 48 -10.346 -19.902 -3.624 385 HA ILE 48 HA ILE 48 -13.137 -20.094 -3.390 386 HB ILE 48 HB ILE 48 -11.026 -22.268 -3.000 387 HG12 ILE 48 HG12 ILE 48 -12.686 -21.629 -5.493 388 HG13 ILE 48 HG11 ILE 48 -11.033 -21.080 -5.244 389 HG21 ILE 48 HG21 ILE 48 -14.010 -22.629 -3.522 390 HG22 ILE 48 HG22 ILE 48 -13.170 -23.021 -2.020 391 HG23 ILE 48 HG23 ILE 48 -12.809 -23.923 -3.491 392 HD11 ILE 48 HD11 ILE 48 -11.912 -23.964 -5.453 393 HD12 ILE 48 HD12 ILE 48 -10.256 -23.392 -5.220 394 HD13 ILE 48 HD13 ILE 48 -11.120 -23.008 -6.707 395 H SER 49 HN SER 49 -10.598 -20.645 -0.954 396 HA SER 49 HA SER 49 -12.252 -21.629 1.130 397 HB2 SER 49 HB2 SER 49 -9.509 -20.301 1.278 398 HB3 SER 49 HB1 SER 49 -10.274 -21.189 2.596 399 HG SER 49 HG SER 49 -8.939 -22.124 0.416 400 H SER 50 HN SER 50 -11.096 -18.373 0.341 401 HA SER 50 HA SER 50 -12.360 -17.153 2.686 402 HB2 SER 50 HB2 SER 50 -11.322 -15.075 1.861 403 HB3 SER 50 HB1 SER 50 -10.136 -16.380 1.904 404 HG SER 50 HG SER 50 -9.952 -16.272 -0.185 405 H GLY 51 HN GLY 51 -13.429 -18.118 -0.325 406 HA2 GLY 51 HA2 GLY 51 -15.605 -17.841 -1.185 407 HA3 GLY 51 HA1 GLY 51 -15.778 -16.333 -0.284 408 H ALA 52 HN ALA 52 -14.315 -14.536 -0.968 409 HA ALA 52 HA ALA 52 -13.158 -14.571 -3.638 410 HB1 ALA 52 HB1 ALA 52 -15.545 -14.126 -4.128 411 HB2 ALA 52 HB2 ALA 52 -14.550 -12.719 -4.509 412 HB3 ALA 52 HB3 ALA 52 -15.522 -12.741 -3.033 413 H GLU 53 HN GLU 53 -12.692 -13.889 -0.592 414 HA GLU 53 HA GLU 53 -12.002 -11.064 -0.601 415 HB2 GLU 53 HB2 GLU 53 -12.957 -12.244 1.399 416 HB3 GLU 53 HB1 GLU 53 -11.474 -13.183 1.533 417 HG2 GLU 53 HG2 GLU 53 -10.198 -11.108 1.934 418 HG3 GLU 53 HG1 GLU 53 -11.679 -10.166 1.787 419 H LEU 54 HN LEU 54 -10.359 -14.117 -1.014 420 HA LEU 54 HA LEU 54 -7.776 -12.733 -1.515 421 HB2 LEU 54 HB2 LEU 54 -8.283 -15.658 -0.801 422 HB3 LEU 54 HB1 LEU 54 -6.707 -14.952 -1.138 423 HG LEU 54 HG LEU 54 -8.477 -14.231 1.241 424 HD11 LEU 54 HD11 LEU 54 -7.642 -16.517 1.440 425 HD12 LEU 54 HD12 LEU 54 -6.854 -15.468 2.615 426 HD13 LEU 54 HD13 LEU 54 -5.985 -15.970 1.161 427 HD21 LEU 54 HD21 LEU 54 -7.073 -12.339 0.573 428 HD22 LEU 54 HD22 LEU 54 -5.630 -13.358 0.599 429 HD23 LEU 54 HD23 LEU 54 -6.500 -13.013 2.098 430 H ALA 55 HN ALA 55 -9.721 -12.550 -3.383 431 HA ALA 55 HA ALA 55 -9.852 -14.612 -5.334 432 HB1 ALA 55 HB1 ALA 55 -10.459 -11.645 -5.598 433 HB2 ALA 55 HB2 ALA 55 -11.613 -12.896 -5.130 434 HB3 ALA 55 HB3 ALA 55 -10.920 -12.903 -6.754 435 H ILE 56 HN ILE 56 -8.537 -14.887 -7.146 436 HA ILE 56 HA ILE 56 -5.872 -14.402 -6.599 437 HB ILE 56 HB ILE 56 -6.962 -15.109 -9.375 438 HG12 ILE 56 HG12 ILE 56 -6.177 -17.054 -7.152 439 HG13 ILE 56 HG11 ILE 56 -7.839 -16.627 -7.555 440 HG21 ILE 56 HG21 ILE 56 -4.222 -15.670 -8.163 441 HG22 ILE 56 HG22 ILE 56 -4.579 -14.501 -9.437 442 HG23 ILE 56 HG23 ILE 56 -4.780 -16.225 -9.744 443 HD11 ILE 56 HD11 ILE 56 -7.252 -18.754 -8.523 444 HD12 ILE 56 HD12 ILE 56 -5.869 -18.045 -9.349 445 HD13 ILE 56 HD13 ILE 56 -7.509 -17.578 -9.810 446 H GLY 57 HN GLY 57 -4.425 -12.836 -7.204 447 HA2 GLY 57 HA2 GLY 57 -3.813 -10.795 -8.443 448 HA3 GLY 57 HA1 GLY 57 -5.527 -10.366 -8.470 449 H THR 58 HN THR 58 -5.597 -11.613 -5.647 450 HA THR 58 HA THR 58 -4.683 -9.402 -4.009 451 HB THR 58 HB THR 58 -5.766 -12.146 -3.167 452 HG1 THR 58 HG1 THR 58 -7.149 -10.662 -4.502 453 HG21 THR 58 HG21 THR 58 -4.613 -10.976 -1.307 454 HG22 THR 58 HG22 THR 58 -6.351 -11.085 -1.024 455 HG23 THR 58 HG23 THR 58 -5.643 -9.559 -1.563 456 H VAL 59 HN VAL 59 -2.913 -9.566 -2.530 457 HA VAL 59 HA VAL 59 -1.174 -11.937 -2.665 458 HB VAL 59 HB VAL 59 -0.179 -9.051 -2.913 459 HG11 VAL 59 HG11 VAL 59 1.371 -10.420 -1.559 460 HG12 VAL 59 HG12 VAL 59 2.091 -10.053 -3.126 461 HG13 VAL 59 HG13 VAL 59 1.415 -11.656 -2.821 462 HG21 VAL 59 HG21 VAL 59 -1.104 -9.833 -5.057 463 HG22 VAL 59 HG22 VAL 59 -0.133 -11.304 -4.969 464 HG23 VAL 59 HG23 VAL 59 0.657 -9.738 -5.164 465 H ARG 60 HN ARG 60 -0.651 -12.589 -0.661 466 HA ARG 60 HA ARG 60 -0.924 -10.760 1.635 467 HB2 ARG 60 HB2 ARG 60 -2.148 -12.865 1.819 468 HB3 ARG 60 HB1 ARG 60 -0.686 -13.789 1.492 469 HG2 ARG 60 HG2 ARG 60 0.285 -13.160 3.603 470 HG3 ARG 60 HG1 ARG 60 -0.989 -11.977 3.905 471 HD2 ARG 60 HD2 ARG 60 -1.259 -14.058 5.228 472 HD3 ARG 60 HD1 ARG 60 -2.634 -13.725 4.177 473 HE ARG 60 HE ARG 60 -1.098 -15.412 2.701 474 HH11 ARG 60 HH11 ARG 60 -2.278 -15.631 5.987 475 HH12 ARG 60 HH12 ARG 60 -2.638 -17.325 5.871 476 HH21 ARG 60 HH21 ARG 60 -1.583 -17.620 2.546 477 HH22 ARG 60 HH22 ARG 60 -2.238 -18.457 3.916 478 H ILE 61 HN ILE 61 0.858 -10.341 2.949 479 HA ILE 61 HA ILE 61 3.539 -11.044 1.932 480 HB ILE 61 HB ILE 61 2.604 -8.160 2.362 481 HG12 ILE 61 HG12 ILE 61 3.407 -9.535 -0.248 482 HG13 ILE 61 HG11 ILE 61 1.743 -9.259 0.243 483 HG21 ILE 61 HG21 ILE 61 4.868 -7.534 1.520 484 HG22 ILE 61 HG22 ILE 61 5.321 -9.238 1.484 485 HG23 ILE 61 HG23 ILE 61 4.954 -8.453 3.022 486 HD11 ILE 61 HD11 ILE 61 2.445 -7.641 -1.376 487 HD12 ILE 61 HD12 ILE 61 3.797 -7.152 -0.358 488 HD13 ILE 61 HD13 ILE 61 2.137 -6.847 0.166 489 H TRP 62 HN TRP 62 4.460 -11.873 3.658 490 HA TRP 62 HA TRP 62 3.700 -11.121 6.390 491 HB2 TRP 62 HB2 TRP 62 5.506 -13.362 5.328 492 HB3 TRP 62 HB1 TRP 62 5.003 -13.169 7.007 493 HD1 TRP 62 HD1 TRP 62 3.191 -13.600 3.563 494 HE1 TRP 62 HE1 TRP 62 1.164 -15.121 3.944 495 HE3 TRP 62 HE3 TRP 62 3.683 -14.367 8.560 496 HZ2 TRP 62 HZ2 TRP 62 -0.055 -16.497 6.085 497 HZ3 TRP 62 HZ3 TRP 62 2.062 -15.798 9.721 498 HH2 TRP 62 HH2 TRP 62 0.221 -16.847 8.503 499 H ILE 63 HN ILE 63 4.921 -9.550 7.393 500 HA ILE 63 HA ILE 63 7.813 -9.295 6.724 501 HB ILE 63 HB ILE 63 7.680 -6.863 7.239 502 HG12 ILE 63 HG12 ILE 63 4.643 -7.146 7.200 503 HG13 ILE 63 HG11 ILE 63 5.583 -7.015 8.681 504 HG21 ILE 63 HG21 ILE 63 7.595 -7.522 4.905 505 HG22 ILE 63 HG22 ILE 63 6.564 -6.112 5.152 506 HG23 ILE 63 HG23 ILE 63 5.839 -7.714 4.979 507 HD11 ILE 63 HD11 ILE 63 5.394 -4.941 6.502 508 HD12 ILE 63 HD12 ILE 63 6.377 -4.804 7.963 509 HD13 ILE 63 HD13 ILE 63 4.619 -4.886 8.085 510 H ARG 64 HN ARG 64 9.153 -8.656 8.573 511 HA ARG 64 HA ARG 64 8.421 -9.373 11.172 512 HB2 ARG 64 HB2 ARG 64 10.461 -7.269 10.304 513 HB3 ARG 64 HB1 ARG 64 10.343 -7.939 11.932 514 HG2 ARG 64 HG2 ARG 64 10.823 -10.203 11.002 515 HG3 ARG 64 HG1 ARG 64 11.023 -9.482 9.405 516 HD2 ARG 64 HD2 ARG 64 12.931 -8.154 10.257 517 HD3 ARG 64 HD1 ARG 64 12.728 -8.900 11.851 518 HE ARG 64 HE ARG 64 13.016 -10.843 9.755 519 HH11 ARG 64 HH11 ARG 64 14.899 -8.775 11.858 520 HH12 ARG 64 HH12 ARG 64 16.320 -9.751 11.721 521 HH21 ARG 64 HH21 ARG 64 14.856 -12.127 9.632 522 HH22 ARG 64 HH22 ARG 64 16.291 -11.666 10.493 523 H TYR 65 HN TYR 65 7.509 -8.282 12.894 524 HA TYR 65 HA TYR 65 5.365 -6.571 12.434 525 HB2 TYR 65 HB2 TYR 65 5.779 -8.094 14.465 526 HB3 TYR 65 HB1 TYR 65 6.806 -6.830 15.120 527 HD1 TYR 65 HD1 TYR 65 5.469 -4.358 15.080 528 HD2 TYR 65 HD2 TYR 65 3.619 -8.204 15.382 529 HE1 TYR 65 HE1 TYR 65 3.520 -3.331 16.143 530 HE2 TYR 65 HE2 TYR 65 1.659 -7.168 16.458 531 HH TYR 65 HH TYR 65 1.118 -3.811 16.469 532 H ARG 66 HN ARG 66 5.242 -4.470 12.075 533 HA ARG 66 HA ARG 66 7.142 -2.601 13.304 534 HB2 ARG 66 HB2 ARG 66 7.954 -3.040 10.979 535 HB3 ARG 66 HB1 ARG 66 6.395 -2.519 10.340 536 HG2 ARG 66 HG2 ARG 66 6.760 -0.252 11.149 537 HG3 ARG 66 HG1 ARG 66 8.227 -0.747 11.997 538 HD2 ARG 66 HD2 ARG 66 9.309 -1.237 9.829 539 HD3 ARG 66 HD1 ARG 66 7.836 -0.734 8.981 540 HE ARG 66 HE ARG 66 8.519 1.381 10.620 541 HH11 ARG 66 HH11 ARG 66 10.221 -0.278 8.045 542 HH12 ARG 66 HH12 ARG 66 11.040 1.159 7.526 543 HH21 ARG 66 HH21 ARG 66 9.555 3.223 9.907 544 HH22 ARG 66 HH22 ARG 66 10.657 3.132 8.573 545 H LYS 67 HN LYS 67 6.195 -0.738 13.990 546 HA LYS 67 HA LYS 67 3.297 -0.786 14.245 547 HB2 LYS 67 HB2 LYS 67 5.303 1.175 15.449 548 HB3 LYS 67 HB1 LYS 67 3.603 1.055 15.874 549 HG2 LYS 67 HG2 LYS 67 4.681 -0.008 17.645 550 HG3 LYS 67 HG1 LYS 67 4.157 -1.359 16.638 551 HD2 LYS 67 HD2 LYS 67 6.401 -1.690 15.789 552 HD3 LYS 67 HD1 LYS 67 6.961 -0.174 16.504 553 HE2 LYS 67 HE2 LYS 67 7.751 -2.078 17.816 554 HE3 LYS 67 HE1 LYS 67 6.610 -1.127 18.762 555 HZ1 LYS 67 HZ1 LYS 67 6.012 -3.658 17.343 556 HZ2 LYS 67 HZ2 LYS 67 4.896 -2.745 18.225 557 HZ3 LYS 67 HZ3 LYS 67 6.200 -3.472 19.013 558 H ASP 68 HN ASP 68 5.169 0.366 11.835 559 HA ASP 68 HA ASP 68 4.068 3.077 11.535 560 HB2 ASP 68 HB2 ASP 68 6.176 1.513 9.963 561 HB3 ASP 68 HB1 ASP 68 5.666 3.147 9.544 562 H ILE 69 HN ILE 69 3.442 -0.121 10.423 563 HA ILE 69 HA ILE 69 2.739 0.480 7.709 564 HB ILE 69 HB ILE 69 1.947 -2.032 9.248 565 HG12 ILE 69 HG12 ILE 69 4.387 -1.710 9.494 566 HG13 ILE 69 HG11 ILE 69 4.061 -3.069 8.426 567 HG21 ILE 69 HG21 ILE 69 1.943 -3.078 6.985 568 HG22 ILE 69 HG22 ILE 69 2.322 -1.515 6.265 569 HG23 ILE 69 HG23 ILE 69 0.787 -1.752 7.102 570 HD11 ILE 69 HD11 ILE 69 4.910 -0.300 7.572 571 HD12 ILE 69 HD12 ILE 69 4.587 -1.661 6.494 572 HD13 ILE 69 HD13 ILE 69 5.923 -1.741 7.639 573 H ASN 70 HN ASN 70 0.880 1.264 6.976 574 HA ASN 70 HA ASN 70 -1.639 1.063 8.520 575 HB2 ASN 70 HB2 ASN 70 -0.441 3.320 8.856 576 HB3 ASN 70 HB1 ASN 70 -0.663 3.612 7.132 577 HD21 ASN 70 HD21 ASN 70 -2.289 3.327 10.238 578 HD22 ASN 70 HD22 ASN 70 -3.772 4.066 9.745 579 H ALA 71 HN ALA 71 -3.550 1.683 7.055 580 HA ALA 71 HA ALA 71 -3.556 0.327 4.570 581 HB1 ALA 71 HB1 ALA 71 -5.586 0.645 5.926 582 HB2 ALA 71 HB2 ALA 71 -5.819 1.263 4.289 583 HB3 ALA 71 HB3 ALA 71 -5.525 2.384 5.623 584 H THR 72 HN THR 72 -2.607 3.527 5.427 585 HA THR 72 HA THR 72 -2.505 4.474 2.656 586 HB THR 72 HB THR 72 -1.654 6.624 3.707 587 HG1 THR 72 HG1 THR 72 -2.480 5.862 6.246 588 HG21 THR 72 HG21 THR 72 -4.071 6.370 3.242 589 HG22 THR 72 HG22 THR 72 -3.799 7.328 4.697 590 HG23 THR 72 HG23 THR 72 -4.311 5.644 4.835 591 H SER 73 HN SER 73 -0.949 2.215 3.373 592 HA SER 73 HA SER 73 1.655 3.243 2.459 593 HB2 SER 73 HB2 SER 73 1.256 0.820 4.286 594 HB3 SER 73 HB1 SER 73 2.802 1.428 3.680 595 HG SER 73 HG SER 73 1.749 3.484 4.822 596 H ARG 74 HN ARG 74 2.559 2.011 0.761 597 HA ARG 74 HA ARG 74 1.056 -0.354 -0.199 598 HB2 ARG 74 HB2 ARG 74 2.770 1.575 -1.834 599 HB3 ARG 74 HB1 ARG 74 2.075 0.075 -2.448 600 HG2 ARG 74 HG2 ARG 74 -0.206 0.992 -2.012 601 HG3 ARG 74 HG1 ARG 74 0.530 2.515 -1.497 602 HD2 ARG 74 HD2 ARG 74 0.644 1.256 -4.263 603 HD3 ARG 74 HD1 ARG 74 -0.204 2.735 -3.804 604 HE ARG 74 HE ARG 74 2.443 3.186 -3.174 605 HH11 ARG 74 HH11 ARG 74 0.670 2.513 -6.130 606 HH12 ARG 74 HH12 ARG 74 1.858 3.261 -7.145 607 HH21 ARG 74 HH21 ARG 74 3.982 4.131 -4.512 608 HH22 ARG 74 HH22 ARG 74 3.735 4.196 -6.225 609 H ILE 75 HN ILE 75 2.518 -1.941 -1.253 610 HA ILE 75 HA ILE 75 5.126 -2.201 0.114 611 HB ILE 75 HB ILE 75 3.099 -4.456 -0.333 612 HG12 ILE 75 HG12 ILE 75 2.247 -2.908 1.441 613 HG13 ILE 75 HG11 ILE 75 2.648 -4.495 2.086 614 HG21 ILE 75 HG21 ILE 75 4.598 -5.790 1.115 615 HG22 ILE 75 HG22 ILE 75 5.729 -4.438 1.173 616 HG23 ILE 75 HG23 ILE 75 5.393 -5.242 -0.362 617 HD11 ILE 75 HD11 ILE 75 3.317 -2.724 3.588 618 HD12 ILE 75 HD12 ILE 75 4.327 -2.002 2.335 619 HD13 ILE 75 HD13 ILE 75 4.731 -3.593 2.992 620 H LYS 76 HN LYS 76 6.377 -1.768 -1.734 621 HA LYS 76 HA LYS 76 5.815 -3.272 -4.224 622 HB2 LYS 76 HB2 LYS 76 6.218 -0.819 -4.439 623 HB3 LYS 76 HB1 LYS 76 7.836 -1.026 -3.780 624 HG2 LYS 76 HG2 LYS 76 8.498 -2.368 -5.719 625 HG3 LYS 76 HG1 LYS 76 6.848 -2.346 -6.331 626 HD2 LYS 76 HD2 LYS 76 7.932 -0.746 -7.656 627 HD3 LYS 76 HD1 LYS 76 7.103 0.228 -6.449 628 HE2 LYS 76 HE2 LYS 76 10.055 -0.499 -6.420 629 HE3 LYS 76 HE1 LYS 76 9.386 1.053 -6.913 630 HZ1 LYS 76 HZ1 LYS 76 9.355 -0.136 -4.204 631 HZ2 LYS 76 HZ2 LYS 76 8.503 1.268 -4.625 632 HZ3 LYS 76 HZ3 LYS 76 10.191 1.239 -4.717 633 H VAL 77 HN VAL 77 6.959 -5.053 -4.673 634 HA VAL 77 HA VAL 77 8.806 -6.090 -2.737 635 HB VAL 77 HB VAL 77 8.131 -7.270 -5.468 636 HG11 VAL 77 HG11 VAL 77 10.081 -8.325 -4.404 637 HG12 VAL 77 HG12 VAL 77 8.713 -9.438 -4.435 638 HG13 VAL 77 HG13 VAL 77 9.147 -8.618 -2.930 639 HG21 VAL 77 HG21 VAL 77 6.354 -8.551 -4.350 640 HG22 VAL 77 HG22 VAL 77 6.068 -6.814 -4.241 641 HG23 VAL 77 HG23 VAL 77 6.675 -7.694 -2.839 642 H SER 78 HN SER 78 10.863 -5.581 -2.681 643 HA SER 78 HA SER 78 12.405 -4.400 -4.758 644 HB2 SER 78 HB2 SER 78 12.924 -4.002 -2.392 645 HB3 SER 78 HB1 SER 78 13.234 -5.716 -2.138 646 HG SER 78 HG SER 78 14.714 -4.047 -3.895 647 H THR 79 HN THR 79 11.905 -7.682 -3.647 648 HA THR 79 HA THR 79 13.013 -8.934 -5.933 649 HB THR 79 HB THR 79 15.187 -8.346 -4.941 650 HG1 THR 79 HG1 THR 79 15.046 -11.095 -4.424 651 HG21 THR 79 HG21 THR 79 15.950 -9.320 -2.802 652 HG22 THR 79 HG22 THR 79 14.321 -9.934 -2.509 653 HG23 THR 79 HG23 THR 79 14.610 -8.192 -2.574 654 H GLY 80 HN GLY 80 12.237 -10.965 -6.113 655 HA2 GLY 80 HA2 GLY 80 11.728 -12.994 -4.479 656 HA3 GLY 80 HA1 GLY 80 10.383 -11.932 -4.069 657 HA PRO 81 HA PRO 81 8.915 -14.564 -7.647 658 HB2 PRO 81 HB2 PRO 81 6.330 -14.825 -6.703 659 HB3 PRO 81 HB1 PRO 81 7.646 -15.921 -6.250 660 HG2 PRO 81 HG2 PRO 81 6.571 -13.525 -4.752 661 HG3 PRO 81 HG1 PRO 81 6.948 -15.146 -4.131 662 HD2 PRO 81 HD2 PRO 81 8.667 -13.106 -3.790 663 HD3 PRO 81 HD1 PRO 81 9.261 -14.751 -4.125 664 H LEU 82 HN LEU 82 7.716 -11.673 -6.064 665 HA LEU 82 HA LEU 82 6.311 -10.782 -8.524 666 HB2 LEU 82 HB2 LEU 82 5.740 -9.993 -5.635 667 HB3 LEU 82 HB1 LEU 82 4.839 -9.473 -7.056 668 HG LEU 82 HG LEU 82 4.942 -12.291 -5.904 669 HD11 LEU 82 HD11 LEU 82 3.540 -10.729 -4.647 670 HD12 LEU 82 HD12 LEU 82 2.577 -11.965 -5.439 671 HD13 LEU 82 HD13 LEU 82 2.636 -10.334 -6.111 672 HD21 LEU 82 HD21 LEU 82 4.847 -12.436 -8.351 673 HD22 LEU 82 HD22 LEU 82 3.459 -11.345 -8.381 674 HD23 LEU 82 HD23 LEU 82 3.319 -12.940 -7.633 675 H ALA 83 HN ALA 83 9.145 -10.471 -7.964 676 HA ALA 83 HA ALA 83 9.911 -8.008 -6.873 677 HB1 ALA 83 HB1 ALA 83 12.010 -8.309 -8.112 678 HB2 ALA 83 HB2 ALA 83 11.257 -9.548 -9.117 679 HB3 ALA 83 HB3 ALA 83 11.489 -9.834 -7.392 680 H GLY 84 HN GLY 84 9.257 -6.040 -7.482 681 HA2 GLY 84 HA2 GLY 84 9.566 -4.235 -9.103 682 HA3 GLY 84 HA1 GLY 84 8.990 -5.320 -10.360 683 H ARG 85 HN ARG 85 6.874 -6.386 -8.522 684 HA ARG 85 HA ARG 85 4.768 -4.599 -9.344 685 HB2 ARG 85 HB2 ARG 85 4.560 -7.044 -7.519 686 HB3 ARG 85 HB1 ARG 85 3.222 -6.225 -8.329 687 HG2 ARG 85 HG2 ARG 85 4.213 -6.890 -10.536 688 HG3 ARG 85 HG1 ARG 85 5.464 -7.785 -9.666 689 HD2 ARG 85 HD2 ARG 85 3.603 -9.131 -8.579 690 HD3 ARG 85 HD1 ARG 85 2.474 -8.335 -9.680 691 HE ARG 85 HE ARG 85 4.659 -9.552 -11.068 692 HH11 ARG 85 HH11 ARG 85 1.477 -10.222 -9.720 693 HH12 ARG 85 HH12 ARG 85 1.310 -11.725 -10.563 694 HH21 ARG 85 HH21 ARG 85 4.445 -11.537 -12.129 695 HH22 ARG 85 HH22 ARG 85 3.000 -12.482 -11.927 696 H VAL 86 HN VAL 86 3.450 -3.309 -8.102 697 HA VAL 86 HA VAL 86 4.298 -2.719 -5.331 698 HB VAL 86 HB VAL 86 4.725 -0.818 -6.778 699 HG11 VAL 86 HG11 VAL 86 1.797 -0.825 -7.583 700 HG12 VAL 86 HG12 VAL 86 3.160 -1.243 -8.618 701 HG13 VAL 86 HG13 VAL 86 2.978 0.412 -8.029 702 HG21 VAL 86 HG21 VAL 86 2.320 -0.251 -5.002 703 HG22 VAL 86 HG22 VAL 86 3.488 0.945 -5.566 704 HG23 VAL 86 HG23 VAL 86 4.001 -0.340 -4.470 705 H LEU 87 HN LEU 87 3.060 -3.968 -4.160 706 HA LEU 87 HA LEU 87 0.257 -4.468 -4.686 707 HB2 LEU 87 HB2 LEU 87 1.950 -5.438 -2.348 708 HB3 LEU 87 HB1 LEU 87 0.355 -6.014 -2.778 709 HG LEU 87 HG LEU 87 1.830 -7.708 -3.492 710 HD11 LEU 87 HD11 LEU 87 1.609 -7.837 -5.906 711 HD12 LEU 87 HD12 LEU 87 1.238 -6.112 -5.990 712 HD13 LEU 87 HD13 LEU 87 0.135 -7.215 -5.165 713 HD21 LEU 87 HD21 LEU 87 3.587 -5.654 -4.848 714 HD22 LEU 87 HD22 LEU 87 3.829 -7.406 -4.843 715 HD23 LEU 87 HD23 LEU 87 3.935 -6.499 -3.336 716 H ASN 88 HN ASN 88 -1.278 -3.151 -4.019 717 HA ASN 88 HA ASN 88 -0.864 -1.064 -2.026 718 HB2 ASN 88 HB2 ASN 88 -3.305 -1.749 -3.735 719 HB3 ASN 88 HB1 ASN 88 -3.172 -0.342 -2.688 720 HD21 ASN 88 HD21 ASN 88 -0.597 -1.592 -4.847 721 HD22 ASN 88 HD22 ASN 88 -0.602 -0.226 -5.885 722 H ILE 89 HN ILE 89 -1.932 -0.993 0.042 723 HA ILE 89 HA ILE 89 -2.602 -3.632 1.082 724 HB ILE 89 HB ILE 89 -2.402 -0.934 2.512 725 HG12 ILE 89 HG12 ILE 89 -0.421 -3.255 2.475 726 HG13 ILE 89 HG11 ILE 89 -0.223 -1.744 1.592 727 HG21 ILE 89 HG21 ILE 89 -2.687 -3.714 3.739 728 HG22 ILE 89 HG22 ILE 89 -3.916 -2.449 3.743 729 HG23 ILE 89 HG23 ILE 89 -2.417 -2.216 4.639 730 HD11 ILE 89 HD11 ILE 89 -0.292 -2.050 4.599 731 HD12 ILE 89 HD12 ILE 89 -0.132 -0.517 3.723 732 HD13 ILE 89 HD13 ILE 89 1.130 -1.751 3.595 733 H ILE 90 HN ILE 90 -4.625 -4.329 1.020 734 HA ILE 90 HA ILE 90 -6.878 -2.424 0.821 735 HB ILE 90 HB ILE 90 -8.236 -4.512 0.177 736 HG12 ILE 90 HG12 ILE 90 -5.460 -5.725 -0.236 737 HG13 ILE 90 HG11 ILE 90 -6.597 -6.230 1.000 738 HG21 ILE 90 HG21 ILE 90 -6.002 -3.616 -1.673 739 HG22 ILE 90 HG22 ILE 90 -7.556 -2.815 -1.445 740 HG23 ILE 90 HG23 ILE 90 -7.496 -4.417 -2.176 741 HD11 ILE 90 HD11 ILE 90 -6.955 -6.490 -1.982 742 HD12 ILE 90 HD12 ILE 90 -8.146 -6.972 -0.769 743 HD13 ILE 90 HD13 ILE 90 -6.581 -7.780 -0.840 744 H GLY 91 HN GLY 91 -8.406 -2.301 2.339 745 HA2 GLY 91 HA2 GLY 91 -9.435 -2.524 4.388 746 HA3 GLY 91 HA1 GLY 91 -8.616 -4.072 4.612 747 H GLN 92 HN GLN 92 -7.276 -4.033 6.306 748 HA GLN 92 HA GLN 92 -5.334 -1.882 6.665 749 HB2 GLN 92 HB2 GLN 92 -5.824 -1.654 9.085 750 HB3 GLN 92 HB1 GLN 92 -7.209 -1.174 8.108 751 HG2 GLN 92 HG2 GLN 92 -8.257 -3.392 8.567 752 HG3 GLN 92 HG1 GLN 92 -6.885 -3.802 9.598 753 HE21 GLN 92 HE21 GLN 92 -9.729 -1.783 9.268 754 HE22 GLN 92 HE22 GLN 92 -9.835 -1.326 10.930 755 HA PRO 93 HA PRO 93 -2.626 -5.378 7.288 756 HB2 PRO 93 HB2 PRO 93 -0.874 -4.373 9.238 757 HB3 PRO 93 HB1 PRO 93 -0.762 -4.029 7.507 758 HG2 PRO 93 HG2 PRO 93 -2.040 -2.388 9.692 759 HG3 PRO 93 HG1 PRO 93 -0.988 -1.851 8.363 760 HD2 PRO 93 HD2 PRO 93 -3.629 -1.507 8.210 761 HD3 PRO 93 HD1 PRO 93 -2.720 -2.012 6.765 762 H LEU 94 HN LEU 94 -2.470 -7.198 8.560 763 HA LEU 94 HA LEU 94 -3.979 -7.242 11.118 764 HB2 LEU 94 HB2 LEU 94 -4.945 -8.433 9.032 765 HB3 LEU 94 HB1 LEU 94 -3.630 -9.576 9.184 766 HG LEU 94 HG LEU 94 -5.884 -10.334 10.071 767 HD11 LEU 94 HD11 LEU 94 -5.047 -11.495 12.025 768 HD12 LEU 94 HD12 LEU 94 -3.662 -10.402 12.115 769 HD13 LEU 94 HD13 LEU 94 -3.838 -11.493 10.739 770 HD21 LEU 94 HD21 LEU 94 -5.339 -8.358 12.302 771 HD22 LEU 94 HD22 LEU 94 -6.638 -9.556 12.264 772 HD23 LEU 94 HD23 LEU 94 -6.617 -8.244 11.088 773 HA PRO 95 HA PRO 95 0.280 -8.304 12.514 774 HB2 PRO 95 HB2 PRO 95 -0.273 -8.290 15.223 775 HB3 PRO 95 HB1 PRO 95 0.041 -6.826 14.283 776 HG2 PRO 95 HG2 PRO 95 -2.612 -8.023 15.077 777 HG3 PRO 95 HG1 PRO 95 -2.079 -6.330 15.162 778 HD2 PRO 95 HD2 PRO 95 -3.643 -7.201 13.138 779 HD3 PRO 95 HD1 PRO 95 -2.367 -5.988 12.858 780 H ASP 96 HN ASP 96 1.246 -10.187 13.395 781 HA ASP 96 HA ASP 96 0.004 -12.662 13.016 782 HB2 ASP 96 HB2 ASP 96 2.401 -12.341 12.944 783 HB3 ASP 96 HB1 ASP 96 2.445 -11.840 14.623 784 H ALA 97 HN ALA 97 -0.593 -14.321 14.499 785 HA ALA 97 HA ALA 97 -2.264 -13.659 16.651 786 HB1 ALA 97 HB1 ALA 97 -2.328 -16.087 17.112 787 HB2 ALA 97 HB2 ALA 97 -0.948 -16.326 16.036 788 HB3 ALA 97 HB3 ALA 97 -2.481 -15.749 15.385 789 H ALA 98 HN ALA 98 1.102 -14.810 16.636 790 HA ALA 98 HA ALA 98 1.370 -14.562 19.543 791 HB1 ALA 98 HB1 ALA 98 3.419 -15.344 17.446 792 HB2 ALA 98 HB2 ALA 98 2.425 -16.465 18.376 793 HB3 ALA 98 HB3 ALA 98 3.630 -15.468 19.194 794 H ARG 99 HN ARG 99 1.593 -12.519 16.882 795 HA ARG 99 HA ARG 99 2.211 -10.397 16.507 796 HB2 ARG 99 HB2 ARG 99 2.661 -10.363 19.507 797 HB3 ARG 99 HB1 ARG 99 3.053 -8.965 18.523 798 HG2 ARG 99 HG2 ARG 99 0.908 -8.548 19.456 799 HG3 ARG 99 HG1 ARG 99 0.642 -8.922 17.756 800 HD2 ARG 99 HD2 ARG 99 -0.086 -11.191 18.354 801 HD3 ARG 99 HD1 ARG 99 0.249 -10.866 20.057 802 HE ARG 99 HE ARG 99 -1.508 -9.071 19.861 803 HH11 ARG 99 HH11 ARG 99 -1.647 -11.867 17.756 804 HH12 ARG 99 HH12 ARG 99 -3.369 -11.807 17.593 805 HH21 ARG 99 HH21 ARG 99 -3.752 -9.012 19.656 806 HH22 ARG 99 HH22 ARG 99 -4.565 -10.188 18.676 807 H THR 100 HN THR 100 4.183 -12.705 16.407 808 HA THR 100 HA THR 100 6.788 -11.508 16.905 809 HB THR 100 HB THR 100 7.711 -13.580 15.867 810 HG1 THR 100 HG1 THR 100 5.014 -14.451 15.591 811 HG21 THR 100 HG21 THR 100 6.904 -15.180 17.546 812 HG22 THR 100 HG22 THR 100 5.502 -14.161 17.876 813 HG23 THR 100 HG23 THR 100 7.123 -13.589 18.280 814 H ARG 101 HN ARG 101 4.596 -10.873 14.597 815 HA ARG 101 HA ARG 101 6.323 -9.721 12.677 816 HB2 ARG 101 HB2 ARG 101 5.851 -11.194 10.753 817 HB3 ARG 101 HB1 ARG 101 6.627 -12.128 12.028 818 HG2 ARG 101 HG2 ARG 101 4.458 -13.034 12.709 819 HG3 ARG 101 HG1 ARG 101 3.652 -12.063 11.478 820 HD2 ARG 101 HD2 ARG 101 3.801 -14.254 10.631 821 HD3 ARG 101 HD1 ARG 101 4.997 -13.296 9.758 822 HE ARG 101 HE ARG 101 6.162 -14.583 12.020 823 HH11 ARG 101 HH11 ARG 101 5.191 -15.195 8.693 824 HH12 ARG 101 HH12 ARG 101 6.165 -16.612 8.538 825 HH21 ARG 101 HH21 ARG 101 7.454 -16.416 11.798 826 HH22 ARG 101 HH22 ARG 101 7.471 -17.306 10.313 827 H LEU 102 HN LEU 102 4.766 -9.377 10.571 828 HA LEU 102 HA LEU 102 2.065 -8.604 11.415 829 HB2 LEU 102 HB2 LEU 102 4.102 -6.736 11.112 830 HB3 LEU 102 HB1 LEU 102 3.475 -6.771 9.485 831 HG LEU 102 HG LEU 102 2.413 -4.938 10.519 832 HD11 LEU 102 HD11 LEU 102 0.043 -5.432 10.576 833 HD12 LEU 102 HD12 LEU 102 0.377 -7.160 10.716 834 HD13 LEU 102 HD13 LEU 102 0.824 -6.290 9.250 835 HD21 LEU 102 HD21 LEU 102 1.788 -6.671 12.920 836 HD22 LEU 102 HD22 LEU 102 1.301 -4.986 12.706 837 HD23 LEU 102 HD23 LEU 102 3.010 -5.401 12.827 838 H GLU 103 HN GLU 103 0.699 -9.699 10.129 839 HA GLU 103 HA GLU 103 1.454 -10.645 7.472 840 HB2 GLU 103 HB2 GLU 103 0.190 -12.176 8.912 841 HB3 GLU 103 HB1 GLU 103 -1.101 -10.996 9.107 842 HG2 GLU 103 HG2 GLU 103 -1.530 -11.167 6.633 843 HG3 GLU 103 HG1 GLU 103 -0.337 -12.461 6.563 844 H ILE 104 HN ILE 104 1.271 -9.213 5.845 845 HA ILE 104 HA ILE 104 -0.680 -7.009 5.974 846 HB ILE 104 HB ILE 104 1.471 -7.412 3.832 847 HG12 ILE 104 HG12 ILE 104 2.652 -7.322 5.991 848 HG13 ILE 104 HG11 ILE 104 2.927 -5.824 5.112 849 HG21 ILE 104 HG21 ILE 104 1.205 -4.983 3.456 850 HG22 ILE 104 HG22 ILE 104 -0.023 -4.912 4.724 851 HG23 ILE 104 HG23 ILE 104 -0.328 -5.835 3.251 852 HD11 ILE 104 HD11 ILE 104 1.040 -6.241 7.420 853 HD12 ILE 104 HD12 ILE 104 1.214 -4.736 6.512 854 HD13 ILE 104 HD13 ILE 104 2.574 -5.370 7.438 855 H LEU 105 HN LEU 105 -2.428 -6.967 4.639 856 HA LEU 105 HA LEU 105 -2.681 -8.997 2.509 857 HB2 LEU 105 HB2 LEU 105 -5.176 -8.695 2.709 858 HB3 LEU 105 HB1 LEU 105 -4.412 -9.497 4.063 859 HG LEU 105 HG LEU 105 -5.228 -6.559 4.145 860 HD11 LEU 105 HD11 LEU 105 -7.235 -7.250 5.377 861 HD12 LEU 105 HD12 LEU 105 -6.833 -8.950 5.114 862 HD13 LEU 105 HD13 LEU 105 -7.229 -7.910 3.742 863 HD21 LEU 105 HD21 LEU 105 -3.561 -7.149 5.834 864 HD22 LEU 105 HD22 LEU 105 -4.540 -8.514 6.377 865 HD23 LEU 105 HD23 LEU 105 -5.119 -6.861 6.603 866 H CYS 106 HN CYS 106 -3.055 -8.302 0.537 867 HA CYS 106 HA CYS 106 -3.272 -5.480 -0.131 868 HB2 CYS 106 HB2 CYS 106 -0.723 -7.044 -0.771 869 HB3 CYS 106 HB1 CYS 106 -1.117 -5.445 -1.386 870 HG CYS 106 HG CYS 106 -1.373 -5.051 1.751 871 H ARG 107 HN ARG 107 -3.076 -5.253 -2.554 872 HA ARG 107 HA ARG 107 -3.482 -7.716 -4.127 873 HB2 ARG 107 HB2 ARG 107 -5.250 -6.663 -5.464 874 HB3 ARG 107 HB1 ARG 107 -5.745 -6.690 -3.777 875 HG2 ARG 107 HG2 ARG 107 -5.184 -4.313 -3.538 876 HG3 ARG 107 HG1 ARG 107 -4.594 -4.264 -5.199 877 HD2 ARG 107 HD2 ARG 107 -6.839 -4.721 -6.047 878 HD3 ARG 107 HD1 ARG 107 -7.455 -4.880 -4.395 879 HE ARG 107 HE ARG 107 -6.192 -2.346 -4.863 880 HH11 ARG 107 HH11 ARG 107 -9.233 -4.044 -5.365 881 HH12 ARG 107 HH12 ARG 107 -10.173 -2.586 -5.355 882 HH21 ARG 107 HH21 ARG 107 -7.451 -0.462 -4.869 883 HH22 ARG 107 HH22 ARG 107 -9.166 -0.571 -5.084 884 H GLU 108 HN GLU 108 -2.715 -7.453 -6.334 885 HA GLU 108 HA GLU 108 -0.577 -5.838 -6.899 886 HB2 GLU 108 HB2 GLU 108 -2.660 -6.937 -8.834 887 HB3 GLU 108 HB1 GLU 108 -1.075 -6.323 -9.303 888 HG2 GLU 108 HG2 GLU 108 0.018 -8.087 -7.966 889 HG3 GLU 108 HG1 GLU 108 -1.566 -8.700 -7.481 890 H GLY 109 HN GLY 109 -0.292 -3.966 -8.215 891 HA2 GLY 109 HA2 GLY 109 -2.182 -1.854 -7.542 892 HA3 GLY 109 HA1 GLY 109 -0.568 -1.663 -8.212 893 H ALA 110 HN ALA 110 -3.200 -3.642 -9.450 894 HA ALA 110 HA ALA 110 -3.194 -2.410 -12.052 895 HB1 ALA 110 HB1 ALA 110 -3.573 -4.837 -11.815 896 HB2 ALA 110 HB2 ALA 110 -4.966 -4.054 -12.560 897 HB3 ALA 110 HB3 ALA 110 -5.029 -4.532 -10.863 898 H GLU 111 HN GLU 111 -3.652 -0.276 -11.432 899 HA GLU 111 HA GLU 111 -5.814 0.520 -9.759 900 HB2 GLU 111 HB2 GLU 111 -5.148 2.832 -10.472 901 HB3 GLU 111 HB1 GLU 111 -3.804 1.856 -9.883 902 HG2 GLU 111 HG2 GLU 111 -3.172 1.369 -12.249 903 HG3 GLU 111 HG1 GLU 111 -4.448 2.459 -12.788 904 H LYS 112 HN LYS 112 -5.700 -0.364 -13.029 905 HA LYS 112 HA LYS 112 -8.537 0.303 -13.343 906 HB2 LYS 112 HB2 LYS 112 -8.265 0.976 -15.684 907 HB3 LYS 112 HB1 LYS 112 -7.328 2.037 -14.642 908 HG2 LYS 112 HG2 LYS 112 -6.093 -0.262 -16.208 909 HG3 LYS 112 HG1 LYS 112 -6.253 1.374 -16.860 910 HD2 LYS 112 HD2 LYS 112 -4.865 2.227 -14.962 911 HD3 LYS 112 HD1 LYS 112 -4.670 0.569 -14.382 912 HE2 LYS 112 HE2 LYS 112 -3.514 -0.028 -16.479 913 HE3 LYS 112 HE1 LYS 112 -3.735 1.618 -17.075 914 HZ1 LYS 112 HZ1 LYS 112 -2.353 2.436 -15.318 915 HZ2 LYS 112 HZ2 LYS 112 -1.528 1.228 -16.163 916 HZ3 LYS 112 HZ3 LYS 112 -2.198 0.893 -14.650 Start of MODEL 3 1 H1 MET 1 HT1 MET 1 7.323 -20.147 15.924 2 H2 MET 1 HT2 MET 1 7.343 -21.771 15.462 3 H3 MET 1 HT3 MET 1 7.541 -21.355 17.090 4 HA MET 1 HA MET 1 5.339 -22.214 16.649 5 HB2 MET 1 HB2 MET 1 5.450 -19.257 17.373 6 HB3 MET 1 HB1 MET 1 4.037 -20.273 17.625 7 HG2 MET 1 HG2 MET 1 5.336 -21.690 19.177 8 HG3 MET 1 HG1 MET 1 6.743 -20.651 18.936 9 HE1 MET 1 HE1 MET 1 5.523 -19.699 22.595 10 HE2 MET 1 HE2 MET 1 6.918 -20.198 21.640 11 HE3 MET 1 HE3 MET 1 5.554 -21.297 21.849 12 H ASN 2 HN ASN 2 5.484 -18.924 15.204 13 HA ASN 2 HA ASN 2 3.488 -19.685 13.184 14 HB2 ASN 2 HB2 ASN 2 3.212 -17.562 14.495 15 HB3 ASN 2 HB1 ASN 2 4.698 -16.943 13.789 16 HD21 ASN 2 HD21 ASN 2 1.997 -15.858 13.665 17 HD22 ASN 2 HD22 ASN 2 1.598 -15.718 11.985 18 H ILE 3 HN ILE 3 4.363 -20.690 11.468 19 HA ILE 3 HA ILE 3 7.080 -20.139 10.533 20 HB ILE 3 HB ILE 3 5.075 -22.224 9.556 21 HG12 ILE 3 HG12 ILE 3 7.464 -22.562 11.433 22 HG13 ILE 3 HG11 ILE 3 5.775 -22.574 11.930 23 HG21 ILE 3 HG21 ILE 3 8.039 -21.936 8.920 24 HG22 ILE 3 HG22 ILE 3 6.699 -21.720 7.795 25 HG23 ILE 3 HG23 ILE 3 7.033 -23.317 8.463 26 HD11 ILE 3 HD11 ILE 3 7.098 -24.600 10.120 27 HD12 ILE 3 HD12 ILE 3 5.410 -24.621 10.636 28 HD13 ILE 3 HD13 ILE 3 6.698 -24.818 11.824 29 H GLY 4 HN GLY 4 6.235 -17.906 10.001 30 HA2 GLY 4 HA2 GLY 4 5.626 -17.804 7.087 31 HA3 GLY 4 HA1 GLY 4 5.357 -16.475 8.212 32 H ARG 5 HN ARG 5 8.082 -18.686 7.512 33 HA ARG 5 HA ARG 5 10.142 -17.001 8.304 34 HB2 ARG 5 HB2 ARG 5 9.978 -19.556 6.886 35 HB3 ARG 5 HB1 ARG 5 11.229 -18.578 6.150 36 HG2 ARG 5 HG2 ARG 5 12.362 -19.845 7.766 37 HG3 ARG 5 HG1 ARG 5 12.182 -18.258 8.512 38 HD2 ARG 5 HD2 ARG 5 11.679 -19.833 10.209 39 HD3 ARG 5 HD1 ARG 5 10.115 -19.199 9.689 40 HE ARG 5 HE ARG 5 10.277 -21.349 8.140 41 HH11 ARG 5 HH11 ARG 5 10.916 -21.081 11.591 42 HH12 ARG 5 HH12 ARG 5 10.570 -22.754 11.894 43 HH21 ARG 5 HH21 ARG 5 9.825 -23.511 8.564 44 HH22 ARG 5 HH22 ARG 5 9.962 -24.129 10.179 45 H LEU 6 HN LEU 6 11.326 -15.393 7.383 46 HA LEU 6 HA LEU 6 10.036 -13.934 5.259 47 HB2 LEU 6 HB2 LEU 6 12.565 -13.220 6.810 48 HB3 LEU 6 HB1 LEU 6 11.669 -12.149 5.752 49 HG LEU 6 HG LEU 6 11.093 -11.460 7.928 50 HD11 LEU 6 HD11 LEU 6 9.138 -11.626 6.492 51 HD12 LEU 6 HD12 LEU 6 8.717 -11.865 8.184 52 HD13 LEU 6 HD13 LEU 6 8.805 -13.254 7.095 53 HD21 LEU 6 HD21 LEU 6 10.388 -12.894 9.780 54 HD22 LEU 6 HD22 LEU 6 11.991 -13.340 9.201 55 HD23 LEU 6 HD23 LEU 6 10.596 -14.330 8.768 56 H ARG 7 HN ARG 7 10.323 -15.083 3.414 57 HA ARG 7 HA ARG 7 12.837 -16.236 2.558 58 HB2 ARG 7 HB2 ARG 7 10.236 -15.951 0.980 59 HB3 ARG 7 HB1 ARG 7 11.569 -17.058 0.630 60 HG2 ARG 7 HG2 ARG 7 11.092 -18.339 2.654 61 HG3 ARG 7 HG1 ARG 7 9.852 -17.175 3.136 62 HD2 ARG 7 HD2 ARG 7 8.631 -17.759 0.974 63 HD3 ARG 7 HD1 ARG 7 9.786 -19.084 0.776 64 HE ARG 7 HE ARG 7 8.478 -19.097 3.339 65 HH11 ARG 7 HH11 ARG 7 8.126 -20.144 0.003 66 HH12 ARG 7 HH12 ARG 7 6.946 -21.356 0.386 67 HH21 ARG 7 HH21 ARG 7 6.919 -20.660 3.823 68 HH22 ARG 7 HH22 ARG 7 6.264 -21.647 2.560 69 H ASP 8 HN ASP 8 10.818 -13.515 1.671 70 HA ASP 8 HA ASP 8 12.503 -12.701 -0.600 71 HB2 ASP 8 HB2 ASP 8 9.607 -12.026 0.124 72 HB3 ASP 8 HB1 ASP 8 10.435 -11.512 -1.344 73 H ARG 9 HN ARG 9 11.503 -10.046 -0.759 74 HA ARG 9 HA ARG 9 11.967 -8.579 1.687 75 HB2 ARG 9 HB2 ARG 9 14.315 -9.186 0.874 76 HB3 ARG 9 HB1 ARG 9 13.987 -8.261 -0.587 77 HG2 ARG 9 HG2 ARG 9 13.710 -6.209 0.793 78 HG3 ARG 9 HG1 ARG 9 14.095 -7.152 2.238 79 HD2 ARG 9 HD2 ARG 9 16.320 -7.685 1.249 80 HD3 ARG 9 HD1 ARG 9 15.915 -6.669 -0.138 81 HE ARG 9 HE ARG 9 15.841 -5.451 2.517 82 HH11 ARG 9 HH11 ARG 9 17.566 -5.771 -0.531 83 HH12 ARG 9 HH12 ARG 9 18.595 -4.411 -0.221 84 HH21 ARG 9 HH21 ARG 9 17.194 -3.684 2.903 85 HH22 ARG 9 HH22 ARG 9 18.373 -3.232 1.714 86 H ILE 10 HN ILE 10 11.032 -6.527 1.537 87 HA ILE 10 HA ILE 10 10.051 -5.524 -1.080 88 HB ILE 10 HB ILE 10 7.848 -5.075 -0.295 89 HG12 ILE 10 HG12 ILE 10 8.233 -4.220 1.948 90 HG13 ILE 10 HG11 ILE 10 7.015 -5.474 2.032 91 HG21 ILE 10 HG21 ILE 10 8.090 -7.384 -0.949 92 HG22 ILE 10 HG22 ILE 10 6.910 -7.263 0.355 93 HG23 ILE 10 HG23 ILE 10 8.541 -7.850 0.691 94 HD11 ILE 10 HD11 ILE 10 9.839 -5.529 3.001 95 HD12 ILE 10 HD12 ILE 10 8.884 -6.993 2.825 96 HD13 ILE 10 HD13 ILE 10 8.343 -5.717 3.909 97 H THR 11 HN THR 11 9.270 -3.235 -0.872 98 HA THR 11 HA THR 11 10.744 -1.619 1.117 99 HB THR 11 HB THR 11 9.873 -0.712 -1.680 100 HG1 THR 11 HG1 THR 11 11.458 -2.293 -1.930 101 HG21 THR 11 HG21 THR 11 11.423 1.161 -1.296 102 HG22 THR 11 HG22 THR 11 11.842 0.513 0.292 103 HG23 THR 11 HG23 THR 11 10.209 1.111 -0.013 104 H ILE 12 HN ILE 12 9.519 -0.167 2.267 105 HA ILE 12 HA ILE 12 6.590 -0.235 1.952 106 HB ILE 12 HB ILE 12 8.157 1.004 4.254 107 HG12 ILE 12 HG12 ILE 12 8.724 -1.381 4.153 108 HG13 ILE 12 HG11 ILE 12 7.670 -1.082 5.525 109 HG21 ILE 12 HG21 ILE 12 6.016 0.802 5.496 110 HG22 ILE 12 HG22 ILE 12 5.231 0.179 4.043 111 HG23 ILE 12 HG23 ILE 12 5.853 1.829 4.070 112 HD11 ILE 12 HD11 ILE 12 7.137 -3.154 4.391 113 HD12 ILE 12 HD12 ILE 12 6.816 -2.283 2.892 114 HD13 ILE 12 HD13 ILE 12 5.787 -2.022 4.307 115 H GLN 13 HN GLN 13 6.079 1.179 0.381 116 HA GLN 13 HA GLN 13 7.041 3.876 0.225 117 HB2 GLN 13 HB2 GLN 13 4.832 2.368 -1.216 118 HB3 GLN 13 HB1 GLN 13 4.978 4.113 -1.385 119 HG2 GLN 13 HG2 GLN 13 6.072 3.008 -3.243 120 HG3 GLN 13 HG1 GLN 13 7.262 3.861 -2.261 121 HE21 GLN 13 HE21 GLN 13 8.988 2.623 -2.963 122 HE22 GLN 13 HE22 GLN 13 9.186 0.954 -2.559 123 H THR 14 HN THR 14 6.686 5.025 1.909 124 HA THR 14 HA THR 14 4.260 5.116 3.491 125 HB THR 14 HB THR 14 5.473 7.041 4.649 126 HG1 THR 14 HG1 THR 14 6.907 7.018 2.425 127 HG21 THR 14 HG21 THR 14 7.061 4.461 4.348 128 HG22 THR 14 HG22 THR 14 5.761 4.750 5.511 129 HG23 THR 14 HG23 THR 14 7.273 5.649 5.636 130 H LEU 15 HN LEU 15 2.798 6.919 3.633 131 HA LEU 15 HA LEU 15 2.616 8.561 1.194 132 HB2 LEU 15 HB2 LEU 15 0.626 7.180 1.820 133 HB3 LEU 15 HB1 LEU 15 0.553 7.998 3.371 134 HG LEU 15 HG LEU 15 0.118 10.160 2.174 135 HD11 LEU 15 HD11 LEU 15 -0.045 8.444 -0.318 136 HD12 LEU 15 HD12 LEU 15 1.154 9.691 0.031 137 HD13 LEU 15 HD13 LEU 15 -0.531 10.133 -0.193 138 HD21 LEU 15 HD21 LEU 15 -1.879 7.953 1.585 139 HD22 LEU 15 HD22 LEU 15 -2.222 9.686 1.603 140 HD23 LEU 15 HD23 LEU 15 -1.744 8.871 3.089 141 H LYS 16 HN LYS 16 3.817 10.386 1.546 142 HA LYS 16 HA LYS 16 3.375 11.938 4.002 143 HB2 LYS 16 HB2 LYS 16 5.723 11.770 3.335 144 HB3 LYS 16 HB1 LYS 16 5.355 12.365 1.719 145 HG2 LYS 16 HG2 LYS 16 4.829 14.561 2.557 146 HG3 LYS 16 HG1 LYS 16 4.882 14.006 4.227 147 HD2 LYS 16 HD2 LYS 16 7.350 13.880 2.463 148 HD3 LYS 16 HD1 LYS 16 6.901 15.374 3.283 149 HE2 LYS 16 HE2 LYS 16 8.556 14.191 4.617 150 HE3 LYS 16 HE1 LYS 16 7.021 14.184 5.473 151 HZ1 LYS 16 HZ1 LYS 16 8.154 11.926 3.917 152 HZ2 LYS 16 HZ2 LYS 16 6.675 11.909 4.734 153 HZ3 LYS 16 HZ3 LYS 16 8.117 12.049 5.603 154 H GLN 17 HN GLN 17 1.761 13.307 3.993 155 HA GLN 17 HA GLN 17 0.643 14.493 1.591 156 HB2 GLN 17 HB2 GLN 17 0.049 14.867 4.562 157 HB3 GLN 17 HB1 GLN 17 -0.822 15.693 3.276 158 HG2 GLN 17 HG2 GLN 17 -1.469 13.434 2.370 159 HG3 GLN 17 HG1 GLN 17 -0.757 12.712 3.807 160 HE21 GLN 17 HE21 GLN 17 -3.560 12.698 2.846 161 HE22 GLN 17 HE22 GLN 17 -4.504 13.362 4.135 162 H THR 18 HN THR 18 2.228 15.772 0.701 163 HA THR 18 HA THR 18 3.753 17.672 2.312 164 HB THR 18 HB THR 18 3.950 17.032 -0.670 165 HG1 THR 18 HG1 THR 18 4.454 15.316 1.008 166 HG21 THR 18 HG21 THR 18 6.177 18.092 -0.554 167 HG22 THR 18 HG22 THR 18 5.922 18.469 1.152 168 HG23 THR 18 HG23 THR 18 4.916 19.235 -0.080 169 H ARG 19 HN ARG 19 2.823 19.641 2.634 170 HA ARG 19 HA ARG 19 0.678 20.620 1.006 171 HB2 ARG 19 HB2 ARG 19 0.973 21.071 3.492 172 HB3 ARG 19 HB1 ARG 19 2.253 22.204 3.073 173 HG2 ARG 19 HG2 ARG 19 0.592 23.508 1.715 174 HG3 ARG 19 HG1 ARG 19 -0.675 22.406 2.261 175 HD2 ARG 19 HD2 ARG 19 -0.714 24.458 3.569 176 HD3 ARG 19 HD1 ARG 19 -0.245 23.096 4.591 177 HE ARG 19 HE ARG 19 2.047 23.857 4.460 178 HH11 ARG 19 HH11 ARG 19 -0.350 26.254 3.498 179 HH12 ARG 19 HH12 ARG 19 0.721 27.592 3.763 180 HH21 ARG 19 HH21 ARG 19 3.422 25.618 4.816 181 HH22 ARG 19 HH22 ARG 19 2.858 27.230 4.493 182 H ASP 20 HN ASP 20 0.734 22.749 -0.101 183 HA ASP 20 HA ASP 20 3.311 23.196 -1.529 184 HB2 ASP 20 HB2 ASP 20 1.395 22.274 -2.907 185 HB3 ASP 20 HB1 ASP 20 0.467 23.722 -2.530 186 H ILE 21 HN ILE 21 3.546 25.504 -2.340 187 HA ILE 21 HA ILE 21 3.222 27.475 -0.370 188 HB ILE 21 HB ILE 21 5.005 27.392 -2.138 189 HG12 ILE 21 HG12 ILE 21 3.486 30.046 -2.026 190 HG13 ILE 21 HG11 ILE 21 4.645 29.488 -0.826 191 HG21 ILE 21 HG21 ILE 21 3.596 26.823 -4.068 192 HG22 ILE 21 HG22 ILE 21 4.562 28.262 -4.398 193 HG23 ILE 21 HG23 ILE 21 2.846 28.420 -4.012 194 HD11 ILE 21 HD11 ILE 21 5.237 30.209 -3.698 195 HD12 ILE 21 HD12 ILE 21 6.417 29.580 -2.547 196 HD13 ILE 21 HD13 ILE 21 5.650 31.140 -2.259 197 H THR 22 HN THR 22 0.791 26.261 -2.441 198 HA THR 22 HA THR 22 -0.802 28.755 -2.423 199 HB THR 22 HB THR 22 -2.365 27.411 -3.894 200 HG1 THR 22 HG1 THR 22 -1.545 25.406 -4.707 201 HG21 THR 22 HG21 THR 22 -0.682 28.881 -4.973 202 HG22 THR 22 HG22 THR 22 -0.971 27.428 -5.930 203 HG23 THR 22 HG23 THR 22 0.491 27.556 -4.951 204 H GLY 23 HN GLY 23 -0.147 25.950 -0.755 205 HA2 GLY 23 HA2 GLY 23 -0.906 25.337 1.369 206 HA3 GLY 23 HA1 GLY 23 -2.338 26.325 1.141 207 H GLU 24 HN GLU 24 -1.255 23.870 -1.173 208 HA GLU 24 HA GLU 24 -3.765 22.389 -0.785 209 HB2 GLU 24 HB2 GLU 24 -1.734 22.279 -3.065 210 HB3 GLU 24 HB1 GLU 24 -3.234 21.354 -2.990 211 HG2 GLU 24 HG2 GLU 24 -4.518 23.471 -3.015 212 HG3 GLU 24 HG1 GLU 24 -3.004 24.372 -3.154 213 H ILE 25 HN ILE 25 -3.738 20.227 -0.224 214 HA ILE 25 HA ILE 25 -1.263 19.139 0.910 215 HB ILE 25 HB ILE 25 -4.141 18.111 1.011 216 HG12 ILE 25 HG12 ILE 25 -3.796 20.261 2.251 217 HG13 ILE 25 HG11 ILE 25 -4.194 18.932 3.330 218 HG21 ILE 25 HG21 ILE 25 -1.689 17.096 2.494 219 HG22 ILE 25 HG22 ILE 25 -2.595 16.239 1.244 220 HG23 ILE 25 HG23 ILE 25 -3.352 16.579 2.798 221 HD11 ILE 25 HD11 ILE 25 -2.485 20.382 4.260 222 HD12 ILE 25 HD12 ILE 25 -1.433 20.062 2.881 223 HD13 ILE 25 HD13 ILE 25 -1.858 18.756 3.993 224 H LEU 26 HN LEU 26 0.018 18.288 -0.701 225 HA LEU 26 HA LEU 26 -1.088 16.660 -2.871 226 HB2 LEU 26 HB2 LEU 26 1.736 17.657 -2.301 227 HB3 LEU 26 HB1 LEU 26 1.386 16.523 -3.586 228 HG LEU 26 HG LEU 26 1.633 18.711 -4.545 229 HD11 LEU 26 HD11 LEU 26 -1.296 17.960 -4.557 230 HD12 LEU 26 HD12 LEU 26 -0.033 17.288 -5.591 231 HD13 LEU 26 HD13 LEU 26 -0.472 18.987 -5.733 232 HD21 LEU 26 HD21 LEU 26 1.185 20.096 -2.583 233 HD22 LEU 26 HD22 LEU 26 -0.537 19.727 -2.689 234 HD23 LEU 26 HD23 LEU 26 0.256 20.639 -3.976 235 H GLU 27 HN GLU 27 -1.608 14.652 -2.211 236 HA GLU 27 HA GLU 27 -0.097 13.205 -0.203 237 HB2 GLU 27 HB2 GLU 27 -2.413 12.287 -1.969 238 HB3 GLU 27 HB1 GLU 27 -1.733 11.385 -0.613 239 HG2 GLU 27 HG2 GLU 27 -2.386 13.213 0.911 240 HG3 GLU 27 HG1 GLU 27 -3.107 14.070 -0.439 241 H THR 28 HN THR 28 1.715 12.227 -0.702 242 HA THR 28 HA THR 28 2.234 11.150 -3.423 243 HB THR 28 HB THR 28 4.673 11.966 -3.057 244 HG1 THR 28 HG1 THR 28 3.781 12.713 -0.748 245 HG21 THR 28 HG21 THR 28 3.202 12.992 -4.739 246 HG22 THR 28 HG22 THR 28 4.209 14.223 -3.968 247 HG23 THR 28 HG23 THR 28 2.510 14.055 -3.512 248 H TRP 29 HN TRP 29 3.583 9.376 -3.520 249 HA TRP 29 HA TRP 29 3.853 7.823 -1.018 250 HB2 TRP 29 HB2 TRP 29 3.686 6.848 -3.908 251 HB3 TRP 29 HB1 TRP 29 3.801 5.824 -2.479 252 HD1 TRP 29 HD1 TRP 29 1.291 7.843 -4.509 253 HE1 TRP 29 HE1 TRP 29 -1.063 7.408 -3.575 254 HE3 TRP 29 HE3 TRP 29 2.559 5.337 -0.245 255 HZ2 TRP 29 HZ2 TRP 29 -2.240 6.188 -1.318 256 HZ3 TRP 29 HZ3 TRP 29 0.765 4.567 1.246 257 HH2 TRP 29 HH2 TRP 29 -1.593 4.983 0.727 258 H GLU 30 HN GLU 30 5.789 8.266 -0.308 259 HA GLU 30 HA GLU 30 8.183 8.252 -2.075 260 HB2 GLU 30 HB2 GLU 30 9.386 9.170 -0.054 261 HB3 GLU 30 HB1 GLU 30 8.130 10.219 -0.698 262 HG2 GLU 30 HG2 GLU 30 6.618 9.620 1.108 263 HG3 GLU 30 HG1 GLU 30 7.755 8.411 1.704 264 H ASP 31 HN ASP 31 9.665 6.645 -1.925 265 HA ASP 31 HA ASP 31 8.982 4.193 -0.618 266 HB2 ASP 31 HB2 ASP 31 11.078 3.287 -1.518 267 HB3 ASP 31 HB1 ASP 31 10.246 4.219 -2.755 268 H GLY 32 HN GLY 32 9.987 3.199 1.159 269 HA2 GLY 32 HA2 GLY 32 11.233 5.099 3.061 270 HA3 GLY 32 HA1 GLY 32 10.123 3.806 3.505 271 H HIS 33 HN HIS 33 10.960 1.909 4.086 272 HA HIS 33 HA HIS 33 13.854 1.441 3.648 273 HB2 HIS 33 HB2 HIS 33 12.172 0.900 6.133 274 HB3 HIS 33 HB1 HIS 33 13.797 0.256 5.894 275 HD1 HIS 33 HD1 HIS 33 11.984 3.392 6.819 276 HD2 HIS 33 HD2 HIS 33 15.873 2.181 6.004 277 HE1 HIS 33 HE1 HIS 33 13.451 5.272 7.624 278 HE2 HIS 33 HE2 HIS 33 15.809 4.502 7.144 279 H THR 34 HN THR 34 14.489 -0.614 3.163 280 HA THR 34 HA THR 34 12.404 -2.367 2.071 281 HB THR 34 HB THR 34 15.394 -2.321 1.443 282 HG1 THR 34 HG1 THR 34 13.330 -1.097 -0.094 283 HG21 THR 34 HG21 THR 34 13.023 -3.406 -0.136 284 HG22 THR 34 HG22 THR 34 14.206 -4.388 0.732 285 HG23 THR 34 HG23 THR 34 14.707 -3.430 -0.663 286 H LEU 35 HN LEU 35 11.867 -3.875 3.628 287 HA LEU 35 HA LEU 35 13.991 -5.187 5.232 288 HB2 LEU 35 HB2 LEU 35 12.347 -5.581 6.996 289 HB3 LEU 35 HB1 LEU 35 12.478 -3.868 6.663 290 HG LEU 35 HG LEU 35 10.204 -5.485 5.449 291 HD11 LEU 35 HD11 LEU 35 8.765 -4.933 7.350 292 HD12 LEU 35 HD12 LEU 35 10.136 -4.219 8.206 293 HD13 LEU 35 HD13 LEU 35 10.112 -5.952 7.865 294 HD21 LEU 35 HD21 LEU 35 10.551 -3.215 4.582 295 HD22 LEU 35 HD22 LEU 35 10.454 -2.559 6.214 296 HD23 LEU 35 HD23 LEU 35 9.040 -3.316 5.478 297 H TRP 36 HN TRP 36 13.256 -7.354 6.076 298 HA TRP 36 HA TRP 36 12.880 -9.143 3.898 299 HB2 TRP 36 HB2 TRP 36 12.823 -9.797 6.870 300 HB3 TRP 36 HB1 TRP 36 13.197 -10.900 5.552 301 HD1 TRP 36 HD1 TRP 36 14.934 -9.105 8.157 302 HE1 TRP 36 HE1 TRP 36 17.409 -8.731 7.607 303 HE3 TRP 36 HE3 TRP 36 14.811 -10.088 3.144 304 HZ2 TRP 36 HZ2 TRP 36 19.099 -8.822 5.359 305 HZ3 TRP 36 HZ3 TRP 36 16.894 -9.907 1.867 306 HH2 TRP 36 HH2 TRP 36 19.003 -9.293 2.944 307 H ALA 37 HN ALA 37 11.125 -10.116 3.169 308 HA ALA 37 HA ALA 37 8.645 -10.379 4.771 309 HB1 ALA 37 HB1 ALA 37 7.296 -9.879 2.731 310 HB2 ALA 37 HB2 ALA 37 8.786 -9.454 1.880 311 HB3 ALA 37 HB3 ALA 37 8.256 -8.508 3.266 312 H SER 38 HN SER 38 7.082 -12.011 3.597 313 HA SER 38 HA SER 38 8.393 -13.777 1.658 314 HB2 SER 38 HB2 SER 38 8.310 -14.866 3.942 315 HB3 SER 38 HB1 SER 38 6.556 -14.690 3.929 316 HG SER 38 HG SER 38 6.771 -15.888 1.812 317 H VAL 39 HN VAL 39 7.319 -13.178 -0.134 318 HA VAL 39 HA VAL 39 4.573 -12.170 -0.058 319 HB VAL 39 HB VAL 39 6.646 -12.151 -2.309 320 HG11 VAL 39 HG11 VAL 39 5.180 -10.445 -3.385 321 HG12 VAL 39 HG12 VAL 39 3.978 -10.692 -2.118 322 HG13 VAL 39 HG13 VAL 39 4.368 -12.006 -3.229 323 HG21 VAL 39 HG21 VAL 39 5.852 -9.920 -0.389 324 HG22 VAL 39 HG22 VAL 39 6.989 -9.769 -1.731 325 HG23 VAL 39 HG23 VAL 39 7.379 -10.809 -0.360 326 H ASN 40 HN ASN 40 3.139 -13.824 -0.144 327 HA ASN 40 HA ASN 40 3.339 -15.919 -2.213 328 HB2 ASN 40 HB2 ASN 40 1.937 -15.892 0.512 329 HB3 ASN 40 HB1 ASN 40 1.771 -17.188 -0.666 330 HD21 ASN 40 HD21 ASN 40 4.344 -17.402 -1.578 331 HD22 ASN 40 HD22 ASN 40 5.350 -17.992 -0.302 332 H MET 41 HN MET 41 2.094 -15.216 -3.942 333 HA MET 41 HA MET 41 -0.274 -13.622 -3.706 334 HB2 MET 41 HB2 MET 41 0.644 -15.405 -6.006 335 HB3 MET 41 HB1 MET 41 -0.634 -14.194 -6.102 336 HG2 MET 41 HG2 MET 41 1.059 -12.424 -5.617 337 HG3 MET 41 HG1 MET 41 2.312 -13.665 -5.601 338 HE1 MET 41 HE1 MET 41 -0.272 -11.670 -7.826 339 HE2 MET 41 HE2 MET 41 -0.830 -13.332 -8.038 340 HE3 MET 41 HE3 MET 41 -0.087 -12.471 -9.385 341 H VAL 42 HN VAL 42 -2.291 -14.290 -3.177 342 HA VAL 42 HA VAL 42 -2.848 -16.803 -2.126 343 HB VAL 42 HB VAL 42 -5.061 -16.103 -1.692 344 HG11 VAL 42 HG11 VAL 42 -3.441 -14.764 -0.450 345 HG12 VAL 42 HG12 VAL 42 -4.887 -13.812 -0.790 346 HG13 VAL 42 HG13 VAL 42 -3.415 -13.551 -1.733 347 HG21 VAL 42 HG21 VAL 42 -5.854 -15.565 -3.934 348 HG22 VAL 42 HG22 VAL 42 -4.909 -14.076 -3.948 349 HG23 VAL 42 HG23 VAL 42 -6.263 -14.250 -2.829 350 H SER 43 HN SER 43 -3.851 -18.610 -2.884 351 HA SER 43 HA SER 43 -4.074 -18.914 -5.799 352 HB2 SER 43 HB2 SER 43 -2.579 -20.452 -4.436 353 HB3 SER 43 HB1 SER 43 -4.027 -21.083 -3.658 354 HG SER 43 HG SER 43 -3.590 -21.075 -6.452 355 H SER 44 HN SER 44 -5.793 -20.839 -6.232 356 HA SER 44 HA SER 44 -8.347 -19.727 -6.082 357 HB2 SER 44 HB2 SER 44 -7.674 -22.666 -6.524 358 HB3 SER 44 HB1 SER 44 -9.114 -21.813 -7.085 359 HG SER 44 HG SER 44 -7.758 -20.571 -8.436 360 H LYS 45 HN LYS 45 -6.744 -22.040 -3.946 361 HA LYS 45 HA LYS 45 -8.864 -23.241 -2.624 362 HB2 LYS 45 HB2 LYS 45 -6.587 -24.009 -2.373 363 HB3 LYS 45 HB1 LYS 45 -6.094 -22.490 -1.638 364 HG2 LYS 45 HG2 LYS 45 -7.492 -23.008 0.350 365 HG3 LYS 45 HG1 LYS 45 -7.950 -24.550 -0.387 366 HD2 LYS 45 HD2 LYS 45 -5.552 -25.242 -0.375 367 HD3 LYS 45 HD1 LYS 45 -5.122 -23.698 0.369 368 HE2 LYS 45 HE2 LYS 45 -6.965 -25.759 1.633 369 HE3 LYS 45 HE1 LYS 45 -5.250 -25.587 2.001 370 HZ1 LYS 45 HZ1 LYS 45 -7.297 -23.484 2.396 371 HZ2 LYS 45 HZ2 LYS 45 -5.659 -23.356 2.790 372 HZ3 LYS 45 HZ3 LYS 45 -6.645 -24.454 3.616 373 H GLU 46 HN GLU 46 -7.045 -20.381 -1.421 374 HA GLU 46 HA GLU 46 -8.931 -19.982 0.740 375 HB2 GLU 46 HB2 GLU 46 -7.458 -18.219 1.514 376 HB3 GLU 46 HB1 GLU 46 -6.504 -19.631 1.078 377 HG2 GLU 46 HG2 GLU 46 -6.012 -18.475 -1.133 378 HG3 GLU 46 HG1 GLU 46 -6.774 -17.036 -0.462 379 H ALA 47 HN ALA 47 -8.442 -18.622 -2.459 380 HA ALA 47 HA ALA 47 -9.979 -16.259 -2.195 381 HB1 ALA 47 HB1 ALA 47 -8.482 -16.705 -4.104 382 HB2 ALA 47 HB2 ALA 47 -10.113 -16.319 -4.650 383 HB3 ALA 47 HB3 ALA 47 -9.557 -17.994 -4.652 384 H ILE 48 HN ILE 48 -10.941 -19.417 -3.562 385 HA ILE 48 HA ILE 48 -13.720 -19.047 -3.715 386 HB ILE 48 HB ILE 48 -12.183 -21.651 -3.292 387 HG12 ILE 48 HG12 ILE 48 -13.230 -20.478 -5.911 388 HG13 ILE 48 HG11 ILE 48 -11.560 -20.353 -5.371 389 HG21 ILE 48 HG21 ILE 48 -15.047 -21.312 -4.259 390 HG22 ILE 48 HG22 ILE 48 -14.546 -21.989 -2.709 391 HG23 ILE 48 HG23 ILE 48 -14.152 -22.834 -4.204 392 HD11 ILE 48 HD11 ILE 48 -13.018 -22.926 -5.999 393 HD12 ILE 48 HD12 ILE 48 -11.334 -22.790 -5.480 394 HD13 ILE 48 HD13 ILE 48 -11.841 -22.110 -7.027 395 H SER 49 HN SER 49 -11.693 -20.149 -1.040 396 HA SER 49 HA SER 49 -13.623 -21.123 0.744 397 HB2 SER 49 HB2 SER 49 -11.186 -21.487 1.031 398 HB3 SER 49 HB1 SER 49 -10.963 -19.775 1.388 399 HG SER 49 HG SER 49 -11.502 -20.175 3.360 400 H SER 50 HN SER 50 -12.263 -17.849 0.408 401 HA SER 50 HA SER 50 -13.985 -16.700 2.455 402 HB2 SER 50 HB2 SER 50 -12.824 -14.581 1.832 403 HB3 SER 50 HB1 SER 50 -11.680 -15.881 2.159 404 HG SER 50 HG SER 50 -11.159 -15.987 0.091 405 H GLY 51 HN GLY 51 -14.234 -17.365 -0.897 406 HA2 GLY 51 HA2 GLY 51 -16.239 -17.281 -2.120 407 HA3 GLY 51 HA1 GLY 51 -16.839 -15.997 -1.079 408 H ALA 52 HN ALA 52 -16.069 -13.847 -1.417 409 HA ALA 52 HA ALA 52 -14.666 -13.306 -3.977 410 HB1 ALA 52 HB1 ALA 52 -17.068 -11.785 -2.905 411 HB2 ALA 52 HB2 ALA 52 -17.095 -12.924 -4.251 412 HB3 ALA 52 HB3 ALA 52 -16.186 -11.416 -4.389 413 H GLU 53 HN GLU 53 -14.528 -13.035 -0.695 414 HA GLU 53 HA GLU 53 -13.670 -10.366 -0.240 415 HB2 GLU 53 HB2 GLU 53 -14.462 -11.736 1.604 416 HB3 GLU 53 HB1 GLU 53 -13.225 -12.947 1.309 417 HG2 GLU 53 HG2 GLU 53 -11.476 -11.312 1.982 418 HG3 GLU 53 HG1 GLU 53 -12.742 -10.127 2.314 419 H LEU 54 HN LEU 54 -11.644 -13.342 -0.139 420 HA LEU 54 HA LEU 54 -9.386 -11.965 -1.406 421 HB2 LEU 54 HB2 LEU 54 -9.679 -14.883 -0.545 422 HB3 LEU 54 HB1 LEU 54 -8.204 -14.150 -1.162 423 HG LEU 54 HG LEU 54 -9.572 -13.431 1.470 424 HD11 LEU 54 HD11 LEU 54 -7.669 -14.511 2.567 425 HD12 LEU 54 HD12 LEU 54 -7.001 -14.984 1.000 426 HD13 LEU 54 HD13 LEU 54 -8.542 -15.655 1.547 427 HD21 LEU 54 HD21 LEU 54 -6.953 -12.396 0.307 428 HD22 LEU 54 HD22 LEU 54 -7.570 -12.048 1.925 429 HD23 LEU 54 HD23 LEU 54 -8.448 -11.475 0.513 430 H ALA 55 HN ALA 55 -8.853 -12.287 -3.510 431 HA ALA 55 HA ALA 55 -10.510 -14.042 -5.228 432 HB1 ALA 55 HB1 ALA 55 -11.276 -11.699 -5.453 433 HB2 ALA 55 HB2 ALA 55 -10.503 -12.249 -6.939 434 HB3 ALA 55 HB3 ALA 55 -9.630 -11.182 -5.835 435 H ILE 56 HN ILE 56 -9.321 -14.987 -6.995 436 HA ILE 56 HA ILE 56 -6.661 -15.701 -6.314 437 HB ILE 56 HB ILE 56 -7.799 -16.057 -9.130 438 HG12 ILE 56 HG12 ILE 56 -8.354 -17.947 -6.794 439 HG13 ILE 56 HG11 ILE 56 -9.512 -16.769 -7.394 440 HG21 ILE 56 HG21 ILE 56 -6.435 -18.126 -9.132 441 HG22 ILE 56 HG22 ILE 56 -5.884 -17.780 -7.491 442 HG23 ILE 56 HG23 ILE 56 -5.439 -16.704 -8.819 443 HD11 ILE 56 HD11 ILE 56 -8.394 -19.105 -8.949 444 HD12 ILE 56 HD12 ILE 56 -9.540 -17.914 -9.571 445 HD13 ILE 56 HD13 ILE 56 -10.004 -18.976 -8.244 446 H GLY 57 HN GLY 57 -4.847 -14.463 -6.595 447 HA2 GLY 57 HA2 GLY 57 -3.326 -13.255 -8.104 448 HA3 GLY 57 HA1 GLY 57 -4.718 -12.399 -8.755 449 H THR 58 HN THR 58 -5.647 -12.378 -5.775 450 HA THR 58 HA THR 58 -4.543 -9.984 -4.721 451 HB THR 58 HB THR 58 -6.054 -12.304 -3.449 452 HG1 THR 58 HG1 THR 58 -7.556 -11.247 -4.470 453 HG21 THR 58 HG21 THR 58 -4.732 -11.275 -1.649 454 HG22 THR 58 HG22 THR 58 -6.452 -10.939 -1.452 455 HG23 THR 58 HG23 THR 58 -5.377 -9.688 -2.080 456 H VAL 59 HN VAL 59 -2.934 -9.810 -2.983 457 HA VAL 59 HA VAL 59 -0.916 -11.980 -3.089 458 HB VAL 59 HB VAL 59 -0.392 -8.975 -3.091 459 HG11 VAL 59 HG11 VAL 59 1.418 -10.238 -1.984 460 HG12 VAL 59 HG12 VAL 59 1.971 -9.594 -3.533 461 HG13 VAL 59 HG13 VAL 59 1.546 -11.299 -3.387 462 HG21 VAL 59 HG21 VAL 59 -1.375 -9.680 -5.237 463 HG22 VAL 59 HG22 VAL 59 -0.172 -10.966 -5.382 464 HG23 VAL 59 HG23 VAL 59 0.335 -9.280 -5.449 465 H ARG 60 HN ARG 60 -0.348 -12.749 -1.141 466 HA ARG 60 HA ARG 60 -0.996 -11.238 1.322 467 HB2 ARG 60 HB2 ARG 60 -1.946 -13.596 0.785 468 HB3 ARG 60 HB1 ARG 60 -0.317 -14.200 1.069 469 HG2 ARG 60 HG2 ARG 60 -0.404 -13.435 3.393 470 HG3 ARG 60 HG1 ARG 60 -1.985 -12.694 3.110 471 HD2 ARG 60 HD2 ARG 60 -2.803 -15.041 2.445 472 HD3 ARG 60 HD1 ARG 60 -1.289 -15.637 3.121 473 HE ARG 60 HE ARG 60 -2.009 -14.599 5.272 474 HH11 ARG 60 HH11 ARG 60 -4.420 -15.566 2.901 475 HH12 ARG 60 HH12 ARG 60 -5.673 -15.740 4.085 476 HH21 ARG 60 HH21 ARG 60 -3.671 -14.838 6.799 477 HH22 ARG 60 HH22 ARG 60 -5.260 -15.314 6.279 478 H ILE 61 HN ILE 61 0.712 -10.727 2.740 479 HA ILE 61 HA ILE 61 3.475 -11.278 1.831 480 HB ILE 61 HB ILE 61 2.339 -8.461 2.225 481 HG12 ILE 61 HG12 ILE 61 3.494 -9.755 -0.293 482 HG13 ILE 61 HG11 ILE 61 1.776 -9.567 0.027 483 HG21 ILE 61 HG21 ILE 61 4.620 -8.587 3.135 484 HG22 ILE 61 HG22 ILE 61 4.604 -7.620 1.661 485 HG23 ILE 61 HG23 ILE 61 5.214 -9.278 1.623 486 HD11 ILE 61 HD11 ILE 61 3.772 -7.355 -0.373 487 HD12 ILE 61 HD12 ILE 61 2.063 -7.125 -0.001 488 HD13 ILE 61 HD13 ILE 61 2.542 -7.893 -1.513 489 H TRP 62 HN TRP 62 4.488 -12.032 3.555 490 HA TRP 62 HA TRP 62 3.572 -11.374 6.289 491 HB2 TRP 62 HB2 TRP 62 5.251 -13.710 5.243 492 HB3 TRP 62 HB1 TRP 62 4.759 -13.495 6.921 493 HD1 TRP 62 HD1 TRP 62 2.780 -13.588 3.529 494 HE1 TRP 62 HE1 TRP 62 0.749 -15.101 3.872 495 HE3 TRP 62 HE3 TRP 62 3.568 -14.943 8.392 496 HZ2 TRP 62 HZ2 TRP 62 -0.369 -16.697 5.897 497 HZ3 TRP 62 HZ3 TRP 62 1.973 -16.485 9.462 498 HH2 TRP 62 HH2 TRP 62 0.042 -17.345 8.234 499 H ILE 63 HN ILE 63 4.767 -9.906 7.347 500 HA ILE 63 HA ILE 63 7.716 -9.803 6.918 501 HB ILE 63 HB ILE 63 7.706 -7.385 7.398 502 HG12 ILE 63 HG12 ILE 63 4.664 -7.447 7.249 503 HG13 ILE 63 HG11 ILE 63 5.556 -7.377 8.758 504 HG21 ILE 63 HG21 ILE 63 6.724 -6.546 5.281 505 HG22 ILE 63 HG22 ILE 63 5.886 -8.085 5.075 506 HG23 ILE 63 HG23 ILE 63 7.649 -8.031 5.054 507 HD11 ILE 63 HD11 ILE 63 5.586 -5.292 6.577 508 HD12 ILE 63 HD12 ILE 63 6.508 -5.213 8.082 509 HD13 ILE 63 HD13 ILE 63 4.745 -5.195 8.123 510 H ARG 64 HN ARG 64 8.917 -9.205 8.890 511 HA ARG 64 HA ARG 64 7.969 -10.052 11.364 512 HB2 ARG 64 HB2 ARG 64 10.234 -8.220 10.555 513 HB3 ARG 64 HB1 ARG 64 9.878 -8.443 12.265 514 HG2 ARG 64 HG2 ARG 64 10.575 -10.662 10.306 515 HG3 ARG 64 HG1 ARG 64 11.668 -9.952 11.506 516 HD2 ARG 64 HD2 ARG 64 10.157 -10.716 13.320 517 HD3 ARG 64 HD1 ARG 64 9.079 -11.439 12.117 518 HE ARG 64 HE ARG 64 11.737 -12.464 11.885 519 HH11 ARG 64 HH11 ARG 64 8.871 -12.681 13.915 520 HH12 ARG 64 HH12 ARG 64 9.209 -14.301 14.425 521 HH21 ARG 64 HH21 ARG 64 12.149 -14.603 12.572 522 HH22 ARG 64 HH22 ARG 64 11.057 -15.391 13.660 523 H TYR 65 HN TYR 65 7.616 -8.822 13.348 524 HA TYR 65 HA TYR 65 5.238 -7.317 13.073 525 HB2 TYR 65 HB2 TYR 65 5.735 -8.853 14.981 526 HB3 TYR 65 HB1 TYR 65 6.943 -7.714 15.568 527 HD1 TYR 65 HD2 TYR 65 3.279 -8.113 14.921 528 HD2 TYR 65 HD1 TYR 65 6.278 -5.857 16.958 529 HE1 TYR 65 HE2 TYR 65 1.543 -6.964 16.235 530 HE2 TYR 65 HE1 TYR 65 4.550 -4.717 18.260 531 HH TYR 65 HH TYR 65 2.156 -4.168 18.038 532 H ARG 66 HN ARG 66 5.376 -5.345 12.173 533 HA ARG 66 HA ARG 66 7.239 -3.373 13.362 534 HB2 ARG 66 HB2 ARG 66 7.829 -4.016 11.013 535 HB3 ARG 66 HB1 ARG 66 6.248 -3.449 10.475 536 HG2 ARG 66 HG2 ARG 66 6.782 -1.172 11.081 537 HG3 ARG 66 HG1 ARG 66 8.271 -1.680 11.884 538 HD2 ARG 66 HD2 ARG 66 9.193 -2.388 9.698 539 HD3 ARG 66 HD1 ARG 66 7.702 -1.841 8.907 540 HE ARG 66 HE ARG 66 9.344 0.008 10.521 541 HH11 ARG 66 HH11 ARG 66 7.941 -0.773 7.399 542 HH12 ARG 66 HH12 ARG 66 8.206 0.814 6.757 543 HH21 ARG 66 HH21 ARG 66 9.710 2.054 9.673 544 HH22 ARG 66 HH22 ARG 66 9.221 2.416 8.050 545 H LYS 67 HN LYS 67 6.263 -1.819 14.404 546 HA LYS 67 HA LYS 67 3.377 -1.615 14.495 547 HB2 LYS 67 HB2 LYS 67 5.345 0.167 16.006 548 HB3 LYS 67 HB1 LYS 67 3.666 -0.155 16.401 549 HG2 LYS 67 HG2 LYS 67 4.787 -1.410 18.007 550 HG3 LYS 67 HG1 LYS 67 4.465 -2.628 16.770 551 HD2 LYS 67 HD2 LYS 67 6.769 -2.415 15.928 552 HD3 LYS 67 HD1 LYS 67 7.093 -1.111 17.070 553 HE2 LYS 67 HE2 LYS 67 6.452 -3.982 17.835 554 HE3 LYS 67 HE1 LYS 67 8.067 -3.279 17.793 555 HZ1 LYS 67 HZ1 LYS 67 7.382 -1.713 19.511 556 HZ2 LYS 67 HZ2 LYS 67 7.190 -3.308 20.034 557 HZ3 LYS 67 HZ3 LYS 67 5.840 -2.413 19.560 558 H ASP 68 HN ASP 68 5.576 -0.313 12.406 559 HA ASP 68 HA ASP 68 4.615 2.462 12.381 560 HB2 ASP 68 HB2 ASP 68 7.085 1.798 12.209 561 HB3 ASP 68 HB1 ASP 68 6.738 1.168 10.607 562 H ILE 69 HN ILE 69 4.043 -0.526 10.730 563 HA ILE 69 HA ILE 69 3.415 0.441 8.116 564 HB ILE 69 HB ILE 69 2.450 -2.159 9.410 565 HG12 ILE 69 HG12 ILE 69 4.930 -1.979 9.493 566 HG13 ILE 69 HG11 ILE 69 4.415 -3.247 8.387 567 HG21 ILE 69 HG21 ILE 69 2.222 -3.002 7.072 568 HG22 ILE 69 HG22 ILE 69 2.659 -1.403 6.461 569 HG23 ILE 69 HG23 ILE 69 1.175 -1.617 7.386 570 HD11 ILE 69 HD11 ILE 69 5.355 -0.489 7.587 571 HD12 ILE 69 HD12 ILE 69 4.874 -1.781 6.478 572 HD13 ILE 69 HD13 ILE 69 6.286 -1.981 7.513 573 H ASN 70 HN ASN 70 1.554 1.202 7.290 574 HA ASN 70 HA ASN 70 -0.984 1.055 8.830 575 HB2 ASN 70 HB2 ASN 70 0.215 3.360 8.976 576 HB3 ASN 70 HB1 ASN 70 -0.064 3.522 7.243 577 HD21 ASN 70 HD21 ASN 70 -1.575 3.497 10.406 578 HD22 ASN 70 HD22 ASN 70 -3.088 4.141 9.901 579 H ALA 71 HN ALA 71 -2.868 1.561 7.283 580 HA ALA 71 HA ALA 71 -2.832 0.039 4.893 581 HB1 ALA 71 HB1 ALA 71 -5.089 0.972 4.510 582 HB2 ALA 71 HB2 ALA 71 -4.822 2.166 5.784 583 HB3 ALA 71 HB3 ALA 71 -4.893 0.447 6.179 584 H THR 72 HN THR 72 -2.062 3.340 5.598 585 HA THR 72 HA THR 72 -1.915 4.276 2.847 586 HB THR 72 HB THR 72 -1.079 6.396 3.899 587 HG1 THR 72 HG1 THR 72 0.011 5.507 5.699 588 HG21 THR 72 HG21 THR 72 -3.553 5.312 5.304 589 HG22 THR 72 HG22 THR 72 -3.531 6.090 3.718 590 HG23 THR 72 HG23 THR 72 -3.107 7.013 5.158 591 H SER 73 HN SER 73 -0.373 2.015 3.213 592 HA SER 73 HA SER 73 2.301 3.019 2.527 593 HB2 SER 73 HB2 SER 73 1.801 0.627 4.375 594 HB3 SER 73 HB1 SER 73 3.377 1.205 3.818 595 HG SER 73 HG SER 73 2.432 3.298 4.859 596 H ARG 74 HN ARG 74 2.724 2.239 0.487 597 HA ARG 74 HA ARG 74 1.291 -0.150 -0.483 598 HB2 ARG 74 HB2 ARG 74 3.146 1.666 -2.081 599 HB3 ARG 74 HB1 ARG 74 2.000 0.476 -2.705 600 HG2 ARG 74 HG2 ARG 74 0.120 1.860 -1.928 601 HG3 ARG 74 HG1 ARG 74 1.253 3.012 -1.226 602 HD2 ARG 74 HD2 ARG 74 0.762 4.078 -3.222 603 HD3 ARG 74 HD1 ARG 74 2.189 3.163 -3.705 604 HE ARG 74 HE ARG 74 -0.469 2.012 -4.162 605 HH11 ARG 74 HH11 ARG 74 2.456 3.328 -5.562 606 HH12 ARG 74 HH12 ARG 74 1.951 3.031 -7.192 607 HH21 ARG 74 HH21 ARG 74 -1.106 1.586 -6.284 608 HH22 ARG 74 HH22 ARG 74 -0.064 2.028 -7.600 609 H ILE 75 HN ILE 75 2.317 -2.034 -0.836 610 HA ILE 75 HA ILE 75 5.051 -2.354 0.154 611 HB ILE 75 HB ILE 75 3.012 -4.531 -0.502 612 HG12 ILE 75 HG12 ILE 75 1.985 -3.042 1.185 613 HG13 ILE 75 HG11 ILE 75 2.389 -4.595 1.899 614 HG21 ILE 75 HG21 ILE 75 5.474 -4.563 1.274 615 HG22 ILE 75 HG22 ILE 75 5.328 -5.304 -0.323 616 HG23 ILE 75 HG23 ILE 75 4.366 -5.915 1.025 617 HD11 ILE 75 HD11 ILE 75 3.920 -2.024 2.237 618 HD12 ILE 75 HD12 ILE 75 4.356 -3.582 2.939 619 HD13 ILE 75 HD13 ILE 75 2.859 -2.788 3.422 620 H LYS 76 HN LYS 76 6.333 -1.771 -1.652 621 HA LYS 76 HA LYS 76 5.890 -3.140 -4.234 622 HB2 LYS 76 HB2 LYS 76 6.340 -0.699 -4.300 623 HB3 LYS 76 HB1 LYS 76 7.905 -0.956 -3.530 624 HG2 LYS 76 HG2 LYS 76 8.670 -2.256 -5.481 625 HG3 LYS 76 HG1 LYS 76 7.084 -2.085 -6.234 626 HD2 LYS 76 HD2 LYS 76 8.629 -0.509 -7.245 627 HD3 LYS 76 HD1 LYS 76 7.406 0.374 -6.328 628 HE2 LYS 76 HE2 LYS 76 9.016 0.680 -4.477 629 HE3 LYS 76 HE1 LYS 76 10.232 -0.225 -5.376 630 HZ1 LYS 76 HZ1 LYS 76 9.015 2.347 -6.203 631 HZ2 LYS 76 HZ2 LYS 76 10.174 1.480 -7.083 632 HZ3 LYS 76 HZ3 LYS 76 10.570 2.130 -5.573 633 H VAL 77 HN VAL 77 6.816 -5.067 -4.481 634 HA VAL 77 HA VAL 77 8.737 -6.108 -2.627 635 HB VAL 77 HB VAL 77 7.746 -7.363 -5.230 636 HG11 VAL 77 HG11 VAL 77 8.391 -9.536 -4.221 637 HG12 VAL 77 HG12 VAL 77 9.083 -8.685 -2.838 638 HG13 VAL 77 HG13 VAL 77 9.784 -8.474 -4.442 639 HG21 VAL 77 HG21 VAL 77 5.880 -6.807 -3.719 640 HG22 VAL 77 HG22 VAL 77 6.648 -7.709 -2.412 641 HG23 VAL 77 HG23 VAL 77 6.085 -8.552 -3.860 642 H SER 78 HN SER 78 10.893 -6.182 -2.773 643 HA SER 78 HA SER 78 12.274 -4.946 -5.046 644 HB2 SER 78 HB2 SER 78 13.190 -5.759 -2.256 645 HB3 SER 78 HB1 SER 78 14.234 -4.991 -3.457 646 HG SER 78 HG SER 78 13.186 -3.135 -3.189 647 H THR 79 HN THR 79 11.719 -7.953 -3.528 648 HA THR 79 HA THR 79 13.575 -9.481 -5.169 649 HB THR 79 HB THR 79 13.830 -9.173 -2.129 650 HG1 THR 79 HG1 THR 79 15.253 -8.251 -4.321 651 HG21 THR 79 HG21 THR 79 14.110 -11.534 -2.725 652 HG22 THR 79 HG22 THR 79 15.634 -10.807 -2.210 653 HG23 THR 79 HG23 THR 79 15.322 -11.088 -3.923 654 H GLY 80 HN GLY 80 12.118 -11.008 -5.856 655 HA2 GLY 80 HA2 GLY 80 11.093 -13.098 -4.566 656 HA3 GLY 80 HA1 GLY 80 9.910 -11.876 -4.117 657 HA PRO 81 HA PRO 81 8.457 -14.023 -8.019 658 HB2 PRO 81 HB2 PRO 81 5.805 -14.188 -7.288 659 HB3 PRO 81 HB1 PRO 81 7.014 -15.373 -6.770 660 HG2 PRO 81 HG2 PRO 81 5.965 -12.961 -5.281 661 HG3 PRO 81 HG1 PRO 81 6.153 -14.627 -4.693 662 HD2 PRO 81 HD2 PRO 81 7.976 -12.737 -4.111 663 HD3 PRO 81 HD1 PRO 81 8.483 -14.411 -4.444 664 H LEU 82 HN LEU 82 7.671 -11.074 -6.437 665 HA LEU 82 HA LEU 82 6.531 -9.874 -8.895 666 HB2 LEU 82 HB2 LEU 82 5.749 -9.311 -5.999 667 HB3 LEU 82 HB1 LEU 82 5.122 -8.450 -7.398 668 HG LEU 82 HG LEU 82 4.670 -11.414 -6.845 669 HD11 LEU 82 HD11 LEU 82 2.373 -10.809 -6.250 670 HD12 LEU 82 HD12 LEU 82 2.752 -9.098 -6.451 671 HD13 LEU 82 HD13 LEU 82 3.535 -10.034 -5.176 672 HD21 LEU 82 HD21 LEU 82 3.466 -9.608 -8.978 673 HD22 LEU 82 HD22 LEU 82 2.998 -11.282 -8.662 674 HD23 LEU 82 HD23 LEU 82 4.621 -10.918 -9.237 675 H ALA 83 HN ALA 83 9.318 -9.977 -8.071 676 HA ALA 83 HA ALA 83 10.187 -7.619 -6.741 677 HB1 ALA 83 HB1 ALA 83 11.580 -9.644 -6.974 678 HB2 ALA 83 HB2 ALA 83 12.416 -8.198 -7.546 679 HB3 ALA 83 HB3 ALA 83 11.734 -9.340 -8.709 680 H GLY 84 HN GLY 84 9.226 -5.808 -7.561 681 HA2 GLY 84 HA2 GLY 84 10.141 -3.949 -9.048 682 HA3 GLY 84 HA1 GLY 84 9.721 -5.016 -10.381 683 H ARG 85 HN ARG 85 7.364 -5.756 -8.399 684 HA ARG 85 HA ARG 85 5.440 -3.864 -9.563 685 HB2 ARG 85 HB2 ARG 85 5.133 -6.372 -9.783 686 HB3 ARG 85 HB1 ARG 85 4.955 -6.442 -8.040 687 HG2 ARG 85 HG2 ARG 85 2.923 -5.117 -8.121 688 HG3 ARG 85 HG1 ARG 85 3.110 -4.883 -9.859 689 HD2 ARG 85 HD2 ARG 85 2.666 -7.561 -8.501 690 HD3 ARG 85 HD1 ARG 85 1.411 -6.605 -9.297 691 HE ARG 85 HE ARG 85 3.496 -8.200 -10.554 692 HH11 ARG 85 HH11 ARG 85 1.182 -5.600 -11.108 693 HH12 ARG 85 HH12 ARG 85 0.961 -6.010 -12.777 694 HH21 ARG 85 HH21 ARG 85 3.249 -8.652 -12.760 695 HH22 ARG 85 HH22 ARG 85 2.110 -7.752 -13.706 696 H VAL 86 HN VAL 86 3.904 -2.798 -8.295 697 HA VAL 86 HA VAL 86 4.538 -2.467 -5.427 698 HB VAL 86 HB VAL 86 4.913 -0.390 -6.678 699 HG11 VAL 86 HG11 VAL 86 3.087 0.911 -7.732 700 HG12 VAL 86 HG12 VAL 86 1.979 -0.434 -7.459 701 HG13 VAL 86 HG13 VAL 86 3.349 -0.635 -8.549 702 HG21 VAL 86 HG21 VAL 86 3.588 1.141 -5.253 703 HG22 VAL 86 HG22 VAL 86 4.210 -0.232 -4.333 704 HG23 VAL 86 HG23 VAL 86 2.515 -0.193 -4.821 705 H LEU 87 HN LEU 87 3.301 -3.856 -4.430 706 HA LEU 87 HA LEU 87 0.505 -4.337 -5.096 707 HB2 LEU 87 HB2 LEU 87 2.188 -5.525 -2.831 708 HB3 LEU 87 HB1 LEU 87 0.568 -6.028 -3.291 709 HG LEU 87 HG LEU 87 2.063 -7.668 -4.140 710 HD11 LEU 87 HD11 LEU 87 1.235 -5.919 -6.465 711 HD12 LEU 87 HD12 LEU 87 0.223 -7.098 -5.626 712 HD13 LEU 87 HD13 LEU 87 1.634 -7.639 -6.530 713 HD21 LEU 87 HD21 LEU 87 3.670 -5.519 -5.552 714 HD22 LEU 87 HD22 LEU 87 3.957 -7.261 -5.587 715 HD23 LEU 87 HD23 LEU 87 4.154 -6.370 -4.083 716 H ASN 88 HN ASN 88 -1.188 -3.547 -4.009 717 HA ASN 88 HA ASN 88 -0.675 -1.429 -1.993 718 HB2 ASN 88 HB2 ASN 88 -2.963 -1.826 -3.977 719 HB3 ASN 88 HB1 ASN 88 -2.954 -0.588 -2.730 720 HD21 ASN 88 HD21 ASN 88 -0.049 -1.455 -4.617 721 HD22 ASN 88 HD22 ASN 88 0.022 0.021 -5.487 722 H ILE 89 HN ILE 89 -2.032 -1.321 -0.113 723 HA ILE 89 HA ILE 89 -2.673 -4.003 0.876 724 HB ILE 89 HB ILE 89 -2.722 -1.318 2.349 725 HG12 ILE 89 HG12 ILE 89 -0.616 -3.534 2.379 726 HG13 ILE 89 HG11 ILE 89 -0.429 -1.935 1.664 727 HG21 ILE 89 HG21 ILE 89 -2.973 -4.124 3.514 728 HG22 ILE 89 HG22 ILE 89 -4.255 -2.915 3.427 729 HG23 ILE 89 HG23 ILE 89 -2.849 -2.631 4.451 730 HD11 ILE 89 HD11 ILE 89 -0.780 -2.514 4.613 731 HD12 ILE 89 HD12 ILE 89 -0.570 -0.913 3.888 732 HD13 ILE 89 HD13 ILE 89 0.728 -2.105 3.798 733 H ILE 90 HN ILE 90 -4.643 -4.745 0.312 734 HA ILE 90 HA ILE 90 -6.967 -2.976 0.024 735 HB ILE 90 HB ILE 90 -8.176 -5.090 -0.690 736 HG12 ILE 90 HG12 ILE 90 -5.409 -6.389 -0.740 737 HG13 ILE 90 HG11 ILE 90 -6.576 -6.685 0.536 738 HG21 ILE 90 HG21 ILE 90 -7.118 -5.173 -2.924 739 HG22 ILE 90 HG22 ILE 90 -5.696 -4.348 -2.279 740 HG23 ILE 90 HG23 ILE 90 -7.251 -3.518 -2.321 741 HD11 ILE 90 HD11 ILE 90 -6.549 -8.460 -1.105 742 HD12 ILE 90 HD12 ILE 90 -6.980 -7.320 -2.379 743 HD13 ILE 90 HD13 ILE 90 -8.119 -7.660 -1.069 744 H GLY 91 HN GLY 91 -6.477 -2.578 2.443 745 HA2 GLY 91 HA2 GLY 91 -8.496 -3.117 4.120 746 HA3 GLY 91 HA1 GLY 91 -7.477 -4.542 4.343 747 H GLN 92 HN GLN 92 -7.000 -3.966 6.477 748 HA GLN 92 HA GLN 92 -4.952 -1.852 6.759 749 HB2 GLN 92 HB2 GLN 92 -5.692 -1.598 9.126 750 HB3 GLN 92 HB1 GLN 92 -6.964 -1.170 7.988 751 HG2 GLN 92 HG2 GLN 92 -7.991 -3.429 8.359 752 HG3 GLN 92 HG1 GLN 92 -6.747 -3.751 9.568 753 HE21 GLN 92 HE21 GLN 92 -9.624 -1.908 8.822 754 HE22 GLN 92 HE22 GLN 92 -9.948 -1.373 10.434 755 HA PRO 93 HA PRO 93 -2.144 -5.198 7.554 756 HB2 PRO 93 HB2 PRO 93 -0.460 -4.033 9.478 757 HB3 PRO 93 HB1 PRO 93 -0.341 -3.769 7.735 758 HG2 PRO 93 HG2 PRO 93 -1.698 -2.079 9.822 759 HG3 PRO 93 HG1 PRO 93 -0.666 -1.572 8.465 760 HD2 PRO 93 HD2 PRO 93 -3.329 -1.351 8.295 761 HD3 PRO 93 HD1 PRO 93 -2.391 -1.885 6.881 762 H LEU 94 HN LEU 94 -2.048 -6.983 8.836 763 HA LEU 94 HA LEU 94 -3.650 -6.993 11.333 764 HB2 LEU 94 HB2 LEU 94 -4.799 -7.964 9.345 765 HB3 LEU 94 HB1 LEU 94 -3.486 -9.099 9.120 766 HG LEU 94 HG LEU 94 -5.697 -9.959 10.145 767 HD11 LEU 94 HD11 LEU 94 -3.677 -11.318 10.091 768 HD12 LEU 94 HD12 LEU 94 -4.622 -11.610 11.547 769 HD13 LEU 94 HD13 LEU 94 -3.156 -10.630 11.632 770 HD21 LEU 94 HD21 LEU 94 -4.611 -8.652 12.658 771 HD22 LEU 94 HD22 LEU 94 -5.988 -9.757 12.567 772 HD23 LEU 94 HD23 LEU 94 -6.071 -8.183 11.779 773 HA PRO 95 HA PRO 95 0.377 -8.740 12.857 774 HB2 PRO 95 HB2 PRO 95 -0.184 -8.399 15.524 775 HB3 PRO 95 HB1 PRO 95 0.427 -7.096 14.495 776 HG2 PRO 95 HG2 PRO 95 -2.425 -7.676 15.308 777 HG3 PRO 95 HG1 PRO 95 -1.555 -6.127 15.317 778 HD2 PRO 95 HD2 PRO 95 -3.243 -6.787 13.300 779 HD3 PRO 95 HD1 PRO 95 -1.757 -5.852 12.993 780 H ASP 96 HN ASP 96 0.843 -10.772 13.852 781 HA ASP 96 HA ASP 96 -1.327 -12.706 13.707 782 HB2 ASP 96 HB2 ASP 96 0.325 -14.398 13.764 783 HB3 ASP 96 HB1 ASP 96 1.057 -13.093 12.838 784 H ALA 97 HN ALA 97 -1.047 -14.543 15.525 785 HA ALA 97 HA ALA 97 -2.282 -13.467 17.845 786 HB1 ALA 97 HB1 ALA 97 -2.422 -15.808 18.587 787 HB2 ALA 97 HB2 ALA 97 -1.290 -16.286 17.316 788 HB3 ALA 97 HB3 ALA 97 -2.878 -15.646 16.888 789 H ALA 98 HN ALA 98 1.024 -14.470 17.178 790 HA ALA 98 HA ALA 98 1.833 -14.409 20.007 791 HB1 ALA 98 HB1 ALA 98 2.769 -16.141 18.502 792 HB2 ALA 98 HB2 ALA 98 4.033 -15.113 19.174 793 HB3 ALA 98 HB3 ALA 98 3.503 -14.883 17.504 794 H ARG 99 HN ARG 99 1.499 -12.192 17.445 795 HA ARG 99 HA ARG 99 2.290 -10.160 16.860 796 HB2 ARG 99 HB2 ARG 99 2.875 -9.944 19.845 797 HB3 ARG 99 HB1 ARG 99 3.045 -8.600 18.726 798 HG2 ARG 99 HG2 ARG 99 0.960 -8.274 19.797 799 HG3 ARG 99 HG1 ARG 99 0.565 -8.872 18.188 800 HD2 ARG 99 HD2 ARG 99 0.105 -11.093 19.094 801 HD3 ARG 99 HD1 ARG 99 0.644 -10.582 20.698 802 HE ARG 99 HE ARG 99 -1.493 -8.941 19.762 803 HH11 ARG 99 HH11 ARG 99 -0.883 -12.129 21.131 804 HH12 ARG 99 HH12 ARG 99 -2.467 -12.252 21.824 805 HH21 ARG 99 HH21 ARG 99 -3.549 -9.131 20.710 806 HH22 ARG 99 HH22 ARG 99 -3.971 -10.571 21.575 807 H THR 100 HN THR 100 3.996 -12.401 16.581 808 HA THR 100 HA THR 100 6.738 -11.417 16.932 809 HB THR 100 HB THR 100 6.175 -13.832 17.408 810 HG1 THR 100 HG1 THR 100 8.310 -12.977 16.505 811 HG21 THR 100 HG21 THR 100 5.828 -14.071 14.397 812 HG22 THR 100 HG22 THR 100 4.545 -14.249 15.596 813 HG23 THR 100 HG23 THR 100 5.873 -15.411 15.545 814 H ARG 101 HN ARG 101 4.253 -10.994 14.742 815 HA ARG 101 HA ARG 101 5.935 -10.031 12.645 816 HB2 ARG 101 HB2 ARG 101 5.274 -11.522 10.863 817 HB3 ARG 101 HB1 ARG 101 5.980 -12.484 12.161 818 HG2 ARG 101 HG2 ARG 101 3.758 -13.170 12.899 819 HG3 ARG 101 HG1 ARG 101 3.006 -12.132 11.684 820 HD2 ARG 101 HD2 ARG 101 3.000 -14.450 10.971 821 HD3 ARG 101 HD1 ARG 101 4.022 -13.476 9.902 822 HE ARG 101 HE ARG 101 4.936 -15.429 11.926 823 HH11 ARG 101 HH11 ARG 101 5.766 -13.292 9.273 824 HH12 ARG 101 HH12 ARG 101 7.322 -14.006 9.012 825 HH21 ARG 101 HH21 ARG 101 6.987 -16.359 11.632 826 HH22 ARG 101 HH22 ARG 101 8.027 -15.769 10.375 827 H LEU 102 HN LEU 102 4.670 -9.257 10.803 828 HA LEU 102 HA LEU 102 1.904 -8.475 11.429 829 HB2 LEU 102 HB2 LEU 102 4.200 -6.821 10.863 830 HB3 LEU 102 HB1 LEU 102 3.209 -6.742 9.427 831 HG LEU 102 HG LEU 102 2.653 -4.863 10.802 832 HD11 LEU 102 HD11 LEU 102 0.750 -5.914 9.684 833 HD12 LEU 102 HD12 LEU 102 0.277 -5.121 11.182 834 HD13 LEU 102 HD13 LEU 102 0.423 -6.880 11.125 835 HD21 LEU 102 HD21 LEU 102 1.891 -5.026 13.125 836 HD22 LEU 102 HD22 LEU 102 3.521 -5.665 12.938 837 HD23 LEU 102 HD23 LEU 102 2.157 -6.773 13.102 838 H GLU 103 HN GLU 103 0.652 -9.830 10.254 839 HA GLU 103 HA GLU 103 1.330 -10.748 7.590 840 HB2 GLU 103 HB2 GLU 103 0.026 -12.227 9.062 841 HB3 GLU 103 HB1 GLU 103 -1.244 -11.018 9.196 842 HG2 GLU 103 HG2 GLU 103 -1.795 -11.266 6.833 843 HG3 GLU 103 HG1 GLU 103 -0.457 -12.397 6.610 844 H ILE 104 HN ILE 104 1.291 -9.313 6.009 845 HA ILE 104 HA ILE 104 -0.614 -7.075 5.984 846 HB ILE 104 HB ILE 104 1.741 -7.515 4.083 847 HG12 ILE 104 HG12 ILE 104 2.663 -7.408 6.373 848 HG13 ILE 104 HG11 ILE 104 3.072 -5.949 5.476 849 HG21 ILE 104 HG21 ILE 104 0.039 -5.943 3.277 850 HG22 ILE 104 HG22 ILE 104 1.548 -5.106 3.627 851 HG23 ILE 104 HG23 ILE 104 0.191 -4.985 4.750 852 HD11 ILE 104 HD11 ILE 104 0.929 -6.222 7.578 853 HD12 ILE 104 HD12 ILE 104 1.270 -4.753 6.650 854 HD13 ILE 104 HD13 ILE 104 2.491 -5.420 7.733 855 H LEU 105 HN LEU 105 -2.490 -7.626 4.985 856 HA LEU 105 HA LEU 105 -2.575 -9.328 2.627 857 HB2 LEU 105 HB2 LEU 105 -4.961 -9.029 2.608 858 HB3 LEU 105 HB1 LEU 105 -4.478 -9.352 4.261 859 HG LEU 105 HG LEU 105 -5.134 -6.565 3.211 860 HD11 LEU 105 HD11 LEU 105 -7.105 -7.984 3.033 861 HD12 LEU 105 HD12 LEU 105 -7.306 -6.772 4.296 862 HD13 LEU 105 HD13 LEU 105 -6.955 -8.450 4.732 863 HD21 LEU 105 HD21 LEU 105 -4.862 -7.545 6.079 864 HD22 LEU 105 HD22 LEU 105 -5.332 -5.918 5.569 865 HD23 LEU 105 HD23 LEU 105 -3.714 -6.518 5.214 866 H CYS 106 HN CYS 106 -2.744 -8.631 0.577 867 HA CYS 106 HA CYS 106 -2.929 -5.824 -0.174 868 HB2 CYS 106 HB2 CYS 106 -0.393 -7.415 -0.805 869 HB3 CYS 106 HB1 CYS 106 -0.787 -5.827 -1.452 870 HG CYS 106 HG CYS 106 -0.997 -5.248 1.621 871 H ARG 107 HN ARG 107 -2.750 -5.691 -2.613 872 HA ARG 107 HA ARG 107 -3.163 -8.156 -4.136 873 HB2 ARG 107 HB2 ARG 107 -5.431 -7.387 -3.443 874 HB3 ARG 107 HB1 ARG 107 -5.109 -5.795 -4.112 875 HG2 ARG 107 HG2 ARG 107 -5.079 -6.718 -6.376 876 HG3 ARG 107 HG1 ARG 107 -5.293 -8.353 -5.741 877 HD2 ARG 107 HD2 ARG 107 -7.504 -7.761 -4.864 878 HD3 ARG 107 HD1 ARG 107 -7.285 -6.086 -5.378 879 HE ARG 107 HE ARG 107 -7.748 -6.674 -7.547 880 HH11 ARG 107 HH11 ARG 107 -7.336 -9.678 -5.730 881 HH12 ARG 107 HH12 ARG 107 -7.982 -10.659 -7.011 882 HH21 ARG 107 HH21 ARG 107 -8.593 -7.976 -9.172 883 HH22 ARG 107 HH22 ARG 107 -8.679 -9.697 -8.957 884 H GLU 108 HN GLU 108 -2.761 -7.787 -6.430 885 HA GLU 108 HA GLU 108 -0.808 -6.161 -7.316 886 HB2 GLU 108 HB2 GLU 108 -2.169 -8.014 -8.540 887 HB3 GLU 108 HB1 GLU 108 -3.229 -6.720 -9.078 888 HG2 GLU 108 HG2 GLU 108 -0.246 -6.878 -9.616 889 HG3 GLU 108 HG1 GLU 108 -1.499 -7.411 -10.741 890 H GLY 109 HN GLY 109 -0.520 -4.015 -7.775 891 HA2 GLY 109 HA2 GLY 109 -2.556 -2.241 -6.663 892 HA3 GLY 109 HA1 GLY 109 -0.869 -1.862 -6.936 893 H ALA 110 HN ALA 110 -2.927 -3.242 -9.413 894 HA ALA 110 HA ALA 110 -4.028 -2.505 -11.222 895 HB1 ALA 110 HB1 ALA 110 -5.030 -0.261 -11.225 896 HB2 ALA 110 HB2 ALA 110 -3.984 0.227 -9.889 897 HB3 ALA 110 HB3 ALA 110 -5.205 -1.019 -9.638 898 H GLU 111 HN GLU 111 -1.189 -2.702 -11.356 899 HA GLU 111 HA GLU 111 -0.217 -0.582 -13.081 900 HB2 GLU 111 HB2 GLU 111 0.886 -3.407 -12.675 901 HB3 GLU 111 HB1 GLU 111 1.708 -2.092 -13.510 902 HG2 GLU 111 HG2 GLU 111 1.760 -0.816 -11.369 903 HG3 GLU 111 HG1 GLU 111 1.016 -2.193 -10.555 904 H LYS 112 HN LYS 112 -1.706 -0.367 -14.744 905 HA LYS 112 HA LYS 112 -1.994 -2.571 -16.674 906 HB2 LYS 112 HB2 LYS 112 -4.493 -1.979 -16.843 907 HB3 LYS 112 HB1 LYS 112 -3.986 -2.880 -15.423 908 HG2 LYS 112 HG2 LYS 112 -3.939 -0.718 -14.141 909 HG3 LYS 112 HG1 LYS 112 -4.628 0.083 -15.552 910 HD2 LYS 112 HD2 LYS 112 -5.957 -2.241 -14.094 911 HD3 LYS 112 HD1 LYS 112 -6.299 -0.543 -13.758 912 HE2 LYS 112 HE2 LYS 112 -6.704 -1.875 -16.460 913 HE3 LYS 112 HE1 LYS 112 -7.976 -1.607 -15.265 914 HZ1 LYS 112 HZ1 LYS 112 -7.965 0.123 -16.952 915 HZ2 LYS 112 HZ2 LYS 112 -6.366 0.514 -16.578 916 HZ3 LYS 112 HZ3 LYS 112 -7.584 0.772 -15.440 Start of MODEL 4 1 H1 MET 1 HT1 MET 1 17.938 -21.518 13.849 2 H2 MET 1 HT2 MET 1 18.236 -20.860 15.377 3 H3 MET 1 HT3 MET 1 19.307 -20.562 14.107 4 HA MET 1 HA MET 1 16.492 -19.668 14.259 5 HB2 MET 1 HB2 MET 1 18.033 -18.486 15.838 6 HB3 MET 1 HB1 MET 1 19.062 -18.056 14.485 7 HG2 MET 1 HG2 MET 1 17.140 -16.760 13.514 8 HG3 MET 1 HG1 MET 1 16.238 -17.093 14.993 9 HE1 MET 1 HE1 MET 1 19.351 -15.302 13.417 10 HE2 MET 1 HE2 MET 1 20.120 -16.325 14.635 11 HE3 MET 1 HE3 MET 1 20.113 -14.572 14.832 12 H ASN 2 HN ASN 2 16.026 -20.436 12.178 13 HA ASN 2 HA ASN 2 17.574 -19.819 9.849 14 HB2 ASN 2 HB2 ASN 2 16.046 -21.774 9.910 15 HB3 ASN 2 HB1 ASN 2 14.660 -20.705 10.101 16 HD21 ASN 2 HD21 ASN 2 13.677 -21.499 8.209 17 HD22 ASN 2 HD22 ASN 2 14.269 -21.107 6.631 18 H ILE 3 HN ILE 3 17.791 -17.796 9.068 19 HA ILE 3 HA ILE 3 15.919 -15.654 9.557 20 HB ILE 3 HB ILE 3 18.275 -15.740 7.609 21 HG12 ILE 3 HG12 ILE 3 18.184 -14.723 10.491 22 HG13 ILE 3 HG11 ILE 3 18.991 -16.190 9.950 23 HG21 ILE 3 HG21 ILE 3 16.797 -13.320 8.730 24 HG22 ILE 3 HG22 ILE 3 16.726 -13.894 7.064 25 HG23 ILE 3 HG23 ILE 3 18.238 -13.262 7.712 26 HD11 ILE 3 HD11 ILE 3 19.744 -13.366 9.187 27 HD12 ILE 3 HD12 ILE 3 20.551 -14.836 8.631 28 HD13 ILE 3 HD13 ILE 3 20.577 -14.407 10.340 29 H GLY 4 HN GLY 4 16.377 -18.076 7.109 30 HA2 GLY 4 HA2 GLY 4 14.930 -16.816 4.953 31 HA3 GLY 4 HA1 GLY 4 15.505 -18.470 5.018 32 H ARG 5 HN ARG 5 13.478 -17.374 7.633 33 HA ARG 5 HA ARG 5 11.091 -18.757 6.854 34 HB2 ARG 5 HB2 ARG 5 11.420 -16.412 8.796 35 HB3 ARG 5 HB1 ARG 5 10.033 -17.495 8.715 36 HG2 ARG 5 HG2 ARG 5 11.252 -19.309 9.635 37 HG3 ARG 5 HG1 ARG 5 12.802 -18.523 9.332 38 HD2 ARG 5 HD2 ARG 5 12.323 -18.446 11.696 39 HD3 ARG 5 HD1 ARG 5 12.255 -16.811 11.042 40 HE ARG 5 HE ARG 5 9.651 -17.796 11.041 41 HH11 ARG 5 HH11 ARG 5 12.112 -17.032 13.449 42 HH12 ARG 5 HH12 ARG 5 10.956 -16.706 14.691 43 HH21 ARG 5 HH21 ARG 5 8.171 -17.378 12.714 44 HH22 ARG 5 HH22 ARG 5 8.734 -16.880 14.272 45 H LEU 6 HN LEU 6 12.190 -15.395 6.874 46 HA LEU 6 HA LEU 6 10.096 -14.501 5.029 47 HB2 LEU 6 HB2 LEU 6 12.296 -12.935 6.460 48 HB3 LEU 6 HB1 LEU 6 11.059 -12.234 5.437 49 HG LEU 6 HG LEU 6 10.352 -11.763 7.640 50 HD11 LEU 6 HD11 LEU 6 8.518 -12.567 6.263 51 HD12 LEU 6 HD12 LEU 6 8.259 -12.947 7.963 52 HD13 LEU 6 HD13 LEU 6 8.775 -14.215 6.849 53 HD21 LEU 6 HD21 LEU 6 10.898 -14.630 8.459 54 HD22 LEU 6 HD22 LEU 6 10.215 -13.370 9.489 55 HD23 LEU 6 HD23 LEU 6 11.861 -13.214 8.882 56 H ARG 7 HN ARG 7 10.560 -15.072 2.992 57 HA ARG 7 HA ARG 7 13.318 -15.725 2.234 58 HB2 ARG 7 HB2 ARG 7 10.673 -16.479 0.938 59 HB3 ARG 7 HB1 ARG 7 12.256 -17.136 0.510 60 HG2 ARG 7 HG2 ARG 7 12.457 -18.198 2.694 61 HG3 ARG 7 HG1 ARG 7 10.971 -17.426 3.249 62 HD2 ARG 7 HD2 ARG 7 9.720 -18.703 1.489 63 HD3 ARG 7 HD1 ARG 7 11.219 -19.548 1.094 64 HE ARG 7 HE ARG 7 11.151 -20.658 3.169 65 HH11 ARG 7 HH11 ARG 7 8.336 -18.568 2.814 66 HH12 ARG 7 HH12 ARG 7 7.431 -19.390 4.041 67 HH21 ARG 7 HH21 ARG 7 9.921 -21.717 4.783 68 HH22 ARG 7 HH22 ARG 7 8.323 -21.155 5.154 69 H ASP 8 HN ASP 8 10.747 -13.544 1.374 70 HA ASP 8 HA ASP 8 12.109 -12.580 -1.070 71 HB2 ASP 8 HB2 ASP 8 9.357 -11.827 0.056 72 HB3 ASP 8 HB1 ASP 8 10.006 -11.370 -1.519 73 H ARG 9 HN ARG 9 11.974 -10.081 -1.244 74 HA ARG 9 HA ARG 9 12.397 -8.714 1.338 75 HB2 ARG 9 HB2 ARG 9 14.307 -8.430 -1.028 76 HB3 ARG 9 HB1 ARG 9 14.412 -7.563 0.506 77 HG2 ARG 9 HG2 ARG 9 14.867 -9.633 1.699 78 HG3 ARG 9 HG1 ARG 9 14.631 -10.578 0.227 79 HD2 ARG 9 HD2 ARG 9 16.580 -9.389 -0.781 80 HD3 ARG 9 HD1 ARG 9 16.846 -8.588 0.774 81 HE ARG 9 HE ARG 9 16.712 -11.390 1.160 82 HH11 ARG 9 HH11 ARG 9 18.917 -8.959 -0.098 83 HH12 ARG 9 HH12 ARG 9 20.320 -9.930 0.192 84 HH21 ARG 9 HH21 ARG 9 18.553 -12.642 1.517 85 HH22 ARG 9 HH22 ARG 9 20.116 -12.011 1.113 86 H ILE 10 HN ILE 10 11.721 -6.617 1.366 87 HA ILE 10 HA ILE 10 10.517 -5.405 -1.041 88 HB ILE 10 HB ILE 10 8.382 -4.960 0.162 89 HG12 ILE 10 HG12 ILE 10 9.407 -6.862 2.323 90 HG13 ILE 10 HG11 ILE 10 9.372 -5.113 2.485 91 HG21 ILE 10 HG21 ILE 10 9.020 -7.926 -0.009 92 HG22 ILE 10 HG22 ILE 10 8.447 -6.901 -1.324 93 HG23 ILE 10 HG23 ILE 10 7.396 -7.229 0.051 94 HD11 ILE 10 HD11 ILE 10 7.533 -6.144 3.642 95 HD12 ILE 10 HD12 ILE 10 6.980 -6.897 2.147 96 HD13 ILE 10 HD13 ILE 10 6.944 -5.139 2.320 97 H THR 11 HN THR 11 9.544 -3.156 -0.303 98 HA THR 11 HA THR 11 11.013 -1.941 1.937 99 HB THR 11 HB THR 11 10.874 -0.625 -0.828 100 HG1 THR 11 HG1 THR 11 13.123 -1.853 0.446 101 HG21 THR 11 HG21 THR 11 12.518 0.097 1.637 102 HG22 THR 11 HG22 THR 11 11.064 0.959 1.114 103 HG23 THR 11 HG23 THR 11 12.505 0.965 0.096 104 H ILE 12 HN ILE 12 9.753 -0.530 3.081 105 HA ILE 12 HA ILE 12 6.950 -0.232 2.530 106 HB ILE 12 HB ILE 12 8.670 1.221 4.606 107 HG12 ILE 12 HG12 ILE 12 8.736 -1.188 5.012 108 HG13 ILE 12 HG11 ILE 12 7.732 -0.436 6.243 109 HG21 ILE 12 HG21 ILE 12 6.600 2.486 4.215 110 HG22 ILE 12 HG22 ILE 12 6.541 1.717 5.800 111 HG23 ILE 12 HG23 ILE 12 5.626 1.028 4.455 112 HD11 ILE 12 HD11 ILE 12 6.771 -1.968 3.834 113 HD12 ILE 12 HD12 ILE 12 5.731 -1.170 5.016 114 HD13 ILE 12 HD13 ILE 12 6.767 -2.505 5.512 115 H GLN 13 HN GLN 13 6.076 1.254 1.229 116 HA GLN 13 HA GLN 13 7.455 3.773 0.651 117 HB2 GLN 13 HB2 GLN 13 4.961 2.574 -0.619 118 HB3 GLN 13 HB1 GLN 13 5.669 4.130 -1.056 119 HG2 GLN 13 HG2 GLN 13 7.811 2.802 -1.594 120 HG3 GLN 13 HG1 GLN 13 6.797 1.359 -1.514 121 HE21 GLN 13 HE21 GLN 13 8.196 2.377 -3.830 122 HE22 GLN 13 HE22 GLN 13 7.005 2.729 -5.029 123 H THR 14 HN THR 14 7.055 5.338 1.813 124 HA THR 14 HA THR 14 4.834 5.457 3.691 125 HB THR 14 HB THR 14 7.115 7.470 3.500 126 HG1 THR 14 HG1 THR 14 7.165 4.784 4.367 127 HG21 THR 14 HG21 THR 14 5.257 7.938 5.082 128 HG22 THR 14 HG22 THR 14 6.776 7.618 5.928 129 HG23 THR 14 HG23 THR 14 5.531 6.365 5.839 130 H LEU 15 HN LEU 15 3.215 7.048 3.602 131 HA LEU 15 HA LEU 15 2.864 8.310 0.971 132 HB2 LEU 15 HB2 LEU 15 1.144 6.728 1.909 133 HB3 LEU 15 HB1 LEU 15 0.854 7.838 3.224 134 HG LEU 15 HG LEU 15 -0.840 7.754 1.257 135 HD11 LEU 15 HD11 LEU 15 -1.387 10.116 1.405 136 HD12 LEU 15 HD12 LEU 15 0.193 10.459 2.118 137 HD13 LEU 15 HD13 LEU 15 -0.969 9.449 2.983 138 HD21 LEU 15 HD21 LEU 15 -0.388 9.105 -0.690 139 HD22 LEU 15 HD22 LEU 15 0.838 7.852 -0.556 140 HD23 LEU 15 HD23 LEU 15 1.224 9.512 -0.095 141 H LYS 16 HN LYS 16 3.983 10.220 1.061 142 HA LYS 16 HA LYS 16 3.744 12.051 3.290 143 HB2 LYS 16 HB2 LYS 16 5.872 11.725 1.984 144 HB3 LYS 16 HB1 LYS 16 5.085 12.441 0.579 145 HG2 LYS 16 HG2 LYS 16 4.858 14.575 1.734 146 HG3 LYS 16 HG1 LYS 16 5.485 13.867 3.229 147 HD2 LYS 16 HD2 LYS 16 7.641 13.378 1.957 148 HD3 LYS 16 HD1 LYS 16 6.993 14.351 0.634 149 HE2 LYS 16 HE2 LYS 16 6.967 16.332 2.042 150 HE3 LYS 16 HE1 LYS 16 7.394 15.379 3.466 151 HZ1 LYS 16 HZ1 LYS 16 9.115 15.794 1.083 152 HZ2 LYS 16 HZ2 LYS 16 9.522 14.873 2.441 153 HZ3 LYS 16 HZ3 LYS 16 9.305 16.543 2.584 154 H GLN 17 HN GLN 17 1.774 13.012 3.448 155 HA GLN 17 HA GLN 17 0.272 14.050 1.197 156 HB2 GLN 17 HB2 GLN 17 0.006 14.616 4.192 157 HB3 GLN 17 HB1 GLN 17 -1.160 15.099 2.957 158 HG2 GLN 17 HG2 GLN 17 -1.620 12.733 2.465 159 HG3 GLN 17 HG1 GLN 17 -0.432 12.245 3.672 160 HE21 GLN 17 HE21 GLN 17 -3.613 13.551 3.146 161 HE22 GLN 17 HE22 GLN 17 -4.170 13.396 4.770 162 H THR 18 HN THR 18 1.092 15.743 0.085 163 HA THR 18 HA THR 18 2.461 17.968 1.506 164 HB THR 18 HB THR 18 2.997 16.973 -1.352 165 HG1 THR 18 HG1 THR 18 4.284 16.482 1.120 166 HG21 THR 18 HG21 THR 18 4.508 19.011 0.333 167 HG22 THR 18 HG22 THR 18 3.466 19.402 -1.036 168 HG23 THR 18 HG23 THR 18 4.947 18.478 -1.291 169 H ARG 19 HN ARG 19 1.307 19.879 1.294 170 HA ARG 19 HA ARG 19 -1.178 19.792 -0.167 171 HB2 ARG 19 HB2 ARG 19 -0.626 20.878 2.179 172 HB3 ARG 19 HB1 ARG 19 -0.141 22.275 1.228 173 HG2 ARG 19 HG2 ARG 19 -2.467 22.256 0.201 174 HG3 ARG 19 HG1 ARG 19 -2.886 20.988 1.352 175 HD2 ARG 19 HD2 ARG 19 -3.668 23.085 2.225 176 HD3 ARG 19 HD1 ARG 19 -2.290 22.574 3.207 177 HE ARG 19 HE ARG 19 -1.166 24.181 1.299 178 HH11 ARG 19 HH11 ARG 19 -3.736 24.674 3.651 179 HH12 ARG 19 HH12 ARG 19 -3.455 26.382 3.746 180 HH21 ARG 19 HH21 ARG 19 -0.826 26.413 1.445 181 HH22 ARG 19 HH22 ARG 19 -1.812 27.364 2.513 182 H ASP 20 HN ASP 20 -1.842 21.869 -1.398 183 HA ASP 20 HA ASP 20 0.261 22.647 -3.342 184 HB2 ASP 20 HB2 ASP 20 -1.813 21.410 -4.210 185 HB3 ASP 20 HB1 ASP 20 -2.772 22.798 -3.733 186 H ILE 21 HN ILE 21 0.162 24.918 -4.082 187 HA ILE 21 HA ILE 21 -0.082 26.807 -2.019 188 HB ILE 21 HB ILE 21 1.489 26.893 -3.979 189 HG12 ILE 21 HG12 ILE 21 -0.139 29.461 -3.634 190 HG13 ILE 21 HG11 ILE 21 1.076 28.893 -2.494 191 HG21 ILE 21 HG21 ILE 21 -0.936 27.853 -5.546 192 HG22 ILE 21 HG22 ILE 21 -0.092 26.322 -5.774 193 HG23 ILE 21 HG23 ILE 21 0.733 27.840 -6.131 194 HD11 ILE 21 HD11 ILE 21 1.577 29.703 -5.358 195 HD12 ILE 21 HD12 ILE 21 2.796 29.109 -4.229 196 HD13 ILE 21 HD13 ILE 21 1.972 30.635 -3.913 197 H THR 22 HN THR 22 -2.649 25.448 -3.799 198 HA THR 22 HA THR 22 -4.383 27.814 -3.407 199 HB THR 22 HB THR 22 -6.033 26.619 -4.867 200 HG1 THR 22 HG1 THR 22 -4.027 24.815 -5.683 201 HG21 THR 22 HG21 THR 22 -4.500 28.242 -5.941 202 HG22 THR 22 HG22 THR 22 -4.881 26.908 -7.031 203 HG23 THR 22 HG23 THR 22 -3.322 26.953 -6.208 204 H GLY 23 HN GLY 23 -3.487 24.701 -2.386 205 HA2 GLY 23 HA2 GLY 23 -3.925 23.900 -0.177 206 HA3 GLY 23 HA1 GLY 23 -5.481 24.712 -0.202 207 H GLU 24 HN GLU 24 -3.890 22.354 -2.389 208 HA GLU 24 HA GLU 24 -6.115 20.434 -2.045 209 HB2 GLU 24 HB2 GLU 24 -3.993 20.484 -4.247 210 HB3 GLU 24 HB1 GLU 24 -5.468 19.520 -4.210 211 HG2 GLU 24 HG2 GLU 24 -6.822 21.496 -4.554 212 HG3 GLU 24 HG1 GLU 24 -5.400 22.540 -4.422 213 H ILE 25 HN ILE 25 -5.490 18.238 -1.469 214 HA ILE 25 HA ILE 25 -2.831 17.992 -0.240 215 HB ILE 25 HB ILE 25 -5.163 16.016 -0.193 216 HG12 ILE 25 HG12 ILE 25 -5.788 18.127 0.928 217 HG13 ILE 25 HG11 ILE 25 -5.586 16.848 2.117 218 HG21 ILE 25 HG21 ILE 25 -3.968 14.948 1.703 219 HG22 ILE 25 HG22 ILE 25 -2.614 16.059 1.483 220 HG23 ILE 25 HG23 ILE 25 -3.013 14.892 0.220 221 HD11 ILE 25 HD11 ILE 25 -4.689 18.934 2.913 222 HD12 ILE 25 HD12 ILE 25 -3.613 19.049 1.524 223 HD13 ILE 25 HD13 ILE 25 -3.391 17.759 2.712 224 H LEU 26 HN LEU 26 -1.323 17.618 -1.788 225 HA LEU 26 HA LEU 26 -1.716 15.676 -3.958 226 HB2 LEU 26 HB2 LEU 26 0.522 17.639 -3.313 227 HB3 LEU 26 HB1 LEU 26 0.710 16.401 -4.539 228 HG LEU 26 HG LEU 26 -1.050 17.411 -5.909 229 HD11 LEU 26 HD11 LEU 26 -2.544 18.286 -4.191 230 HD12 LEU 26 HD12 LEU 26 -2.098 19.554 -5.330 231 HD13 LEU 26 HD13 LEU 26 -1.343 19.498 -3.735 232 HD21 LEU 26 HD21 LEU 26 0.087 19.498 -6.513 233 HD22 LEU 26 HD22 LEU 26 1.249 18.212 -6.193 234 HD23 LEU 26 HD23 LEU 26 0.976 19.472 -4.986 235 H GLU 27 HN GLU 27 -1.651 13.687 -3.064 236 HA GLU 27 HA GLU 27 0.218 12.973 -0.965 237 HB2 GLU 27 HB2 GLU 27 -1.795 11.242 -2.463 238 HB3 GLU 27 HB1 GLU 27 -0.926 10.813 -0.988 239 HG2 GLU 27 HG2 GLU 27 -2.027 12.684 0.188 240 HG3 GLU 27 HG1 GLU 27 -2.946 13.037 -1.272 241 H THR 28 HN THR 28 2.031 11.823 -1.198 242 HA THR 28 HA THR 28 2.870 10.798 -3.842 243 HB THR 28 HB THR 28 5.191 11.787 -3.392 244 HG1 THR 28 HG1 THR 28 3.702 13.045 -1.332 245 HG21 THR 28 HG21 THR 28 4.644 14.043 -4.228 246 HG22 THR 28 HG22 THR 28 2.951 13.810 -3.784 247 HG23 THR 28 HG23 THR 28 3.673 12.816 -5.053 248 H TRP 29 HN TRP 29 4.809 9.387 -3.667 249 HA TRP 29 HA TRP 29 4.813 7.853 -1.133 250 HB2 TRP 29 HB2 TRP 29 5.029 6.798 -3.993 251 HB3 TRP 29 HB1 TRP 29 5.169 5.818 -2.534 252 HD1 TRP 29 HD1 TRP 29 2.573 7.418 -4.807 253 HE1 TRP 29 HE1 TRP 29 0.229 6.701 -4.039 254 HE3 TRP 29 HE3 TRP 29 3.793 5.257 -0.336 255 HZ2 TRP 29 HZ2 TRP 29 -0.965 5.425 -1.827 256 HZ3 TRP 29 HZ3 TRP 29 1.995 4.326 1.054 257 HH2 TRP 29 HH2 TRP 29 -0.342 4.406 0.327 258 H GLU 30 HN GLU 30 6.663 8.029 -0.174 259 HA GLU 30 HA GLU 30 9.215 8.241 -1.675 260 HB2 GLU 30 HB2 GLU 30 10.168 9.085 0.482 261 HB3 GLU 30 HB1 GLU 30 8.858 10.091 -0.125 262 HG2 GLU 30 HG2 GLU 30 7.298 9.039 1.490 263 HG3 GLU 30 HG1 GLU 30 8.623 8.053 2.112 264 H ASP 31 HN ASP 31 10.943 6.866 -1.076 265 HA ASP 31 HA ASP 31 10.192 4.210 -0.194 266 HB2 ASP 31 HB2 ASP 31 12.564 3.611 -0.629 267 HB3 ASP 31 HB1 ASP 31 11.843 4.436 -2.002 268 H GLY 32 HN GLY 32 10.664 3.257 1.767 269 HA2 GLY 32 HA2 GLY 32 11.466 5.104 3.954 270 HA3 GLY 32 HA1 GLY 32 10.243 3.846 4.090 271 H HIS 33 HN HIS 33 10.870 1.910 4.907 272 HA HIS 33 HA HIS 33 13.785 1.353 5.094 273 HB2 HIS 33 HB2 HIS 33 12.552 1.778 7.280 274 HB3 HIS 33 HB1 HIS 33 11.624 0.317 6.973 275 HD1 HIS 33 HD1 HIS 33 12.665 -1.842 7.779 276 HD2 HIS 33 HD2 HIS 33 15.420 1.256 7.580 277 HE1 HIS 33 HE1 HIS 33 14.772 -2.746 8.814 278 HE2 HIS 33 HE2 HIS 33 16.463 -0.899 8.530 279 H THR 34 HN THR 34 14.484 -0.456 4.157 280 HA THR 34 HA THR 34 12.787 -2.339 2.827 281 HB THR 34 HB THR 34 15.797 -2.503 3.390 282 HG1 THR 34 HG1 THR 34 16.105 -1.212 1.699 283 HG21 THR 34 HG21 THR 34 14.153 -3.769 1.156 284 HG22 THR 34 HG22 THR 34 14.814 -4.641 2.543 285 HG23 THR 34 HG23 THR 34 15.902 -3.904 1.366 286 H LEU 35 HN LEU 35 12.425 -4.489 3.452 287 HA LEU 35 HA LEU 35 13.309 -5.450 6.035 288 HB2 LEU 35 HB2 LEU 35 11.116 -5.733 7.062 289 HB3 LEU 35 HB1 LEU 35 11.464 -4.042 6.777 290 HG LEU 35 HG LEU 35 9.580 -5.714 5.048 291 HD11 LEU 35 HD11 LEU 35 7.732 -4.551 6.152 292 HD12 LEU 35 HD12 LEU 35 8.865 -3.738 7.238 293 HD13 LEU 35 HD13 LEU 35 8.671 -5.493 7.311 294 HD21 LEU 35 HD21 LEU 35 8.814 -3.545 4.151 295 HD22 LEU 35 HD22 LEU 35 10.522 -3.813 3.825 296 HD23 LEU 35 HD23 LEU 35 10.040 -2.710 5.115 297 H TRP 36 HN TRP 36 13.086 -7.565 6.388 298 HA TRP 36 HA TRP 36 12.872 -9.294 4.137 299 HB2 TRP 36 HB2 TRP 36 12.813 -10.304 7.001 300 HB3 TRP 36 HB1 TRP 36 13.548 -11.047 5.587 301 HD1 TRP 36 HD1 TRP 36 14.540 -9.371 8.642 302 HE1 TRP 36 HE1 TRP 36 16.904 -8.400 8.526 303 HE3 TRP 36 HE3 TRP 36 15.289 -9.606 3.572 304 HZ2 TRP 36 HZ2 TRP 36 18.834 -7.805 6.588 305 HZ3 TRP 36 HZ3 TRP 36 17.441 -8.804 2.682 306 HH2 TRP 36 HH2 TRP 36 19.175 -7.923 4.160 307 H ALA 37 HN ALA 37 11.099 -10.200 3.322 308 HA ALA 37 HA ALA 37 8.654 -10.648 4.941 309 HB1 ALA 37 HB1 ALA 37 7.259 -9.739 3.132 310 HB2 ALA 37 HB2 ALA 37 8.707 -9.352 2.193 311 HB3 ALA 37 HB3 ALA 37 8.390 -8.518 3.715 312 H SER 38 HN SER 38 7.111 -12.191 3.832 313 HA SER 38 HA SER 38 8.168 -13.556 1.462 314 HB2 SER 38 HB2 SER 38 6.601 -14.762 3.788 315 HB3 SER 38 HB1 SER 38 6.924 -15.596 2.265 316 HG SER 38 HG SER 38 8.431 -15.725 4.281 317 H VAL 39 HN VAL 39 7.019 -12.734 -0.172 318 HA VAL 39 HA VAL 39 4.325 -11.645 0.223 319 HB VAL 39 HB VAL 39 6.242 -11.470 -2.158 320 HG11 VAL 39 HG11 VAL 39 3.706 -9.876 -1.617 321 HG12 VAL 39 HG12 VAL 39 3.920 -11.088 -2.881 322 HG13 VAL 39 HG13 VAL 39 4.834 -9.580 -2.940 323 HG21 VAL 39 HG21 VAL 39 5.727 -9.429 0.039 324 HG22 VAL 39 HG22 VAL 39 6.761 -9.183 -1.371 325 HG23 VAL 39 HG23 VAL 39 7.198 -10.387 -0.156 326 H ASN 40 HN ASN 40 2.988 -13.520 0.262 327 HA ASN 40 HA ASN 40 3.057 -15.307 -2.107 328 HB2 ASN 40 HB2 ASN 40 2.128 -15.972 0.732 329 HB3 ASN 40 HB1 ASN 40 2.032 -17.060 -0.647 330 HD21 ASN 40 HD21 ASN 40 4.672 -14.969 0.564 331 HD22 ASN 40 HD22 ASN 40 5.817 -16.259 0.729 332 H MET 41 HN MET 41 1.316 -15.015 -3.396 333 HA MET 41 HA MET 41 -0.929 -13.401 -2.692 334 HB2 MET 41 HB2 MET 41 -0.589 -15.355 -5.001 335 HB3 MET 41 HB1 MET 41 -1.858 -14.140 -4.874 336 HG2 MET 41 HG2 MET 41 -0.106 -12.365 -4.910 337 HG3 MET 41 HG1 MET 41 1.116 -13.615 -5.133 338 HE1 MET 41 HE1 MET 41 -2.190 -12.749 -8.260 339 HE2 MET 41 HE2 MET 41 -2.103 -11.945 -6.691 340 HE3 MET 41 HE3 MET 41 -2.498 -13.663 -6.783 341 H VAL 42 HN VAL 42 -3.163 -14.105 -2.533 342 HA VAL 42 HA VAL 42 -3.455 -16.231 -0.657 343 HB VAL 42 HB VAL 42 -5.833 -15.658 -0.554 344 HG11 VAL 42 HG11 VAL 42 -4.081 -13.177 -0.613 345 HG12 VAL 42 HG12 VAL 42 -4.298 -14.276 0.751 346 HG13 VAL 42 HG13 VAL 42 -5.655 -13.301 0.184 347 HG21 VAL 42 HG21 VAL 42 -5.352 -13.808 -2.924 348 HG22 VAL 42 HG22 VAL 42 -6.838 -13.883 -1.973 349 HG23 VAL 42 HG23 VAL 42 -6.328 -15.277 -2.924 350 H SER 43 HN SER 43 -4.639 -18.137 -0.834 351 HA SER 43 HA SER 43 -4.866 -19.324 -3.502 352 HB2 SER 43 HB2 SER 43 -3.838 -20.545 -1.530 353 HB3 SER 43 HB1 SER 43 -5.423 -20.557 -0.754 354 HG SER 43 HG SER 43 -4.660 -21.806 -3.192 355 H SER 44 HN SER 44 -6.965 -20.780 -3.712 356 HA SER 44 HA SER 44 -9.266 -19.192 -3.946 357 HB2 SER 44 HB2 SER 44 -9.048 -22.226 -3.746 358 HB3 SER 44 HB1 SER 44 -10.473 -21.350 -4.315 359 HG SER 44 HG SER 44 -9.545 -21.534 -6.177 360 H LYS 45 HN LYS 45 -8.099 -21.250 -1.353 361 HA LYS 45 HA LYS 45 -10.297 -21.668 0.259 362 HB2 LYS 45 HB2 LYS 45 -7.958 -22.618 0.540 363 HB3 LYS 45 HB1 LYS 45 -7.478 -21.087 1.253 364 HG2 LYS 45 HG2 LYS 45 -9.708 -21.841 2.792 365 HG3 LYS 45 HG1 LYS 45 -8.900 -23.370 2.460 366 HD2 LYS 45 HD2 LYS 45 -8.044 -22.536 4.540 367 HD3 LYS 45 HD1 LYS 45 -6.761 -22.349 3.340 368 HE2 LYS 45 HE2 LYS 45 -7.429 -19.944 3.083 369 HE3 LYS 45 HE1 LYS 45 -8.609 -20.165 4.377 370 HZ1 LYS 45 HZ1 LYS 45 -6.595 -19.179 5.189 371 HZ2 LYS 45 HZ2 LYS 45 -5.673 -20.465 4.604 372 HZ3 LYS 45 HZ3 LYS 45 -6.780 -20.722 5.859 373 H GLU 46 HN GLU 46 -8.219 -18.779 0.108 374 HA GLU 46 HA GLU 46 -9.199 -17.489 2.452 375 HB2 GLU 46 HB2 GLU 46 -7.858 -16.324 -0.017 376 HB3 GLU 46 HB1 GLU 46 -8.171 -15.419 1.466 377 HG2 GLU 46 HG2 GLU 46 -6.382 -17.850 1.205 378 HG3 GLU 46 HG1 GLU 46 -5.843 -16.177 1.313 379 H ALA 47 HN ALA 47 -9.973 -17.063 -1.005 380 HA ALA 47 HA ALA 47 -11.901 -15.015 -0.731 381 HB1 ALA 47 HB1 ALA 47 -11.647 -17.104 -2.928 382 HB2 ALA 47 HB2 ALA 47 -10.807 -15.554 -2.874 383 HB3 ALA 47 HB3 ALA 47 -12.562 -15.595 -3.039 384 H ILE 48 HN ILE 48 -12.211 -18.532 -0.862 385 HA ILE 48 HA ILE 48 -15.019 -18.779 -0.631 386 HB ILE 48 HB ILE 48 -12.841 -20.719 0.277 387 HG12 ILE 48 HG12 ILE 48 -14.452 -20.719 -2.322 388 HG13 ILE 48 HG11 ILE 48 -12.819 -20.083 -2.180 389 HG21 ILE 48 HG21 ILE 48 -15.804 -21.266 -0.192 390 HG22 ILE 48 HG22 ILE 48 -14.972 -21.295 1.365 391 HG23 ILE 48 HG23 ILE 48 -14.575 -22.492 0.135 392 HD11 ILE 48 HD11 ILE 48 -12.838 -22.301 -3.164 393 HD12 ILE 48 HD12 ILE 48 -13.627 -22.957 -1.730 394 HD13 ILE 48 HD13 ILE 48 -11.988 -22.308 -1.619 395 H SER 49 HN SER 49 -12.477 -18.604 1.843 396 HA SER 49 HA SER 49 -14.230 -19.019 4.093 397 HB2 SER 49 HB2 SER 49 -11.838 -19.689 4.119 398 HB3 SER 49 HB1 SER 49 -11.360 -17.995 4.018 399 HG SER 49 HG SER 49 -12.912 -19.142 6.106 400 H SER 50 HN SER 50 -13.475 -16.295 2.164 401 HA SER 50 HA SER 50 -14.451 -14.383 4.210 402 HB2 SER 50 HB2 SER 50 -12.851 -13.851 1.669 403 HB3 SER 50 HB1 SER 50 -13.344 -12.640 2.856 404 HG SER 50 HG SER 50 -11.446 -14.707 3.108 405 H GLY 51 HN GLY 51 -15.559 -16.148 1.603 406 HA2 GLY 51 HA2 GLY 51 -17.632 -16.122 0.582 407 HA3 GLY 51 HA1 GLY 51 -18.002 -14.602 1.375 408 H ALA 52 HN ALA 52 -16.932 -12.642 0.474 409 HA ALA 52 HA ALA 52 -15.862 -12.785 -2.253 410 HB1 ALA 52 HB1 ALA 52 -18.289 -11.080 -1.564 411 HB2 ALA 52 HB2 ALA 52 -18.299 -12.526 -2.576 412 HB3 ALA 52 HB3 ALA 52 -17.436 -11.081 -3.109 413 H GLU 53 HN GLU 53 -15.417 -11.756 0.786 414 HA GLU 53 HA GLU 53 -14.811 -8.971 0.520 415 HB2 GLU 53 HB2 GLU 53 -15.415 -10.030 2.674 416 HB3 GLU 53 HB1 GLU 53 -13.920 -10.957 2.646 417 HG2 GLU 53 HG2 GLU 53 -12.613 -8.869 2.771 418 HG3 GLU 53 HG1 GLU 53 -14.108 -7.933 2.777 419 H LEU 54 HN LEU 54 -12.439 -11.540 1.398 420 HA LEU 54 HA LEU 54 -10.342 -10.433 -0.214 421 HB2 LEU 54 HB2 LEU 54 -10.600 -13.220 1.000 422 HB3 LEU 54 HB1 LEU 54 -9.152 -12.601 0.217 423 HG LEU 54 HG LEU 54 -10.369 -11.568 2.813 424 HD11 LEU 54 HD11 LEU 54 -9.263 -13.733 3.088 425 HD12 LEU 54 HD12 LEU 54 -8.351 -12.456 3.889 426 HD13 LEU 54 HD13 LEU 54 -7.788 -13.102 2.344 427 HD21 LEU 54 HD21 LEU 54 -9.377 -9.707 1.577 428 HD22 LEU 54 HD22 LEU 54 -7.878 -10.610 1.354 429 HD23 LEU 54 HD23 LEU 54 -8.374 -10.105 2.972 430 H ALA 55 HN ALA 55 -9.663 -11.138 -2.227 431 HA ALA 55 HA ALA 55 -11.506 -12.865 -3.782 432 HB1 ALA 55 HB1 ALA 55 -10.119 -10.322 -4.730 433 HB2 ALA 55 HB2 ALA 55 -11.838 -10.487 -4.368 434 HB3 ALA 55 HB3 ALA 55 -11.134 -11.380 -5.717 435 H ILE 56 HN ILE 56 -10.518 -14.118 -5.420 436 HA ILE 56 HA ILE 56 -7.853 -14.991 -4.972 437 HB ILE 56 HB ILE 56 -9.657 -15.412 -7.402 438 HG12 ILE 56 HG12 ILE 56 -9.097 -17.227 -5.008 439 HG13 ILE 56 HG11 ILE 56 -10.593 -16.347 -5.302 440 HG21 ILE 56 HG21 ILE 56 -8.169 -17.300 -8.006 441 HG22 ILE 56 HG22 ILE 56 -7.074 -16.852 -6.699 442 HG23 ILE 56 HG23 ILE 56 -7.323 -15.752 -8.056 443 HD11 ILE 56 HD11 ILE 56 -10.815 -18.703 -5.842 444 HD12 ILE 56 HD12 ILE 56 -9.496 -18.586 -7.004 445 HD13 ILE 56 HD13 ILE 56 -11.006 -17.715 -7.291 446 H GLY 57 HN GLY 57 -6.026 -13.957 -5.510 447 HA2 GLY 57 HA2 GLY 57 -4.658 -12.772 -7.159 448 HA3 GLY 57 HA1 GLY 57 -6.072 -11.827 -7.600 449 H THR 58 HN THR 58 -6.444 -12.007 -4.394 450 HA THR 58 HA THR 58 -5.205 -9.524 -3.674 451 HB THR 58 HB THR 58 -6.414 -11.725 -1.932 452 HG1 THR 58 HG1 THR 58 -7.795 -10.529 -3.442 453 HG21 THR 58 HG21 THR 58 -4.874 -10.382 -0.552 454 HG22 THR 58 HG22 THR 58 -6.549 -10.037 -0.119 455 HG23 THR 58 HG23 THR 58 -5.642 -8.895 -1.111 456 H VAL 59 HN VAL 59 -3.073 -9.275 -3.274 457 HA VAL 59 HA VAL 59 -1.314 -11.566 -2.903 458 HB VAL 59 HB VAL 59 -0.640 -8.591 -3.007 459 HG11 VAL 59 HG11 VAL 59 1.663 -9.359 -3.514 460 HG12 VAL 59 HG12 VAL 59 1.154 -11.034 -3.296 461 HG13 VAL 59 HG13 VAL 59 1.128 -9.921 -1.927 462 HG21 VAL 59 HG21 VAL 59 -1.730 -9.286 -5.099 463 HG22 VAL 59 HG22 VAL 59 -0.619 -10.645 -5.256 464 HG23 VAL 59 HG23 VAL 59 -0.010 -8.996 -5.381 465 H ARG 60 HN ARG 60 -0.914 -12.347 -0.877 466 HA ARG 60 HA ARG 60 -1.228 -10.554 1.456 467 HB2 ARG 60 HB2 ARG 60 -2.552 -12.585 1.601 468 HB3 ARG 60 HB1 ARG 60 -1.152 -13.589 1.245 469 HG2 ARG 60 HG2 ARG 60 -0.212 -13.274 3.386 470 HG3 ARG 60 HG1 ARG 60 -1.186 -11.838 3.714 471 HD2 ARG 60 HD2 ARG 60 -2.391 -14.613 3.416 472 HD3 ARG 60 HD1 ARG 60 -1.856 -13.947 4.966 473 HE ARG 60 HE ARG 60 -3.468 -11.990 4.046 474 HH11 ARG 60 HH11 ARG 60 -3.997 -15.414 4.444 475 HH12 ARG 60 HH12 ARG 60 -5.695 -15.244 4.741 476 HH21 ARG 60 HH21 ARG 60 -5.663 -11.754 4.490 477 HH22 ARG 60 HH22 ARG 60 -6.642 -13.153 4.788 478 H ILE 61 HN ILE 61 0.470 -10.449 3.031 479 HA ILE 61 HA ILE 61 3.178 -10.981 2.003 480 HB ILE 61 HB ILE 61 2.174 -8.164 2.661 481 HG12 ILE 61 HG12 ILE 61 3.084 -9.236 -0.054 482 HG13 ILE 61 HG11 ILE 61 1.397 -9.128 0.419 483 HG21 ILE 61 HG21 ILE 61 4.426 -7.412 1.944 484 HG22 ILE 61 HG22 ILE 61 4.919 -9.095 1.737 485 HG23 ILE 61 HG23 ILE 61 4.511 -8.487 3.343 486 HD11 ILE 61 HD11 ILE 61 3.293 -6.841 0.090 487 HD12 ILE 61 HD12 ILE 61 1.616 -6.710 0.603 488 HD13 ILE 61 HD13 ILE 61 2.005 -7.310 -1.008 489 H TRP 62 HN TRP 62 4.044 -12.005 3.682 490 HA TRP 62 HA TRP 62 3.336 -11.297 6.455 491 HB2 TRP 62 HB2 TRP 62 4.876 -13.704 5.359 492 HB3 TRP 62 HB1 TRP 62 4.416 -13.459 7.045 493 HD1 TRP 62 HD1 TRP 62 2.802 -14.172 3.598 494 HE1 TRP 62 HE1 TRP 62 0.512 -15.268 4.002 495 HE3 TRP 62 HE3 TRP 62 2.544 -13.710 8.680 496 HZ2 TRP 62 HZ2 TRP 62 -1.191 -15.864 6.172 497 HZ3 TRP 62 HZ3 TRP 62 0.550 -14.558 9.855 498 HH2 TRP 62 HH2 TRP 62 -1.283 -15.613 8.622 499 H ILE 63 HN ILE 63 4.679 -9.991 7.524 500 HA ILE 63 HA ILE 63 7.511 -9.697 6.648 501 HB ILE 63 HB ILE 63 7.384 -7.283 7.177 502 HG12 ILE 63 HG12 ILE 63 4.372 -7.647 7.541 503 HG13 ILE 63 HG11 ILE 63 5.500 -7.464 8.877 504 HG21 ILE 63 HG21 ILE 63 6.959 -7.943 4.853 505 HG22 ILE 63 HG22 ILE 63 6.000 -6.524 5.269 506 HG23 ILE 63 HG23 ILE 63 5.237 -8.116 5.192 507 HD11 ILE 63 HD11 ILE 63 4.933 -5.430 6.732 508 HD12 ILE 63 HD12 ILE 63 6.099 -5.240 8.046 509 HD13 ILE 63 HD13 ILE 63 4.379 -5.392 8.406 510 H ARG 64 HN ARG 64 8.981 -9.184 8.417 511 HA ARG 64 HA ARG 64 8.481 -10.134 10.978 512 HB2 ARG 64 HB2 ARG 64 10.328 -7.804 10.317 513 HB3 ARG 64 HB1 ARG 64 10.412 -8.836 11.745 514 HG2 ARG 64 HG2 ARG 64 10.891 -10.784 10.201 515 HG3 ARG 64 HG1 ARG 64 10.995 -9.625 8.870 516 HD2 ARG 64 HD2 ARG 64 12.761 -9.770 11.332 517 HD3 ARG 64 HD1 ARG 64 13.226 -10.095 9.661 518 HE ARG 64 HE ARG 64 12.887 -7.703 9.194 519 HH11 ARG 64 HH11 ARG 64 13.267 -8.579 12.577 520 HH12 ARG 64 HH12 ARG 64 13.818 -7.003 13.045 521 HH21 ARG 64 HH21 ARG 64 13.564 -5.623 9.853 522 HH22 ARG 64 HH22 ARG 64 13.964 -5.332 11.514 523 H TYR 65 HN TYR 65 7.787 -9.196 12.927 524 HA TYR 65 HA TYR 65 5.456 -7.736 12.835 525 HB2 TYR 65 HB2 TYR 65 6.167 -9.219 14.720 526 HB3 TYR 65 HB1 TYR 65 7.316 -7.996 15.244 527 HD1 TYR 65 HD1 TYR 65 6.489 -5.875 16.317 528 HD2 TYR 65 HD2 TYR 65 3.755 -8.960 15.159 529 HE1 TYR 65 HE1 TYR 65 4.720 -4.805 17.640 530 HE2 TYR 65 HE2 TYR 65 1.990 -7.879 16.491 531 HH TYR 65 HH TYR 65 1.802 -6.337 18.405 532 H ARG 66 HN ARG 66 5.017 -5.658 12.473 533 HA ARG 66 HA ARG 66 6.834 -3.519 13.316 534 HB2 ARG 66 HB2 ARG 66 7.561 -4.153 11.031 535 HB3 ARG 66 HB1 ARG 66 5.929 -3.892 10.422 536 HG2 ARG 66 HG2 ARG 66 6.081 -1.519 10.807 537 HG3 ARG 66 HG1 ARG 66 7.598 -1.693 11.694 538 HD2 ARG 66 HD2 ARG 66 7.240 -2.333 8.737 539 HD3 ARG 66 HD1 ARG 66 7.891 -0.817 9.364 540 HE ARG 66 HE ARG 66 9.187 -3.458 9.442 541 HH11 ARG 66 HH11 ARG 66 9.435 0.001 10.039 542 HH12 ARG 66 HH12 ARG 66 11.145 -0.042 10.317 543 HH21 ARG 66 HH21 ARG 66 11.446 -3.498 9.810 544 HH22 ARG 66 HH22 ARG 66 12.285 -2.029 10.208 545 H LYS 67 HN LYS 67 5.648 -2.106 14.382 546 HA LYS 67 HA LYS 67 2.750 -1.962 14.233 547 HB2 LYS 67 HB2 LYS 67 4.781 -0.402 15.884 548 HB3 LYS 67 HB1 LYS 67 3.034 -0.252 16.067 549 HG2 LYS 67 HG2 LYS 67 2.879 -2.581 16.805 550 HG3 LYS 67 HG1 LYS 67 4.617 -2.802 16.550 551 HD2 LYS 67 HD2 LYS 67 5.106 -1.120 18.288 552 HD3 LYS 67 HD1 LYS 67 3.382 -0.812 18.505 553 HE2 LYS 67 HE2 LYS 67 4.761 -3.458 19.087 554 HE3 LYS 67 HE1 LYS 67 4.355 -2.240 20.295 555 HZ1 LYS 67 HZ1 LYS 67 2.451 -3.804 18.635 556 HZ2 LYS 67 HZ2 LYS 67 2.005 -2.520 19.639 557 HZ3 LYS 67 HZ3 LYS 67 2.692 -3.912 20.311 558 H ASP 68 HN ASP 68 4.965 -0.666 12.240 559 HA ASP 68 HA ASP 68 4.068 2.125 12.165 560 HB2 ASP 68 HB2 ASP 68 6.209 0.705 10.518 561 HB3 ASP 68 HB1 ASP 68 5.914 2.441 10.554 562 H ILE 69 HN ILE 69 3.380 -0.845 10.612 563 HA ILE 69 HA ILE 69 2.773 0.048 7.975 564 HB ILE 69 HB ILE 69 1.571 -2.399 9.357 565 HG12 ILE 69 HG12 ILE 69 4.016 -2.488 9.615 566 HG13 ILE 69 HG11 ILE 69 3.493 -3.685 8.439 567 HG21 ILE 69 HG21 ILE 69 0.484 -1.823 7.228 568 HG22 ILE 69 HG22 ILE 69 1.421 -3.302 7.042 569 HG23 ILE 69 HG23 ILE 69 2.047 -1.781 6.407 570 HD11 ILE 69 HD11 ILE 69 4.744 -1.015 7.817 571 HD12 ILE 69 HD12 ILE 69 4.220 -2.210 6.626 572 HD13 ILE 69 HD13 ILE 69 5.531 -2.591 7.741 573 H ASN 70 HN ASN 70 0.882 0.731 7.097 574 HA ASN 70 HA ASN 70 -1.603 0.908 8.650 575 HB2 ASN 70 HB2 ASN 70 -0.206 3.015 9.081 576 HB3 ASN 70 HB1 ASN 70 -0.302 3.354 7.358 577 HD21 ASN 70 HD21 ASN 70 -2.119 3.191 10.355 578 HD22 ASN 70 HD22 ASN 70 -3.462 4.130 9.808 579 H ALA 71 HN ALA 71 -3.395 1.770 7.140 580 HA ALA 71 HA ALA 71 -3.509 0.323 4.732 581 HB1 ALA 71 HB1 ALA 71 -5.260 2.627 5.639 582 HB2 ALA 71 HB2 ALA 71 -5.517 0.920 6.003 583 HB3 ALA 71 HB3 ALA 71 -5.646 1.492 4.342 584 H THR 72 HN THR 72 -2.429 3.575 5.424 585 HA THR 72 HA THR 72 -2.158 4.244 2.568 586 HB THR 72 HB THR 72 -1.520 6.550 3.458 587 HG1 THR 72 HG1 THR 72 -1.167 5.402 5.696 588 HG21 THR 72 HG21 THR 72 -3.837 6.068 2.723 589 HG22 THR 72 HG22 THR 72 -3.812 7.196 4.079 590 HG23 THR 72 HG23 THR 72 -4.234 5.505 4.348 591 H SER 73 HN SER 73 -0.596 2.182 3.375 592 HA SER 73 HA SER 73 2.066 3.311 2.739 593 HB2 SER 73 HB2 SER 73 1.600 0.766 4.387 594 HB3 SER 73 HB1 SER 73 3.153 1.518 4.014 595 HG SER 73 HG SER 73 1.281 3.110 5.334 596 H ARG 74 HN ARG 74 3.239 1.930 1.164 597 HA ARG 74 HA ARG 74 1.660 -0.322 0.042 598 HB2 ARG 74 HB2 ARG 74 3.323 1.659 -1.578 599 HB3 ARG 74 HB1 ARG 74 2.657 0.155 -2.207 600 HG2 ARG 74 HG2 ARG 74 0.357 1.033 -1.648 601 HG3 ARG 74 HG1 ARG 74 1.114 2.578 -1.261 602 HD2 ARG 74 HD2 ARG 74 1.066 1.184 -3.959 603 HD3 ARG 74 HD1 ARG 74 0.236 2.676 -3.513 604 HE ARG 74 HE ARG 74 3.084 2.871 -3.216 605 HH11 ARG 74 HH11 ARG 74 0.468 3.276 -5.521 606 HH12 ARG 74 HH12 ARG 74 1.444 4.153 -6.649 607 HH21 ARG 74 HH21 ARG 74 4.341 4.002 -4.708 608 HH22 ARG 74 HH22 ARG 74 3.637 4.568 -6.186 609 H ILE 75 HN ILE 75 2.938 -1.931 -1.014 610 HA ILE 75 HA ILE 75 5.553 -2.390 0.293 611 HB ILE 75 HB ILE 75 3.434 -4.380 -0.648 612 HG12 ILE 75 HG12 ILE 75 2.768 -3.253 1.453 613 HG13 ILE 75 HG11 ILE 75 3.132 -4.947 1.748 614 HG21 ILE 75 HG21 ILE 75 6.145 -4.916 0.599 615 HG22 ILE 75 HG22 ILE 75 5.608 -5.365 -1.020 616 HG23 ILE 75 HG23 ILE 75 4.889 -6.132 0.398 617 HD11 ILE 75 HD11 ILE 75 3.964 -3.575 3.533 618 HD12 ILE 75 HD12 ILE 75 4.896 -2.594 2.404 619 HD13 ILE 75 HD13 ILE 75 5.321 -4.289 2.664 620 H LYS 76 HN LYS 76 6.941 -1.622 -1.314 621 HA LYS 76 HA LYS 76 6.631 -2.589 -4.070 622 HB2 LYS 76 HB2 LYS 76 7.318 -0.221 -3.648 623 HB3 LYS 76 HB1 LYS 76 8.801 -0.805 -2.892 624 HG2 LYS 76 HG2 LYS 76 9.432 -1.895 -5.050 625 HG3 LYS 76 HG1 LYS 76 7.974 -1.226 -5.785 626 HD2 LYS 76 HD2 LYS 76 9.914 0.142 -6.357 627 HD3 LYS 76 HD1 LYS 76 8.795 1.060 -5.347 628 HE2 LYS 76 HE2 LYS 76 11.138 1.438 -4.680 629 HE3 LYS 76 HE1 LYS 76 10.231 0.668 -3.381 630 HZ1 LYS 76 HZ1 LYS 76 12.055 -0.707 -5.274 631 HZ2 LYS 76 HZ2 LYS 76 11.199 -1.448 -4.024 632 HZ3 LYS 76 HZ3 LYS 76 12.407 -0.321 -3.665 633 H VAL 77 HN VAL 77 7.420 -4.517 -4.582 634 HA VAL 77 HA VAL 77 9.079 -6.009 -2.758 635 HB VAL 77 HB VAL 77 7.951 -6.819 -5.475 636 HG11 VAL 77 HG11 VAL 77 9.191 -8.568 -3.309 637 HG12 VAL 77 HG12 VAL 77 9.879 -8.242 -4.900 638 HG13 VAL 77 HG13 VAL 77 8.382 -9.164 -4.764 639 HG21 VAL 77 HG21 VAL 77 6.920 -7.418 -2.679 640 HG22 VAL 77 HG22 VAL 77 6.224 -8.023 -4.184 641 HG23 VAL 77 HG23 VAL 77 6.193 -6.296 -3.827 642 H SER 78 HN SER 78 11.177 -5.737 -2.718 643 HA SER 78 HA SER 78 12.785 -4.693 -4.840 644 HB2 SER 78 HB2 SER 78 13.279 -4.288 -2.427 645 HB3 SER 78 HB1 SER 78 13.653 -5.998 -2.220 646 HG SER 78 HG SER 78 14.978 -4.413 -4.150 647 H THR 79 HN THR 79 11.998 -7.918 -3.703 648 HA THR 79 HA THR 79 12.852 -9.161 -6.101 649 HB THR 79 HB THR 79 15.093 -9.029 -5.015 650 HG1 THR 79 HG1 THR 79 14.789 -10.740 -6.407 651 HG21 THR 79 HG21 THR 79 15.634 -10.430 -3.062 652 HG22 THR 79 HG22 THR 79 13.926 -10.836 -2.877 653 HG23 THR 79 HG23 THR 79 14.466 -9.172 -2.651 654 H GLY 80 HN GLY 80 11.850 -11.128 -6.364 655 HA2 GLY 80 HA2 GLY 80 10.806 -13.018 -4.797 656 HA3 GLY 80 HA1 GLY 80 9.671 -11.704 -4.488 657 HA PRO 81 HA PRO 81 8.180 -14.031 -8.284 658 HB2 PRO 81 HB2 PRO 81 5.538 -14.202 -7.571 659 HB3 PRO 81 HB1 PRO 81 6.746 -15.375 -7.028 660 HG2 PRO 81 HG2 PRO 81 5.628 -12.988 -5.552 661 HG3 PRO 81 HG1 PRO 81 5.890 -14.640 -4.954 662 HD2 PRO 81 HD2 PRO 81 7.647 -12.628 -4.432 663 HD3 PRO 81 HD1 PRO 81 8.183 -14.308 -4.646 664 H LEU 82 HN LEU 82 7.140 -11.178 -6.572 665 HA LEU 82 HA LEU 82 6.023 -9.935 -9.020 666 HB2 LEU 82 HB2 LEU 82 5.451 -9.262 -6.097 667 HB3 LEU 82 HB1 LEU 82 4.677 -8.537 -7.502 668 HG LEU 82 HG LEU 82 4.384 -11.435 -6.607 669 HD11 LEU 82 HD11 LEU 82 2.075 -10.838 -6.041 670 HD12 LEU 82 HD12 LEU 82 2.390 -9.155 -6.475 671 HD13 LEU 82 HD13 LEU 82 3.237 -9.890 -5.112 672 HD21 LEU 82 HD21 LEU 82 2.666 -11.656 -8.350 673 HD22 LEU 82 HD22 LEU 82 4.233 -11.266 -9.053 674 HD23 LEU 82 HD23 LEU 82 2.998 -10.012 -8.908 675 H ALA 83 HN ALA 83 8.843 -10.088 -8.387 676 HA ALA 83 HA ALA 83 9.916 -7.841 -7.057 677 HB1 ALA 83 HB1 ALA 83 12.015 -8.425 -8.180 678 HB2 ALA 83 HB2 ALA 83 11.149 -9.481 -9.297 679 HB3 ALA 83 HB3 ALA 83 11.215 -9.878 -7.577 680 H GLY 84 HN GLY 84 9.478 -5.787 -7.592 681 HA2 GLY 84 HA2 GLY 84 10.166 -3.951 -9.098 682 HA3 GLY 84 HA1 GLY 84 9.562 -4.909 -10.442 683 H ARG 85 HN ARG 85 7.241 -5.742 -8.604 684 HA ARG 85 HA ARG 85 5.414 -3.593 -9.289 685 HB2 ARG 85 HB2 ARG 85 4.909 -6.214 -7.799 686 HB3 ARG 85 HB1 ARG 85 3.659 -5.065 -8.282 687 HG2 ARG 85 HG2 ARG 85 4.299 -5.425 -10.664 688 HG3 ARG 85 HG1 ARG 85 5.456 -6.652 -10.133 689 HD2 ARG 85 HD2 ARG 85 3.604 -7.977 -9.170 690 HD3 ARG 85 HD1 ARG 85 2.452 -6.743 -9.697 691 HE ARG 85 HE ARG 85 3.935 -7.620 -11.931 692 HH11 ARG 85 HH11 ARG 85 1.420 -8.787 -9.765 693 HH12 ARG 85 HH12 ARG 85 0.796 -9.926 -10.914 694 HH21 ARG 85 HH21 ARG 85 3.118 -9.102 -13.417 695 HH22 ARG 85 HH22 ARG 85 1.773 -10.107 -13.002 696 H VAL 86 HN VAL 86 3.827 -2.812 -7.683 697 HA VAL 86 HA VAL 86 4.835 -2.599 -4.928 698 HB VAL 86 HB VAL 86 5.610 -0.566 -5.967 699 HG11 VAL 86 HG11 VAL 86 4.118 1.095 -7.043 700 HG12 VAL 86 HG12 VAL 86 2.772 -0.040 -6.916 701 HG13 VAL 86 HG13 VAL 86 4.162 -0.431 -7.933 702 HG21 VAL 86 HG21 VAL 86 4.773 -0.388 -3.669 703 HG22 VAL 86 HG22 VAL 86 3.161 0.002 -4.277 704 HG23 VAL 86 HG23 VAL 86 4.499 1.116 -4.552 705 H LEU 87 HN LEU 87 3.391 -3.686 -3.918 706 HA LEU 87 HA LEU 87 0.638 -3.953 -4.717 707 HB2 LEU 87 HB2 LEU 87 2.130 -5.152 -2.347 708 HB3 LEU 87 HB1 LEU 87 0.491 -5.563 -2.816 709 HG LEU 87 HG LEU 87 1.841 -7.344 -3.603 710 HD11 LEU 87 HD11 LEU 87 1.610 -7.322 -6.026 711 HD12 LEU 87 HD12 LEU 87 1.354 -5.573 -6.003 712 HD13 LEU 87 HD13 LEU 87 0.183 -6.650 -5.237 713 HD21 LEU 87 HD21 LEU 87 3.848 -7.125 -4.963 714 HD22 LEU 87 HD22 LEU 87 4.037 -6.300 -3.416 715 HD23 LEU 87 HD23 LEU 87 3.736 -5.362 -4.883 716 H ASN 88 HN ASN 88 -0.951 -2.735 -4.065 717 HA ASN 88 HA ASN 88 -0.672 -0.706 -1.997 718 HB2 ASN 88 HB2 ASN 88 -3.024 -1.400 -3.832 719 HB3 ASN 88 HB1 ASN 88 -2.970 -0.022 -2.744 720 HD21 ASN 88 HD21 ASN 88 -0.280 -1.125 -4.840 721 HD22 ASN 88 HD22 ASN 88 -0.295 0.271 -5.841 722 H ILE 89 HN ILE 89 -1.815 -0.746 -0.008 723 HA ILE 89 HA ILE 89 -2.431 -3.455 0.917 724 HB ILE 89 HB ILE 89 -2.151 -0.838 2.479 725 HG12 ILE 89 HG12 ILE 89 -0.206 -3.169 2.195 726 HG13 ILE 89 HG11 ILE 89 -0.018 -1.588 1.442 727 HG21 ILE 89 HG21 ILE 89 -3.625 -2.390 3.684 728 HG22 ILE 89 HG22 ILE 89 -2.085 -2.238 4.526 729 HG23 ILE 89 HG23 ILE 89 -2.420 -3.673 3.555 730 HD11 ILE 89 HD11 ILE 89 0.048 -2.183 4.400 731 HD12 ILE 89 HD12 ILE 89 0.189 -0.574 3.680 732 HD13 ILE 89 HD13 ILE 89 1.426 -1.797 3.367 733 H ILE 90 HN ILE 90 -4.442 -3.942 0.166 734 HA ILE 90 HA ILE 90 -6.662 -2.073 0.205 735 HB ILE 90 HB ILE 90 -8.005 -4.020 -0.727 736 HG12 ILE 90 HG12 ILE 90 -5.340 -5.488 -1.011 737 HG13 ILE 90 HG11 ILE 90 -6.444 -5.821 0.311 738 HG21 ILE 90 HG21 ILE 90 -5.481 -3.280 -2.251 739 HG22 ILE 90 HG22 ILE 90 -6.979 -2.347 -2.201 740 HG23 ILE 90 HG23 ILE 90 -6.959 -3.940 -2.963 741 HD11 ILE 90 HD11 ILE 90 -7.075 -6.156 -2.614 742 HD12 ILE 90 HD12 ILE 90 -8.147 -6.545 -1.268 743 HD13 ILE 90 HD13 ILE 90 -6.647 -7.439 -1.489 744 H GLY 91 HN GLY 91 -6.274 -1.894 2.608 745 HA2 GLY 91 HA2 GLY 91 -8.203 -2.507 4.294 746 HA3 GLY 91 HA1 GLY 91 -7.339 -4.049 4.292 747 H GLN 92 HN GLN 92 -6.912 -3.658 6.547 748 HA GLN 92 HA GLN 92 -4.599 -1.863 7.006 749 HB2 GLN 92 HB2 GLN 92 -6.891 -2.387 8.962 750 HB3 GLN 92 HB1 GLN 92 -5.434 -1.464 9.330 751 HG2 GLN 92 HG2 GLN 92 -6.052 0.169 7.566 752 HG3 GLN 92 HG1 GLN 92 -7.541 -0.725 7.274 753 HE21 GLN 92 HE21 GLN 92 -7.191 2.051 8.105 754 HE22 GLN 92 HE22 GLN 92 -8.037 2.216 9.602 755 HA PRO 93 HA PRO 93 -2.312 -5.460 8.062 756 HB2 PRO 93 HB2 PRO 93 -0.688 -4.559 10.127 757 HB3 PRO 93 HB1 PRO 93 -0.447 -4.142 8.429 758 HG2 PRO 93 HG2 PRO 93 -1.902 -2.574 10.571 759 HG3 PRO 93 HG1 PRO 93 -0.655 -2.007 9.433 760 HD2 PRO 93 HD2 PRO 93 -3.209 -1.529 8.903 761 HD3 PRO 93 HD1 PRO 93 -2.139 -2.069 7.588 762 H LEU 94 HN LEU 94 -2.721 -7.288 9.176 763 HA LEU 94 HA LEU 94 -4.047 -7.217 11.826 764 HB2 LEU 94 HB2 LEU 94 -5.162 -8.356 9.808 765 HB3 LEU 94 HB1 LEU 94 -3.884 -9.543 9.849 766 HG LEU 94 HG LEU 94 -6.108 -10.254 10.833 767 HD11 LEU 94 HD11 LEU 94 -4.069 -11.486 11.354 768 HD12 LEU 94 HD12 LEU 94 -5.201 -11.489 12.705 769 HD13 LEU 94 HD13 LEU 94 -3.780 -10.439 12.747 770 HD21 LEU 94 HD21 LEU 94 -6.691 -8.142 11.934 771 HD22 LEU 94 HD22 LEU 94 -5.385 -8.378 13.100 772 HD23 LEU 94 HD23 LEU 94 -6.747 -9.502 13.056 773 HA PRO 95 HA PRO 95 0.162 -8.609 13.104 774 HB2 PRO 95 HB2 PRO 95 -0.241 -8.399 15.812 775 HB3 PRO 95 HB1 PRO 95 0.134 -7.008 14.780 776 HG2 PRO 95 HG2 PRO 95 -2.555 -7.964 15.766 777 HG3 PRO 95 HG1 PRO 95 -1.904 -6.310 15.743 778 HD2 PRO 95 HD2 PRO 95 -3.627 -7.179 13.847 779 HD3 PRO 95 HD1 PRO 95 -2.320 -6.042 13.458 780 H ASP 96 HN ASP 96 0.932 -10.575 13.667 781 HA ASP 96 HA ASP 96 -0.765 -12.849 13.722 782 HB2 ASP 96 HB2 ASP 96 1.415 -13.075 12.757 783 HB3 ASP 96 HB1 ASP 96 2.194 -12.409 14.186 784 H ALA 97 HN ALA 97 -1.078 -14.391 15.389 785 HA ALA 97 HA ALA 97 -1.783 -13.355 17.936 786 HB1 ALA 97 HB1 ALA 97 -1.615 -16.251 17.029 787 HB2 ALA 97 HB2 ALA 97 -3.009 -15.190 16.835 788 HB3 ALA 97 HB3 ALA 97 -2.481 -15.659 18.453 789 H ALA 98 HN ALA 98 1.052 -15.124 16.797 790 HA ALA 98 HA ALA 98 2.201 -15.341 19.497 791 HB1 ALA 98 HB1 ALA 98 2.495 -17.231 17.926 792 HB2 ALA 98 HB2 ALA 98 4.048 -16.536 18.399 793 HB3 ALA 98 HB3 ALA 98 3.362 -16.171 16.812 794 H ARG 99 HN ARG 99 2.009 -13.031 17.045 795 HA ARG 99 HA ARG 99 2.972 -11.059 16.569 796 HB2 ARG 99 HB2 ARG 99 4.136 -11.333 19.368 797 HB3 ARG 99 HB1 ARG 99 4.350 -9.898 18.383 798 HG2 ARG 99 HG2 ARG 99 2.607 -9.389 19.896 799 HG3 ARG 99 HG1 ARG 99 1.822 -9.661 18.341 800 HD2 ARG 99 HD2 ARG 99 1.101 -11.879 19.056 801 HD3 ARG 99 HD1 ARG 99 1.998 -11.715 20.571 802 HE ARG 99 HE ARG 99 0.079 -9.614 20.205 803 HH11 ARG 99 HH11 ARG 99 0.314 -12.967 21.252 804 HH12 ARG 99 HH12 ARG 99 -1.063 -12.847 22.294 805 HH21 ARG 99 HH21 ARG 99 -1.717 -9.511 21.560 806 HH22 ARG 99 HH22 ARG 99 -2.195 -10.897 22.480 807 H THR 100 HN THR 100 4.425 -13.649 15.963 808 HA THR 100 HA THR 100 7.233 -12.800 15.912 809 HB THR 100 HB THR 100 6.708 -15.146 16.560 810 HG1 THR 100 HG1 THR 100 8.457 -14.392 14.578 811 HG21 THR 100 HG21 THR 100 5.842 -15.511 13.675 812 HG22 THR 100 HG22 THR 100 4.787 -15.598 15.088 813 HG23 THR 100 HG23 THR 100 6.057 -16.802 14.857 814 H ARG 101 HN ARG 101 4.577 -12.226 14.040 815 HA ARG 101 HA ARG 101 6.140 -10.906 12.096 816 HB2 ARG 101 HB2 ARG 101 5.516 -11.988 10.032 817 HB3 ARG 101 HB1 ARG 101 6.230 -13.208 11.068 818 HG2 ARG 101 HG2 ARG 101 3.233 -12.877 10.710 819 HG3 ARG 101 HG1 ARG 101 4.221 -13.922 9.692 820 HD2 ARG 101 HD2 ARG 101 4.900 -15.191 11.716 821 HD3 ARG 101 HD1 ARG 101 3.833 -14.166 12.684 822 HE ARG 101 HE ARG 101 2.110 -15.118 10.889 823 HH11 ARG 101 HH11 ARG 101 4.549 -16.848 12.726 824 HH12 ARG 101 HH12 ARG 101 3.619 -18.303 12.831 825 HH21 ARG 101 HH21 ARG 101 0.877 -17.041 11.062 826 HH22 ARG 101 HH22 ARG 101 1.541 -18.411 11.895 827 H LEU 102 HN LEU 102 4.361 -10.305 10.167 828 HA LEU 102 HA LEU 102 1.911 -9.344 11.472 829 HB2 LEU 102 HB2 LEU 102 4.120 -7.685 11.085 830 HB3 LEU 102 HB1 LEU 102 3.286 -7.459 9.569 831 HG LEU 102 HG LEU 102 2.629 -5.664 10.964 832 HD11 LEU 102 HD11 LEU 102 0.767 -6.584 9.706 833 HD12 LEU 102 HD12 LEU 102 0.220 -5.899 11.233 834 HD13 LEU 102 HD13 LEU 102 0.349 -7.651 11.047 835 HD21 LEU 102 HD21 LEU 102 3.367 -6.531 13.107 836 HD22 LEU 102 HD22 LEU 102 2.003 -7.652 13.166 837 HD23 LEU 102 HD23 LEU 102 1.722 -5.907 13.233 838 H GLU 103 HN GLU 103 0.200 -9.886 10.176 839 HA GLU 103 HA GLU 103 0.662 -10.833 7.437 840 HB2 GLU 103 HB2 GLU 103 -0.713 -12.203 8.982 841 HB3 GLU 103 HB1 GLU 103 -1.858 -10.885 9.155 842 HG2 GLU 103 HG2 GLU 103 -1.343 -11.940 6.387 843 HG3 GLU 103 HG1 GLU 103 -2.265 -12.957 7.485 844 H ILE 104 HN ILE 104 0.575 -9.407 5.839 845 HA ILE 104 HA ILE 104 -1.191 -7.047 6.021 846 HB ILE 104 HB ILE 104 1.064 -7.463 4.000 847 HG12 ILE 104 HG12 ILE 104 2.159 -7.608 6.189 848 HG13 ILE 104 HG11 ILE 104 2.548 -6.060 5.453 849 HG21 ILE 104 HG21 ILE 104 -0.296 -4.935 5.004 850 HG22 ILE 104 HG22 ILE 104 -0.564 -5.715 3.443 851 HG23 ILE 104 HG23 ILE 104 1.006 -5.000 3.812 852 HD11 ILE 104 HD11 ILE 104 0.582 -6.563 7.679 853 HD12 ILE 104 HD12 ILE 104 0.844 -5.001 6.901 854 HD13 ILE 104 HD13 ILE 104 2.155 -5.776 7.788 855 H LEU 105 HN LEU 105 -2.745 -6.754 4.458 856 HA LEU 105 HA LEU 105 -3.003 -8.765 2.296 857 HB2 LEU 105 HB2 LEU 105 -5.391 -8.433 2.259 858 HB3 LEU 105 HB1 LEU 105 -4.916 -8.826 3.899 859 HG LEU 105 HG LEU 105 -5.575 -6.000 2.952 860 HD11 LEU 105 HD11 LEU 105 -7.715 -6.231 4.097 861 HD12 LEU 105 HD12 LEU 105 -7.356 -7.918 4.475 862 HD13 LEU 105 HD13 LEU 105 -7.560 -7.410 2.797 863 HD21 LEU 105 HD21 LEU 105 -4.097 -6.040 4.920 864 HD22 LEU 105 HD22 LEU 105 -5.235 -7.084 5.768 865 HD23 LEU 105 HD23 LEU 105 -5.702 -5.433 5.339 866 H CYS 106 HN CYS 106 -2.985 -8.037 0.295 867 HA CYS 106 HA CYS 106 -3.128 -5.214 -0.419 868 HB2 CYS 106 HB2 CYS 106 -0.527 -6.740 -0.888 869 HB3 CYS 106 HB1 CYS 106 -0.869 -5.079 -1.344 870 HG CYS 106 HG CYS 106 -1.354 -4.878 1.737 871 H ARG 107 HN ARG 107 -2.565 -5.020 -2.857 872 HA ARG 107 HA ARG 107 -2.083 -7.338 -4.427 873 HB2 ARG 107 HB2 ARG 107 -4.098 -7.279 -5.870 874 HB3 ARG 107 HB1 ARG 107 -4.516 -7.702 -4.211 875 HG2 ARG 107 HG2 ARG 107 -5.269 -5.369 -3.816 876 HG3 ARG 107 HG1 ARG 107 -4.882 -4.974 -5.494 877 HD2 ARG 107 HD2 ARG 107 -6.538 -6.660 -6.257 878 HD3 ARG 107 HD1 ARG 107 -6.939 -7.007 -4.573 879 HE ARG 107 HE ARG 107 -7.972 -4.901 -4.376 880 HH11 ARG 107 HH11 ARG 107 -6.804 -5.456 -7.650 881 HH12 ARG 107 HH12 ARG 107 -7.831 -4.241 -8.340 882 HH21 ARG 107 HH21 ARG 107 -9.290 -3.313 -5.297 883 HH22 ARG 107 HH22 ARG 107 -9.227 -3.016 -7.007 884 H GLU 108 HN GLU 108 -2.216 -6.619 -6.855 885 HA GLU 108 HA GLU 108 -0.571 -4.409 -7.345 886 HB2 GLU 108 HB2 GLU 108 -2.451 -5.891 -9.228 887 HB3 GLU 108 HB1 GLU 108 -1.306 -4.681 -9.763 888 HG2 GLU 108 HG2 GLU 108 -0.352 -6.815 -10.228 889 HG3 GLU 108 HG1 GLU 108 0.559 -6.110 -8.898 890 H GLY 109 HN GLY 109 -1.276 -2.600 -8.999 891 HA2 GLY 109 HA2 GLY 109 -3.288 -1.008 -7.599 892 HA3 GLY 109 HA1 GLY 109 -2.166 -0.447 -8.834 893 H ALA 110 HN ALA 110 -4.511 -3.119 -8.907 894 HA ALA 110 HA ALA 110 -5.467 -2.366 -11.537 895 HB1 ALA 110 HB1 ALA 110 -4.970 -4.724 -11.036 896 HB2 ALA 110 HB2 ALA 110 -6.672 -4.515 -11.455 897 HB3 ALA 110 HB3 ALA 110 -6.200 -4.727 -9.766 898 H GLU 111 HN GLU 111 -6.434 -0.424 -10.952 899 HA GLU 111 HA GLU 111 -8.893 -0.390 -9.361 900 HB2 GLU 111 HB2 GLU 111 -8.811 2.125 -10.225 901 HB3 GLU 111 HB1 GLU 111 -7.761 1.591 -8.927 902 HG2 GLU 111 HG2 GLU 111 -6.615 3.066 -10.548 903 HG3 GLU 111 HG1 GLU 111 -5.858 1.483 -10.419 904 H LYS 112 HN LYS 112 -8.228 -1.500 -12.282 905 HA LYS 112 HA LYS 112 -10.297 -0.265 -13.900 906 HB2 LYS 112 HB2 LYS 112 -8.035 -0.917 -14.821 907 HB3 LYS 112 HB1 LYS 112 -8.446 -2.605 -14.549 908 HG2 LYS 112 HG2 LYS 112 -8.738 -1.989 -16.900 909 HG3 LYS 112 HG1 LYS 112 -10.293 -2.431 -16.179 910 HD2 LYS 112 HD2 LYS 112 -10.928 -0.087 -15.980 911 HD3 LYS 112 HD1 LYS 112 -9.320 0.440 -16.490 912 HE2 LYS 112 HE2 LYS 112 -11.267 -1.112 -18.233 913 HE3 LYS 112 HE1 LYS 112 -11.022 0.634 -18.299 914 HZ1 LYS 112 HZ1 LYS 112 -9.752 -0.491 -20.007 915 HZ2 LYS 112 HZ2 LYS 112 -8.956 -1.429 -18.850 916 HZ3 LYS 112 HZ3 LYS 112 -8.707 0.243 -18.899 Start of MODEL 5 1 H1 MET 1 HT1 MET 1 17.050 -19.100 16.180 2 H2 MET 1 HT2 MET 1 17.766 -19.095 14.651 3 H3 MET 1 HT3 MET 1 17.453 -20.560 15.429 4 HA MET 1 HA MET 1 15.106 -20.199 15.281 5 HB2 MET 1 HB2 MET 1 15.837 -17.663 13.749 6 HB3 MET 1 HB1 MET 1 14.205 -18.269 14.020 7 HG2 MET 1 HG2 MET 1 16.115 -17.183 16.104 8 HG3 MET 1 HG1 MET 1 14.620 -16.436 15.521 9 HE1 MET 1 HE1 MET 1 15.457 -17.024 18.616 10 HE2 MET 1 HE2 MET 1 13.915 -17.561 19.279 11 HE3 MET 1 HE3 MET 1 13.971 -16.178 18.187 12 H ASN 2 HN ASN 2 14.037 -21.139 13.504 13 HA ASN 2 HA ASN 2 15.669 -22.190 11.386 14 HB2 ASN 2 HB2 ASN 2 13.577 -23.243 10.559 15 HB3 ASN 2 HB1 ASN 2 13.848 -23.552 12.264 16 HD21 ASN 2 HD21 ASN 2 11.719 -24.038 12.688 17 HD22 ASN 2 HD22 ASN 2 10.449 -22.868 12.663 18 H ILE 3 HN ILE 3 15.351 -21.839 9.099 19 HA ILE 3 HA ILE 3 14.578 -19.088 8.400 20 HB ILE 3 HB ILE 3 15.725 -21.172 6.481 21 HG12 ILE 3 HG12 ILE 3 17.374 -19.250 8.203 22 HG13 ILE 3 HG11 ILE 3 17.264 -20.985 8.469 23 HG21 ILE 3 HG21 ILE 3 16.553 -19.188 5.238 24 HG22 ILE 3 HG22 ILE 3 15.849 -18.125 6.457 25 HG23 ILE 3 HG23 ILE 3 14.802 -19.123 5.446 26 HD11 ILE 3 HD11 ILE 3 19.342 -20.393 7.371 27 HD12 ILE 3 HD12 ILE 3 18.468 -19.635 6.043 28 HD13 ILE 3 HD13 ILE 3 18.351 -21.379 6.296 29 H GLY 4 HN GLY 4 12.455 -20.512 9.267 30 HA2 GLY 4 HA2 GLY 4 10.893 -21.306 6.877 31 HA3 GLY 4 HA1 GLY 4 10.598 -21.868 8.519 32 H ARG 5 HN ARG 5 11.434 -18.538 7.828 33 HA ARG 5 HA ARG 5 8.659 -17.672 8.412 34 HB2 ARG 5 HB2 ARG 5 11.222 -16.217 9.190 35 HB3 ARG 5 HB1 ARG 5 9.579 -15.710 9.563 36 HG2 ARG 5 HG2 ARG 5 9.319 -17.651 11.068 37 HG3 ARG 5 HG1 ARG 5 10.966 -18.176 10.680 38 HD2 ARG 5 HD2 ARG 5 11.829 -16.008 11.587 39 HD3 ARG 5 HD1 ARG 5 10.176 -15.564 12.033 40 HE ARG 5 HE ARG 5 11.053 -18.070 13.143 41 HH11 ARG 5 HH11 ARG 5 10.893 -14.603 13.688 42 HH12 ARG 5 HH12 ARG 5 11.216 -14.744 15.387 43 HH21 ARG 5 HH21 ARG 5 11.452 -18.231 15.363 44 HH22 ARG 5 HH22 ARG 5 11.536 -16.791 16.333 45 H LEU 6 HN LEU 6 11.571 -15.861 7.368 46 HA LEU 6 HA LEU 6 9.986 -14.702 5.154 47 HB2 LEU 6 HB2 LEU 6 12.501 -13.521 6.398 48 HB3 LEU 6 HB1 LEU 6 11.420 -12.748 5.255 49 HG LEU 6 HG LEU 6 10.880 -11.685 7.251 50 HD11 LEU 6 HD11 LEU 6 8.668 -12.350 7.967 51 HD12 LEU 6 HD12 LEU 6 8.868 -13.934 7.214 52 HD13 LEU 6 HD13 LEU 6 8.828 -12.477 6.216 53 HD21 LEU 6 HD21 LEU 6 12.239 -12.934 8.775 54 HD22 LEU 6 HD22 LEU 6 11.135 -14.307 8.727 55 HD23 LEU 6 HD23 LEU 6 10.620 -12.784 9.452 56 H ARG 7 HN ARG 7 10.742 -14.674 3.119 57 HA ARG 7 HA ARG 7 13.236 -16.148 2.438 58 HB2 ARG 7 HB2 ARG 7 10.769 -15.813 0.677 59 HB3 ARG 7 HB1 ARG 7 12.162 -16.853 0.380 60 HG2 ARG 7 HG2 ARG 7 11.507 -18.340 2.161 61 HG3 ARG 7 HG1 ARG 7 10.218 -17.237 2.669 62 HD2 ARG 7 HD2 ARG 7 10.377 -18.766 0.044 63 HD3 ARG 7 HD1 ARG 7 9.255 -19.069 1.378 64 HE ARG 7 HE ARG 7 9.222 -16.468 -0.044 65 HH11 ARG 7 HH11 ARG 7 7.524 -19.397 0.840 66 HH12 ARG 7 HH12 ARG 7 6.013 -18.853 0.188 67 HH21 ARG 7 HH21 ARG 7 7.285 -15.757 -0.869 68 HH22 ARG 7 HH22 ARG 7 5.870 -16.761 -0.781 69 H ASP 8 HN ASP 8 11.119 -13.472 1.692 70 HA ASP 8 HA ASP 8 12.736 -12.524 -0.554 71 HB2 ASP 8 HB2 ASP 8 9.843 -11.865 0.212 72 HB3 ASP 8 HB1 ASP 8 10.667 -11.378 -1.270 73 H ARG 9 HN ARG 9 12.186 -10.025 -0.809 74 HA ARG 9 HA ARG 9 12.436 -8.553 1.730 75 HB2 ARG 9 HB2 ARG 9 14.144 -8.251 -0.784 76 HB3 ARG 9 HB1 ARG 9 13.961 -6.936 0.375 77 HG2 ARG 9 HG2 ARG 9 14.946 -8.306 2.146 78 HG3 ARG 9 HG1 ARG 9 15.073 -9.681 1.044 79 HD2 ARG 9 HD2 ARG 9 16.468 -7.023 0.571 80 HD3 ARG 9 HD1 ARG 9 17.207 -8.384 1.415 81 HE ARG 9 HE ARG 9 16.796 -9.685 -0.704 82 HH11 ARG 9 HH11 ARG 9 17.157 -6.194 -0.896 83 HH12 ARG 9 HH12 ARG 9 17.880 -6.244 -2.471 84 HH21 ARG 9 HH21 ARG 9 17.757 -9.718 -2.769 85 HH22 ARG 9 HH22 ARG 9 18.233 -8.225 -3.517 86 H ILE 10 HN ILE 10 11.453 -6.536 1.712 87 HA ILE 10 HA ILE 10 9.927 -5.631 -0.649 88 HB ILE 10 HB ILE 10 7.960 -5.090 0.799 89 HG12 ILE 10 HG12 ILE 10 9.054 -6.948 2.955 90 HG13 ILE 10 HG11 ILE 10 9.443 -5.238 2.986 91 HG21 ILE 10 HG21 ILE 10 6.995 -7.368 0.932 92 HG22 ILE 10 HG22 ILE 10 8.598 -8.060 0.674 93 HG23 ILE 10 HG23 ILE 10 7.842 -7.089 -0.592 94 HD11 ILE 10 HD11 ILE 10 6.699 -6.429 3.107 95 HD12 ILE 10 HD12 ILE 10 7.077 -4.702 3.140 96 HD13 ILE 10 HD13 ILE 10 7.623 -5.756 4.446 97 H THR 11 HN THR 11 9.716 -3.378 -0.710 98 HA THR 11 HA THR 11 11.116 -1.798 1.338 99 HB THR 11 HB THR 11 10.430 -0.886 -1.496 100 HG1 THR 11 HG1 THR 11 12.314 -2.712 -0.686 101 HG21 THR 11 HG21 THR 11 11.076 0.868 0.151 102 HG22 THR 11 HG22 THR 11 12.268 0.690 -1.140 103 HG23 THR 11 HG23 THR 11 12.584 -0.001 0.454 104 H ILE 12 HN ILE 12 9.994 -0.166 2.343 105 HA ILE 12 HA ILE 12 7.066 -0.148 2.031 106 HB ILE 12 HB ILE 12 8.737 1.168 4.217 107 HG12 ILE 12 HG12 ILE 12 9.140 -1.233 4.305 108 HG13 ILE 12 HG11 ILE 12 8.078 -0.795 5.636 109 HG21 ILE 12 HG21 ILE 12 6.490 2.165 4.027 110 HG22 ILE 12 HG22 ILE 12 6.619 1.229 5.517 111 HG23 ILE 12 HG23 ILE 12 5.744 0.566 4.134 112 HD11 ILE 12 HD11 ILE 12 7.391 -2.867 4.667 113 HD12 ILE 12 HD12 ILE 12 7.278 -2.144 3.062 114 HD13 ILE 12 HD13 ILE 12 6.162 -1.645 4.343 115 H GLN 13 HN GLN 13 6.273 1.298 0.654 116 HA GLN 13 HA GLN 13 7.481 3.935 0.265 117 HB2 GLN 13 HB2 GLN 13 5.089 2.610 -1.093 118 HB3 GLN 13 HB1 GLN 13 5.620 4.254 -1.430 119 HG2 GLN 13 HG2 GLN 13 6.479 2.823 -3.153 120 HG3 GLN 13 HG1 GLN 13 7.831 3.359 -2.154 121 HE21 GLN 13 HE21 GLN 13 9.214 1.671 -2.508 122 HE22 GLN 13 HE22 GLN 13 8.881 0.036 -2.072 123 H THR 14 HN THR 14 7.116 5.187 1.856 124 HA THR 14 HA THR 14 4.705 5.206 3.477 125 HB THR 14 HB THR 14 5.844 7.110 4.685 126 HG1 THR 14 HG1 THR 14 7.035 7.841 2.800 127 HG21 THR 14 HG21 THR 14 7.616 4.674 4.271 128 HG22 THR 14 HG22 THR 14 6.288 4.802 5.430 129 HG23 THR 14 HG23 THR 14 7.721 5.814 5.617 130 H LEU 15 HN LEU 15 3.411 7.246 3.790 131 HA LEU 15 HA LEU 15 3.068 8.710 1.238 132 HB2 LEU 15 HB2 LEU 15 1.215 7.170 1.732 133 HB3 LEU 15 HB1 LEU 15 0.991 7.902 3.308 134 HG LEU 15 HG LEU 15 0.274 10.020 2.239 135 HD11 LEU 15 HD11 LEU 15 1.595 9.875 0.180 136 HD12 LEU 15 HD12 LEU 15 -0.100 10.164 -0.152 137 HD13 LEU 15 HD13 LEU 15 0.571 8.557 -0.399 138 HD21 LEU 15 HD21 LEU 15 -1.438 8.347 2.823 139 HD22 LEU 15 HD22 LEU 15 -1.285 7.615 1.222 140 HD23 LEU 15 HD23 LEU 15 -1.900 9.263 1.388 141 H LYS 16 HN LYS 16 4.013 10.627 1.556 142 HA LYS 16 HA LYS 16 3.492 12.241 3.937 143 HB2 LYS 16 HB2 LYS 16 5.751 12.195 2.950 144 HB3 LYS 16 HB1 LYS 16 5.113 12.761 1.417 145 HG2 LYS 16 HG2 LYS 16 4.492 14.926 2.487 146 HG3 LYS 16 HG1 LYS 16 5.182 14.349 4.010 147 HD2 LYS 16 HD2 LYS 16 6.774 15.807 2.791 148 HD3 LYS 16 HD1 LYS 16 7.411 14.168 2.963 149 HE2 LYS 16 HE2 LYS 16 6.654 13.684 0.613 150 HE3 LYS 16 HE1 LYS 16 6.158 15.369 0.457 151 HZ1 LYS 16 HZ1 LYS 16 8.439 16.034 0.791 152 HZ2 LYS 16 HZ2 LYS 16 8.321 14.950 -0.498 153 HZ3 LYS 16 HZ3 LYS 16 8.915 14.422 0.993 154 H GLN 17 HN GLN 17 1.404 12.838 3.895 155 HA GLN 17 HA GLN 17 0.061 14.037 1.619 156 HB2 GLN 17 HB2 GLN 17 -0.659 13.930 4.590 157 HB3 GLN 17 HB1 GLN 17 -1.733 14.518 3.316 158 HG2 GLN 17 HG2 GLN 17 -1.983 12.342 2.377 159 HG3 GLN 17 HG1 GLN 17 -0.609 11.708 3.285 160 HE21 GLN 17 HE21 GLN 17 -3.942 12.760 3.530 161 HE22 GLN 17 HE22 GLN 17 -4.291 11.955 5.018 162 H THR 18 HN THR 18 0.247 16.132 1.068 163 HA THR 18 HA THR 18 1.148 18.190 2.992 164 HB THR 18 HB THR 18 2.343 17.730 0.204 165 HG1 THR 18 HG1 THR 18 3.058 16.904 2.723 166 HG21 THR 18 HG21 THR 18 3.055 19.853 2.266 167 HG22 THR 18 HG22 THR 18 2.260 20.149 0.717 168 HG23 THR 18 HG23 THR 18 3.919 19.551 0.758 169 H ARG 19 HN ARG 19 0.351 20.296 2.446 170 HA ARG 19 HA ARG 19 -1.873 20.330 0.519 171 HB2 ARG 19 HB2 ARG 19 -2.217 20.982 2.942 172 HB3 ARG 19 HB1 ARG 19 -1.204 22.392 2.658 173 HG2 ARG 19 HG2 ARG 19 -2.811 23.300 1.072 174 HG3 ARG 19 HG1 ARG 19 -3.763 21.814 1.122 175 HD2 ARG 19 HD2 ARG 19 -4.851 23.537 2.434 176 HD3 ARG 19 HD1 ARG 19 -4.292 22.240 3.494 177 HE ARG 19 HE ARG 19 -2.901 24.854 3.174 178 HH11 ARG 19 HH11 ARG 19 -3.875 22.187 5.238 179 HH12 ARG 19 HH12 ARG 19 -3.205 22.897 6.671 180 HH21 ARG 19 HH21 ARG 19 -2.041 25.782 5.043 181 HH22 ARG 19 HH22 ARG 19 -2.180 24.964 6.565 182 H ASP 20 HN ASP 20 -2.166 22.469 -0.630 183 HA ASP 20 HA ASP 20 0.392 23.474 -1.765 184 HB2 ASP 20 HB2 ASP 20 -0.796 22.242 -3.463 185 HB3 ASP 20 HB1 ASP 20 -2.329 22.969 -3.038 186 H ILE 21 HN ILE 21 0.227 25.764 -2.534 187 HA ILE 21 HA ILE 21 -0.407 27.514 -0.473 188 HB ILE 21 HB ILE 21 1.334 27.824 -2.244 189 HG12 ILE 21 HG12 ILE 21 -0.550 30.214 -1.879 190 HG13 ILE 21 HG11 ILE 21 0.752 29.744 -0.792 191 HG21 ILE 21 HG21 ILE 21 -0.957 28.682 -4.057 192 HG22 ILE 21 HG22 ILE 21 -0.018 27.198 -4.217 193 HG23 ILE 21 HG23 ILE 21 0.764 28.762 -4.447 194 HD11 ILE 21 HD11 ILE 21 1.043 30.787 -3.609 195 HD12 ILE 21 HD12 ILE 21 2.379 30.220 -2.603 196 HD13 ILE 21 HD13 ILE 21 1.441 31.631 -2.109 197 H THR 22 HN THR 22 -2.737 26.183 -2.640 198 HA THR 22 HA THR 22 -4.544 28.515 -2.397 199 HB THR 22 HB THR 22 -5.729 27.733 -4.425 200 HG1 THR 22 HG1 THR 22 -3.770 25.895 -5.160 201 HG21 THR 22 HG21 THR 22 -2.740 27.941 -5.004 202 HG22 THR 22 HG22 THR 22 -3.833 29.313 -4.803 203 HG23 THR 22 HG23 THR 22 -4.043 28.211 -6.166 204 H GLY 23 HN GLY 23 -4.053 25.047 -2.327 205 HA2 GLY 23 HA2 GLY 23 -4.797 24.114 -0.086 206 HA3 GLY 23 HA1 GLY 23 -6.389 24.701 -0.518 207 H GLU 24 HN GLU 24 -3.968 22.932 -2.488 208 HA GLU 24 HA GLU 24 -5.876 20.776 -2.990 209 HB2 GLU 24 HB2 GLU 24 -3.050 21.185 -4.085 210 HB3 GLU 24 HB1 GLU 24 -4.259 20.052 -4.682 211 HG2 GLU 24 HG2 GLU 24 -4.377 23.078 -4.851 212 HG3 GLU 24 HG1 GLU 24 -4.020 21.968 -6.173 213 H ILE 25 HN ILE 25 -5.226 18.522 -2.525 214 HA ILE 25 HA ILE 25 -3.177 18.292 -0.383 215 HB ILE 25 HB ILE 25 -5.509 16.408 -0.979 216 HG12 ILE 25 HG12 ILE 25 -6.283 18.518 0.041 217 HG13 ILE 25 HG11 ILE 25 -6.414 17.208 1.205 218 HG21 ILE 25 HG21 ILE 25 -3.587 15.132 -0.109 219 HG22 ILE 25 HG22 ILE 25 -4.847 15.232 1.122 220 HG23 ILE 25 HG23 ILE 25 -3.417 16.259 1.242 221 HD11 ILE 25 HD11 ILE 25 -4.291 19.348 1.140 222 HD12 ILE 25 HD12 ILE 25 -4.340 18.000 2.280 223 HD13 ILE 25 HD13 ILE 25 -5.630 19.202 2.281 224 H LEU 26 HN LEU 26 -1.340 17.855 -1.401 225 HA LEU 26 HA LEU 26 -1.055 16.027 -3.636 226 HB2 LEU 26 HB2 LEU 26 1.002 17.649 -2.065 227 HB3 LEU 26 HB1 LEU 26 1.407 16.589 -3.400 228 HG LEU 26 HG LEU 26 -0.046 18.061 -4.891 229 HD11 LEU 26 HD11 LEU 26 -0.528 20.358 -4.159 230 HD12 LEU 26 HD12 LEU 26 0.018 19.962 -2.526 231 HD13 LEU 26 HD13 LEU 26 -1.417 19.176 -3.195 232 HD21 LEU 26 HD21 LEU 26 2.395 18.181 -4.926 233 HD22 LEU 26 HD22 LEU 26 2.378 19.340 -3.594 234 HD23 LEU 26 HD23 LEU 26 1.689 19.780 -5.157 235 H GLU 27 HN GLU 27 -1.426 13.979 -2.934 236 HA GLU 27 HA GLU 27 -0.039 12.867 -0.627 237 HB2 GLU 27 HB2 GLU 27 -1.976 11.678 -2.655 238 HB3 GLU 27 HB1 GLU 27 -1.173 10.721 -1.419 239 HG2 GLU 27 HG2 GLU 27 -2.174 12.250 0.310 240 HG3 GLU 27 HG1 GLU 27 -3.122 12.982 -0.981 241 H THR 28 HN THR 28 2.037 12.461 -0.898 242 HA THR 28 HA THR 28 3.077 11.484 -3.511 243 HB THR 28 HB THR 28 5.293 12.546 -2.774 244 HG1 THR 28 HG1 THR 28 4.320 12.821 -0.507 245 HG21 THR 28 HG21 THR 28 2.946 14.432 -3.256 246 HG22 THR 28 HG22 THR 28 3.870 13.589 -4.504 247 HG23 THR 28 HG23 THR 28 4.650 14.824 -3.512 248 H TRP 29 HN TRP 29 4.659 9.905 -3.465 249 HA TRP 29 HA TRP 29 4.718 8.238 -1.012 250 HB2 TRP 29 HB2 TRP 29 4.718 7.333 -3.935 251 HB3 TRP 29 HB1 TRP 29 4.809 6.269 -2.534 252 HD1 TRP 29 HD1 TRP 29 2.333 8.284 -4.603 253 HE1 TRP 29 HE1 TRP 29 -0.050 7.676 -3.860 254 HE3 TRP 29 HE3 TRP 29 3.456 5.586 -0.407 255 HZ2 TRP 29 HZ2 TRP 29 -1.297 6.249 -1.771 256 HZ3 TRP 29 HZ3 TRP 29 1.611 4.639 0.916 257 HH2 TRP 29 HH2 TRP 29 -0.723 4.965 0.248 258 H GLU 30 HN GLU 30 6.679 8.325 -0.159 259 HA GLU 30 HA GLU 30 9.057 8.406 -1.931 260 HB2 GLU 30 HB2 GLU 30 10.380 8.968 0.177 261 HB3 GLU 30 HB1 GLU 30 9.316 10.219 -0.443 262 HG2 GLU 30 HG2 GLU 30 8.519 8.408 1.839 263 HG3 GLU 30 HG1 GLU 30 9.423 9.900 2.089 264 H ASP 31 HN ASP 31 10.151 6.713 -2.236 265 HA ASP 31 HA ASP 31 9.619 4.120 -1.274 266 HB2 ASP 31 HB2 ASP 31 10.640 4.627 -3.485 267 HB3 ASP 31 HB1 ASP 31 12.080 5.262 -2.699 268 H GLY 32 HN GLY 32 10.551 2.939 0.463 269 HA2 GLY 32 HA2 GLY 32 12.099 4.638 2.360 270 HA3 GLY 32 HA1 GLY 32 10.751 3.619 2.826 271 H HIS 33 HN HIS 33 11.378 1.888 3.895 272 HA HIS 33 HA HIS 33 14.195 1.021 3.712 273 HB2 HIS 33 HB2 HIS 33 12.176 0.780 5.985 274 HB3 HIS 33 HB1 HIS 33 13.818 0.140 6.038 275 HD1 HIS 33 HD1 HIS 33 11.885 3.290 6.399 276 HD2 HIS 33 HD2 HIS 33 15.865 2.120 6.166 277 HE1 HIS 33 HE1 HIS 33 13.219 5.299 7.110 278 HE2 HIS 33 HE2 HIS 33 15.623 4.600 6.858 279 H THR 34 HN THR 34 14.750 -1.048 3.267 280 HA THR 34 HA THR 34 12.609 -2.827 2.338 281 HB THR 34 HB THR 34 15.601 -3.010 1.770 282 HG1 THR 34 HG1 THR 34 14.223 -1.057 1.027 283 HG21 THR 34 HG21 THR 34 14.912 -4.391 -0.152 284 HG22 THR 34 HG22 THR 34 13.215 -4.205 0.300 285 HG23 THR 34 HG23 THR 34 14.316 -5.105 1.346 286 H LEU 35 HN LEU 35 11.932 -4.185 3.971 287 HA LEU 35 HA LEU 35 13.938 -5.536 5.675 288 HB2 LEU 35 HB2 LEU 35 12.119 -6.002 7.272 289 HB3 LEU 35 HB1 LEU 35 12.349 -4.282 7.024 290 HG LEU 35 HG LEU 35 10.161 -5.720 5.492 291 HD11 LEU 35 HD11 LEU 35 8.554 -5.300 7.276 292 HD12 LEU 35 HD12 LEU 35 9.845 -4.721 8.336 293 HD13 LEU 35 HD13 LEU 35 9.815 -6.409 7.814 294 HD21 LEU 35 HD21 LEU 35 9.048 -3.531 5.595 295 HD22 LEU 35 HD22 LEU 35 10.649 -3.393 4.879 296 HD23 LEU 35 HD23 LEU 35 10.388 -2.878 6.544 297 H TRP 36 HN TRP 36 13.238 -7.683 6.444 298 HA TRP 36 HA TRP 36 12.952 -9.496 4.280 299 HB2 TRP 36 HB2 TRP 36 12.709 -10.241 7.215 300 HB3 TRP 36 HB1 TRP 36 13.310 -11.228 5.888 301 HD1 TRP 36 HD1 TRP 36 14.556 -9.248 8.706 302 HE1 TRP 36 HE1 TRP 36 17.041 -8.686 8.452 303 HE3 TRP 36 HE3 TRP 36 15.185 -10.453 3.774 304 HZ2 TRP 36 HZ2 TRP 36 19.022 -8.723 6.449 305 HZ3 TRP 36 HZ3 TRP 36 17.409 -10.156 2.780 306 HH2 TRP 36 HH2 TRP 36 19.293 -9.314 4.083 307 H ALA 37 HN ALA 37 11.176 -10.321 3.427 308 HA ALA 37 HA ALA 37 8.669 -10.699 4.967 309 HB1 ALA 37 HB1 ALA 37 7.343 -9.869 3.061 310 HB2 ALA 37 HB2 ALA 37 8.831 -9.504 2.178 311 HB3 ALA 37 HB3 ALA 37 8.441 -8.622 3.654 312 H SER 38 HN SER 38 7.123 -12.247 3.750 313 HA SER 38 HA SER 38 8.332 -13.686 1.490 314 HB2 SER 38 HB2 SER 38 6.710 -14.891 3.776 315 HB3 SER 38 HB1 SER 38 7.102 -15.740 2.280 316 HG SER 38 HG SER 38 8.570 -16.192 3.977 317 H VAL 39 HN VAL 39 7.193 -13.054 -0.217 318 HA VAL 39 HA VAL 39 4.442 -12.111 0.017 319 HB VAL 39 HB VAL 39 5.862 -10.687 -1.283 320 HG11 VAL 39 HG11 VAL 39 6.609 -13.061 -3.034 321 HG12 VAL 39 HG12 VAL 39 7.666 -12.240 -1.884 322 HG13 VAL 39 HG13 VAL 39 7.095 -11.386 -3.318 323 HG21 VAL 39 HG21 VAL 39 3.571 -10.910 -2.144 324 HG22 VAL 39 HG22 VAL 39 4.074 -12.234 -3.198 325 HG23 VAL 39 HG23 VAL 39 4.698 -10.607 -3.469 326 H ASN 40 HN ASN 40 2.999 -13.765 0.160 327 HA ASN 40 HA ASN 40 2.948 -15.840 -1.936 328 HB2 ASN 40 HB2 ASN 40 1.566 -15.767 0.788 329 HB3 ASN 40 HB1 ASN 40 1.374 -17.044 -0.405 330 HD21 ASN 40 HD21 ASN 40 4.383 -15.436 0.712 331 HD22 ASN 40 HD22 ASN 40 5.083 -16.875 1.345 332 H MET 41 HN MET 41 1.783 -14.819 -3.595 333 HA MET 41 HA MET 41 -0.653 -13.365 -3.227 334 HB2 MET 41 HB2 MET 41 0.236 -14.992 -5.656 335 HB3 MET 41 HB1 MET 41 -1.084 -13.826 -5.634 336 HG2 MET 41 HG2 MET 41 0.527 -12.015 -5.150 337 HG3 MET 41 HG1 MET 41 1.842 -13.188 -5.170 338 HE1 MET 41 HE1 MET 41 -0.717 -11.113 -7.331 339 HE2 MET 41 HE2 MET 41 -1.320 -12.752 -7.571 340 HE3 MET 41 HE3 MET 41 -0.574 -11.881 -8.911 341 H VAL 42 HN VAL 42 -2.704 -14.121 -2.890 342 HA VAL 42 HA VAL 42 -2.965 -16.790 -1.887 343 HB VAL 42 HB VAL 42 -5.242 -16.209 -1.255 344 HG11 VAL 42 HG11 VAL 42 -3.386 -13.858 -0.771 345 HG12 VAL 42 HG12 VAL 42 -3.447 -15.345 0.178 346 HG13 VAL 42 HG13 VAL 42 -4.827 -14.245 0.177 347 HG21 VAL 42 HG21 VAL 42 -6.009 -15.062 -3.274 348 HG22 VAL 42 HG22 VAL 42 -4.941 -13.699 -2.931 349 HG23 VAL 42 HG23 VAL 42 -6.298 -14.048 -1.856 350 H SER 43 HN SER 43 -4.087 -18.490 -2.693 351 HA SER 43 HA SER 43 -4.821 -18.487 -5.537 352 HB2 SER 43 HB2 SER 43 -4.258 -20.782 -3.604 353 HB3 SER 43 HB1 SER 43 -4.644 -20.972 -5.323 354 HG SER 43 HG SER 43 -2.756 -19.353 -5.482 355 H SER 44 HN SER 44 -6.569 -20.479 -5.750 356 HA SER 44 HA SER 44 -9.066 -19.401 -5.284 357 HB2 SER 44 HB2 SER 44 -8.384 -22.344 -5.670 358 HB3 SER 44 HB1 SER 44 -9.954 -21.594 -5.974 359 HG SER 44 HG SER 44 -9.245 -21.092 -7.875 360 H LYS 45 HN LYS 45 -7.169 -21.469 -3.137 361 HA LYS 45 HA LYS 45 -9.028 -22.562 -1.417 362 HB2 LYS 45 HB2 LYS 45 -6.667 -23.109 -1.214 363 HB3 LYS 45 HB1 LYS 45 -6.267 -21.452 -0.789 364 HG2 LYS 45 HG2 LYS 45 -6.176 -22.892 1.185 365 HG3 LYS 45 HG1 LYS 45 -7.458 -21.686 1.355 366 HD2 LYS 45 HD2 LYS 45 -9.088 -23.501 0.546 367 HD3 LYS 45 HD1 LYS 45 -7.760 -24.654 0.725 368 HE2 LYS 45 HE2 LYS 45 -8.895 -22.922 2.952 369 HE3 LYS 45 HE1 LYS 45 -9.294 -24.617 2.686 370 HZ1 LYS 45 HZ1 LYS 45 -6.586 -23.571 3.332 371 HZ2 LYS 45 HZ2 LYS 45 -6.989 -25.196 3.126 372 HZ3 LYS 45 HZ3 LYS 45 -7.631 -24.327 4.423 373 H GLU 46 HN GLU 46 -7.545 -19.332 -1.143 374 HA GLU 46 HA GLU 46 -8.804 -18.636 1.317 375 HB2 GLU 46 HB2 GLU 46 -7.532 -16.866 -0.817 376 HB3 GLU 46 HB1 GLU 46 -7.947 -16.344 0.818 377 HG2 GLU 46 HG2 GLU 46 -5.872 -18.399 0.010 378 HG3 GLU 46 HG1 GLU 46 -5.582 -16.813 0.729 379 H ALA 47 HN ALA 47 -9.613 -17.991 -2.065 380 HA ALA 47 HA ALA 47 -11.741 -16.155 -1.637 381 HB1 ALA 47 HB1 ALA 47 -10.576 -16.361 -3.794 382 HB2 ALA 47 HB2 ALA 47 -12.312 -16.618 -4.003 383 HB3 ALA 47 HB3 ALA 47 -11.203 -17.996 -3.998 384 H ILE 48 HN ILE 48 -11.709 -19.673 -2.244 385 HA ILE 48 HA ILE 48 -14.512 -20.112 -2.132 386 HB ILE 48 HB ILE 48 -12.246 -22.112 -1.674 387 HG12 ILE 48 HG12 ILE 48 -13.810 -21.591 -4.243 388 HG13 ILE 48 HG11 ILE 48 -12.222 -20.910 -3.916 389 HG21 ILE 48 HG21 ILE 48 -14.377 -23.019 -0.817 390 HG22 ILE 48 HG22 ILE 48 -13.883 -23.875 -2.275 391 HG23 ILE 48 HG23 ILE 48 -15.165 -22.667 -2.360 392 HD11 ILE 48 HD11 ILE 48 -12.086 -22.849 -5.365 393 HD12 ILE 48 HD12 ILE 48 -12.863 -23.850 -4.141 394 HD13 ILE 48 HD13 ILE 48 -11.267 -23.158 -3.836 395 H SER 49 HN SER 49 -11.970 -20.363 0.332 396 HA SER 49 HA SER 49 -13.580 -21.532 2.377 397 HB2 SER 49 HB2 SER 49 -11.086 -21.696 2.311 398 HB3 SER 49 HB1 SER 49 -10.975 -19.976 2.678 399 HG SER 49 HG SER 49 -11.879 -20.354 4.671 400 H SER 50 HN SER 50 -12.897 -18.200 1.440 401 HA SER 50 HA SER 50 -14.380 -17.056 3.704 402 HB2 SER 50 HB2 SER 50 -13.699 -14.883 2.784 403 HB3 SER 50 HB1 SER 50 -12.292 -15.953 2.823 404 HG SER 50 HG SER 50 -12.728 -16.398 0.582 405 H GLY 51 HN GLY 51 -15.096 -18.317 0.633 406 HA2 GLY 51 HA2 GLY 51 -17.187 -18.563 -0.364 407 HA3 GLY 51 HA1 GLY 51 -17.842 -17.295 0.664 408 H ALA 52 HN ALA 52 -17.013 -15.061 0.203 409 HA ALA 52 HA ALA 52 -15.979 -14.499 -2.475 410 HB1 ALA 52 HB1 ALA 52 -17.873 -13.018 -3.072 411 HB2 ALA 52 HB2 ALA 52 -18.707 -13.480 -1.582 412 HB3 ALA 52 HB3 ALA 52 -18.411 -14.683 -2.837 413 H GLU 53 HN GLU 53 -15.651 -14.027 0.656 414 HA GLU 53 HA GLU 53 -15.595 -11.144 0.883 415 HB2 GLU 53 HB2 GLU 53 -14.517 -13.284 2.773 416 HB3 GLU 53 HB1 GLU 53 -14.668 -11.564 3.147 417 HG2 GLU 53 HG2 GLU 53 -17.124 -11.734 2.859 418 HG3 GLU 53 HG1 GLU 53 -16.956 -13.459 2.529 419 H LEU 54 HN LEU 54 -13.277 -13.693 0.239 420 HA LEU 54 HA LEU 54 -11.185 -11.683 -0.351 421 HB2 LEU 54 HB2 LEU 54 -10.847 -14.672 0.175 422 HB3 LEU 54 HB1 LEU 54 -9.547 -13.549 -0.212 423 HG LEU 54 HG LEU 54 -11.234 -13.557 2.328 424 HD11 LEU 54 HD11 LEU 54 -9.609 -15.379 2.263 425 HD12 LEU 54 HD12 LEU 54 -9.129 -14.177 3.461 426 HD13 LEU 54 HD13 LEU 54 -8.304 -14.241 1.898 427 HD21 LEU 54 HD21 LEU 54 -8.967 -11.674 1.561 428 HD22 LEU 54 HD22 LEU 54 -9.723 -11.761 3.155 429 HD23 LEU 54 HD23 LEU 54 -10.670 -11.246 1.763 430 H ALA 55 HN ALA 55 -9.743 -12.483 -2.188 431 HA ALA 55 HA ALA 55 -11.144 -13.871 -4.363 432 HB1 ALA 55 HB1 ALA 55 -11.819 -11.504 -4.618 433 HB2 ALA 55 HB2 ALA 55 -10.777 -12.003 -5.946 434 HB3 ALA 55 HB3 ALA 55 -10.117 -11.007 -4.648 435 H ILE 56 HN ILE 56 -9.738 -14.649 -5.967 436 HA ILE 56 HA ILE 56 -7.138 -15.417 -5.161 437 HB ILE 56 HB ILE 56 -8.195 -15.417 -8.032 438 HG12 ILE 56 HG12 ILE 56 -8.541 -17.619 -5.956 439 HG13 ILE 56 HG11 ILE 56 -9.821 -16.529 -6.477 440 HG21 ILE 56 HG21 ILE 56 -6.675 -17.327 -8.400 441 HG22 ILE 56 HG22 ILE 56 -6.101 -17.215 -6.735 442 HG23 ILE 56 HG23 ILE 56 -5.778 -15.904 -7.871 443 HD11 ILE 56 HD11 ILE 56 -9.649 -17.453 -8.761 444 HD12 ILE 56 HD12 ILE 56 -10.026 -18.688 -7.560 445 HD13 ILE 56 HD13 ILE 56 -8.391 -18.559 -8.202 446 H GLY 57 HN GLY 57 -5.103 -14.679 -5.776 447 HA2 GLY 57 HA2 GLY 57 -3.512 -13.475 -7.002 448 HA3 GLY 57 HA1 GLY 57 -4.779 -12.473 -7.692 449 H THR 58 HN THR 58 -5.697 -12.343 -4.650 450 HA THR 58 HA THR 58 -4.639 -9.813 -3.997 451 HB THR 58 HB THR 58 -6.016 -11.900 -2.270 452 HG1 THR 58 HG1 THR 58 -7.520 -11.099 -3.565 453 HG21 THR 58 HG21 THR 58 -5.308 -9.045 -1.488 454 HG22 THR 58 HG22 THR 58 -4.700 -10.526 -0.740 455 HG23 THR 58 HG23 THR 58 -6.405 -10.106 -0.595 456 H VAL 59 HN VAL 59 -2.693 -9.316 -3.336 457 HA VAL 59 HA VAL 59 -0.696 -11.337 -2.940 458 HB VAL 59 HB VAL 59 -0.438 -8.302 -2.812 459 HG11 VAL 59 HG11 VAL 59 1.960 -8.744 -3.341 460 HG12 VAL 59 HG12 VAL 59 1.658 -10.476 -3.196 461 HG13 VAL 59 HG13 VAL 59 1.472 -9.424 -1.791 462 HG21 VAL 59 HG21 VAL 59 -0.083 -10.159 -5.207 463 HG22 VAL 59 HG22 VAL 59 0.255 -8.426 -5.193 464 HG23 VAL 59 HG23 VAL 59 -1.399 -8.999 -4.977 465 H ARG 60 HN ARG 60 -0.775 -12.311 -0.971 466 HA ARG 60 HA ARG 60 -0.956 -10.742 1.510 467 HB2 ARG 60 HB2 ARG 60 -2.273 -12.845 1.236 468 HB3 ARG 60 HB1 ARG 60 -0.775 -13.753 1.059 469 HG2 ARG 60 HG2 ARG 60 -0.152 -13.278 3.354 470 HG3 ARG 60 HG1 ARG 60 -1.536 -12.195 3.549 471 HD2 ARG 60 HD2 ARG 60 -1.674 -15.189 3.029 472 HD3 ARG 60 HD1 ARG 60 -1.977 -14.387 4.575 473 HE ARG 60 HE ARG 60 -3.714 -13.230 2.748 474 HH11 ARG 60 HH11 ARG 60 -3.254 -16.434 4.112 475 HH12 ARG 60 HH12 ARG 60 -4.907 -16.894 3.863 476 HH21 ARG 60 HH21 ARG 60 -5.851 -13.858 2.421 477 HH22 ARG 60 HH22 ARG 60 -6.379 -15.437 2.907 478 H ILE 61 HN ILE 61 0.798 -10.643 2.975 479 HA ILE 61 HA ILE 61 3.485 -11.371 2.026 480 HB ILE 61 HB ILE 61 2.644 -8.451 2.478 481 HG12 ILE 61 HG12 ILE 61 3.651 -9.778 -0.085 482 HG13 ILE 61 HG11 ILE 61 1.963 -9.428 0.245 483 HG21 ILE 61 HG21 ILE 61 4.908 -8.831 3.355 484 HG22 ILE 61 HG22 ILE 61 4.984 -7.867 1.880 485 HG23 ILE 61 HG23 ILE 61 5.396 -9.582 1.829 486 HD11 ILE 61 HD11 ILE 61 4.168 -7.416 -0.090 487 HD12 ILE 61 HD12 ILE 61 2.488 -7.034 0.286 488 HD13 ILE 61 HD13 ILE 61 2.899 -7.799 -1.250 489 H TRP 62 HN TRP 62 4.223 -12.366 3.802 490 HA TRP 62 HA TRP 62 3.470 -11.507 6.516 491 HB2 TRP 62 HB2 TRP 62 4.917 -13.977 5.453 492 HB3 TRP 62 HB1 TRP 62 4.724 -13.645 7.170 493 HD1 TRP 62 HD1 TRP 62 1.790 -13.127 4.690 494 HE1 TRP 62 HE1 TRP 62 -0.046 -14.829 5.286 495 HE3 TRP 62 HE3 TRP 62 4.307 -15.875 8.171 496 HZ2 TRP 62 HZ2 TRP 62 -0.376 -17.062 6.993 497 HZ3 TRP 62 HZ3 TRP 62 3.176 -17.775 9.237 498 HH2 TRP 62 HH2 TRP 62 0.875 -18.370 8.654 499 H ILE 63 HN ILE 63 4.835 -10.331 7.775 500 HA ILE 63 HA ILE 63 7.697 -10.051 7.040 501 HB ILE 63 HB ILE 63 7.628 -7.629 7.462 502 HG12 ILE 63 HG12 ILE 63 4.585 -7.801 7.651 503 HG13 ILE 63 HG11 ILE 63 5.626 -7.704 9.064 504 HG21 ILE 63 HG21 ILE 63 7.326 -8.315 5.166 505 HG22 ILE 63 HG22 ILE 63 6.333 -6.892 5.478 506 HG23 ILE 63 HG23 ILE 63 5.582 -8.489 5.395 507 HD11 ILE 63 HD11 ILE 63 4.706 -5.551 8.523 508 HD12 ILE 63 HD12 ILE 63 5.370 -5.637 6.893 509 HD13 ILE 63 HD13 ILE 63 6.453 -5.529 8.283 510 H ARG 64 HN ARG 64 9.035 -9.255 8.841 511 HA ARG 64 HA ARG 64 8.602 -10.027 11.448 512 HB2 ARG 64 HB2 ARG 64 10.033 -7.449 10.644 513 HB3 ARG 64 HB1 ARG 64 10.248 -8.327 12.159 514 HG2 ARG 64 HG2 ARG 64 10.993 -9.334 9.399 515 HG3 ARG 64 HG1 ARG 64 12.113 -8.708 10.609 516 HD2 ARG 64 HD2 ARG 64 10.461 -11.257 10.787 517 HD3 ARG 64 HD1 ARG 64 12.210 -11.143 10.606 518 HE ARG 64 HE ARG 64 10.635 -10.691 13.025 519 HH11 ARG 64 HH11 ARG 64 13.850 -10.552 11.590 520 HH12 ARG 64 HH12 ARG 64 14.655 -10.722 13.114 521 HH21 ARG 64 HH21 ARG 64 11.714 -10.917 14.997 522 HH22 ARG 64 HH22 ARG 64 13.446 -10.924 15.044 523 H TYR 65 HN TYR 65 7.831 -9.008 13.351 524 HA TYR 65 HA TYR 65 5.516 -7.404 13.253 525 HB2 TYR 65 HB2 TYR 65 6.109 -8.913 15.158 526 HB3 TYR 65 HB1 TYR 65 7.416 -7.832 15.612 527 HD1 TYR 65 HD2 TYR 65 3.766 -8.318 15.595 528 HD2 TYR 65 HD1 TYR 65 6.902 -5.635 16.738 529 HE1 TYR 65 HE2 TYR 65 2.198 -7.072 17.008 530 HE2 TYR 65 HE1 TYR 65 5.331 -4.412 18.167 531 HH TYR 65 HH TYR 65 2.943 -4.044 18.401 532 H ARG 66 HN ARG 66 5.523 -5.366 12.481 533 HA ARG 66 HA ARG 66 7.668 -3.492 13.296 534 HB2 ARG 66 HB2 ARG 66 7.955 -4.395 10.916 535 HB3 ARG 66 HB1 ARG 66 6.448 -3.588 10.499 536 HG2 ARG 66 HG2 ARG 66 7.441 -1.399 11.042 537 HG3 ARG 66 HG1 ARG 66 8.949 -2.183 11.526 538 HD2 ARG 66 HD2 ARG 66 9.168 -3.068 9.188 539 HD3 ARG 66 HD1 ARG 66 7.731 -2.146 8.739 540 HE ARG 66 HE ARG 66 10.329 -0.999 9.589 541 HH11 ARG 66 HH11 ARG 66 7.252 -0.539 7.955 542 HH12 ARG 66 HH12 ARG 66 7.726 0.960 7.232 543 HH21 ARG 66 HH21 ARG 66 10.946 0.939 8.621 544 HH22 ARG 66 HH22 ARG 66 9.828 1.802 7.608 545 H LYS 67 HN LYS 67 6.847 -1.828 14.320 546 HA LYS 67 HA LYS 67 4.032 -1.343 14.615 547 HB2 LYS 67 HB2 LYS 67 6.440 0.213 15.663 548 HB3 LYS 67 HB1 LYS 67 4.776 0.420 16.209 549 HG2 LYS 67 HG2 LYS 67 4.762 -1.865 17.104 550 HG3 LYS 67 HG1 LYS 67 6.410 -2.124 16.521 551 HD2 LYS 67 HD2 LYS 67 7.257 -0.395 18.034 552 HD3 LYS 67 HD1 LYS 67 5.615 0.007 18.549 553 HE2 LYS 67 HE2 LYS 67 6.716 -1.366 20.249 554 HE3 LYS 67 HE1 LYS 67 5.384 -2.266 19.524 555 HZ1 LYS 67 HZ1 LYS 67 8.269 -2.588 18.883 556 HZ2 LYS 67 HZ2 LYS 67 7.007 -3.422 18.127 557 HZ3 LYS 67 HZ3 LYS 67 7.311 -3.657 19.775 558 H ASP 68 HN ASP 68 6.062 -0.418 12.178 559 HA ASP 68 HA ASP 68 5.279 2.395 11.923 560 HB2 ASP 68 HB2 ASP 68 7.148 0.682 10.212 561 HB3 ASP 68 HB1 ASP 68 6.951 2.430 10.087 562 H ILE 69 HN ILE 69 4.351 -0.697 10.685 563 HA ILE 69 HA ILE 69 3.598 0.109 8.033 564 HB ILE 69 HB ILE 69 2.699 -2.396 9.530 565 HG12 ILE 69 HG12 ILE 69 5.202 -2.205 9.389 566 HG13 ILE 69 HG11 ILE 69 4.568 -3.564 8.475 567 HG21 ILE 69 HG21 ILE 69 2.717 -1.746 6.546 568 HG22 ILE 69 HG22 ILE 69 1.290 -1.910 7.570 569 HG23 ILE 69 HG23 ILE 69 2.299 -3.314 7.240 570 HD11 ILE 69 HD11 ILE 69 4.848 -2.314 6.402 571 HD12 ILE 69 HD12 ILE 69 6.360 -2.436 7.299 572 HD13 ILE 69 HD13 ILE 69 5.452 -0.926 7.314 573 H ASN 70 HN ASN 70 1.721 0.902 7.332 574 HA ASN 70 HA ASN 70 -0.760 0.711 8.885 575 HB2 ASN 70 HB2 ASN 70 0.549 2.935 9.385 576 HB3 ASN 70 HB1 ASN 70 0.129 3.404 7.741 577 HD21 ASN 70 HD21 ASN 70 -2.043 3.877 7.266 578 HD22 ASN 70 HD22 ASN 70 -3.227 4.123 8.494 579 H ALA 71 HN ALA 71 -2.653 1.323 7.470 580 HA ALA 71 HA ALA 71 -2.581 0.007 4.998 581 HB1 ALA 71 HB1 ALA 71 -4.898 0.806 4.710 582 HB2 ALA 71 HB2 ALA 71 -4.661 1.969 6.019 583 HB3 ALA 71 HB3 ALA 71 -4.624 0.239 6.361 584 H THR 72 HN THR 72 -2.050 3.328 5.824 585 HA THR 72 HA THR 72 -2.273 4.450 3.181 586 HB THR 72 HB THR 72 -1.295 6.513 4.338 587 HG1 THR 72 HG1 THR 72 -1.189 6.329 6.678 588 HG21 THR 72 HG21 THR 72 -3.757 6.194 4.174 589 HG22 THR 72 HG22 THR 72 -3.311 6.972 5.691 590 HG23 THR 72 HG23 THR 72 -3.736 5.262 5.678 591 H SER 73 HN SER 73 -0.094 2.294 4.076 592 HA SER 73 HA SER 73 2.178 3.585 2.678 593 HB2 SER 73 HB2 SER 73 2.205 1.075 4.432 594 HB3 SER 73 HB1 SER 73 3.608 1.922 3.765 595 HG SER 73 HG SER 73 1.931 3.527 5.244 596 H ARG 74 HN ARG 74 3.367 2.042 1.216 597 HA ARG 74 HA ARG 74 1.677 -0.095 0.063 598 HB2 ARG 74 HB2 ARG 74 3.700 1.602 -1.464 599 HB3 ARG 74 HB1 ARG 74 2.697 0.312 -2.132 600 HG2 ARG 74 HG2 ARG 74 0.671 1.667 -1.627 601 HG3 ARG 74 HG1 ARG 74 1.710 2.963 -1.032 602 HD2 ARG 74 HD2 ARG 74 1.511 1.909 -3.869 603 HD3 ARG 74 HD1 ARG 74 1.044 3.508 -3.280 604 HE ARG 74 HE ARG 74 3.850 2.883 -2.927 605 HH11 ARG 74 HH11 ARG 74 1.496 4.331 -5.071 606 HH12 ARG 74 HH12 ARG 74 2.693 5.152 -6.019 607 HH21 ARG 74 HH21 ARG 74 5.402 3.947 -4.176 608 HH22 ARG 74 HH22 ARG 74 4.907 4.925 -5.520 609 H ILE 75 HN ILE 75 2.767 -1.926 -0.591 610 HA ILE 75 HA ILE 75 5.418 -2.418 0.616 611 HB ILE 75 HB ILE 75 3.247 -4.480 -0.023 612 HG12 ILE 75 HG12 ILE 75 2.353 -2.912 1.704 613 HG13 ILE 75 HG11 ILE 75 2.604 -4.523 2.357 614 HG21 ILE 75 HG21 ILE 75 5.737 -4.660 1.686 615 HG22 ILE 75 HG22 ILE 75 5.487 -5.409 0.109 616 HG23 ILE 75 HG23 ILE 75 4.537 -5.938 1.500 617 HD11 ILE 75 HD11 ILE 75 4.653 -3.752 3.447 618 HD12 ILE 75 HD12 ILE 75 3.241 -2.819 3.941 619 HD13 ILE 75 HD13 ILE 75 4.386 -2.133 2.789 620 H LYS 76 HN LYS 76 6.770 -2.056 -1.184 621 HA LYS 76 HA LYS 76 6.155 -3.250 -3.796 622 HB2 LYS 76 HB2 LYS 76 7.174 -0.990 -3.684 623 HB3 LYS 76 HB1 LYS 76 8.578 -1.655 -2.855 624 HG2 LYS 76 HG2 LYS 76 9.031 -3.058 -4.909 625 HG3 LYS 76 HG1 LYS 76 7.709 -2.207 -5.715 626 HD2 LYS 76 HD2 LYS 76 9.825 -1.207 -6.358 627 HD3 LYS 76 HD1 LYS 76 8.918 -0.055 -5.375 628 HE2 LYS 76 HE2 LYS 76 10.311 -0.595 -3.418 629 HE3 LYS 76 HE1 LYS 76 11.172 -1.827 -4.339 630 HZ1 LYS 76 HZ1 LYS 76 12.457 0.142 -4.225 631 HZ2 LYS 76 HZ2 LYS 76 11.188 1.089 -4.806 632 HZ3 LYS 76 HZ3 LYS 76 11.932 -0.042 -5.824 633 H VAL 77 HN VAL 77 6.774 -5.313 -4.231 634 HA VAL 77 HA VAL 77 8.599 -6.758 -2.511 635 HB VAL 77 HB VAL 77 7.095 -7.555 -5.035 636 HG11 VAL 77 HG11 VAL 77 7.777 -9.903 -4.605 637 HG12 VAL 77 HG12 VAL 77 8.840 -9.356 -3.309 638 HG13 VAL 77 HG13 VAL 77 9.174 -8.889 -4.976 639 HG21 VAL 77 HG21 VAL 77 5.733 -7.208 -2.981 640 HG22 VAL 77 HG22 VAL 77 6.723 -8.395 -2.131 641 HG23 VAL 77 HG23 VAL 77 5.721 -8.897 -3.495 642 H SER 78 HN SER 78 10.692 -6.736 -2.705 643 HA SER 78 HA SER 78 12.093 -5.600 -4.975 644 HB2 SER 78 HB2 SER 78 13.162 -6.724 -2.347 645 HB3 SER 78 HB1 SER 78 14.079 -5.765 -3.512 646 HG SER 78 HG SER 78 12.050 -4.280 -3.048 647 H THR 79 HN THR 79 11.434 -8.779 -3.661 648 HA THR 79 HA THR 79 12.995 -10.106 -5.768 649 HB THR 79 HB THR 79 13.840 -11.800 -4.066 650 HG1 THR 79 HG1 THR 79 12.426 -11.246 -2.363 651 HG21 THR 79 HG21 THR 79 14.890 -8.986 -3.658 652 HG22 THR 79 HG22 THR 79 15.391 -10.092 -4.938 653 HG23 THR 79 HG23 THR 79 15.744 -10.475 -3.253 654 H GLY 80 HN GLY 80 11.705 -11.622 -6.696 655 HA2 GLY 80 HA2 GLY 80 10.529 -13.794 -5.939 656 HA3 GLY 80 HA1 GLY 80 9.384 -12.698 -5.186 657 HA PRO 81 HA PRO 81 7.725 -13.672 -9.443 658 HB2 PRO 81 HB2 PRO 81 5.121 -13.982 -8.689 659 HB3 PRO 81 HB1 PRO 81 6.310 -15.281 -8.515 660 HG2 PRO 81 HG2 PRO 81 5.347 -13.311 -6.426 661 HG3 PRO 81 HG1 PRO 81 5.517 -15.075 -6.287 662 HD2 PRO 81 HD2 PRO 81 7.405 -13.391 -5.325 663 HD3 PRO 81 HD1 PRO 81 7.843 -14.963 -6.041 664 H LEU 82 HN LEU 82 7.194 -11.237 -7.082 665 HA LEU 82 HA LEU 82 5.897 -9.423 -9.037 666 HB2 LEU 82 HB2 LEU 82 5.666 -9.346 -6.001 667 HB3 LEU 82 HB1 LEU 82 4.842 -8.288 -7.141 668 HG LEU 82 HG LEU 82 4.345 -11.279 -6.818 669 HD11 LEU 82 HD11 LEU 82 2.632 -8.917 -6.018 670 HD12 LEU 82 HD12 LEU 82 3.522 -9.982 -4.930 671 HD13 LEU 82 HD13 LEU 82 2.188 -10.620 -5.885 672 HD21 LEU 82 HD21 LEU 82 2.899 -9.286 -8.608 673 HD22 LEU 82 HD22 LEU 82 2.450 -10.978 -8.362 674 HD23 LEU 82 HD23 LEU 82 3.975 -10.579 -9.148 675 H ALA 83 HN ALA 83 8.785 -10.023 -8.455 676 HA ALA 83 HA ALA 83 10.031 -7.906 -7.055 677 HB1 ALA 83 HB1 ALA 83 12.078 -8.599 -8.232 678 HB2 ALA 83 HB2 ALA 83 11.120 -9.571 -9.353 679 HB3 ALA 83 HB3 ALA 83 11.183 -10.002 -7.642 680 H GLY 84 HN GLY 84 9.829 -5.806 -7.522 681 HA2 GLY 84 HA2 GLY 84 10.379 -3.896 -8.843 682 HA3 GLY 84 HA1 GLY 84 10.070 -4.823 -10.302 683 H ARG 85 HN ARG 85 7.620 -5.514 -8.130 684 HA ARG 85 HA ARG 85 5.791 -3.495 -9.288 685 HB2 ARG 85 HB2 ARG 85 5.060 -6.143 -7.950 686 HB3 ARG 85 HB1 ARG 85 3.956 -5.029 -8.759 687 HG2 ARG 85 HG2 ARG 85 5.191 -5.473 -10.911 688 HG3 ARG 85 HG1 ARG 85 6.138 -6.697 -10.058 689 HD2 ARG 85 HD2 ARG 85 3.880 -7.795 -9.471 690 HD3 ARG 85 HD1 ARG 85 3.168 -6.706 -10.671 691 HE ARG 85 HE ARG 85 5.353 -8.026 -11.841 692 HH11 ARG 85 HH11 ARG 85 2.069 -8.744 -10.842 693 HH12 ARG 85 HH12 ARG 85 1.957 -10.153 -11.846 694 HH21 ARG 85 HH21 ARG 85 5.191 -9.854 -13.145 695 HH22 ARG 85 HH22 ARG 85 3.723 -10.785 -13.154 696 H VAL 86 HN VAL 86 4.621 -2.159 -7.936 697 HA VAL 86 HA VAL 86 5.216 -2.297 -5.050 698 HB VAL 86 HB VAL 86 6.008 -0.218 -6.026 699 HG11 VAL 86 HG11 VAL 86 3.164 0.385 -6.906 700 HG12 VAL 86 HG12 VAL 86 4.509 -0.019 -7.970 701 HG13 VAL 86 HG13 VAL 86 4.542 1.482 -7.043 702 HG21 VAL 86 HG21 VAL 86 5.190 -0.121 -3.707 703 HG22 VAL 86 HG22 VAL 86 3.568 0.279 -4.275 704 HG23 VAL 86 HG23 VAL 86 4.895 1.414 -4.528 705 H LEU 87 HN LEU 87 3.763 -3.409 -4.090 706 HA LEU 87 HA LEU 87 1.007 -3.646 -4.999 707 HB2 LEU 87 HB2 LEU 87 2.336 -4.955 -2.576 708 HB3 LEU 87 HB1 LEU 87 0.781 -5.379 -3.266 709 HG LEU 87 HG LEU 87 2.324 -7.083 -3.889 710 HD11 LEU 87 HD11 LEU 87 1.921 -5.355 -6.328 711 HD12 LEU 87 HD12 LEU 87 0.773 -6.509 -5.649 712 HD13 LEU 87 HD13 LEU 87 2.298 -7.084 -6.317 713 HD21 LEU 87 HD21 LEU 87 4.437 -5.925 -3.529 714 HD22 LEU 87 HD22 LEU 87 4.213 -5.020 -5.029 715 HD23 LEU 87 HD23 LEU 87 4.411 -6.775 -5.073 716 H ASN 88 HN ASN 88 -0.748 -2.695 -4.030 717 HA ASN 88 HA ASN 88 -0.258 -0.770 -1.832 718 HB2 ASN 88 HB2 ASN 88 -2.488 -0.938 -3.908 719 HB3 ASN 88 HB1 ASN 88 -2.523 0.177 -2.549 720 HD21 ASN 88 HD21 ASN 88 0.360 -0.640 -4.475 721 HD22 ASN 88 HD22 ASN 88 0.554 0.934 -5.134 722 H ILE 89 HN ILE 89 -1.712 -0.710 -0.011 723 HA ILE 89 HA ILE 89 -2.365 -3.438 0.822 724 HB ILE 89 HB ILE 89 -2.385 -0.827 2.422 725 HG12 ILE 89 HG12 ILE 89 -0.290 -3.044 2.336 726 HG13 ILE 89 HG11 ILE 89 -0.117 -1.455 1.597 727 HG21 ILE 89 HG21 ILE 89 -2.467 -2.246 4.461 728 HG22 ILE 89 HG22 ILE 89 -2.585 -3.693 3.457 729 HG23 ILE 89 HG23 ILE 89 -3.893 -2.506 3.449 730 HD11 ILE 89 HD11 ILE 89 -0.184 -0.417 3.828 731 HD12 ILE 89 HD12 ILE 89 1.123 -1.592 3.682 732 HD13 ILE 89 HD13 ILE 89 -0.343 -2.015 4.563 733 H ILE 90 HN ILE 90 -4.429 -4.123 1.409 734 HA ILE 90 HA ILE 90 -6.694 -2.273 0.957 735 HB ILE 90 HB ILE 90 -8.003 -4.524 0.376 736 HG12 ILE 90 HG12 ILE 90 -5.163 -5.244 -0.509 737 HG13 ILE 90 HG11 ILE 90 -6.061 -6.057 0.763 738 HG21 ILE 90 HG21 ILE 90 -7.656 -4.085 -2.026 739 HG22 ILE 90 HG22 ILE 90 -6.236 -3.114 -1.646 740 HG23 ILE 90 HG23 ILE 90 -7.829 -2.584 -1.111 741 HD11 ILE 90 HD11 ILE 90 -7.699 -6.818 -0.909 742 HD12 ILE 90 HD12 ILE 90 -6.060 -7.356 -1.270 743 HD13 ILE 90 HD13 ILE 90 -6.760 -6.013 -2.168 744 H GLY 91 HN GLY 91 -7.320 -1.760 2.928 745 HA2 GLY 91 HA2 GLY 91 -8.810 -2.299 4.733 746 HA3 GLY 91 HA1 GLY 91 -8.086 -3.900 4.834 747 H GLN 92 HN GLN 92 -6.376 -4.203 6.208 748 HA GLN 92 HA GLN 92 -4.869 -1.964 7.341 749 HB2 GLN 92 HB2 GLN 92 -5.412 -2.617 9.687 750 HB3 GLN 92 HB1 GLN 92 -6.834 -2.054 8.823 751 HG2 GLN 92 HG2 GLN 92 -7.629 -4.334 8.532 752 HG3 GLN 92 HG1 GLN 92 -6.145 -4.972 9.233 753 HE21 GLN 92 HE21 GLN 92 -8.975 -5.321 10.069 754 HE22 GLN 92 HE22 GLN 92 -9.007 -4.841 11.731 755 HA PRO 93 HA PRO 93 -1.742 -5.312 7.651 756 HB2 PRO 93 HB2 PRO 93 -0.199 -4.242 9.697 757 HB3 PRO 93 HB1 PRO 93 -0.064 -3.767 7.996 758 HG2 PRO 93 HG2 PRO 93 -1.590 -2.415 10.223 759 HG3 PRO 93 HG1 PRO 93 -0.521 -1.683 9.003 760 HD2 PRO 93 HD2 PRO 93 -3.190 -1.589 8.715 761 HD3 PRO 93 HD1 PRO 93 -2.142 -1.863 7.305 762 H LEU 94 HN LEU 94 -2.186 -7.189 8.651 763 HA LEU 94 HA LEU 94 -3.718 -7.301 11.148 764 HB2 LEU 94 HB2 LEU 94 -4.345 -8.643 9.094 765 HB3 LEU 94 HB1 LEU 94 -2.862 -9.552 9.257 766 HG LEU 94 HG LEU 94 -5.031 -10.686 10.011 767 HD11 LEU 94 HD11 LEU 94 -4.052 -11.864 11.883 768 HD12 LEU 94 HD12 LEU 94 -2.820 -10.613 12.070 769 HD13 LEU 94 HD13 LEU 94 -2.857 -11.610 10.612 770 HD21 LEU 94 HD21 LEU 94 -6.046 -8.794 11.174 771 HD22 LEU 94 HD22 LEU 94 -4.778 -8.842 12.404 772 HD23 LEU 94 HD23 LEU 94 -5.905 -10.194 12.237 773 HA PRO 95 HA PRO 95 0.285 -8.336 13.220 774 HB2 PRO 95 HB2 PRO 95 -0.505 -7.898 15.781 775 HB3 PRO 95 HB1 PRO 95 -0.101 -6.565 14.686 776 HG2 PRO 95 HG2 PRO 95 -2.825 -7.611 15.462 777 HG3 PRO 95 HG1 PRO 95 -2.279 -5.927 15.295 778 HD2 PRO 95 HD2 PRO 95 -3.688 -7.274 13.329 779 HD3 PRO 95 HD1 PRO 95 -2.573 -5.933 12.993 780 H ASP 96 HN ASP 96 0.824 -10.389 13.545 781 HA ASP 96 HA ASP 96 -0.810 -12.608 13.624 782 HB2 ASP 96 HB2 ASP 96 1.499 -12.778 13.050 783 HB3 ASP 96 HB1 ASP 96 2.026 -12.165 14.607 784 H ALA 97 HN ALA 97 -1.425 -14.103 15.269 785 HA ALA 97 HA ALA 97 -2.619 -13.070 17.565 786 HB1 ALA 97 HB1 ALA 97 -1.814 -15.946 17.006 787 HB2 ALA 97 HB2 ALA 97 -3.297 -15.162 16.460 788 HB3 ALA 97 HB3 ALA 97 -3.025 -15.416 18.182 789 H ALA 98 HN ALA 98 0.486 -14.794 17.251 790 HA ALA 98 HA ALA 98 1.168 -14.463 20.084 791 HB1 ALA 98 HB1 ALA 98 1.707 -16.598 18.942 792 HB2 ALA 98 HB2 ALA 98 3.164 -15.798 19.539 793 HB3 ALA 98 HB3 ALA 98 2.758 -15.726 17.821 794 H ARG 99 HN ARG 99 1.250 -12.481 17.460 795 HA ARG 99 HA ARG 99 2.210 -10.527 16.876 796 HB2 ARG 99 HB2 ARG 99 3.257 -10.564 19.731 797 HB3 ARG 99 HB1 ARG 99 3.332 -9.160 18.670 798 HG2 ARG 99 HG2 ARG 99 0.813 -10.497 19.723 799 HG3 ARG 99 HG1 ARG 99 1.482 -8.951 20.253 800 HD2 ARG 99 HD2 ARG 99 1.127 -8.082 17.920 801 HD3 ARG 99 HD1 ARG 99 0.325 -9.599 17.519 802 HE ARG 99 HE ARG 99 -0.640 -7.669 19.545 803 HH11 ARG 99 HH11 ARG 99 -1.388 -9.981 17.006 804 HH12 ARG 99 HH12 ARG 99 -3.095 -9.730 17.146 805 HH21 ARG 99 HH21 ARG 99 -2.842 -7.371 19.705 806 HH22 ARG 99 HH22 ARG 99 -3.915 -8.247 18.666 807 H THR 100 HN THR 100 3.675 -13.049 16.433 808 HA THR 100 HA THR 100 6.511 -12.491 16.688 809 HB THR 100 HB THR 100 6.802 -14.641 15.450 810 HG1 THR 100 HG1 THR 100 4.067 -15.157 15.482 811 HG21 THR 100 HG21 THR 100 6.439 -14.752 17.897 812 HG22 THR 100 HG22 THR 100 5.708 -16.139 17.087 813 HG23 THR 100 HG23 THR 100 4.691 -14.806 17.636 814 H ARG 101 HN ARG 101 4.110 -11.482 14.538 815 HA ARG 101 HA ARG 101 5.911 -10.475 12.541 816 HB2 ARG 101 HB2 ARG 101 5.434 -11.939 10.716 817 HB3 ARG 101 HB1 ARG 101 5.639 -13.049 12.063 818 HG2 ARG 101 HG2 ARG 101 3.001 -12.736 12.233 819 HG3 ARG 101 HG1 ARG 101 3.163 -12.312 10.536 820 HD2 ARG 101 HD2 ARG 101 2.624 -14.621 10.686 821 HD3 ARG 101 HD1 ARG 101 4.322 -14.514 10.206 822 HE ARG 101 HE ARG 101 3.914 -14.754 13.057 823 HH11 ARG 101 HH11 ARG 101 4.475 -16.572 10.123 824 HH12 ARG 101 HH12 ARG 101 4.862 -18.026 10.975 825 HH21 ARG 101 HH21 ARG 101 4.461 -16.633 14.141 826 HH22 ARG 101 HH22 ARG 101 4.849 -18.067 13.246 827 H LEU 102 HN LEU 102 4.555 -9.507 10.670 828 HA LEU 102 HA LEU 102 1.705 -9.072 11.340 829 HB2 LEU 102 HB2 LEU 102 3.769 -7.089 10.434 830 HB3 LEU 102 HB1 LEU 102 2.240 -6.982 9.589 831 HG LEU 102 HG LEU 102 1.096 -6.694 11.836 832 HD11 LEU 102 HD11 LEU 102 2.429 -6.009 13.771 833 HD12 LEU 102 HD12 LEU 102 3.915 -6.344 12.879 834 HD13 LEU 102 HD13 LEU 102 2.816 -7.662 13.288 835 HD21 LEU 102 HD21 LEU 102 1.552 -4.779 10.372 836 HD22 LEU 102 HD22 LEU 102 3.149 -4.589 11.103 837 HD23 LEU 102 HD23 LEU 102 1.696 -4.333 12.074 838 H GLU 103 HN GLU 103 0.449 -10.152 9.996 839 HA GLU 103 HA GLU 103 1.240 -10.858 7.290 840 HB2 GLU 103 HB2 GLU 103 -0.203 -12.425 8.561 841 HB3 GLU 103 HB1 GLU 103 -1.438 -11.179 8.725 842 HG2 GLU 103 HG2 GLU 103 -1.638 -11.160 6.200 843 HG3 GLU 103 HG1 GLU 103 -0.545 -12.544 6.161 844 H ILE 104 HN ILE 104 1.401 -9.030 6.038 845 HA ILE 104 HA ILE 104 -0.689 -7.003 5.968 846 HB ILE 104 HB ILE 104 1.602 -7.221 3.957 847 HG12 ILE 104 HG12 ILE 104 2.737 -7.378 6.118 848 HG13 ILE 104 HG11 ILE 104 3.000 -5.767 5.464 849 HG21 ILE 104 HG21 ILE 104 1.382 -4.749 3.866 850 HG22 ILE 104 HG22 ILE 104 0.074 -4.819 5.051 851 HG23 ILE 104 HG23 ILE 104 -0.135 -5.557 3.459 852 HD11 ILE 104 HD11 ILE 104 1.096 -6.540 7.664 853 HD12 ILE 104 HD12 ILE 104 1.236 -4.922 6.967 854 HD13 ILE 104 HD13 ILE 104 2.608 -5.641 7.810 855 H LEU 105 HN LEU 105 -2.206 -6.838 4.288 856 HA LEU 105 HA LEU 105 -2.074 -8.828 2.098 857 HB2 LEU 105 HB2 LEU 105 -4.468 -9.076 2.064 858 HB3 LEU 105 HB1 LEU 105 -3.896 -9.437 3.680 859 HG LEU 105 HG LEU 105 -5.278 -6.838 2.871 860 HD11 LEU 105 HD11 LEU 105 -6.815 -8.725 2.736 861 HD12 LEU 105 HD12 LEU 105 -7.229 -7.665 4.080 862 HD13 LEU 105 HD13 LEU 105 -6.411 -9.203 4.390 863 HD21 LEU 105 HD21 LEU 105 -4.553 -7.840 5.650 864 HD22 LEU 105 HD22 LEU 105 -5.453 -6.367 5.273 865 HD23 LEU 105 HD23 LEU 105 -3.764 -6.512 4.789 866 H CYS 106 HN CYS 106 -2.630 -8.097 0.133 867 HA CYS 106 HA CYS 106 -2.892 -5.239 -0.414 868 HB2 CYS 106 HB2 CYS 106 -0.305 -6.745 -1.053 869 HB3 CYS 106 HB1 CYS 106 -0.696 -5.122 -1.617 870 HG CYS 106 HG CYS 106 -0.412 -5.883 1.707 871 H ARG 107 HN ARG 107 -2.664 -4.878 -2.835 872 HA ARG 107 HA ARG 107 -2.725 -7.275 -4.530 873 HB2 ARG 107 HB2 ARG 107 -4.656 -6.681 -5.767 874 HB3 ARG 107 HB1 ARG 107 -5.151 -6.392 -4.108 875 HG2 ARG 107 HG2 ARG 107 -4.308 -4.255 -6.108 876 HG3 ARG 107 HG1 ARG 107 -5.968 -4.655 -5.670 877 HD2 ARG 107 HD2 ARG 107 -5.533 -3.918 -3.357 878 HD3 ARG 107 HD1 ARG 107 -3.863 -3.525 -3.791 879 HE ARG 107 HE ARG 107 -5.524 -2.140 -5.564 880 HH11 ARG 107 HH11 ARG 107 -4.831 -2.068 -2.111 881 HH12 ARG 107 HH12 ARG 107 -5.310 -0.413 -1.931 882 HH21 ARG 107 HH21 ARG 107 -6.095 0.036 -5.312 883 HH22 ARG 107 HH22 ARG 107 -6.018 0.785 -3.748 884 H GLU 108 HN GLU 108 -1.982 -6.763 -6.733 885 HA GLU 108 HA GLU 108 0.104 -5.104 -7.149 886 HB2 GLU 108 HB2 GLU 108 -1.993 -5.960 -9.171 887 HB3 GLU 108 HB1 GLU 108 -0.445 -5.240 -9.603 888 HG2 GLU 108 HG2 GLU 108 0.766 -7.118 -8.653 889 HG3 GLU 108 HG1 GLU 108 -0.731 -7.819 -8.028 890 H GLY 109 HN GLY 109 0.480 -3.024 -7.261 891 HA2 GLY 109 HA2 GLY 109 -1.730 -1.146 -6.912 892 HA3 GLY 109 HA1 GLY 109 -0.020 -0.843 -6.643 893 H ALA 110 HN ALA 110 -1.698 -2.085 -9.463 894 HA ALA 110 HA ALA 110 -0.783 0.008 -11.221 895 HB1 ALA 110 HB1 ALA 110 -2.246 -1.130 -12.873 896 HB2 ALA 110 HB2 ALA 110 -2.855 -2.199 -11.608 897 HB3 ALA 110 HB3 ALA 110 -1.156 -2.269 -12.085 898 H GLU 111 HN GLU 111 -1.802 1.999 -11.352 899 HA GLU 111 HA GLU 111 -3.958 2.595 -9.568 900 HB2 GLU 111 HB2 GLU 111 -2.791 4.376 -11.754 901 HB3 GLU 111 HB1 GLU 111 -3.887 4.894 -10.479 902 HG2 GLU 111 HG2 GLU 111 -1.763 5.612 -9.775 903 HG3 GLU 111 HG1 GLU 111 -2.103 4.173 -8.817 904 H LYS 112 HN LYS 112 -3.742 3.042 -13.116 905 HA LYS 112 HA LYS 112 -5.968 1.522 -13.833 906 HB2 LYS 112 HB2 LYS 112 -7.155 3.401 -12.536 907 HB3 LYS 112 HB1 LYS 112 -6.631 4.499 -13.804 908 HG2 LYS 112 HG2 LYS 112 -8.983 3.751 -14.070 909 HG3 LYS 112 HG1 LYS 112 -7.966 3.348 -15.451 910 HD2 LYS 112 HD2 LYS 112 -9.547 1.512 -14.808 911 HD3 LYS 112 HD1 LYS 112 -7.858 1.012 -14.783 912 HE2 LYS 112 HE2 LYS 112 -9.139 0.117 -12.849 913 HE3 LYS 112 HE1 LYS 112 -7.821 1.167 -12.335 914 HZ1 LYS 112 HZ1 LYS 112 -9.897 1.547 -11.120 915 HZ2 LYS 112 HZ2 LYS 112 -10.656 2.014 -12.556 916 HZ3 LYS 112 HZ3 LYS 112 -9.375 2.929 -11.945 Start of MODEL 6 1 H1 MET 1 HT1 MET 1 12.038 -18.339 17.416 2 H2 MET 1 HT2 MET 1 10.919 -17.152 16.986 3 H3 MET 1 HT3 MET 1 11.425 -17.294 18.592 4 HA MET 1 HA MET 1 12.467 -15.408 17.532 5 HB2 MET 1 HB2 MET 1 14.807 -15.925 18.133 6 HB3 MET 1 HB1 MET 1 13.693 -16.601 19.312 7 HG2 MET 1 HG2 MET 1 13.959 -18.832 18.224 8 HG3 MET 1 HG1 MET 1 15.168 -18.129 17.150 9 HE1 MET 1 HE1 MET 1 18.036 -17.220 19.697 10 HE2 MET 1 HE2 MET 1 16.734 -16.136 19.225 11 HE3 MET 1 HE3 MET 1 17.499 -17.164 18.008 12 H ASN 2 HN ASN 2 12.964 -18.455 15.788 13 HA ASN 2 HA ASN 2 14.280 -17.104 13.533 14 HB2 ASN 2 HB2 ASN 2 15.150 -19.320 14.179 15 HB3 ASN 2 HB1 ASN 2 13.556 -20.043 13.992 16 HD21 ASN 2 HD21 ASN 2 14.006 -21.488 12.381 17 HD22 ASN 2 HD22 ASN 2 14.549 -21.057 10.793 18 H ILE 3 HN ILE 3 12.830 -15.930 12.358 19 HA ILE 3 HA ILE 3 10.275 -17.090 11.513 20 HB ILE 3 HB ILE 3 11.527 -14.433 10.647 21 HG12 ILE 3 HG12 ILE 3 11.157 -14.424 13.089 22 HG13 ILE 3 HG11 ILE 3 9.999 -13.358 12.303 23 HG21 ILE 3 HG21 ILE 3 9.223 -13.835 9.933 24 HG22 ILE 3 HG22 ILE 3 8.660 -15.445 10.388 25 HG23 ILE 3 HG23 ILE 3 9.817 -15.256 9.069 26 HD11 ILE 3 HD11 ILE 3 8.963 -14.620 14.077 27 HD12 ILE 3 HD12 ILE 3 9.444 -16.141 13.330 28 HD13 ILE 3 HD13 ILE 3 8.275 -15.088 12.526 29 H GLY 4 HN GLY 4 11.018 -18.886 10.398 30 HA2 GLY 4 HA2 GLY 4 13.010 -18.749 8.282 31 HA3 GLY 4 HA1 GLY 4 12.129 -20.165 8.823 32 H ARG 5 HN ARG 5 11.105 -17.033 7.505 33 HA ARG 5 HA ARG 5 9.606 -18.360 5.309 34 HB2 ARG 5 HB2 ARG 5 8.777 -15.987 7.048 35 HB3 ARG 5 HB1 ARG 5 7.913 -16.485 5.598 36 HG2 ARG 5 HG2 ARG 5 8.273 -18.197 8.076 37 HG3 ARG 5 HG1 ARG 5 6.839 -17.237 7.704 38 HD2 ARG 5 HD2 ARG 5 6.497 -18.575 5.639 39 HD3 ARG 5 HD1 ARG 5 7.913 -19.555 6.048 40 HE ARG 5 HE ARG 5 6.345 -19.751 8.255 41 HH11 ARG 5 HH11 ARG 5 5.737 -20.426 4.863 42 HH12 ARG 5 HH12 ARG 5 4.549 -21.639 5.207 43 HH21 ARG 5 HH21 ARG 5 4.792 -21.323 8.681 44 HH22 ARG 5 HH22 ARG 5 4.005 -22.136 7.373 45 H LEU 6 HN LEU 6 11.537 -15.656 6.458 46 HA LEU 6 HA LEU 6 10.807 -13.815 4.388 47 HB2 LEU 6 HB2 LEU 6 13.133 -13.563 6.335 48 HB3 LEU 6 HB1 LEU 6 12.286 -12.266 5.504 49 HG LEU 6 HG LEU 6 11.166 -14.004 7.741 50 HD11 LEU 6 HD11 LEU 6 11.876 -11.056 7.757 51 HD12 LEU 6 HD12 LEU 6 12.786 -12.353 8.537 52 HD13 LEU 6 HD13 LEU 6 11.158 -11.971 9.088 53 HD21 LEU 6 HD21 LEU 6 9.792 -11.742 6.257 54 HD22 LEU 6 HD22 LEU 6 9.170 -12.575 7.687 55 HD23 LEU 6 HD23 LEU 6 9.380 -13.459 6.179 56 H ARG 7 HN ARG 7 11.373 -14.920 2.469 57 HA ARG 7 HA ARG 7 14.227 -15.410 1.895 58 HB2 ARG 7 HB2 ARG 7 11.739 -16.111 0.278 59 HB3 ARG 7 HB1 ARG 7 13.397 -16.497 -0.197 60 HG2 ARG 7 HG2 ARG 7 13.592 -17.881 1.897 61 HG3 ARG 7 HG1 ARG 7 11.865 -17.608 2.177 62 HD2 ARG 7 HD2 ARG 7 12.253 -19.773 1.074 63 HD3 ARG 7 HD1 ARG 7 11.348 -18.690 0.010 64 HE ARG 7 HE ARG 7 14.282 -18.995 -0.255 65 HH11 ARG 7 HH11 ARG 7 11.102 -19.229 -1.752 66 HH12 ARG 7 HH12 ARG 7 11.751 -19.481 -3.339 67 HH21 ARG 7 HH21 ARG 7 15.095 -19.300 -2.342 68 HH22 ARG 7 HH22 ARG 7 14.005 -19.515 -3.673 69 H ASP 8 HN ASP 8 11.755 -13.076 1.297 70 HA ASP 8 HA ASP 8 13.134 -11.938 -1.063 71 HB2 ASP 8 HB2 ASP 8 10.195 -11.703 -0.233 72 HB3 ASP 8 HB1 ASP 8 10.922 -11.020 -1.687 73 H ARG 9 HN ARG 9 12.200 -9.475 -1.176 74 HA ARG 9 HA ARG 9 12.302 -8.181 1.467 75 HB2 ARG 9 HB2 ARG 9 14.004 -7.252 -0.891 76 HB3 ARG 9 HB1 ARG 9 13.833 -6.416 0.653 77 HG2 ARG 9 HG2 ARG 9 14.880 -8.407 1.777 78 HG3 ARG 9 HG1 ARG 9 15.163 -9.108 0.178 79 HD2 ARG 9 HD2 ARG 9 16.314 -6.538 1.298 80 HD3 ARG 9 HD1 ARG 9 17.179 -8.023 0.921 81 HE ARG 9 HE ARG 9 16.519 -7.561 -1.475 82 HH11 ARG 9 HH11 ARG 9 17.043 -4.967 0.824 83 HH12 ARG 9 HH12 ARG 9 17.404 -3.795 -0.395 84 HH21 ARG 9 HH21 ARG 9 16.966 -5.990 -3.075 85 HH22 ARG 9 HH22 ARG 9 17.355 -4.368 -2.603 86 H ILE 10 HN ILE 10 11.363 -6.136 1.529 87 HA ILE 10 HA ILE 10 9.761 -5.187 -0.773 88 HB ILE 10 HB ILE 10 7.762 -4.885 0.628 89 HG12 ILE 10 HG12 ILE 10 9.195 -6.424 2.852 90 HG13 ILE 10 HG11 ILE 10 9.040 -4.675 2.824 91 HG21 ILE 10 HG21 ILE 10 8.687 -7.782 0.641 92 HG22 ILE 10 HG22 ILE 10 7.859 -6.946 -0.672 93 HG23 ILE 10 HG23 ILE 10 7.019 -7.239 0.848 94 HD11 ILE 10 HD11 ILE 10 6.625 -4.871 2.978 95 HD12 ILE 10 HD12 ILE 10 7.445 -5.689 4.311 96 HD13 ILE 10 HD13 ILE 10 6.766 -6.633 2.983 97 H THR 11 HN THR 11 8.777 -2.986 -0.204 98 HA THR 11 HA THR 11 10.409 -1.433 1.713 99 HB THR 11 HB THR 11 9.508 -0.341 -0.998 100 HG1 THR 11 HG1 THR 11 11.026 -2.133 -1.205 101 HG21 THR 11 HG21 THR 11 11.673 0.598 0.922 102 HG22 THR 11 HG22 THR 11 10.064 1.323 0.789 103 HG23 THR 11 HG23 THR 11 11.184 1.394 -0.576 104 H ILE 12 HN ILE 12 9.251 -0.003 2.926 105 HA ILE 12 HA ILE 12 6.321 -0.115 2.807 106 HB ILE 12 HB ILE 12 8.059 1.251 4.904 107 HG12 ILE 12 HG12 ILE 12 8.621 -1.126 4.884 108 HG13 ILE 12 HG11 ILE 12 7.641 -0.796 6.308 109 HG21 ILE 12 HG21 ILE 12 5.116 0.458 5.014 110 HG22 ILE 12 HG22 ILE 12 5.749 2.099 4.892 111 HG23 ILE 12 HG23 ILE 12 6.042 1.155 6.352 112 HD11 ILE 12 HD11 ILE 12 5.681 -1.721 5.127 113 HD12 ILE 12 HD12 ILE 12 6.996 -2.878 5.329 114 HD13 ILE 12 HD13 ILE 12 6.730 -2.121 3.759 115 H GLN 13 HN GLN 13 5.867 1.109 1.019 116 HA GLN 13 HA GLN 13 6.596 3.841 0.685 117 HB2 GLN 13 HB2 GLN 13 4.768 1.937 -0.719 118 HB3 GLN 13 HB1 GLN 13 4.347 3.636 -0.877 119 HG2 GLN 13 HG2 GLN 13 5.786 2.826 -2.723 120 HG3 GLN 13 HG1 GLN 13 6.498 4.167 -1.821 121 HE21 GLN 13 HE21 GLN 13 8.613 3.722 -2.334 122 HE22 GLN 13 HE22 GLN 13 9.452 2.307 -1.814 123 H THR 14 HN THR 14 6.188 5.041 2.316 124 HA THR 14 HA THR 14 3.598 5.267 3.644 125 HB THR 14 HB THR 14 4.781 7.163 4.902 126 HG1 THR 14 HG1 THR 14 6.515 6.874 2.916 127 HG21 THR 14 HG21 THR 14 6.146 4.435 4.927 128 HG22 THR 14 HG22 THR 14 4.699 4.869 5.843 129 HG23 THR 14 HG23 THR 14 6.239 5.644 6.214 130 H LEU 15 HN LEU 15 2.143 7.033 3.403 131 HA LEU 15 HA LEU 15 2.119 8.178 0.742 132 HB2 LEU 15 HB2 LEU 15 0.079 7.197 1.732 133 HB3 LEU 15 HB1 LEU 15 0.144 8.343 3.057 134 HG LEU 15 HG LEU 15 -0.272 10.207 1.431 135 HD11 LEU 15 HD11 LEU 15 -1.079 9.725 -0.837 136 HD12 LEU 15 HD12 LEU 15 -0.692 8.016 -0.619 137 HD13 LEU 15 HD13 LEU 15 0.594 9.222 -0.617 138 HD21 LEU 15 HD21 LEU 15 -2.400 8.050 1.451 139 HD22 LEU 15 HD22 LEU 15 -2.660 9.761 1.107 140 HD23 LEU 15 HD23 LEU 15 -2.123 9.259 2.709 141 H LYS 16 HN LYS 16 3.449 9.926 0.481 142 HA LYS 16 HA LYS 16 3.812 11.940 2.552 143 HB2 LYS 16 HB2 LYS 16 5.730 11.061 1.213 144 HB3 LYS 16 HB1 LYS 16 5.007 11.726 -0.250 145 HG2 LYS 16 HG2 LYS 16 5.250 14.015 0.689 146 HG3 LYS 16 HG1 LYS 16 5.963 13.327 2.153 147 HD2 LYS 16 HD2 LYS 16 7.790 12.340 0.668 148 HD3 LYS 16 HD1 LYS 16 7.133 13.309 -0.655 149 HE2 LYS 16 HE2 LYS 16 9.031 14.463 0.370 150 HE3 LYS 16 HE1 LYS 16 7.550 15.370 0.686 151 HZ1 LYS 16 HZ1 LYS 16 8.914 13.528 2.585 152 HZ2 LYS 16 HZ2 LYS 16 7.472 14.351 2.896 153 HZ3 LYS 16 HZ3 LYS 16 8.904 15.219 2.665 154 H GLN 17 HN GLN 17 2.359 13.577 2.670 155 HA GLN 17 HA GLN 17 0.908 14.610 0.374 156 HB2 GLN 17 HB2 GLN 17 1.140 15.601 3.256 157 HB3 GLN 17 HB1 GLN 17 0.072 16.314 2.044 158 HG2 GLN 17 HG2 GLN 17 -1.164 14.185 1.879 159 HG3 GLN 17 HG1 GLN 17 -0.078 13.455 3.062 160 HE21 GLN 17 HE21 GLN 17 -2.694 15.716 2.586 161 HE22 GLN 17 HE22 GLN 17 -3.116 15.884 4.249 162 H THR 18 HN THR 18 2.330 15.460 -1.101 163 HA THR 18 HA THR 18 4.615 17.070 -0.253 164 HB THR 18 HB THR 18 3.853 15.984 -3.001 165 HG1 THR 18 HG1 THR 18 5.173 14.347 -2.550 166 HG21 THR 18 HG21 THR 18 6.388 17.416 -2.136 167 HG22 THR 18 HG22 THR 18 5.169 18.057 -3.243 168 HG23 THR 18 HG23 THR 18 6.133 16.646 -3.703 169 H ARG 19 HN ARG 19 4.283 19.204 -0.061 170 HA ARG 19 HA ARG 19 1.954 20.443 -1.285 171 HB2 ARG 19 HB2 ARG 19 2.498 20.699 1.148 172 HB3 ARG 19 HB1 ARG 19 3.928 21.623 0.698 173 HG2 ARG 19 HG2 ARG 19 2.542 23.378 -0.285 174 HG3 ARG 19 HG1 ARG 19 1.082 22.423 -0.014 175 HD2 ARG 19 HD2 ARG 19 1.429 22.577 2.415 176 HD3 ARG 19 HD1 ARG 19 2.898 23.529 2.155 177 HE ARG 19 HE ARG 19 0.157 24.406 1.443 178 HH11 ARG 19 HH11 ARG 19 3.405 25.244 2.513 179 HH12 ARG 19 HH12 ARG 19 3.059 26.940 2.608 180 HH21 ARG 19 HH21 ARG 19 -0.279 26.631 1.587 181 HH22 ARG 19 HH22 ARG 19 0.977 27.722 2.078 182 H ASP 20 HN ASP 20 2.036 22.415 -2.412 183 HA ASP 20 HA ASP 20 4.507 22.899 -3.973 184 HB2 ASP 20 HB2 ASP 20 2.457 22.146 -5.278 185 HB3 ASP 20 HB1 ASP 20 1.627 23.604 -4.747 186 H ILE 21 HN ILE 21 4.840 25.257 -4.585 187 HA ILE 21 HA ILE 21 4.707 26.959 -2.330 188 HB ILE 21 HB ILE 21 6.576 26.859 -3.999 189 HG12 ILE 21 HG12 ILE 21 5.463 29.687 -3.662 190 HG13 ILE 21 HG11 ILE 21 6.320 28.804 -2.403 191 HG21 ILE 21 HG21 ILE 21 6.418 28.083 -6.132 192 HG22 ILE 21 HG22 ILE 21 4.716 28.424 -5.818 193 HG23 ILE 21 HG23 ILE 21 5.249 26.759 -6.063 194 HD11 ILE 21 HD11 ILE 21 7.458 29.677 -5.059 195 HD12 ILE 21 HD12 ILE 21 8.327 28.762 -3.824 196 HD13 ILE 21 HD13 ILE 21 7.777 30.403 -3.483 197 H THR 22 HN THR 22 2.205 26.299 -4.446 198 HA THR 22 HA THR 22 0.950 28.973 -4.258 199 HB THR 22 HB THR 22 -0.828 27.948 -5.723 200 HG1 THR 22 HG1 THR 22 -0.359 25.855 -6.625 201 HG21 THR 22 HG21 THR 22 0.483 27.820 -7.814 202 HG22 THR 22 HG22 THR 22 1.975 27.669 -6.885 203 HG23 THR 22 HG23 THR 22 1.044 29.168 -6.814 204 H GLY 23 HN GLY 23 1.229 26.007 -2.776 205 HA2 GLY 23 HA2 GLY 23 0.402 25.318 -0.686 206 HA3 GLY 23 HA1 GLY 23 -0.913 26.470 -0.830 207 H GLU 24 HN GLU 24 0.055 23.970 -3.175 208 HA GLU 24 HA GLU 24 -2.564 22.654 -2.970 209 HB2 GLU 24 HB2 GLU 24 -0.313 22.323 -4.996 210 HB3 GLU 24 HB1 GLU 24 -1.824 21.411 -5.025 211 HG2 GLU 24 HG2 GLU 24 -3.089 23.461 -5.412 212 HG3 GLU 24 HG1 GLU 24 -1.608 24.423 -5.303 213 H ILE 25 HN ILE 25 -2.714 20.402 -2.476 214 HA ILE 25 HA ILE 25 -0.283 19.137 -1.332 215 HB ILE 25 HB ILE 25 -3.234 18.577 -0.749 216 HG12 ILE 25 HG12 ILE 25 -2.304 20.609 0.380 217 HG13 ILE 25 HG11 ILE 25 -2.730 19.354 1.539 218 HG21 ILE 25 HG21 ILE 25 -2.041 16.435 -0.750 219 HG22 ILE 25 HG22 ILE 25 -2.440 16.884 0.906 220 HG23 ILE 25 HG23 ILE 25 -0.789 17.089 0.314 221 HD11 ILE 25 HD11 ILE 25 -0.351 18.731 1.698 222 HD12 ILE 25 HD12 ILE 25 -0.660 20.404 2.154 223 HD13 ILE 25 HD13 ILE 25 0.046 20.040 0.581 224 H LEU 26 HN LEU 26 0.626 18.017 -2.918 225 HA LEU 26 HA LEU 26 -0.884 16.274 -4.739 226 HB2 LEU 26 HB2 LEU 26 2.084 17.018 -4.688 227 HB3 LEU 26 HB1 LEU 26 1.355 15.913 -5.839 228 HG LEU 26 HG LEU 26 -0.076 17.897 -6.636 229 HD11 LEU 26 HD11 LEU 26 0.229 19.397 -4.706 230 HD12 LEU 26 HD12 LEU 26 0.742 20.164 -6.208 231 HD13 LEU 26 HD13 LEU 26 1.952 19.541 -5.084 232 HD21 LEU 26 HD21 LEU 26 1.817 17.004 -7.925 233 HD22 LEU 26 HD22 LEU 26 2.928 18.055 -7.044 234 HD23 LEU 26 HD23 LEU 26 1.698 18.754 -8.099 235 H GLU 27 HN GLU 27 -1.363 14.377 -3.694 236 HA GLU 27 HA GLU 27 0.350 13.336 -1.600 237 HB2 GLU 27 HB2 GLU 27 -2.266 12.280 -2.761 238 HB3 GLU 27 HB1 GLU 27 -1.387 11.534 -1.419 239 HG2 GLU 27 HG2 GLU 27 -1.589 13.691 -0.159 240 HG3 GLU 27 HG1 GLU 27 -2.601 14.311 -1.463 241 H THR 28 HN THR 28 1.721 11.734 -1.775 242 HA THR 28 HA THR 28 2.225 10.306 -4.288 243 HB THR 28 HB THR 28 4.670 11.035 -4.173 244 HG1 THR 28 HG1 THR 28 3.600 12.894 -2.295 245 HG21 THR 28 HG21 THR 28 3.177 12.095 -5.832 246 HG22 THR 28 HG22 THR 28 4.378 13.240 -5.233 247 HG23 THR 28 HG23 THR 28 2.716 13.317 -4.643 248 H TRP 29 HN TRP 29 4.560 9.056 -3.692 249 HA TRP 29 HA TRP 29 4.160 7.813 -1.033 250 HB2 TRP 29 HB2 TRP 29 4.657 6.345 -3.668 251 HB3 TRP 29 HB1 TRP 29 4.577 5.591 -2.078 252 HD1 TRP 29 HD1 TRP 29 2.327 6.981 -4.836 253 HE1 TRP 29 HE1 TRP 29 -0.126 6.464 -4.259 254 HE3 TRP 29 HE3 TRP 29 2.950 5.276 -0.061 255 HZ2 TRP 29 HZ2 TRP 29 -1.610 5.479 -2.077 256 HZ3 TRP 29 HZ3 TRP 29 0.963 4.575 1.212 257 HH2 TRP 29 HH2 TRP 29 -1.276 4.674 0.227 258 H GLU 30 HN GLU 30 5.901 8.177 0.091 259 HA GLU 30 HA GLU 30 8.585 8.261 -1.155 260 HB2 GLU 30 HB2 GLU 30 9.374 9.228 0.989 261 HB3 GLU 30 HB1 GLU 30 8.095 10.193 0.268 262 HG2 GLU 30 HG2 GLU 30 6.481 9.368 1.879 263 HG3 GLU 30 HG1 GLU 30 7.653 8.228 2.533 264 H ASP 31 HN ASP 31 10.232 6.909 -0.409 265 HA ASP 31 HA ASP 31 9.322 4.270 0.354 266 HB2 ASP 31 HB2 ASP 31 11.541 3.491 -0.204 267 HB3 ASP 31 HB1 ASP 31 11.057 4.632 -1.449 268 H GLY 32 HN GLY 32 9.712 3.215 2.271 269 HA2 GLY 32 HA2 GLY 32 10.626 4.886 4.543 270 HA3 GLY 32 HA1 GLY 32 9.522 3.515 4.635 271 H HIS 33 HN HIS 33 10.340 1.589 5.194 272 HA HIS 33 HA HIS 33 13.292 1.231 5.198 273 HB2 HIS 33 HB2 HIS 33 11.117 0.093 7.010 274 HB3 HIS 33 HB1 HIS 33 12.751 -0.567 6.971 275 HD1 HIS 33 HD1 HIS 33 14.427 0.544 8.477 276 HD2 HIS 33 HD2 HIS 33 11.058 2.904 7.879 277 HE1 HIS 33 HE1 HIS 33 14.677 2.482 10.052 278 HE2 HIS 33 HE2 HIS 33 12.656 3.937 9.636 279 H THR 34 HN THR 34 14.128 -0.431 3.977 280 HA THR 34 HA THR 34 12.279 -2.277 2.637 281 HB THR 34 HB THR 34 15.229 -1.718 2.115 282 HG1 THR 34 HG1 THR 34 12.936 -1.076 0.556 283 HG21 THR 34 HG21 THR 34 14.900 -3.046 0.034 284 HG22 THR 34 HG22 THR 34 13.249 -3.413 0.533 285 HG23 THR 34 HG23 THR 34 14.611 -4.046 1.461 286 H LEU 35 HN LEU 35 11.849 -3.945 3.938 287 HA LEU 35 HA LEU 35 13.963 -5.104 5.650 288 HB2 LEU 35 HB2 LEU 35 12.142 -5.908 7.116 289 HB3 LEU 35 HB1 LEU 35 12.153 -4.164 6.978 290 HG LEU 35 HG LEU 35 10.275 -5.735 5.200 291 HD11 LEU 35 HD11 LEU 35 9.699 -5.129 8.107 292 HD12 LEU 35 HD12 LEU 35 9.903 -6.727 7.387 293 HD13 LEU 35 HD13 LEU 35 8.537 -5.720 6.918 294 HD21 LEU 35 HD21 LEU 35 10.465 -3.301 4.878 295 HD22 LEU 35 HD22 LEU 35 10.015 -3.029 6.561 296 HD23 LEU 35 HD23 LEU 35 8.857 -3.747 5.438 297 H TRP 36 HN TRP 36 13.677 -7.351 6.225 298 HA TRP 36 HA TRP 36 13.487 -9.152 4.028 299 HB2 TRP 36 HB2 TRP 36 13.387 -10.001 6.944 300 HB3 TRP 36 HB1 TRP 36 14.082 -10.869 5.581 301 HD1 TRP 36 HD1 TRP 36 15.132 -8.939 8.500 302 HE1 TRP 36 HE1 TRP 36 17.565 -8.160 8.294 303 HE3 TRP 36 HE3 TRP 36 15.857 -9.721 3.481 304 HZ2 TRP 36 HZ2 TRP 36 19.530 -7.882 6.311 305 HZ3 TRP 36 HZ3 TRP 36 18.055 -9.163 2.518 306 HH2 TRP 36 HH2 TRP 36 19.855 -8.260 3.904 307 H ALA 37 HN ALA 37 11.702 -10.043 3.211 308 HA ALA 37 HA ALA 37 9.226 -10.382 4.789 309 HB1 ALA 37 HB1 ALA 37 7.880 -9.327 3.033 310 HB2 ALA 37 HB2 ALA 37 9.346 -8.976 2.106 311 HB3 ALA 37 HB3 ALA 37 9.084 -8.201 3.668 312 H SER 38 HN SER 38 7.520 -11.613 3.573 313 HA SER 38 HA SER 38 8.537 -13.434 1.483 314 HB2 SER 38 HB2 SER 38 6.467 -14.211 3.588 315 HB3 SER 38 HB1 SER 38 7.449 -15.265 2.569 316 HG SER 38 HG SER 38 8.433 -13.595 4.633 317 H VAL 39 HN VAL 39 7.529 -12.360 -0.252 318 HA VAL 39 HA VAL 39 4.762 -11.406 0.031 319 HB VAL 39 HB VAL 39 6.241 -9.744 -0.884 320 HG11 VAL 39 HG11 VAL 39 7.084 -11.706 -3.043 321 HG12 VAL 39 HG12 VAL 39 8.070 -11.180 -1.681 322 HG13 VAL 39 HG13 VAL 39 7.594 -10.022 -2.922 323 HG21 VAL 39 HG21 VAL 39 5.176 -9.228 -3.059 324 HG22 VAL 39 HG22 VAL 39 3.991 -9.786 -1.882 325 HG23 VAL 39 HG23 VAL 39 4.553 -10.876 -3.152 326 H ASN 40 HN ASN 40 3.476 -13.189 -0.099 327 HA ASN 40 HA ASN 40 3.770 -15.082 -2.358 328 HB2 ASN 40 HB2 ASN 40 2.574 -15.565 0.420 329 HB3 ASN 40 HB1 ASN 40 2.605 -16.745 -0.890 330 HD21 ASN 40 HD21 ASN 40 4.506 -15.089 1.529 331 HD22 ASN 40 HD22 ASN 40 5.917 -16.082 1.373 332 H MET 41 HN MET 41 2.207 -14.815 -3.845 333 HA MET 41 HA MET 41 -0.288 -13.454 -3.349 334 HB2 MET 41 HB2 MET 41 0.474 -15.095 -5.809 335 HB3 MET 41 HB1 MET 41 -0.798 -13.883 -5.694 336 HG2 MET 41 HG2 MET 41 1.046 -12.189 -5.220 337 HG3 MET 41 HG1 MET 41 2.188 -13.451 -5.677 338 HE1 MET 41 HE1 MET 41 -0.462 -10.858 -6.879 339 HE2 MET 41 HE2 MET 41 -1.354 -12.358 -7.132 340 HE3 MET 41 HE3 MET 41 -0.829 -11.404 -8.517 341 H VAL 42 HN VAL 42 -2.377 -14.416 -3.536 342 HA VAL 42 HA VAL 42 -2.532 -17.006 -2.245 343 HB VAL 42 HB VAL 42 -4.840 -16.543 -1.778 344 HG11 VAL 42 HG11 VAL 42 -3.266 -13.979 -1.366 345 HG12 VAL 42 HG12 VAL 42 -3.249 -15.396 -0.310 346 HG13 VAL 42 HG13 VAL 42 -4.727 -14.445 -0.483 347 HG21 VAL 42 HG21 VAL 42 -5.611 -15.647 -3.917 348 HG22 VAL 42 HG22 VAL 42 -4.719 -14.150 -3.656 349 HG23 VAL 42 HG23 VAL 42 -6.084 -14.556 -2.613 350 H SER 43 HN SER 43 -3.300 -18.827 -3.143 351 HA SER 43 HA SER 43 -3.671 -18.973 -6.041 352 HB2 SER 43 HB2 SER 43 -2.086 -20.530 -4.909 353 HB3 SER 43 HB1 SER 43 -3.400 -21.149 -3.915 354 HG SER 43 HG SER 43 -3.027 -21.434 -6.711 355 H SER 44 HN SER 44 -5.346 -20.879 -6.556 356 HA SER 44 HA SER 44 -7.945 -19.879 -6.197 357 HB2 SER 44 HB2 SER 44 -8.644 -22.062 -7.262 358 HB3 SER 44 HB1 SER 44 -7.367 -21.223 -8.143 359 HG SER 44 HG SER 44 -7.213 -23.619 -7.616 360 H LYS 45 HN LYS 45 -6.142 -22.351 -4.477 361 HA LYS 45 HA LYS 45 -8.039 -23.601 -2.879 362 HB2 LYS 45 HB2 LYS 45 -6.167 -24.024 -1.290 363 HB3 LYS 45 HB1 LYS 45 -5.703 -24.329 -2.960 364 HG2 LYS 45 HG2 LYS 45 -4.548 -22.135 -3.037 365 HG3 LYS 45 HG1 LYS 45 -5.020 -21.830 -1.368 366 HD2 LYS 45 HD2 LYS 45 -2.695 -22.553 -1.474 367 HD3 LYS 45 HD1 LYS 45 -3.667 -23.759 -0.633 368 HE2 LYS 45 HE2 LYS 45 -3.721 -25.143 -2.684 369 HE3 LYS 45 HE1 LYS 45 -2.761 -23.931 -3.531 370 HZ1 LYS 45 HZ1 LYS 45 -1.874 -25.434 -1.137 371 HZ2 LYS 45 HZ2 LYS 45 -0.952 -24.340 -2.039 372 HZ3 LYS 45 HZ3 LYS 45 -1.446 -25.798 -2.733 373 H GLU 46 HN GLU 46 -6.436 -20.490 -2.400 374 HA GLU 46 HA GLU 46 -7.350 -19.954 0.253 375 HB2 GLU 46 HB2 GLU 46 -6.341 -18.061 -1.914 376 HB3 GLU 46 HB1 GLU 46 -6.503 -17.654 -0.207 377 HG2 GLU 46 HG2 GLU 46 -4.699 -19.844 -1.269 378 HG3 GLU 46 HG1 GLU 46 -4.163 -18.194 -0.962 379 H ALA 47 HN ALA 47 -8.391 -18.890 -2.978 380 HA ALA 47 HA ALA 47 -10.579 -17.291 -2.247 381 HB1 ALA 47 HB1 ALA 47 -10.196 -18.921 -4.781 382 HB2 ALA 47 HB2 ALA 47 -9.618 -17.274 -4.503 383 HB3 ALA 47 HB3 ALA 47 -11.352 -17.599 -4.570 384 H ILE 48 HN ILE 48 -10.335 -20.799 -2.638 385 HA ILE 48 HA ILE 48 -13.131 -21.398 -2.348 386 HB ILE 48 HB ILE 48 -10.694 -23.186 -1.900 387 HG12 ILE 48 HG12 ILE 48 -12.558 -23.054 -4.309 388 HG13 ILE 48 HG11 ILE 48 -10.973 -22.298 -4.241 389 HG21 ILE 48 HG21 ILE 48 -12.244 -25.125 -2.102 390 HG22 ILE 48 HG22 ILE 48 -13.615 -24.013 -2.146 391 HG23 ILE 48 HG23 ILE 48 -12.618 -24.127 -0.693 392 HD11 ILE 48 HD11 ILE 48 -11.526 -25.259 -4.082 393 HD12 ILE 48 HD12 ILE 48 -9.933 -24.503 -4.029 394 HD13 ILE 48 HD13 ILE 48 -10.919 -24.380 -5.484 395 H SER 49 HN SER 49 -10.360 -21.307 -0.100 396 HA SER 49 HA SER 49 -11.634 -22.363 2.196 397 HB2 SER 49 HB2 SER 49 -9.204 -20.526 1.999 398 HB3 SER 49 HB1 SER 49 -9.674 -21.435 3.441 399 HG SER 49 HG SER 49 -9.503 -23.350 2.053 400 H SER 50 HN SER 50 -11.332 -19.073 0.981 401 HA SER 50 HA SER 50 -12.554 -17.865 3.346 402 HB2 SER 50 HB2 SER 50 -12.191 -15.741 2.095 403 HB3 SER 50 HB1 SER 50 -10.716 -16.690 2.212 404 HG SER 50 HG SER 50 -10.720 -16.976 0.112 405 H GLY 51 HN GLY 51 -13.307 -18.296 -0.120 406 HA2 GLY 51 HA2 GLY 51 -15.563 -19.029 -0.756 407 HA3 GLY 51 HA1 GLY 51 -16.204 -17.911 0.442 408 H ALA 52 HN ALA 52 -15.314 -15.591 0.105 409 HA ALA 52 HA ALA 52 -15.074 -14.786 -2.714 410 HB1 ALA 52 HB1 ALA 52 -17.506 -14.791 -2.243 411 HB2 ALA 52 HB2 ALA 52 -16.923 -13.150 -2.529 412 HB3 ALA 52 HB3 ALA 52 -17.256 -13.699 -0.882 413 H GLU 53 HN GLU 53 -14.065 -14.458 0.469 414 HA GLU 53 HA GLU 53 -13.483 -11.652 0.612 415 HB2 GLU 53 HB2 GLU 53 -13.743 -12.978 2.647 416 HB3 GLU 53 HB1 GLU 53 -12.428 -14.038 2.176 417 HG2 GLU 53 HG2 GLU 53 -10.869 -12.064 2.361 418 HG3 GLU 53 HG1 GLU 53 -12.221 -11.139 3.018 419 H LEU 54 HN LEU 54 -11.158 -14.395 0.550 420 HA LEU 54 HA LEU 54 -9.080 -12.830 -0.713 421 HB2 LEU 54 HB2 LEU 54 -9.216 -15.845 -0.231 422 HB3 LEU 54 HB1 LEU 54 -7.779 -14.938 -0.692 423 HG LEU 54 HG LEU 54 -9.264 -14.648 1.955 424 HD11 LEU 54 HD11 LEU 54 -8.142 -16.809 1.795 425 HD12 LEU 54 HD12 LEU 54 -7.345 -15.775 2.975 426 HD13 LEU 54 HD13 LEU 54 -6.617 -16.018 1.384 427 HD21 LEU 54 HD21 LEU 54 -7.344 -13.268 2.677 428 HD22 LEU 54 HD22 LEU 54 -8.199 -12.537 1.321 429 HD23 LEU 54 HD23 LEU 54 -6.659 -13.359 1.049 430 H ALA 55 HN ALA 55 -9.065 -12.464 -2.836 431 HA ALA 55 HA ALA 55 -10.275 -14.381 -4.754 432 HB1 ALA 55 HB1 ALA 55 -10.510 -12.447 -6.293 433 HB2 ALA 55 HB2 ALA 55 -9.845 -11.374 -5.058 434 HB3 ALA 55 HB3 ALA 55 -11.392 -12.176 -4.790 435 H ILE 56 HN ILE 56 -8.976 -14.903 -6.611 436 HA ILE 56 HA ILE 56 -6.260 -15.303 -5.983 437 HB ILE 56 HB ILE 56 -7.548 -15.479 -8.758 438 HG12 ILE 56 HG12 ILE 56 -7.294 -17.702 -6.668 439 HG13 ILE 56 HG11 ILE 56 -8.774 -16.802 -6.979 440 HG21 ILE 56 HG21 ILE 56 -5.777 -17.135 -9.264 441 HG22 ILE 56 HG22 ILE 56 -5.055 -16.859 -7.676 442 HG23 ILE 56 HG23 ILE 56 -5.092 -15.559 -8.870 443 HD11 ILE 56 HD11 ILE 56 -8.804 -18.971 -8.058 444 HD12 ILE 56 HD12 ILE 56 -7.347 -18.571 -8.964 445 HD13 ILE 56 HD13 ILE 56 -8.842 -17.680 -9.256 446 H GLY 57 HN GLY 57 -4.555 -13.898 -6.172 447 HA2 GLY 57 HA2 GLY 57 -3.346 -12.152 -7.422 448 HA3 GLY 57 HA1 GLY 57 -4.891 -11.394 -7.776 449 H THR 58 HN THR 58 -5.574 -12.180 -4.825 450 HA THR 58 HA THR 58 -4.634 -9.917 -3.365 451 HB THR 58 HB THR 58 -5.835 -12.559 -2.411 452 HG1 THR 58 HG1 THR 58 -7.121 -11.022 -3.723 453 HG21 THR 58 HG21 THR 58 -6.330 -11.442 -0.255 454 HG22 THR 58 HG22 THR 58 -5.403 -10.032 -0.774 455 HG23 THR 58 HG23 THR 58 -4.590 -11.581 -0.527 456 H VAL 59 HN VAL 59 -2.953 -9.954 -1.688 457 HA VAL 59 HA VAL 59 -0.873 -12.006 -2.092 458 HB VAL 59 HB VAL 59 -0.288 -9.009 -1.947 459 HG11 VAL 59 HG11 VAL 59 1.502 -11.372 -2.653 460 HG12 VAL 59 HG12 VAL 59 1.534 -10.466 -1.138 461 HG13 VAL 59 HG13 VAL 59 1.991 -9.672 -2.646 462 HG21 VAL 59 HG21 VAL 59 -1.479 -9.461 -4.061 463 HG22 VAL 59 HG22 VAL 59 -0.349 -10.762 -4.442 464 HG23 VAL 59 HG23 VAL 59 0.220 -9.093 -4.378 465 H ARG 60 HN ARG 60 -0.534 -12.914 -0.154 466 HA ARG 60 HA ARG 60 -0.742 -11.459 2.377 467 HB2 ARG 60 HB2 ARG 60 0.083 -14.341 1.793 468 HB3 ARG 60 HB1 ARG 60 -0.080 -13.649 3.406 469 HG2 ARG 60 HG2 ARG 60 -2.522 -13.323 2.974 470 HG3 ARG 60 HG1 ARG 60 -2.322 -14.129 1.410 471 HD2 ARG 60 HD2 ARG 60 -1.447 -16.139 2.605 472 HD3 ARG 60 HD1 ARG 60 -1.746 -15.331 4.146 473 HE ARG 60 HE ARG 60 -3.844 -16.182 2.224 474 HH11 ARG 60 HH11 ARG 60 -2.901 -15.383 5.517 475 HH12 ARG 60 HH12 ARG 60 -4.308 -16.113 6.211 476 HH21 ARG 60 HH21 ARG 60 -5.627 -17.204 3.153 477 HH22 ARG 60 HH22 ARG 60 -5.856 -17.171 4.872 478 H ILE 61 HN ILE 61 1.033 -10.584 3.333 479 HA ILE 61 HA ILE 61 3.748 -11.175 2.230 480 HB ILE 61 HB ILE 61 2.687 -8.416 3.015 481 HG12 ILE 61 HG12 ILE 61 3.432 -9.351 0.204 482 HG13 ILE 61 HG11 ILE 61 1.791 -9.482 0.821 483 HG21 ILE 61 HG21 ILE 61 4.834 -7.559 2.084 484 HG22 ILE 61 HG22 ILE 61 5.389 -9.219 1.857 485 HG23 ILE 61 HG23 ILE 61 5.088 -8.603 3.486 486 HD11 ILE 61 HD11 ILE 61 2.037 -7.549 -0.580 487 HD12 ILE 61 HD12 ILE 61 3.334 -6.937 0.433 488 HD13 ILE 61 HD13 ILE 61 1.700 -7.053 1.078 489 H TRP 62 HN TRP 62 4.661 -12.274 3.817 490 HA TRP 62 HA TRP 62 4.062 -11.792 6.645 491 HB2 TRP 62 HB2 TRP 62 5.613 -14.002 5.208 492 HB3 TRP 62 HB1 TRP 62 5.507 -13.887 6.965 493 HD1 TRP 62 HD1 TRP 62 2.483 -13.383 4.563 494 HE1 TRP 62 HE1 TRP 62 0.752 -15.192 5.108 495 HE3 TRP 62 HE3 TRP 62 5.181 -16.079 7.960 496 HZ2 TRP 62 HZ2 TRP 62 0.562 -17.508 6.735 497 HZ3 TRP 62 HZ3 TRP 62 4.162 -18.087 8.968 498 HH2 TRP 62 HH2 TRP 62 1.898 -18.784 8.367 499 H ILE 63 HN ILE 63 5.261 -10.464 7.761 500 HA ILE 63 HA ILE 63 8.173 -10.198 7.279 501 HB ILE 63 HB ILE 63 8.036 -7.796 7.777 502 HG12 ILE 63 HG12 ILE 63 4.991 -8.076 7.801 503 HG13 ILE 63 HG11 ILE 63 5.979 -7.869 9.240 504 HG21 ILE 63 HG21 ILE 63 6.127 -8.549 5.534 505 HG22 ILE 63 HG22 ILE 63 7.885 -8.439 5.422 506 HG23 ILE 63 HG23 ILE 63 6.933 -6.986 5.717 507 HD11 ILE 63 HD11 ILE 63 5.656 -5.887 6.994 508 HD12 ILE 63 HD12 ILE 63 6.699 -5.673 8.403 509 HD13 ILE 63 HD13 ILE 63 4.950 -5.788 8.606 510 H ARG 64 HN ARG 64 9.362 -9.720 9.343 511 HA ARG 64 HA ARG 64 8.246 -10.613 11.742 512 HB2 ARG 64 HB2 ARG 64 10.543 -8.654 11.359 513 HB3 ARG 64 HB1 ARG 64 10.069 -9.302 12.931 514 HG2 ARG 64 HG2 ARG 64 10.389 -11.633 11.850 515 HG3 ARG 64 HG1 ARG 64 11.250 -10.777 10.573 516 HD2 ARG 64 HD2 ARG 64 11.976 -10.678 13.519 517 HD3 ARG 64 HD1 ARG 64 12.729 -11.748 12.337 518 HE ARG 64 HE ARG 64 12.978 -9.131 11.393 519 HH11 ARG 64 HH11 ARG 64 14.164 -11.010 14.121 520 HH12 ARG 64 HH12 ARG 64 15.660 -10.135 14.217 521 HH21 ARG 64 HH21 ARG 64 14.951 -8.006 11.544 522 HH22 ARG 64 HH22 ARG 64 16.103 -8.450 12.755 523 H TYR 65 HN TYR 65 7.276 -9.662 13.479 524 HA TYR 65 HA TYR 65 5.240 -7.817 13.071 525 HB2 TYR 65 HB2 TYR 65 5.328 -9.561 14.856 526 HB3 TYR 65 HB1 TYR 65 6.558 -8.641 15.707 527 HD1 TYR 65 HD1 TYR 65 5.866 -6.236 16.522 528 HD2 TYR 65 HD2 TYR 65 3.022 -9.230 15.396 529 HE1 TYR 65 HE1 TYR 65 4.134 -5.060 17.786 530 HE2 TYR 65 HE2 TYR 65 1.291 -8.038 16.678 531 HH TYR 65 HH TYR 65 1.120 -6.472 18.523 532 H ARG 66 HN ARG 66 5.088 -5.627 13.178 533 HA ARG 66 HA ARG 66 6.974 -3.984 14.632 534 HB2 ARG 66 HB2 ARG 66 7.445 -2.546 12.519 535 HB3 ARG 66 HB1 ARG 66 8.340 -4.047 12.716 536 HG2 ARG 66 HG2 ARG 66 6.756 -5.146 11.125 537 HG3 ARG 66 HG1 ARG 66 5.967 -3.582 10.887 538 HD2 ARG 66 HD2 ARG 66 7.589 -4.072 9.093 539 HD3 ARG 66 HD1 ARG 66 8.059 -2.633 10.007 540 HE ARG 66 HE ARG 66 9.242 -5.260 10.674 541 HH11 ARG 66 HH11 ARG 66 9.713 -1.972 9.548 542 HH12 ARG 66 HH12 ARG 66 11.438 -2.101 9.550 543 HH21 ARG 66 HH21 ARG 66 11.497 -5.400 10.680 544 HH22 ARG 66 HH22 ARG 66 12.452 -4.034 10.198 545 H LYS 67 HN LYS 67 6.298 -1.898 14.989 546 HA LYS 67 HA LYS 67 3.420 -1.479 15.005 547 HB2 LYS 67 HB2 LYS 67 5.613 0.363 16.049 548 HB3 LYS 67 HB1 LYS 67 3.912 0.380 16.505 549 HG2 LYS 67 HG2 LYS 67 5.885 -1.834 17.140 550 HG3 LYS 67 HG1 LYS 67 5.380 -0.556 18.251 551 HD2 LYS 67 HD2 LYS 67 3.009 -1.398 18.027 552 HD3 LYS 67 HD1 LYS 67 3.629 -2.743 17.059 553 HE2 LYS 67 HE2 LYS 67 3.293 -3.433 19.388 554 HE3 LYS 67 HE1 LYS 67 5.009 -3.474 18.976 555 HZ1 LYS 67 HZ1 LYS 67 4.595 -2.484 21.152 556 HZ2 LYS 67 HZ2 LYS 67 3.665 -1.266 20.444 557 HZ3 LYS 67 HZ3 LYS 67 5.313 -1.380 20.098 558 H ASP 68 HN ASP 68 5.542 -0.957 12.599 559 HA ASP 68 HA ASP 68 5.262 1.932 12.230 560 HB2 ASP 68 HB2 ASP 68 7.496 0.841 12.051 561 HB3 ASP 68 HB1 ASP 68 6.914 -0.138 10.706 562 H ILE 69 HN ILE 69 4.029 -1.040 10.886 563 HA ILE 69 HA ILE 69 3.352 0.007 8.283 564 HB ILE 69 HB ILE 69 2.050 -2.494 9.437 565 HG12 ILE 69 HG12 ILE 69 4.400 -2.846 9.942 566 HG13 ILE 69 HG11 ILE 69 3.983 -3.844 8.556 567 HG21 ILE 69 HG21 ILE 69 2.054 -3.226 7.074 568 HG22 ILE 69 HG22 ILE 69 2.870 -1.737 6.600 569 HG23 ILE 69 HG23 ILE 69 1.234 -1.675 7.259 570 HD11 ILE 69 HD11 ILE 69 5.510 -1.245 8.511 571 HD12 ILE 69 HD12 ILE 69 5.062 -2.186 7.085 572 HD13 ILE 69 HD13 ILE 69 6.157 -2.868 8.288 573 H ASN 70 HN ASN 70 1.526 1.026 7.703 574 HA ASN 70 HA ASN 70 -0.894 0.881 9.421 575 HB2 ASN 70 HB2 ASN 70 0.385 3.116 9.592 576 HB3 ASN 70 HB1 ASN 70 -0.002 3.372 7.892 577 HD21 ASN 70 HD21 ASN 70 -1.390 3.015 11.126 578 HD22 ASN 70 HD22 ASN 70 -2.872 3.828 10.775 579 H ALA 71 HN ALA 71 -2.887 1.483 8.122 580 HA ALA 71 HA ALA 71 -3.063 -0.074 5.743 581 HB1 ALA 71 HB1 ALA 71 -4.933 0.160 7.332 582 HB2 ALA 71 HB2 ALA 71 -5.414 0.648 5.706 583 HB3 ALA 71 HB3 ALA 71 -5.069 1.875 6.928 584 H THR 72 HN THR 72 -2.327 3.248 6.347 585 HA THR 72 HA THR 72 -2.808 4.200 3.649 586 HB THR 72 HB THR 72 -1.762 6.328 4.485 587 HG1 THR 72 HG1 THR 72 -0.354 5.858 6.041 588 HG21 THR 72 HG21 THR 72 -3.907 5.216 6.344 589 HG22 THR 72 HG22 THR 72 -4.196 6.010 4.793 590 HG23 THR 72 HG23 THR 72 -3.504 6.924 6.135 591 H SER 73 HN SER 73 -0.513 2.198 4.877 592 HA SER 73 HA SER 73 1.743 3.186 3.275 593 HB2 SER 73 HB2 SER 73 1.538 0.670 4.997 594 HB3 SER 73 HB1 SER 73 3.018 1.355 4.311 595 HG SER 73 HG SER 73 1.392 2.930 5.998 596 H ARG 74 HN ARG 74 2.700 1.781 1.641 597 HA ARG 74 HA ARG 74 1.103 -0.518 0.704 598 HB2 ARG 74 HB2 ARG 74 2.368 1.584 -1.116 599 HB3 ARG 74 HB1 ARG 74 1.727 0.033 -1.661 600 HG2 ARG 74 HG2 ARG 74 -0.511 0.794 -0.654 601 HG3 ARG 74 HG1 ARG 74 0.211 2.404 -0.569 602 HD2 ARG 74 HD2 ARG 74 -0.184 0.720 -3.064 603 HD3 ARG 74 HD1 ARG 74 -1.119 2.143 -2.610 604 HE ARG 74 HE ARG 74 1.629 2.806 -2.838 605 HH11 ARG 74 HH11 ARG 74 -1.205 2.094 -4.807 606 HH12 ARG 74 HH12 ARG 74 -0.592 2.933 -6.192 607 HH21 ARG 74 HH21 ARG 74 2.402 3.894 -4.669 608 HH22 ARG 74 HH22 ARG 74 1.444 3.947 -6.110 609 H ILE 75 HN ILE 75 2.471 -1.921 -0.746 610 HA ILE 75 HA ILE 75 5.145 -2.240 0.494 611 HB ILE 75 HB ILE 75 3.202 -4.386 -0.475 612 HG12 ILE 75 HG12 ILE 75 2.326 -3.296 1.571 613 HG13 ILE 75 HG11 ILE 75 2.824 -4.949 1.902 614 HG21 ILE 75 HG21 ILE 75 5.487 -5.137 -0.699 615 HG22 ILE 75 HG22 ILE 75 4.746 -5.968 0.665 616 HG23 ILE 75 HG23 ILE 75 5.863 -4.639 0.953 617 HD11 ILE 75 HD11 ILE 75 4.351 -2.450 2.610 618 HD12 ILE 75 HD12 ILE 75 4.891 -4.100 2.926 619 HD13 ILE 75 HD13 ILE 75 3.440 -3.482 3.713 620 H LYS 76 HN LYS 76 6.454 -1.349 -1.179 621 HA LYS 76 HA LYS 76 6.159 -2.405 -3.913 622 HB2 LYS 76 HB2 LYS 76 6.648 0.023 -3.609 623 HB3 LYS 76 HB1 LYS 76 8.196 -0.394 -2.874 624 HG2 LYS 76 HG2 LYS 76 8.936 -1.435 -4.974 625 HG3 LYS 76 HG1 LYS 76 7.363 -1.096 -5.711 626 HD2 LYS 76 HD2 LYS 76 8.988 0.558 -6.461 627 HD3 LYS 76 HD1 LYS 76 7.781 1.339 -5.444 628 HE2 LYS 76 HE2 LYS 76 9.946 2.229 -4.871 629 HE3 LYS 76 HE1 LYS 76 9.412 1.221 -3.529 630 HZ1 LYS 76 HZ1 LYS 76 10.837 -0.538 -4.319 631 HZ2 LYS 76 HZ2 LYS 76 11.742 0.873 -4.093 632 HZ3 LYS 76 HZ3 LYS 76 11.308 0.390 -5.652 633 H VAL 77 HN VAL 77 7.036 -4.283 -4.341 634 HA VAL 77 HA VAL 77 8.793 -5.608 -2.510 635 HB VAL 77 HB VAL 77 7.677 -6.481 -5.209 636 HG11 VAL 77 HG11 VAL 77 9.715 -7.766 -4.749 637 HG12 VAL 77 HG12 VAL 77 8.294 -8.794 -4.556 638 HG13 VAL 77 HG13 VAL 77 9.125 -8.163 -3.131 639 HG21 VAL 77 HG21 VAL 77 6.810 -7.206 -2.385 640 HG22 VAL 77 HG22 VAL 77 6.073 -7.777 -3.887 641 HG23 VAL 77 HG23 VAL 77 5.981 -6.071 -3.454 642 H SER 78 HN SER 78 10.888 -5.429 -2.466 643 HA SER 78 HA SER 78 12.484 -4.196 -4.514 644 HB2 SER 78 HB2 SER 78 13.309 -5.526 -1.900 645 HB3 SER 78 HB1 SER 78 14.308 -4.438 -2.873 646 HG SER 78 HG SER 78 13.136 -2.764 -2.244 647 H THR 79 HN THR 79 11.689 -7.449 -3.699 648 HA THR 79 HA THR 79 12.881 -8.534 -6.035 649 HB THR 79 HB THR 79 14.986 -8.469 -4.755 650 HG1 THR 79 HG1 THR 79 14.559 -11.178 -4.612 651 HG21 THR 79 HG21 THR 79 13.632 -10.248 -2.691 652 HG22 THR 79 HG22 THR 79 14.135 -8.574 -2.438 653 HG23 THR 79 HG23 THR 79 15.347 -9.826 -2.724 654 H GLY 80 HN GLY 80 11.773 -10.349 -6.622 655 HA2 GLY 80 HA2 GLY 80 10.743 -12.453 -5.363 656 HA3 GLY 80 HA1 GLY 80 9.587 -11.220 -4.884 657 HA PRO 81 HA PRO 81 8.076 -12.968 -8.956 658 HB2 PRO 81 HB2 PRO 81 5.560 -13.626 -8.191 659 HB3 PRO 81 HB1 PRO 81 6.935 -14.677 -7.814 660 HG2 PRO 81 HG2 PRO 81 5.585 -12.628 -6.041 661 HG3 PRO 81 HG1 PRO 81 6.022 -14.308 -5.658 662 HD2 PRO 81 HD2 PRO 81 7.579 -12.191 -4.920 663 HD3 PRO 81 HD1 PRO 81 8.268 -13.779 -5.317 664 H LEU 82 HN LEU 82 7.100 -10.493 -6.777 665 HA LEU 82 HA LEU 82 5.617 -9.005 -8.869 666 HB2 LEU 82 HB2 LEU 82 5.308 -8.874 -5.840 667 HB3 LEU 82 HB1 LEU 82 4.414 -7.893 -6.995 668 HG LEU 82 HG LEU 82 4.218 -10.924 -6.764 669 HD11 LEU 82 HD11 LEU 82 1.992 -10.528 -5.793 670 HD12 LEU 82 HD12 LEU 82 2.297 -8.792 -5.796 671 HD13 LEU 82 HD13 LEU 82 3.279 -9.862 -4.795 672 HD21 LEU 82 HD21 LEU 82 2.572 -9.000 -8.451 673 HD22 LEU 82 HD22 LEU 82 2.290 -10.736 -8.287 674 HD23 LEU 82 HD23 LEU 82 3.767 -10.156 -9.049 675 H ALA 83 HN ALA 83 8.518 -9.116 -8.382 676 HA ALA 83 HA ALA 83 9.473 -6.869 -6.931 677 HB1 ALA 83 HB1 ALA 83 10.903 -8.803 -7.490 678 HB2 ALA 83 HB2 ALA 83 11.604 -7.298 -8.082 679 HB3 ALA 83 HB3 ALA 83 10.796 -8.392 -9.205 680 H GLY 84 HN GLY 84 9.128 -4.801 -7.413 681 HA2 GLY 84 HA2 GLY 84 9.481 -2.880 -8.810 682 HA3 GLY 84 HA1 GLY 84 9.107 -3.847 -10.229 683 H ARG 85 HN ARG 85 6.902 -4.730 -7.936 684 HA ARG 85 HA ARG 85 4.841 -2.785 -8.849 685 HB2 ARG 85 HB2 ARG 85 4.454 -5.592 -7.685 686 HB3 ARG 85 HB1 ARG 85 3.188 -4.522 -8.292 687 HG2 ARG 85 HG2 ARG 85 4.108 -4.682 -10.566 688 HG3 ARG 85 HG1 ARG 85 5.418 -5.706 -9.969 689 HD2 ARG 85 HD2 ARG 85 3.771 -7.416 -9.289 690 HD3 ARG 85 HD1 ARG 85 2.462 -6.388 -9.882 691 HE ARG 85 HE ARG 85 4.411 -6.937 -11.912 692 HH11 ARG 85 HH11 ARG 85 1.625 -8.361 -10.304 693 HH12 ARG 85 HH12 ARG 85 1.206 -9.361 -11.652 694 HH21 ARG 85 HH21 ARG 85 3.872 -8.284 -13.656 695 HH22 ARG 85 HH22 ARG 85 2.491 -9.332 -13.548 696 H VAL 86 HN VAL 86 3.551 -1.741 -7.335 697 HA VAL 86 HA VAL 86 4.383 -1.928 -4.506 698 HB VAL 86 HB VAL 86 4.949 0.232 -5.491 699 HG11 VAL 86 HG11 VAL 86 2.003 0.647 -6.088 700 HG12 VAL 86 HG12 VAL 86 3.285 0.396 -7.272 701 HG13 VAL 86 HG13 VAL 86 3.275 1.858 -6.285 702 HG21 VAL 86 HG21 VAL 86 4.390 0.193 -3.108 703 HG22 VAL 86 HG22 VAL 86 2.690 0.489 -3.479 704 HG23 VAL 86 HG23 VAL 86 3.894 1.730 -3.825 705 H LEU 87 HN LEU 87 3.083 -3.503 -3.898 706 HA LEU 87 HA LEU 87 0.381 -3.933 -4.530 707 HB2 LEU 87 HB2 LEU 87 1.979 -5.016 -2.169 708 HB3 LEU 87 HB1 LEU 87 0.386 -5.584 -2.636 709 HG LEU 87 HG LEU 87 1.999 -7.194 -3.392 710 HD11 LEU 87 HD11 LEU 87 0.131 -6.838 -4.883 711 HD12 LEU 87 HD12 LEU 87 1.572 -7.287 -5.792 712 HD13 LEU 87 HD13 LEU 87 1.029 -5.605 -5.772 713 HD21 LEU 87 HD21 LEU 87 3.834 -6.750 -4.912 714 HD22 LEU 87 HD22 LEU 87 4.015 -5.793 -3.443 715 HD23 LEU 87 HD23 LEU 87 3.447 -5.025 -4.927 716 H ASN 88 HN ASN 88 -1.480 -3.350 -3.601 717 HA ASN 88 HA ASN 88 -1.433 -1.084 -1.719 718 HB2 ASN 88 HB2 ASN 88 -3.595 -2.151 -3.610 719 HB3 ASN 88 HB1 ASN 88 -3.799 -0.750 -2.561 720 HD21 ASN 88 HD21 ASN 88 -1.451 -1.951 -4.983 721 HD22 ASN 88 HD22 ASN 88 -1.226 -0.434 -5.764 722 H ILE 89 HN ILE 89 -2.393 -1.231 0.336 723 HA ILE 89 HA ILE 89 -2.874 -3.928 1.330 724 HB ILE 89 HB ILE 89 -2.933 -1.241 2.787 725 HG12 ILE 89 HG12 ILE 89 -0.777 -3.397 2.669 726 HG13 ILE 89 HG11 ILE 89 -0.678 -1.779 1.980 727 HG21 ILE 89 HG21 ILE 89 -2.898 -2.522 4.909 728 HG22 ILE 89 HG22 ILE 89 -3.023 -4.036 4.014 729 HG23 ILE 89 HG23 ILE 89 -4.357 -2.882 3.982 730 HD11 ILE 89 HD11 ILE 89 -0.777 -2.479 4.921 731 HD12 ILE 89 HD12 ILE 89 -0.759 -0.832 4.265 732 HD13 ILE 89 HD13 ILE 89 0.620 -1.902 4.008 733 H ILE 90 HN ILE 90 -4.799 -4.836 1.623 734 HA ILE 90 HA ILE 90 -7.278 -3.265 1.316 735 HB ILE 90 HB ILE 90 -8.288 -5.766 1.463 736 HG12 ILE 90 HG12 ILE 90 -5.602 -6.309 0.136 737 HG13 ILE 90 HG11 ILE 90 -5.940 -6.758 1.794 738 HG21 ILE 90 HG21 ILE 90 -8.688 -4.245 -0.397 739 HG22 ILE 90 HG22 ILE 90 -8.321 -5.860 -1.001 740 HG23 ILE 90 HG23 ILE 90 -7.091 -4.598 -1.068 741 HD11 ILE 90 HD11 ILE 90 -7.779 -8.210 0.972 742 HD12 ILE 90 HD12 ILE 90 -6.185 -8.657 0.365 743 HD13 ILE 90 HD13 ILE 90 -7.310 -7.790 -0.678 744 H GLY 91 HN GLY 91 -8.009 -2.456 3.154 745 HA2 GLY 91 HA2 GLY 91 -9.185 -2.585 5.177 746 HA3 GLY 91 HA1 GLY 91 -8.470 -4.158 5.498 747 H GLN 92 HN GLN 92 -6.434 -4.286 6.455 748 HA GLN 92 HA GLN 92 -4.772 -2.066 7.114 749 HB2 GLN 92 HB2 GLN 92 -5.129 -2.031 9.571 750 HB3 GLN 92 HB1 GLN 92 -6.586 -1.543 8.713 751 HG2 GLN 92 HG2 GLN 92 -7.609 -3.731 9.115 752 HG3 GLN 92 HG1 GLN 92 -6.120 -4.312 9.863 753 HE21 GLN 92 HE21 GLN 92 -8.847 -2.126 10.248 754 HE22 GLN 92 HE22 GLN 92 -8.694 -1.944 11.956 755 HA PRO 93 HA PRO 93 -1.829 -5.440 7.675 756 HB2 PRO 93 HB2 PRO 93 -0.270 -4.502 9.792 757 HB3 PRO 93 HB1 PRO 93 -0.089 -3.981 8.115 758 HG2 PRO 93 HG2 PRO 93 -1.634 -2.668 10.348 759 HG3 PRO 93 HG1 PRO 93 -0.508 -1.924 9.188 760 HD2 PRO 93 HD2 PRO 93 -3.129 -1.703 8.801 761 HD3 PRO 93 HD1 PRO 93 -2.069 -2.051 7.411 762 H LEU 94 HN LEU 94 -2.223 -7.381 8.582 763 HA LEU 94 HA LEU 94 -3.794 -7.556 11.085 764 HB2 LEU 94 HB2 LEU 94 -4.772 -8.404 8.906 765 HB3 LEU 94 HB1 LEU 94 -3.511 -9.608 8.841 766 HG LEU 94 HG LEU 94 -5.810 -10.406 9.585 767 HD11 LEU 94 HD11 LEU 94 -5.025 -11.962 11.272 768 HD12 LEU 94 HD12 LEU 94 -3.564 -10.997 11.516 769 HD13 LEU 94 HD13 LEU 94 -3.856 -11.792 9.965 770 HD21 LEU 94 HD21 LEU 94 -6.515 -10.048 11.897 771 HD22 LEU 94 HD22 LEU 94 -6.435 -8.527 11.011 772 HD23 LEU 94 HD23 LEU 94 -5.159 -8.947 12.157 773 HA PRO 95 HA PRO 95 0.137 -9.273 12.741 774 HB2 PRO 95 HB2 PRO 95 -1.302 -9.295 15.355 775 HB3 PRO 95 HB1 PRO 95 0.172 -8.435 14.887 776 HG2 PRO 95 HG2 PRO 95 -2.143 -7.116 15.273 777 HG3 PRO 95 HG1 PRO 95 -0.995 -6.622 14.009 778 HD2 PRO 95 HD2 PRO 95 -3.522 -8.271 13.719 779 HD3 PRO 95 HD1 PRO 95 -2.965 -6.882 12.751 780 H ASP 96 HN ASP 96 0.856 -11.209 13.616 781 HA ASP 96 HA ASP 96 -0.629 -13.588 13.046 782 HB2 ASP 96 HB2 ASP 96 1.799 -13.473 12.753 783 HB3 ASP 96 HB1 ASP 96 2.028 -13.086 14.450 784 H ALA 97 HN ALA 97 -1.181 -15.281 14.578 785 HA ALA 97 HA ALA 97 -2.550 -14.400 16.908 786 HB1 ALA 97 HB1 ALA 97 -3.062 -16.770 17.283 787 HB2 ALA 97 HB2 ALA 97 -1.844 -17.236 16.089 788 HB3 ALA 97 HB3 ALA 97 -3.277 -16.339 15.587 789 H ALA 98 HN ALA 98 0.578 -16.073 16.482 790 HA ALA 98 HA ALA 98 1.202 -16.007 19.340 791 HB1 ALA 98 HB1 ALA 98 3.379 -16.969 18.658 792 HB2 ALA 98 HB2 ALA 98 2.954 -16.743 16.959 793 HB3 ALA 98 HB3 ALA 98 2.037 -17.876 17.955 794 H ARG 99 HN ARG 99 1.196 -13.774 16.856 795 HA ARG 99 HA ARG 99 1.916 -11.674 16.503 796 HB2 ARG 99 HB2 ARG 99 2.393 -11.818 19.494 797 HB3 ARG 99 HB1 ARG 99 2.823 -10.379 18.586 798 HG2 ARG 99 HG2 ARG 99 0.707 -9.892 19.485 799 HG3 ARG 99 HG1 ARG 99 0.380 -10.302 17.802 800 HD2 ARG 99 HD2 ARG 99 -0.342 -12.554 18.492 801 HD3 ARG 99 HD1 ARG 99 0.018 -12.160 20.176 802 HE ARG 99 HE ARG 99 -1.797 -10.271 19.082 803 HH11 ARG 99 HH11 ARG 99 -1.767 -13.606 20.238 804 HH12 ARG 99 HH12 ARG 99 -3.442 -13.579 20.681 805 HH21 ARG 99 HH21 ARG 99 -3.959 -10.264 19.676 806 HH22 ARG 99 HH22 ARG 99 -4.688 -11.681 20.363 807 H THR 100 HN THR 100 3.797 -13.945 16.166 808 HA THR 100 HA THR 100 6.434 -12.828 16.718 809 HB THR 100 HB THR 100 5.981 -15.277 16.988 810 HG1 THR 100 HG1 THR 100 8.067 -14.148 15.590 811 HG21 THR 100 HG21 THR 100 5.941 -16.741 15.002 812 HG22 THR 100 HG22 THR 100 5.852 -15.323 13.955 813 HG23 THR 100 HG23 THR 100 4.523 -15.692 15.057 814 H ARG 101 HN ARG 101 4.176 -12.271 14.366 815 HA ARG 101 HA ARG 101 5.954 -11.046 12.526 816 HB2 ARG 101 HB2 ARG 101 5.419 -12.435 10.504 817 HB3 ARG 101 HB1 ARG 101 6.376 -13.287 11.696 818 HG2 ARG 101 HG2 ARG 101 4.912 -14.965 11.156 819 HG3 ARG 101 HG1 ARG 101 4.012 -14.222 12.472 820 HD2 ARG 101 HD2 ARG 101 2.738 -12.907 10.696 821 HD3 ARG 101 HD1 ARG 101 3.525 -13.937 9.488 822 HE ARG 101 HE ARG 101 2.277 -15.475 11.552 823 HH11 ARG 101 HH11 ARG 101 1.554 -13.856 8.524 824 HH12 ARG 101 HH12 ARG 101 0.047 -14.685 8.314 825 HH21 ARG 101 HH21 ARG 101 0.305 -16.489 11.299 826 HH22 ARG 101 HH22 ARG 101 -0.667 -16.166 9.896 827 H LEU 102 HN LEU 102 4.759 -10.016 10.741 828 HA LEU 102 HA LEU 102 1.955 -9.370 11.421 829 HB2 LEU 102 HB2 LEU 102 4.164 -7.631 11.347 830 HB3 LEU 102 HB1 LEU 102 3.491 -7.410 9.754 831 HG LEU 102 HG LEU 102 2.593 -5.672 11.070 832 HD11 LEU 102 HD11 LEU 102 0.930 -6.722 9.647 833 HD12 LEU 102 HD12 LEU 102 0.198 -6.020 11.084 834 HD13 LEU 102 HD13 LEU 102 0.424 -7.769 10.972 835 HD21 LEU 102 HD21 LEU 102 1.489 -5.953 13.251 836 HD22 LEU 102 HD22 LEU 102 3.167 -6.498 13.286 837 HD23 LEU 102 HD23 LEU 102 1.859 -7.682 13.214 838 H GLU 103 HN GLU 103 0.580 -10.256 9.899 839 HA GLU 103 HA GLU 103 1.550 -10.846 7.199 840 HB2 GLU 103 HB2 GLU 103 0.172 -12.557 8.367 841 HB3 GLU 103 HB1 GLU 103 -1.190 -11.447 8.394 842 HG2 GLU 103 HG2 GLU 103 -1.300 -11.472 5.947 843 HG3 GLU 103 HG1 GLU 103 0.153 -12.460 5.863 844 H ILE 104 HN ILE 104 1.598 -9.138 5.948 845 HA ILE 104 HA ILE 104 -0.375 -6.993 6.071 846 HB ILE 104 HB ILE 104 1.948 -7.175 4.096 847 HG12 ILE 104 HG12 ILE 104 2.980 -7.466 6.298 848 HG13 ILE 104 HG11 ILE 104 3.348 -5.856 5.697 849 HG21 ILE 104 HG21 ILE 104 0.444 -4.795 5.244 850 HG22 ILE 104 HG22 ILE 104 0.264 -5.464 3.621 851 HG23 ILE 104 HG23 ILE 104 1.784 -4.705 4.095 852 HD11 ILE 104 HD11 ILE 104 2.873 -5.753 8.026 853 HD12 ILE 104 HD12 ILE 104 1.342 -6.594 7.813 854 HD13 ILE 104 HD13 ILE 104 1.551 -4.967 7.163 855 H LEU 105 HN LEU 105 -2.253 -7.803 5.180 856 HA LEU 105 HA LEU 105 -2.185 -9.330 2.699 857 HB2 LEU 105 HB2 LEU 105 -4.568 -9.576 2.824 858 HB3 LEU 105 HB1 LEU 105 -3.919 -9.903 4.417 859 HG LEU 105 HG LEU 105 -5.230 -7.264 3.664 860 HD11 LEU 105 HD11 LEU 105 -6.868 -9.037 3.383 861 HD12 LEU 105 HD12 LEU 105 -7.250 -8.064 4.800 862 HD13 LEU 105 HD13 LEU 105 -6.521 -9.662 4.999 863 HD21 LEU 105 HD21 LEU 105 -5.445 -6.935 6.092 864 HD22 LEU 105 HD22 LEU 105 -3.760 -7.100 5.610 865 HD23 LEU 105 HD23 LEU 105 -4.588 -8.453 6.385 866 H CYS 106 HN CYS 106 -2.887 -8.605 0.766 867 HA CYS 106 HA CYS 106 -3.285 -5.796 0.196 868 HB2 CYS 106 HB2 CYS 106 -0.634 -7.119 -0.577 869 HB3 CYS 106 HB1 CYS 106 -1.183 -5.538 -1.130 870 HG CYS 106 HG CYS 106 -0.123 -6.438 1.973 871 H ARG 107 HN ARG 107 -3.007 -5.570 -2.329 872 HA ARG 107 HA ARG 107 -3.062 -8.063 -3.835 873 HB2 ARG 107 HB2 ARG 107 -5.097 -7.726 -5.034 874 HB3 ARG 107 HB1 ARG 107 -5.518 -7.504 -3.346 875 HG2 ARG 107 HG2 ARG 107 -5.116 -5.275 -5.381 876 HG3 ARG 107 HG1 ARG 107 -6.670 -5.894 -4.819 877 HD2 ARG 107 HD2 ARG 107 -6.108 -5.149 -2.519 878 HD3 ARG 107 HD1 ARG 107 -4.587 -4.479 -3.122 879 HE ARG 107 HE ARG 107 -6.651 -3.371 -4.639 880 HH11 ARG 107 HH11 ARG 107 -5.500 -3.244 -1.312 881 HH12 ARG 107 HH12 ARG 107 -6.194 -1.683 -1.012 882 HH21 ARG 107 HH21 ARG 107 -7.540 -1.337 -4.221 883 HH22 ARG 107 HH22 ARG 107 -7.340 -0.602 -2.666 884 H GLU 108 HN GLU 108 -2.681 -7.701 -6.130 885 HA GLU 108 HA GLU 108 -0.771 -5.783 -6.759 886 HB2 GLU 108 HB2 GLU 108 -1.608 -8.079 -7.935 887 HB3 GLU 108 HB1 GLU 108 -2.398 -6.936 -9.009 888 HG2 GLU 108 HG2 GLU 108 0.577 -7.107 -8.426 889 HG3 GLU 108 HG1 GLU 108 -0.231 -7.678 -9.878 890 H GLY 109 HN GLY 109 -0.799 -3.829 -7.822 891 HA2 GLY 109 HA2 GLY 109 -3.228 -2.279 -7.360 892 HA3 GLY 109 HA1 GLY 109 -1.614 -1.660 -7.662 893 H ALA 110 HN ALA 110 -2.899 -4.071 -9.837 894 HA ALA 110 HA ALA 110 -3.175 -2.304 -12.069 895 HB1 ALA 110 HB1 ALA 110 -2.708 -4.703 -12.383 896 HB2 ALA 110 HB2 ALA 110 -4.197 -4.249 -13.207 897 HB3 ALA 110 HB3 ALA 110 -4.269 -5.123 -11.676 898 H GLU 111 HN GLU 111 -4.609 -0.680 -11.825 899 HA GLU 111 HA GLU 111 -6.807 -0.684 -10.045 900 HB2 GLU 111 HB2 GLU 111 -6.179 1.274 -12.294 901 HB3 GLU 111 HB1 GLU 111 -7.270 1.570 -10.943 902 HG2 GLU 111 HG2 GLU 111 -5.400 1.465 -9.365 903 HG3 GLU 111 HG1 GLU 111 -4.283 1.064 -10.669 904 H LYS 112 HN LYS 112 -8.343 -2.166 -10.465 905 HA LYS 112 HA LYS 112 -10.083 -1.937 -12.774 906 HB2 LYS 112 HB2 LYS 112 -8.260 -3.439 -13.595 907 HB3 LYS 112 HB1 LYS 112 -8.515 -4.506 -12.219 908 HG2 LYS 112 HG2 LYS 112 -10.832 -4.965 -13.067 909 HG3 LYS 112 HG1 LYS 112 -10.461 -3.986 -14.494 910 HD2 LYS 112 HD2 LYS 112 -8.639 -5.551 -15.097 911 HD3 LYS 112 HD1 LYS 112 -8.970 -6.507 -13.648 912 HE2 LYS 112 HE2 LYS 112 -11.242 -7.013 -14.533 913 HE3 LYS 112 HE1 LYS 112 -10.862 -6.101 -15.998 914 HZ1 LYS 112 HZ1 LYS 112 -10.552 -8.457 -16.331 915 HZ2 LYS 112 HZ2 LYS 112 -9.465 -8.538 -15.041 916 HZ3 LYS 112 HZ3 LYS 112 -9.060 -7.667 -16.432 Start of MODEL 7 1 H1 MET 1 HT1 MET 1 14.818 -21.508 16.137 2 H2 MET 1 HT2 MET 1 15.184 -19.926 16.587 3 H3 MET 1 HT3 MET 1 16.159 -21.195 17.112 4 HA MET 1 HA MET 1 17.176 -19.931 15.327 5 HB2 MET 1 HB2 MET 1 16.383 -22.775 14.562 6 HB3 MET 1 HB1 MET 1 17.756 -21.890 13.898 7 HG2 MET 1 HG2 MET 1 17.414 -22.727 16.792 8 HG3 MET 1 HG1 MET 1 18.470 -23.493 15.605 9 HE1 MET 1 HE1 MET 1 20.765 -22.433 14.740 10 HE2 MET 1 HE2 MET 1 21.235 -20.763 15.065 11 HE3 MET 1 HE3 MET 1 19.826 -21.102 14.058 12 H ASN 2 HN ASN 2 13.967 -19.940 15.062 13 HA ASN 2 HA ASN 2 13.517 -20.094 12.233 14 HB2 ASN 2 HB2 ASN 2 11.712 -20.609 13.835 15 HB3 ASN 2 HB1 ASN 2 11.750 -18.957 14.443 16 HD21 ASN 2 HD21 ASN 2 9.634 -18.487 13.871 17 HD22 ASN 2 HD22 ASN 2 9.095 -18.350 12.237 18 H ILE 3 HN ILE 3 14.744 -18.635 11.125 19 HA ILE 3 HA ILE 3 13.981 -15.771 11.348 20 HB ILE 3 HB ILE 3 16.687 -16.835 10.361 21 HG12 ILE 3 HG12 ILE 3 16.068 -15.340 12.954 22 HG13 ILE 3 HG11 ILE 3 16.493 -17.044 12.837 23 HG21 ILE 3 HG21 ILE 3 17.385 -14.471 10.235 24 HG22 ILE 3 HG22 ILE 3 15.780 -13.953 10.746 25 HG23 ILE 3 HG23 ILE 3 15.993 -14.766 9.195 26 HD11 ILE 3 HD11 ILE 3 18.385 -15.757 13.585 27 HD12 ILE 3 HD12 ILE 3 18.285 -14.702 12.177 28 HD13 ILE 3 HD13 ILE 3 18.720 -16.403 11.978 29 H GLY 4 HN GLY 4 14.429 -18.640 9.423 30 HA2 GLY 4 HA2 GLY 4 14.651 -17.376 6.847 31 HA3 GLY 4 HA1 GLY 4 14.578 -19.094 7.178 32 H ARG 5 HN ARG 5 11.952 -17.191 8.461 33 HA ARG 5 HA ARG 5 10.025 -18.147 6.543 34 HB2 ARG 5 HB2 ARG 5 9.788 -15.884 8.586 35 HB3 ARG 5 HB1 ARG 5 8.446 -16.561 7.669 36 HG2 ARG 5 HG2 ARG 5 10.106 -18.035 9.735 37 HG3 ARG 5 HG1 ARG 5 8.489 -17.376 9.993 38 HD2 ARG 5 HD2 ARG 5 7.608 -18.934 8.274 39 HD3 ARG 5 HD1 ARG 5 9.239 -19.587 8.047 40 HE ARG 5 HE ARG 5 7.755 -19.761 10.624 41 HH11 ARG 5 HH11 ARG 5 9.797 -21.300 8.203 42 HH12 ARG 5 HH12 ARG 5 9.960 -22.766 9.109 43 HH21 ARG 5 HH21 ARG 5 8.030 -21.684 11.800 44 HH22 ARG 5 HH22 ARG 5 8.958 -22.982 11.130 45 H LEU 6 HN LEU 6 11.856 -15.187 7.093 46 HA LEU 6 HA LEU 6 10.488 -13.765 4.899 47 HB2 LEU 6 HB2 LEU 6 12.403 -12.575 6.946 48 HB3 LEU 6 HB1 LEU 6 11.324 -11.724 5.869 49 HG LEU 6 HG LEU 6 10.304 -11.476 7.942 50 HD11 LEU 6 HD11 LEU 6 8.691 -12.219 6.291 51 HD12 LEU 6 HD12 LEU 6 8.228 -12.701 7.921 52 HD13 LEU 6 HD13 LEU 6 8.903 -13.897 6.811 53 HD21 LEU 6 HD21 LEU 6 10.880 -14.376 8.604 54 HD22 LEU 6 HD22 LEU 6 10.018 -13.228 9.633 55 HD23 LEU 6 HD23 LEU 6 11.711 -12.948 9.241 56 H ARG 7 HN ARG 7 11.566 -14.798 3.197 57 HA ARG 7 HA ARG 7 14.490 -14.494 2.949 58 HB2 ARG 7 HB2 ARG 7 12.600 -16.261 1.345 59 HB3 ARG 7 HB1 ARG 7 14.357 -16.215 1.178 60 HG2 ARG 7 HG2 ARG 7 14.562 -17.008 3.538 61 HG3 ARG 7 HG1 ARG 7 12.803 -17.151 3.617 62 HD2 ARG 7 HD2 ARG 7 12.852 -18.812 1.795 63 HD3 ARG 7 HD1 ARG 7 14.607 -18.649 1.674 64 HE ARG 7 HE ARG 7 13.117 -20.162 3.610 65 HH11 ARG 7 HH11 ARG 7 16.168 -18.492 3.139 66 HH12 ARG 7 HH12 ARG 7 17.005 -19.463 4.300 67 HH21 ARG 7 HH21 ARG 7 14.228 -21.395 5.151 68 HH22 ARG 7 HH22 ARG 7 15.912 -21.106 5.445 69 H ASP 8 HN ASP 8 11.698 -12.966 1.902 70 HA ASP 8 HA ASP 8 12.886 -11.978 -0.615 71 HB2 ASP 8 HB2 ASP 8 10.041 -11.587 0.449 72 HB3 ASP 8 HB1 ASP 8 10.645 -11.090 -1.128 73 H ARG 9 HN ARG 9 12.105 -9.548 -0.889 74 HA ARG 9 HA ARG 9 12.132 -8.055 1.652 75 HB2 ARG 9 HB2 ARG 9 13.589 -7.183 -0.880 76 HB3 ARG 9 HB1 ARG 9 13.397 -6.212 0.581 77 HG2 ARG 9 HG2 ARG 9 14.738 -7.915 1.822 78 HG3 ARG 9 HG1 ARG 9 15.005 -8.765 0.294 79 HD2 ARG 9 HD2 ARG 9 15.901 -5.952 1.008 80 HD3 ARG 9 HD1 ARG 9 16.919 -7.369 0.769 81 HE ARG 9 HE ARG 9 15.324 -6.645 -1.540 82 HH11 ARG 9 HH11 ARG 9 18.438 -6.236 0.013 83 HH12 ARG 9 HH12 ARG 9 19.188 -5.580 -1.404 84 HH21 ARG 9 HH21 ARG 9 16.308 -5.773 -3.377 85 HH22 ARG 9 HH22 ARG 9 17.984 -5.324 -3.324 86 H ILE 10 HN ILE 10 10.931 -6.220 1.644 87 HA ILE 10 HA ILE 10 9.431 -5.381 -0.757 88 HB ILE 10 HB ILE 10 7.419 -4.904 0.631 89 HG12 ILE 10 HG12 ILE 10 8.527 -6.629 2.871 90 HG13 ILE 10 HG11 ILE 10 8.876 -4.914 2.839 91 HG21 ILE 10 HG21 ILE 10 8.190 -7.839 0.647 92 HG22 ILE 10 HG22 ILE 10 7.422 -6.959 -0.676 93 HG23 ILE 10 HG23 ILE 10 6.550 -7.211 0.837 94 HD11 ILE 10 HD11 ILE 10 7.070 -5.364 4.293 95 HD12 ILE 10 HD12 ILE 10 6.168 -6.172 3.006 96 HD13 ILE 10 HD13 ILE 10 6.485 -4.435 2.908 97 H THR 11 HN THR 11 8.780 -3.138 -0.551 98 HA THR 11 HA THR 11 10.429 -1.534 1.298 99 HB THR 11 HB THR 11 9.495 -0.759 -1.511 100 HG1 THR 11 HG1 THR 11 12.079 -1.608 -0.628 101 HG21 THR 11 HG21 THR 11 11.536 0.523 0.354 102 HG22 THR 11 HG22 THR 11 9.925 1.168 0.012 103 HG23 THR 11 HG23 THR 11 11.134 1.075 -1.274 104 H ILE 12 HN ILE 12 9.210 -0.404 2.683 105 HA ILE 12 HA ILE 12 6.354 -0.229 2.519 106 HB ILE 12 HB ILE 12 8.247 1.273 4.393 107 HG12 ILE 12 HG12 ILE 12 8.568 -1.080 4.775 108 HG13 ILE 12 HG11 ILE 12 7.549 -0.498 6.085 109 HG21 ILE 12 HG21 ILE 12 6.259 1.584 5.868 110 HG22 ILE 12 HG22 ILE 12 5.232 0.882 4.616 111 HG23 ILE 12 HG23 ILE 12 6.075 2.407 4.316 112 HD11 ILE 12 HD11 ILE 12 6.763 -2.621 5.360 113 HD12 ILE 12 HD12 ILE 12 6.706 -2.097 3.680 114 HD13 ILE 12 HD13 ILE 12 5.585 -1.410 4.858 115 H GLN 13 HN GLN 13 5.805 0.828 0.671 116 HA GLN 13 HA GLN 13 6.958 3.307 -0.177 117 HB2 GLN 13 HB2 GLN 13 5.780 1.498 -1.642 118 HB3 GLN 13 HB1 GLN 13 4.273 2.201 -1.080 119 HG2 GLN 13 HG2 GLN 13 4.584 3.305 -3.090 120 HG3 GLN 13 HG1 GLN 13 5.268 4.448 -1.948 121 HE21 GLN 13 HE21 GLN 13 6.033 2.022 -4.363 122 HE22 GLN 13 HE22 GLN 13 7.623 2.597 -4.702 123 H THR 14 HN THR 14 6.756 4.881 1.086 124 HA THR 14 HA THR 14 4.656 5.218 3.032 125 HB THR 14 HB THR 14 7.106 6.969 2.563 126 HG1 THR 14 HG1 THR 14 7.168 4.440 3.078 127 HG21 THR 14 HG21 THR 14 5.421 7.894 4.115 128 HG22 THR 14 HG22 THR 14 6.910 7.448 4.956 129 HG23 THR 14 HG23 THR 14 5.489 6.406 5.054 130 H LEU 15 HN LEU 15 3.155 6.969 3.095 131 HA LEU 15 HA LEU 15 2.929 8.533 0.601 132 HB2 LEU 15 HB2 LEU 15 0.982 7.119 1.214 133 HB3 LEU 15 HB1 LEU 15 0.826 7.995 2.726 134 HG LEU 15 HG LEU 15 0.317 10.084 1.487 135 HD11 LEU 15 HD11 LEU 15 1.557 9.783 -0.541 136 HD12 LEU 15 HD12 LEU 15 -0.136 9.949 -0.973 137 HD13 LEU 15 HD13 LEU 15 0.614 8.365 -0.983 138 HD21 LEU 15 HD21 LEU 15 -1.915 9.458 0.682 139 HD22 LEU 15 HD22 LEU 15 -1.532 8.647 2.199 140 HD23 LEU 15 HD23 LEU 15 -1.449 7.754 0.677 141 H LYS 16 HN LYS 16 4.233 10.239 0.978 142 HA LYS 16 HA LYS 16 4.046 11.912 3.335 143 HB2 LYS 16 HB2 LYS 16 6.218 11.665 2.207 144 HB3 LYS 16 HB1 LYS 16 5.534 12.240 0.693 145 HG2 LYS 16 HG2 LYS 16 5.159 14.470 1.705 146 HG3 LYS 16 HG1 LYS 16 5.845 13.894 3.226 147 HD2 LYS 16 HD2 LYS 16 7.467 15.224 1.894 148 HD3 LYS 16 HD1 LYS 16 8.027 13.575 2.179 149 HE2 LYS 16 HE2 LYS 16 7.361 12.947 -0.119 150 HE3 LYS 16 HE1 LYS 16 6.755 14.580 -0.405 151 HZ1 LYS 16 HZ1 LYS 16 9.563 13.857 0.193 152 HZ2 LYS 16 HZ2 LYS 16 8.989 15.418 -0.097 153 HZ3 LYS 16 HZ3 LYS 16 8.947 14.262 -1.325 154 H GLN 17 HN GLN 17 2.110 12.920 3.488 155 HA GLN 17 HA GLN 17 0.699 14.149 1.295 156 HB2 GLN 17 HB2 GLN 17 0.379 14.455 4.322 157 HB3 GLN 17 HB1 GLN 17 -0.728 15.131 3.129 158 HG2 GLN 17 HG2 GLN 17 -1.276 12.847 2.350 159 HG3 GLN 17 HG1 GLN 17 -0.166 12.181 3.544 160 HE21 GLN 17 HE21 GLN 17 -3.257 13.767 3.072 161 HE22 GLN 17 HE22 GLN 17 -3.888 13.448 4.648 162 H THR 18 HN THR 18 2.062 15.601 0.282 163 HA THR 18 HA THR 18 3.769 17.416 1.804 164 HB THR 18 HB THR 18 3.571 17.107 -1.235 165 HG1 THR 18 HG1 THR 18 4.224 15.118 -0.591 166 HG21 THR 18 HG21 THR 18 5.858 18.050 -1.225 167 HG22 THR 18 HG22 THR 18 5.803 18.184 0.534 168 HG23 THR 18 HG23 THR 18 4.721 19.166 -0.457 169 H ARG 19 HN ARG 19 2.842 19.329 2.421 170 HA ARG 19 HA ARG 19 0.570 20.452 1.106 171 HB2 ARG 19 HB2 ARG 19 1.057 20.632 3.575 172 HB3 ARG 19 HB1 ARG 19 2.339 21.779 3.197 173 HG2 ARG 19 HG2 ARG 19 0.804 23.415 2.404 174 HG3 ARG 19 HG1 ARG 19 -0.507 22.246 2.269 175 HD2 ARG 19 HD2 ARG 19 -0.929 23.691 4.146 176 HD3 ARG 19 HD1 ARG 19 -0.568 22.070 4.742 177 HE ARG 19 HE ARG 19 1.825 23.133 4.978 178 HH11 ARG 19 HH11 ARG 19 -1.221 24.716 5.679 179 HH12 ARG 19 HH12 ARG 19 -0.577 25.669 6.971 180 HH21 ARG 19 HH21 ARG 19 2.681 24.399 6.660 181 HH22 ARG 19 HH22 ARG 19 1.652 25.480 7.541 182 H ASP 20 HN ASP 20 0.494 22.572 0.153 183 HA ASP 20 HA ASP 20 2.917 23.233 -1.436 184 HB2 ASP 20 HB2 ASP 20 0.971 22.180 -2.721 185 HB3 ASP 20 HB1 ASP 20 -0.002 23.582 -2.298 186 H ILE 21 HN ILE 21 2.988 25.550 -2.110 187 HA ILE 21 HA ILE 21 2.435 27.364 0.020 188 HB ILE 21 HB ILE 21 4.473 27.397 -1.456 189 HG12 ILE 21 HG12 ILE 21 2.936 30.037 -1.354 190 HG13 ILE 21 HG11 ILE 21 3.900 29.366 -0.045 191 HG21 ILE 21 HG21 ILE 21 3.387 26.996 -3.632 192 HG22 ILE 21 HG22 ILE 21 4.396 28.443 -3.679 193 HG23 ILE 21 HG23 ILE 21 2.639 28.595 -3.564 194 HD11 ILE 21 HD11 ILE 21 5.105 31.122 -1.150 195 HD12 ILE 21 HD12 ILE 21 4.912 30.330 -2.712 196 HD13 ILE 21 HD13 ILE 21 5.909 29.584 -1.459 197 H THR 22 HN THR 22 0.232 26.148 -2.102 198 HA THR 22 HA THR 22 -1.395 28.612 -2.284 199 HB THR 22 HB THR 22 -2.920 27.174 -3.691 200 HG1 THR 22 HG1 THR 22 -1.135 25.199 -4.226 201 HG21 THR 22 HG21 THR 22 -1.206 28.534 -4.856 202 HG22 THR 22 HG22 THR 22 -1.481 27.007 -5.694 203 HG23 THR 22 HG23 THR 22 -0.043 27.212 -4.694 204 H GLY 23 HN GLY 23 -0.779 25.840 -0.507 205 HA2 GLY 23 HA2 GLY 23 -1.610 25.248 1.608 206 HA3 GLY 23 HA1 GLY 23 -3.045 26.219 1.318 207 H GLU 24 HN GLU 24 -1.761 23.775 -0.906 208 HA GLU 24 HA GLU 24 -4.182 22.127 -0.552 209 HB2 GLU 24 HB2 GLU 24 -2.137 22.251 -2.810 210 HB3 GLU 24 HB1 GLU 24 -3.469 21.097 -2.735 211 HG2 GLU 24 HG2 GLU 24 -5.085 22.957 -2.828 212 HG3 GLU 24 HG1 GLU 24 -3.744 24.108 -2.909 213 H ILE 25 HN ILE 25 -3.816 19.735 -0.794 214 HA ILE 25 HA ILE 25 -1.302 18.823 0.495 215 HB ILE 25 HB ILE 25 -4.088 17.565 0.632 216 HG12 ILE 25 HG12 ILE 25 -3.901 19.596 2.055 217 HG13 ILE 25 HG11 ILE 25 -4.040 18.149 3.045 218 HG21 ILE 25 HG21 ILE 25 -3.089 15.949 2.232 219 HG22 ILE 25 HG22 ILE 25 -1.493 16.632 1.916 220 HG23 ILE 25 HG23 ILE 25 -2.376 15.818 0.622 221 HD11 ILE 25 HD11 ILE 25 -1.509 19.695 2.494 222 HD12 ILE 25 HD12 ILE 25 -1.630 18.231 3.476 223 HD13 ILE 25 HD13 ILE 25 -2.456 19.702 3.982 224 H LEU 26 HN LEU 26 -0.053 18.143 -1.106 225 HA LEU 26 HA LEU 26 -1.038 16.573 -3.384 226 HB2 LEU 26 HB2 LEU 26 1.667 17.916 -2.880 227 HB3 LEU 26 HB1 LEU 26 1.322 16.896 -4.267 228 HG LEU 26 HG LEU 26 -0.428 18.559 -4.988 229 HD11 LEU 26 HD11 LEU 26 0.682 20.280 -2.760 230 HD12 LEU 26 HD12 LEU 26 -0.952 19.624 -2.869 231 HD13 LEU 26 HD13 LEU 26 -0.411 20.831 -4.031 232 HD21 LEU 26 HD21 LEU 26 1.170 20.218 -5.865 233 HD22 LEU 26 HD22 LEU 26 1.791 18.574 -6.009 234 HD23 LEU 26 HD23 LEU 26 2.397 19.634 -4.734 235 H GLU 27 HN GLU 27 -1.300 14.562 -2.559 236 HA GLU 27 HA GLU 27 0.511 13.374 -0.650 237 HB2 GLU 27 HB2 GLU 27 -1.861 12.195 -2.170 238 HB3 GLU 27 HB1 GLU 27 -1.033 11.437 -0.814 239 HG2 GLU 27 HG2 GLU 27 -1.723 13.252 0.665 240 HG3 GLU 27 HG1 GLU 27 -2.510 14.073 -0.676 241 H THR 28 HN THR 28 2.272 12.304 -1.167 242 HA THR 28 HA THR 28 2.782 11.300 -3.904 243 HB THR 28 HB THR 28 5.206 12.134 -3.539 244 HG1 THR 28 HG1 THR 28 4.323 12.754 -1.179 245 HG21 THR 28 HG21 THR 28 3.691 13.231 -5.138 246 HG22 THR 28 HG22 THR 28 4.706 14.428 -4.330 247 HG23 THR 28 HG23 THR 28 3.019 14.233 -3.843 248 H TRP 29 HN TRP 29 4.335 9.595 -4.028 249 HA TRP 29 HA TRP 29 4.439 7.941 -1.575 250 HB2 TRP 29 HB2 TRP 29 4.315 7.075 -4.501 251 HB3 TRP 29 HB1 TRP 29 4.461 5.978 -3.131 252 HD1 TRP 29 HD1 TRP 29 1.871 8.021 -5.047 253 HE1 TRP 29 HE1 TRP 29 -0.473 7.464 -4.140 254 HE3 TRP 29 HE3 TRP 29 3.198 5.323 -0.894 255 HZ2 TRP 29 HZ2 TRP 29 -1.617 6.103 -1.959 256 HZ3 TRP 29 HZ3 TRP 29 1.412 4.443 0.561 257 HH2 TRP 29 HH2 TRP 29 -0.950 4.827 0.038 258 H GLU 30 HN GLU 30 6.352 8.076 -0.746 259 HA GLU 30 HA GLU 30 8.817 7.999 -2.408 260 HB2 GLU 30 HB2 GLU 30 10.014 8.866 -0.433 261 HB3 GLU 30 HB1 GLU 30 8.722 9.954 -0.914 262 HG2 GLU 30 HG2 GLU 30 7.331 9.214 0.937 263 HG3 GLU 30 HG1 GLU 30 8.524 7.989 1.386 264 H ASP 31 HN ASP 31 10.272 6.332 -2.083 265 HA ASP 31 HA ASP 31 9.248 3.884 -0.962 266 HB2 ASP 31 HB2 ASP 31 11.450 2.883 -1.651 267 HB3 ASP 31 HB1 ASP 31 10.621 3.706 -2.960 268 H GLY 32 HN GLY 32 9.706 2.972 1.007 269 HA2 GLY 32 HA2 GLY 32 10.994 4.784 2.988 270 HA3 GLY 32 HA1 GLY 32 9.639 3.719 3.310 271 H HIS 33 HN HIS 33 10.158 1.988 4.495 272 HA HIS 33 HA HIS 33 12.966 1.222 4.840 273 HB2 HIS 33 HB2 HIS 33 10.430 0.456 6.361 274 HB3 HIS 33 HB1 HIS 33 12.028 -0.179 6.745 275 HD1 HIS 33 HD1 HIS 33 12.704 0.916 8.865 276 HD2 HIS 33 HD2 HIS 33 10.918 3.621 6.270 277 HE1 HIS 33 HE1 HIS 33 12.812 3.134 10.030 278 HE2 HIS 33 HE2 HIS 33 11.961 4.780 8.329 279 H THR 34 HN THR 34 13.766 -0.409 3.530 280 HA THR 34 HA THR 34 11.930 -2.357 2.371 281 HB THR 34 HB THR 34 14.930 -2.055 1.912 282 HG1 THR 34 HG1 THR 34 13.832 -0.194 1.251 283 HG21 THR 34 HG21 THR 34 14.510 -3.318 -0.167 284 HG22 THR 34 HG22 THR 34 12.801 -3.470 0.252 285 HG23 THR 34 HG23 THR 34 14.029 -4.277 1.234 286 H LEU 35 HN LEU 35 11.351 -3.750 4.016 287 HA LEU 35 HA LEU 35 13.472 -4.980 5.652 288 HB2 LEU 35 HB2 LEU 35 11.825 -5.574 7.300 289 HB3 LEU 35 HB1 LEU 35 11.707 -3.859 6.973 290 HG LEU 35 HG LEU 35 9.766 -5.950 5.880 291 HD11 LEU 35 HD11 LEU 35 9.432 -4.187 8.334 292 HD12 LEU 35 HD12 LEU 35 9.673 -5.939 8.330 293 HD13 LEU 35 HD13 LEU 35 8.206 -5.255 7.635 294 HD21 LEU 35 HD21 LEU 35 9.639 -2.921 5.970 295 HD22 LEU 35 HD22 LEU 35 8.269 -3.963 5.577 296 HD23 LEU 35 HD23 LEU 35 9.689 -3.962 4.544 297 H TRP 36 HN TRP 36 13.257 -7.183 6.250 298 HA TRP 36 HA TRP 36 12.956 -9.022 4.159 299 HB2 TRP 36 HB2 TRP 36 12.907 -9.668 7.131 300 HB3 TRP 36 HB1 TRP 36 13.365 -10.754 5.825 301 HD1 TRP 36 HD1 TRP 36 14.934 -8.801 8.425 302 HE1 TRP 36 HE1 TRP 36 17.386 -8.271 7.892 303 HE3 TRP 36 HE3 TRP 36 14.969 -9.931 3.429 304 HZ2 TRP 36 HZ2 TRP 36 19.110 -8.293 5.681 305 HZ3 TRP 36 HZ3 TRP 36 17.066 -9.634 2.182 306 HH2 TRP 36 HH2 TRP 36 19.101 -8.836 3.282 307 H ALA 37 HN ALA 37 11.244 -9.982 3.354 308 HA ALA 37 HA ALA 37 8.723 -10.324 4.876 309 HB1 ALA 37 HB1 ALA 37 7.448 -9.661 2.866 310 HB2 ALA 37 HB2 ALA 37 8.962 -9.308 2.026 311 HB3 ALA 37 HB3 ALA 37 8.493 -8.356 3.434 312 H SER 38 HN SER 38 7.303 -12.011 3.999 313 HA SER 38 HA SER 38 8.462 -13.854 2.037 314 HB2 SER 38 HB2 SER 38 8.169 -14.827 4.340 315 HB3 SER 38 HB1 SER 38 6.455 -14.425 4.281 316 HG SER 38 HG SER 38 7.753 -16.089 2.378 317 H VAL 39 HN VAL 39 7.537 -13.046 0.166 318 HA VAL 39 HA VAL 39 4.850 -11.915 0.151 319 HB VAL 39 HB VAL 39 6.859 -12.221 -2.125 320 HG11 VAL 39 HG11 VAL 39 5.587 -10.459 -3.277 321 HG12 VAL 39 HG12 VAL 39 4.422 -10.408 -1.949 322 HG13 VAL 39 HG13 VAL 39 4.566 -11.860 -2.946 323 HG21 VAL 39 HG21 VAL 39 6.436 -9.820 -0.300 324 HG22 VAL 39 HG22 VAL 39 7.484 -9.858 -1.722 325 HG23 VAL 39 HG23 VAL 39 7.855 -10.877 -0.330 326 H ASN 40 HN ASN 40 3.487 -13.693 0.447 327 HA ASN 40 HA ASN 40 3.637 -15.979 -1.367 328 HB2 ASN 40 HB2 ASN 40 1.910 -15.462 1.092 329 HB3 ASN 40 HB1 ASN 40 1.917 -16.956 0.160 330 HD21 ASN 40 HD21 ASN 40 3.751 -14.936 2.358 331 HD22 ASN 40 HD22 ASN 40 4.896 -16.141 2.831 332 H MET 41 HN MET 41 2.685 -15.628 -3.272 333 HA MET 41 HA MET 41 0.492 -13.824 -3.709 334 HB2 MET 41 HB2 MET 41 2.407 -14.736 -5.360 335 HB3 MET 41 HB1 MET 41 1.210 -15.968 -5.716 336 HG2 MET 41 HG2 MET 41 0.892 -12.983 -6.090 337 HG3 MET 41 HG1 MET 41 1.108 -14.196 -7.353 338 HE1 MET 41 HE1 MET 41 -0.984 -13.156 -8.617 339 HE2 MET 41 HE2 MET 41 -1.213 -11.983 -7.316 340 HE3 MET 41 HE3 MET 41 -2.574 -12.956 -7.878 341 H VAL 42 HN VAL 42 -1.732 -14.318 -3.807 342 HA VAL 42 HA VAL 42 -2.447 -16.563 -2.166 343 HB VAL 42 HB VAL 42 -4.711 -15.773 -2.135 344 HG11 VAL 42 HG11 VAL 42 -2.812 -13.414 -2.046 345 HG12 VAL 42 HG12 VAL 42 -3.192 -14.513 -0.718 346 HG13 VAL 42 HG13 VAL 42 -4.434 -13.430 -1.351 347 HG21 VAL 42 HG21 VAL 42 -5.131 -15.345 -4.489 348 HG22 VAL 42 HG22 VAL 42 -4.033 -13.969 -4.475 349 HG23 VAL 42 HG23 VAL 42 -5.543 -13.896 -3.567 350 H SER 43 HN SER 43 -3.874 -18.234 -2.577 351 HA SER 43 HA SER 43 -3.927 -19.283 -5.329 352 HB2 SER 43 HB2 SER 43 -3.029 -20.673 -3.413 353 HB3 SER 43 HB1 SER 43 -4.635 -20.654 -2.683 354 HG SER 43 HG SER 43 -3.912 -21.753 -5.210 355 H SER 44 HN SER 44 -6.075 -20.765 -5.559 356 HA SER 44 HA SER 44 -8.294 -19.072 -5.952 357 HB2 SER 44 HB2 SER 44 -8.250 -22.118 -5.743 358 HB3 SER 44 HB1 SER 44 -9.520 -21.158 -6.507 359 HG SER 44 HG SER 44 -8.118 -20.588 -8.119 360 H LYS 45 HN LYS 45 -7.492 -21.337 -3.333 361 HA LYS 45 HA LYS 45 -9.901 -21.439 -1.935 362 HB2 LYS 45 HB2 LYS 45 -8.075 -23.008 -1.463 363 HB3 LYS 45 HB1 LYS 45 -7.062 -21.707 -0.865 364 HG2 LYS 45 HG2 LYS 45 -7.974 -23.040 0.981 365 HG3 LYS 45 HG1 LYS 45 -8.556 -21.373 1.051 366 HD2 LYS 45 HD2 LYS 45 -10.699 -22.125 -0.026 367 HD3 LYS 45 HD1 LYS 45 -10.115 -23.791 0.040 368 HE2 LYS 45 HE2 LYS 45 -10.556 -21.995 2.452 369 HE3 LYS 45 HE1 LYS 45 -11.663 -23.253 1.904 370 HZ1 LYS 45 HZ1 LYS 45 -10.306 -24.066 3.696 371 HZ2 LYS 45 HZ2 LYS 45 -8.891 -23.658 2.876 372 HZ3 LYS 45 HZ3 LYS 45 -9.882 -24.883 2.275 373 H GLU 46 HN GLU 46 -7.364 -19.005 -1.815 374 HA GLU 46 HA GLU 46 -8.090 -17.654 0.557 375 HB2 GLU 46 HB2 GLU 46 -6.740 -16.638 -1.974 376 HB3 GLU 46 HB1 GLU 46 -6.760 -15.773 -0.439 377 HG2 GLU 46 HG2 GLU 46 -5.653 -18.583 -0.540 378 HG3 GLU 46 HG1 GLU 46 -4.675 -17.253 -1.142 379 H ALA 47 HN ALA 47 -9.116 -17.221 -2.815 380 HA ALA 47 HA ALA 47 -10.912 -15.042 -2.389 381 HB1 ALA 47 HB1 ALA 47 -10.847 -17.129 -4.597 382 HB2 ALA 47 HB2 ALA 47 -9.990 -15.587 -4.608 383 HB3 ALA 47 HB3 ALA 47 -11.754 -15.615 -4.643 384 H ILE 48 HN ILE 48 -11.298 -18.556 -2.582 385 HA ILE 48 HA ILE 48 -14.123 -18.713 -2.388 386 HB ILE 48 HB ILE 48 -12.042 -20.824 -1.640 387 HG12 ILE 48 HG12 ILE 48 -13.546 -20.466 -4.279 388 HG13 ILE 48 HG11 ILE 48 -11.883 -19.961 -4.005 389 HG21 ILE 48 HG21 ILE 48 -14.999 -21.225 -2.258 390 HG22 ILE 48 HG22 ILE 48 -14.242 -21.404 -0.675 391 HG23 ILE 48 HG23 ILE 48 -13.824 -22.514 -1.981 392 HD11 ILE 48 HD11 ILE 48 -11.246 -22.293 -3.607 393 HD12 ILE 48 HD12 ILE 48 -11.955 -22.051 -5.204 394 HD13 ILE 48 HD13 ILE 48 -12.911 -22.793 -3.921 395 H SER 49 HN SER 49 -11.657 -18.469 0.101 396 HA SER 49 HA SER 49 -13.410 -19.348 2.270 397 HB2 SER 49 HB2 SER 49 -11.003 -20.063 2.204 398 HB3 SER 49 HB1 SER 49 -10.514 -18.382 2.405 399 HG SER 49 HG SER 49 -12.324 -19.405 4.268 400 H SER 50 HN SER 50 -11.642 -16.394 1.279 401 HA SER 50 HA SER 50 -12.679 -14.846 3.531 402 HB2 SER 50 HB2 SER 50 -10.965 -13.940 1.180 403 HB3 SER 50 HB1 SER 50 -11.198 -13.088 2.710 404 HG SER 50 HG SER 50 -10.363 -15.591 3.196 405 H GLY 51 HN GLY 51 -13.478 -15.334 0.195 406 HA2 GLY 51 HA2 GLY 51 -15.329 -14.743 -1.010 407 HA3 GLY 51 HA1 GLY 51 -15.990 -13.981 0.423 408 H ALA 52 HN ALA 52 -15.860 -11.767 0.626 409 HA ALA 52 HA ALA 52 -15.151 -10.268 -1.786 410 HB1 ALA 52 HB1 ALA 52 -16.602 -9.363 0.731 411 HB2 ALA 52 HB2 ALA 52 -17.369 -9.938 -0.751 412 HB3 ALA 52 HB3 ALA 52 -16.441 -8.437 -0.769 413 H GLU 53 HN GLU 53 -13.544 -11.106 1.040 414 HA GLU 53 HA GLU 53 -12.153 -8.600 1.491 415 HB2 GLU 53 HB2 GLU 53 -12.623 -10.105 3.380 416 HB3 GLU 53 HB1 GLU 53 -11.666 -11.374 2.623 417 HG2 GLU 53 HG2 GLU 53 -9.639 -9.936 2.832 418 HG3 GLU 53 HG1 GLU 53 -10.621 -8.717 3.652 419 H LEU 54 HN LEU 54 -11.032 -11.893 0.581 420 HA LEU 54 HA LEU 54 -8.802 -10.718 -0.976 421 HB2 LEU 54 HB2 LEU 54 -8.954 -13.548 0.158 422 HB3 LEU 54 HB1 LEU 54 -7.576 -12.818 -0.657 423 HG LEU 54 HG LEU 54 -8.650 -12.141 2.115 424 HD11 LEU 54 HD11 LEU 54 -6.458 -12.897 2.906 425 HD12 LEU 54 HD12 LEU 54 -5.978 -13.297 1.252 426 HD13 LEU 54 HD13 LEU 54 -7.301 -14.171 2.031 427 HD21 LEU 54 HD21 LEU 54 -7.972 -10.048 1.060 428 HD22 LEU 54 HD22 LEU 54 -6.404 -10.735 0.632 429 HD23 LEU 54 HD23 LEU 54 -6.833 -10.494 2.328 430 H ALA 55 HN ALA 55 -8.383 -11.547 -3.016 431 HA ALA 55 HA ALA 55 -10.323 -13.345 -4.315 432 HB1 ALA 55 HB1 ALA 55 -11.126 -11.042 -4.705 433 HB2 ALA 55 HB2 ALA 55 -10.571 -11.782 -6.214 434 HB3 ALA 55 HB3 ALA 55 -9.562 -10.595 -5.370 435 H ILE 56 HN ILE 56 -9.516 -13.959 -6.555 436 HA ILE 56 HA ILE 56 -6.759 -14.763 -6.494 437 HB ILE 56 HB ILE 56 -8.772 -14.844 -8.799 438 HG12 ILE 56 HG12 ILE 56 -8.024 -17.070 -6.840 439 HG13 ILE 56 HG11 ILE 56 -9.477 -16.087 -6.710 440 HG21 ILE 56 HG21 ILE 56 -6.151 -16.366 -8.500 441 HG22 ILE 56 HG22 ILE 56 -6.474 -15.061 -9.645 442 HG23 ILE 56 HG23 ILE 56 -7.334 -16.594 -9.797 443 HD11 ILE 56 HD11 ILE 56 -10.282 -17.003 -8.840 444 HD12 ILE 56 HD12 ILE 56 -9.959 -18.264 -7.653 445 HD13 ILE 56 HD13 ILE 56 -8.820 -17.986 -8.967 446 H GLY 57 HN GLY 57 -5.058 -13.506 -7.062 447 HA2 GLY 57 HA2 GLY 57 -4.012 -11.824 -8.536 448 HA3 GLY 57 HA1 GLY 57 -5.537 -10.945 -8.520 449 H THR 58 HN THR 58 -5.507 -11.927 -5.519 450 HA THR 58 HA THR 58 -4.266 -9.595 -4.314 451 HB THR 58 HB THR 58 -5.703 -12.018 -3.114 452 HG1 THR 58 HG1 THR 58 -6.961 -10.607 -4.451 453 HG21 THR 58 HG21 THR 58 -4.265 -10.952 -1.379 454 HG22 THR 58 HG22 THR 58 -5.981 -10.730 -1.046 455 HG23 THR 58 HG23 THR 58 -5.038 -9.398 -1.710 456 H VAL 59 HN VAL 59 -2.641 -9.879 -2.539 457 HA VAL 59 HA VAL 59 -0.977 -12.292 -2.596 458 HB VAL 59 HB VAL 59 0.197 -9.467 -2.743 459 HG11 VAL 59 HG11 VAL 59 1.556 -12.198 -2.817 460 HG12 VAL 59 HG12 VAL 59 1.619 -11.047 -1.481 461 HG13 VAL 59 HG13 VAL 59 2.377 -10.646 -3.023 462 HG21 VAL 59 HG21 VAL 59 0.939 -10.022 -5.032 463 HG22 VAL 59 HG22 VAL 59 -0.815 -10.090 -4.920 464 HG23 VAL 59 HG23 VAL 59 0.120 -11.584 -4.932 465 H ARG 60 HN ARG 60 -0.656 -12.959 -0.560 466 HA ARG 60 HA ARG 60 -1.007 -11.165 1.745 467 HB2 ARG 60 HB2 ARG 60 -2.169 -13.418 1.649 468 HB3 ARG 60 HB1 ARG 60 -0.583 -14.187 1.681 469 HG2 ARG 60 HG2 ARG 60 -0.168 -13.120 3.916 470 HG3 ARG 60 HG1 ARG 60 -1.810 -12.470 3.878 471 HD2 ARG 60 HD2 ARG 60 -1.011 -15.406 3.934 472 HD3 ARG 60 HD1 ARG 60 -1.743 -14.489 5.253 473 HE ARG 60 HE ARG 60 -3.098 -15.195 2.709 474 HH11 ARG 60 HH11 ARG 60 -3.345 -14.477 6.118 475 HH12 ARG 60 HH12 ARG 60 -5.023 -14.892 6.189 476 HH21 ARG 60 HH21 ARG 60 -5.282 -15.732 2.839 477 HH22 ARG 60 HH22 ARG 60 -6.100 -15.609 4.364 478 H ILE 61 HN ILE 61 0.758 -10.745 3.159 479 HA ILE 61 HA ILE 61 3.458 -11.490 2.232 480 HB ILE 61 HB ILE 61 2.512 -8.579 2.444 481 HG12 ILE 61 HG12 ILE 61 3.585 -10.083 0.009 482 HG13 ILE 61 HG11 ILE 61 1.879 -9.814 0.322 483 HG21 ILE 61 HG21 ILE 61 5.317 -9.632 1.879 484 HG22 ILE 61 HG22 ILE 61 4.791 -8.790 3.341 485 HG23 ILE 61 HG23 ILE 61 4.816 -7.935 1.801 486 HD11 ILE 61 HD11 ILE 61 2.247 -7.394 0.130 487 HD12 ILE 61 HD12 ILE 61 2.701 -8.280 -1.327 488 HD13 ILE 61 HD13 ILE 61 3.951 -7.699 -0.225 489 H TRP 62 HN TRP 62 4.327 -12.286 4.026 490 HA TRP 62 HA TRP 62 3.556 -11.317 6.705 491 HB2 TRP 62 HB2 TRP 62 5.220 -13.750 5.887 492 HB3 TRP 62 HB1 TRP 62 4.685 -13.375 7.525 493 HD1 TRP 62 HD1 TRP 62 3.136 -14.283 4.070 494 HE1 TRP 62 HE1 TRP 62 0.921 -15.485 4.493 495 HE3 TRP 62 HE3 TRP 62 2.922 -13.883 9.162 496 HZ2 TRP 62 HZ2 TRP 62 -0.710 -16.221 6.677 497 HZ3 TRP 62 HZ3 TRP 62 1.002 -14.868 10.353 498 HH2 TRP 62 HH2 TRP 62 -0.783 -16.014 9.126 499 H ILE 63 HN ILE 63 4.953 -10.098 7.917 500 HA ILE 63 HA ILE 63 7.750 -9.748 6.990 501 HB ILE 63 HB ILE 63 7.596 -7.300 7.293 502 HG12 ILE 63 HG12 ILE 63 4.576 -7.655 7.613 503 HG13 ILE 63 HG11 ILE 63 5.667 -7.309 8.944 504 HG21 ILE 63 HG21 ILE 63 7.300 -8.146 5.053 505 HG22 ILE 63 HG22 ILE 63 6.228 -6.771 5.290 506 HG23 ILE 63 HG23 ILE 63 5.575 -8.408 5.326 507 HD11 ILE 63 HD11 ILE 63 5.133 -5.516 6.577 508 HD12 ILE 63 HD12 ILE 63 6.254 -5.164 7.893 509 HD13 ILE 63 HD13 ILE 63 4.529 -5.309 8.217 510 H ARG 64 HN ARG 64 9.162 -8.781 8.627 511 HA ARG 64 HA ARG 64 8.959 -9.350 11.286 512 HB2 ARG 64 HB2 ARG 64 10.096 -6.788 10.069 513 HB3 ARG 64 HB1 ARG 64 10.444 -7.359 11.703 514 HG2 ARG 64 HG2 ARG 64 11.128 -8.871 9.156 515 HG3 ARG 64 HG1 ARG 64 12.258 -7.862 10.067 516 HD2 ARG 64 HD2 ARG 64 10.897 -10.409 11.040 517 HD3 ARG 64 HD1 ARG 64 12.606 -10.220 10.634 518 HE ARG 64 HE ARG 64 12.208 -8.352 12.572 519 HH11 ARG 64 HH11 ARG 64 11.653 -11.813 12.472 520 HH12 ARG 64 HH12 ARG 64 11.822 -12.009 14.186 521 HH21 ARG 64 HH21 ARG 64 12.330 -8.610 14.814 522 HH22 ARG 64 HH22 ARG 64 12.211 -10.192 15.513 523 H TYR 65 HN TYR 65 7.867 -8.579 13.033 524 HA TYR 65 HA TYR 65 5.272 -7.665 12.760 525 HB2 TYR 65 HB2 TYR 65 6.175 -9.030 14.644 526 HB3 TYR 65 HB1 TYR 65 7.007 -7.613 15.272 527 HD1 TYR 65 HD2 TYR 65 3.623 -9.036 14.589 528 HD2 TYR 65 HD1 TYR 65 5.816 -6.058 16.724 529 HE1 TYR 65 HE2 TYR 65 1.614 -8.496 15.907 530 HE2 TYR 65 HE1 TYR 65 3.821 -5.530 18.041 531 HH TYR 65 HH TYR 65 1.374 -5.715 17.842 532 H ARG 66 HN ARG 66 5.018 -5.739 11.689 533 HA ARG 66 HA ARG 66 6.344 -3.305 12.716 534 HB2 ARG 66 HB2 ARG 66 6.779 -4.172 10.292 535 HB3 ARG 66 HB1 ARG 66 5.142 -3.650 9.938 536 HG2 ARG 66 HG2 ARG 66 6.326 -1.792 9.246 537 HG3 ARG 66 HG1 ARG 66 5.979 -1.332 10.912 538 HD2 ARG 66 HD2 ARG 66 8.593 -2.454 9.824 539 HD3 ARG 66 HD1 ARG 66 8.309 -0.811 10.411 540 HE ARG 66 HE ARG 66 8.281 -3.241 12.122 541 HH11 ARG 66 HH11 ARG 66 9.178 0.130 11.693 542 HH12 ARG 66 HH12 ARG 66 9.736 0.298 13.323 543 HH21 ARG 66 HH21 ARG 66 8.970 -2.980 14.250 544 HH22 ARG 66 HH22 ARG 66 9.622 -1.459 14.773 545 H LYS 67 HN LYS 67 4.944 -2.398 14.107 546 HA LYS 67 HA LYS 67 2.057 -2.378 13.786 547 HB2 LYS 67 HB2 LYS 67 3.863 -0.946 15.781 548 HB3 LYS 67 HB1 LYS 67 2.110 -1.074 15.906 549 HG2 LYS 67 HG2 LYS 67 2.239 -3.466 16.251 550 HG3 LYS 67 HG1 LYS 67 3.973 -3.471 15.918 551 HD2 LYS 67 HD2 LYS 67 2.658 -2.032 18.260 552 HD3 LYS 67 HD1 LYS 67 3.446 -3.611 18.360 553 HE2 LYS 67 HE2 LYS 67 5.595 -2.601 17.722 554 HE3 LYS 67 HE1 LYS 67 4.819 -1.032 17.521 555 HZ1 LYS 67 HZ1 LYS 67 5.932 -1.113 19.598 556 HZ2 LYS 67 HZ2 LYS 67 5.131 -2.528 20.056 557 HZ3 LYS 67 HZ3 LYS 67 4.268 -1.082 19.890 558 H ASP 68 HN ASP 68 4.250 -0.743 12.097 559 HA ASP 68 HA ASP 68 3.146 1.970 12.220 560 HB2 ASP 68 HB2 ASP 68 5.445 0.805 10.585 561 HB3 ASP 68 HB1 ASP 68 5.002 2.507 10.646 562 H ILE 69 HN ILE 69 2.775 -0.923 10.409 563 HA ILE 69 HA ILE 69 2.173 0.159 7.839 564 HB ILE 69 HB ILE 69 1.291 -2.550 8.948 565 HG12 ILE 69 HG12 ILE 69 3.737 -2.335 9.161 566 HG13 ILE 69 HG11 ILE 69 3.350 -3.466 7.869 567 HG21 ILE 69 HG21 ILE 69 1.222 -3.225 6.542 568 HG22 ILE 69 HG22 ILE 69 1.585 -1.562 6.082 569 HG23 ILE 69 HG23 ILE 69 0.076 -1.936 6.917 570 HD11 ILE 69 HD11 ILE 69 4.246 -0.604 7.545 571 HD12 ILE 69 HD12 ILE 69 3.810 -1.691 6.220 572 HD13 ILE 69 HD13 ILE 69 5.190 -2.061 7.251 573 H ASN 70 HN ASN 70 0.345 0.997 7.109 574 HA ASN 70 HA ASN 70 -2.260 0.533 8.398 575 HB2 ASN 70 HB2 ASN 70 -1.128 2.682 9.338 576 HB3 ASN 70 HB1 ASN 70 -1.295 3.349 7.717 577 HD21 ASN 70 HD21 ASN 70 -3.043 2.281 10.586 578 HD22 ASN 70 HD22 ASN 70 -4.524 3.089 10.208 579 H ALA 71 HN ALA 71 -3.994 1.672 6.944 580 HA ALA 71 HA ALA 71 -4.019 0.442 4.459 581 HB1 ALA 71 HB1 ALA 71 -6.105 1.697 4.069 582 HB2 ALA 71 HB2 ALA 71 -5.715 2.767 5.420 583 HB3 ALA 71 HB3 ALA 71 -6.038 1.056 5.712 584 H THR 72 HN THR 72 -2.884 3.638 5.327 585 HA THR 72 HA THR 72 -2.795 4.600 2.568 586 HB THR 72 HB THR 72 -1.981 6.762 3.667 587 HG1 THR 72 HG1 THR 72 -1.175 6.004 5.610 588 HG21 THR 72 HG21 THR 72 -4.374 6.420 3.096 589 HG22 THR 72 HG22 THR 72 -4.184 7.381 4.563 590 HG23 THR 72 HG23 THR 72 -4.643 5.679 4.678 591 H SER 73 HN SER 73 -0.952 2.448 3.771 592 HA SER 73 HA SER 73 1.508 3.530 2.516 593 HB2 SER 73 HB2 SER 73 1.199 1.074 4.321 594 HB3 SER 73 HB1 SER 73 2.708 1.656 3.611 595 HG SER 73 HG SER 73 2.412 3.596 4.798 596 H ARG 74 HN ARG 74 2.554 2.090 1.005 597 HA ARG 74 HA ARG 74 0.926 -0.137 -0.081 598 HB2 ARG 74 HB2 ARG 74 2.798 1.728 -1.603 599 HB3 ARG 74 HB1 ARG 74 2.106 0.255 -2.273 600 HG2 ARG 74 HG2 ARG 74 -0.139 1.188 -2.114 601 HG3 ARG 74 HG1 ARG 74 0.488 2.640 -1.326 602 HD2 ARG 74 HD2 ARG 74 1.778 3.189 -3.367 603 HD3 ARG 74 HD1 ARG 74 1.152 1.735 -4.156 604 HE ARG 74 HE ARG 74 -1.033 3.260 -3.285 605 HH11 ARG 74 HH11 ARG 74 1.531 3.570 -5.671 606 HH12 ARG 74 HH12 ARG 74 0.558 4.514 -6.754 607 HH21 ARG 74 HH21 ARG 74 -2.259 4.513 -4.667 608 HH22 ARG 74 HH22 ARG 74 -1.593 5.067 -6.171 609 H ILE 75 HN ILE 75 2.227 -1.875 -0.953 610 HA ILE 75 HA ILE 75 4.823 -2.256 0.413 611 HB ILE 75 HB ILE 75 2.683 -4.335 -0.265 612 HG12 ILE 75 HG12 ILE 75 1.955 -2.898 1.616 613 HG13 ILE 75 HG11 ILE 75 2.285 -4.533 2.170 614 HG21 ILE 75 HG21 ILE 75 4.071 -5.916 1.050 615 HG22 ILE 75 HG22 ILE 75 5.314 -4.673 1.197 616 HG23 ILE 75 HG23 ILE 75 4.899 -5.316 -0.391 617 HD11 ILE 75 HD11 ILE 75 3.058 -2.881 3.757 618 HD12 ILE 75 HD12 ILE 75 4.082 -2.137 2.528 619 HD13 ILE 75 HD13 ILE 75 4.425 -3.776 3.092 620 H LYS 76 HN LYS 76 6.132 -1.623 -1.354 621 HA LYS 76 HA LYS 76 5.714 -2.867 -3.986 622 HB2 LYS 76 HB2 LYS 76 6.312 -0.463 -3.947 623 HB3 LYS 76 HB1 LYS 76 7.817 -0.839 -3.109 624 HG2 LYS 76 HG2 LYS 76 8.549 -2.190 -5.078 625 HG3 LYS 76 HG1 LYS 76 7.057 -1.752 -5.909 626 HD2 LYS 76 HD2 LYS 76 8.904 -0.378 -6.704 627 HD3 LYS 76 HD1 LYS 76 7.724 0.624 -5.856 628 HE2 LYS 76 HE2 LYS 76 9.176 0.735 -3.884 629 HE3 LYS 76 HE1 LYS 76 10.311 -0.403 -4.614 630 HZ1 LYS 76 HZ1 LYS 76 10.825 1.195 -6.301 631 HZ2 LYS 76 HZ2 LYS 76 11.029 1.905 -4.780 632 HZ3 LYS 76 HZ3 LYS 76 9.667 2.273 -5.710 633 H VAL 77 HN VAL 77 6.515 -4.863 -4.244 634 HA VAL 77 HA VAL 77 8.396 -6.056 -2.461 635 HB VAL 77 HB VAL 77 7.289 -7.047 -5.123 636 HG11 VAL 77 HG11 VAL 77 8.892 -8.609 -3.058 637 HG12 VAL 77 HG12 VAL 77 9.418 -8.209 -4.695 638 HG13 VAL 77 HG13 VAL 77 8.064 -9.316 -4.452 639 HG21 VAL 77 HG21 VAL 77 5.615 -6.722 -3.315 640 HG22 VAL 77 HG22 VAL 77 6.534 -7.816 -2.284 641 HG23 VAL 77 HG23 VAL 77 5.791 -8.418 -3.766 642 H SER 78 HN SER 78 10.510 -5.918 -2.494 643 HA SER 78 HA SER 78 11.987 -4.656 -4.641 644 HB2 SER 78 HB2 SER 78 12.510 -4.087 -2.301 645 HB3 SER 78 HB1 SER 78 12.871 -5.773 -1.939 646 HG SER 78 HG SER 78 14.300 -4.027 -3.663 647 H THR 79 HN THR 79 11.589 -7.872 -3.246 648 HA THR 79 HA THR 79 13.051 -9.132 -5.444 649 HB THR 79 HB THR 79 14.285 -10.643 -3.774 650 HG1 THR 79 HG1 THR 79 14.599 -9.828 -1.696 651 HG21 THR 79 HG21 THR 79 15.495 -8.930 -5.060 652 HG22 THR 79 HG22 THR 79 16.163 -9.093 -3.436 653 HG23 THR 79 HG23 THR 79 15.113 -7.729 -3.823 654 H GLY 80 HN GLY 80 12.218 -11.053 -5.990 655 HA2 GLY 80 HA2 GLY 80 11.154 -13.175 -5.023 656 HA3 GLY 80 HA1 GLY 80 9.874 -12.082 -4.498 657 HA PRO 81 HA PRO 81 8.718 -13.677 -8.753 658 HB2 PRO 81 HB2 PRO 81 6.069 -14.109 -8.191 659 HB3 PRO 81 HB1 PRO 81 7.327 -15.293 -7.805 660 HG2 PRO 81 HG2 PRO 81 6.058 -13.226 -5.999 661 HG3 PRO 81 HG1 PRO 81 6.338 -14.953 -5.683 662 HD2 PRO 81 HD2 PRO 81 8.015 -13.065 -4.729 663 HD3 PRO 81 HD1 PRO 81 8.626 -14.641 -5.282 664 H LEU 82 HN LEU 82 7.679 -11.108 -6.703 665 HA LEU 82 HA LEU 82 6.364 -9.637 -8.922 666 HB2 LEU 82 HB2 LEU 82 5.935 -9.317 -5.923 667 HB3 LEU 82 HB1 LEU 82 5.069 -8.467 -7.195 668 HG LEU 82 HG LEU 82 4.899 -11.459 -6.655 669 HD11 LEU 82 HD11 LEU 82 3.877 -10.126 -4.875 670 HD12 LEU 82 HD12 LEU 82 2.668 -11.018 -5.790 671 HD13 LEU 82 HD13 LEU 82 2.874 -9.284 -6.061 672 HD21 LEU 82 HD21 LEU 82 3.047 -11.482 -8.275 673 HD22 LEU 82 HD22 LEU 82 4.545 -10.951 -9.035 674 HD23 LEU 82 HD23 LEU 82 3.304 -9.765 -8.619 675 H ALA 83 HN ALA 83 9.262 -9.788 -8.255 676 HA ALA 83 HA ALA 83 10.169 -7.557 -6.768 677 HB1 ALA 83 HB1 ALA 83 11.617 -9.074 -8.968 678 HB2 ALA 83 HB2 ALA 83 11.572 -9.524 -7.260 679 HB3 ALA 83 HB3 ALA 83 12.363 -8.028 -7.757 680 H GLY 84 HN GLY 84 9.217 -5.661 -7.367 681 HA2 GLY 84 HA2 GLY 84 10.061 -3.660 -8.644 682 HA3 GLY 84 HA1 GLY 84 9.695 -4.582 -10.096 683 H ARG 85 HN ARG 85 7.249 -5.620 -8.412 684 HA ARG 85 HA ARG 85 5.367 -3.630 -9.433 685 HB2 ARG 85 HB2 ARG 85 4.822 -6.304 -8.057 686 HB3 ARG 85 HB1 ARG 85 3.642 -5.302 -8.906 687 HG2 ARG 85 HG2 ARG 85 4.810 -5.699 -11.040 688 HG3 ARG 85 HG1 ARG 85 6.033 -6.664 -10.199 689 HD2 ARG 85 HD2 ARG 85 4.231 -8.242 -9.490 690 HD3 ARG 85 HD1 ARG 85 3.072 -7.303 -10.440 691 HE ARG 85 HE ARG 85 5.322 -8.195 -11.989 692 HH11 ARG 85 HH11 ARG 85 2.211 -9.240 -10.763 693 HH12 ARG 85 HH12 ARG 85 2.000 -10.444 -11.993 694 HH21 ARG 85 HH21 ARG 85 5.037 -9.758 -13.594 695 HH22 ARG 85 HH22 ARG 85 3.606 -10.744 -13.594 696 H VAL 86 HN VAL 86 3.953 -2.427 -8.154 697 HA VAL 86 HA VAL 86 4.478 -2.398 -5.256 698 HB VAL 86 HB VAL 86 4.778 -0.221 -6.405 699 HG11 VAL 86 HG11 VAL 86 3.102 -0.379 -8.196 700 HG12 VAL 86 HG12 VAL 86 2.866 1.099 -7.262 701 HG13 VAL 86 HG13 VAL 86 1.797 -0.284 -7.011 702 HG21 VAL 86 HG21 VAL 86 3.500 1.156 -4.788 703 HG22 VAL 86 HG22 VAL 86 4.204 -0.270 -4.018 704 HG23 VAL 86 HG23 VAL 86 2.483 -0.239 -4.409 705 H LEU 87 HN LEU 87 3.149 -3.519 -4.104 706 HA LEU 87 HA LEU 87 0.411 -4.145 -4.862 707 HB2 LEU 87 HB2 LEU 87 2.054 -4.890 -2.395 708 HB3 LEU 87 HB1 LEU 87 0.424 -5.450 -2.696 709 HG LEU 87 HG LEU 87 2.047 -7.216 -3.151 710 HD11 LEU 87 HD11 LEU 87 0.833 -6.296 -5.739 711 HD12 LEU 87 HD12 LEU 87 -0.003 -7.190 -4.470 712 HD13 LEU 87 HD13 LEU 87 1.346 -7.933 -5.329 713 HD21 LEU 87 HD21 LEU 87 3.995 -5.858 -3.754 714 HD22 LEU 87 HD22 LEU 87 3.252 -5.476 -5.310 715 HD23 LEU 87 HD23 LEU 87 3.694 -7.144 -4.923 716 H ASN 88 HN ASN 88 -1.401 -3.329 -3.800 717 HA ASN 88 HA ASN 88 -1.040 -0.980 -2.012 718 HB2 ASN 88 HB2 ASN 88 -3.134 -1.695 -4.107 719 HB3 ASN 88 HB1 ASN 88 -3.571 -0.628 -2.777 720 HD21 ASN 88 HD21 ASN 88 -1.281 -0.998 -5.455 721 HD22 ASN 88 HD22 ASN 88 -1.039 0.693 -5.705 722 H ILE 89 HN ILE 89 -2.239 -0.907 -0.048 723 HA ILE 89 HA ILE 89 -2.775 -3.560 1.046 724 HB ILE 89 HB ILE 89 -2.714 -0.826 2.408 725 HG12 ILE 89 HG12 ILE 89 -0.641 -3.072 2.423 726 HG13 ILE 89 HG11 ILE 89 -0.509 -1.572 1.508 727 HG21 ILE 89 HG21 ILE 89 -2.912 -3.588 3.696 728 HG22 ILE 89 HG22 ILE 89 -4.172 -2.349 3.678 729 HG23 ILE 89 HG23 ILE 89 -2.675 -2.066 4.566 730 HD11 ILE 89 HD11 ILE 89 -0.550 -1.826 4.515 731 HD12 ILE 89 HD12 ILE 89 -0.457 -0.305 3.613 732 HD13 ILE 89 HD13 ILE 89 0.853 -1.487 3.501 733 H ILE 90 HN ILE 90 -4.681 -4.230 0.300 734 HA ILE 90 HA ILE 90 -7.067 -2.642 0.182 735 HB ILE 90 HB ILE 90 -8.224 -4.874 -0.286 736 HG12 ILE 90 HG12 ILE 90 -5.388 -6.016 -0.422 737 HG13 ILE 90 HG11 ILE 90 -6.497 -6.334 0.898 738 HG21 ILE 90 HG21 ILE 90 -7.332 -5.044 -2.572 739 HG22 ILE 90 HG22 ILE 90 -5.900 -4.124 -2.098 740 HG23 ILE 90 HG23 ILE 90 -7.492 -3.355 -2.076 741 HD11 ILE 90 HD11 ILE 90 -8.037 -7.436 -0.667 742 HD12 ILE 90 HD12 ILE 90 -6.441 -8.185 -0.633 743 HD13 ILE 90 HD13 ILE 90 -6.890 -7.140 -1.979 744 H GLY 91 HN GLY 91 -7.540 -1.821 2.155 745 HA2 GLY 91 HA2 GLY 91 -8.934 -1.945 4.065 746 HA3 GLY 91 HA1 GLY 91 -8.533 -3.647 4.255 747 H GLN 92 HN GLN 92 -7.565 -3.784 6.204 748 HA GLN 92 HA GLN 92 -5.331 -1.977 6.916 749 HB2 GLN 92 HB2 GLN 92 -6.161 -2.022 9.277 750 HB3 GLN 92 HB1 GLN 92 -7.324 -1.278 8.185 751 HG2 GLN 92 HG2 GLN 92 -8.594 -3.431 8.137 752 HG3 GLN 92 HG1 GLN 92 -7.456 -4.093 9.307 753 HE21 GLN 92 HE21 GLN 92 -10.344 -3.738 9.530 754 HE22 GLN 92 HE22 GLN 92 -10.600 -2.757 10.929 755 HA PRO 93 HA PRO 93 -3.100 -5.824 7.366 756 HB2 PRO 93 HB2 PRO 93 -1.080 -5.128 9.085 757 HB3 PRO 93 HB1 PRO 93 -1.159 -4.529 7.419 758 HG2 PRO 93 HG2 PRO 93 -2.082 -3.172 9.960 759 HG3 PRO 93 HG1 PRO 93 -1.082 -2.508 8.650 760 HD2 PRO 93 HD2 PRO 93 -3.727 -1.990 8.780 761 HD3 PRO 93 HD1 PRO 93 -2.920 -2.225 7.214 762 H LEU 94 HN LEU 94 -2.643 -7.570 8.800 763 HA LEU 94 HA LEU 94 -4.204 -7.561 11.321 764 HB2 LEU 94 HB2 LEU 94 -5.117 -8.879 9.262 765 HB3 LEU 94 HB1 LEU 94 -3.800 -10.000 9.532 766 HG LEU 94 HG LEU 94 -6.062 -10.710 10.435 767 HD11 LEU 94 HD11 LEU 94 -5.266 -11.651 12.524 768 HD12 LEU 94 HD12 LEU 94 -3.894 -10.536 12.533 769 HD13 LEU 94 HD13 LEU 94 -4.030 -11.767 11.273 770 HD21 LEU 94 HD21 LEU 94 -6.842 -8.535 11.223 771 HD22 LEU 94 HD22 LEU 94 -5.599 -8.516 12.477 772 HD23 LEU 94 HD23 LEU 94 -6.886 -9.724 12.519 773 HA PRO 95 HA PRO 95 0.060 -8.524 12.878 774 HB2 PRO 95 HB2 PRO 95 -1.376 -8.354 15.510 775 HB3 PRO 95 HB1 PRO 95 0.098 -7.535 14.975 776 HG2 PRO 95 HG2 PRO 95 -2.205 -6.174 15.191 777 HG3 PRO 95 HG1 PRO 95 -1.089 -5.845 13.848 778 HD2 PRO 95 HD2 PRO 95 -3.625 -7.494 13.841 779 HD3 PRO 95 HD1 PRO 95 -3.062 -6.291 12.653 780 H ASP 96 HN ASP 96 0.909 -10.513 13.421 781 HA ASP 96 HA ASP 96 -0.764 -12.827 13.611 782 HB2 ASP 96 HB2 ASP 96 1.255 -13.400 12.622 783 HB3 ASP 96 HB1 ASP 96 2.170 -12.250 13.573 784 H ALA 97 HN ALA 97 -1.097 -14.179 15.373 785 HA ALA 97 HA ALA 97 -1.764 -12.883 17.807 786 HB1 ALA 97 HB1 ALA 97 -2.600 -15.097 18.483 787 HB2 ALA 97 HB2 ALA 97 -1.753 -15.842 17.123 788 HB3 ALA 97 HB3 ALA 97 -3.082 -14.721 16.825 789 H ALA 98 HN ALA 98 1.002 -14.827 16.834 790 HA ALA 98 HA ALA 98 2.023 -15.138 19.549 791 HB1 ALA 98 HB1 ALA 98 3.920 -16.287 18.486 792 HB2 ALA 98 HB2 ALA 98 3.321 -15.825 16.889 793 HB3 ALA 98 HB3 ALA 98 2.386 -16.930 17.899 794 H ARG 99 HN ARG 99 2.067 -12.660 17.207 795 HA ARG 99 HA ARG 99 3.107 -10.690 16.959 796 HB2 ARG 99 HB2 ARG 99 3.878 -11.254 19.826 797 HB3 ARG 99 HB1 ARG 99 4.542 -9.846 19.012 798 HG2 ARG 99 HG2 ARG 99 2.618 -9.180 20.308 799 HG3 ARG 99 HG1 ARG 99 2.261 -9.005 18.595 800 HD2 ARG 99 HD2 ARG 99 1.070 -11.253 18.745 801 HD3 ARG 99 HD1 ARG 99 1.251 -11.124 20.499 802 HE ARG 99 HE ARG 99 0.057 -8.779 19.386 803 HH11 ARG 99 HH11 ARG 99 -0.694 -12.057 20.361 804 HH12 ARG 99 HH12 ARG 99 -2.385 -11.741 20.551 805 HH21 ARG 99 HH21 ARG 99 -2.153 -8.373 19.632 806 HH22 ARG 99 HH22 ARG 99 -3.212 -9.646 20.148 807 H THR 100 HN THR 100 4.577 -13.344 16.412 808 HA THR 100 HA THR 100 7.375 -12.486 16.414 809 HB THR 100 HB THR 100 6.865 -14.813 17.097 810 HG1 THR 100 HG1 THR 100 8.881 -14.259 15.995 811 HG21 THR 100 HG21 THR 100 5.995 -15.261 14.229 812 HG22 THR 100 HG22 THR 100 4.935 -15.286 15.637 813 HG23 THR 100 HG23 THR 100 6.192 -16.510 15.462 814 H ARG 101 HN ARG 101 4.729 -12.029 14.425 815 HA ARG 101 HA ARG 101 6.290 -10.669 12.522 816 HB2 ARG 101 HB2 ARG 101 5.888 -11.817 10.440 817 HB3 ARG 101 HB1 ARG 101 6.667 -12.935 11.539 818 HG2 ARG 101 HG2 ARG 101 3.688 -12.951 10.954 819 HG3 ARG 101 HG1 ARG 101 4.868 -13.898 10.050 820 HD2 ARG 101 HD2 ARG 101 5.528 -14.843 12.402 821 HD3 ARG 101 HD1 ARG 101 3.952 -14.211 12.898 822 HE ARG 101 HE ARG 101 3.819 -15.852 10.533 823 HH11 ARG 101 HH11 ARG 101 3.711 -15.996 14.056 824 HH12 ARG 101 HH12 ARG 101 3.106 -17.621 14.082 825 HH21 ARG 101 HH21 ARG 101 3.062 -17.967 10.587 826 HH22 ARG 101 HH22 ARG 101 2.751 -18.750 12.103 827 H LEU 102 HN LEU 102 4.709 -10.044 10.512 828 HA LEU 102 HA LEU 102 2.073 -9.306 11.619 829 HB2 LEU 102 HB2 LEU 102 4.095 -7.480 11.394 830 HB3 LEU 102 HB1 LEU 102 3.532 -7.416 9.747 831 HG LEU 102 HG LEU 102 2.509 -5.588 10.815 832 HD11 LEU 102 HD11 LEU 102 0.127 -5.953 10.791 833 HD12 LEU 102 HD12 LEU 102 0.357 -7.702 10.887 834 HD13 LEU 102 HD13 LEU 102 0.897 -6.817 9.462 835 HD21 LEU 102 HD21 LEU 102 1.742 -7.368 13.142 836 HD22 LEU 102 HD22 LEU 102 1.343 -5.657 12.969 837 HD23 LEU 102 HD23 LEU 102 3.025 -6.154 13.113 838 H GLU 103 HN GLU 103 0.537 -10.121 10.323 839 HA GLU 103 HA GLU 103 1.104 -11.018 7.613 840 HB2 GLU 103 HB2 GLU 103 -0.346 -12.420 9.005 841 HB3 GLU 103 HB1 GLU 103 -1.445 -11.072 9.278 842 HG2 GLU 103 HG2 GLU 103 -1.891 -11.066 6.778 843 HG3 GLU 103 HG1 GLU 103 -0.971 -12.570 6.683 844 H ILE 104 HN ILE 104 1.160 -9.469 6.086 845 HA ILE 104 HA ILE 104 -0.740 -7.213 6.135 846 HB ILE 104 HB ILE 104 1.508 -7.669 4.105 847 HG12 ILE 104 HG12 ILE 104 2.590 -7.589 6.313 848 HG13 ILE 104 HG11 ILE 104 2.932 -6.099 5.442 849 HG21 ILE 104 HG21 ILE 104 0.022 -5.125 4.894 850 HG22 ILE 104 HG22 ILE 104 -0.194 -6.041 3.402 851 HG23 ILE 104 HG23 ILE 104 1.337 -5.225 3.714 852 HD11 ILE 104 HD11 ILE 104 0.929 -6.472 7.655 853 HD12 ILE 104 HD12 ILE 104 1.186 -4.976 6.754 854 HD13 ILE 104 HD13 ILE 104 2.483 -5.644 7.743 855 H LEU 105 HN LEU 105 -2.333 -7.030 4.585 856 HA LEU 105 HA LEU 105 -2.445 -9.060 2.439 857 HB2 LEU 105 HB2 LEU 105 -4.847 -8.981 2.407 858 HB3 LEU 105 HB1 LEU 105 -4.316 -9.380 4.028 859 HG LEU 105 HG LEU 105 -5.290 -6.608 3.202 860 HD11 LEU 105 HD11 LEU 105 -6.866 -8.787 4.608 861 HD12 LEU 105 HD12 LEU 105 -7.111 -8.210 2.959 862 HD13 LEU 105 HD13 LEU 105 -7.399 -7.129 4.316 863 HD21 LEU 105 HD21 LEU 105 -3.831 -6.544 5.160 864 HD22 LEU 105 HD22 LEU 105 -4.807 -7.773 5.967 865 HD23 LEU 105 HD23 LEU 105 -5.494 -6.182 5.615 866 H CYS 106 HN CYS 106 -2.726 -8.337 0.474 867 HA CYS 106 HA CYS 106 -2.921 -5.516 -0.181 868 HB2 CYS 106 HB2 CYS 106 -0.323 -7.064 -0.641 869 HB3 CYS 106 HB1 CYS 106 -0.700 -5.493 -1.350 870 HG CYS 106 HG CYS 106 -1.173 -4.847 1.673 871 H ARG 107 HN ARG 107 -2.941 -5.243 -2.529 872 HA ARG 107 HA ARG 107 -3.168 -7.639 -4.179 873 HB2 ARG 107 HB2 ARG 107 -5.480 -7.094 -3.291 874 HB3 ARG 107 HB1 ARG 107 -5.374 -5.524 -4.075 875 HG2 ARG 107 HG2 ARG 107 -5.336 -6.572 -6.275 876 HG3 ARG 107 HG1 ARG 107 -5.257 -8.179 -5.543 877 HD2 ARG 107 HD2 ARG 107 -7.540 -7.671 -6.311 878 HD3 ARG 107 HD1 ARG 107 -7.488 -7.862 -4.557 879 HE ARG 107 HE ARG 107 -7.221 -5.123 -5.408 880 HH11 ARG 107 HH11 ARG 107 -9.576 -7.600 -4.630 881 HH12 ARG 107 HH12 ARG 107 -10.831 -6.456 -4.295 882 HH21 ARG 107 HH21 ARG 107 -8.840 -3.675 -5.002 883 HH22 ARG 107 HH22 ARG 107 -10.411 -4.219 -4.522 884 H GLU 108 HN GLU 108 -2.592 -7.216 -6.305 885 HA GLU 108 HA GLU 108 -0.504 -5.512 -6.602 886 HB2 GLU 108 HB2 GLU 108 -0.993 -7.523 -7.973 887 HB3 GLU 108 HB1 GLU 108 -2.182 -6.604 -8.888 888 HG2 GLU 108 HG2 GLU 108 -0.469 -5.156 -9.791 889 HG3 GLU 108 HG1 GLU 108 0.745 -5.838 -8.706 890 H GLY 109 HN GLY 109 -0.035 -3.618 -7.680 891 HA2 GLY 109 HA2 GLY 109 -2.130 -1.602 -7.421 892 HA3 GLY 109 HA1 GLY 109 -0.400 -1.332 -7.607 893 H ALA 110 HN ALA 110 -2.751 -3.139 -9.521 894 HA ALA 110 HA ALA 110 -2.019 -1.957 -12.022 895 HB1 ALA 110 HB1 ALA 110 -3.868 -3.324 -12.904 896 HB2 ALA 110 HB2 ALA 110 -4.406 -3.693 -11.265 897 HB3 ALA 110 HB3 ALA 110 -2.844 -4.285 -11.838 898 H GLU 111 HN GLU 111 -2.239 0.260 -11.169 899 HA GLU 111 HA GLU 111 -4.523 1.306 -9.942 900 HB2 GLU 111 HB2 GLU 111 -2.278 2.747 -11.421 901 HB3 GLU 111 HB1 GLU 111 -3.449 3.540 -10.366 902 HG2 GLU 111 HG2 GLU 111 -2.603 2.304 -8.436 903 HG3 GLU 111 HG1 GLU 111 -1.514 1.372 -9.463 904 H LYS 112 HN LYS 112 -6.374 0.963 -11.004 905 HA LYS 112 HA LYS 112 -7.209 2.641 -13.147 906 HB2 LYS 112 HB2 LYS 112 -6.063 0.985 -14.558 907 HB3 LYS 112 HB1 LYS 112 -6.860 -0.344 -13.728 908 HG2 LYS 112 HG2 LYS 112 -7.863 0.021 -15.928 909 HG3 LYS 112 HG1 LYS 112 -9.035 0.362 -14.647 910 HD2 LYS 112 HD2 LYS 112 -8.513 2.819 -14.917 911 HD3 LYS 112 HD1 LYS 112 -7.471 2.406 -16.285 912 HE2 LYS 112 HE2 LYS 112 -9.446 1.420 -17.448 913 HE3 LYS 112 HE1 LYS 112 -10.471 1.915 -16.098 914 HZ1 LYS 112 HZ1 LYS 112 -10.619 3.488 -17.867 915 HZ2 LYS 112 HZ2 LYS 112 -8.942 3.698 -17.909 916 HZ3 LYS 112 HZ3 LYS 112 -9.827 4.219 -16.563 Start of MODEL 8 1 H1 MET 1 HT1 MET 1 0.941 -23.899 13.465 2 H2 MET 1 HT2 MET 1 0.688 -22.265 13.817 3 H3 MET 1 HT3 MET 1 1.031 -23.348 15.065 4 HA MET 1 HA MET 1 2.933 -21.974 14.514 5 HB2 MET 1 HB2 MET 1 3.296 -24.905 13.738 6 HB3 MET 1 HB1 MET 1 4.591 -23.807 14.197 7 HG2 MET 1 HG2 MET 1 3.499 -23.571 16.448 8 HG3 MET 1 HG1 MET 1 2.364 -24.832 15.970 9 HE1 MET 1 HE1 MET 1 6.062 -23.930 16.903 10 HE2 MET 1 HE2 MET 1 6.296 -24.527 15.254 11 HE3 MET 1 HE3 MET 1 6.911 -25.455 16.613 12 H ASN 2 HN ASN 2 3.934 -20.855 12.969 13 HA ASN 2 HA ASN 2 2.923 -21.085 10.217 14 HB2 ASN 2 HB2 ASN 2 4.227 -18.788 11.741 15 HB3 ASN 2 HB1 ASN 2 3.733 -18.703 10.052 16 HD21 ASN 2 HD21 ASN 2 2.357 -16.936 10.638 17 HD22 ASN 2 HD22 ASN 2 0.841 -17.213 11.413 18 H ILE 3 HN ILE 3 4.199 -21.856 8.657 19 HA ILE 3 HA ILE 3 7.144 -21.885 9.009 20 HB ILE 3 HB ILE 3 7.098 -23.691 7.188 21 HG12 ILE 3 HG12 ILE 3 4.817 -25.005 7.131 22 HG13 ILE 3 HG11 ILE 3 4.085 -23.510 7.683 23 HG21 ILE 3 HG21 ILE 3 5.741 -24.301 9.846 24 HG22 ILE 3 HG22 ILE 3 7.479 -24.228 9.542 25 HG23 ILE 3 HG23 ILE 3 6.508 -25.494 8.790 26 HD11 ILE 3 HD11 ILE 3 5.581 -23.868 5.080 27 HD12 ILE 3 HD12 ILE 3 4.772 -22.397 5.631 28 HD13 ILE 3 HD13 ILE 3 3.830 -23.845 5.287 29 H GLY 4 HN GLY 4 5.127 -19.810 7.804 30 HA2 GLY 4 HA2 GLY 4 6.033 -19.369 5.077 31 HA3 GLY 4 HA1 GLY 4 4.959 -18.340 6.017 32 H ARG 5 HN ARG 5 8.288 -19.478 6.189 33 HA ARG 5 HA ARG 5 9.280 -17.364 7.783 34 HB2 ARG 5 HB2 ARG 5 11.510 -18.446 7.339 35 HB3 ARG 5 HB1 ARG 5 10.272 -19.566 7.898 36 HG2 ARG 5 HG2 ARG 5 9.919 -20.273 5.499 37 HG3 ARG 5 HG1 ARG 5 11.300 -19.263 5.055 38 HD2 ARG 5 HD2 ARG 5 12.737 -20.608 6.582 39 HD3 ARG 5 HD1 ARG 5 11.334 -21.613 6.978 40 HE ARG 5 HE ARG 5 12.208 -21.440 4.169 41 HH11 ARG 5 HH11 ARG 5 11.963 -23.383 7.112 42 HH12 ARG 5 HH12 ARG 5 12.334 -24.866 6.292 43 HH21 ARG 5 HH21 ARG 5 12.694 -23.392 3.131 44 HH22 ARG 5 HH22 ARG 5 12.734 -24.870 4.037 45 H LEU 6 HN LEU 6 10.626 -15.665 7.278 46 HA LEU 6 HA LEU 6 9.936 -14.270 4.880 47 HB2 LEU 6 HB2 LEU 6 11.752 -13.570 7.218 48 HB3 LEU 6 HB1 LEU 6 11.521 -12.497 5.857 49 HG LEU 6 HG LEU 6 9.139 -12.249 6.379 50 HD11 LEU 6 HD11 LEU 6 8.591 -14.421 7.356 51 HD12 LEU 6 HD12 LEU 6 8.099 -13.104 8.419 52 HD13 LEU 6 HD13 LEU 6 9.553 -14.038 8.789 53 HD21 LEU 6 HD21 LEU 6 10.889 -11.725 8.792 54 HD22 LEU 6 HD22 LEU 6 9.335 -10.961 8.445 55 HD23 LEU 6 HD23 LEU 6 10.706 -10.681 7.377 56 H ARG 7 HN ARG 7 10.942 -14.387 2.981 57 HA ARG 7 HA ARG 7 13.750 -15.350 2.784 58 HB2 ARG 7 HB2 ARG 7 13.093 -16.609 0.761 59 HB3 ARG 7 HB1 ARG 7 12.157 -17.144 2.152 60 HG2 ARG 7 HG2 ARG 7 10.190 -16.002 1.397 61 HG3 ARG 7 HG1 ARG 7 11.094 -15.107 0.179 62 HD2 ARG 7 HD2 ARG 7 11.580 -17.384 -0.908 63 HD3 ARG 7 HD1 ARG 7 10.314 -18.026 0.150 64 HE ARG 7 HE ARG 7 9.212 -15.811 -1.082 65 HH11 ARG 7 HH11 ARG 7 10.503 -18.881 -2.201 66 HH12 ARG 7 HH12 ARG 7 9.545 -18.889 -3.643 67 HH21 ARG 7 HH21 ARG 7 8.025 -15.812 -3.003 68 HH22 ARG 7 HH22 ARG 7 8.172 -17.132 -4.118 69 H ASP 8 HN ASP 8 11.323 -13.110 1.651 70 HA ASP 8 HA ASP 8 12.866 -12.142 -0.647 71 HB2 ASP 8 HB2 ASP 8 9.970 -11.573 0.166 72 HB3 ASP 8 HB1 ASP 8 10.736 -11.077 -1.342 73 H ARG 9 HN ARG 9 12.162 -9.615 -0.937 74 HA ARG 9 HA ARG 9 12.127 -8.153 1.621 75 HB2 ARG 9 HB2 ARG 9 14.012 -7.461 -0.678 76 HB3 ARG 9 HB1 ARG 9 13.693 -6.420 0.708 77 HG2 ARG 9 HG2 ARG 9 14.621 -8.223 2.190 78 HG3 ARG 9 HG1 ARG 9 15.072 -9.119 0.733 79 HD2 ARG 9 HD2 ARG 9 16.061 -6.352 1.515 80 HD3 ARG 9 HD1 ARG 9 16.967 -7.855 1.639 81 HE ARG 9 HE ARG 9 16.636 -7.957 -0.908 82 HH11 ARG 9 HH11 ARG 9 17.010 -4.950 0.858 83 HH12 ARG 9 HH12 ARG 9 17.773 -4.128 -0.462 84 HH21 ARG 9 HH21 ARG 9 17.635 -6.854 -2.644 85 HH22 ARG 9 HH22 ARG 9 18.130 -5.205 -2.443 86 H ILE 10 HN ILE 10 11.075 -6.198 1.556 87 HA ILE 10 HA ILE 10 9.805 -5.268 -0.951 88 HB ILE 10 HB ILE 10 7.637 -4.963 0.006 89 HG12 ILE 10 HG12 ILE 10 8.122 -4.217 2.272 90 HG13 ILE 10 HG11 ILE 10 6.976 -5.543 2.351 91 HG21 ILE 10 HG21 ILE 10 8.542 -7.744 0.785 92 HG22 ILE 10 HG22 ILE 10 7.964 -7.224 -0.800 93 HG23 ILE 10 HG23 ILE 10 6.863 -7.233 0.580 94 HD11 ILE 10 HD11 ILE 10 9.883 -5.542 3.097 95 HD12 ILE 10 HD12 ILE 10 8.930 -7.010 2.933 96 HD13 ILE 10 HD13 ILE 10 8.477 -5.803 4.129 97 H THR 11 HN THR 11 9.354 -3.011 -0.942 98 HA THR 11 HA THR 11 10.790 -1.441 1.097 99 HB THR 11 HB THR 11 10.036 -0.483 -1.705 100 HG1 THR 11 HG1 THR 11 12.469 -1.703 -0.838 101 HG21 THR 11 HG21 THR 11 11.857 1.142 -1.325 102 HG22 THR 11 HG22 THR 11 12.207 0.415 0.245 103 HG23 THR 11 HG23 THR 11 10.677 1.263 -0.014 104 H ILE 12 HN ILE 12 9.589 -0.184 2.378 105 HA ILE 12 HA ILE 12 6.720 -0.114 2.203 106 HB ILE 12 HB ILE 12 8.536 1.389 4.145 107 HG12 ILE 12 HG12 ILE 12 8.928 -1.041 4.325 108 HG13 ILE 12 HG11 ILE 12 8.090 -0.456 5.756 109 HG21 ILE 12 HG21 ILE 12 6.531 1.529 5.608 110 HG22 ILE 12 HG22 ILE 12 5.556 0.797 4.331 111 HG23 ILE 12 HG23 ILE 12 6.297 2.380 4.079 112 HD11 ILE 12 HD11 ILE 12 7.233 -2.599 5.050 113 HD12 ILE 12 HD12 ILE 12 6.847 -1.962 3.454 114 HD13 ILE 12 HD13 ILE 12 5.986 -1.366 4.877 115 H GLN 13 HN GLN 13 5.800 1.198 0.759 116 HA GLN 13 HA GLN 13 6.753 3.927 0.300 117 HB2 GLN 13 HB2 GLN 13 4.695 2.235 -1.156 118 HB3 GLN 13 HB1 GLN 13 4.866 3.966 -1.446 119 HG2 GLN 13 HG2 GLN 13 7.205 3.620 -2.134 120 HG3 GLN 13 HG1 GLN 13 7.027 1.882 -1.865 121 HE21 GLN 13 HE21 GLN 13 7.579 1.552 -4.061 122 HE22 GLN 13 HE22 GLN 13 6.428 1.808 -5.328 123 H THR 14 HN THR 14 6.256 4.978 2.002 124 HA THR 14 HA THR 14 3.647 4.951 3.290 125 HB THR 14 HB THR 14 5.855 6.995 3.801 126 HG1 THR 14 HG1 THR 14 5.744 4.291 4.728 127 HG21 THR 14 HG21 THR 14 3.734 7.260 5.045 128 HG22 THR 14 HG22 THR 14 5.058 6.824 6.129 129 HG23 THR 14 HG23 THR 14 3.881 5.604 5.636 130 H LEU 15 HN LEU 15 2.159 6.883 3.296 131 HA LEU 15 HA LEU 15 2.272 8.337 0.754 132 HB2 LEU 15 HB2 LEU 15 0.157 7.216 1.423 133 HB3 LEU 15 HB1 LEU 15 0.081 8.216 2.864 134 HG LEU 15 HG LEU 15 -0.150 10.246 1.431 135 HD11 LEU 15 HD11 LEU 15 1.007 9.519 -0.572 136 HD12 LEU 15 HD12 LEU 15 -0.631 10.007 -0.974 137 HD13 LEU 15 HD13 LEU 15 -0.225 8.297 -0.889 138 HD21 LEU 15 HD21 LEU 15 -2.466 9.862 0.738 139 HD22 LEU 15 HD22 LEU 15 -2.151 9.147 2.318 140 HD23 LEU 15 HD23 LEU 15 -2.241 8.116 0.886 141 H LYS 16 HN LYS 16 3.723 9.966 0.979 142 HA LYS 16 HA LYS 16 3.839 11.651 3.336 143 HB2 LYS 16 HB2 LYS 16 5.885 10.882 2.033 144 HB3 LYS 16 HB1 LYS 16 5.380 11.938 0.720 145 HG2 LYS 16 HG2 LYS 16 5.636 13.902 2.154 146 HG3 LYS 16 HG1 LYS 16 6.008 12.874 3.542 147 HD2 LYS 16 HD2 LYS 16 8.051 12.060 2.338 148 HD3 LYS 16 HD1 LYS 16 7.692 13.183 1.023 149 HE2 LYS 16 HE2 LYS 16 9.409 14.092 2.545 150 HE3 LYS 16 HE1 LYS 16 7.951 15.088 2.565 151 HZ1 LYS 16 HZ1 LYS 16 8.566 13.000 4.584 152 HZ2 LYS 16 HZ2 LYS 16 7.310 14.128 4.646 153 HZ3 LYS 16 HZ3 LYS 16 8.916 14.637 4.785 154 H GLN 17 HN GLN 17 2.095 12.933 3.453 155 HA GLN 17 HA GLN 17 0.995 14.335 1.147 156 HB2 GLN 17 HB2 GLN 17 0.190 14.260 4.092 157 HB3 GLN 17 HB1 GLN 17 -0.701 15.110 2.834 158 HG2 GLN 17 HG2 GLN 17 -1.049 12.930 1.655 159 HG3 GLN 17 HG1 GLN 17 -0.237 12.117 2.995 160 HE21 GLN 17 HE21 GLN 17 -3.129 13.813 1.998 161 HE22 GLN 17 HE22 GLN 17 -4.100 13.365 3.357 162 H THR 18 HN THR 18 2.667 15.702 0.569 163 HA THR 18 HA THR 18 3.932 17.487 2.511 164 HB THR 18 HB THR 18 4.549 16.985 -0.437 165 HG1 THR 18 HG1 THR 18 5.273 15.746 1.939 166 HG21 THR 18 HG21 THR 18 5.356 19.213 0.238 167 HG22 THR 18 HG22 THR 18 6.724 18.107 0.055 168 HG23 THR 18 HG23 THR 18 6.128 18.525 1.661 169 H ARG 19 HN ARG 19 3.364 19.600 2.695 170 HA ARG 19 HA ARG 19 1.162 20.591 1.128 171 HB2 ARG 19 HB2 ARG 19 1.435 20.928 3.633 172 HB3 ARG 19 HB1 ARG 19 2.704 22.097 3.274 173 HG2 ARG 19 HG2 ARG 19 1.098 23.515 2.070 174 HG3 ARG 19 HG1 ARG 19 -0.175 22.315 2.307 175 HD2 ARG 19 HD2 ARG 19 -0.465 24.134 3.882 176 HD3 ARG 19 HD1 ARG 19 -0.006 22.677 4.764 177 HE ARG 19 HE ARG 19 2.369 23.945 4.328 178 HH11 ARG 19 HH11 ARG 19 -0.643 24.911 5.848 179 HH12 ARG 19 HH12 ARG 19 0.119 26.051 6.908 180 HH21 ARG 19 HH21 ARG 19 3.357 25.431 5.742 181 HH22 ARG 19 HH22 ARG 19 2.378 26.342 6.844 182 H ASP 20 HN ASP 20 1.140 22.543 -0.066 183 HA ASP 20 HA ASP 20 3.610 23.004 -1.619 184 HB2 ASP 20 HB2 ASP 20 1.489 22.325 -2.818 185 HB3 ASP 20 HB1 ASP 20 0.716 23.789 -2.244 186 H ILE 21 HN ILE 21 4.048 25.335 -2.268 187 HA ILE 21 HA ILE 21 4.066 27.170 -0.176 188 HB ILE 21 HB ILE 21 5.682 27.115 -2.053 189 HG12 ILE 21 HG12 ILE 21 4.336 29.853 -1.849 190 HG13 ILE 21 HG11 ILE 21 5.452 29.197 -0.659 191 HG21 ILE 21 HG21 ILE 21 5.133 28.079 -4.256 192 HG22 ILE 21 HG22 ILE 21 3.452 28.279 -3.759 193 HG23 ILE 21 HG23 ILE 21 4.141 26.659 -3.906 194 HD11 ILE 21 HD11 ILE 21 6.538 30.812 -2.099 195 HD12 ILE 21 HD12 ILE 21 6.111 29.872 -3.527 196 HD13 ILE 21 HD13 ILE 21 7.239 29.212 -2.338 197 H THR 22 HN THR 22 1.336 26.376 -2.085 198 HA THR 22 HA THR 22 0.016 28.995 -1.603 199 HB THR 22 HB THR 22 -1.708 28.263 -3.232 200 HG1 THR 22 HG1 THR 22 -0.115 26.092 -4.050 201 HG21 THR 22 HG21 THR 22 0.213 29.538 -4.141 202 HG22 THR 22 HG22 THR 22 -0.401 28.370 -5.314 203 HG23 THR 22 HG23 THR 22 1.080 28.021 -4.421 204 H GLY 23 HN GLY 23 0.438 25.927 -0.464 205 HA2 GLY 23 HA2 GLY 23 -0.373 24.995 1.503 206 HA3 GLY 23 HA1 GLY 23 -1.704 26.134 1.497 207 H GLU 24 HN GLU 24 -0.598 23.703 -0.864 208 HA GLU 24 HA GLU 24 -3.220 22.360 -0.772 209 HB2 GLU 24 HB2 GLU 24 -1.024 22.253 -2.893 210 HB3 GLU 24 HB1 GLU 24 -2.547 21.367 -2.959 211 HG2 GLU 24 HG2 GLU 24 -3.787 23.475 -3.098 212 HG3 GLU 24 HG1 GLU 24 -2.275 24.386 -2.987 213 H ILE 25 HN ILE 25 -3.272 20.196 -0.155 214 HA ILE 25 HA ILE 25 -0.836 19.018 0.957 215 HB ILE 25 HB ILE 25 -3.739 18.069 1.011 216 HG12 ILE 25 HG12 ILE 25 -3.373 20.146 2.324 217 HG13 ILE 25 HG11 ILE 25 -3.726 18.787 3.383 218 HG21 ILE 25 HG21 ILE 25 -1.345 16.913 2.470 219 HG22 ILE 25 HG22 ILE 25 -2.269 16.133 1.185 220 HG23 ILE 25 HG23 ILE 25 -3.028 16.449 2.746 221 HD11 ILE 25 HD11 ILE 25 -0.996 19.976 2.876 222 HD12 ILE 25 HD12 ILE 25 -1.342 18.611 3.943 223 HD13 ILE 25 HD13 ILE 25 -1.999 20.204 4.308 224 H LEU 26 HN LEU 26 0.445 18.249 -0.672 225 HA LEU 26 HA LEU 26 -0.600 16.809 -2.974 226 HB2 LEU 26 HB2 LEU 26 2.214 17.634 -2.155 227 HB3 LEU 26 HB1 LEU 26 1.947 16.532 -3.490 228 HG LEU 26 HG LEU 26 2.328 18.750 -4.353 229 HD11 LEU 26 HD11 LEU 26 0.353 19.057 -5.754 230 HD12 LEU 26 HD12 LEU 26 -0.593 18.012 -4.689 231 HD13 LEU 26 HD13 LEU 26 0.771 17.352 -5.599 232 HD21 LEU 26 HD21 LEU 26 -0.019 19.711 -2.697 233 HD22 LEU 26 HD22 LEU 26 0.890 20.666 -3.874 234 HD23 LEU 26 HD23 LEU 26 1.685 20.081 -2.416 235 H GLU 27 HN GLU 27 -1.237 14.800 -2.612 236 HA GLU 27 HA GLU 27 0.040 13.011 -0.733 237 HB2 GLU 27 HB2 GLU 27 -2.120 12.526 -2.834 238 HB3 GLU 27 HB1 GLU 27 -1.594 11.350 -1.628 239 HG2 GLU 27 HG2 GLU 27 -2.375 12.798 0.176 240 HG3 GLU 27 HG1 GLU 27 -2.839 14.035 -0.995 241 H THR 28 HN THR 28 1.929 12.197 -1.229 242 HA THR 28 HA THR 28 2.491 11.061 -3.900 243 HB THR 28 HB THR 28 4.961 11.816 -3.502 244 HG1 THR 28 HG1 THR 28 3.595 13.296 -1.547 245 HG21 THR 28 HG21 THR 28 4.625 14.025 -4.556 246 HG22 THR 28 HG22 THR 28 2.910 13.960 -4.139 247 HG23 THR 28 HG23 THR 28 3.578 12.802 -5.291 248 H TRP 29 HN TRP 29 4.114 9.331 -3.799 249 HA TRP 29 HA TRP 29 3.915 7.867 -1.236 250 HB2 TRP 29 HB2 TRP 29 4.208 6.836 -4.099 251 HB3 TRP 29 HB1 TRP 29 4.267 5.808 -2.665 252 HD1 TRP 29 HD1 TRP 29 1.791 7.609 -4.923 253 HE1 TRP 29 HE1 TRP 29 -0.601 7.054 -4.171 254 HE3 TRP 29 HE3 TRP 29 2.855 5.289 -0.502 255 HZ2 TRP 29 HZ2 TRP 29 -1.878 5.820 -1.976 256 HZ3 TRP 29 HZ3 TRP 29 0.996 4.465 0.873 257 HH2 TRP 29 HH2 TRP 29 -1.328 4.722 0.158 258 H GLU 30 HN GLU 30 5.639 8.248 -0.129 259 HA GLU 30 HA GLU 30 8.293 8.645 -1.272 260 HB2 GLU 30 HB2 GLU 30 8.984 9.235 0.968 261 HB3 GLU 30 HB1 GLU 30 7.430 10.004 0.686 262 HG2 GLU 30 HG2 GLU 30 6.336 8.188 1.982 263 HG3 GLU 30 HG1 GLU 30 7.917 7.492 2.312 264 H ASP 31 HN ASP 31 9.944 7.130 -1.191 265 HA ASP 31 HA ASP 31 9.297 4.408 -0.370 266 HB2 ASP 31 HB2 ASP 31 11.353 3.707 -1.405 267 HB3 ASP 31 HB1 ASP 31 10.590 4.848 -2.499 268 H GLY 32 HN GLY 32 10.229 3.337 1.352 269 HA2 GLY 32 HA2 GLY 32 11.478 5.062 3.425 270 HA3 GLY 32 HA1 GLY 32 10.302 3.785 3.744 271 H HIS 33 HN HIS 33 11.037 1.771 4.165 272 HA HIS 33 HA HIS 33 13.923 1.226 3.689 273 HB2 HIS 33 HB2 HIS 33 13.475 1.575 6.115 274 HB3 HIS 33 HB1 HIS 33 12.282 0.283 6.090 275 HD1 HIS 33 HD1 HIS 33 13.169 -1.954 6.709 276 HD2 HIS 33 HD2 HIS 33 16.173 0.546 5.312 277 HE1 HIS 33 HE1 HIS 33 15.289 -3.285 6.886 278 HE2 HIS 33 HE2 HIS 33 17.040 -1.823 5.843 279 H THR 34 HN THR 34 14.478 -0.729 2.924 280 HA THR 34 HA THR 34 12.403 -2.535 1.958 281 HB THR 34 HB THR 34 15.400 -2.562 1.369 282 HG1 THR 34 HG1 THR 34 14.970 -1.275 -0.375 283 HG21 THR 34 HG21 THR 34 13.033 -3.722 -0.147 284 HG22 THR 34 HG22 THR 34 14.194 -4.656 0.806 285 HG23 THR 34 HG23 THR 34 14.724 -3.811 -0.648 286 H LEU 35 HN LEU 35 11.839 -3.794 3.779 287 HA LEU 35 HA LEU 35 14.010 -5.096 5.313 288 HB2 LEU 35 HB2 LEU 35 12.394 -5.517 7.089 289 HB3 LEU 35 HB1 LEU 35 12.469 -3.804 6.726 290 HG LEU 35 HG LEU 35 10.259 -5.460 5.477 291 HD11 LEU 35 HD11 LEU 35 8.800 -5.130 7.404 292 HD12 LEU 35 HD12 LEU 35 10.129 -4.413 8.321 293 HD13 LEU 35 HD13 LEU 35 10.200 -6.112 7.842 294 HD21 LEU 35 HD21 LEU 35 9.000 -3.358 5.646 295 HD22 LEU 35 HD22 LEU 35 10.510 -3.124 4.773 296 HD23 LEU 35 HD23 LEU 35 10.371 -2.585 6.448 297 H TRP 36 HN TRP 36 13.200 -7.243 6.276 298 HA TRP 36 HA TRP 36 12.974 -9.139 4.168 299 HB2 TRP 36 HB2 TRP 36 12.664 -9.769 7.127 300 HB3 TRP 36 HB1 TRP 36 13.304 -10.809 5.857 301 HD1 TRP 36 HD1 TRP 36 14.458 -8.661 8.612 302 HE1 TRP 36 HE1 TRP 36 16.952 -8.106 8.392 303 HE3 TRP 36 HE3 TRP 36 15.220 -10.132 3.768 304 HZ2 TRP 36 HZ2 TRP 36 18.974 -8.253 6.454 305 HZ3 TRP 36 HZ3 TRP 36 17.463 -9.874 2.810 306 HH2 TRP 36 HH2 TRP 36 19.307 -8.958 4.121 307 H ALA 37 HN ALA 37 11.259 -10.166 3.413 308 HA ALA 37 HA ALA 37 8.756 -10.456 4.938 309 HB1 ALA 37 HB1 ALA 37 7.394 -9.909 2.925 310 HB2 ALA 37 HB2 ALA 37 8.876 -9.442 2.074 311 HB3 ALA 37 HB3 ALA 37 8.348 -8.541 3.492 312 H SER 38 HN SER 38 7.344 -12.195 4.055 313 HA SER 38 HA SER 38 8.537 -13.919 1.987 314 HB2 SER 38 HB2 SER 38 8.315 -14.986 4.291 315 HB3 SER 38 HB1 SER 38 6.576 -14.710 4.207 316 HG SER 38 HG SER 38 7.862 -16.784 3.334 317 H VAL 39 HN VAL 39 7.550 -13.037 0.199 318 HA VAL 39 HA VAL 39 4.849 -11.954 0.303 319 HB VAL 39 HB VAL 39 6.760 -12.197 -2.072 320 HG11 VAL 39 HG11 VAL 39 4.279 -10.459 -1.778 321 HG12 VAL 39 HG12 VAL 39 4.404 -11.912 -2.773 322 HG13 VAL 39 HG13 VAL 39 5.368 -10.489 -3.168 323 HG21 VAL 39 HG21 VAL 39 7.334 -9.824 -1.674 324 HG22 VAL 39 HG22 VAL 39 7.780 -10.831 -0.297 325 HG23 VAL 39 HG23 VAL 39 6.335 -9.818 -0.217 326 H ASN 40 HN ASN 40 3.585 -13.780 0.682 327 HA ASN 40 HA ASN 40 3.641 -16.047 -1.145 328 HB2 ASN 40 HB2 ASN 40 1.931 -15.485 1.330 329 HB3 ASN 40 HB1 ASN 40 1.939 -16.995 0.427 330 HD21 ASN 40 HD21 ASN 40 3.695 -15.001 2.682 331 HD22 ASN 40 HD22 ASN 40 4.886 -16.174 3.115 332 H MET 41 HN MET 41 2.832 -15.358 -3.063 333 HA MET 41 HA MET 41 0.429 -13.755 -3.316 334 HB2 MET 41 HB2 MET 41 2.424 -13.645 -4.885 335 HB3 MET 41 HB1 MET 41 2.006 -15.250 -5.465 336 HG2 MET 41 HG2 MET 41 0.170 -12.858 -5.670 337 HG3 MET 41 HG1 MET 41 1.294 -13.355 -6.936 338 HE1 MET 41 HE1 MET 41 -0.530 -13.543 -8.750 339 HE2 MET 41 HE2 MET 41 -1.724 -12.950 -7.588 340 HE3 MET 41 HE3 MET 41 -2.056 -14.401 -8.540 341 H VAL 42 HN VAL 42 -1.496 -14.718 -2.875 342 HA VAL 42 HA VAL 42 -1.638 -17.566 -2.562 343 HB VAL 42 HB VAL 42 -3.694 -17.299 -1.433 344 HG11 VAL 42 HG11 VAL 42 -2.102 -14.798 -0.823 345 HG12 VAL 42 HG12 VAL 42 -1.812 -16.406 -0.158 346 HG13 VAL 42 HG13 VAL 42 -3.297 -15.539 0.246 347 HG21 VAL 42 HG21 VAL 42 -4.982 -16.023 -3.053 348 HG22 VAL 42 HG22 VAL 42 -4.073 -14.562 -2.679 349 HG23 VAL 42 HG23 VAL 42 -5.130 -15.277 -1.459 350 H SER 43 HN SER 43 -2.691 -19.045 -3.699 351 HA SER 43 HA SER 43 -3.863 -18.376 -6.299 352 HB2 SER 43 HB2 SER 43 -2.997 -21.069 -5.154 353 HB3 SER 43 HB1 SER 43 -3.528 -20.777 -6.813 354 HG SER 43 HG SER 43 -1.654 -19.057 -6.475 355 H SER 44 HN SER 44 -5.536 -20.361 -6.775 356 HA SER 44 HA SER 44 -7.956 -19.633 -5.659 357 HB2 SER 44 HB2 SER 44 -8.788 -21.840 -6.714 358 HB3 SER 44 HB1 SER 44 -7.976 -20.696 -7.783 359 HG SER 44 HG SER 44 -6.768 -22.336 -8.246 360 H LYS 45 HN LYS 45 -5.874 -22.366 -4.731 361 HA LYS 45 HA LYS 45 -7.640 -23.716 -3.024 362 HB2 LYS 45 HB2 LYS 45 -5.524 -24.717 -3.830 363 HB3 LYS 45 HB1 LYS 45 -4.597 -23.591 -2.855 364 HG2 LYS 45 HG2 LYS 45 -4.659 -25.795 -1.803 365 HG3 LYS 45 HG1 LYS 45 -5.482 -24.602 -0.795 366 HD2 LYS 45 HD2 LYS 45 -7.677 -25.414 -1.694 367 HD3 LYS 45 HD1 LYS 45 -6.815 -26.656 -2.612 368 HE2 LYS 45 HE2 LYS 45 -7.717 -27.639 -0.577 369 HE3 LYS 45 HE1 LYS 45 -5.957 -27.585 -0.446 370 HZ1 LYS 45 HZ1 LYS 45 -6.183 -25.558 0.882 371 HZ2 LYS 45 HZ2 LYS 45 -6.987 -26.858 1.603 372 HZ3 LYS 45 HZ3 LYS 45 -7.866 -25.665 0.785 373 H GLU 46 HN GLU 46 -5.227 -21.190 -2.189 374 HA GLU 46 HA GLU 46 -5.773 -20.992 0.566 375 HB2 GLU 46 HB2 GLU 46 -4.782 -18.871 -1.376 376 HB3 GLU 46 HB1 GLU 46 -4.826 -18.642 0.370 377 HG2 GLU 46 HG2 GLU 46 -3.188 -20.718 -1.109 378 HG3 GLU 46 HG1 GLU 46 -2.583 -19.207 -0.440 379 H ALA 47 HN ALA 47 -7.238 -19.293 -2.186 380 HA ALA 47 HA ALA 47 -8.816 -17.432 -0.736 381 HB1 ALA 47 HB1 ALA 47 -8.240 -17.138 -3.119 382 HB2 ALA 47 HB2 ALA 47 -9.988 -17.066 -2.880 383 HB3 ALA 47 HB3 ALA 47 -9.243 -18.527 -3.541 384 H ILE 48 HN ILE 48 -9.473 -20.678 -1.940 385 HA ILE 48 HA ILE 48 -12.268 -20.736 -1.229 386 HB ILE 48 HB ILE 48 -10.382 -23.010 -2.005 387 HG12 ILE 48 HG12 ILE 48 -12.432 -21.567 -3.746 388 HG13 ILE 48 HG11 ILE 48 -10.715 -21.191 -3.746 389 HG21 ILE 48 HG21 ILE 48 -12.427 -24.319 -2.532 390 HG22 ILE 48 HG22 ILE 48 -13.420 -23.024 -1.864 391 HG23 ILE 48 HG23 ILE 48 -12.323 -23.922 -0.813 392 HD11 ILE 48 HD11 ILE 48 -11.933 -23.837 -4.547 393 HD12 ILE 48 HD12 ILE 48 -10.215 -23.433 -4.574 394 HD13 ILE 48 HD13 ILE 48 -11.334 -22.587 -5.640 395 H SER 49 HN SER 49 -9.240 -21.720 0.321 396 HA SER 49 HA SER 49 -10.374 -22.990 2.634 397 HB2 SER 49 HB2 SER 49 -7.640 -21.685 2.234 398 HB3 SER 49 HB1 SER 49 -8.087 -22.685 3.620 399 HG SER 49 HG SER 49 -8.308 -23.620 0.969 400 H SER 50 HN SER 50 -9.774 -19.707 1.683 401 HA SER 50 HA SER 50 -10.375 -18.557 4.312 402 HB2 SER 50 HB2 SER 50 -8.563 -17.595 2.854 403 HB3 SER 50 HB1 SER 50 -9.779 -17.204 1.639 404 HG SER 50 HG SER 50 -9.363 -16.070 4.183 405 H GLY 51 HN GLY 51 -12.045 -19.625 1.542 406 HA2 GLY 51 HA2 GLY 51 -14.324 -19.754 1.162 407 HA3 GLY 51 HA1 GLY 51 -14.608 -18.628 2.485 408 H ALA 52 HN ALA 52 -14.138 -16.364 2.091 409 HA ALA 52 HA ALA 52 -13.935 -15.371 -0.641 410 HB1 ALA 52 HB1 ALA 52 -16.351 -15.851 -0.420 411 HB2 ALA 52 HB2 ALA 52 -16.066 -14.115 -0.547 412 HB3 ALA 52 HB3 ALA 52 -16.432 -14.839 1.022 413 H GLU 53 HN GLU 53 -12.811 -15.200 2.341 414 HA GLU 53 HA GLU 53 -12.878 -12.362 2.888 415 HB2 GLU 53 HB2 GLU 53 -12.612 -14.038 4.724 416 HB3 GLU 53 HB1 GLU 53 -11.053 -14.513 4.065 417 HG2 GLU 53 HG2 GLU 53 -10.145 -12.287 4.521 418 HG3 GLU 53 HG1 GLU 53 -11.726 -11.740 5.079 419 H LEU 54 HN LEU 54 -10.251 -14.623 1.893 420 HA LEU 54 HA LEU 54 -8.835 -12.508 0.465 421 HB2 LEU 54 HB2 LEU 54 -8.253 -15.499 0.580 422 HB3 LEU 54 HB1 LEU 54 -7.211 -14.287 -0.155 423 HG LEU 54 HG LEU 54 -7.825 -14.601 2.809 424 HD11 LEU 54 HD11 LEU 54 -5.231 -15.007 1.281 425 HD12 LEU 54 HD12 LEU 54 -6.261 -16.272 1.959 426 HD13 LEU 54 HD13 LEU 54 -5.439 -15.143 3.032 427 HD21 LEU 54 HD21 LEU 54 -7.644 -12.210 2.284 428 HD22 LEU 54 HD22 LEU 54 -6.090 -12.476 1.492 429 HD23 LEU 54 HD23 LEU 54 -6.258 -12.751 3.228 430 H ALA 55 HN ALA 55 -8.203 -12.958 -1.818 431 HA ALA 55 HA ALA 55 -10.292 -14.292 -3.444 432 HB1 ALA 55 HB1 ALA 55 -9.040 -11.576 -4.026 433 HB2 ALA 55 HB2 ALA 55 -10.695 -11.856 -3.485 434 HB3 ALA 55 HB3 ALA 55 -10.179 -12.440 -5.068 435 H ILE 56 HN ILE 56 -9.500 -14.855 -5.623 436 HA ILE 56 HA ILE 56 -6.948 -16.149 -5.500 437 HB ILE 56 HB ILE 56 -8.730 -15.744 -7.964 438 HG12 ILE 56 HG12 ILE 56 -8.733 -18.054 -5.956 439 HG13 ILE 56 HG11 ILE 56 -9.987 -16.832 -6.114 440 HG21 ILE 56 HG21 ILE 56 -6.562 -17.827 -7.452 441 HG22 ILE 56 HG22 ILE 56 -6.439 -16.454 -8.556 442 HG23 ILE 56 HG23 ILE 56 -7.593 -17.746 -8.882 443 HD11 ILE 56 HD11 ILE 56 -9.261 -18.920 -8.171 444 HD12 ILE 56 HD12 ILE 56 -10.495 -17.673 -8.369 445 HD13 ILE 56 HD13 ILE 56 -10.680 -18.905 -7.124 446 H GLY 57 HN GLY 57 -5.152 -14.942 -5.533 447 HA2 GLY 57 HA2 GLY 57 -3.564 -13.784 -6.968 448 HA3 GLY 57 HA1 GLY 57 -4.860 -12.744 -7.528 449 H THR 58 HN THR 58 -5.284 -13.256 -4.255 450 HA THR 58 HA THR 58 -4.475 -10.640 -3.480 451 HB THR 58 HB THR 58 -5.382 -13.055 -1.864 452 HG1 THR 58 HG1 THR 58 -6.830 -11.733 -3.283 453 HG21 THR 58 HG21 THR 58 -4.794 -10.263 -0.808 454 HG22 THR 58 HG22 THR 58 -3.948 -11.749 -0.365 455 HG23 THR 58 HG23 THR 58 -5.639 -11.528 0.088 456 H VAL 59 HN VAL 59 -2.504 -9.963 -3.043 457 HA VAL 59 HA VAL 59 -0.286 -11.806 -2.705 458 HB VAL 59 HB VAL 59 -0.241 -8.756 -2.757 459 HG11 VAL 59 HG11 VAL 59 1.795 -9.737 -1.789 460 HG12 VAL 59 HG12 VAL 59 2.156 -9.065 -3.380 461 HG13 VAL 59 HG13 VAL 59 1.975 -10.811 -3.182 462 HG21 VAL 59 HG21 VAL 59 -1.272 -9.615 -4.828 463 HG22 VAL 59 HG22 VAL 59 0.087 -10.715 -5.077 464 HG23 VAL 59 HG23 VAL 59 0.335 -8.970 -5.170 465 H ARG 60 HN ARG 60 -0.392 -12.682 -0.728 466 HA ARG 60 HA ARG 60 -0.849 -11.145 1.723 467 HB2 ARG 60 HB2 ARG 60 -1.855 -13.417 1.252 468 HB3 ARG 60 HB1 ARG 60 -0.238 -14.101 1.268 469 HG2 ARG 60 HG2 ARG 60 -0.019 -13.503 3.664 470 HG3 ARG 60 HG1 ARG 60 -1.656 -12.834 3.635 471 HD2 ARG 60 HD2 ARG 60 -2.540 -15.064 2.972 472 HD3 ARG 60 HD1 ARG 60 -0.900 -15.718 3.045 473 HE ARG 60 HE ARG 60 -1.855 -14.511 5.500 474 HH11 ARG 60 HH11 ARG 60 -1.508 -17.492 3.686 475 HH12 ARG 60 HH12 ARG 60 -1.808 -18.499 5.062 476 HH21 ARG 60 HH21 ARG 60 -2.222 -15.825 7.297 477 HH22 ARG 60 HH22 ARG 60 -2.207 -17.549 7.122 478 H ILE 61 HN ILE 61 0.872 -10.529 3.071 479 HA ILE 61 HA ILE 61 3.633 -11.100 2.146 480 HB ILE 61 HB ILE 61 2.480 -8.300 2.589 481 HG12 ILE 61 HG12 ILE 61 3.663 -9.501 0.037 482 HG13 ILE 61 HG11 ILE 61 1.938 -9.452 0.374 483 HG21 ILE 61 HG21 ILE 61 5.357 -9.084 1.946 484 HG22 ILE 61 HG22 ILE 61 4.778 -8.389 3.461 485 HG23 ILE 61 HG23 ILE 61 4.728 -7.432 1.983 486 HD11 ILE 61 HD11 ILE 61 3.757 -7.084 0.015 487 HD12 ILE 61 HD12 ILE 61 2.040 -6.994 0.418 488 HD13 ILE 61 HD13 ILE 61 2.551 -7.686 -1.123 489 H TRP 62 HN TRP 62 4.585 -11.965 3.838 490 HA TRP 62 HA TRP 62 3.783 -11.303 6.597 491 HB2 TRP 62 HB2 TRP 62 5.407 -13.602 5.411 492 HB3 TRP 62 HB1 TRP 62 5.145 -13.383 7.137 493 HD1 TRP 62 HD1 TRP 62 2.220 -12.912 4.640 494 HE1 TRP 62 HE1 TRP 62 0.525 -14.791 5.067 495 HE3 TRP 62 HE3 TRP 62 4.924 -15.696 7.928 496 HZ2 TRP 62 HZ2 TRP 62 0.359 -17.159 6.585 497 HZ3 TRP 62 HZ3 TRP 62 3.945 -17.760 8.813 498 HH2 TRP 62 HH2 TRP 62 1.705 -18.483 8.159 499 H ILE 63 HN ILE 63 4.990 -9.806 7.597 500 HA ILE 63 HA ILE 63 7.903 -9.559 7.007 501 HB ILE 63 HB ILE 63 7.738 -7.125 7.495 502 HG12 ILE 63 HG12 ILE 63 4.704 -7.514 7.485 503 HG13 ILE 63 HG11 ILE 63 5.668 -7.208 8.924 504 HG21 ILE 63 HG21 ILE 63 7.669 -7.831 5.155 505 HG22 ILE 63 HG22 ILE 63 6.654 -6.406 5.384 506 HG23 ILE 63 HG23 ILE 63 5.914 -8.003 5.227 507 HD11 ILE 63 HD11 ILE 63 5.250 -5.346 6.596 508 HD12 ILE 63 HD12 ILE 63 6.336 -5.028 7.950 509 HD13 ILE 63 HD13 ILE 63 4.602 -5.186 8.228 510 H ARG 64 HN ARG 64 9.187 -8.907 8.949 511 HA ARG 64 HA ARG 64 8.357 -9.804 11.429 512 HB2 ARG 64 HB2 ARG 64 10.513 -7.848 10.625 513 HB3 ARG 64 HB1 ARG 64 10.168 -8.082 12.337 514 HG2 ARG 64 HG2 ARG 64 11.066 -10.217 10.371 515 HG3 ARG 64 HG1 ARG 64 12.020 -9.515 11.682 516 HD2 ARG 64 HD2 ARG 64 10.352 -10.447 13.315 517 HD3 ARG 64 HD1 ARG 64 9.527 -11.241 11.970 518 HE ARG 64 HE ARG 64 12.231 -11.992 11.945 519 HH11 ARG 64 HH11 ARG 64 9.370 -12.517 13.928 520 HH12 ARG 64 HH12 ARG 64 9.936 -14.029 14.550 521 HH21 ARG 64 HH21 ARG 64 12.970 -13.951 12.809 522 HH22 ARG 64 HH22 ARG 64 11.970 -14.849 13.905 523 H TYR 65 HN TYR 65 7.814 -8.747 13.393 524 HA TYR 65 HA TYR 65 5.355 -7.404 13.088 525 HB2 TYR 65 HB2 TYR 65 5.914 -9.030 14.907 526 HB3 TYR 65 HB1 TYR 65 6.992 -7.844 15.625 527 HD1 TYR 65 HD2 TYR 65 3.470 -8.787 15.071 528 HD2 TYR 65 HD1 TYR 65 6.053 -5.881 16.843 529 HE1 TYR 65 HE2 TYR 65 1.591 -7.913 16.387 530 HE2 TYR 65 HE1 TYR 65 4.180 -5.012 18.153 531 HH TYR 65 HH TYR 65 1.251 -6.642 18.494 532 H ARG 66 HN ARG 66 4.906 -5.309 12.961 533 HA ARG 66 HA ARG 66 6.437 -3.280 14.352 534 HB2 ARG 66 HB2 ARG 66 6.684 -1.911 12.160 535 HB3 ARG 66 HB1 ARG 66 7.811 -3.236 12.430 536 HG2 ARG 66 HG2 ARG 66 6.334 -4.661 10.944 537 HG3 ARG 66 HG1 ARG 66 5.437 -3.188 10.553 538 HD2 ARG 66 HD2 ARG 66 8.408 -3.639 10.086 539 HD3 ARG 66 HD1 ARG 66 7.150 -3.690 8.851 540 HE ARG 66 HE ARG 66 6.735 -1.262 9.600 541 HH11 ARG 66 HH11 ARG 66 9.923 -2.721 9.584 542 HH12 ARG 66 HH12 ARG 66 10.723 -1.235 9.183 543 HH21 ARG 66 HH21 ARG 66 7.786 0.647 9.071 544 HH22 ARG 66 HH22 ARG 66 9.507 0.677 8.889 545 H LYS 67 HN LYS 67 5.163 -1.638 14.972 546 HA LYS 67 HA LYS 67 2.302 -1.750 14.440 547 HB2 LYS 67 HB2 LYS 67 3.810 0.252 16.173 548 HB3 LYS 67 HB1 LYS 67 2.091 -0.124 16.241 549 HG2 LYS 67 HG2 LYS 67 4.374 -1.961 17.037 550 HG3 LYS 67 HG1 LYS 67 3.290 -1.101 18.138 551 HD2 LYS 67 HD2 LYS 67 2.437 -3.261 16.158 552 HD3 LYS 67 HD1 LYS 67 2.727 -3.516 17.878 553 HE2 LYS 67 HE2 LYS 67 0.880 -1.954 18.411 554 HE3 LYS 67 HE1 LYS 67 0.581 -1.738 16.682 555 HZ1 LYS 67 HZ1 LYS 67 -0.903 -3.370 17.718 556 HZ2 LYS 67 HZ2 LYS 67 0.428 -4.336 18.117 557 HZ3 LYS 67 HZ3 LYS 67 0.040 -4.058 16.494 558 H ASP 68 HN ASP 68 4.486 -0.680 12.482 559 HA ASP 68 HA ASP 68 3.999 2.190 12.285 560 HB2 ASP 68 HB2 ASP 68 6.320 1.442 12.263 561 HB3 ASP 68 HB1 ASP 68 5.992 0.271 10.989 562 H ILE 69 HN ILE 69 3.142 -0.762 10.628 563 HA ILE 69 HA ILE 69 2.767 0.422 8.030 564 HB ILE 69 HB ILE 69 1.644 -2.272 8.903 565 HG12 ILE 69 HG12 ILE 69 4.019 -2.307 9.459 566 HG13 ILE 69 HG11 ILE 69 3.763 -3.285 8.022 567 HG21 ILE 69 HG21 ILE 69 1.828 -2.825 6.482 568 HG22 ILE 69 HG22 ILE 69 2.402 -1.191 6.151 569 HG23 ILE 69 HG23 ILE 69 0.764 -1.446 6.761 570 HD11 ILE 69 HD11 ILE 69 4.869 -0.477 8.068 571 HD12 ILE 69 HD12 ILE 69 4.664 -1.490 6.634 572 HD13 ILE 69 HD13 ILE 69 5.799 -1.962 7.901 573 H ASN 70 HN ASN 70 0.942 1.112 7.096 574 HA ASN 70 HA ASN 70 -1.658 0.952 8.472 575 HB2 ASN 70 HB2 ASN 70 -0.432 3.179 8.965 576 HB3 ASN 70 HB1 ASN 70 -0.591 3.538 7.246 577 HD21 ASN 70 HD21 ASN 70 -2.289 3.238 10.296 578 HD22 ASN 70 HD22 ASN 70 -3.766 3.956 9.763 579 H ALA 71 HN ALA 71 -3.441 1.527 6.960 580 HA ALA 71 HA ALA 71 -3.322 0.234 4.469 581 HB1 ALA 71 HB1 ALA 71 -5.590 1.129 4.120 582 HB2 ALA 71 HB2 ALA 71 -5.356 2.257 5.460 583 HB3 ALA 71 HB3 ALA 71 -5.396 0.520 5.767 584 H THR 72 HN THR 72 -2.581 3.503 5.384 585 HA THR 72 HA THR 72 -2.517 4.550 2.669 586 HB THR 72 HB THR 72 -1.646 6.644 3.793 587 HG1 THR 72 HG1 THR 72 -0.669 6.001 5.615 588 HG21 THR 72 HG21 THR 72 -3.731 7.247 4.969 589 HG22 THR 72 HG22 THR 72 -4.212 5.550 5.020 590 HG23 THR 72 HG23 THR 72 -4.087 6.387 3.470 591 H SER 73 HN SER 73 -0.738 2.282 3.514 592 HA SER 73 HA SER 73 1.726 3.385 2.314 593 HB2 SER 73 HB2 SER 73 2.192 2.677 4.651 594 HB3 SER 73 HB1 SER 73 1.523 1.080 4.314 595 HG SER 73 HG SER 73 3.482 1.824 2.547 596 H ARG 74 HN ARG 74 2.212 2.435 0.363 597 HA ARG 74 HA ARG 74 0.908 -0.106 -0.388 598 HB2 ARG 74 HB2 ARG 74 2.504 1.836 -2.127 599 HB3 ARG 74 HB1 ARG 74 1.722 0.355 -2.690 600 HG2 ARG 74 HG2 ARG 74 -0.475 1.269 -2.179 601 HG3 ARG 74 HG1 ARG 74 0.261 2.721 -1.494 602 HD2 ARG 74 HD2 ARG 74 -0.552 3.187 -3.737 603 HD3 ARG 74 HD1 ARG 74 1.211 3.275 -3.713 604 HE ARG 74 HE ARG 74 0.646 0.696 -4.491 605 HH11 ARG 74 HH11 ARG 74 -0.177 3.876 -5.731 606 HH12 ARG 74 HH12 ARG 74 -0.267 3.344 -7.376 607 HH21 ARG 74 HH21 ARG 74 0.501 0.011 -6.662 608 HH22 ARG 74 HH22 ARG 74 0.118 1.157 -7.909 609 H ILE 75 HN ILE 75 2.176 -1.850 -1.106 610 HA ILE 75 HA ILE 75 4.914 -1.945 0.018 611 HB ILE 75 HB ILE 75 2.936 -4.236 -0.439 612 HG12 ILE 75 HG12 ILE 75 2.138 -2.751 1.384 613 HG13 ILE 75 HG11 ILE 75 2.630 -4.316 2.016 614 HG21 ILE 75 HG21 ILE 75 5.639 -4.224 0.946 615 HG22 ILE 75 HG22 ILE 75 5.246 -4.995 -0.592 616 HG23 ILE 75 HG23 ILE 75 4.526 -5.590 0.904 617 HD11 ILE 75 HD11 ILE 75 4.198 -1.744 2.181 618 HD12 ILE 75 HD12 ILE 75 4.744 -3.312 2.780 619 HD13 ILE 75 HD13 ILE 75 3.326 -2.544 3.489 620 H LYS 76 HN LYS 76 6.356 -1.694 -1.677 621 HA LYS 76 HA LYS 76 5.782 -3.034 -4.256 622 HB2 LYS 76 HB2 LYS 76 6.413 -0.581 -4.311 623 HB3 LYS 76 HB1 LYS 76 8.008 -1.017 -3.697 624 HG2 LYS 76 HG2 LYS 76 8.491 -2.313 -5.700 625 HG3 LYS 76 HG1 LYS 76 6.834 -2.130 -6.269 626 HD2 LYS 76 HD2 LYS 76 8.113 -0.612 -7.566 627 HD3 LYS 76 HD1 LYS 76 7.268 0.378 -6.381 628 HE2 LYS 76 HE2 LYS 76 9.499 1.216 -6.522 629 HE3 LYS 76 HE1 LYS 76 9.400 0.340 -4.994 630 HZ1 LYS 76 HZ1 LYS 76 10.460 -1.550 -6.067 631 HZ2 LYS 76 HZ2 LYS 76 11.435 -0.169 -6.160 632 HZ3 LYS 76 HZ3 LYS 76 10.567 -0.693 -7.519 633 H VAL 77 HN VAL 77 6.593 -5.022 -4.456 634 HA VAL 77 HA VAL 77 8.495 -6.144 -2.640 635 HB VAL 77 HB VAL 77 7.418 -7.281 -5.266 636 HG11 VAL 77 HG11 VAL 77 8.866 -8.735 -3.012 637 HG12 VAL 77 HG12 VAL 77 9.506 -8.426 -4.627 638 HG13 VAL 77 HG13 VAL 77 8.123 -9.503 -4.420 639 HG21 VAL 77 HG21 VAL 77 5.642 -6.802 -3.614 640 HG22 VAL 77 HG22 VAL 77 6.485 -7.779 -2.412 641 HG23 VAL 77 HG23 VAL 77 5.830 -8.539 -3.865 642 H SER 78 HN SER 78 10.528 -5.430 -2.696 643 HA SER 78 HA SER 78 11.866 -4.366 -4.985 644 HB2 SER 78 HB2 SER 78 12.323 -3.591 -2.673 645 HB3 SER 78 HB1 SER 78 13.007 -5.167 -2.279 646 HG SER 78 HG SER 78 14.038 -3.721 -4.463 647 H THR 79 HN THR 79 11.671 -7.514 -3.582 648 HA THR 79 HA THR 79 12.894 -8.763 -5.824 649 HB THR 79 HB THR 79 14.990 -8.165 -4.598 650 HG1 THR 79 HG1 THR 79 15.874 -10.259 -4.755 651 HG21 THR 79 HG21 THR 79 14.021 -10.073 -2.432 652 HG22 THR 79 HG22 THR 79 14.203 -8.327 -2.252 653 HG23 THR 79 HG23 THR 79 15.622 -9.336 -2.529 654 H GLY 80 HN GLY 80 12.062 -10.769 -6.067 655 HA2 GLY 80 HA2 GLY 80 11.488 -12.818 -4.516 656 HA3 GLY 80 HA1 GLY 80 10.182 -11.739 -4.031 657 HA PRO 81 HA PRO 81 8.596 -14.323 -7.566 658 HB2 PRO 81 HB2 PRO 81 6.033 -14.563 -6.651 659 HB3 PRO 81 HB1 PRO 81 7.352 -15.562 -6.020 660 HG2 PRO 81 HG2 PRO 81 6.179 -13.025 -4.869 661 HG3 PRO 81 HG1 PRO 81 6.519 -14.562 -4.041 662 HD2 PRO 81 HD2 PRO 81 8.220 -12.463 -3.888 663 HD3 PRO 81 HD1 PRO 81 8.823 -14.138 -3.931 664 H LEU 82 HN LEU 82 7.638 -11.253 -6.253 665 HA LEU 82 HA LEU 82 6.319 -10.448 -8.782 666 HB2 LEU 82 HB2 LEU 82 5.505 -9.640 -5.957 667 HB3 LEU 82 HB1 LEU 82 4.755 -9.070 -7.445 668 HG LEU 82 HG LEU 82 4.684 -11.936 -6.406 669 HD11 LEU 82 HD11 LEU 82 3.343 -10.401 -5.046 670 HD12 LEU 82 HD12 LEU 82 2.325 -11.524 -5.940 671 HD13 LEU 82 HD13 LEU 82 2.480 -9.852 -6.487 672 HD21 LEU 82 HD21 LEU 82 3.271 -10.745 -8.827 673 HD22 LEU 82 HD22 LEU 82 3.074 -12.389 -8.210 674 HD23 LEU 82 HD23 LEU 82 4.624 -11.882 -8.867 675 H ALA 83 HN ALA 83 9.062 -10.153 -8.169 676 HA ALA 83 HA ALA 83 9.791 -7.687 -6.984 677 HB1 ALA 83 HB1 ALA 83 11.991 -8.051 -8.003 678 HB2 ALA 83 HB2 ALA 83 11.317 -9.301 -9.054 679 HB3 ALA 83 HB3 ALA 83 11.374 -9.549 -7.308 680 H GLY 84 HN GLY 84 8.727 -5.918 -7.727 681 HA2 GLY 84 HA2 GLY 84 9.386 -4.155 -9.515 682 HA3 GLY 84 HA1 GLY 84 8.612 -5.296 -10.617 683 H ARG 85 HN ARG 85 6.593 -6.119 -8.699 684 HA ARG 85 HA ARG 85 4.561 -4.239 -9.347 685 HB2 ARG 85 HB2 ARG 85 4.616 -6.746 -7.648 686 HB3 ARG 85 HB1 ARG 85 3.172 -5.740 -7.700 687 HG2 ARG 85 HG2 ARG 85 3.005 -6.068 -10.127 688 HG3 ARG 85 HG1 ARG 85 4.468 -7.064 -10.101 689 HD2 ARG 85 HD2 ARG 85 3.384 -8.742 -8.750 690 HD3 ARG 85 HD1 ARG 85 1.976 -7.715 -8.490 691 HE ARG 85 HE ARG 85 1.140 -8.367 -10.487 692 HH11 ARG 85 HH11 ARG 85 4.556 -9.202 -10.587 693 HH12 ARG 85 HH12 ARG 85 4.374 -10.219 -11.977 694 HH21 ARG 85 HH21 ARG 85 0.908 -9.706 -12.251 695 HH22 ARG 85 HH22 ARG 85 2.288 -10.523 -12.915 696 H VAL 86 HN VAL 86 3.579 -2.716 -8.194 697 HA VAL 86 HA VAL 86 4.390 -2.196 -5.396 698 HB VAL 86 HB VAL 86 5.047 -0.334 -6.783 699 HG11 VAL 86 HG11 VAL 86 3.624 -0.676 -8.738 700 HG12 VAL 86 HG12 VAL 86 3.508 0.997 -8.187 701 HG13 VAL 86 HG13 VAL 86 2.205 -0.145 -7.835 702 HG21 VAL 86 HG21 VAL 86 3.824 1.535 -5.707 703 HG22 VAL 86 HG22 VAL 86 4.189 0.246 -4.557 704 HG23 VAL 86 HG23 VAL 86 2.555 0.417 -5.206 705 H LEU 87 HN LEU 87 3.005 -3.601 -4.524 706 HA LEU 87 HA LEU 87 0.245 -3.893 -5.223 707 HB2 LEU 87 HB2 LEU 87 1.725 -4.957 -2.777 708 HB3 LEU 87 HB1 LEU 87 0.114 -5.437 -3.279 709 HG LEU 87 HG LEU 87 1.473 -7.215 -3.971 710 HD11 LEU 87 HD11 LEU 87 1.231 -5.515 -6.457 711 HD12 LEU 87 HD12 LEU 87 -0.034 -6.527 -5.756 712 HD13 LEU 87 HD13 LEU 87 1.432 -7.269 -6.392 713 HD21 LEU 87 HD21 LEU 87 3.653 -6.195 -3.589 714 HD22 LEU 87 HD22 LEU 87 3.520 -5.300 -5.106 715 HD23 LEU 87 HD23 LEU 87 3.608 -7.065 -5.121 716 H ASN 88 HN ASN 88 -1.549 -3.427 -3.982 717 HA ASN 88 HA ASN 88 -1.313 -1.113 -2.147 718 HB2 ASN 88 HB2 ASN 88 -3.582 -1.994 -4.001 719 HB3 ASN 88 HB1 ASN 88 -3.715 -0.681 -2.834 720 HD21 ASN 88 HD21 ASN 88 -1.837 -1.740 -5.645 721 HD22 ASN 88 HD22 ASN 88 -1.550 -0.157 -6.262 722 H ILE 89 HN ILE 89 -2.404 -1.224 -0.166 723 HA ILE 89 HA ILE 89 -2.810 -3.922 0.856 724 HB ILE 89 HB ILE 89 -3.013 -1.223 2.286 725 HG12 ILE 89 HG12 ILE 89 -0.789 -3.318 2.318 726 HG13 ILE 89 HG11 ILE 89 -0.709 -1.743 1.531 727 HG21 ILE 89 HG21 ILE 89 -3.059 -4.014 3.518 728 HG22 ILE 89 HG22 ILE 89 -4.418 -2.892 3.436 729 HG23 ILE 89 HG23 ILE 89 -3.009 -2.492 4.417 730 HD11 ILE 89 HD11 ILE 89 -0.927 -2.224 4.507 731 HD12 ILE 89 HD12 ILE 89 -0.853 -0.639 3.720 732 HD13 ILE 89 HD13 ILE 89 0.520 -1.745 3.619 733 H ILE 90 HN ILE 90 -4.678 -4.831 0.312 734 HA ILE 90 HA ILE 90 -7.134 -3.363 -0.129 735 HB ILE 90 HB ILE 90 -8.130 -5.700 -0.518 736 HG12 ILE 90 HG12 ILE 90 -5.208 -6.616 -0.440 737 HG13 ILE 90 HG11 ILE 90 -6.364 -6.955 0.828 738 HG21 ILE 90 HG21 ILE 90 -7.100 -5.930 -2.747 739 HG22 ILE 90 HG22 ILE 90 -5.772 -4.875 -2.260 740 HG23 ILE 90 HG23 ILE 90 -7.415 -4.235 -2.362 741 HD11 ILE 90 HD11 ILE 90 -6.057 -8.864 -0.610 742 HD12 ILE 90 HD12 ILE 90 -6.533 -7.918 -2.017 743 HD13 ILE 90 HD13 ILE 90 -7.709 -8.264 -0.745 744 H GLY 91 HN GLY 91 -7.201 -2.434 2.009 745 HA2 GLY 91 HA2 GLY 91 -8.891 -2.624 3.836 746 HA3 GLY 91 HA1 GLY 91 -8.211 -4.218 4.167 747 H GLN 92 HN GLN 92 -7.345 -3.903 6.168 748 HA GLN 92 HA GLN 92 -5.234 -1.848 6.497 749 HB2 GLN 92 HB2 GLN 92 -7.277 -2.722 8.600 750 HB3 GLN 92 HB1 GLN 92 -5.940 -1.607 8.884 751 HG2 GLN 92 HG2 GLN 92 -6.934 -0.001 7.305 752 HG3 GLN 92 HG1 GLN 92 -8.262 -1.119 6.988 753 HE21 GLN 92 HE21 GLN 92 -8.360 1.593 8.013 754 HE22 GLN 92 HE22 GLN 92 -9.158 1.525 9.542 755 HA PRO 93 HA PRO 93 -2.600 -5.398 7.359 756 HB2 PRO 93 HB2 PRO 93 -0.840 -4.199 9.197 757 HB3 PRO 93 HB1 PRO 93 -0.708 -4.080 7.438 758 HG2 PRO 93 HG2 PRO 93 -1.988 -2.156 9.380 759 HG3 PRO 93 HG1 PRO 93 -0.902 -1.809 8.016 760 HD2 PRO 93 HD2 PRO 93 -3.511 -1.425 7.746 761 HD3 PRO 93 HD1 PRO 93 -2.604 -2.178 6.411 762 H LEU 94 HN LEU 94 -2.440 -7.054 8.847 763 HA LEU 94 HA LEU 94 -3.938 -6.777 11.387 764 HB2 LEU 94 HB2 LEU 94 -5.020 -8.029 9.313 765 HB3 LEU 94 HB1 LEU 94 -3.930 -9.329 9.734 766 HG LEU 94 HG LEU 94 -6.234 -9.686 10.576 767 HD11 LEU 94 HD11 LEU 94 -4.406 -10.744 11.790 768 HD12 LEU 94 HD12 LEU 94 -5.743 -10.340 12.861 769 HD13 LEU 94 HD13 LEU 94 -4.281 -9.345 12.859 770 HD21 LEU 94 HD21 LEU 94 -7.167 -8.331 12.390 771 HD22 LEU 94 HD22 LEU 94 -6.907 -7.375 10.933 772 HD23 LEU 94 HD23 LEU 94 -5.789 -7.233 12.293 773 HA PRO 95 HA PRO 95 0.105 -8.240 12.965 774 HB2 PRO 95 HB2 PRO 95 -0.667 -8.489 15.622 775 HB3 PRO 95 HB1 PRO 95 -0.205 -6.958 14.865 776 HG2 PRO 95 HG2 PRO 95 -2.969 -8.090 15.313 777 HG3 PRO 95 HG1 PRO 95 -2.371 -6.447 15.632 778 HD2 PRO 95 HD2 PRO 95 -3.789 -6.969 13.407 779 HD3 PRO 95 HD1 PRO 95 -2.403 -5.850 13.350 780 H ASP 96 HN ASP 96 0.967 -10.224 13.729 781 HA ASP 96 HA ASP 96 -0.443 -12.600 13.011 782 HB2 ASP 96 HB2 ASP 96 1.962 -12.489 12.758 783 HB3 ASP 96 HB1 ASP 96 2.178 -12.088 14.457 784 H ALA 97 HN ALA 97 -1.104 -14.321 14.345 785 HA ALA 97 HA ALA 97 -2.535 -13.765 16.705 786 HB1 ALA 97 HB1 ALA 97 -2.824 -16.213 16.847 787 HB2 ALA 97 HB2 ALA 97 -1.535 -16.443 15.661 788 HB3 ALA 97 HB3 ALA 97 -3.038 -15.647 15.190 789 H ALA 98 HN ALA 98 0.699 -15.196 16.245 790 HA ALA 98 HA ALA 98 1.191 -15.415 19.137 791 HB1 ALA 98 HB1 ALA 98 3.287 -16.519 18.475 792 HB2 ALA 98 HB2 ALA 98 2.981 -16.129 16.780 793 HB3 ALA 98 HB3 ALA 98 1.912 -17.241 17.638 794 H ARG 99 HN ARG 99 1.427 -12.988 16.845 795 HA ARG 99 HA ARG 99 2.267 -10.902 16.780 796 HB2 ARG 99 HB2 ARG 99 2.714 -11.464 19.717 797 HB3 ARG 99 HB1 ARG 99 3.289 -9.962 19.015 798 HG2 ARG 99 HG2 ARG 99 1.192 -9.498 20.046 799 HG3 ARG 99 HG1 ARG 99 0.926 -9.462 18.305 800 HD2 ARG 99 HD2 ARG 99 -0.114 -11.664 18.376 801 HD3 ARG 99 HD1 ARG 99 0.275 -11.826 20.089 802 HE ARG 99 HE ARG 99 -1.244 -9.901 20.482 803 HH11 ARG 99 HH11 ARG 99 -1.745 -11.826 17.579 804 HH12 ARG 99 HH12 ARG 99 -3.423 -11.419 17.467 805 HH21 ARG 99 HH21 ARG 99 -3.437 -9.402 20.315 806 HH22 ARG 99 HH22 ARG 99 -4.382 -10.070 19.020 807 H THR 100 HN THR 100 4.132 -13.345 16.375 808 HA THR 100 HA THR 100 6.771 -12.270 16.964 809 HB THR 100 HB THR 100 6.338 -14.722 17.080 810 HG1 THR 100 HG1 THR 100 8.255 -15.312 15.886 811 HG21 THR 100 HG21 THR 100 6.194 -16.066 15.016 812 HG22 THR 100 HG22 THR 100 6.107 -14.591 14.050 813 HG23 THR 100 HG23 THR 100 4.803 -14.991 15.171 814 H ARG 101 HN ARG 101 4.532 -11.559 14.639 815 HA ARG 101 HA ARG 101 6.300 -10.259 12.847 816 HB2 ARG 101 HB2 ARG 101 5.831 -11.608 10.789 817 HB3 ARG 101 HB1 ARG 101 6.746 -12.493 11.986 818 HG2 ARG 101 HG2 ARG 101 5.290 -14.161 11.410 819 HG3 ARG 101 HG1 ARG 101 4.320 -13.398 12.668 820 HD2 ARG 101 HD2 ARG 101 3.216 -12.044 10.804 821 HD3 ARG 101 HD1 ARG 101 4.028 -13.131 9.662 822 HE ARG 101 HE ARG 101 2.544 -14.533 11.699 823 HH11 ARG 101 HH11 ARG 101 2.317 -13.088 8.549 824 HH12 ARG 101 HH12 ARG 101 0.775 -13.790 8.190 825 HH21 ARG 101 HH21 ARG 101 0.476 -15.390 11.291 826 HH22 ARG 101 HH22 ARG 101 -0.287 -15.091 9.757 827 H LEU 102 HN LEU 102 4.985 -9.304 10.976 828 HA LEU 102 HA LEU 102 2.197 -8.733 11.788 829 HB2 LEU 102 HB2 LEU 102 4.257 -6.902 11.535 830 HB3 LEU 102 HB1 LEU 102 3.624 -6.860 9.907 831 HG LEU 102 HG LEU 102 2.675 -5.043 11.170 832 HD11 LEU 102 HD11 LEU 102 0.274 -5.389 10.927 833 HD12 LEU 102 HD12 LEU 102 0.513 -7.138 10.807 834 HD13 LEU 102 HD13 LEU 102 1.158 -6.068 9.561 835 HD21 LEU 102 HD21 LEU 102 1.340 -5.348 13.221 836 HD22 LEU 102 HD22 LEU 102 3.003 -5.884 13.428 837 HD23 LEU 102 HD23 LEU 102 1.719 -7.077 13.216 838 H GLU 103 HN GLU 103 0.614 -9.309 10.312 839 HA GLU 103 HA GLU 103 1.510 -10.331 7.696 840 HB2 GLU 103 HB2 GLU 103 0.133 -11.872 9.120 841 HB3 GLU 103 HB1 GLU 103 -1.217 -10.747 8.988 842 HG2 GLU 103 HG2 GLU 103 -1.288 -11.040 6.569 843 HG3 GLU 103 HG1 GLU 103 0.164 -12.039 6.608 844 H ILE 104 HN ILE 104 1.441 -8.897 6.156 845 HA ILE 104 HA ILE 104 -0.615 -6.813 6.025 846 HB ILE 104 HB ILE 104 1.618 -7.295 3.988 847 HG12 ILE 104 HG12 ILE 104 2.773 -7.083 6.134 848 HG13 ILE 104 HG11 ILE 104 2.988 -5.585 5.239 849 HG21 ILE 104 HG21 ILE 104 1.329 -4.898 3.469 850 HG22 ILE 104 HG22 ILE 104 0.072 -4.770 4.701 851 HG23 ILE 104 HG23 ILE 104 -0.189 -5.779 3.278 852 HD11 ILE 104 HD11 ILE 104 2.597 -5.112 7.547 853 HD12 ILE 104 HD12 ILE 104 1.115 -6.063 7.549 854 HD13 ILE 104 HD13 ILE 104 1.204 -4.564 6.617 855 H LEU 105 HN LEU 105 -2.311 -6.948 4.637 856 HA LEU 105 HA LEU 105 -2.379 -9.098 2.611 857 HB2 LEU 105 HB2 LEU 105 -4.812 -8.954 2.589 858 HB3 LEU 105 HB1 LEU 105 -4.246 -9.315 4.207 859 HG LEU 105 HG LEU 105 -5.201 -6.557 3.308 860 HD11 LEU 105 HD11 LEU 105 -7.053 -8.144 3.209 861 HD12 LEU 105 HD12 LEU 105 -7.272 -6.991 4.520 862 HD13 LEU 105 HD13 LEU 105 -6.748 -8.640 4.879 863 HD21 LEU 105 HD21 LEU 105 -5.328 -6.016 5.702 864 HD22 LEU 105 HD22 LEU 105 -3.684 -6.412 5.217 865 HD23 LEU 105 HD23 LEU 105 -4.646 -7.595 6.109 866 H CYS 106 HN CYS 106 -2.560 -8.527 0.566 867 HA CYS 106 HA CYS 106 -2.969 -5.784 -0.302 868 HB2 CYS 106 HB2 CYS 106 -0.291 -7.173 -0.817 869 HB3 CYS 106 HB1 CYS 106 -0.803 -5.644 -1.517 870 HG CYS 106 HG CYS 106 -1.110 -5.110 1.601 871 H ARG 107 HN ARG 107 -2.826 -5.705 -2.717 872 HA ARG 107 HA ARG 107 -2.711 -8.186 -4.180 873 HB2 ARG 107 HB2 ARG 107 -5.142 -7.966 -3.309 874 HB3 ARG 107 HB1 ARG 107 -5.310 -6.594 -4.397 875 HG2 ARG 107 HG2 ARG 107 -4.922 -8.040 -6.335 876 HG3 ARG 107 HG1 ARG 107 -4.596 -9.416 -5.278 877 HD2 ARG 107 HD2 ARG 107 -6.947 -9.202 -4.402 878 HD3 ARG 107 HD1 ARG 107 -7.234 -7.965 -5.634 879 HE ARG 107 HE ARG 107 -6.218 -10.367 -6.787 880 HH11 ARG 107 HH11 ARG 107 -9.164 -8.895 -5.578 881 HH12 ARG 107 HH12 ARG 107 -10.206 -9.965 -6.455 882 HH21 ARG 107 HH21 ARG 107 -7.584 -11.777 -7.913 883 HH22 ARG 107 HH22 ARG 107 -9.305 -11.617 -7.763 884 H GLU 108 HN GLU 108 -2.738 -7.852 -6.450 885 HA GLU 108 HA GLU 108 -1.331 -5.623 -7.450 886 HB2 GLU 108 HB2 GLU 108 -3.003 -7.694 -8.949 887 HB3 GLU 108 HB1 GLU 108 -1.724 -6.705 -9.645 888 HG2 GLU 108 HG2 GLU 108 -0.020 -7.897 -8.481 889 HG3 GLU 108 HG1 GLU 108 -1.183 -8.650 -7.388 890 H GLY 109 HN GLY 109 -2.037 -3.845 -8.619 891 HA2 GLY 109 HA2 GLY 109 -4.878 -3.137 -8.624 892 HA3 GLY 109 HA1 GLY 109 -3.527 -2.120 -9.122 893 H ALA 110 HN ALA 110 -4.566 -5.368 -10.073 894 HA ALA 110 HA ALA 110 -4.636 -6.498 -11.993 895 HB1 ALA 110 HB1 ALA 110 -6.811 -5.389 -12.068 896 HB2 ALA 110 HB2 ALA 110 -6.170 -5.648 -13.695 897 HB3 ALA 110 HB3 ALA 110 -6.105 -4.041 -12.964 898 H GLU 111 HN GLU 111 -4.501 -3.572 -13.887 899 HA GLU 111 HA GLU 111 -1.743 -3.531 -14.554 900 HB2 GLU 111 HB2 GLU 111 -2.048 -4.323 -16.968 901 HB3 GLU 111 HB1 GLU 111 -2.125 -5.591 -15.751 902 HG2 GLU 111 HG2 GLU 111 -4.601 -5.564 -15.892 903 HG3 GLU 111 HG1 GLU 111 -4.503 -4.312 -17.131 904 H LYS 112 HN LYS 112 -3.978 -1.855 -13.767 905 HA LYS 112 HA LYS 112 -4.531 -0.126 -16.102 906 HB2 LYS 112 HB2 LYS 112 -6.505 0.653 -14.587 907 HB3 LYS 112 HB1 LYS 112 -6.613 -0.953 -15.307 908 HG2 LYS 112 HG2 LYS 112 -5.885 -1.973 -13.191 909 HG3 LYS 112 HG1 LYS 112 -5.759 -0.375 -12.445 910 HD2 LYS 112 HD2 LYS 112 -8.326 -1.610 -13.532 911 HD3 LYS 112 HD1 LYS 112 -7.842 -1.622 -11.834 912 HE2 LYS 112 HE2 LYS 112 -7.879 0.887 -11.858 913 HE3 LYS 112 HE1 LYS 112 -8.484 0.832 -13.516 914 HZ1 LYS 112 HZ1 LYS 112 -10.420 -0.399 -12.686 915 HZ2 LYS 112 HZ2 LYS 112 -10.279 1.122 -11.968 916 HZ3 LYS 112 HZ3 LYS 112 -9.834 -0.262 -11.105 Start of MODEL 9 1 H1 MET 1 HT1 MET 1 6.572 -16.508 17.261 2 H2 MET 1 HT2 MET 1 7.642 -17.809 17.374 3 H3 MET 1 HT3 MET 1 6.110 -17.922 18.070 4 HA MET 1 HA MET 1 6.262 -19.171 16.036 5 HB2 MET 1 HB2 MET 1 4.121 -17.933 16.844 6 HB3 MET 1 HB1 MET 1 4.456 -16.761 15.581 7 HG2 MET 1 HG2 MET 1 4.381 -18.692 13.933 8 HG3 MET 1 HG1 MET 1 3.761 -19.686 15.249 9 HE1 MET 1 HE1 MET 1 0.329 -17.856 16.012 10 HE2 MET 1 HE2 MET 1 1.870 -17.495 16.793 11 HE3 MET 1 HE3 MET 1 1.402 -19.169 16.488 12 H ASN 2 HN ASN 2 8.122 -16.459 16.017 13 HA ASN 2 HA ASN 2 8.251 -15.897 13.191 14 HB2 ASN 2 HB2 ASN 2 10.260 -14.553 13.725 15 HB3 ASN 2 HB1 ASN 2 8.915 -14.141 14.773 16 HD21 ASN 2 HD21 ASN 2 9.082 -14.537 16.979 17 HD22 ASN 2 HD22 ASN 2 10.570 -14.979 17.739 18 H ILE 3 HN ILE 3 9.212 -17.080 11.728 19 HA ILE 3 HA ILE 3 11.449 -18.927 12.338 20 HB ILE 3 HB ILE 3 9.113 -19.567 10.426 21 HG12 ILE 3 HG12 ILE 3 9.641 -20.702 13.221 22 HG13 ILE 3 HG11 ILE 3 8.306 -19.650 12.770 23 HG21 ILE 3 HG21 ILE 3 11.229 -20.641 9.733 24 HG22 ILE 3 HG22 ILE 3 10.075 -21.848 10.289 25 HG23 ILE 3 HG23 ILE 3 11.407 -21.361 11.336 26 HD11 ILE 3 HD11 ILE 3 8.736 -22.480 11.808 27 HD12 ILE 3 HD12 ILE 3 7.414 -21.418 11.317 28 HD13 ILE 3 HD13 ILE 3 7.556 -21.929 12.997 29 H GLY 4 HN GLY 4 12.627 -19.455 10.167 30 HA2 GLY 4 HA2 GLY 4 13.229 -17.080 8.662 31 HA3 GLY 4 HA1 GLY 4 13.877 -18.692 8.398 32 H ARG 5 HN ARG 5 10.622 -17.248 8.220 33 HA ARG 5 HA ARG 5 9.914 -18.557 5.734 34 HB2 ARG 5 HB2 ARG 5 8.478 -16.471 7.442 35 HB3 ARG 5 HB1 ARG 5 7.768 -17.252 6.038 36 HG2 ARG 5 HG2 ARG 5 8.758 -19.000 8.280 37 HG3 ARG 5 HG1 ARG 5 7.271 -18.086 8.523 38 HD2 ARG 5 HD2 ARG 5 6.719 -20.311 7.739 39 HD3 ARG 5 HD1 ARG 5 6.307 -19.142 6.489 40 HE ARG 5 HE ARG 5 8.905 -20.304 6.097 41 HH11 ARG 5 HH11 ARG 5 5.473 -20.876 5.550 42 HH12 ARG 5 HH12 ARG 5 5.745 -22.009 4.270 43 HH21 ARG 5 HH21 ARG 5 9.228 -21.797 4.388 44 HH22 ARG 5 HH22 ARG 5 7.855 -22.513 3.609 45 H LEU 6 HN LEU 6 11.270 -15.553 6.796 46 HA LEU 6 HA LEU 6 10.464 -13.856 4.640 47 HB2 LEU 6 HB2 LEU 6 12.860 -13.486 6.486 48 HB3 LEU 6 HB1 LEU 6 12.022 -12.238 5.575 49 HG LEU 6 HG LEU 6 10.924 -13.752 7.987 50 HD11 LEU 6 HD11 LEU 6 12.642 -12.109 8.590 51 HD12 LEU 6 HD12 LEU 6 11.057 -11.612 9.169 52 HD13 LEU 6 HD13 LEU 6 11.755 -10.836 7.743 53 HD21 LEU 6 HD21 LEU 6 8.970 -12.268 7.875 54 HD22 LEU 6 HD22 LEU 6 9.109 -13.258 6.426 55 HD23 LEU 6 HD23 LEU 6 9.580 -11.557 6.376 56 H ARG 7 HN ARG 7 11.025 -14.656 2.650 57 HA ARG 7 HA ARG 7 13.831 -15.478 2.106 58 HB2 ARG 7 HB2 ARG 7 13.012 -16.792 0.279 59 HB3 ARG 7 HB1 ARG 7 11.922 -17.112 1.617 60 HG2 ARG 7 HG2 ARG 7 10.325 -15.440 0.616 61 HG3 ARG 7 HG1 ARG 7 11.401 -15.329 -0.770 62 HD2 ARG 7 HD2 ARG 7 9.922 -16.873 -1.593 63 HD3 ARG 7 HD1 ARG 7 11.035 -17.983 -0.794 64 HE ARG 7 HE ARG 7 9.437 -18.423 0.825 65 HH11 ARG 7 HH11 ARG 7 8.306 -15.691 -1.112 66 HH12 ARG 7 HH12 ARG 7 6.640 -15.922 -0.682 67 HH21 ARG 7 HH21 ARG 7 7.250 -18.687 1.410 68 HH22 ARG 7 HH22 ARG 7 6.040 -17.630 0.757 69 H ASP 8 HN ASP 8 11.285 -13.262 1.223 70 HA ASP 8 HA ASP 8 12.747 -12.080 -1.037 71 HB2 ASP 8 HB2 ASP 8 9.920 -11.478 -0.035 72 HB3 ASP 8 HB1 ASP 8 10.620 -10.966 -1.571 73 H ARG 9 HN ARG 9 12.044 -9.535 -1.068 74 HA ARG 9 HA ARG 9 12.302 -8.228 1.517 75 HB2 ARG 9 HB2 ARG 9 14.686 -8.790 0.781 76 HB3 ARG 9 HB1 ARG 9 14.443 -7.750 -0.619 77 HG2 ARG 9 HG2 ARG 9 14.137 -5.815 0.847 78 HG3 ARG 9 HG1 ARG 9 14.286 -6.841 2.273 79 HD2 ARG 9 HD2 ARG 9 16.371 -5.627 1.840 80 HD3 ARG 9 HD1 ARG 9 16.611 -7.369 1.672 81 HE ARG 9 HE ARG 9 16.062 -5.902 -0.790 82 HH11 ARG 9 HH11 ARG 9 18.536 -7.289 1.283 83 HH12 ARG 9 HH12 ARG 9 19.762 -7.217 0.061 84 HH21 ARG 9 HH21 ARG 9 17.687 -5.819 -2.369 85 HH22 ARG 9 HH22 ARG 9 19.294 -6.361 -1.997 86 H ILE 10 HN ILE 10 10.987 -6.501 1.453 87 HA ILE 10 HA ILE 10 10.256 -5.285 -1.160 88 HB ILE 10 HB ILE 10 8.021 -4.960 -0.491 89 HG12 ILE 10 HG12 ILE 10 8.381 -4.038 1.776 90 HG13 ILE 10 HG11 ILE 10 7.072 -5.201 1.762 91 HG21 ILE 10 HG21 ILE 10 8.394 -7.297 -1.036 92 HG22 ILE 10 HG22 ILE 10 7.128 -7.158 0.181 93 HG23 ILE 10 HG23 ILE 10 8.749 -7.676 0.652 94 HD11 ILE 10 HD11 ILE 10 8.394 -5.362 3.747 95 HD12 ILE 10 HD12 ILE 10 9.854 -5.659 2.806 96 HD13 ILE 10 HD13 ILE 10 8.539 -6.836 2.805 97 H THR 11 HN THR 11 9.803 -2.995 -1.131 98 HA THR 11 HA THR 11 10.845 -1.491 1.196 99 HB THR 11 HB THR 11 10.450 -0.426 -1.645 100 HG1 THR 11 HG1 THR 11 12.150 -2.132 -1.210 101 HG21 THR 11 HG21 THR 11 11.959 0.711 0.747 102 HG22 THR 11 HG22 THR 11 10.421 1.317 0.129 103 HG23 THR 11 HG23 THR 11 11.868 1.440 -0.867 104 H ILE 12 HN ILE 12 9.593 0.173 2.039 105 HA ILE 12 HA ILE 12 6.679 -0.138 1.734 106 HB ILE 12 HB ILE 12 8.325 1.095 3.990 107 HG12 ILE 12 HG12 ILE 12 8.773 -1.303 3.878 108 HG13 ILE 12 HG11 ILE 12 7.786 -0.964 5.291 109 HG21 ILE 12 HG21 ILE 12 6.076 2.056 3.929 110 HG22 ILE 12 HG22 ILE 12 6.269 1.021 5.343 111 HG23 ILE 12 HG23 ILE 12 5.361 0.441 3.945 112 HD11 ILE 12 HD11 ILE 12 6.798 -2.132 2.688 113 HD12 ILE 12 HD12 ILE 12 5.817 -1.813 4.124 114 HD13 ILE 12 HD13 ILE 12 7.112 -3.007 4.187 115 H GLN 13 HN GLN 13 5.922 1.358 0.258 116 HA GLN 13 HA GLN 13 6.987 4.045 0.038 117 HB2 GLN 13 HB2 GLN 13 4.459 2.872 -1.218 118 HB3 GLN 13 HB1 GLN 13 5.062 4.490 -1.524 119 HG2 GLN 13 HG2 GLN 13 5.661 3.166 -3.396 120 HG3 GLN 13 HG1 GLN 13 7.149 3.445 -2.488 121 HE21 GLN 13 HE21 GLN 13 8.193 1.682 -1.543 122 HE22 GLN 13 HE22 GLN 13 7.716 0.048 -1.826 123 H THR 14 HN THR 14 6.741 5.023 1.980 124 HA THR 14 HA THR 14 4.238 5.122 3.424 125 HB THR 14 HB THR 14 5.598 6.896 4.782 126 HG1 THR 14 HG1 THR 14 7.203 6.706 2.751 127 HG21 THR 14 HG21 THR 14 6.931 5.158 5.940 128 HG22 THR 14 HG22 THR 14 6.661 4.050 4.593 129 HG23 THR 14 HG23 THR 14 5.301 4.577 5.589 130 H LEU 15 HN LEU 15 3.068 7.145 3.826 131 HA LEU 15 HA LEU 15 2.802 8.605 1.297 132 HB2 LEU 15 HB2 LEU 15 0.831 7.438 2.350 133 HB3 LEU 15 HB1 LEU 15 0.904 8.596 3.672 134 HG LEU 15 HG LEU 15 0.502 10.453 2.056 135 HD11 LEU 15 HD11 LEU 15 0.218 8.254 -0.005 136 HD12 LEU 15 HD12 LEU 15 1.445 9.521 0.036 137 HD13 LEU 15 HD13 LEU 15 -0.236 9.938 -0.251 138 HD21 LEU 15 HD21 LEU 15 -1.863 10.007 1.626 139 HD22 LEU 15 HD22 LEU 15 -1.395 9.500 3.247 140 HD23 LEU 15 HD23 LEU 15 -1.616 8.293 1.978 141 H LYS 16 HN LYS 16 4.324 10.161 1.364 142 HA LYS 16 HA LYS 16 4.674 12.068 3.489 143 HB2 LYS 16 HB2 LYS 16 6.480 11.436 1.873 144 HB3 LYS 16 HB1 LYS 16 5.571 12.207 0.580 145 HG2 LYS 16 HG2 LYS 16 5.798 14.390 1.709 146 HG3 LYS 16 HG1 LYS 16 6.682 13.615 3.030 147 HD2 LYS 16 HD2 LYS 16 8.465 12.949 1.421 148 HD3 LYS 16 HD1 LYS 16 7.584 13.773 0.125 149 HE2 LYS 16 HE2 LYS 16 8.666 15.119 2.631 150 HE3 LYS 16 HE1 LYS 16 9.440 15.155 1.047 151 HZ1 LYS 16 HZ1 LYS 16 7.568 16.342 0.160 152 HZ2 LYS 16 HZ2 LYS 16 8.131 17.151 1.532 153 HZ3 LYS 16 HZ3 LYS 16 6.728 16.217 1.621 154 H GLN 17 HN GLN 17 2.735 13.068 3.900 155 HA GLN 17 HA GLN 17 1.116 14.285 1.791 156 HB2 GLN 17 HB2 GLN 17 0.783 14.361 4.835 157 HB3 GLN 17 HB1 GLN 17 -0.421 14.868 3.649 158 HG2 GLN 17 HG2 GLN 17 -0.564 12.541 2.805 159 HG3 GLN 17 HG1 GLN 17 0.634 12.042 3.997 160 HE21 GLN 17 HE21 GLN 17 -2.692 12.935 3.478 161 HE22 GLN 17 HE22 GLN 17 -3.267 12.480 5.046 162 H THR 18 HN THR 18 1.920 16.103 0.948 163 HA THR 18 HA THR 18 3.617 17.927 2.556 164 HB THR 18 HB THR 18 3.678 17.446 -0.467 165 HG1 THR 18 HG1 THR 18 4.502 15.601 0.330 166 HG21 THR 18 HG21 THR 18 4.551 19.670 0.213 167 HG22 THR 18 HG22 THR 18 5.850 18.628 -0.379 168 HG23 THR 18 HG23 THR 18 5.649 18.887 1.355 169 H ARG 19 HN ARG 19 2.657 19.865 2.952 170 HA ARG 19 HA ARG 19 0.254 20.626 1.499 171 HB2 ARG 19 HB2 ARG 19 0.375 20.674 4.000 172 HB3 ARG 19 HB1 ARG 19 1.534 21.989 3.895 173 HG2 ARG 19 HG2 ARG 19 -0.114 23.460 2.901 174 HG3 ARG 19 HG1 ARG 19 -1.275 22.143 2.750 175 HD2 ARG 19 HD2 ARG 19 -1.865 23.574 4.632 176 HD3 ARG 19 HD1 ARG 19 -1.405 21.968 5.208 177 HE ARG 19 HE ARG 19 0.825 23.756 5.235 178 HH11 ARG 19 HH11 ARG 19 -2.102 23.016 7.048 179 HH12 ARG 19 HH12 ARG 19 -1.453 23.585 8.551 180 HH21 ARG 19 HH21 ARG 19 1.641 24.513 7.211 181 HH22 ARG 19 HH22 ARG 19 0.661 24.438 8.642 182 H ASP 20 HN ASP 20 -0.007 22.459 0.271 183 HA ASP 20 HA ASP 20 2.432 23.731 -0.811 184 HB2 ASP 20 HB2 ASP 20 0.718 22.410 -2.231 185 HB3 ASP 20 HB1 ASP 20 -0.389 23.746 -1.972 186 H ILE 21 HN ILE 21 1.679 26.096 -1.775 187 HA ILE 21 HA ILE 21 1.878 27.807 0.370 188 HB ILE 21 HB ILE 21 2.561 28.477 -1.880 189 HG12 ILE 21 HG12 ILE 21 0.487 30.362 -0.671 190 HG13 ILE 21 HG11 ILE 21 2.203 30.303 -0.297 191 HG21 ILE 21 HG21 ILE 21 0.983 29.179 -3.637 192 HG22 ILE 21 HG22 ILE 21 -0.372 28.672 -2.625 193 HG23 ILE 21 HG23 ILE 21 0.778 27.474 -3.225 194 HD11 ILE 21 HD11 ILE 21 2.699 31.079 -2.584 195 HD12 ILE 21 HD12 ILE 21 1.708 32.214 -1.671 196 HD13 ILE 21 HD13 ILE 21 0.966 31.195 -2.905 197 H THR 22 HN THR 22 -1.147 27.023 -1.412 198 HA THR 22 HA THR 22 -2.670 28.651 0.556 199 HB THR 22 HB THR 22 -4.532 28.576 -1.199 200 HG1 THR 22 HG1 THR 22 -3.501 26.791 -2.381 201 HG21 THR 22 HG21 THR 22 -3.529 30.351 -2.617 202 HG22 THR 22 HG22 THR 22 -1.926 29.922 -2.013 203 HG23 THR 22 HG23 THR 22 -3.130 30.596 -0.911 204 H GLY 23 HN GLY 23 -1.754 25.559 0.374 205 HA2 GLY 23 HA2 GLY 23 -2.437 24.291 2.301 206 HA3 GLY 23 HA1 GLY 23 -4.088 24.833 2.077 207 H GLU 24 HN GLU 24 -2.266 23.684 -0.689 208 HA GLU 24 HA GLU 24 -4.084 21.464 -1.128 209 HB2 GLU 24 HB2 GLU 24 -1.555 22.302 -2.626 210 HB3 GLU 24 HB1 GLU 24 -2.602 20.989 -3.128 211 HG2 GLU 24 HG2 GLU 24 -2.992 22.991 -4.459 212 HG3 GLU 24 HG1 GLU 24 -4.432 22.547 -3.538 213 H ILE 25 HN ILE 25 -3.823 19.493 -0.187 214 HA ILE 25 HA ILE 25 -1.267 18.751 1.047 215 HB ILE 25 HB ILE 25 -3.906 17.215 1.095 216 HG12 ILE 25 HG12 ILE 25 -4.139 19.455 2.174 217 HG13 ILE 25 HG11 ILE 25 -4.300 18.146 3.335 218 HG21 ILE 25 HG21 ILE 25 -1.424 16.873 2.829 219 HG22 ILE 25 HG22 ILE 25 -1.953 15.781 1.549 220 HG23 ILE 25 HG23 ILE 25 -2.937 15.972 3.003 221 HD11 ILE 25 HD11 ILE 25 -3.042 19.985 4.260 222 HD12 ILE 25 HD12 ILE 25 -1.863 19.894 2.956 223 HD13 ILE 25 HD13 ILE 25 -2.004 18.569 4.118 224 H LEU 26 HN LEU 26 -0.040 18.426 -0.833 225 HA LEU 26 HA LEU 26 -0.656 16.516 -2.863 226 HB2 LEU 26 HB2 LEU 26 2.014 17.778 -2.102 227 HB3 LEU 26 HB1 LEU 26 1.817 16.667 -3.443 228 HG LEU 26 HG LEU 26 1.886 18.841 -4.388 229 HD11 LEU 26 HD11 LEU 26 0.200 17.384 -5.390 230 HD12 LEU 26 HD12 LEU 26 -0.252 19.080 -5.516 231 HD13 LEU 26 HD13 LEU 26 -1.038 18.048 -4.319 232 HD21 LEU 26 HD21 LEU 26 -0.236 19.757 -2.426 233 HD22 LEU 26 HD22 LEU 26 0.473 20.723 -3.725 234 HD23 LEU 26 HD23 LEU 26 1.481 20.176 -2.389 235 H GLU 27 HN GLU 27 -1.201 14.607 -1.935 236 HA GLU 27 HA GLU 27 0.463 13.269 0.010 237 HB2 GLU 27 HB2 GLU 27 -1.998 12.341 -1.530 238 HB3 GLU 27 HB1 GLU 27 -1.215 11.421 -0.250 239 HG2 GLU 27 HG2 GLU 27 -1.697 13.232 1.350 240 HG3 GLU 27 HG1 GLU 27 -2.501 14.143 0.070 241 H THR 28 HN THR 28 2.383 12.909 -0.885 242 HA THR 28 HA THR 28 2.661 11.420 -3.422 243 HB THR 28 HB THR 28 5.134 12.069 -3.153 244 HG1 THR 28 HG1 THR 28 4.527 12.723 -0.781 245 HG21 THR 28 HG21 THR 28 3.159 14.368 -3.381 246 HG22 THR 28 HG22 THR 28 3.610 13.270 -4.689 247 HG23 THR 28 HG23 THR 28 4.818 14.355 -3.991 248 H TRP 29 HN TRP 29 3.794 9.506 -3.477 249 HA TRP 29 HA TRP 29 3.909 8.009 -0.943 250 HB2 TRP 29 HB2 TRP 29 4.052 7.043 -3.837 251 HB3 TRP 29 HB1 TRP 29 3.988 6.000 -2.417 252 HD1 TRP 29 HD1 TRP 29 1.761 8.079 -4.696 253 HE1 TRP 29 HE1 TRP 29 -0.694 7.667 -4.060 254 HE3 TRP 29 HE3 TRP 29 2.486 5.527 -0.337 255 HZ2 TRP 29 HZ2 TRP 29 -2.143 6.435 -1.971 256 HZ3 TRP 29 HZ3 TRP 29 0.522 4.777 0.925 257 HH2 TRP 29 HH2 TRP 29 -1.747 5.220 0.134 258 H GLU 30 HN GLU 30 5.878 8.711 -0.032 259 HA GLU 30 HA GLU 30 8.300 8.734 -1.628 260 HB2 GLU 30 HB2 GLU 30 9.468 9.336 0.453 261 HB3 GLU 30 HB1 GLU 30 8.081 10.375 0.177 262 HG2 GLU 30 HG2 GLU 30 6.801 9.164 1.883 263 HG3 GLU 30 HG1 GLU 30 8.148 8.058 2.134 264 H ASP 31 HN ASP 31 9.132 6.895 -2.256 265 HA ASP 31 HA ASP 31 8.753 4.334 -1.154 266 HB2 ASP 31 HB2 ASP 31 9.482 4.782 -3.499 267 HB3 ASP 31 HB1 ASP 31 11.040 5.354 -2.904 268 H GLY 32 HN GLY 32 9.408 3.741 0.842 269 HA2 GLY 32 HA2 GLY 32 11.221 5.543 2.275 270 HA3 GLY 32 HA1 GLY 32 9.997 4.501 2.969 271 H HIS 33 HN HIS 33 10.619 2.582 3.840 272 HA HIS 33 HA HIS 33 13.516 1.981 3.747 273 HB2 HIS 33 HB2 HIS 33 11.478 1.598 5.979 274 HB3 HIS 33 HB1 HIS 33 13.107 0.933 6.033 275 HD1 HIS 33 HD1 HIS 33 15.082 2.594 6.296 276 HD2 HIS 33 HD2 HIS 33 11.331 4.362 6.475 277 HE1 HIS 33 HE1 HIS 33 15.471 4.906 7.181 278 HE2 HIS 33 HE2 HIS 33 13.172 5.893 7.445 279 H THR 34 HN THR 34 14.233 -0.104 3.702 280 HA THR 34 HA THR 34 12.394 -2.038 2.432 281 HB THR 34 HB THR 34 15.440 -2.028 2.270 282 HG1 THR 34 HG1 THR 34 13.712 -0.850 0.353 283 HG21 THR 34 HG21 THR 34 13.350 -3.102 0.350 284 HG22 THR 34 HG22 THR 34 14.247 -4.090 1.507 285 HG23 THR 34 HG23 THR 34 15.101 -3.271 0.195 286 H LEU 35 HN LEU 35 12.257 -4.126 3.256 287 HA LEU 35 HA LEU 35 14.072 -5.130 5.275 288 HB2 LEU 35 HB2 LEU 35 12.398 -5.589 6.997 289 HB3 LEU 35 HB1 LEU 35 12.534 -3.864 6.715 290 HG LEU 35 HG LEU 35 10.269 -5.548 5.551 291 HD11 LEU 35 HD11 LEU 35 10.178 -5.708 7.994 292 HD12 LEU 35 HD12 LEU 35 8.832 -4.766 7.362 293 HD13 LEU 35 HD13 LEU 35 10.199 -3.946 8.126 294 HD21 LEU 35 HD21 LEU 35 9.105 -3.388 5.298 295 HD22 LEU 35 HD22 LEU 35 10.611 -3.420 4.388 296 HD23 LEU 35 HD23 LEU 35 10.528 -2.538 5.914 297 H TRP 36 HN TRP 36 13.734 -7.386 5.761 298 HA TRP 36 HA TRP 36 13.123 -9.035 3.586 299 HB2 TRP 36 HB2 TRP 36 13.251 -9.847 6.517 300 HB3 TRP 36 HB1 TRP 36 13.498 -10.900 5.128 301 HD1 TRP 36 HD1 TRP 36 15.452 -9.059 7.619 302 HE1 TRP 36 HE1 TRP 36 17.896 -8.770 6.874 303 HE3 TRP 36 HE3 TRP 36 14.943 -10.244 2.674 304 HZ2 TRP 36 HZ2 TRP 36 19.413 -8.997 4.508 305 HZ3 TRP 36 HZ3 TRP 36 16.925 -10.163 1.241 306 HH2 TRP 36 HH2 TRP 36 19.123 -9.558 2.126 307 H ALA 37 HN ALA 37 11.460 -10.586 3.269 308 HA ALA 37 HA ALA 37 8.965 -10.449 4.738 309 HB1 ALA 37 HB1 ALA 37 9.101 -9.429 1.875 310 HB2 ALA 37 HB2 ALA 37 8.795 -8.463 3.316 311 HB3 ALA 37 HB3 ALA 37 7.624 -9.677 2.816 312 H SER 38 HN SER 38 7.292 -11.812 3.691 313 HA SER 38 HA SER 38 8.338 -14.008 2.012 314 HB2 SER 38 HB2 SER 38 8.082 -14.677 4.463 315 HB3 SER 38 HB1 SER 38 6.351 -14.359 4.312 316 HG SER 38 HG SER 38 7.929 -16.340 3.044 317 H VAL 39 HN VAL 39 7.495 -13.075 0.207 318 HA VAL 39 HA VAL 39 4.811 -12.047 0.025 319 HB VAL 39 HB VAL 39 6.820 -12.629 -2.200 320 HG11 VAL 39 HG11 VAL 39 5.510 -11.032 -3.575 321 HG12 VAL 39 HG12 VAL 39 4.324 -10.882 -2.277 322 HG13 VAL 39 HG13 VAL 39 4.533 -12.426 -3.105 323 HG21 VAL 39 HG21 VAL 39 7.718 -11.056 -0.520 324 HG22 VAL 39 HG22 VAL 39 6.298 -10.024 -0.717 325 HG23 VAL 39 HG23 VAL 39 7.422 -10.247 -2.060 326 H ASN 40 HN ASN 40 3.354 -13.602 0.431 327 HA ASN 40 HA ASN 40 3.367 -16.127 -1.111 328 HB2 ASN 40 HB2 ASN 40 1.828 -15.471 1.460 329 HB3 ASN 40 HB1 ASN 40 1.864 -17.026 0.638 330 HD21 ASN 40 HD21 ASN 40 3.499 -14.927 2.804 331 HD22 ASN 40 HD22 ASN 40 4.801 -15.988 3.204 332 H MET 41 HN MET 41 2.329 -15.489 -3.010 333 HA MET 41 HA MET 41 -0.170 -14.065 -3.009 334 HB2 MET 41 HB2 MET 41 1.145 -15.761 -5.165 335 HB3 MET 41 HB1 MET 41 -0.369 -14.896 -5.393 336 HG2 MET 41 HG2 MET 41 1.001 -12.788 -4.712 337 HG3 MET 41 HG1 MET 41 2.406 -13.792 -5.076 338 HE1 MET 41 HE1 MET 41 -0.820 -12.037 -6.493 339 HE2 MET 41 HE2 MET 41 -1.180 -13.732 -6.829 340 HE3 MET 41 HE3 MET 41 -0.863 -12.624 -8.159 341 H VAL 42 HN VAL 42 -2.238 -14.916 -3.274 342 HA VAL 42 HA VAL 42 -2.636 -17.315 -1.724 343 HB VAL 42 HB VAL 42 -4.995 -16.696 -1.687 344 HG11 VAL 42 HG11 VAL 42 -4.818 -14.511 -0.546 345 HG12 VAL 42 HG12 VAL 42 -3.200 -14.288 -1.216 346 HG13 VAL 42 HG13 VAL 42 -3.509 -15.601 -0.077 347 HG21 VAL 42 HG21 VAL 42 -4.314 -14.470 -3.664 348 HG22 VAL 42 HG22 VAL 42 -5.872 -14.687 -2.864 349 HG23 VAL 42 HG23 VAL 42 -5.293 -15.900 -4.004 350 H SER 43 HN SER 43 -4.083 -19.000 -2.272 351 HA SER 43 HA SER 43 -4.226 -19.768 -5.106 352 HB2 SER 43 HB2 SER 43 -5.050 -21.301 -2.590 353 HB3 SER 43 HB1 SER 43 -4.886 -21.970 -4.214 354 HG SER 43 HG SER 43 -2.637 -20.679 -3.348 355 H SER 44 HN SER 44 -6.497 -21.005 -5.482 356 HA SER 44 HA SER 44 -8.594 -19.056 -5.385 357 HB2 SER 44 HB2 SER 44 -9.968 -20.929 -6.426 358 HB3 SER 44 HB1 SER 44 -8.482 -20.545 -7.294 359 HG SER 44 HG SER 44 -8.538 -22.734 -7.116 360 H LYS 45 HN LYS 45 -7.571 -21.544 -3.252 361 HA LYS 45 HA LYS 45 -9.872 -22.592 -2.136 362 HB2 LYS 45 HB2 LYS 45 -8.498 -23.160 -0.163 363 HB3 LYS 45 HB1 LYS 45 -7.661 -23.509 -1.668 364 HG2 LYS 45 HG2 LYS 45 -6.218 -21.600 -1.423 365 HG3 LYS 45 HG1 LYS 45 -7.162 -20.974 -0.069 366 HD2 LYS 45 HD2 LYS 45 -5.535 -23.551 -0.055 367 HD3 LYS 45 HD1 LYS 45 -5.046 -22.020 0.674 368 HE2 LYS 45 HE2 LYS 45 -6.968 -22.147 2.230 369 HE3 LYS 45 HE1 LYS 45 -7.456 -23.677 1.499 370 HZ1 LYS 45 HZ1 LYS 45 -5.405 -24.664 2.242 371 HZ2 LYS 45 HZ2 LYS 45 -6.224 -23.972 3.549 372 HZ3 LYS 45 HZ3 LYS 45 -4.887 -23.187 2.889 373 H GLU 46 HN GLU 46 -8.251 -19.547 -1.276 374 HA GLU 46 HA GLU 46 -9.769 -19.165 1.156 375 HB2 GLU 46 HB2 GLU 46 -8.510 -16.943 1.249 376 HB3 GLU 46 HB1 GLU 46 -7.530 -18.397 1.276 377 HG2 GLU 46 HG2 GLU 46 -6.310 -17.070 -0.169 378 HG3 GLU 46 HG1 GLU 46 -7.278 -18.008 -1.292 379 H ALA 47 HN ALA 47 -9.861 -17.946 -2.153 380 HA ALA 47 HA ALA 47 -11.879 -15.993 -1.940 381 HB1 ALA 47 HB1 ALA 47 -11.300 -17.858 -4.277 382 HB2 ALA 47 HB2 ALA 47 -10.505 -16.312 -3.978 383 HB3 ALA 47 HB3 ALA 47 -12.228 -16.357 -4.359 384 H ILE 48 HN ILE 48 -12.036 -19.459 -2.582 385 HA ILE 48 HA ILE 48 -14.865 -19.706 -2.786 386 HB ILE 48 HB ILE 48 -12.726 -21.813 -2.216 387 HG12 ILE 48 HG12 ILE 48 -14.044 -21.086 -4.878 388 HG13 ILE 48 HG11 ILE 48 -12.449 -20.538 -4.380 389 HG21 ILE 48 HG21 ILE 48 -15.593 -22.248 -3.137 390 HG22 ILE 48 HG22 ILE 48 -14.935 -22.667 -1.556 391 HG23 ILE 48 HG23 ILE 48 -14.356 -23.501 -2.995 392 HD11 ILE 48 HD11 ILE 48 -11.666 -22.871 -4.356 393 HD12 ILE 48 HD12 ILE 48 -12.285 -22.383 -5.933 394 HD13 ILE 48 HD13 ILE 48 -13.268 -23.401 -4.884 395 H SER 49 HN SER 49 -12.585 -19.930 -0.115 396 HA SER 49 HA SER 49 -14.290 -21.098 1.850 397 HB2 SER 49 HB2 SER 49 -11.829 -21.178 2.024 398 HB3 SER 49 HB1 SER 49 -11.755 -19.422 2.178 399 HG SER 49 HG SER 49 -13.392 -20.757 3.992 400 H SER 50 HN SER 50 -13.327 -17.722 1.192 401 HA SER 50 HA SER 50 -15.115 -16.691 3.287 402 HB2 SER 50 HB2 SER 50 -13.090 -15.225 1.540 403 HB3 SER 50 HB1 SER 50 -13.937 -14.562 2.941 404 HG SER 50 HG SER 50 -11.817 -16.373 2.814 405 H GLY 51 HN GLY 51 -15.455 -17.491 0.077 406 HA2 GLY 51 HA2 GLY 51 -17.308 -17.239 -1.279 407 HA3 GLY 51 HA1 GLY 51 -17.969 -16.067 -0.153 408 H ALA 52 HN ALA 52 -17.023 -13.882 -0.199 409 HA ALA 52 HA ALA 52 -15.873 -13.054 -2.803 410 HB1 ALA 52 HB1 ALA 52 -18.317 -12.638 -2.841 411 HB2 ALA 52 HB2 ALA 52 -17.404 -11.128 -2.879 412 HB3 ALA 52 HB3 ALA 52 -18.177 -11.658 -1.380 413 H GLU 53 HN GLU 53 -15.915 -12.785 0.643 414 HA GLU 53 HA GLU 53 -14.779 -10.265 1.113 415 HB2 GLU 53 HB2 GLU 53 -15.606 -11.535 2.977 416 HB3 GLU 53 HB1 GLU 53 -14.532 -12.887 2.636 417 HG2 GLU 53 HG2 GLU 53 -12.588 -11.548 3.296 418 HG3 GLU 53 HG1 GLU 53 -13.624 -10.144 3.559 419 H LEU 54 HN LEU 54 -13.140 -13.398 0.709 420 HA LEU 54 HA LEU 54 -10.668 -12.032 -0.127 421 HB2 LEU 54 HB2 LEU 54 -11.189 -14.883 0.784 422 HB3 LEU 54 HB1 LEU 54 -9.661 -14.364 0.087 423 HG LEU 54 HG LEU 54 -10.876 -13.335 2.690 424 HD11 LEU 54 HD11 LEU 54 -8.983 -14.445 3.788 425 HD12 LEU 54 HD12 LEU 54 -8.443 -15.087 2.233 426 HD13 LEU 54 HD13 LEU 54 -9.990 -15.598 2.913 427 HD21 LEU 54 HD21 LEU 54 -8.765 -12.080 2.981 428 HD22 LEU 54 HD22 LEU 54 -9.663 -11.531 1.570 429 HD23 LEU 54 HD23 LEU 54 -8.248 -12.569 1.362 430 H ALA 55 HN ALA 55 -9.562 -13.025 -1.995 431 HA ALA 55 HA ALA 55 -11.182 -14.167 -4.082 432 HB1 ALA 55 HB1 ALA 55 -11.181 -12.191 -5.562 433 HB2 ALA 55 HB2 ALA 55 -10.441 -11.218 -4.284 434 HB3 ALA 55 HB3 ALA 55 -12.070 -11.859 -4.073 435 H ILE 56 HN ILE 56 -9.971 -14.592 -5.977 436 HA ILE 56 HA ILE 56 -7.232 -15.207 -5.576 437 HB ILE 56 HB ILE 56 -8.664 -15.033 -8.281 438 HG12 ILE 56 HG12 ILE 56 -8.571 -17.443 -6.402 439 HG13 ILE 56 HG11 ILE 56 -9.984 -16.429 -6.659 440 HG21 ILE 56 HG21 ILE 56 -6.217 -15.292 -8.446 441 HG22 ILE 56 HG22 ILE 56 -7.035 -16.751 -9.002 442 HG23 ILE 56 HG23 ILE 56 -6.281 -16.719 -7.406 443 HD11 ILE 56 HD11 ILE 56 -8.638 -18.154 -8.742 444 HD12 ILE 56 HD12 ILE 56 -10.047 -17.124 -9.016 445 HD13 ILE 56 HD13 ILE 56 -10.156 -18.493 -7.910 446 H GLY 57 HN GLY 57 -5.439 -13.967 -5.968 447 HA2 GLY 57 HA2 GLY 57 -4.269 -12.280 -7.317 448 HA3 GLY 57 HA1 GLY 57 -5.743 -11.321 -7.322 449 H THR 58 HN THR 58 -5.841 -12.427 -4.321 450 HA THR 58 HA THR 58 -4.699 -10.163 -3.010 451 HB THR 58 HB THR 58 -5.559 -12.838 -1.792 452 HG1 THR 58 HG1 THR 58 -7.521 -12.187 -2.115 453 HG21 THR 58 HG21 THR 58 -5.884 -11.580 0.314 454 HG22 THR 58 HG22 THR 58 -5.247 -10.124 -0.450 455 HG23 THR 58 HG23 THR 58 -4.194 -11.519 -0.207 456 H VAL 59 HN VAL 59 -2.728 -9.974 -1.957 457 HA VAL 59 HA VAL 59 -0.780 -12.185 -2.188 458 HB VAL 59 HB VAL 59 -0.099 -9.223 -2.473 459 HG11 VAL 59 HG11 VAL 59 2.095 -10.048 -3.265 460 HG12 VAL 59 HG12 VAL 59 1.570 -11.713 -3.009 461 HG13 VAL 59 HG13 VAL 59 1.751 -10.624 -1.631 462 HG21 VAL 59 HG21 VAL 59 -0.410 -11.256 -4.715 463 HG22 VAL 59 HG22 VAL 59 0.196 -9.609 -4.897 464 HG23 VAL 59 HG23 VAL 59 -1.478 -9.883 -4.406 465 H ARG 60 HN ARG 60 -0.695 -12.875 -0.132 466 HA ARG 60 HA ARG 60 -0.691 -11.116 2.194 467 HB2 ARG 60 HB2 ARG 60 -0.183 -14.129 1.985 468 HB3 ARG 60 HB1 ARG 60 -0.451 -13.237 3.479 469 HG2 ARG 60 HG2 ARG 60 -2.754 -12.831 2.934 470 HG3 ARG 60 HG1 ARG 60 -2.526 -13.401 1.276 471 HD2 ARG 60 HD2 ARG 60 -3.630 -15.155 2.475 472 HD3 ARG 60 HD1 ARG 60 -1.962 -15.667 2.213 473 HE ARG 60 HE ARG 60 -2.217 -14.425 4.742 474 HH11 ARG 60 HH11 ARG 60 -3.011 -17.448 3.131 475 HH12 ARG 60 HH12 ARG 60 -3.039 -18.350 4.613 476 HH21 ARG 60 HH21 ARG 60 -2.325 -15.614 6.662 477 HH22 ARG 60 HH22 ARG 60 -2.672 -17.313 6.612 478 H ILE 61 HN ILE 61 1.183 -9.879 2.151 479 HA ILE 61 HA ILE 61 3.808 -11.194 1.839 480 HB ILE 61 HB ILE 61 3.089 -8.223 1.979 481 HG12 ILE 61 HG12 ILE 61 3.898 -9.952 -0.408 482 HG13 ILE 61 HG11 ILE 61 2.277 -9.349 -0.087 483 HG21 ILE 61 HG21 ILE 61 5.781 -9.526 1.400 484 HG22 ILE 61 HG22 ILE 61 5.359 -8.613 2.849 485 HG23 ILE 61 HG23 ILE 61 5.436 -7.795 1.289 486 HD11 ILE 61 HD11 ILE 61 4.691 -7.666 -0.731 487 HD12 ILE 61 HD12 ILE 61 3.062 -7.061 -0.417 488 HD13 ILE 61 HD13 ILE 61 3.373 -8.078 -1.824 489 H TRP 62 HN TRP 62 4.477 -12.036 3.682 490 HA TRP 62 HA TRP 62 3.634 -11.035 6.295 491 HB2 TRP 62 HB2 TRP 62 5.317 -13.478 5.526 492 HB3 TRP 62 HB1 TRP 62 4.718 -13.121 7.140 493 HD1 TRP 62 HD1 TRP 62 2.310 -12.873 4.099 494 HE1 TRP 62 HE1 TRP 62 0.599 -14.760 4.280 495 HE3 TRP 62 HE3 TRP 62 4.331 -15.439 8.021 496 HZ2 TRP 62 HZ2 TRP 62 0.131 -17.035 5.856 497 HZ3 TRP 62 HZ3 TRP 62 3.192 -17.465 8.809 498 HH2 TRP 62 HH2 TRP 62 1.135 -18.264 7.741 499 H ILE 63 HN ILE 63 4.828 -9.400 7.079 500 HA ILE 63 HA ILE 63 7.796 -9.542 6.979 501 HB ILE 63 HB ILE 63 7.842 -7.121 7.423 502 HG12 ILE 63 HG12 ILE 63 4.794 -7.065 7.173 503 HG13 ILE 63 HG11 ILE 63 5.630 -7.035 8.718 504 HG21 ILE 63 HG21 ILE 63 6.984 -6.292 5.255 505 HG22 ILE 63 HG22 ILE 63 6.041 -7.774 5.062 506 HG23 ILE 63 HG23 ILE 63 7.804 -7.847 5.081 507 HD11 ILE 63 HD11 ILE 63 4.950 -4.815 8.064 508 HD12 ILE 63 HD12 ILE 63 5.828 -4.952 6.545 509 HD13 ILE 63 HD13 ILE 63 6.711 -4.913 8.075 510 H ARG 64 HN ARG 64 8.507 -8.052 9.112 511 HA ARG 64 HA ARG 64 7.505 -9.507 11.440 512 HB2 ARG 64 HB2 ARG 64 9.788 -7.518 11.086 513 HB3 ARG 64 HB1 ARG 64 9.331 -8.200 12.651 514 HG2 ARG 64 HG2 ARG 64 9.704 -10.494 11.691 515 HG3 ARG 64 HG1 ARG 64 10.322 -9.736 10.222 516 HD2 ARG 64 HD2 ARG 64 12.235 -8.888 11.340 517 HD3 ARG 64 HD1 ARG 64 11.525 -9.142 12.939 518 HE ARG 64 HE ARG 64 11.691 -11.579 12.469 519 HH11 ARG 64 HH11 ARG 64 13.817 -9.446 10.655 520 HH12 ARG 64 HH12 ARG 64 15.089 -10.618 10.549 521 HH21 ARG 64 HH21 ARG 64 13.374 -13.089 12.362 522 HH22 ARG 64 HH22 ARG 64 14.838 -12.683 11.524 523 H TYR 65 HN TYR 65 6.977 -8.324 13.421 524 HA TYR 65 HA TYR 65 4.627 -6.842 13.011 525 HB2 TYR 65 HB2 TYR 65 5.062 -8.383 14.909 526 HB3 TYR 65 HB1 TYR 65 6.206 -7.230 15.576 527 HD1 TYR 65 HD2 TYR 65 2.575 -7.712 14.769 528 HD2 TYR 65 HD1 TYR 65 5.432 -5.419 16.988 529 HE1 TYR 65 HE2 TYR 65 0.761 -6.672 16.072 530 HE2 TYR 65 HE1 TYR 65 3.618 -4.404 18.277 531 HH TYR 65 HH TYR 65 0.536 -5.629 18.372 532 H ARG 66 HN ARG 66 4.889 -4.875 11.996 533 HA ARG 66 HA ARG 66 6.358 -2.742 13.444 534 HB2 ARG 66 HB2 ARG 66 7.457 -3.218 11.289 535 HB3 ARG 66 HB1 ARG 66 5.926 -3.037 10.434 536 HG2 ARG 66 HG2 ARG 66 5.857 -0.651 11.016 537 HG3 ARG 66 HG1 ARG 66 7.349 -0.812 11.946 538 HD2 ARG 66 HD2 ARG 66 7.095 -1.275 8.950 539 HD3 ARG 66 HD1 ARG 66 7.702 0.207 9.697 540 HE ARG 66 HE ARG 66 9.048 -2.328 10.303 541 HH11 ARG 66 HH11 ARG 66 9.179 0.724 8.571 542 HH12 ARG 66 HH12 ARG 66 10.892 0.625 8.308 543 HH21 ARG 66 HH21 ARG 66 11.263 -2.447 9.929 544 HH22 ARG 66 HH22 ARG 66 12.065 -1.180 9.057 545 H LYS 67 HN LYS 67 4.822 -1.684 14.555 546 HA LYS 67 HA LYS 67 2.061 -1.504 13.848 547 HB2 LYS 67 HB2 LYS 67 3.714 -0.017 15.919 548 HB3 LYS 67 HB1 LYS 67 1.958 0.105 15.801 549 HG2 LYS 67 HG2 LYS 67 1.730 -2.282 16.295 550 HG3 LYS 67 HG1 LYS 67 3.487 -2.465 16.317 551 HD2 LYS 67 HD2 LYS 67 2.575 -2.357 18.598 552 HD3 LYS 67 HD1 LYS 67 3.644 -0.987 18.275 553 HE2 LYS 67 HE2 LYS 67 1.665 0.451 17.899 554 HE3 LYS 67 HE1 LYS 67 0.599 -0.922 18.208 555 HZ1 LYS 67 HZ1 LYS 67 1.438 -1.032 20.453 556 HZ2 LYS 67 HZ2 LYS 67 0.856 0.526 20.136 557 HZ3 LYS 67 HZ3 LYS 67 2.520 0.229 20.155 558 H ASP 68 HN ASP 68 4.566 0.113 12.435 559 HA ASP 68 HA ASP 68 3.316 2.736 12.159 560 HB2 ASP 68 HB2 ASP 68 5.752 2.600 12.570 561 HB3 ASP 68 HB1 ASP 68 5.961 1.628 11.117 562 H ILE 69 HN ILE 69 3.561 -0.265 10.405 563 HA ILE 69 HA ILE 69 3.016 0.694 7.781 564 HB ILE 69 HB ILE 69 2.277 -2.046 8.938 565 HG12 ILE 69 HG12 ILE 69 4.718 -1.620 9.081 566 HG13 ILE 69 HG11 ILE 69 4.363 -2.882 7.910 567 HG21 ILE 69 HG21 ILE 69 2.464 -1.149 6.023 568 HG22 ILE 69 HG22 ILE 69 0.987 -1.559 6.897 569 HG23 ILE 69 HG23 ILE 69 2.187 -2.807 6.567 570 HD11 ILE 69 HD11 ILE 69 5.045 -0.014 7.270 571 HD12 ILE 69 HD12 ILE 69 4.694 -1.282 6.091 572 HD13 ILE 69 HD13 ILE 69 6.114 -1.409 7.128 573 H ASN 70 HN ASN 70 1.190 1.410 6.952 574 HA ASN 70 HA ASN 70 -1.415 1.024 8.306 575 HB2 ASN 70 HB2 ASN 70 -0.084 3.580 7.373 576 HB3 ASN 70 HB1 ASN 70 -1.827 3.463 7.210 577 HD21 ASN 70 HD21 ASN 70 0.070 2.129 9.910 578 HD22 ASN 70 HD22 ASN 70 -0.576 3.184 11.096 579 H ALA 71 HN ALA 71 -3.238 1.342 6.790 580 HA ALA 71 HA ALA 71 -3.005 -0.016 4.319 581 HB1 ALA 71 HB1 ALA 71 -5.343 0.660 3.946 582 HB2 ALA 71 HB2 ALA 71 -5.232 1.821 5.273 583 HB3 ALA 71 HB3 ALA 71 -5.108 0.090 5.601 584 H THR 72 HN THR 72 -2.513 3.290 5.194 585 HA THR 72 HA THR 72 -2.510 4.336 2.479 586 HB THR 72 HB THR 72 -1.830 6.487 3.574 587 HG1 THR 72 HG1 THR 72 -0.719 6.048 5.361 588 HG21 THR 72 HG21 THR 72 -3.892 6.904 4.866 589 HG22 THR 72 HG22 THR 72 -4.208 5.171 4.952 590 HG23 THR 72 HG23 THR 72 -4.245 6.000 3.395 591 H SER 73 HN SER 73 -0.736 2.168 2.900 592 HA SER 73 HA SER 73 1.750 3.431 2.002 593 HB2 SER 73 HB2 SER 73 2.154 2.798 4.384 594 HB3 SER 73 HB1 SER 73 1.678 1.139 4.020 595 HG SER 73 HG SER 73 3.852 2.548 2.874 596 H ARG 74 HN ARG 74 2.820 2.208 0.418 597 HA ARG 74 HA ARG 74 1.272 -0.069 -0.699 598 HB2 ARG 74 HB2 ARG 74 3.281 1.625 -2.234 599 HB3 ARG 74 HB1 ARG 74 2.048 0.539 -2.879 600 HG2 ARG 74 HG2 ARG 74 0.290 2.106 -2.008 601 HG3 ARG 74 HG1 ARG 74 1.575 3.194 -1.483 602 HD2 ARG 74 HD2 ARG 74 0.945 4.125 -3.521 603 HD3 ARG 74 HD1 ARG 74 2.323 3.126 -3.996 604 HE ARG 74 HE ARG 74 -0.257 1.820 -4.189 605 HH11 ARG 74 HH11 ARG 74 2.188 3.629 -5.938 606 HH12 ARG 74 HH12 ARG 74 1.465 3.329 -7.485 607 HH21 ARG 74 HH21 ARG 74 -1.203 1.475 -6.199 608 HH22 ARG 74 HH22 ARG 74 -0.470 2.121 -7.627 609 H ILE 75 HN ILE 75 2.347 -1.968 -1.158 610 HA ILE 75 HA ILE 75 4.988 -2.269 0.133 611 HB ILE 75 HB ILE 75 2.920 -4.458 -0.352 612 HG12 ILE 75 HG12 ILE 75 1.900 -2.753 1.115 613 HG13 ILE 75 HG11 ILE 75 2.226 -4.228 2.007 614 HG21 ILE 75 HG21 ILE 75 4.182 -5.703 1.372 615 HG22 ILE 75 HG22 ILE 75 5.330 -4.366 1.508 616 HG23 ILE 75 HG23 ILE 75 5.209 -5.275 0.000 617 HD11 ILE 75 HD11 ILE 75 4.186 -3.179 3.018 618 HD12 ILE 75 HD12 ILE 75 2.712 -2.265 3.328 619 HD13 ILE 75 HD13 ILE 75 3.861 -1.696 2.116 620 H LYS 76 HN LYS 76 6.265 -1.826 -1.653 621 HA LYS 76 HA LYS 76 5.891 -3.167 -4.212 622 HB2 LYS 76 HB2 LYS 76 6.748 -0.837 -4.126 623 HB3 LYS 76 HB1 LYS 76 8.148 -1.381 -3.209 624 HG2 LYS 76 HG2 LYS 76 8.692 -2.870 -5.253 625 HG3 LYS 76 HG1 LYS 76 7.486 -1.912 -6.120 626 HD2 LYS 76 HD2 LYS 76 10.058 -0.927 -4.833 627 HD3 LYS 76 HD1 LYS 76 9.683 -0.983 -6.555 628 HE2 LYS 76 HE2 LYS 76 7.952 0.741 -6.241 629 HE3 LYS 76 HE1 LYS 76 8.280 0.776 -4.506 630 HZ1 LYS 76 HZ1 LYS 76 10.217 1.484 -6.638 631 HZ2 LYS 76 HZ2 LYS 76 10.499 1.555 -4.968 632 HZ3 LYS 76 HZ3 LYS 76 9.361 2.579 -5.674 633 H VAL 77 HN VAL 77 6.551 -5.233 -4.429 634 HA VAL 77 HA VAL 77 8.575 -6.435 -2.728 635 HB VAL 77 HB VAL 77 7.261 -7.495 -5.274 636 HG11 VAL 77 HG11 VAL 77 9.429 -8.628 -4.942 637 HG12 VAL 77 HG12 VAL 77 8.099 -9.737 -4.610 638 HG13 VAL 77 HG13 VAL 77 8.995 -9.011 -3.272 639 HG21 VAL 77 HG21 VAL 77 6.701 -8.167 -2.366 640 HG22 VAL 77 HG22 VAL 77 5.867 -8.832 -3.774 641 HG23 VAL 77 HG23 VAL 77 5.712 -7.121 -3.381 642 H SER 78 HN SER 78 10.534 -5.525 -2.919 643 HA SER 78 HA SER 78 11.617 -4.421 -5.313 644 HB2 SER 78 HB2 SER 78 13.030 -5.068 -2.689 645 HB3 SER 78 HB1 SER 78 13.582 -3.940 -3.934 646 HG SER 78 HG SER 78 11.799 -2.645 -3.506 647 H THR 79 HN THR 79 11.853 -7.541 -3.744 648 HA THR 79 HA THR 79 12.901 -8.721 -6.166 649 HB THR 79 HB THR 79 14.993 -8.144 -4.882 650 HG1 THR 79 HG1 THR 79 14.778 -10.044 -6.277 651 HG21 THR 79 HG21 THR 79 15.582 -9.407 -2.847 652 HG22 THR 79 HG22 THR 79 13.977 -10.134 -2.820 653 HG23 THR 79 HG23 THR 79 14.157 -8.397 -2.567 654 H GLY 80 HN GLY 80 12.203 -10.847 -6.374 655 HA2 GLY 80 HA2 GLY 80 11.521 -12.832 -4.798 656 HA3 GLY 80 HA1 GLY 80 10.195 -11.747 -4.416 657 HA PRO 81 HA PRO 81 8.650 -14.327 -7.980 658 HB2 PRO 81 HB2 PRO 81 6.043 -14.419 -7.061 659 HB3 PRO 81 HB1 PRO 81 7.283 -15.587 -6.578 660 HG2 PRO 81 HG2 PRO 81 6.316 -13.128 -5.114 661 HG3 PRO 81 HG1 PRO 81 6.624 -14.758 -4.473 662 HD2 PRO 81 HD2 PRO 81 8.411 -12.757 -4.162 663 HD3 PRO 81 HD1 PRO 81 8.941 -14.436 -4.415 664 H LEU 82 HN LEU 82 7.290 -11.505 -6.347 665 HA LEU 82 HA LEU 82 6.217 -10.382 -8.868 666 HB2 LEU 82 HB2 LEU 82 5.695 -9.640 -5.955 667 HB3 LEU 82 HB1 LEU 82 4.943 -8.866 -7.346 668 HG LEU 82 HG LEU 82 4.574 -11.795 -6.578 669 HD11 LEU 82 HD11 LEU 82 3.539 -10.332 -4.930 670 HD12 LEU 82 HD12 LEU 82 2.311 -11.151 -5.886 671 HD13 LEU 82 HD13 LEU 82 2.681 -9.454 -6.201 672 HD21 LEU 82 HD21 LEU 82 3.185 -10.155 -8.734 673 HD22 LEU 82 HD22 LEU 82 2.765 -11.803 -8.259 674 HD23 LEU 82 HD23 LEU 82 4.332 -11.474 -8.990 675 H ALA 83 HN ALA 83 8.952 -10.398 -8.617 676 HA ALA 83 HA ALA 83 10.176 -8.221 -7.294 677 HB1 ALA 83 HB1 ALA 83 11.138 -9.786 -9.721 678 HB2 ALA 83 HB2 ALA 83 11.405 -10.224 -8.030 679 HB3 ALA 83 HB3 ALA 83 12.136 -8.760 -8.686 680 H GLY 84 HN GLY 84 9.370 -6.238 -7.706 681 HA2 GLY 84 HA2 GLY 84 9.980 -4.227 -8.976 682 HA3 GLY 84 HA1 GLY 84 9.493 -5.075 -10.436 683 H ARG 85 HN ARG 85 7.221 -6.215 -8.590 684 HA ARG 85 HA ARG 85 5.246 -4.273 -9.486 685 HB2 ARG 85 HB2 ARG 85 4.853 -6.982 -8.126 686 HB3 ARG 85 HB1 ARG 85 3.565 -5.982 -8.811 687 HG2 ARG 85 HG2 ARG 85 4.760 -6.162 -11.051 688 HG3 ARG 85 HG1 ARG 85 5.827 -7.353 -10.306 689 HD2 ARG 85 HD2 ARG 85 3.904 -8.824 -9.880 690 HD3 ARG 85 HD1 ARG 85 2.810 -7.616 -10.576 691 HE ARG 85 HE ARG 85 4.901 -8.298 -12.394 692 HH11 ARG 85 HH11 ARG 85 1.858 -9.568 -11.209 693 HH12 ARG 85 HH12 ARG 85 1.554 -10.473 -12.655 694 HH21 ARG 85 HH21 ARG 85 4.514 -9.484 -14.243 695 HH22 ARG 85 HH22 ARG 85 3.077 -10.446 -14.366 696 H VAL 86 HN VAL 86 3.896 -3.114 -8.253 697 HA VAL 86 HA VAL 86 4.542 -2.714 -5.402 698 HB VAL 86 HB VAL 86 3.030 -0.901 -7.325 699 HG11 VAL 86 HG11 VAL 86 3.335 0.877 -5.617 700 HG12 VAL 86 HG12 VAL 86 4.097 -0.299 -4.542 701 HG13 VAL 86 HG13 VAL 86 2.398 -0.483 -4.988 702 HG21 VAL 86 HG21 VAL 86 5.933 -0.665 -6.454 703 HG22 VAL 86 HG22 VAL 86 5.066 0.504 -7.451 704 HG23 VAL 86 HG23 VAL 86 5.368 -1.123 -8.062 705 H LEU 87 HN LEU 87 3.198 -3.918 -4.168 706 HA LEU 87 HA LEU 87 0.501 -4.635 -5.068 707 HB2 LEU 87 HB2 LEU 87 2.102 -5.579 -2.643 708 HB3 LEU 87 HB1 LEU 87 0.506 -6.159 -3.079 709 HG LEU 87 HG LEU 87 2.093 -7.825 -3.758 710 HD11 LEU 87 HD11 LEU 87 1.182 -6.340 -6.225 711 HD12 LEU 87 HD12 LEU 87 0.239 -7.501 -5.287 712 HD13 LEU 87 HD13 LEU 87 1.682 -8.032 -6.145 713 HD21 LEU 87 HD21 LEU 87 3.576 -5.744 -5.381 714 HD22 LEU 87 HD22 LEU 87 3.954 -7.467 -5.259 715 HD23 LEU 87 HD23 LEU 87 4.110 -6.427 -3.845 716 H ASN 88 HN ASN 88 -1.302 -3.795 -4.236 717 HA ASN 88 HA ASN 88 -1.014 -1.503 -2.404 718 HB2 ASN 88 HB2 ASN 88 -3.138 -2.270 -4.448 719 HB3 ASN 88 HB1 ASN 88 -3.344 -0.942 -3.317 720 HD21 ASN 88 HD21 ASN 88 -0.306 -1.785 -5.024 721 HD22 ASN 88 HD22 ASN 88 -0.253 -0.345 -5.962 722 H ILE 89 HN ILE 89 -1.594 -1.768 -0.345 723 HA ILE 89 HA ILE 89 -2.656 -4.088 0.796 724 HB ILE 89 HB ILE 89 -2.752 -1.272 1.978 725 HG12 ILE 89 HG12 ILE 89 -0.600 -3.422 2.199 726 HG13 ILE 89 HG11 ILE 89 -0.451 -1.875 1.365 727 HG21 ILE 89 HG21 ILE 89 -2.931 -3.955 3.412 728 HG22 ILE 89 HG22 ILE 89 -4.249 -2.802 3.206 729 HG23 ILE 89 HG23 ILE 89 -2.856 -2.374 4.196 730 HD11 ILE 89 HD11 ILE 89 -0.702 -0.719 3.541 731 HD12 ILE 89 HD12 ILE 89 0.700 -1.792 3.469 732 HD13 ILE 89 HD13 ILE 89 -0.747 -2.304 4.342 733 H ILE 90 HN ILE 90 -4.654 -4.824 1.191 734 HA ILE 90 HA ILE 90 -6.991 -3.102 0.604 735 HB ILE 90 HB ILE 90 -8.243 -5.348 0.288 736 HG12 ILE 90 HG12 ILE 90 -5.432 -6.432 -0.226 737 HG13 ILE 90 HG11 ILE 90 -6.358 -6.804 1.213 738 HG21 ILE 90 HG21 ILE 90 -7.618 -5.456 -2.096 739 HG22 ILE 90 HG22 ILE 90 -6.154 -4.529 -1.763 740 HG23 ILE 90 HG23 ILE 90 -7.741 -3.784 -1.542 741 HD11 ILE 90 HD11 ILE 90 -7.094 -7.532 -1.614 742 HD12 ILE 90 HD12 ILE 90 -8.055 -7.899 -0.178 743 HD13 ILE 90 HD13 ILE 90 -6.453 -8.608 -0.375 744 H GLY 91 HN GLY 91 -7.276 -2.227 2.591 745 HA2 GLY 91 HA2 GLY 91 -8.937 -2.491 4.372 746 HA3 GLY 91 HA1 GLY 91 -8.231 -4.064 4.734 747 H GLN 92 HN GLN 92 -6.042 -4.116 5.563 748 HA GLN 92 HA GLN 92 -4.753 -1.884 6.779 749 HB2 GLN 92 HB2 GLN 92 -5.376 -2.367 9.157 750 HB3 GLN 92 HB1 GLN 92 -6.755 -1.825 8.209 751 HG2 GLN 92 HG2 GLN 92 -7.452 -4.225 7.955 752 HG3 GLN 92 HG1 GLN 92 -6.139 -4.677 9.038 753 HE21 GLN 92 HE21 GLN 92 -9.036 -5.053 9.321 754 HE22 GLN 92 HE22 GLN 92 -9.465 -4.299 10.815 755 HA PRO 93 HA PRO 93 -1.698 -5.259 7.368 756 HB2 PRO 93 HB2 PRO 93 -0.188 -4.319 9.462 757 HB3 PRO 93 HB1 PRO 93 -0.069 -3.669 7.820 758 HG2 PRO 93 HG2 PRO 93 -1.641 -2.598 10.164 759 HG3 PRO 93 HG1 PRO 93 -0.563 -1.726 9.051 760 HD2 PRO 93 HD2 PRO 93 -3.245 -1.672 8.732 761 HD3 PRO 93 HD1 PRO 93 -2.158 -1.701 7.326 762 H LEU 94 HN LEU 94 -2.057 -7.189 8.327 763 HA LEU 94 HA LEU 94 -3.741 -7.356 10.758 764 HB2 LEU 94 HB2 LEU 94 -4.434 -8.293 8.413 765 HB3 LEU 94 HB1 LEU 94 -3.284 -9.573 8.711 766 HG LEU 94 HG LEU 94 -5.684 -10.176 9.133 767 HD11 LEU 94 HD11 LEU 94 -5.365 -11.402 11.202 768 HD12 LEU 94 HD12 LEU 94 -3.951 -10.420 11.591 769 HD13 LEU 94 HD13 LEU 94 -3.925 -11.488 10.188 770 HD21 LEU 94 HD21 LEU 94 -6.463 -8.034 10.013 771 HD22 LEU 94 HD22 LEU 94 -5.503 -8.264 11.478 772 HD23 LEU 94 HD23 LEU 94 -6.847 -9.353 11.117 773 HA PRO 95 HA PRO 95 0.160 -9.111 12.551 774 HB2 PRO 95 HB2 PRO 95 -1.206 -8.898 15.173 775 HB3 PRO 95 HB1 PRO 95 0.242 -8.062 14.604 776 HG2 PRO 95 HG2 PRO 95 -2.138 -6.788 15.014 777 HG3 PRO 95 HG1 PRO 95 -0.949 -6.246 13.813 778 HD2 PRO 95 HD2 PRO 95 -3.480 -7.844 13.394 779 HD3 PRO 95 HD1 PRO 95 -2.809 -6.512 12.422 780 H ASP 96 HN ASP 96 0.625 -11.235 13.370 781 HA ASP 96 HA ASP 96 -1.498 -13.196 13.067 782 HB2 ASP 96 HB2 ASP 96 0.166 -14.878 13.429 783 HB3 ASP 96 HB1 ASP 96 0.958 -13.617 12.494 784 H ALA 97 HN ALA 97 -1.599 -14.970 14.963 785 HA ALA 97 HA ALA 97 -3.040 -13.849 17.093 786 HB1 ALA 97 HB1 ALA 97 -3.089 -16.117 18.045 787 HB2 ALA 97 HB2 ALA 97 -1.784 -16.613 16.961 788 HB3 ALA 97 HB3 ALA 97 -3.356 -16.157 16.301 789 H ALA 98 HN ALA 98 0.368 -14.606 16.851 790 HA ALA 98 HA ALA 98 0.864 -14.330 19.732 791 HB1 ALA 98 HB1 ALA 98 1.957 -16.154 18.488 792 HB2 ALA 98 HB2 ALA 98 3.144 -15.046 19.177 793 HB3 ALA 98 HB3 ALA 98 2.765 -14.972 17.454 794 H ARG 99 HN ARG 99 0.843 -12.323 16.967 795 HA ARG 99 HA ARG 99 1.504 -10.236 16.446 796 HB2 ARG 99 HB2 ARG 99 1.676 -9.966 19.468 797 HB3 ARG 99 HB1 ARG 99 2.069 -8.623 18.402 798 HG2 ARG 99 HG2 ARG 99 -0.177 -8.286 19.100 799 HG3 ARG 99 HG1 ARG 99 -0.255 -8.821 17.422 800 HD2 ARG 99 HD2 ARG 99 -2.004 -9.925 18.678 801 HD3 ARG 99 HD1 ARG 99 -0.789 -11.126 18.240 802 HE ARG 99 HE ARG 99 0.044 -11.049 20.521 803 HH11 ARG 99 HH11 ARG 99 -3.085 -9.521 20.052 804 HH12 ARG 99 HH12 ARG 99 -3.564 -9.711 21.708 805 HH21 ARG 99 HH21 ARG 99 -0.604 -11.251 22.725 806 HH22 ARG 99 HH22 ARG 99 -2.172 -10.681 23.207 807 H THR 100 HN THR 100 3.464 -12.421 16.589 808 HA THR 100 HA THR 100 6.026 -11.187 17.209 809 HB THR 100 HB THR 100 5.701 -13.633 17.562 810 HG1 THR 100 HG1 THR 100 7.752 -12.489 16.238 811 HG21 THR 100 HG21 THR 100 4.208 -14.158 15.671 812 HG22 THR 100 HG22 THR 100 5.637 -15.192 15.651 813 HG23 THR 100 HG23 THR 100 5.522 -13.834 14.533 814 H ARG 101 HN ARG 101 3.875 -11.442 14.515 815 HA ARG 101 HA ARG 101 5.803 -10.237 12.663 816 HB2 ARG 101 HB2 ARG 101 5.482 -11.825 10.932 817 HB3 ARG 101 HB1 ARG 101 5.652 -12.846 12.358 818 HG2 ARG 101 HG2 ARG 101 3.220 -13.152 12.463 819 HG3 ARG 101 HG1 ARG 101 2.992 -12.037 11.122 820 HD2 ARG 101 HD2 ARG 101 2.753 -14.203 10.217 821 HD3 ARG 101 HD1 ARG 101 4.343 -13.641 9.706 822 HE ARG 101 HE ARG 101 5.353 -15.104 11.294 823 HH11 ARG 101 HH11 ARG 101 1.877 -15.588 11.022 824 HH12 ARG 101 HH12 ARG 101 1.936 -17.212 11.628 825 HH21 ARG 101 HH21 ARG 101 5.394 -17.236 12.118 826 HH22 ARG 101 HH22 ARG 101 3.919 -18.137 12.233 827 H LEU 102 HN LEU 102 4.606 -9.496 10.678 828 HA LEU 102 HA LEU 102 1.814 -8.719 11.213 829 HB2 LEU 102 HB2 LEU 102 3.653 -6.907 11.564 830 HB3 LEU 102 HB1 LEU 102 3.848 -6.947 9.825 831 HG LEU 102 HG LEU 102 1.416 -6.309 9.599 832 HD11 LEU 102 HD11 LEU 102 0.608 -7.113 11.764 833 HD12 LEU 102 HD12 LEU 102 0.249 -5.401 11.558 834 HD13 LEU 102 HD13 LEU 102 1.583 -5.903 12.603 835 HD21 LEU 102 HD21 LEU 102 1.763 -3.947 10.171 836 HD22 LEU 102 HD22 LEU 102 3.187 -4.634 9.394 837 HD23 LEU 102 HD23 LEU 102 3.175 -4.377 11.142 838 H GLU 103 HN GLU 103 0.729 -9.897 9.774 839 HA GLU 103 HA GLU 103 1.751 -10.523 7.123 840 HB2 GLU 103 HB2 GLU 103 0.489 -12.229 8.386 841 HB3 GLU 103 HB1 GLU 103 -0.912 -11.166 8.461 842 HG2 GLU 103 HG2 GLU 103 -1.051 -11.257 5.960 843 HG3 GLU 103 HG1 GLU 103 0.273 -12.423 5.965 844 H ILE 104 HN ILE 104 1.620 -8.954 5.653 845 HA ILE 104 HA ILE 104 -0.429 -6.870 5.781 846 HB ILE 104 HB ILE 104 1.777 -7.053 3.673 847 HG12 ILE 104 HG12 ILE 104 2.896 -7.180 5.887 848 HG13 ILE 104 HG11 ILE 104 3.232 -5.645 5.097 849 HG21 ILE 104 HG21 ILE 104 0.004 -5.443 3.202 850 HG22 ILE 104 HG22 ILE 104 1.482 -4.576 3.615 851 HG23 ILE 104 HG23 ILE 104 0.186 -4.714 4.799 852 HD11 ILE 104 HD11 ILE 104 2.851 -5.338 7.448 853 HD12 ILE 104 HD12 ILE 104 1.273 -6.118 7.330 854 HD13 ILE 104 HD13 ILE 104 1.558 -4.570 6.526 855 H LEU 105 HN LEU 105 -2.345 -7.615 4.947 856 HA LEU 105 HA LEU 105 -2.404 -9.339 2.597 857 HB2 LEU 105 HB2 LEU 105 -4.861 -9.304 2.742 858 HB3 LEU 105 HB1 LEU 105 -4.108 -9.873 4.211 859 HG LEU 105 HG LEU 105 -5.138 -7.021 3.978 860 HD11 LEU 105 HD11 LEU 105 -7.029 -8.489 3.452 861 HD12 LEU 105 HD12 LEU 105 -7.235 -7.735 5.032 862 HD13 LEU 105 HD13 LEU 105 -6.732 -9.427 4.921 863 HD21 LEU 105 HD21 LEU 105 -3.625 -7.446 5.849 864 HD22 LEU 105 HD22 LEU 105 -4.614 -8.815 6.369 865 HD23 LEU 105 HD23 LEU 105 -5.265 -7.175 6.435 866 H CYS 106 HN CYS 106 -1.864 -8.423 0.849 867 HA CYS 106 HA CYS 106 -2.896 -5.778 0.044 868 HB2 CYS 106 HB2 CYS 106 -0.448 -7.292 -0.990 869 HB3 CYS 106 HB1 CYS 106 -0.949 -5.669 -1.469 870 HG CYS 106 HG CYS 106 0.240 -6.634 1.585 871 H ARG 107 HN ARG 107 -2.948 -5.727 -2.453 872 HA ARG 107 HA ARG 107 -3.637 -8.239 -3.774 873 HB2 ARG 107 HB2 ARG 107 -5.826 -7.453 -3.062 874 HB3 ARG 107 HB1 ARG 107 -5.506 -5.824 -3.630 875 HG2 ARG 107 HG2 ARG 107 -5.621 -6.521 -5.935 876 HG3 ARG 107 HG1 ARG 107 -5.680 -8.225 -5.478 877 HD2 ARG 107 HD2 ARG 107 -7.905 -7.205 -6.170 878 HD3 ARG 107 HD1 ARG 107 -7.891 -8.016 -4.610 879 HE ARG 107 HE ARG 107 -7.956 -5.916 -3.521 880 HH11 ARG 107 HH11 ARG 107 -8.448 -5.577 -6.980 881 HH12 ARG 107 HH12 ARG 107 -9.280 -4.066 -6.819 882 HH21 ARG 107 HH21 ARG 107 -9.040 -3.946 -3.337 883 HH22 ARG 107 HH22 ARG 107 -9.613 -3.145 -4.764 884 H GLU 108 HN GLU 108 -3.096 -8.191 -5.932 885 HA GLU 108 HA GLU 108 -0.984 -6.469 -6.602 886 HB2 GLU 108 HB2 GLU 108 -1.171 -8.792 -7.424 887 HB3 GLU 108 HB1 GLU 108 -2.555 -8.340 -8.416 888 HG2 GLU 108 HG2 GLU 108 -1.162 -6.890 -9.787 889 HG3 GLU 108 HG1 GLU 108 0.222 -7.160 -8.727 890 H GLY 109 HN GLY 109 -1.055 -4.448 -7.271 891 HA2 GLY 109 HA2 GLY 109 -3.438 -3.240 -8.458 892 HA3 GLY 109 HA1 GLY 109 -1.973 -2.412 -7.945 893 H ALA 110 HN ALA 110 -2.217 -5.212 -10.021 894 HA ALA 110 HA ALA 110 -1.821 -3.738 -12.508 895 HB1 ALA 110 HB1 ALA 110 0.482 -4.246 -11.756 896 HB2 ALA 110 HB2 ALA 110 0.067 -5.195 -13.184 897 HB3 ALA 110 HB3 ALA 110 0.065 -5.956 -11.591 898 H GLU 111 HN GLU 111 -3.924 -5.110 -11.172 899 HA GLU 111 HA GLU 111 -4.406 -7.728 -12.247 900 HB2 GLU 111 HB2 GLU 111 -6.718 -7.317 -11.212 901 HB3 GLU 111 HB1 GLU 111 -5.341 -7.258 -10.115 902 HG2 GLU 111 HG2 GLU 111 -5.387 -4.801 -10.137 903 HG3 GLU 111 HG1 GLU 111 -6.727 -4.825 -11.289 904 H LYS 112 HN LYS 112 -4.068 -7.253 -14.475 905 HA LYS 112 HA LYS 112 -6.239 -5.809 -15.885 906 HB2 LYS 112 HB2 LYS 112 -3.960 -4.704 -15.928 907 HB3 LYS 112 HB1 LYS 112 -3.308 -6.130 -16.709 908 HG2 LYS 112 HG2 LYS 112 -5.572 -4.685 -18.066 909 HG3 LYS 112 HG1 LYS 112 -3.992 -3.917 -18.057 910 HD2 LYS 112 HD2 LYS 112 -3.688 -5.074 -20.007 911 HD3 LYS 112 HD1 LYS 112 -3.286 -6.415 -18.938 912 HE2 LYS 112 HE2 LYS 112 -5.672 -7.179 -19.086 913 HE3 LYS 112 HE1 LYS 112 -5.983 -5.889 -20.248 914 HZ1 LYS 112 HZ1 LYS 112 -4.367 -6.874 -21.718 915 HZ2 LYS 112 HZ2 LYS 112 -5.541 -8.020 -21.310 916 HZ3 LYS 112 HZ3 LYS 112 -4.013 -8.074 -20.587 Start of MODEL 10 1 H1 MET 1 HT1 MET 1 12.226 -24.273 14.703 2 H2 MET 1 HT2 MET 1 12.632 -24.459 16.330 3 H3 MET 1 HT3 MET 1 13.123 -23.080 15.484 4 HA MET 1 HA MET 1 10.330 -23.839 16.073 5 HB2 MET 1 HB2 MET 1 11.989 -21.553 17.227 6 HB3 MET 1 HB1 MET 1 10.314 -21.923 17.625 7 HG2 MET 1 HG2 MET 1 11.009 -24.031 18.653 8 HG3 MET 1 HG1 MET 1 12.690 -23.704 18.216 9 HE1 MET 1 HE1 MET 1 13.765 -23.776 20.579 10 HE2 MET 1 HE2 MET 1 12.222 -24.402 21.167 11 HE3 MET 1 HE3 MET 1 13.019 -23.079 22.015 12 H ASN 2 HN ASN 2 12.312 -20.952 15.260 13 HA ASN 2 HA ASN 2 10.279 -19.934 13.410 14 HB2 ASN 2 HB2 ASN 2 13.002 -18.807 14.242 15 HB3 ASN 2 HB1 ASN 2 11.915 -18.011 13.107 16 HD21 ASN 2 HD21 ASN 2 12.935 -17.086 15.690 17 HD22 ASN 2 HD22 ASN 2 11.549 -16.750 16.665 18 H ILE 3 HN ILE 3 10.242 -20.921 11.450 19 HA ILE 3 HA ILE 3 12.588 -21.740 9.984 20 HB ILE 3 HB ILE 3 9.684 -21.337 9.100 21 HG12 ILE 3 HG12 ILE 3 10.017 -23.210 10.718 22 HG13 ILE 3 HG11 ILE 3 9.519 -23.802 9.137 23 HG21 ILE 3 HG21 ILE 3 10.232 -22.585 7.015 24 HG22 ILE 3 HG22 ILE 3 11.940 -22.575 7.462 25 HG23 ILE 3 HG23 ILE 3 11.109 -21.058 7.121 26 HD11 ILE 3 HD11 ILE 3 12.335 -23.825 10.211 27 HD12 ILE 3 HD12 ILE 3 11.806 -24.459 8.647 28 HD13 ILE 3 HD13 ILE 3 11.226 -25.196 10.142 29 H GLY 4 HN GLY 4 13.522 -20.660 8.200 30 HA2 GLY 4 HA2 GLY 4 13.564 -17.785 8.219 31 HA3 GLY 4 HA1 GLY 4 14.421 -18.847 7.114 32 H ARG 5 HN ARG 5 11.023 -18.005 7.814 33 HA ARG 5 HA ARG 5 9.905 -18.581 5.318 34 HB2 ARG 5 HB2 ARG 5 9.005 -16.678 7.526 35 HB3 ARG 5 HB1 ARG 5 7.994 -17.108 6.150 36 HG2 ARG 5 HG2 ARG 5 9.095 -19.114 8.148 37 HG3 ARG 5 HG1 ARG 5 7.494 -18.372 8.259 38 HD2 ARG 5 HD2 ARG 5 8.480 -20.079 5.936 39 HD3 ARG 5 HD1 ARG 5 7.414 -20.638 7.232 40 HE ARG 5 HE ARG 5 5.988 -18.599 6.341 41 HH11 ARG 5 HH11 ARG 5 7.657 -20.989 4.402 42 HH12 ARG 5 HH12 ARG 5 6.489 -20.931 3.119 43 HH21 ARG 5 HH21 ARG 5 4.473 -18.539 4.669 44 HH22 ARG 5 HH22 ARG 5 4.685 -19.553 3.280 45 H LEU 6 HN LEU 6 11.416 -15.658 6.563 46 HA LEU 6 HA LEU 6 10.432 -13.833 4.605 47 HB2 LEU 6 HB2 LEU 6 12.869 -13.522 6.396 48 HB3 LEU 6 HB1 LEU 6 11.979 -12.232 5.599 49 HG LEU 6 HG LEU 6 10.928 -13.985 7.870 50 HD11 LEU 6 HD11 LEU 6 11.020 -11.954 9.245 51 HD12 LEU 6 HD12 LEU 6 11.725 -11.053 7.899 52 HD13 LEU 6 HD13 LEU 6 12.616 -12.387 8.636 53 HD21 LEU 6 HD21 LEU 6 9.110 -13.348 6.340 54 HD22 LEU 6 HD22 LEU 6 9.554 -11.646 6.492 55 HD23 LEU 6 HD23 LEU 6 8.947 -12.534 7.894 56 H ARG 7 HN ARG 7 10.861 -14.920 2.680 57 HA ARG 7 HA ARG 7 13.583 -15.589 1.823 58 HB2 ARG 7 HB2 ARG 7 12.426 -16.676 -0.106 59 HB3 ARG 7 HB1 ARG 7 11.796 -17.250 1.437 60 HG2 ARG 7 HG2 ARG 7 9.812 -15.885 1.222 61 HG3 ARG 7 HG1 ARG 7 10.471 -15.064 -0.189 62 HD2 ARG 7 HD2 ARG 7 10.458 -17.332 -1.355 63 HD3 ARG 7 HD1 ARG 7 9.485 -17.915 0.002 64 HE ARG 7 HE ARG 7 8.231 -15.615 -0.879 65 HH11 ARG 7 HH11 ARG 7 9.028 -18.690 -2.364 66 HH12 ARG 7 HH12 ARG 7 7.681 -18.653 -3.449 67 HH21 ARG 7 HH21 ARG 7 6.517 -15.535 -2.331 68 HH22 ARG 7 HH22 ARG 7 6.243 -16.844 -3.435 69 H ASP 8 HN ASP 8 11.154 -13.153 1.320 70 HA ASP 8 HA ASP 8 12.371 -12.036 -1.095 71 HB2 ASP 8 HB2 ASP 8 9.591 -11.627 0.127 72 HB3 ASP 8 HB1 ASP 8 10.154 -10.901 -1.376 73 H ARG 9 HN ARG 9 11.583 -9.504 -1.009 74 HA ARG 9 HA ARG 9 11.941 -8.220 1.566 75 HB2 ARG 9 HB2 ARG 9 14.291 -8.668 0.760 76 HB3 ARG 9 HB1 ARG 9 13.955 -7.708 -0.671 77 HG2 ARG 9 HG2 ARG 9 13.625 -5.710 0.758 78 HG3 ARG 9 HG1 ARG 9 13.986 -6.683 2.185 79 HD2 ARG 9 HD2 ARG 9 15.946 -5.383 1.485 80 HD3 ARG 9 HD1 ARG 9 16.256 -7.113 1.333 81 HE ARG 9 HE ARG 9 15.635 -6.739 -1.131 82 HH11 ARG 9 HH11 ARG 9 17.292 -4.307 0.788 83 HH12 ARG 9 HH12 ARG 9 18.097 -3.630 -0.589 84 HH21 ARG 9 HH21 ARG 9 16.668 -5.821 -2.889 85 HH22 ARG 9 HH22 ARG 9 17.758 -4.493 -2.657 86 H ILE 10 HN ILE 10 11.032 -6.135 1.554 87 HA ILE 10 HA ILE 10 9.866 -5.160 -0.983 88 HB ILE 10 HB ILE 10 7.661 -4.866 -0.093 89 HG12 ILE 10 HG12 ILE 10 8.084 -4.181 2.218 90 HG13 ILE 10 HG11 ILE 10 6.936 -5.503 2.218 91 HG21 ILE 10 HG21 ILE 10 8.548 -7.662 0.666 92 HG22 ILE 10 HG22 ILE 10 8.066 -7.119 -0.941 93 HG23 ILE 10 HG23 ILE 10 6.881 -7.158 0.368 94 HD11 ILE 10 HD11 ILE 10 9.800 -5.516 3.090 95 HD12 ILE 10 HD12 ILE 10 8.889 -6.992 2.819 96 HD13 ILE 10 HD13 ILE 10 8.352 -5.844 4.040 97 H THR 11 HN THR 11 9.636 -2.976 -1.131 98 HA THR 11 HA THR 11 10.705 -1.220 0.924 99 HB THR 11 HB THR 11 9.664 -0.514 -1.861 100 HG1 THR 11 HG1 THR 11 11.592 -2.041 -1.491 101 HG21 THR 11 HG21 THR 11 9.816 1.430 -0.331 102 HG22 THR 11 HG22 THR 11 11.057 1.520 -1.587 103 HG23 THR 11 HG23 THR 11 11.490 1.007 0.047 104 H ILE 12 HN ILE 12 9.360 -0.384 2.379 105 HA ILE 12 HA ILE 12 6.471 -0.304 2.094 106 HB ILE 12 HB ILE 12 8.141 0.918 4.341 107 HG12 ILE 12 HG12 ILE 12 8.763 -1.456 4.136 108 HG13 ILE 12 HG11 ILE 12 7.826 -1.206 5.598 109 HG21 ILE 12 HG21 ILE 12 6.082 0.642 5.708 110 HG22 ILE 12 HG22 ILE 12 5.232 0.026 4.290 111 HG23 ILE 12 HG23 ILE 12 5.812 1.693 4.313 112 HD11 ILE 12 HD11 ILE 12 7.245 -3.274 4.482 113 HD12 ILE 12 HD12 ILE 12 6.790 -2.394 3.025 114 HD13 ILE 12 HD13 ILE 12 5.870 -2.175 4.517 115 H GLN 13 HN GLN 13 6.006 1.169 0.437 116 HA GLN 13 HA GLN 13 7.111 3.807 0.306 117 HB2 GLN 13 HB2 GLN 13 4.742 2.538 -1.111 118 HB3 GLN 13 HB1 GLN 13 5.256 4.203 -1.391 119 HG2 GLN 13 HG2 GLN 13 7.452 3.405 -2.161 120 HG3 GLN 13 HG1 GLN 13 6.953 1.733 -1.879 121 HE21 GLN 13 HE21 GLN 13 7.299 1.271 -4.057 122 HE22 GLN 13 HE22 GLN 13 6.193 1.754 -5.294 123 H THR 14 HN THR 14 6.765 4.932 2.032 124 HA THR 14 HA THR 14 4.248 5.129 3.475 125 HB THR 14 HB THR 14 5.539 6.935 4.774 126 HG1 THR 14 HG1 THR 14 7.126 6.844 2.709 127 HG21 THR 14 HG21 THR 14 6.817 4.177 4.593 128 HG22 THR 14 HG22 THR 14 5.422 4.603 5.592 129 HG23 THR 14 HG23 THR 14 7.004 5.312 5.929 130 H LEU 15 HN LEU 15 2.930 7.087 3.613 131 HA LEU 15 HA LEU 15 2.828 8.436 1.010 132 HB2 LEU 15 HB2 LEU 15 0.819 7.233 1.809 133 HB3 LEU 15 HB1 LEU 15 0.785 8.224 3.260 134 HG LEU 15 HG LEU 15 0.347 10.240 1.865 135 HD11 LEU 15 HD11 LEU 15 1.473 9.498 -0.189 136 HD12 LEU 15 HD12 LEU 15 -0.164 10.036 -0.498 137 HD13 LEU 15 HD13 LEU 15 0.194 8.314 -0.471 138 HD21 LEU 15 HD21 LEU 15 -1.555 9.018 2.825 139 HD22 LEU 15 HD22 LEU 15 -1.640 7.989 1.393 140 HD23 LEU 15 HD23 LEU 15 -1.979 9.717 1.263 141 H LYS 16 HN LYS 16 4.094 10.253 1.056 142 HA LYS 16 HA LYS 16 3.917 12.129 3.288 143 HB2 LYS 16 HB2 LYS 16 6.142 11.596 2.248 144 HB3 LYS 16 HB1 LYS 16 5.578 12.301 0.733 145 HG2 LYS 16 HG2 LYS 16 5.309 14.489 1.849 146 HG3 LYS 16 HG1 LYS 16 5.848 13.777 3.378 147 HD2 LYS 16 HD2 LYS 16 8.046 13.243 2.267 148 HD3 LYS 16 HD1 LYS 16 7.487 14.110 0.830 149 HE2 LYS 16 HE2 LYS 16 7.319 16.188 2.143 150 HE3 LYS 16 HE1 LYS 16 7.810 15.328 3.607 151 HZ1 LYS 16 HZ1 LYS 16 9.450 15.706 1.164 152 HZ2 LYS 16 HZ2 LYS 16 9.925 14.838 2.537 153 HZ3 LYS 16 HZ3 LYS 16 9.655 16.503 2.640 154 H GLN 17 HN GLN 17 1.965 13.098 3.165 155 HA GLN 17 HA GLN 17 0.808 14.174 0.760 156 HB2 GLN 17 HB2 GLN 17 0.104 14.589 3.695 157 HB3 GLN 17 HB1 GLN 17 -0.853 15.189 2.344 158 HG2 GLN 17 HG2 GLN 17 -1.156 12.808 1.591 159 HG3 GLN 17 HG1 GLN 17 -0.330 12.293 3.064 160 HE21 GLN 17 HE21 GLN 17 -3.220 13.808 1.775 161 HE22 GLN 17 HE22 GLN 17 -4.197 13.592 3.186 162 H THR 18 HN THR 18 2.190 15.622 -0.153 163 HA THR 18 HA THR 18 3.529 17.702 1.396 164 HB THR 18 HB THR 18 3.798 16.941 -1.556 165 HG1 THR 18 HG1 THR 18 4.898 15.904 0.760 166 HG21 THR 18 HG21 THR 18 5.917 18.214 -1.476 167 HG22 THR 18 HG22 THR 18 5.563 18.708 0.180 168 HG23 THR 18 HG23 THR 18 4.534 19.259 -1.148 169 H ARG 19 HN ARG 19 2.693 19.710 1.512 170 HA ARG 19 HA ARG 19 0.320 20.488 0.091 171 HB2 ARG 19 HB2 ARG 19 0.891 21.122 2.470 172 HB3 ARG 19 HB1 ARG 19 2.135 22.194 1.842 173 HG2 ARG 19 HG2 ARG 19 0.380 23.521 0.677 174 HG3 ARG 19 HG1 ARG 19 -0.853 22.441 1.330 175 HD2 ARG 19 HD2 ARG 19 -0.743 24.496 2.640 176 HD3 ARG 19 HD1 ARG 19 -0.225 23.124 3.625 177 HE ARG 19 HE ARG 19 1.685 24.989 2.326 178 HH11 ARG 19 HH11 ARG 19 0.719 23.171 5.160 179 HH12 ARG 19 HH12 ARG 19 2.050 23.731 6.114 180 HH21 ARG 19 HH21 ARG 19 3.420 25.728 3.602 181 HH22 ARG 19 HH22 ARG 19 3.569 25.184 5.243 182 H ASP 20 HN ASP 20 0.193 22.594 -1.104 183 HA ASP 20 HA ASP 20 2.510 23.078 -2.901 184 HB2 ASP 20 HB2 ASP 20 0.421 22.129 -3.967 185 HB3 ASP 20 HB1 ASP 20 -0.485 23.525 -3.398 186 H ILE 21 HN ILE 21 2.739 25.435 -3.594 187 HA ILE 21 HA ILE 21 2.682 27.318 -1.588 188 HB ILE 21 HB ILE 21 4.069 27.406 -3.668 189 HG12 ILE 21 HG12 ILE 21 2.495 29.964 -3.100 190 HG13 ILE 21 HG11 ILE 21 3.920 29.423 -2.225 191 HG21 ILE 21 HG21 ILE 21 2.327 26.857 -5.314 192 HG22 ILE 21 HG22 ILE 21 3.163 28.348 -5.747 193 HG23 ILE 21 HG23 ILE 21 1.551 28.420 -5.030 194 HD11 ILE 21 HD11 ILE 21 3.822 30.283 -5.115 195 HD12 ILE 21 HD12 ILE 21 5.263 29.724 -4.260 196 HD13 ILE 21 HD13 ILE 21 4.459 31.211 -3.757 197 H THR 22 HN THR 22 -0.145 26.246 -3.263 198 HA THR 22 HA THR 22 -1.570 28.813 -2.962 199 HB THR 22 HB THR 22 -3.364 27.668 -4.284 200 HG1 THR 22 HG1 THR 22 -3.019 25.622 -5.099 201 HG21 THR 22 HG21 THR 22 -1.668 28.992 -5.522 202 HG22 THR 22 HG22 THR 22 -2.224 27.608 -6.468 203 HG23 THR 22 HG23 THR 22 -0.651 27.550 -5.668 204 H GLY 23 HN GLY 23 -0.817 25.996 -1.412 205 HA2 GLY 23 HA2 GLY 23 -1.396 25.258 0.714 206 HA3 GLY 23 HA1 GLY 23 -2.778 26.341 0.699 207 H GLU 24 HN GLU 24 -1.819 23.751 -1.560 208 HA GLU 24 HA GLU 24 -4.327 22.303 -0.999 209 HB2 GLU 24 HB2 GLU 24 -2.768 22.449 -3.631 210 HB3 GLU 24 HB1 GLU 24 -4.192 21.447 -3.346 211 HG2 GLU 24 HG2 GLU 24 -5.504 23.529 -2.897 212 HG3 GLU 24 HG1 GLU 24 -4.082 24.477 -3.338 213 H ILE 25 HN ILE 25 -4.131 20.131 -0.537 214 HA ILE 25 HA ILE 25 -1.453 19.156 0.170 215 HB ILE 25 HB ILE 25 -4.181 17.924 0.802 216 HG12 ILE 25 HG12 ILE 25 -4.059 20.199 1.787 217 HG13 ILE 25 HG11 ILE 25 -4.020 18.973 3.045 218 HG21 ILE 25 HG21 ILE 25 -2.977 16.702 2.585 219 HG22 ILE 25 HG22 ILE 25 -1.457 17.426 2.053 220 HG23 ILE 25 HG23 ILE 25 -2.332 16.326 0.986 221 HD11 ILE 25 HD11 ILE 25 -1.652 20.534 2.012 222 HD12 ILE 25 HD12 ILE 25 -1.595 19.288 3.265 223 HD13 ILE 25 HD13 ILE 25 -2.498 20.778 3.541 224 H LEU 26 HN LEU 26 -0.397 17.822 -1.183 225 HA LEU 26 HA LEU 26 -1.855 16.167 -3.163 226 HB2 LEU 26 HB2 LEU 26 0.957 17.355 -3.294 227 HB3 LEU 26 HB1 LEU 26 0.383 16.124 -4.401 228 HG LEU 26 HG LEU 26 -1.439 17.782 -5.106 229 HD11 LEU 26 HD11 LEU 26 0.325 19.804 -3.693 230 HD12 LEU 26 HD12 LEU 26 -1.319 19.355 -3.230 231 HD13 LEU 26 HD13 LEU 26 -1.031 20.165 -4.768 232 HD21 LEU 26 HD21 LEU 26 1.447 18.495 -5.715 233 HD22 LEU 26 HD22 LEU 26 0.040 18.925 -6.691 234 HD23 LEU 26 HD23 LEU 26 0.500 17.236 -6.511 235 H GLU 27 HN GLU 27 -1.800 14.073 -2.815 236 HA GLU 27 HA GLU 27 -0.077 12.845 -0.851 237 HB2 GLU 27 HB2 GLU 27 -2.225 11.726 -2.700 238 HB3 GLU 27 HB1 GLU 27 -1.353 10.753 -1.536 239 HG2 GLU 27 HG2 GLU 27 -3.430 11.252 -0.526 240 HG3 GLU 27 HG1 GLU 27 -2.241 12.279 0.265 241 H THR 28 HN THR 28 1.916 12.203 -1.317 242 HA THR 28 HA THR 28 2.541 10.888 -3.895 243 HB THR 28 HB THR 28 4.912 11.890 -3.725 244 HG1 THR 28 HG1 THR 28 3.605 13.348 -1.720 245 HG21 THR 28 HG21 THR 28 3.321 12.686 -5.429 246 HG22 THR 28 HG22 THR 28 4.336 14.007 -4.839 247 HG23 THR 28 HG23 THR 28 2.665 13.853 -4.283 248 H TRP 29 HN TRP 29 4.363 9.386 -3.696 249 HA TRP 29 HA TRP 29 4.266 8.053 -1.052 250 HB2 TRP 29 HB2 TRP 29 4.441 6.799 -3.833 251 HB3 TRP 29 HB1 TRP 29 4.459 5.906 -2.315 252 HD1 TRP 29 HD1 TRP 29 2.076 7.741 -4.678 253 HE1 TRP 29 HE1 TRP 29 -0.338 7.228 -3.987 254 HE3 TRP 29 HE3 TRP 29 2.976 5.393 -0.222 255 HZ2 TRP 29 HZ2 TRP 29 -1.707 6.025 -1.834 256 HZ3 TRP 29 HZ3 TRP 29 1.055 4.604 1.097 257 HH2 TRP 29 HH2 TRP 29 -1.243 4.909 0.313 258 H GLU 30 HN GLU 30 6.112 8.362 -0.087 259 HA GLU 30 HA GLU 30 8.660 8.454 -1.578 260 HB2 GLU 30 HB2 GLU 30 9.677 9.107 0.638 261 HB3 GLU 30 HB1 GLU 30 8.517 10.256 -0.007 262 HG2 GLU 30 HG2 GLU 30 6.905 9.760 1.626 263 HG3 GLU 30 HG1 GLU 30 7.647 8.207 2.025 264 H ASP 31 HN ASP 31 10.086 6.848 -1.509 265 HA ASP 31 HA ASP 31 9.408 4.245 -0.581 266 HB2 ASP 31 HB2 ASP 31 11.757 3.609 -1.241 267 HB3 ASP 31 HB1 ASP 31 10.856 4.417 -2.516 268 H GLY 32 HN GLY 32 9.847 3.227 1.358 269 HA2 GLY 32 HA2 GLY 32 10.986 4.956 3.486 270 HA3 GLY 32 HA1 GLY 32 9.700 3.777 3.707 271 H HIS 33 HN HIS 33 10.283 1.863 4.513 272 HA HIS 33 HA HIS 33 13.156 1.210 4.729 273 HB2 HIS 33 HB2 HIS 33 10.721 0.219 6.291 274 HB3 HIS 33 HB1 HIS 33 12.381 -0.300 6.582 275 HD1 HIS 33 HD1 HIS 33 9.974 2.258 7.559 276 HD2 HIS 33 HD2 HIS 33 14.116 1.901 7.433 277 HE1 HIS 33 HE1 HIS 33 10.855 4.120 9.002 278 HE2 HIS 33 HE2 HIS 33 13.358 4.007 8.722 279 H THR 34 HN THR 34 13.974 -0.453 3.502 280 HA THR 34 HA THR 34 12.107 -2.286 2.170 281 HB THR 34 HB THR 34 15.057 -1.844 1.551 282 HG1 THR 34 HG1 THR 34 13.254 -0.736 -0.197 283 HG21 THR 34 HG21 THR 34 12.811 -2.962 -0.177 284 HG22 THR 34 HG22 THR 34 14.043 -3.937 0.625 285 HG23 THR 34 HG23 THR 34 14.508 -2.805 -0.645 286 H LEU 35 HN LEU 35 11.736 -3.844 3.769 287 HA LEU 35 HA LEU 35 14.085 -5.173 5.012 288 HB2 LEU 35 HB2 LEU 35 12.803 -5.628 6.986 289 HB3 LEU 35 HB1 LEU 35 12.680 -3.913 6.648 290 HG LEU 35 HG LEU 35 10.454 -5.855 5.877 291 HD11 LEU 35 HD11 LEU 35 10.672 -4.346 8.497 292 HD12 LEU 35 HD12 LEU 35 10.837 -6.093 8.290 293 HD13 LEU 35 HD13 LEU 35 9.295 -5.311 7.949 294 HD21 LEU 35 HD21 LEU 35 10.293 -3.689 4.785 295 HD22 LEU 35 HD22 LEU 35 10.466 -2.849 6.327 296 HD23 LEU 35 HD23 LEU 35 9.027 -3.823 6.003 297 H TRP 36 HN TRP 36 13.621 -7.428 5.760 298 HA TRP 36 HA TRP 36 12.949 -9.107 3.607 299 HB2 TRP 36 HB2 TRP 36 13.280 -9.838 6.545 300 HB3 TRP 36 HB1 TRP 36 13.279 -10.982 5.209 301 HD1 TRP 36 HD1 TRP 36 15.706 -9.550 7.391 302 HE1 TRP 36 HE1 TRP 36 18.038 -9.375 6.334 303 HE3 TRP 36 HE3 TRP 36 14.437 -10.090 2.471 304 HZ2 TRP 36 HZ2 TRP 36 19.200 -9.444 3.773 305 HZ3 TRP 36 HZ3 TRP 36 16.208 -10.013 0.788 306 HH2 TRP 36 HH2 TRP 36 18.553 -9.699 1.413 307 H ALA 37 HN ALA 37 11.212 -10.171 3.042 308 HA ALA 37 HA ALA 37 8.825 -10.454 4.787 309 HB1 ALA 37 HB1 ALA 37 8.766 -9.427 1.926 310 HB2 ALA 37 HB2 ALA 37 8.339 -8.535 3.386 311 HB3 ALA 37 HB3 ALA 37 7.342 -9.884 2.864 312 H SER 38 HN SER 38 7.294 -12.189 4.057 313 HA SER 38 HA SER 38 8.323 -14.022 1.999 314 HB2 SER 38 HB2 SER 38 8.205 -14.944 4.359 315 HB3 SER 38 HB1 SER 38 6.470 -14.644 4.348 316 HG SER 38 HG SER 38 7.955 -16.626 3.103 317 H VAL 39 HN VAL 39 7.313 -13.083 0.273 318 HA VAL 39 HA VAL 39 4.587 -12.040 0.458 319 HB VAL 39 HB VAL 39 6.646 -11.875 -1.796 320 HG11 VAL 39 HG11 VAL 39 4.007 -10.394 -1.480 321 HG12 VAL 39 HG12 VAL 39 4.351 -11.655 -2.665 322 HG13 VAL 39 HG13 VAL 39 5.197 -10.112 -2.754 323 HG21 VAL 39 HG21 VAL 39 7.010 -9.549 -1.079 324 HG22 VAL 39 HG22 VAL 39 7.397 -10.675 0.222 325 HG23 VAL 39 HG23 VAL 39 5.879 -9.773 0.261 326 H ASN 40 HN ASN 40 3.243 -13.816 0.364 327 HA ASN 40 HA ASN 40 3.472 -15.646 -1.950 328 HB2 ASN 40 HB2 ASN 40 2.375 -16.203 0.856 329 HB3 ASN 40 HB1 ASN 40 2.301 -17.330 -0.498 330 HD21 ASN 40 HD21 ASN 40 4.407 -15.767 1.822 331 HD22 ASN 40 HD22 ASN 40 5.759 -16.818 1.599 332 H MET 41 HN MET 41 1.939 -15.129 -3.416 333 HA MET 41 HA MET 41 -0.492 -13.724 -2.891 334 HB2 MET 41 HB2 MET 41 0.160 -15.576 -5.236 335 HB3 MET 41 HB1 MET 41 -1.144 -14.391 -5.188 336 HG2 MET 41 HG2 MET 41 0.508 -12.576 -5.086 337 HG3 MET 41 HG1 MET 41 1.813 -13.753 -5.085 338 HE1 MET 41 HE1 MET 41 -1.529 -13.795 -7.235 339 HE2 MET 41 HE2 MET 41 -0.970 -13.014 -8.714 340 HE3 MET 41 HE3 MET 41 -1.064 -12.093 -7.212 341 H VAL 42 HN VAL 42 -2.466 -14.518 -2.217 342 HA VAL 42 HA VAL 42 -2.574 -17.161 -1.139 343 HB VAL 42 HB VAL 42 -4.826 -16.655 -0.393 344 HG11 VAL 42 HG11 VAL 42 -3.020 -15.716 0.958 345 HG12 VAL 42 HG12 VAL 42 -4.433 -14.661 1.000 346 HG13 VAL 42 HG13 VAL 42 -3.044 -14.231 -0.001 347 HG21 VAL 42 HG21 VAL 42 -6.020 -14.560 -0.951 348 HG22 VAL 42 HG22 VAL 42 -5.763 -15.570 -2.372 349 HG23 VAL 42 HG23 VAL 42 -4.750 -14.153 -2.108 350 H SER 43 HN SER 43 -3.800 -18.929 -1.773 351 HA SER 43 HA SER 43 -4.528 -19.145 -4.589 352 HB2 SER 43 HB2 SER 43 -3.243 -20.959 -3.387 353 HB3 SER 43 HB1 SER 43 -4.661 -21.259 -2.384 354 HG SER 43 HG SER 43 -5.233 -22.557 -3.923 355 H SER 44 HN SER 44 -6.672 -20.585 -4.846 356 HA SER 44 HA SER 44 -8.704 -18.667 -4.642 357 HB2 SER 44 HB2 SER 44 -10.178 -20.487 -5.618 358 HB3 SER 44 HB1 SER 44 -8.683 -20.185 -6.504 359 HG SER 44 HG SER 44 -8.599 -22.301 -6.326 360 H LYS 45 HN LYS 45 -7.923 -21.263 -2.427 361 HA LYS 45 HA LYS 45 -10.492 -21.723 -1.360 362 HB2 LYS 45 HB2 LYS 45 -9.511 -22.979 0.393 363 HB3 LYS 45 HB1 LYS 45 -8.509 -23.239 -1.021 364 HG2 LYS 45 HG2 LYS 45 -7.798 -21.375 1.272 365 HG3 LYS 45 HG1 LYS 45 -7.236 -23.039 1.110 366 HD2 LYS 45 HD2 LYS 45 -6.266 -22.287 -1.175 367 HD3 LYS 45 HD1 LYS 45 -6.529 -20.636 -0.604 368 HE2 LYS 45 HE2 LYS 45 -4.807 -22.743 0.763 369 HE3 LYS 45 HE1 LYS 45 -4.210 -21.400 -0.210 370 HZ1 LYS 45 HZ1 LYS 45 -4.997 -19.858 1.407 371 HZ2 LYS 45 HZ2 LYS 45 -4.095 -21.033 2.219 372 HZ3 LYS 45 HZ3 LYS 45 -5.783 -21.066 2.287 373 H GLU 46 HN GLU 46 -8.227 -19.164 -0.721 374 HA GLU 46 HA GLU 46 -9.309 -18.207 1.738 375 HB2 GLU 46 HB2 GLU 46 -7.796 -16.716 -0.446 376 HB3 GLU 46 HB1 GLU 46 -8.081 -16.107 1.187 377 HG2 GLU 46 HG2 GLU 46 -6.440 -18.541 0.420 378 HG3 GLU 46 HG1 GLU 46 -5.819 -16.982 0.955 379 H ALA 47 HN ALA 47 -9.942 -17.476 -1.665 380 HA ALA 47 HA ALA 47 -11.887 -15.423 -1.249 381 HB1 ALA 47 HB1 ALA 47 -10.620 -15.635 -3.347 382 HB2 ALA 47 HB2 ALA 47 -12.355 -15.706 -3.655 383 HB3 ALA 47 HB3 ALA 47 -11.393 -17.186 -3.673 384 H ILE 48 HN ILE 48 -12.049 -18.924 -1.749 385 HA ILE 48 HA ILE 48 -14.862 -19.253 -1.769 386 HB ILE 48 HB ILE 48 -12.732 -21.232 -0.817 387 HG12 ILE 48 HG12 ILE 48 -14.050 -20.980 -3.558 388 HG13 ILE 48 HG11 ILE 48 -12.422 -20.435 -3.181 389 HG21 ILE 48 HG21 ILE 48 -14.400 -23.012 -1.277 390 HG22 ILE 48 HG22 ILE 48 -15.609 -21.785 -1.652 391 HG23 ILE 48 HG23 ILE 48 -14.962 -21.913 -0.016 392 HD11 ILE 48 HD11 ILE 48 -13.396 -23.291 -3.135 393 HD12 ILE 48 HD12 ILE 48 -11.757 -22.760 -2.751 394 HD13 ILE 48 HD13 ILE 48 -12.400 -22.537 -4.376 395 H SER 49 HN SER 49 -12.508 -19.122 0.891 396 HA SER 49 HA SER 49 -14.230 -19.873 3.025 397 HB2 SER 49 HB2 SER 49 -11.618 -18.301 3.044 398 HB3 SER 49 HB1 SER 49 -12.428 -18.887 4.500 399 HG SER 49 HG SER 49 -11.879 -20.684 2.418 400 H SER 50 HN SER 50 -13.203 -16.687 1.835 401 HA SER 50 HA SER 50 -14.743 -15.278 3.898 402 HB2 SER 50 HB2 SER 50 -13.531 -13.291 3.006 403 HB3 SER 50 HB1 SER 50 -12.436 -14.588 3.473 404 HG SER 50 HG SER 50 -11.796 -14.737 1.487 405 H GLY 51 HN GLY 51 -15.083 -16.161 0.580 406 HA2 GLY 51 HA2 GLY 51 -17.002 -15.919 -0.744 407 HA3 GLY 51 HA1 GLY 51 -17.571 -14.624 0.300 408 H ALA 52 HN ALA 52 -16.102 -12.623 0.276 409 HA ALA 52 HA ALA 52 -14.944 -12.045 -2.380 410 HB1 ALA 52 HB1 ALA 52 -17.084 -10.313 -1.073 411 HB2 ALA 52 HB2 ALA 52 -17.321 -11.355 -2.479 412 HB3 ALA 52 HB3 ALA 52 -16.243 -9.962 -2.587 413 H GLU 53 HN GLU 53 -14.825 -11.668 1.050 414 HA GLU 53 HA GLU 53 -13.586 -9.156 1.368 415 HB2 GLU 53 HB2 GLU 53 -13.127 -11.607 3.116 416 HB3 GLU 53 HB1 GLU 53 -12.849 -9.933 3.573 417 HG2 GLU 53 HG2 GLU 53 -15.546 -11.199 2.981 418 HG3 GLU 53 HG1 GLU 53 -14.900 -10.834 4.580 419 H LEU 54 HN LEU 54 -12.136 -12.368 0.970 420 HA LEU 54 HA LEU 54 -9.583 -11.167 0.063 421 HB2 LEU 54 HB2 LEU 54 -10.183 -14.035 0.935 422 HB3 LEU 54 HB1 LEU 54 -8.620 -13.457 0.371 423 HG LEU 54 HG LEU 54 -10.006 -12.515 2.920 424 HD11 LEU 54 HD11 LEU 54 -9.281 -14.854 3.117 425 HD12 LEU 54 HD12 LEU 54 -8.326 -13.795 4.152 426 HD13 LEU 54 HD13 LEU 54 -7.640 -14.401 2.640 427 HD21 LEU 54 HD21 LEU 54 -7.872 -11.400 3.451 428 HD22 LEU 54 HD22 LEU 54 -8.572 -10.763 1.966 429 HD23 LEU 54 HD23 LEU 54 -7.213 -11.888 1.885 430 H ALA 55 HN ALA 55 -8.758 -11.902 -1.954 431 HA ALA 55 HA ALA 55 -10.711 -13.166 -3.804 432 HB1 ALA 55 HB1 ALA 55 -10.530 -10.728 -4.217 433 HB2 ALA 55 HB2 ALA 55 -9.882 -11.655 -5.571 434 HB3 ALA 55 HB3 ALA 55 -8.784 -10.881 -4.421 435 H ILE 56 HN ILE 56 -9.557 -14.050 -5.793 436 HA ILE 56 HA ILE 56 -7.512 -15.875 -4.894 437 HB ILE 56 HB ILE 56 -8.513 -15.522 -7.758 438 HG12 ILE 56 HG12 ILE 56 -9.695 -17.339 -5.599 439 HG13 ILE 56 HG11 ILE 56 -10.446 -15.876 -6.221 440 HG21 ILE 56 HG21 ILE 56 -7.241 -17.938 -6.393 441 HG22 ILE 56 HG22 ILE 56 -6.460 -16.874 -7.563 442 HG23 ILE 56 HG23 ILE 56 -7.817 -17.877 -8.061 443 HD11 ILE 56 HD11 ILE 56 -9.899 -18.388 -7.801 444 HD12 ILE 56 HD12 ILE 56 -10.654 -16.918 -8.426 445 HD13 ILE 56 HD13 ILE 56 -11.456 -17.856 -7.167 446 H GLY 57 HN GLY 57 -5.415 -15.317 -4.826 447 HA2 GLY 57 HA2 GLY 57 -3.343 -14.678 -5.743 448 HA3 GLY 57 HA1 GLY 57 -4.169 -13.709 -6.958 449 H THR 58 HN THR 58 -5.624 -13.052 -4.017 450 HA THR 58 HA THR 58 -4.587 -10.483 -3.596 451 HB THR 58 HB THR 58 -6.040 -12.398 -1.735 452 HG1 THR 58 HG1 THR 58 -6.972 -11.131 -3.634 453 HG21 THR 58 HG21 THR 58 -4.706 -11.000 -0.233 454 HG22 THR 58 HG22 THR 58 -6.397 -10.503 -0.154 455 HG23 THR 58 HG23 THR 58 -5.233 -9.538 -1.067 456 H VAL 59 HN VAL 59 -2.629 -9.896 -3.006 457 HA VAL 59 HA VAL 59 -0.622 -11.853 -2.462 458 HB VAL 59 HB VAL 59 -0.407 -8.814 -2.592 459 HG11 VAL 59 HG11 VAL 59 1.986 -9.221 -3.095 460 HG12 VAL 59 HG12 VAL 59 1.744 -10.951 -2.839 461 HG13 VAL 59 HG13 VAL 59 1.547 -9.823 -1.494 462 HG21 VAL 59 HG21 VAL 59 0.262 -9.172 -4.965 463 HG22 VAL 59 HG22 VAL 59 -1.384 -9.724 -4.662 464 HG23 VAL 59 HG23 VAL 59 -0.071 -10.892 -4.793 465 H ARG 60 HN ARG 60 -0.493 -12.688 -0.460 466 HA ARG 60 HA ARG 60 -0.798 -11.049 1.954 467 HB2 ARG 60 HB2 ARG 60 -1.868 -13.300 1.821 468 HB3 ARG 60 HB1 ARG 60 -0.281 -14.037 1.624 469 HG2 ARG 60 HG2 ARG 60 0.360 -13.374 3.877 470 HG3 ARG 60 HG1 ARG 60 -1.144 -12.468 4.081 471 HD2 ARG 60 HD2 ARG 60 -0.923 -15.480 3.699 472 HD3 ARG 60 HD1 ARG 60 -1.223 -14.654 5.230 473 HE ARG 60 HE ARG 60 -3.087 -14.472 2.939 474 HH11 ARG 60 HH11 ARG 60 -2.590 -15.040 6.374 475 HH12 ARG 60 HH12 ARG 60 -4.278 -15.272 6.689 476 HH21 ARG 60 HH21 ARG 60 -5.280 -14.765 3.379 477 HH22 ARG 60 HH22 ARG 60 -5.795 -15.131 4.990 478 H ILE 61 HN ILE 61 0.936 -10.581 3.301 479 HA ILE 61 HA ILE 61 3.672 -11.107 2.303 480 HB ILE 61 HB ILE 61 2.543 -8.306 2.820 481 HG12 ILE 61 HG12 ILE 61 3.589 -9.534 0.229 482 HG13 ILE 61 HG11 ILE 61 1.890 -9.328 0.619 483 HG21 ILE 61 HG21 ILE 61 5.392 -9.097 2.092 484 HG22 ILE 61 HG22 ILE 61 4.859 -8.424 3.635 485 HG23 ILE 61 HG23 ILE 61 4.780 -7.441 2.172 486 HD11 ILE 61 HD11 ILE 61 2.620 -7.648 -0.920 487 HD12 ILE 61 HD12 ILE 61 3.898 -7.135 0.180 488 HD13 ILE 61 HD13 ILE 61 2.204 -6.898 0.621 489 H TRP 62 HN TRP 62 4.537 -12.087 4.012 490 HA TRP 62 HA TRP 62 3.873 -11.353 6.776 491 HB2 TRP 62 HB2 TRP 62 5.528 -13.610 5.560 492 HB3 TRP 62 HB1 TRP 62 5.434 -13.335 7.298 493 HD1 TRP 62 HD1 TRP 62 2.138 -12.885 5.472 494 HE1 TRP 62 HE1 TRP 62 0.626 -14.882 6.012 495 HE3 TRP 62 HE3 TRP 62 5.580 -15.903 7.726 496 HZ2 TRP 62 HZ2 TRP 62 0.852 -17.428 7.218 497 HZ3 TRP 62 HZ3 TRP 62 4.863 -18.100 8.566 498 HH2 TRP 62 HH2 TRP 62 2.544 -18.862 8.304 499 H ILE 63 HN ILE 63 5.105 -9.938 7.880 500 HA ILE 63 HA ILE 63 8.032 -9.866 7.429 501 HB ILE 63 HB ILE 63 8.079 -7.418 7.920 502 HG12 ILE 63 HG12 ILE 63 5.049 -7.447 7.562 503 HG13 ILE 63 HG11 ILE 63 5.852 -7.318 9.122 504 HG21 ILE 63 HG21 ILE 63 6.405 -8.084 5.469 505 HG22 ILE 63 HG22 ILE 63 8.166 -8.127 5.572 506 HG23 ILE 63 HG23 ILE 63 7.316 -6.590 5.718 507 HD11 ILE 63 HD11 ILE 63 6.031 -5.341 6.853 508 HD12 ILE 63 HD12 ILE 63 6.861 -5.197 8.404 509 HD13 ILE 63 HD13 ILE 63 5.100 -5.162 8.338 510 H ARG 64 HN ARG 64 9.184 -9.292 9.433 511 HA ARG 64 HA ARG 64 8.297 -10.146 11.879 512 HB2 ARG 64 HB2 ARG 64 10.210 -7.845 11.323 513 HB3 ARG 64 HB1 ARG 64 9.976 -8.560 12.919 514 HG2 ARG 64 HG2 ARG 64 10.737 -10.748 12.040 515 HG3 ARG 64 HG1 ARG 64 11.022 -10.004 10.463 516 HD2 ARG 64 HD2 ARG 64 12.697 -8.503 11.482 517 HD3 ARG 64 HD1 ARG 64 12.398 -9.245 13.064 518 HE ARG 64 HE ARG 64 13.338 -10.863 10.774 519 HH11 ARG 64 HH11 ARG 64 13.878 -9.696 14.032 520 HH12 ARG 64 HH12 ARG 64 15.226 -10.752 14.308 521 HH21 ARG 64 HH21 ARG 64 15.114 -12.187 11.129 522 HH22 ARG 64 HH22 ARG 64 15.951 -12.130 12.645 523 H TYR 65 HN TYR 65 7.447 -9.172 13.760 524 HA TYR 65 HA TYR 65 5.176 -7.578 13.433 525 HB2 TYR 65 HB2 TYR 65 5.530 -9.142 15.341 526 HB3 TYR 65 HB1 TYR 65 6.753 -8.057 16.007 527 HD1 TYR 65 HD1 TYR 65 6.061 -5.898 17.074 528 HD2 TYR 65 HD2 TYR 65 3.146 -8.571 15.450 529 HE1 TYR 65 HE1 TYR 65 4.291 -4.669 18.225 530 HE2 TYR 65 HE2 TYR 65 1.381 -7.321 16.607 531 HH TYR 65 HH TYR 65 1.846 -4.279 17.948 532 H ARG 66 HN ARG 66 5.133 -5.490 12.846 533 HA ARG 66 HA ARG 66 7.229 -3.633 13.768 534 HB2 ARG 66 HB2 ARG 66 7.897 -4.669 11.587 535 HB3 ARG 66 HB1 ARG 66 6.430 -4.033 10.845 536 HG2 ARG 66 HG2 ARG 66 7.197 -1.744 11.210 537 HG3 ARG 66 HG1 ARG 66 8.611 -2.329 12.092 538 HD2 ARG 66 HD2 ARG 66 9.436 -3.433 10.034 539 HD3 ARG 66 HD1 ARG 66 8.021 -2.841 9.153 540 HE ARG 66 HE ARG 66 8.825 -0.616 9.387 541 HH11 ARG 66 HH11 ARG 66 11.224 -3.025 10.320 542 HH12 ARG 66 HH12 ARG 66 12.520 -1.872 10.372 543 HH21 ARG 66 HH21 ARG 66 10.515 0.858 9.489 544 HH22 ARG 66 HH22 ARG 66 12.114 0.321 9.904 545 H LYS 67 HN LYS 67 6.276 -1.952 14.659 546 HA LYS 67 HA LYS 67 3.507 -1.201 14.174 547 HB2 LYS 67 HB2 LYS 67 5.601 0.009 16.032 548 HB3 LYS 67 HB1 LYS 67 3.870 0.352 16.073 549 HG2 LYS 67 HG2 LYS 67 3.402 -1.970 16.729 550 HG3 LYS 67 HG1 LYS 67 5.123 -2.366 16.611 551 HD2 LYS 67 HD2 LYS 67 5.612 -0.746 18.428 552 HD3 LYS 67 HD1 LYS 67 3.893 -0.365 18.551 553 HE2 LYS 67 HE2 LYS 67 3.441 -2.727 19.186 554 HE3 LYS 67 HE1 LYS 67 5.169 -3.064 19.101 555 HZ1 LYS 67 HZ1 LYS 67 5.481 -1.382 20.852 556 HZ2 LYS 67 HZ2 LYS 67 4.547 -2.697 21.351 557 HZ3 LYS 67 HZ3 LYS 67 3.806 -1.228 20.978 558 H ASP 68 HN ASP 68 6.037 -0.620 12.353 559 HA ASP 68 HA ASP 68 6.010 2.298 12.057 560 HB2 ASP 68 HB2 ASP 68 8.185 1.198 12.156 561 HB3 ASP 68 HB1 ASP 68 7.719 0.035 10.928 562 H ILE 69 HN ILE 69 4.627 -0.505 10.640 563 HA ILE 69 HA ILE 69 4.168 0.592 7.982 564 HB ILE 69 HB ILE 69 2.888 -1.933 9.124 565 HG12 ILE 69 HG12 ILE 69 5.280 -2.179 9.540 566 HG13 ILE 69 HG11 ILE 69 4.827 -3.222 8.202 567 HG21 ILE 69 HG21 ILE 69 1.975 -1.153 6.965 568 HG22 ILE 69 HG22 ILE 69 2.833 -2.682 6.766 569 HG23 ILE 69 HG23 ILE 69 3.594 -1.172 6.256 570 HD11 ILE 69 HD11 ILE 69 6.266 -0.580 8.010 571 HD12 ILE 69 HD12 ILE 69 5.771 -1.568 6.633 572 HD13 ILE 69 HD13 ILE 69 6.950 -2.186 7.786 573 H ASN 70 HN ASN 70 2.232 1.468 7.272 574 HA ASN 70 HA ASN 70 -0.145 1.380 9.046 575 HB2 ASN 70 HB2 ASN 70 1.035 3.661 9.146 576 HB3 ASN 70 HB1 ASN 70 0.665 3.850 7.430 577 HD21 ASN 70 HD21 ASN 70 -0.784 3.471 10.633 578 HD22 ASN 70 HD22 ASN 70 -2.277 4.253 10.251 579 H ALA 71 HN ALA 71 -2.169 1.863 7.808 580 HA ALA 71 HA ALA 71 -2.410 0.311 5.464 581 HB1 ALA 71 HB1 ALA 71 -4.262 0.601 7.048 582 HB2 ALA 71 HB2 ALA 71 -4.747 1.092 5.424 583 HB3 ALA 71 HB3 ALA 71 -4.364 2.317 6.638 584 H THR 72 HN THR 72 -1.703 3.688 5.965 585 HA THR 72 HA THR 72 -2.055 4.501 3.190 586 HB THR 72 HB THR 72 -1.082 6.680 3.984 587 HG1 THR 72 HG1 THR 72 0.301 6.092 5.597 588 HG21 THR 72 HG21 THR 72 -3.295 5.646 5.809 589 HG22 THR 72 HG22 THR 72 -3.528 6.357 4.209 590 HG23 THR 72 HG23 THR 72 -2.897 7.341 5.530 591 H SER 73 HN SER 73 -0.338 2.264 3.484 592 HA SER 73 HA SER 73 2.160 3.361 2.366 593 HB2 SER 73 HB2 SER 73 1.968 0.909 4.186 594 HB3 SER 73 HB1 SER 73 3.435 1.510 3.405 595 HG SER 73 HG SER 73 2.420 3.548 4.735 596 H ARG 74 HN ARG 74 2.944 2.222 0.562 597 HA ARG 74 HA ARG 74 1.311 -0.051 -0.419 598 HB2 ARG 74 HB2 ARG 74 2.951 1.911 -2.075 599 HB3 ARG 74 HB1 ARG 74 2.069 0.514 -2.698 600 HG2 ARG 74 HG2 ARG 74 -0.059 1.579 -1.844 601 HG3 ARG 74 HG1 ARG 74 0.893 3.011 -1.439 602 HD2 ARG 74 HD2 ARG 74 0.401 1.839 -4.195 603 HD3 ARG 74 HD1 ARG 74 -0.150 3.396 -3.569 604 HE ARG 74 HE ARG 74 2.726 3.118 -3.604 605 HH11 ARG 74 HH11 ARG 74 -0.055 4.231 -5.429 606 HH12 ARG 74 HH12 ARG 74 0.906 5.091 -6.588 607 HH21 ARG 74 HH21 ARG 74 3.959 4.246 -5.112 608 HH22 ARG 74 HH22 ARG 74 3.181 5.089 -6.410 609 H ILE 75 HN ILE 75 2.292 -1.877 -0.427 610 HA ILE 75 HA ILE 75 5.063 -2.130 0.389 611 HB ILE 75 HB ILE 75 2.997 -4.336 -0.034 612 HG12 ILE 75 HG12 ILE 75 1.974 -2.657 1.466 613 HG13 ILE 75 HG11 ILE 75 2.346 -4.131 2.343 614 HG21 ILE 75 HG21 ILE 75 4.295 -5.558 1.655 615 HG22 ILE 75 HG22 ILE 75 5.423 -4.203 1.768 616 HG23 ILE 75 HG23 ILE 75 5.285 -5.112 0.262 617 HD11 ILE 75 HD11 ILE 75 4.297 -3.051 3.328 618 HD12 ILE 75 HD12 ILE 75 2.816 -2.159 3.653 619 HD13 ILE 75 HD13 ILE 75 3.940 -1.573 2.429 620 H LYS 76 HN LYS 76 6.267 -1.714 -1.525 621 HA LYS 76 HA LYS 76 5.602 -3.158 -4.013 622 HB2 LYS 76 HB2 LYS 76 6.172 -0.741 -4.205 623 HB3 LYS 76 HB1 LYS 76 7.764 -1.052 -3.517 624 HG2 LYS 76 HG2 LYS 76 8.288 -2.538 -5.458 625 HG3 LYS 76 HG1 LYS 76 6.708 -2.167 -6.141 626 HD2 LYS 76 HD2 LYS 76 8.395 -0.842 -7.263 627 HD3 LYS 76 HD1 LYS 76 7.361 0.225 -6.312 628 HE2 LYS 76 HE2 LYS 76 9.062 0.459 -4.603 629 HE3 LYS 76 HE1 LYS 76 10.060 -0.785 -5.354 630 HZ1 LYS 76 HZ1 LYS 76 9.393 1.849 -6.502 631 HZ2 LYS 76 HZ2 LYS 76 10.293 0.650 -7.290 632 HZ3 LYS 76 HZ3 LYS 76 10.884 1.373 -5.877 633 H VAL 77 HN VAL 77 6.570 -5.092 -4.415 634 HA VAL 77 HA VAL 77 8.622 -6.125 -2.694 635 HB VAL 77 HB VAL 77 7.469 -7.276 -5.271 636 HG11 VAL 77 HG11 VAL 77 9.699 -8.263 -4.836 637 HG12 VAL 77 HG12 VAL 77 8.424 -9.451 -4.566 638 HG13 VAL 77 HG13 VAL 77 9.200 -8.666 -3.189 639 HG21 VAL 77 HG21 VAL 77 6.116 -8.700 -3.814 640 HG22 VAL 77 HG22 VAL 77 5.822 -7.004 -3.424 641 HG23 VAL 77 HG23 VAL 77 6.854 -7.980 -2.383 642 H SER 78 HN SER 78 10.706 -5.821 -2.871 643 HA SER 78 HA SER 78 11.984 -4.621 -5.205 644 HB2 SER 78 HB2 SER 78 13.029 -5.354 -2.423 645 HB3 SER 78 HB1 SER 78 13.950 -4.473 -3.647 646 HG SER 78 HG SER 78 11.934 -3.030 -3.551 647 H THR 79 HN THR 79 11.595 -7.613 -3.581 648 HA THR 79 HA THR 79 13.649 -9.024 -5.128 649 HB THR 79 HB THR 79 13.505 -8.945 -2.069 650 HG1 THR 79 HG1 THR 79 15.161 -7.631 -3.926 651 HG21 THR 79 HG21 THR 79 14.239 -11.125 -2.913 652 HG22 THR 79 HG22 THR 79 15.552 -10.260 -2.105 653 HG23 THR 79 HG23 THR 79 15.488 -10.333 -3.866 654 H GLY 80 HN GLY 80 12.337 -10.618 -6.026 655 HA2 GLY 80 HA2 GLY 80 11.367 -12.819 -4.876 656 HA3 GLY 80 HA1 GLY 80 10.071 -11.698 -4.490 657 HA PRO 81 HA PRO 81 9.140 -13.650 -8.672 658 HB2 PRO 81 HB2 PRO 81 6.595 -14.504 -8.054 659 HB3 PRO 81 HB1 PRO 81 8.036 -15.478 -7.735 660 HG2 PRO 81 HG2 PRO 81 6.487 -13.714 -5.831 661 HG3 PRO 81 HG1 PRO 81 7.106 -15.360 -5.567 662 HD2 PRO 81 HD2 PRO 81 8.400 -13.167 -4.629 663 HD3 PRO 81 HD1 PRO 81 9.287 -14.609 -5.172 664 H LEU 82 HN LEU 82 7.404 -11.501 -6.487 665 HA LEU 82 HA LEU 82 5.995 -10.137 -8.691 666 HB2 LEU 82 HB2 LEU 82 5.754 -9.802 -5.678 667 HB3 LEU 82 HB1 LEU 82 4.770 -8.970 -6.875 668 HG LEU 82 HG LEU 82 4.759 -11.962 -6.288 669 HD11 LEU 82 HD11 LEU 82 3.634 -10.612 -4.584 670 HD12 LEU 82 HD12 LEU 82 2.474 -11.564 -5.497 671 HD13 LEU 82 HD13 LEU 82 2.636 -9.837 -5.819 672 HD21 LEU 82 HD21 LEU 82 2.906 -12.134 -7.911 673 HD22 LEU 82 HD22 LEU 82 4.399 -11.619 -8.690 674 HD23 LEU 82 HD23 LEU 82 3.127 -10.438 -8.361 675 H ALA 83 HN ALA 83 8.991 -9.954 -8.027 676 HA ALA 83 HA ALA 83 9.634 -7.422 -6.997 677 HB1 ALA 83 HB1 ALA 83 11.296 -9.207 -7.293 678 HB2 ALA 83 HB2 ALA 83 11.818 -7.714 -8.080 679 HB3 ALA 83 HB3 ALA 83 11.177 -9.047 -9.050 680 H GLY 84 HN GLY 84 9.352 -5.427 -7.781 681 HA2 GLY 84 HA2 GLY 84 9.517 -3.778 -9.520 682 HA3 GLY 84 HA1 GLY 84 8.987 -4.968 -10.701 683 H ARG 85 HN ARG 85 6.899 -5.811 -8.560 684 HA ARG 85 HA ARG 85 4.782 -3.998 -9.484 685 HB2 ARG 85 HB2 ARG 85 4.633 -6.599 -7.880 686 HB3 ARG 85 HB1 ARG 85 3.237 -5.669 -8.434 687 HG2 ARG 85 HG2 ARG 85 3.858 -6.080 -10.773 688 HG3 ARG 85 HG1 ARG 85 5.303 -6.958 -10.252 689 HD2 ARG 85 HD2 ARG 85 3.957 -8.702 -9.257 690 HD3 ARG 85 HD1 ARG 85 2.473 -7.781 -9.514 691 HE ARG 85 HE ARG 85 4.021 -8.519 -11.886 692 HH11 ARG 85 HH11 ARG 85 1.280 -9.275 -9.836 693 HH12 ARG 85 HH12 ARG 85 0.444 -10.163 -11.068 694 HH21 ARG 85 HH21 ARG 85 2.938 -9.671 -13.504 695 HH22 ARG 85 HH22 ARG 85 1.391 -10.379 -13.177 696 H VAL 86 HN VAL 86 3.489 -2.772 -8.144 697 HA VAL 86 HA VAL 86 4.426 -2.351 -5.371 698 HB VAL 86 HB VAL 86 4.740 -0.346 -6.704 699 HG11 VAL 86 HG11 VAL 86 1.774 -0.389 -7.346 700 HG12 VAL 86 HG12 VAL 86 3.088 -0.697 -8.478 701 HG13 VAL 86 HG13 VAL 86 2.897 0.909 -7.770 702 HG21 VAL 86 HG21 VAL 86 2.412 0.005 -4.779 703 HG22 VAL 86 HG22 VAL 86 3.475 1.298 -5.341 704 HG23 VAL 86 HG23 VAL 86 4.125 -0.012 -4.354 705 H LEU 87 HN LEU 87 3.290 -3.637 -4.175 706 HA LEU 87 HA LEU 87 0.504 -4.277 -4.624 707 HB2 LEU 87 HB2 LEU 87 2.357 -5.165 -2.372 708 HB3 LEU 87 HB1 LEU 87 0.746 -5.785 -2.682 709 HG LEU 87 HG LEU 87 2.299 -7.419 -3.465 710 HD11 LEU 87 HD11 LEU 87 0.325 -7.106 -4.843 711 HD12 LEU 87 HD12 LEU 87 1.698 -7.657 -5.798 712 HD13 LEU 87 HD13 LEU 87 1.194 -5.966 -5.872 713 HD21 LEU 87 HD21 LEU 87 4.292 -5.993 -3.710 714 HD22 LEU 87 HD22 LEU 87 3.643 -5.348 -5.219 715 HD23 LEU 87 HD23 LEU 87 4.045 -7.064 -5.089 716 H ASN 88 HN ASN 88 -1.039 -2.991 -3.938 717 HA ASN 88 HA ASN 88 -0.648 -0.959 -1.892 718 HB2 ASN 88 HB2 ASN 88 -3.038 -1.634 -3.675 719 HB3 ASN 88 HB1 ASN 88 -3.004 -0.293 -2.540 720 HD21 ASN 88 HD21 ASN 88 -0.337 -1.303 -4.717 721 HD22 ASN 88 HD22 ASN 88 -0.363 0.135 -5.657 722 H ILE 89 HN ILE 89 -1.805 -0.921 0.136 723 HA ILE 89 HA ILE 89 -2.405 -3.589 1.163 724 HB ILE 89 HB ILE 89 -2.418 -0.894 2.623 725 HG12 ILE 89 HG12 ILE 89 -0.308 -3.102 2.613 726 HG13 ILE 89 HG11 ILE 89 -0.150 -1.527 1.843 727 HG21 ILE 89 HG21 ILE 89 -2.599 -3.717 3.780 728 HG22 ILE 89 HG22 ILE 89 -3.902 -2.526 3.744 729 HG23 ILE 89 HG23 ILE 89 -2.468 -2.228 4.725 730 HD11 ILE 89 HD11 ILE 89 -0.365 -2.047 4.815 731 HD12 ILE 89 HD12 ILE 89 -0.241 -0.453 4.060 732 HD13 ILE 89 HD13 ILE 89 1.088 -1.601 3.920 733 H ILE 90 HN ILE 90 -4.357 -4.319 0.688 734 HA ILE 90 HA ILE 90 -6.697 -2.546 0.520 735 HB ILE 90 HB ILE 90 -7.874 -4.674 -0.308 736 HG12 ILE 90 HG12 ILE 90 -5.022 -5.760 -0.580 737 HG13 ILE 90 HG11 ILE 90 -6.150 -6.295 0.651 738 HG21 ILE 90 HG21 ILE 90 -7.126 -2.881 -1.816 739 HG22 ILE 90 HG22 ILE 90 -6.942 -4.456 -2.586 740 HG23 ILE 90 HG23 ILE 90 -5.528 -3.624 -1.936 741 HD11 ILE 90 HD11 ILE 90 -6.551 -6.600 -2.320 742 HD12 ILE 90 HD12 ILE 90 -7.621 -7.199 -1.050 743 HD13 ILE 90 HD13 ILE 90 -5.991 -7.850 -1.213 744 H GLY 91 HN GLY 91 -6.152 -2.296 2.905 745 HA2 GLY 91 HA2 GLY 91 -8.169 -2.950 4.540 746 HA3 GLY 91 HA1 GLY 91 -7.112 -4.353 4.721 747 H GLN 92 HN GLN 92 -5.798 -4.189 6.406 748 HA GLN 92 HA GLN 92 -4.310 -1.761 7.014 749 HB2 GLN 92 HB2 GLN 92 -5.026 -1.778 9.423 750 HB3 GLN 92 HB1 GLN 92 -6.342 -1.375 8.325 751 HG2 GLN 92 HG2 GLN 92 -7.219 -3.670 8.514 752 HG3 GLN 92 HG1 GLN 92 -5.883 -4.103 9.575 753 HE21 GLN 92 HE21 GLN 92 -7.618 -1.027 9.773 754 HE22 GLN 92 HE22 GLN 92 -8.369 -1.351 11.294 755 HA PRO 93 HA PRO 93 -1.210 -4.908 7.917 756 HB2 PRO 93 HB2 PRO 93 0.352 -3.508 9.750 757 HB3 PRO 93 HB1 PRO 93 0.438 -3.279 7.998 758 HG2 PRO 93 HG2 PRO 93 -1.086 -1.683 10.042 759 HG3 PRO 93 HG1 PRO 93 -0.072 -1.098 8.703 760 HD2 PRO 93 HD2 PRO 93 -2.742 -1.135 8.482 761 HD3 PRO 93 HD1 PRO 93 -1.729 -1.581 7.091 762 H LEU 94 HN LEU 94 -1.806 -6.626 9.082 763 HA LEU 94 HA LEU 94 -3.075 -6.308 11.745 764 HB2 LEU 94 HB2 LEU 94 -4.426 -6.987 9.508 765 HB3 LEU 94 HB1 LEU 94 -3.795 -8.573 9.862 766 HG LEU 94 HG LEU 94 -6.104 -8.300 10.663 767 HD11 LEU 94 HD11 LEU 94 -5.868 -9.139 12.929 768 HD12 LEU 94 HD12 LEU 94 -4.189 -8.595 12.982 769 HD13 LEU 94 HD13 LEU 94 -4.670 -9.869 11.859 770 HD21 LEU 94 HD21 LEU 94 -6.089 -5.892 11.092 771 HD22 LEU 94 HD22 LEU 94 -5.034 -6.127 12.489 772 HD23 LEU 94 HD23 LEU 94 -6.675 -6.778 12.498 773 HA PRO 95 HA PRO 95 0.442 -9.105 12.834 774 HB2 PRO 95 HB2 PRO 95 -0.164 -9.341 15.519 775 HB3 PRO 95 HB1 PRO 95 0.682 -7.951 14.820 776 HG2 PRO 95 HG2 PRO 95 -2.255 -8.235 15.478 777 HG3 PRO 95 HG1 PRO 95 -1.154 -6.890 15.850 778 HD2 PRO 95 HD2 PRO 95 -2.844 -6.767 13.745 779 HD3 PRO 95 HD1 PRO 95 -1.205 -6.068 13.640 780 H ASP 96 HN ASP 96 0.636 -11.324 13.538 781 HA ASP 96 HA ASP 96 -1.612 -12.984 12.768 782 HB2 ASP 96 HB2 ASP 96 -0.084 -14.829 12.869 783 HB3 ASP 96 HB1 ASP 96 0.789 -13.475 12.157 784 H ALA 97 HN ALA 97 -1.589 -15.182 14.308 785 HA ALA 97 HA ALA 97 -3.022 -14.466 16.662 786 HB1 ALA 97 HB1 ALA 97 -3.211 -16.890 17.031 787 HB2 ALA 97 HB2 ALA 97 -1.987 -17.183 15.792 788 HB3 ALA 97 HB3 ALA 97 -3.541 -16.478 15.344 789 H ALA 98 HN ALA 98 0.208 -15.907 16.149 790 HA ALA 98 HA ALA 98 0.790 -16.175 18.981 791 HB1 ALA 98 HB1 ALA 98 2.594 -16.592 16.566 792 HB2 ALA 98 HB2 ALA 98 1.605 -17.833 17.335 793 HB3 ALA 98 HB3 ALA 98 2.942 -17.103 18.222 794 H ARG 99 HN ARG 99 0.981 -13.574 16.829 795 HA ARG 99 HA ARG 99 1.688 -11.439 16.988 796 HB2 ARG 99 HB2 ARG 99 1.298 -11.997 19.595 797 HB3 ARG 99 HB1 ARG 99 3.037 -11.810 19.667 798 HG2 ARG 99 HG2 ARG 99 2.103 -9.698 20.269 799 HG3 ARG 99 HG1 ARG 99 2.746 -9.510 18.632 800 HD2 ARG 99 HD2 ARG 99 0.495 -9.752 17.690 801 HD3 ARG 99 HD1 ARG 99 -0.175 -10.035 19.303 802 HE ARG 99 HE ARG 99 1.237 -7.534 19.107 803 HH11 ARG 99 HH11 ARG 99 -1.890 -9.027 18.536 804 HH12 ARG 99 HH12 ARG 99 -2.739 -7.520 18.586 805 HH21 ARG 99 HH21 ARG 99 0.121 -5.593 19.171 806 HH22 ARG 99 HH22 ARG 99 -1.601 -5.562 18.949 807 H THR 100 HN THR 100 3.427 -13.798 16.168 808 HA THR 100 HA THR 100 6.182 -12.997 16.708 809 HB THR 100 HB THR 100 5.506 -15.402 16.749 810 HG1 THR 100 HG1 THR 100 7.244 -16.131 15.281 811 HG21 THR 100 HG21 THR 100 5.123 -15.097 13.749 812 HG22 THR 100 HG22 THR 100 3.847 -15.414 14.923 813 HG23 THR 100 HG23 THR 100 5.098 -16.624 14.642 814 H ARG 101 HN ARG 101 3.956 -11.885 14.560 815 HA ARG 101 HA ARG 101 5.848 -10.767 12.725 816 HB2 ARG 101 HB2 ARG 101 4.800 -11.782 10.630 817 HB3 ARG 101 HB1 ARG 101 5.794 -12.894 11.563 818 HG2 ARG 101 HG2 ARG 101 3.983 -14.171 12.260 819 HG3 ARG 101 HG1 ARG 101 2.838 -12.843 12.087 820 HD2 ARG 101 HD2 ARG 101 2.843 -13.106 9.671 821 HD3 ARG 101 HD1 ARG 101 4.090 -14.360 9.773 822 HE ARG 101 HE ARG 101 1.277 -14.671 10.167 823 HH11 ARG 101 HH11 ARG 101 4.355 -15.988 11.297 824 HH12 ARG 101 HH12 ARG 101 3.659 -17.498 11.783 825 HH21 ARG 101 HH21 ARG 101 0.402 -16.642 10.817 826 HH22 ARG 101 HH22 ARG 101 1.422 -17.876 11.492 827 H LEU 102 HN LEU 102 4.862 -9.312 11.256 828 HA LEU 102 HA LEU 102 2.102 -8.463 11.841 829 HB2 LEU 102 HB2 LEU 102 4.445 -6.961 11.753 830 HB3 LEU 102 HB1 LEU 102 3.882 -6.771 10.109 831 HG LEU 102 HG LEU 102 3.119 -4.885 11.351 832 HD11 LEU 102 HD11 LEU 102 0.763 -6.746 11.014 833 HD12 LEU 102 HD12 LEU 102 1.510 -5.762 9.756 834 HD13 LEU 102 HD13 LEU 102 0.708 -4.982 11.115 835 HD21 LEU 102 HD21 LEU 102 3.348 -5.765 13.620 836 HD22 LEU 102 HD22 LEU 102 1.912 -6.771 13.403 837 HD23 LEU 102 HD23 LEU 102 1.770 -5.010 13.395 838 H GLU 103 HN GLU 103 0.726 -9.455 10.458 839 HA GLU 103 HA GLU 103 1.638 -10.367 7.830 840 HB2 GLU 103 HB2 GLU 103 0.352 -11.921 9.336 841 HB3 GLU 103 HB1 GLU 103 -1.052 -10.858 9.178 842 HG2 GLU 103 HG2 GLU 103 -1.107 -11.277 6.753 843 HG3 GLU 103 HG1 GLU 103 0.319 -12.309 6.884 844 H ILE 104 HN ILE 104 1.562 -8.869 6.311 845 HA ILE 104 HA ILE 104 -0.484 -6.803 6.198 846 HB ILE 104 HB ILE 104 1.678 -7.252 4.090 847 HG12 ILE 104 HG12 ILE 104 2.879 -7.223 6.266 848 HG13 ILE 104 HG11 ILE 104 3.243 -5.782 5.328 849 HG21 ILE 104 HG21 ILE 104 -0.048 -5.620 3.522 850 HG22 ILE 104 HG22 ILE 104 1.487 -4.794 3.780 851 HG23 ILE 104 HG23 ILE 104 0.240 -4.740 5.025 852 HD11 ILE 104 HD11 ILE 104 1.347 -5.957 7.662 853 HD12 ILE 104 HD12 ILE 104 1.698 -4.500 6.724 854 HD13 ILE 104 HD13 ILE 104 2.972 -5.271 7.669 855 H LEU 105 HN LEU 105 -2.042 -6.682 4.548 856 HA LEU 105 HA LEU 105 -2.263 -8.912 2.613 857 HB2 LEU 105 HB2 LEU 105 -4.692 -8.764 2.695 858 HB3 LEU 105 HB1 LEU 105 -4.078 -9.081 4.303 859 HG LEU 105 HG LEU 105 -5.023 -6.334 3.362 860 HD11 LEU 105 HD11 LEU 105 -7.069 -6.705 4.630 861 HD12 LEU 105 HD12 LEU 105 -6.558 -8.349 5.024 862 HD13 LEU 105 HD13 LEU 105 -6.898 -7.903 3.349 863 HD21 LEU 105 HD21 LEU 105 -3.438 -6.196 5.231 864 HD22 LEU 105 HD22 LEU 105 -4.416 -7.323 6.172 865 HD23 LEU 105 HD23 LEU 105 -5.060 -5.734 5.747 866 H CYS 106 HN CYS 106 -2.621 -8.306 0.534 867 HA CYS 106 HA CYS 106 -2.835 -5.538 -0.277 868 HB2 CYS 106 HB2 CYS 106 -0.186 -6.981 -0.775 869 HB3 CYS 106 HB1 CYS 106 -0.619 -5.369 -1.324 870 HG CYS 106 HG CYS 106 -0.995 -4.795 1.654 871 H ARG 107 HN ARG 107 -2.432 -5.343 -2.675 872 HA ARG 107 HA ARG 107 -2.229 -7.665 -4.353 873 HB2 ARG 107 HB2 ARG 107 -4.330 -7.424 -5.567 874 HB3 ARG 107 HB1 ARG 107 -4.706 -7.651 -3.862 875 HG2 ARG 107 HG2 ARG 107 -5.100 -5.231 -3.607 876 HG3 ARG 107 HG1 ARG 107 -4.682 -4.970 -5.301 877 HD2 ARG 107 HD2 ARG 107 -7.048 -6.580 -4.279 878 HD3 ARG 107 HD1 ARG 107 -7.112 -4.953 -4.959 879 HE ARG 107 HE ARG 107 -6.313 -5.916 -7.083 880 HH11 ARG 107 HH11 ARG 107 -7.730 -8.140 -4.763 881 HH12 ARG 107 HH12 ARG 107 -8.272 -9.243 -5.983 882 HH21 ARG 107 HH21 ARG 107 -7.051 -7.349 -8.650 883 HH22 ARG 107 HH22 ARG 107 -7.901 -8.792 -8.191 884 H GLU 108 HN GLU 108 -2.163 -6.933 -6.668 885 HA GLU 108 HA GLU 108 -0.746 -4.458 -7.031 886 HB2 GLU 108 HB2 GLU 108 -1.890 -6.324 -9.158 887 HB3 GLU 108 HB1 GLU 108 -0.774 -5.008 -9.448 888 HG2 GLU 108 HG2 GLU 108 0.614 -6.865 -9.550 889 HG3 GLU 108 HG1 GLU 108 0.860 -6.302 -7.906 890 H GLY 109 HN GLY 109 -1.467 -2.645 -8.271 891 HA2 GLY 109 HA2 GLY 109 -4.397 -2.343 -8.635 892 HA3 GLY 109 HA1 GLY 109 -3.215 -1.037 -8.611 893 H ALA 110 HN ALA 110 -2.602 -4.007 -10.307 894 HA ALA 110 HA ALA 110 -3.491 -3.379 -12.913 895 HB1 ALA 110 HB1 ALA 110 -1.744 -1.612 -12.809 896 HB2 ALA 110 HB2 ALA 110 -1.316 -2.844 -13.998 897 HB3 ALA 110 HB3 ALA 110 -0.527 -2.829 -12.419 898 H GLU 111 HN GLU 111 -3.450 -5.508 -11.049 899 HA GLU 111 HA GLU 111 -1.633 -7.591 -11.555 900 HB2 GLU 111 HB2 GLU 111 -3.241 -9.066 -10.466 901 HB3 GLU 111 HB1 GLU 111 -3.170 -7.537 -9.602 902 HG2 GLU 111 HG2 GLU 111 -5.355 -8.299 -11.570 903 HG3 GLU 111 HG1 GLU 111 -5.475 -8.514 -9.831 904 H LYS 112 HN LYS 112 -4.170 -6.382 -13.481 905 HA LYS 112 HA LYS 112 -4.878 -8.559 -15.095 906 HB2 LYS 112 HB2 LYS 112 -4.704 -5.630 -15.934 907 HB3 LYS 112 HB1 LYS 112 -5.701 -6.878 -16.681 908 HG2 LYS 112 HG2 LYS 112 -7.082 -7.037 -14.684 909 HG3 LYS 112 HG1 LYS 112 -6.024 -5.918 -13.823 910 HD2 LYS 112 HD2 LYS 112 -6.643 -4.151 -15.519 911 HD3 LYS 112 HD1 LYS 112 -7.829 -5.282 -16.186 912 HE2 LYS 112 HE2 LYS 112 -9.003 -5.345 -14.017 913 HE3 LYS 112 HE1 LYS 112 -7.796 -4.265 -13.315 914 HZ1 LYS 112 HZ1 LYS 112 -8.478 -2.560 -14.864 915 HZ2 LYS 112 HZ2 LYS 112 -9.801 -3.096 -13.956 916 HZ3 LYS 112 HZ3 LYS 112 -9.611 -3.600 -15.555 Start of MODEL 11 1 H1 MET 1 HT1 MET 1 21.818 -20.882 12.738 2 H2 MET 1 HT2 MET 1 21.227 -22.081 11.706 3 H3 MET 1 HT3 MET 1 22.757 -22.245 12.402 4 HA MET 1 HA MET 1 21.104 -23.657 13.457 5 HB2 MET 1 HB2 MET 1 21.652 -23.051 15.792 6 HB3 MET 1 HB1 MET 1 23.057 -22.895 14.748 7 HG2 MET 1 HG2 MET 1 22.713 -20.445 14.669 8 HG3 MET 1 HG1 MET 1 21.336 -20.612 15.754 9 HE1 MET 1 HE1 MET 1 22.430 -22.881 17.809 10 HE2 MET 1 HE2 MET 1 21.563 -21.427 18.308 11 HE3 MET 1 HE3 MET 1 23.099 -21.840 19.066 12 H ASN 2 HN ASN 2 19.926 -20.672 12.605 13 HA ASN 2 HA ASN 2 17.333 -21.148 13.904 14 HB2 ASN 2 HB2 ASN 2 18.609 -19.476 15.323 15 HB3 ASN 2 HB1 ASN 2 18.718 -18.413 13.923 16 HD21 ASN 2 HD21 ASN 2 17.545 -16.744 14.842 17 HD22 ASN 2 HD22 ASN 2 15.857 -16.839 15.195 18 H ILE 3 HN ILE 3 15.779 -21.041 12.375 19 HA ILE 3 HA ILE 3 16.202 -20.253 9.688 20 HB ILE 3 HB ILE 3 13.549 -20.547 11.191 21 HG12 ILE 3 HG12 ILE 3 15.050 -22.596 9.495 22 HG13 ILE 3 HG11 ILE 3 14.885 -22.639 11.248 23 HG21 ILE 3 HG21 ILE 3 14.041 -20.551 8.191 24 HG22 ILE 3 HG22 ILE 3 13.263 -19.260 9.108 25 HG23 ILE 3 HG23 ILE 3 12.490 -20.839 8.985 26 HD11 ILE 3 HD11 ILE 3 12.654 -22.938 9.232 27 HD12 ILE 3 HD12 ILE 3 12.447 -22.918 10.986 28 HD13 ILE 3 HD13 ILE 3 13.373 -24.207 10.222 29 H GLY 4 HN GLY 4 16.115 -18.235 8.763 30 HA2 GLY 4 HA2 GLY 4 15.634 -15.885 10.421 31 HA3 GLY 4 HA1 GLY 4 16.182 -15.917 8.753 32 H ARG 5 HN ARG 5 13.357 -17.741 9.472 33 HA ARG 5 HA ARG 5 11.193 -17.678 8.979 34 HB2 ARG 5 HB2 ARG 5 11.615 -14.834 9.921 35 HB3 ARG 5 HB1 ARG 5 10.039 -15.308 9.307 36 HG2 ARG 5 HG2 ARG 5 10.030 -15.475 11.719 37 HG3 ARG 5 HG1 ARG 5 9.908 -17.088 11.023 38 HD2 ARG 5 HD2 ARG 5 12.337 -17.424 11.448 39 HD3 ARG 5 HD1 ARG 5 12.401 -15.832 12.216 40 HE ARG 5 HE ARG 5 10.389 -17.221 13.506 41 HH11 ARG 5 HH11 ARG 5 13.866 -17.531 13.200 42 HH12 ARG 5 HH12 ARG 5 14.013 -18.497 14.629 43 HH21 ARG 5 HH21 ARG 5 10.618 -18.473 15.378 44 HH22 ARG 5 HH22 ARG 5 12.198 -18.995 15.875 45 H LEU 6 HN LEU 6 12.161 -14.551 7.584 46 HA LEU 6 HA LEU 6 10.383 -14.794 5.371 47 HB2 LEU 6 HB2 LEU 6 12.469 -12.665 5.983 48 HB3 LEU 6 HB1 LEU 6 11.186 -12.529 4.801 49 HG LEU 6 HG LEU 6 10.341 -11.242 6.546 50 HD11 LEU 6 HD11 LEU 6 8.663 -12.890 5.919 51 HD12 LEU 6 HD12 LEU 6 8.486 -12.378 7.597 52 HD13 LEU 6 HD13 LEU 6 9.196 -13.952 7.228 53 HD21 LEU 6 HD21 LEU 6 12.103 -11.645 8.173 54 HD22 LEU 6 HD22 LEU 6 11.393 -13.203 8.600 55 HD23 LEU 6 HD23 LEU 6 10.518 -11.707 8.945 56 H ARG 7 HN ARG 7 11.151 -14.279 3.117 57 HA ARG 7 HA ARG 7 13.657 -15.731 2.414 58 HB2 ARG 7 HB2 ARG 7 12.444 -16.845 0.564 59 HB3 ARG 7 HB1 ARG 7 11.727 -17.257 2.118 60 HG2 ARG 7 HG2 ARG 7 9.865 -15.767 1.736 61 HG3 ARG 7 HG1 ARG 7 10.636 -15.089 0.307 62 HD2 ARG 7 HD2 ARG 7 10.481 -17.421 -0.730 63 HD3 ARG 7 HD1 ARG 7 9.419 -17.849 0.620 64 HE ARG 7 HE ARG 7 8.338 -15.540 -0.366 65 HH11 ARG 7 HH11 ARG 7 9.068 -18.637 -1.860 66 HH12 ARG 7 HH12 ARG 7 7.846 -18.461 -3.075 67 HH21 ARG 7 HH21 ARG 7 6.831 -15.288 -2.010 68 HH22 ARG 7 HH22 ARG 7 6.606 -16.544 -3.183 69 H ASP 8 HN ASP 8 11.386 -13.198 1.634 70 HA ASP 8 HA ASP 8 12.850 -12.246 -0.738 71 HB2 ASP 8 HB2 ASP 8 9.976 -11.640 0.123 72 HB3 ASP 8 HB1 ASP 8 10.726 -11.136 -1.385 73 H ARG 9 HN ARG 9 11.920 -9.661 -0.837 74 HA ARG 9 HA ARG 9 12.208 -8.278 1.725 75 HB2 ARG 9 HB2 ARG 9 14.579 -8.657 0.731 76 HB3 ARG 9 HB1 ARG 9 14.103 -7.570 -0.566 77 HG2 ARG 9 HG2 ARG 9 13.656 -5.817 1.222 78 HG3 ARG 9 HG1 ARG 9 14.412 -6.918 2.378 79 HD2 ARG 9 HD2 ARG 9 15.698 -5.671 -0.065 80 HD3 ARG 9 HD1 ARG 9 16.043 -5.274 1.618 81 HE ARG 9 HE ARG 9 16.537 -8.008 1.202 82 HH11 ARG 9 HH11 ARG 9 17.913 -4.920 0.250 83 HH12 ARG 9 HH12 ARG 9 19.511 -5.564 0.075 84 HH21 ARG 9 HH21 ARG 9 18.624 -8.817 0.943 85 HH22 ARG 9 HH22 ARG 9 19.907 -7.755 0.469 86 H ILE 10 HN ILE 10 11.192 -6.260 1.678 87 HA ILE 10 HA ILE 10 10.115 -5.226 -0.875 88 HB ILE 10 HB ILE 10 7.911 -4.875 -0.058 89 HG12 ILE 10 HG12 ILE 10 8.265 -4.098 2.217 90 HG13 ILE 10 HG11 ILE 10 7.100 -5.402 2.256 91 HG21 ILE 10 HG21 ILE 10 7.040 -7.121 0.505 92 HG22 ILE 10 HG22 ILE 10 8.690 -7.668 0.808 93 HG23 ILE 10 HG23 ILE 10 8.218 -7.159 -0.813 94 HD11 ILE 10 HD11 ILE 10 9.959 -5.449 3.176 95 HD12 ILE 10 HD12 ILE 10 8.959 -6.888 3.042 96 HD13 ILE 10 HD13 ILE 10 8.495 -5.601 4.147 97 H THR 11 HN THR 11 9.626 -2.994 -0.828 98 HA THR 11 HA THR 11 10.870 -1.370 1.280 99 HB THR 11 HB THR 11 9.959 -0.533 -1.516 100 HG1 THR 11 HG1 THR 11 11.925 -2.014 -1.097 101 HG21 THR 11 HG21 THR 11 11.629 0.967 0.537 102 HG22 THR 11 HG22 THR 11 9.958 1.344 0.100 103 HG23 THR 11 HG23 THR 11 11.247 1.526 -1.092 104 H ILE 12 HN ILE 12 9.526 -0.539 2.724 105 HA ILE 12 HA ILE 12 6.650 -0.364 2.419 106 HB ILE 12 HB ILE 12 8.368 0.857 4.642 107 HG12 ILE 12 HG12 ILE 12 8.885 -1.548 4.534 108 HG13 ILE 12 HG11 ILE 12 7.939 -1.199 5.975 109 HG21 ILE 12 HG21 ILE 12 6.076 1.731 4.574 110 HG22 ILE 12 HG22 ILE 12 6.311 0.734 6.008 111 HG23 ILE 12 HG23 ILE 12 5.422 0.091 4.626 112 HD11 ILE 12 HD11 ILE 12 7.249 -3.265 4.963 113 HD12 ILE 12 HD12 ILE 12 6.918 -2.460 3.430 114 HD13 ILE 12 HD13 ILE 12 5.940 -2.089 4.856 115 H GLN 13 HN GLN 13 5.862 1.208 1.129 116 HA GLN 13 HA GLN 13 7.297 3.694 0.669 117 HB2 GLN 13 HB2 GLN 13 4.803 2.533 -0.625 118 HB3 GLN 13 HB1 GLN 13 5.436 4.140 -1.004 119 HG2 GLN 13 HG2 GLN 13 7.611 3.045 -1.640 120 HG3 GLN 13 HG1 GLN 13 6.822 1.475 -1.440 121 HE21 GLN 13 HE21 GLN 13 7.963 2.866 -3.812 122 HE22 GLN 13 HE22 GLN 13 6.702 2.844 -4.994 123 H THR 14 HN THR 14 7.059 5.209 1.952 124 HA THR 14 HA THR 14 4.780 5.633 3.729 125 HB THR 14 HB THR 14 6.264 7.579 4.544 126 HG1 THR 14 HG1 THR 14 7.548 7.091 2.330 127 HG21 THR 14 HG21 THR 14 7.836 6.111 5.758 128 HG22 THR 14 HG22 THR 14 7.465 4.782 4.659 129 HG23 THR 14 HG23 THR 14 6.217 5.410 5.741 130 H LEU 15 HN LEU 15 3.412 7.450 3.640 131 HA LEU 15 HA LEU 15 3.244 8.834 1.061 132 HB2 LEU 15 HB2 LEU 15 1.243 7.590 1.804 133 HB3 LEU 15 HB1 LEU 15 1.222 8.486 3.312 134 HG LEU 15 HG LEU 15 0.711 10.578 2.094 135 HD11 LEU 15 HD11 LEU 15 0.669 8.878 -0.417 136 HD12 LEU 15 HD12 LEU 15 1.863 10.112 -0.008 137 HD13 LEU 15 HD13 LEU 15 0.194 10.571 -0.290 138 HD21 LEU 15 HD21 LEU 15 -1.154 9.204 2.912 139 HD22 LEU 15 HD22 LEU 15 -1.204 8.333 1.376 140 HD23 LEU 15 HD23 LEU 15 -1.589 10.056 1.431 141 H LYS 16 HN LYS 16 4.316 10.729 1.100 142 HA LYS 16 HA LYS 16 4.115 12.551 3.389 143 HB2 LYS 16 HB2 LYS 16 6.341 12.261 2.457 144 HB3 LYS 16 HB1 LYS 16 5.765 12.595 0.830 145 HG2 LYS 16 HG2 LYS 16 5.304 14.934 1.465 146 HG3 LYS 16 HG1 LYS 16 5.843 14.597 3.108 147 HD2 LYS 16 HD2 LYS 16 7.642 15.720 1.961 148 HD3 LYS 16 HD1 LYS 16 8.124 14.041 2.194 149 HE2 LYS 16 HE2 LYS 16 7.026 15.190 -0.399 150 HE3 LYS 16 HE1 LYS 16 8.734 14.951 -0.048 151 HZ1 LYS 16 HZ1 LYS 16 8.099 12.529 0.286 152 HZ2 LYS 16 HZ2 LYS 16 8.124 13.116 -1.294 153 HZ3 LYS 16 HZ3 LYS 16 6.647 12.914 -0.498 154 H GLN 17 HN GLN 17 2.312 13.721 3.379 155 HA GLN 17 HA GLN 17 1.009 14.698 0.967 156 HB2 GLN 17 HB2 GLN 17 0.445 15.023 3.938 157 HB3 GLN 17 HB1 GLN 17 -0.542 15.771 2.685 158 HG2 GLN 17 HG2 GLN 17 -1.207 13.586 1.841 159 HG3 GLN 17 HG1 GLN 17 -0.102 12.784 2.965 160 HE21 GLN 17 HE21 GLN 17 -3.060 14.688 2.724 161 HE22 GLN 17 HE22 GLN 17 -3.703 14.226 4.260 162 H THR 18 HN THR 18 2.238 16.246 -0.003 163 HA THR 18 HA THR 18 3.347 18.524 1.495 164 HB THR 18 HB THR 18 3.490 17.881 -1.499 165 HG1 THR 18 HG1 THR 18 5.123 17.101 0.693 166 HG21 THR 18 HG21 THR 18 5.488 19.357 -1.509 167 HG22 THR 18 HG22 THR 18 5.239 19.721 0.200 168 HG23 THR 18 HG23 THR 18 4.052 20.248 -0.995 169 H ARG 19 HN ARG 19 2.764 20.776 0.550 170 HA ARG 19 HA ARG 19 -0.053 20.841 -0.366 171 HB2 ARG 19 HB2 ARG 19 0.523 21.764 1.974 172 HB3 ARG 19 HB1 ARG 19 1.375 23.066 1.151 173 HG2 ARG 19 HG2 ARG 19 -0.728 23.790 0.085 174 HG3 ARG 19 HG1 ARG 19 -1.591 22.440 0.825 175 HD2 ARG 19 HD2 ARG 19 -2.025 24.502 2.057 176 HD3 ARG 19 HD1 ARG 19 -1.107 23.373 3.064 177 HE ARG 19 HE ARG 19 0.487 25.300 1.594 178 HH11 ARG 19 HH11 ARG 19 -1.162 24.698 4.632 179 HH12 ARG 19 HH12 ARG 19 -0.212 25.856 5.506 180 HH21 ARG 19 HH21 ARG 19 1.724 26.773 2.732 181 HH22 ARG 19 HH22 ARG 19 1.425 27.042 4.421 182 H ASP 20 HN ASP 20 -0.571 22.864 -1.613 183 HA ASP 20 HA ASP 20 1.556 23.507 -3.590 184 HB2 ASP 20 HB2 ASP 20 -0.537 22.269 -4.425 185 HB3 ASP 20 HB1 ASP 20 -1.481 23.673 -3.958 186 H ILE 21 HN ILE 21 1.522 25.795 -4.374 187 HA ILE 21 HA ILE 21 1.293 27.748 -2.431 188 HB ILE 21 HB ILE 21 2.660 27.828 -4.562 189 HG12 ILE 21 HG12 ILE 21 0.988 30.340 -4.044 190 HG13 ILE 21 HG11 ILE 21 2.383 29.848 -3.089 191 HG21 ILE 21 HG21 ILE 21 1.638 28.725 -6.618 192 HG22 ILE 21 HG22 ILE 21 0.047 28.697 -5.860 193 HG23 ILE 21 HG23 ILE 21 0.905 27.183 -6.167 194 HD11 ILE 21 HD11 ILE 21 2.400 30.642 -6.003 195 HD12 ILE 21 HD12 ILE 21 3.809 30.111 -5.079 196 HD13 ILE 21 HD13 ILE 21 2.975 31.599 -4.640 197 H THR 22 HN THR 22 -1.421 26.294 -4.029 198 HA THR 22 HA THR 22 -3.114 28.698 -3.773 199 HB THR 22 HB THR 22 -4.725 27.430 -5.243 200 HG1 THR 22 HG1 THR 22 -2.715 25.640 -6.008 201 HG21 THR 22 HG21 THR 22 -1.961 27.743 -6.475 202 HG22 THR 22 HG22 THR 22 -3.162 29.027 -6.308 203 HG23 THR 22 HG23 THR 22 -3.484 27.651 -7.364 204 H GLY 23 HN GLY 23 -2.205 25.768 -2.432 205 HA2 GLY 23 HA2 GLY 23 -2.715 25.334 -0.129 206 HA3 GLY 23 HA1 GLY 23 -4.332 25.955 -0.368 207 H GLU 24 HN GLU 24 -3.202 23.658 -2.786 208 HA GLU 24 HA GLU 24 -5.095 21.673 -1.761 209 HB2 GLU 24 HB2 GLU 24 -3.823 22.277 -4.438 210 HB3 GLU 24 HB1 GLU 24 -4.380 20.642 -4.123 211 HG2 GLU 24 HG2 GLU 24 -5.982 22.071 -5.382 212 HG3 GLU 24 HG1 GLU 24 -6.632 21.329 -3.928 213 H ILE 25 HN ILE 25 -4.432 19.537 -1.358 214 HA ILE 25 HA ILE 25 -1.634 19.234 -0.557 215 HB ILE 25 HB ILE 25 -4.073 17.503 0.042 216 HG12 ILE 25 HG12 ILE 25 -4.209 19.711 1.143 217 HG13 ILE 25 HG11 ILE 25 -3.911 18.460 2.343 218 HG21 ILE 25 HG21 ILE 25 -1.253 17.269 1.159 219 HG22 ILE 25 HG22 ILE 25 -2.066 16.112 0.104 220 HG23 ILE 25 HG23 ILE 25 -2.657 16.372 1.745 221 HD11 ILE 25 HD11 ILE 25 -1.530 19.112 2.400 222 HD12 ILE 25 HD12 ILE 25 -2.619 20.428 2.833 223 HD13 ILE 25 HD13 ILE 25 -1.876 20.398 1.238 224 H LEU 26 HN LEU 26 -0.223 18.167 -1.792 225 HA LEU 26 HA LEU 26 -1.055 16.279 -3.878 226 HB2 LEU 26 HB2 LEU 26 1.671 17.539 -3.317 227 HB3 LEU 26 HB1 LEU 26 1.341 16.398 -4.609 228 HG LEU 26 HG LEU 26 -0.323 18.155 -5.526 229 HD11 LEU 26 HD11 LEU 26 1.194 20.002 -3.656 230 HD12 LEU 26 HD12 LEU 26 -0.508 19.557 -3.515 231 HD13 LEU 26 HD13 LEU 26 0.041 20.492 -4.903 232 HD21 LEU 26 HD21 LEU 26 1.817 17.678 -6.604 233 HD22 LEU 26 HD22 LEU 26 2.643 18.803 -5.522 234 HD23 LEU 26 HD23 LEU 26 1.459 19.402 -6.689 235 H GLU 27 HN GLU 27 -1.313 14.293 -3.061 236 HA GLU 27 HA GLU 27 0.272 13.210 -0.891 237 HB2 GLU 27 HB2 GLU 27 -1.899 12.018 -2.677 238 HB3 GLU 27 HB1 GLU 27 -1.117 11.126 -1.376 239 HG2 GLU 27 HG2 GLU 27 -1.956 12.706 0.280 240 HG3 GLU 27 HG1 GLU 27 -2.652 13.707 -0.993 241 H THR 28 HN THR 28 2.302 12.598 -1.298 242 HA THR 28 HA THR 28 3.047 11.418 -3.918 243 HB THR 28 HB THR 28 5.374 12.323 -3.501 244 HG1 THR 28 HG1 THR 28 4.115 13.935 -1.513 245 HG21 THR 28 HG21 THR 28 3.813 13.490 -5.020 246 HG22 THR 28 HG22 THR 28 4.871 14.632 -4.186 247 HG23 THR 28 HG23 THR 28 3.195 14.438 -3.665 248 H TRP 29 HN TRP 29 4.605 9.762 -3.897 249 HA TRP 29 HA TRP 29 4.528 8.162 -1.401 250 HB2 TRP 29 HB2 TRP 29 4.371 7.270 -4.314 251 HB3 TRP 29 HB1 TRP 29 4.515 6.168 -2.942 252 HD1 TRP 29 HD1 TRP 29 1.932 8.236 -4.822 253 HE1 TRP 29 HE1 TRP 29 -0.382 7.850 -3.756 254 HE3 TRP 29 HE3 TRP 29 3.375 5.775 -0.568 255 HZ2 TRP 29 HZ2 TRP 29 -1.459 6.680 -1.431 256 HZ3 TRP 29 HZ3 TRP 29 1.643 5.068 1.035 257 HH2 TRP 29 HH2 TRP 29 -0.732 5.515 0.614 258 H GLU 30 HN GLU 30 6.416 8.289 -0.514 259 HA GLU 30 HA GLU 30 8.884 8.146 -2.165 260 HB2 GLU 30 HB2 GLU 30 10.087 9.107 -0.205 261 HB3 GLU 30 HB1 GLU 30 8.862 10.190 -0.854 262 HG2 GLU 30 HG2 GLU 30 7.364 9.701 0.988 263 HG3 GLU 30 HG1 GLU 30 8.453 8.455 1.602 264 H ASP 31 HN ASP 31 10.412 6.668 -1.658 265 HA ASP 31 HA ASP 31 9.511 4.168 -0.550 266 HB2 ASP 31 HB2 ASP 31 12.240 5.051 -1.589 267 HB3 ASP 31 HB1 ASP 31 11.874 3.409 -1.078 268 H GLY 32 HN GLY 32 10.148 3.215 1.420 269 HA2 GLY 32 HA2 GLY 32 11.211 5.131 3.434 270 HA3 GLY 32 HA1 GLY 32 9.986 3.903 3.740 271 H HIS 33 HN HIS 33 10.715 2.135 4.776 272 HA HIS 33 HA HIS 33 13.608 1.495 4.704 273 HB2 HIS 33 HB2 HIS 33 12.466 1.800 6.960 274 HB3 HIS 33 HB1 HIS 33 11.493 0.382 6.609 275 HD1 HIS 33 HD1 HIS 33 14.617 1.386 8.149 276 HD2 HIS 33 HD2 HIS 33 13.165 -2.057 6.336 277 HE1 HIS 33 HE1 HIS 33 16.116 -0.466 8.927 278 HE2 HIS 33 HE2 HIS 33 15.303 -2.516 7.716 279 H THR 34 HN THR 34 14.304 -0.469 3.926 280 HA THR 34 HA THR 34 12.338 -2.141 2.492 281 HB THR 34 HB THR 34 15.330 -1.846 1.932 282 HG1 THR 34 HG1 THR 34 13.236 -0.561 0.499 283 HG21 THR 34 HG21 THR 34 14.261 -3.876 0.968 284 HG22 THR 34 HG22 THR 34 14.753 -2.739 -0.287 285 HG23 THR 34 HG23 THR 34 13.055 -2.854 0.180 286 H LEU 35 HN LEU 35 11.875 -3.736 4.058 287 HA LEU 35 HA LEU 35 14.160 -5.141 5.342 288 HB2 LEU 35 HB2 LEU 35 12.667 -5.753 7.191 289 HB3 LEU 35 HB1 LEU 35 12.815 -4.015 7.043 290 HG LEU 35 HG LEU 35 10.409 -5.395 5.811 291 HD11 LEU 35 HD11 LEU 35 10.496 -6.314 8.081 292 HD12 LEU 35 HD12 LEU 35 9.146 -5.198 7.901 293 HD13 LEU 35 HD13 LEU 35 10.604 -4.684 8.755 294 HD21 LEU 35 HD21 LEU 35 10.783 -2.656 7.069 295 HD22 LEU 35 HD22 LEU 35 9.294 -3.261 6.335 296 HD23 LEU 35 HD23 LEU 35 10.726 -3.013 5.338 297 H TRP 36 HN TRP 36 13.396 -7.357 6.148 298 HA TRP 36 HA TRP 36 13.016 -8.990 3.858 299 HB2 TRP 36 HB2 TRP 36 12.867 -9.997 6.715 300 HB3 TRP 36 HB1 TRP 36 13.467 -10.835 5.291 301 HD1 TRP 36 HD1 TRP 36 14.718 -9.237 8.301 302 HE1 TRP 36 HE1 TRP 36 17.205 -8.646 8.125 303 HE3 TRP 36 HE3 TRP 36 15.337 -9.646 3.208 304 HZ2 TRP 36 HZ2 TRP 36 19.165 -8.379 6.152 305 HZ3 TRP 36 HZ3 TRP 36 17.571 -9.209 2.285 306 HH2 TRP 36 HH2 TRP 36 19.443 -8.584 3.722 307 H ALA 37 HN ALA 37 11.254 -9.953 3.081 308 HA ALA 37 HA ALA 37 8.829 -10.401 4.724 309 HB1 ALA 37 HB1 ALA 37 8.325 -8.457 3.361 310 HB2 ALA 37 HB2 ALA 37 7.393 -9.828 2.766 311 HB3 ALA 37 HB3 ALA 37 8.837 -9.292 1.898 312 H SER 38 HN SER 38 7.382 -12.134 3.730 313 HA SER 38 HA SER 38 8.530 -13.641 1.495 314 HB2 SER 38 HB2 SER 38 6.850 -14.719 3.824 315 HB3 SER 38 HB1 SER 38 7.398 -15.654 2.426 316 HG SER 38 HG SER 38 8.695 -15.772 4.422 317 H VAL 39 HN VAL 39 7.372 -12.714 -0.127 318 HA VAL 39 HA VAL 39 4.585 -11.892 0.319 319 HB VAL 39 HB VAL 39 5.923 -10.059 -0.466 320 HG11 VAL 39 HG11 VAL 39 7.286 -10.060 -2.510 321 HG12 VAL 39 HG12 VAL 39 6.892 -11.756 -2.791 322 HG13 VAL 39 HG13 VAL 39 7.849 -11.297 -1.382 323 HG21 VAL 39 HG21 VAL 39 4.813 -9.426 -2.572 324 HG22 VAL 39 HG22 VAL 39 3.677 -10.209 -1.474 325 HG23 VAL 39 HG23 VAL 39 4.339 -11.104 -2.840 326 H ASN 40 HN ASN 40 3.301 -13.609 -0.049 327 HA ASN 40 HA ASN 40 3.667 -15.233 -2.500 328 HB2 ASN 40 HB2 ASN 40 2.466 -16.073 0.184 329 HB3 ASN 40 HB1 ASN 40 2.445 -17.062 -1.269 330 HD21 ASN 40 HD21 ASN 40 5.044 -15.151 0.324 331 HD22 ASN 40 HD22 ASN 40 6.137 -16.478 0.446 332 H MET 41 HN MET 41 2.092 -14.868 -3.968 333 HA MET 41 HA MET 41 -0.364 -13.490 -3.372 334 HB2 MET 41 HB2 MET 41 0.317 -15.101 -5.875 335 HB3 MET 41 HB1 MET 41 -0.964 -13.903 -5.716 336 HG2 MET 41 HG2 MET 41 0.826 -12.168 -5.340 337 HG3 MET 41 HG1 MET 41 2.022 -13.412 -5.700 338 HE1 MET 41 HE1 MET 41 -1.006 -11.681 -8.745 339 HE2 MET 41 HE2 MET 41 -0.758 -11.048 -7.111 340 HE3 MET 41 HE3 MET 41 -1.530 -12.613 -7.347 341 H VAL 42 HN VAL 42 -2.447 -14.370 -3.226 342 HA VAL 42 HA VAL 42 -2.711 -17.019 -2.240 343 HB VAL 42 HB VAL 42 -5.048 -16.640 -1.988 344 HG11 VAL 42 HG11 VAL 42 -3.690 -15.368 -0.418 345 HG12 VAL 42 HG12 VAL 42 -5.181 -14.494 -0.775 346 HG13 VAL 42 HG13 VAL 42 -3.659 -13.984 -1.516 347 HG21 VAL 42 HG21 VAL 42 -4.894 -14.291 -3.911 348 HG22 VAL 42 HG22 VAL 42 -6.328 -14.774 -3.002 349 HG23 VAL 42 HG23 VAL 42 -5.654 -15.851 -4.225 350 H SER 43 HN SER 43 -3.264 -18.840 -3.282 351 HA SER 43 HA SER 43 -3.147 -18.941 -6.178 352 HB2 SER 43 HB2 SER 43 -1.930 -20.567 -4.643 353 HB3 SER 43 HB1 SER 43 -3.498 -21.229 -4.184 354 HG SER 43 HG SER 43 -2.026 -21.549 -6.504 355 H SER 44 HN SER 44 -4.728 -20.606 -7.192 356 HA SER 44 HA SER 44 -7.386 -19.694 -7.099 357 HB2 SER 44 HB2 SER 44 -7.832 -21.849 -8.451 358 HB3 SER 44 HB1 SER 44 -6.637 -20.731 -9.110 359 HG SER 44 HG SER 44 -5.229 -22.251 -8.975 360 H LYS 45 HN LYS 45 -5.751 -22.270 -5.366 361 HA LYS 45 HA LYS 45 -7.868 -23.654 -4.192 362 HB2 LYS 45 HB2 LYS 45 -5.547 -24.408 -3.983 363 HB3 LYS 45 HB1 LYS 45 -5.118 -22.968 -3.067 364 HG2 LYS 45 HG2 LYS 45 -6.625 -23.728 -1.227 365 HG3 LYS 45 HG1 LYS 45 -6.963 -25.200 -2.144 366 HD2 LYS 45 HD2 LYS 45 -4.623 -25.883 -1.990 367 HD3 LYS 45 HD1 LYS 45 -4.187 -24.350 -1.227 368 HE2 LYS 45 HE2 LYS 45 -4.316 -26.112 0.457 369 HE3 LYS 45 HE1 LYS 45 -5.604 -24.939 0.722 370 HZ1 LYS 45 HZ1 LYS 45 -6.426 -27.167 0.977 371 HZ2 LYS 45 HZ2 LYS 45 -5.887 -27.599 -0.565 372 HZ3 LYS 45 HZ3 LYS 45 -7.134 -26.473 -0.398 373 H GLU 46 HN GLU 46 -6.174 -20.749 -3.045 374 HA GLU 46 HA GLU 46 -7.556 -20.430 -0.590 375 HB2 GLU 46 HB2 GLU 46 -6.225 -18.197 -2.179 376 HB3 GLU 46 HB1 GLU 46 -6.502 -18.249 -0.438 377 HG2 GLU 46 HG2 GLU 46 -4.527 -19.892 -2.054 378 HG3 GLU 46 HG1 GLU 46 -4.159 -18.629 -0.887 379 H ALA 47 HN ALA 47 -7.987 -18.933 -3.788 380 HA ALA 47 HA ALA 47 -10.121 -17.202 -3.258 381 HB1 ALA 47 HB1 ALA 47 -10.511 -17.236 -5.688 382 HB2 ALA 47 HB2 ALA 47 -9.510 -18.682 -5.840 383 HB3 ALA 47 HB3 ALA 47 -8.781 -17.157 -5.333 384 H ILE 48 HN ILE 48 -10.239 -20.594 -4.391 385 HA ILE 48 HA ILE 48 -13.030 -20.926 -4.508 386 HB ILE 48 HB ILE 48 -10.831 -22.981 -4.014 387 HG12 ILE 48 HG12 ILE 48 -12.427 -22.408 -6.553 388 HG13 ILE 48 HG11 ILE 48 -10.825 -21.761 -6.226 389 HG21 ILE 48 HG21 ILE 48 -12.444 -24.762 -4.628 390 HG22 ILE 48 HG22 ILE 48 -13.749 -23.574 -4.651 391 HG23 ILE 48 HG23 ILE 48 -12.918 -23.939 -3.138 392 HD11 ILE 48 HD11 ILE 48 -11.510 -24.688 -6.537 393 HD12 ILE 48 HD12 ILE 48 -9.902 -24.028 -6.223 394 HD13 ILE 48 HD13 ILE 48 -10.727 -23.657 -7.735 395 H SER 49 HN SER 49 -10.767 -21.570 -1.827 396 HA SER 49 HA SER 49 -12.633 -22.666 0.004 397 HB2 SER 49 HB2 SER 49 -9.966 -21.291 0.560 398 HB3 SER 49 HB1 SER 49 -10.841 -22.341 1.684 399 HG SER 49 HG SER 49 -9.197 -22.998 -0.356 400 H SER 50 HN SER 50 -11.771 -19.373 -0.743 401 HA SER 50 HA SER 50 -13.060 -18.229 1.624 402 HB2 SER 50 HB2 SER 50 -12.197 -16.106 0.711 403 HB3 SER 50 HB1 SER 50 -10.922 -17.313 0.776 404 HG SER 50 HG SER 50 -10.779 -17.264 -1.312 405 H GLY 51 HN GLY 51 -13.892 -19.012 -1.642 406 HA2 GLY 51 HA2 GLY 51 -15.977 -18.953 -2.667 407 HA3 GLY 51 HA1 GLY 51 -16.615 -18.021 -1.318 408 H ALA 52 HN ALA 52 -16.040 -15.716 -1.213 409 HA ALA 52 HA ALA 52 -15.148 -14.457 -3.722 410 HB1 ALA 52 HB1 ALA 52 -17.046 -12.893 -3.744 411 HB2 ALA 52 HB2 ALA 52 -17.748 -13.692 -2.333 412 HB3 ALA 52 HB3 ALA 52 -17.615 -14.559 -3.864 413 H GLU 53 HN GLU 53 -14.430 -14.819 -0.642 414 HA GLU 53 HA GLU 53 -14.043 -12.090 0.262 415 HB2 GLU 53 HB2 GLU 53 -14.358 -13.866 1.914 416 HB3 GLU 53 HB1 GLU 53 -12.977 -14.746 1.299 417 HG2 GLU 53 HG2 GLU 53 -12.329 -13.718 3.351 418 HG3 GLU 53 HG1 GLU 53 -11.496 -12.877 2.046 419 H LEU 54 HN LEU 54 -11.844 -14.713 -0.790 420 HA LEU 54 HA LEU 54 -9.826 -12.744 -1.696 421 HB2 LEU 54 HB2 LEU 54 -9.497 -15.751 -1.262 422 HB3 LEU 54 HB1 LEU 54 -8.225 -14.641 -1.753 423 HG LEU 54 HG LEU 54 -9.611 -14.715 0.958 424 HD11 LEU 54 HD11 LEU 54 -6.750 -15.398 0.185 425 HD12 LEU 54 HD12 LEU 54 -8.016 -16.543 0.641 426 HD13 LEU 54 HD13 LEU 54 -7.409 -15.389 1.826 427 HD21 LEU 54 HD21 LEU 54 -7.443 -12.813 -0.008 428 HD22 LEU 54 HD22 LEU 54 -8.054 -12.931 1.644 429 HD23 LEU 54 HD23 LEU 54 -9.120 -12.392 0.353 430 H ALA 55 HN ALA 55 -9.109 -12.825 -3.797 431 HA ALA 55 HA ALA 55 -10.290 -14.776 -5.695 432 HB1 ALA 55 HB1 ALA 55 -10.532 -12.963 -7.370 433 HB2 ALA 55 HB2 ALA 55 -10.007 -11.772 -6.174 434 HB3 ALA 55 HB3 ALA 55 -11.525 -12.644 -5.946 435 H ILE 56 HN ILE 56 -8.902 -15.065 -7.620 436 HA ILE 56 HA ILE 56 -6.150 -15.289 -6.983 437 HB ILE 56 HB ILE 56 -7.386 -15.269 -9.790 438 HG12 ILE 56 HG12 ILE 56 -6.902 -17.654 -7.933 439 HG13 ILE 56 HG11 ILE 56 -8.474 -16.963 -8.322 440 HG21 ILE 56 HG21 ILE 56 -4.731 -16.427 -8.832 441 HG22 ILE 56 HG22 ILE 56 -4.938 -15.006 -9.859 442 HG23 ILE 56 HG23 ILE 56 -5.394 -16.599 -10.461 443 HD11 ILE 56 HD11 ILE 56 -6.612 -18.328 -10.276 444 HD12 ILE 56 HD12 ILE 56 -8.184 -17.624 -10.665 445 HD13 ILE 56 HD13 ILE 56 -8.082 -19.000 -9.570 446 H GLY 57 HN GLY 57 -4.620 -13.701 -6.994 447 HA2 GLY 57 HA2 GLY 57 -3.541 -11.784 -8.107 448 HA3 GLY 57 HA1 GLY 57 -5.142 -11.105 -8.381 449 H THR 58 HN THR 58 -5.718 -12.235 -5.480 450 HA THR 58 HA THR 58 -4.909 -9.978 -3.894 451 HB THR 58 HB THR 58 -5.842 -12.709 -2.879 452 HG1 THR 58 HG1 THR 58 -7.323 -10.429 -3.662 453 HG21 THR 58 HG21 THR 58 -5.936 -9.978 -1.542 454 HG22 THR 58 HG22 THR 58 -4.854 -11.305 -1.097 455 HG23 THR 58 HG23 THR 58 -6.600 -11.463 -0.881 456 H VAL 59 HN VAL 59 -3.157 -9.855 -2.480 457 HA VAL 59 HA VAL 59 -1.092 -11.967 -2.658 458 HB VAL 59 HB VAL 59 -0.585 -8.962 -2.509 459 HG11 VAL 59 HG11 VAL 59 1.761 -9.574 -3.059 460 HG12 VAL 59 HG12 VAL 59 1.326 -11.282 -2.997 461 HG13 VAL 59 HG13 VAL 59 1.233 -10.295 -1.536 462 HG21 VAL 59 HG21 VAL 59 0.100 -9.073 -4.894 463 HG22 VAL 59 HG22 VAL 59 -1.605 -9.480 -4.689 464 HG23 VAL 59 HG23 VAL 59 -0.423 -10.760 -4.962 465 H ARG 60 HN ARG 60 -0.678 -12.828 -0.694 466 HA ARG 60 HA ARG 60 -1.025 -11.258 1.775 467 HB2 ARG 60 HB2 ARG 60 -0.426 -14.214 1.308 468 HB3 ARG 60 HB1 ARG 60 -0.460 -13.464 2.907 469 HG2 ARG 60 HG2 ARG 60 -2.829 -12.792 2.511 470 HG3 ARG 60 HG1 ARG 60 -2.788 -13.646 0.965 471 HD2 ARG 60 HD2 ARG 60 -2.333 -14.923 3.681 472 HD3 ARG 60 HD1 ARG 60 -3.858 -14.960 2.788 473 HE ARG 60 HE ARG 60 -1.491 -16.037 1.436 474 HH11 ARG 60 HH11 ARG 60 -4.462 -16.767 3.190 475 HH12 ARG 60 HH12 ARG 60 -4.486 -18.425 2.675 476 HH21 ARG 60 HH21 ARG 60 -1.553 -18.213 0.795 477 HH22 ARG 60 HH22 ARG 60 -2.843 -19.246 1.335 478 H ILE 61 HN ILE 61 0.694 -10.690 3.068 479 HA ILE 61 HA ILE 61 3.420 -11.011 1.953 480 HB ILE 61 HB ILE 61 2.209 -8.309 2.720 481 HG12 ILE 61 HG12 ILE 61 3.043 -9.336 -0.034 482 HG13 ILE 61 HG11 ILE 61 1.381 -9.209 0.520 483 HG21 ILE 61 HG21 ILE 61 4.993 -8.939 1.653 484 HG22 ILE 61 HG22 ILE 61 4.607 -8.473 3.310 485 HG23 ILE 61 HG23 ILE 61 4.352 -7.332 1.996 486 HD11 ILE 61 HD11 ILE 61 3.294 -6.950 0.019 487 HD12 ILE 61 HD12 ILE 61 1.667 -6.771 0.674 488 HD13 ILE 61 HD13 ILE 61 1.899 -7.411 -0.951 489 H TRP 62 HN TRP 62 4.431 -11.966 3.519 490 HA TRP 62 HA TRP 62 3.721 -11.571 6.347 491 HB2 TRP 62 HB2 TRP 62 5.385 -13.676 4.871 492 HB3 TRP 62 HB1 TRP 62 5.218 -13.628 6.626 493 HD1 TRP 62 HD1 TRP 62 2.248 -13.148 4.148 494 HE1 TRP 62 HE1 TRP 62 0.556 -15.015 4.588 495 HE3 TRP 62 HE3 TRP 62 4.935 -15.880 7.510 496 HZ2 TRP 62 HZ2 TRP 62 0.372 -17.361 6.151 497 HZ3 TRP 62 HZ3 TRP 62 3.933 -17.914 8.449 498 HH2 TRP 62 HH2 TRP 62 1.699 -18.654 7.770 499 H ILE 63 HN ILE 63 4.936 -10.087 7.447 500 HA ILE 63 HA ILE 63 7.844 -9.893 6.832 501 HB ILE 63 HB ILE 63 7.796 -7.505 7.604 502 HG12 ILE 63 HG12 ILE 63 4.759 -7.725 7.371 503 HG13 ILE 63 HG11 ILE 63 5.631 -7.656 8.897 504 HG21 ILE 63 HG21 ILE 63 7.840 -7.964 5.200 505 HG22 ILE 63 HG22 ILE 63 6.876 -6.526 5.523 506 HG23 ILE 63 HG23 ILE 63 6.075 -8.055 5.157 507 HD11 ILE 63 HD11 ILE 63 6.461 -5.427 8.314 508 HD12 ILE 63 HD12 ILE 63 4.700 -5.507 8.335 509 HD13 ILE 63 HD13 ILE 63 5.559 -5.497 6.795 510 H ARG 64 HN ARG 64 9.170 -9.619 8.731 511 HA ARG 64 HA ARG 64 8.415 -10.640 11.171 512 HB2 ARG 64 HB2 ARG 64 10.773 -9.958 10.289 513 HB3 ARG 64 HB1 ARG 64 10.439 -8.368 10.961 514 HG2 ARG 64 HG2 ARG 64 10.355 -10.913 12.616 515 HG3 ARG 64 HG1 ARG 64 11.837 -9.987 12.383 516 HD2 ARG 64 HD2 ARG 64 11.006 -8.140 13.615 517 HD3 ARG 64 HD1 ARG 64 9.337 -8.702 13.508 518 HE ARG 64 HE ARG 64 11.138 -10.460 14.947 519 HH11 ARG 64 HH11 ARG 64 8.906 -7.754 15.248 520 HH12 ARG 64 HH12 ARG 64 8.534 -8.097 16.906 521 HH21 ARG 64 HH21 ARG 64 10.618 -10.900 17.122 522 HH22 ARG 64 HH22 ARG 64 9.486 -9.882 17.958 523 H TYR 65 HN TYR 65 7.485 -9.855 13.032 524 HA TYR 65 HA TYR 65 5.274 -8.260 12.878 525 HB2 TYR 65 HB2 TYR 65 5.769 -9.971 14.620 526 HB3 TYR 65 HB1 TYR 65 6.895 -8.862 15.383 527 HD1 TYR 65 HD2 TYR 65 3.348 -9.651 14.822 528 HD2 TYR 65 HD1 TYR 65 6.028 -6.921 16.719 529 HE1 TYR 65 HE2 TYR 65 1.510 -8.795 16.197 530 HE2 TYR 65 HE1 TYR 65 4.186 -6.070 18.094 531 HH TYR 65 HH TYR 65 1.207 -7.659 18.355 532 H ARG 66 HN ARG 66 5.124 -6.151 12.424 533 HA ARG 66 HA ARG 66 6.421 -4.218 14.234 534 HB2 ARG 66 HB2 ARG 66 6.076 -3.690 11.242 535 HB3 ARG 66 HB1 ARG 66 6.765 -2.587 12.434 536 HG2 ARG 66 HG2 ARG 66 8.626 -4.252 12.765 537 HG3 ARG 66 HG1 ARG 66 7.950 -5.168 11.421 538 HD2 ARG 66 HD2 ARG 66 9.787 -3.768 10.633 539 HD3 ARG 66 HD1 ARG 66 8.264 -3.195 9.936 540 HE ARG 66 HE ARG 66 9.453 -1.954 12.349 541 HH11 ARG 66 HH11 ARG 66 8.250 -1.557 9.075 542 HH12 ARG 66 HH12 ARG 66 8.293 0.173 9.156 543 HH21 ARG 66 HH21 ARG 66 9.482 0.294 12.433 544 HH22 ARG 66 HH22 ARG 66 8.947 1.219 11.063 545 H LYS 67 HN LYS 67 4.805 -3.232 15.292 546 HA LYS 67 HA LYS 67 2.113 -2.982 14.230 547 HB2 LYS 67 HB2 LYS 67 3.318 -1.741 16.744 548 HB3 LYS 67 HB1 LYS 67 1.602 -1.805 16.339 549 HG2 LYS 67 HG2 LYS 67 1.731 -4.298 16.432 550 HG3 LYS 67 HG1 LYS 67 3.406 -4.154 16.962 551 HD2 LYS 67 HD2 LYS 67 0.949 -3.135 18.448 552 HD3 LYS 67 HD1 LYS 67 1.889 -4.566 18.859 553 HE2 LYS 67 HE2 LYS 67 2.627 -2.949 20.398 554 HE3 LYS 67 HE1 LYS 67 3.879 -2.920 19.160 555 HZ1 LYS 67 HZ1 LYS 67 1.604 -1.011 19.239 556 HZ2 LYS 67 HZ2 LYS 67 2.985 -0.925 18.264 557 HZ3 LYS 67 HZ3 LYS 67 3.109 -0.706 19.931 558 H ASP 68 HN ASP 68 4.783 -1.453 13.274 559 HA ASP 68 HA ASP 68 3.878 1.337 13.395 560 HB2 ASP 68 HB2 ASP 68 6.247 0.908 13.840 561 HB3 ASP 68 HB1 ASP 68 6.415 0.015 12.333 562 H ILE 69 HN ILE 69 3.885 -1.361 11.242 563 HA ILE 69 HA ILE 69 3.640 0.021 8.756 564 HB ILE 69 HB ILE 69 2.678 -2.790 9.441 565 HG12 ILE 69 HG12 ILE 69 5.094 -2.488 9.951 566 HG13 ILE 69 HG11 ILE 69 4.846 -3.589 8.609 567 HG21 ILE 69 HG21 ILE 69 1.669 -2.008 7.359 568 HG22 ILE 69 HG22 ILE 69 2.898 -3.217 6.983 569 HG23 ILE 69 HG23 ILE 69 3.245 -1.504 6.740 570 HD11 ILE 69 HD11 ILE 69 6.733 -2.128 8.233 571 HD12 ILE 69 HD12 ILE 69 5.699 -0.710 8.377 572 HD13 ILE 69 HD13 ILE 69 5.475 -1.836 7.032 573 H ASN 70 HN ASN 70 1.870 0.889 7.824 574 HA ASN 70 HA ASN 70 -0.784 0.605 9.126 575 HB2 ASN 70 HB2 ASN 70 0.475 2.824 9.587 576 HB3 ASN 70 HB1 ASN 70 0.278 3.183 7.876 577 HD21 ASN 70 HD21 ASN 70 -1.335 2.854 10.953 578 HD22 ASN 70 HD22 ASN 70 -2.831 3.574 10.475 579 H ALA 71 HN ALA 71 -2.596 1.131 7.624 580 HA ALA 71 HA ALA 71 -2.352 -0.185 5.113 581 HB1 ALA 71 HB1 ALA 71 -4.425 -0.247 6.445 582 HB2 ALA 71 HB2 ALA 71 -4.735 0.356 4.814 583 HB3 ALA 71 HB3 ALA 71 -4.656 1.482 6.173 584 H THR 72 HN THR 72 -1.793 3.087 6.029 585 HA THR 72 HA THR 72 -2.143 4.255 3.392 586 HB THR 72 HB THR 72 -1.172 6.321 4.429 587 HG1 THR 72 HG1 THR 72 0.227 5.679 5.968 588 HG21 THR 72 HG21 THR 72 -3.609 5.914 4.642 589 HG22 THR 72 HG22 THR 72 -2.971 6.769 6.048 590 HG23 THR 72 HG23 THR 72 -3.330 5.044 6.153 591 H SER 73 HN SER 73 0.102 2.178 4.576 592 HA SER 73 HA SER 73 2.348 3.237 2.981 593 HB2 SER 73 HB2 SER 73 2.257 0.821 4.855 594 HB3 SER 73 HB1 SER 73 3.697 1.498 4.090 595 HG SER 73 HG SER 73 2.763 3.525 5.298 596 H ARG 74 HN ARG 74 2.923 2.237 1.061 597 HA ARG 74 HA ARG 74 1.293 -0.068 0.139 598 HB2 ARG 74 HB2 ARG 74 2.930 1.908 -1.517 599 HB3 ARG 74 HB1 ARG 74 1.955 0.579 -2.159 600 HG2 ARG 74 HG2 ARG 74 -0.081 1.630 -1.527 601 HG3 ARG 74 HG1 ARG 74 0.756 2.810 -0.516 602 HD2 ARG 74 HD2 ARG 74 0.013 3.864 -2.564 603 HD3 ARG 74 HD1 ARG 74 1.774 3.813 -2.519 604 HE ARG 74 HE ARG 74 0.736 1.601 -3.967 605 HH11 ARG 74 HH11 ARG 74 1.237 5.070 -4.244 606 HH12 ARG 74 HH12 ARG 74 1.328 5.039 -5.973 607 HH21 ARG 74 HH21 ARG 74 0.823 1.605 -6.254 608 HH22 ARG 74 HH22 ARG 74 1.099 3.091 -7.099 609 H ILE 75 HN ILE 75 2.283 -1.951 -0.415 610 HA ILE 75 HA ILE 75 5.079 -2.268 0.424 611 HB ILE 75 HB ILE 75 3.034 -4.419 -0.282 612 HG12 ILE 75 HG12 ILE 75 2.134 -3.075 1.598 613 HG13 ILE 75 HG11 ILE 75 2.604 -4.675 2.153 614 HG21 ILE 75 HG21 ILE 75 5.350 -5.183 -0.358 615 HG22 ILE 75 HG22 ILE 75 4.513 -5.912 1.007 616 HG23 ILE 75 HG23 ILE 75 5.634 -4.578 1.275 617 HD11 ILE 75 HD11 ILE 75 3.196 -2.989 3.759 618 HD12 ILE 75 HD12 ILE 75 4.149 -2.121 2.557 619 HD13 ILE 75 HD13 ILE 75 4.658 -3.724 3.099 620 H LYS 76 HN LYS 76 6.426 -1.782 -1.305 621 HA LYS 76 HA LYS 76 5.848 -2.975 -3.955 622 HB2 LYS 76 HB2 LYS 76 6.243 -0.505 -3.893 623 HB3 LYS 76 HB1 LYS 76 7.865 -0.796 -3.267 624 HG2 LYS 76 HG2 LYS 76 8.466 -1.998 -5.335 625 HG3 LYS 76 HG1 LYS 76 6.826 -1.785 -5.949 626 HD2 LYS 76 HD2 LYS 76 8.305 -0.160 -6.995 627 HD3 LYS 76 HD1 LYS 76 7.157 0.673 -5.946 628 HE2 LYS 76 HE2 LYS 76 8.904 0.858 -4.198 629 HE3 LYS 76 HE1 LYS 76 10.047 0.033 -5.261 630 HZ1 LYS 76 HZ1 LYS 76 8.708 2.589 -5.930 631 HZ2 LYS 76 HZ2 LYS 76 9.964 1.843 -6.782 632 HZ3 LYS 76 HZ3 LYS 76 10.243 2.478 -5.235 633 H VAL 77 HN VAL 77 6.840 -4.854 -4.333 634 HA VAL 77 HA VAL 77 8.776 -5.931 -2.523 635 HB VAL 77 HB VAL 77 7.731 -7.051 -5.152 636 HG11 VAL 77 HG11 VAL 77 8.508 -9.265 -4.353 637 HG12 VAL 77 HG12 VAL 77 9.256 -8.495 -2.951 638 HG13 VAL 77 HG13 VAL 77 9.856 -8.146 -4.573 639 HG21 VAL 77 HG21 VAL 77 6.199 -8.369 -3.770 640 HG22 VAL 77 HG22 VAL 77 5.973 -6.648 -3.461 641 HG23 VAL 77 HG23 VAL 77 6.857 -7.640 -2.302 642 H SER 78 HN SER 78 10.838 -5.642 -2.556 643 HA SER 78 HA SER 78 12.330 -4.457 -4.713 644 HB2 SER 78 HB2 SER 78 13.317 -5.572 -2.054 645 HB3 SER 78 HB1 SER 78 14.157 -4.414 -3.097 646 HG SER 78 HG SER 78 11.891 -3.293 -2.730 647 H THR 79 HN THR 79 11.907 -7.673 -3.418 648 HA THR 79 HA THR 79 13.088 -8.911 -5.719 649 HB THR 79 HB THR 79 15.174 -8.441 -4.366 650 HG1 THR 79 HG1 THR 79 15.305 -10.124 -5.778 651 HG21 THR 79 HG21 THR 79 15.668 -9.806 -2.371 652 HG22 THR 79 HG22 THR 79 14.028 -10.455 -2.396 653 HG23 THR 79 HG23 THR 79 14.286 -8.739 -2.083 654 H GLY 80 HN GLY 80 12.429 -11.055 -5.935 655 HA2 GLY 80 HA2 GLY 80 11.474 -13.038 -4.634 656 HA3 GLY 80 HA1 GLY 80 10.277 -11.879 -4.063 657 HA PRO 81 HA PRO 81 8.599 -13.966 -7.908 658 HB2 PRO 81 HB2 PRO 81 5.980 -14.113 -7.058 659 HB3 PRO 81 HB1 PRO 81 7.200 -15.332 -6.655 660 HG2 PRO 81 HG2 PRO 81 6.234 -12.995 -5.010 661 HG3 PRO 81 HG1 PRO 81 6.491 -14.680 -4.506 662 HD2 PRO 81 HD2 PRO 81 8.312 -12.754 -3.973 663 HD3 PRO 81 HD1 PRO 81 8.816 -14.415 -4.360 664 H LEU 82 HN LEU 82 7.616 -11.103 -6.144 665 HA LEU 82 HA LEU 82 6.282 -9.956 -8.538 666 HB2 LEU 82 HB2 LEU 82 5.784 -9.250 -5.615 667 HB3 LEU 82 HB1 LEU 82 4.915 -8.625 -7.010 668 HG LEU 82 HG LEU 82 4.806 -11.461 -5.919 669 HD11 LEU 82 HD11 LEU 82 3.536 -9.799 -4.630 670 HD12 LEU 82 HD12 LEU 82 2.467 -10.940 -5.433 671 HD13 LEU 82 HD13 LEU 82 2.664 -9.312 -6.086 672 HD21 LEU 82 HD21 LEU 82 3.151 -11.950 -7.682 673 HD22 LEU 82 HD22 LEU 82 4.725 -11.563 -8.366 674 HD23 LEU 82 HD23 LEU 82 3.433 -10.363 -8.402 675 H ALA 83 HN ALA 83 9.153 -9.871 -7.945 676 HA ALA 83 HA ALA 83 10.009 -7.423 -6.828 677 HB1 ALA 83 HB1 ALA 83 11.519 -9.332 -7.215 678 HB2 ALA 83 HB2 ALA 83 12.146 -7.860 -7.958 679 HB3 ALA 83 HB3 ALA 83 11.381 -9.094 -8.961 680 H GLY 84 HN GLY 84 8.915 -5.640 -7.525 681 HA2 GLY 84 HA2 GLY 84 9.437 -3.792 -9.187 682 HA3 GLY 84 HA1 GLY 84 8.904 -4.931 -10.419 683 H ARG 85 HN ARG 85 6.815 -5.839 -8.282 684 HA ARG 85 HA ARG 85 4.699 -4.014 -9.124 685 HB2 ARG 85 HB2 ARG 85 4.538 -6.560 -7.443 686 HB3 ARG 85 HB1 ARG 85 3.157 -5.643 -8.051 687 HG2 ARG 85 HG2 ARG 85 3.995 -6.115 -10.396 688 HG3 ARG 85 HG1 ARG 85 5.191 -7.203 -9.680 689 HD2 ARG 85 HD2 ARG 85 3.362 -8.547 -8.687 690 HD3 ARG 85 HD1 ARG 85 2.167 -7.460 -9.401 691 HE ARG 85 HE ARG 85 3.737 -9.505 -10.744 692 HH11 ARG 85 HH11 ARG 85 1.635 -6.723 -11.180 693 HH12 ARG 85 HH12 ARG 85 1.196 -7.161 -12.797 694 HH21 ARG 85 HH21 ARG 85 3.164 -10.075 -12.853 695 HH22 ARG 85 HH22 ARG 85 2.048 -9.089 -13.739 696 H VAL 86 HN VAL 86 3.531 -2.664 -7.793 697 HA VAL 86 HA VAL 86 4.301 -2.473 -4.946 698 HB VAL 86 HB VAL 86 4.734 -0.369 -6.068 699 HG11 VAL 86 HG11 VAL 86 2.985 0.990 -7.183 700 HG12 VAL 86 HG12 VAL 86 1.841 -0.340 -7.001 701 HG13 VAL 86 HG13 VAL 86 3.269 -0.542 -8.017 702 HG21 VAL 86 HG21 VAL 86 2.244 -0.135 -4.331 703 HG22 VAL 86 HG22 VAL 86 3.377 1.175 -4.680 704 HG23 VAL 86 HG23 VAL 86 3.908 -0.235 -3.758 705 H LEU 87 HN LEU 87 3.042 -3.968 -4.096 706 HA LEU 87 HA LEU 87 0.228 -4.295 -4.635 707 HB2 LEU 87 HB2 LEU 87 1.792 -5.496 -2.307 708 HB3 LEU 87 HB1 LEU 87 0.230 -6.014 -2.912 709 HG LEU 87 HG LEU 87 1.697 -7.658 -3.694 710 HD11 LEU 87 HD11 LEU 87 0.233 -6.920 -5.478 711 HD12 LEU 87 HD12 LEU 87 1.767 -7.498 -6.120 712 HD13 LEU 87 HD13 LEU 87 1.446 -5.763 -6.035 713 HD21 LEU 87 HD21 LEU 87 3.685 -5.583 -4.632 714 HD22 LEU 87 HD22 LEU 87 3.861 -7.338 -4.708 715 HD23 LEU 87 HD23 LEU 87 3.806 -6.529 -3.145 716 H ASN 88 HN ASN 88 -1.425 -3.366 -3.611 717 HA ASN 88 HA ASN 88 -0.858 -1.320 -1.554 718 HB2 ASN 88 HB2 ASN 88 -3.163 -1.672 -3.530 719 HB3 ASN 88 HB1 ASN 88 -3.146 -0.441 -2.267 720 HD21 ASN 88 HD21 ASN 88 -1.456 -1.572 -5.140 721 HD22 ASN 88 HD22 ASN 88 -0.775 -0.050 -5.567 722 H ILE 89 HN ILE 89 -2.145 -1.226 0.369 723 HA ILE 89 HA ILE 89 -2.753 -3.920 1.331 724 HB ILE 89 HB ILE 89 -2.751 -1.255 2.841 725 HG12 ILE 89 HG12 ILE 89 -0.646 -3.469 2.718 726 HG13 ILE 89 HG11 ILE 89 -0.493 -1.849 2.043 727 HG21 ILE 89 HG21 ILE 89 -2.788 -2.604 4.929 728 HG22 ILE 89 HG22 ILE 89 -2.947 -4.085 3.980 729 HG23 ILE 89 HG23 ILE 89 -4.239 -2.883 3.963 730 HD11 ILE 89 HD11 ILE 89 -0.673 -2.555 4.977 731 HD12 ILE 89 HD12 ILE 89 -0.566 -0.912 4.320 732 HD13 ILE 89 HD13 ILE 89 0.766 -2.048 4.091 733 H ILE 90 HN ILE 90 -4.751 -4.713 1.424 734 HA ILE 90 HA ILE 90 -7.057 -2.938 0.861 735 HB ILE 90 HB ILE 90 -8.266 -5.142 0.298 736 HG12 ILE 90 HG12 ILE 90 -5.425 -6.256 0.146 737 HG13 ILE 90 HG11 ILE 90 -6.544 -6.640 1.438 738 HG21 ILE 90 HG21 ILE 90 -7.321 -5.226 -1.993 739 HG22 ILE 90 HG22 ILE 90 -5.912 -4.313 -1.445 740 HG23 ILE 90 HG23 ILE 90 -7.508 -3.563 -1.426 741 HD11 ILE 90 HD11 ILE 90 -6.443 -8.422 -0.155 742 HD12 ILE 90 HD12 ILE 90 -6.850 -7.329 -1.477 743 HD13 ILE 90 HD13 ILE 90 -8.042 -7.682 -0.219 744 H GLY 91 HN GLY 91 -7.255 -2.175 2.983 745 HA2 GLY 91 HA2 GLY 91 -9.116 -2.490 4.594 746 HA3 GLY 91 HA1 GLY 91 -8.464 -4.093 4.920 747 H GLN 92 HN GLN 92 -6.577 -4.315 6.125 748 HA GLN 92 HA GLN 92 -5.185 -2.078 7.291 749 HB2 GLN 92 HB2 GLN 92 -5.866 -2.467 9.623 750 HB3 GLN 92 HB1 GLN 92 -7.270 -2.063 8.644 751 HG2 GLN 92 HG2 GLN 92 -7.848 -4.499 8.541 752 HG3 GLN 92 HG1 GLN 92 -6.493 -4.825 9.626 753 HE21 GLN 92 HE21 GLN 92 -9.705 -3.486 9.368 754 HE22 GLN 92 HE22 GLN 92 -10.003 -3.339 11.063 755 HA PRO 93 HA PRO 93 -2.089 -5.386 7.665 756 HB2 PRO 93 HB2 PRO 93 -0.433 -4.253 9.572 757 HB3 PRO 93 HB1 PRO 93 -0.444 -3.743 7.878 758 HG2 PRO 93 HG2 PRO 93 -1.876 -2.517 10.234 759 HG3 PRO 93 HG1 PRO 93 -0.902 -1.713 8.979 760 HD2 PRO 93 HD2 PRO 93 -3.580 -1.719 8.834 761 HD3 PRO 93 HD1 PRO 93 -2.604 -1.906 7.358 762 H LEU 94 HN LEU 94 -2.657 -7.239 8.663 763 HA LEU 94 HA LEU 94 -3.935 -7.224 11.328 764 HB2 LEU 94 HB2 LEU 94 -5.010 -8.246 9.176 765 HB3 LEU 94 HB1 LEU 94 -3.857 -9.551 9.350 766 HG LEU 94 HG LEU 94 -6.158 -10.096 10.171 767 HD11 LEU 94 HD11 LEU 94 -5.557 -11.222 12.222 768 HD12 LEU 94 HD12 LEU 94 -4.111 -10.222 12.389 769 HD13 LEU 94 HD13 LEU 94 -4.253 -11.358 11.044 770 HD21 LEU 94 HD21 LEU 94 -5.634 -8.037 12.332 771 HD22 LEU 94 HD22 LEU 94 -7.011 -9.140 12.260 772 HD23 LEU 94 HD23 LEU 94 -6.813 -7.909 11.018 773 HA PRO 95 HA PRO 95 0.139 -9.018 12.727 774 HB2 PRO 95 HB2 PRO 95 -1.060 -8.634 15.439 775 HB3 PRO 95 HB1 PRO 95 0.456 -8.007 14.784 776 HG2 PRO 95 HG2 PRO 95 -1.629 -6.372 15.208 777 HG3 PRO 95 HG1 PRO 95 -0.575 -6.156 13.791 778 HD2 PRO 95 HD2 PRO 95 -3.281 -7.514 13.943 779 HD3 PRO 95 HD1 PRO 95 -2.699 -6.311 12.765 780 H ASP 96 HN ASP 96 0.673 -11.163 13.401 781 HA ASP 96 HA ASP 96 -1.534 -13.051 13.369 782 HB2 ASP 96 HB2 ASP 96 0.059 -14.790 13.186 783 HB3 ASP 96 HB1 ASP 96 0.788 -13.447 12.310 784 H ALA 97 HN ALA 97 -1.467 -14.918 15.019 785 HA ALA 97 HA ALA 97 -2.303 -13.847 17.519 786 HB1 ALA 97 HB1 ALA 97 -2.854 -16.169 18.093 787 HB2 ALA 97 HB2 ALA 97 -1.913 -16.750 16.717 788 HB3 ALA 97 HB3 ALA 97 -3.372 -15.797 16.446 789 H ALA 98 HN ALA 98 0.719 -15.264 16.463 790 HA ALA 98 HA ALA 98 1.653 -15.745 19.219 791 HB1 ALA 98 HB1 ALA 98 2.982 -16.380 16.563 792 HB2 ALA 98 HB2 ALA 98 2.036 -17.502 17.543 793 HB3 ALA 98 HB3 ALA 98 3.562 -16.870 18.159 794 H ARG 99 HN ARG 99 1.659 -13.201 17.023 795 HA ARG 99 HA ARG 99 2.700 -11.231 16.809 796 HB2 ARG 99 HB2 ARG 99 3.637 -11.815 19.647 797 HB3 ARG 99 HB1 ARG 99 4.002 -10.307 18.829 798 HG2 ARG 99 HG2 ARG 99 2.145 -9.878 20.259 799 HG3 ARG 99 HG1 ARG 99 1.518 -9.893 18.611 800 HD2 ARG 99 HD2 ARG 99 0.612 -12.147 18.955 801 HD3 ARG 99 HD1 ARG 99 1.338 -12.214 20.564 802 HE ARG 99 HE ARG 99 -0.430 -9.985 20.261 803 HH11 ARG 99 HH11 ARG 99 -0.430 -13.447 20.930 804 HH12 ARG 99 HH12 ARG 99 -1.932 -13.381 21.795 805 HH21 ARG 99 HH21 ARG 99 -2.347 -9.936 21.408 806 HH22 ARG 99 HH22 ARG 99 -3.014 -11.391 22.074 807 H THR 100 HN THR 100 3.984 -13.603 15.824 808 HA THR 100 HA THR 100 6.883 -13.143 15.999 809 HB THR 100 HB THR 100 7.032 -15.171 14.520 810 HG1 THR 100 HG1 THR 100 4.265 -14.750 14.401 811 HG21 THR 100 HG21 THR 100 7.031 -15.484 16.969 812 HG22 THR 100 HG22 THR 100 6.214 -16.825 16.165 813 HG23 THR 100 HG23 THR 100 5.265 -15.572 16.969 814 H ARG 101 HN ARG 101 4.272 -12.073 14.092 815 HA ARG 101 HA ARG 101 5.887 -11.051 11.933 816 HB2 ARG 101 HB2 ARG 101 5.113 -12.397 10.141 817 HB3 ARG 101 HB1 ARG 101 5.452 -13.573 11.408 818 HG2 ARG 101 HG2 ARG 101 2.973 -13.456 12.000 819 HG3 ARG 101 HG1 ARG 101 2.751 -12.518 10.528 820 HD2 ARG 101 HD2 ARG 101 2.167 -14.751 10.049 821 HD3 ARG 101 HD1 ARG 101 3.720 -14.445 9.266 822 HE ARG 101 HE ARG 101 4.763 -15.620 11.201 823 HH11 ARG 101 HH11 ARG 101 1.408 -16.315 10.417 824 HH12 ARG 101 HH12 ARG 101 1.443 -17.896 11.131 825 HH21 ARG 101 HH21 ARG 101 4.788 -17.690 12.139 826 HH22 ARG 101 HH22 ARG 101 3.357 -18.668 12.104 827 H LEU 102 HN LEU 102 4.449 -10.056 10.238 828 HA LEU 102 HA LEU 102 1.839 -9.168 11.254 829 HB2 LEU 102 HB2 LEU 102 4.120 -7.509 10.858 830 HB3 LEU 102 HB1 LEU 102 3.140 -7.218 9.440 831 HG LEU 102 HG LEU 102 2.663 -5.536 11.105 832 HD11 LEU 102 HD11 LEU 102 0.764 -6.231 9.750 833 HD12 LEU 102 HD12 LEU 102 0.247 -5.737 11.357 834 HD13 LEU 102 HD13 LEU 102 0.324 -7.453 10.947 835 HD21 LEU 102 HD21 LEU 102 1.782 -6.057 13.335 836 HD22 LEU 102 HD22 LEU 102 3.391 -6.732 13.101 837 HD23 LEU 102 HD23 LEU 102 1.976 -7.785 13.020 838 H GLU 103 HN GLU 103 0.380 -10.093 10.024 839 HA GLU 103 HA GLU 103 0.846 -10.961 7.307 840 HB2 GLU 103 HB2 GLU 103 -0.592 -12.334 8.757 841 HB3 GLU 103 HB1 GLU 103 -1.669 -10.979 9.046 842 HG2 GLU 103 HG2 GLU 103 -2.714 -12.487 7.486 843 HG3 GLU 103 HG1 GLU 103 -2.309 -10.987 6.649 844 H ILE 104 HN ILE 104 1.197 -9.175 6.078 845 HA ILE 104 HA ILE 104 -0.653 -6.923 6.044 846 HB ILE 104 HB ILE 104 1.727 -7.405 4.186 847 HG12 ILE 104 HG12 ILE 104 2.582 -7.496 6.503 848 HG13 ILE 104 HG11 ILE 104 3.109 -6.015 5.716 849 HG21 ILE 104 HG21 ILE 104 1.699 -4.936 3.934 850 HG22 ILE 104 HG22 ILE 104 0.273 -4.854 4.973 851 HG23 ILE 104 HG23 ILE 104 0.186 -5.683 3.419 852 HD11 ILE 104 HD11 ILE 104 2.483 -5.595 7.990 853 HD12 ILE 104 HD12 ILE 104 0.877 -6.271 7.728 854 HD13 ILE 104 HD13 ILE 104 1.354 -4.774 6.913 855 H LEU 105 HN LEU 105 -2.562 -7.677 5.188 856 HA LEU 105 HA LEU 105 -2.648 -9.292 2.786 857 HB2 LEU 105 HB2 LEU 105 -5.157 -8.965 2.888 858 HB3 LEU 105 HB1 LEU 105 -4.449 -9.825 4.239 859 HG LEU 105 HG LEU 105 -5.106 -6.860 4.471 860 HD11 LEU 105 HD11 LEU 105 -7.177 -7.946 3.730 861 HD12 LEU 105 HD12 LEU 105 -7.301 -7.437 5.412 862 HD13 LEU 105 HD13 LEU 105 -7.040 -9.142 5.021 863 HD21 LEU 105 HD21 LEU 105 -3.704 -7.799 6.241 864 HD22 LEU 105 HD22 LEU 105 -4.882 -9.081 6.539 865 HD23 LEU 105 HD23 LEU 105 -5.297 -7.397 6.875 866 H CYS 106 HN CYS 106 -3.065 -8.591 0.804 867 HA CYS 106 HA CYS 106 -3.321 -5.780 0.126 868 HB2 CYS 106 HB2 CYS 106 -0.726 -7.261 -0.541 869 HB3 CYS 106 HB1 CYS 106 -1.177 -5.661 -1.130 870 HG CYS 106 HG CYS 106 -0.277 -6.579 2.013 871 H ARG 107 HN ARG 107 -3.205 -5.561 -2.305 872 HA ARG 107 HA ARG 107 -3.749 -8.037 -3.826 873 HB2 ARG 107 HB2 ARG 107 -5.889 -6.796 -3.162 874 HB3 ARG 107 HB1 ARG 107 -5.323 -5.440 -4.134 875 HG2 ARG 107 HG2 ARG 107 -5.373 -6.914 -6.151 876 HG3 ARG 107 HG1 ARG 107 -6.005 -8.225 -5.144 877 HD2 ARG 107 HD2 ARG 107 -7.921 -6.660 -4.527 878 HD3 ARG 107 HD1 ARG 107 -7.334 -5.576 -5.793 879 HE ARG 107 HE ARG 107 -7.729 -8.188 -6.825 880 HH11 ARG 107 HH11 ARG 107 -9.562 -5.370 -5.819 881 HH12 ARG 107 HH12 ARG 107 -10.939 -5.771 -6.797 882 HH21 ARG 107 HH21 ARG 107 -9.586 -8.732 -8.048 883 HH22 ARG 107 HH22 ARG 107 -10.964 -7.680 -8.020 884 H GLU 108 HN GLU 108 -3.021 -7.922 -6.047 885 HA GLU 108 HA GLU 108 -0.890 -6.553 -6.851 886 HB2 GLU 108 HB2 GLU 108 -1.947 -8.364 -8.147 887 HB3 GLU 108 HB1 GLU 108 -3.247 -7.277 -8.640 888 HG2 GLU 108 HG2 GLU 108 -1.615 -5.875 -9.845 889 HG3 GLU 108 HG1 GLU 108 -0.310 -6.939 -9.324 890 H GLY 109 HN GLY 109 -0.297 -4.537 -7.334 891 HA2 GLY 109 HA2 GLY 109 -2.248 -2.361 -7.244 892 HA3 GLY 109 HA1 GLY 109 -0.502 -2.221 -7.145 893 H ALA 110 HN ALA 110 -2.654 -3.712 -9.507 894 HA ALA 110 HA ALA 110 -1.657 -1.896 -11.629 895 HB1 ALA 110 HB1 ALA 110 -2.064 -3.733 -13.235 896 HB2 ALA 110 HB2 ALA 110 -2.539 -4.801 -11.908 897 HB3 ALA 110 HB3 ALA 110 -0.882 -4.201 -12.012 898 H GLU 111 HN GLU 111 -3.216 -0.928 -12.897 899 HA GLU 111 HA GLU 111 -5.933 -0.858 -11.943 900 HB2 GLU 111 HB2 GLU 111 -4.679 0.367 -14.440 901 HB3 GLU 111 HB1 GLU 111 -6.301 0.724 -13.839 902 HG2 GLU 111 HG2 GLU 111 -5.301 1.601 -11.738 903 HG3 GLU 111 HG1 GLU 111 -3.693 1.299 -12.394 904 H LYS 112 HN LYS 112 -4.209 -2.514 -14.496 905 HA LYS 112 HA LYS 112 -6.557 -4.201 -15.044 906 HB2 LYS 112 HB2 LYS 112 -6.351 -2.478 -16.883 907 HB3 LYS 112 HB1 LYS 112 -4.729 -3.064 -17.221 908 HG2 LYS 112 HG2 LYS 112 -5.633 -5.257 -17.890 909 HG3 LYS 112 HG1 LYS 112 -7.268 -4.718 -17.490 910 HD2 LYS 112 HD2 LYS 112 -7.072 -2.933 -19.242 911 HD3 LYS 112 HD1 LYS 112 -5.477 -3.557 -19.665 912 HE2 LYS 112 HE2 LYS 112 -8.072 -5.131 -19.889 913 HE3 LYS 112 HE1 LYS 112 -7.269 -4.312 -21.227 914 HZ1 LYS 112 HZ1 LYS 112 -6.117 -6.542 -19.633 915 HZ2 LYS 112 HZ2 LYS 112 -5.360 -5.759 -20.925 916 HZ3 LYS 112 HZ3 LYS 112 -6.758 -6.666 -21.191 Start of MODEL 12 1 H1 MET 1 HT1 MET 1 5.582 -27.528 5.789 2 H2 MET 1 HT2 MET 1 4.746 -27.590 7.254 3 H3 MET 1 HT3 MET 1 6.191 -28.441 7.075 4 HA MET 1 HA MET 1 6.515 -26.474 8.390 5 HB2 MET 1 HB2 MET 1 7.796 -26.274 5.625 6 HB3 MET 1 HB1 MET 1 8.382 -25.460 7.073 7 HG2 MET 1 HG2 MET 1 8.265 -28.462 6.667 8 HG3 MET 1 HG1 MET 1 9.707 -27.458 6.534 9 HE1 MET 1 HE1 MET 1 9.466 -25.430 9.002 10 HE2 MET 1 HE2 MET 1 10.938 -26.324 8.612 11 HE3 MET 1 HE3 MET 1 10.300 -26.348 10.255 12 H ASN 2 HN ASN 2 5.267 -24.802 8.903 13 HA ASN 2 HA ASN 2 3.634 -23.211 7.220 14 HB2 ASN 2 HB2 ASN 2 3.403 -23.468 9.723 15 HB3 ASN 2 HB1 ASN 2 4.862 -22.519 9.936 16 HD21 ASN 2 HD21 ASN 2 2.183 -22.053 10.971 17 HD22 ASN 2 HD22 ASN 2 1.684 -20.499 10.409 18 H ILE 3 HN ILE 3 3.995 -21.037 6.451 19 HA ILE 3 HA ILE 3 6.693 -20.484 5.517 20 HB ILE 3 HB ILE 3 5.613 -18.652 4.211 21 HG12 ILE 3 HG12 ILE 3 2.994 -19.543 5.525 22 HG13 ILE 3 HG11 ILE 3 3.816 -18.023 5.845 23 HG21 ILE 3 HG21 ILE 3 4.139 -21.300 3.965 24 HG22 ILE 3 HG22 ILE 3 5.716 -20.928 3.265 25 HG23 ILE 3 HG23 ILE 3 4.279 -20.069 2.706 26 HD11 ILE 3 HD11 ILE 3 2.556 -18.859 3.236 27 HD12 ILE 3 HD12 ILE 3 3.431 -17.350 3.506 28 HD13 ILE 3 HD13 ILE 3 1.937 -17.673 4.385 29 H GLY 4 HN GLY 4 6.416 -20.193 8.396 30 HA2 GLY 4 HA2 GLY 4 6.143 -17.379 9.097 31 HA3 GLY 4 HA1 GLY 4 6.457 -18.719 10.182 32 H ARG 5 HN ARG 5 8.250 -17.534 7.336 33 HA ARG 5 HA ARG 5 10.420 -16.468 8.981 34 HB2 ARG 5 HB2 ARG 5 12.176 -17.688 7.764 35 HB3 ARG 5 HB1 ARG 5 11.094 -18.815 8.575 36 HG2 ARG 5 HG2 ARG 5 9.946 -19.221 6.383 37 HG3 ARG 5 HG1 ARG 5 11.137 -18.172 5.604 38 HD2 ARG 5 HD2 ARG 5 11.738 -20.756 7.098 39 HD3 ARG 5 HD1 ARG 5 11.730 -20.557 5.345 40 HE ARG 5 HE ARG 5 13.593 -18.889 5.739 41 HH11 ARG 5 HH11 ARG 5 13.142 -21.602 7.931 42 HH12 ARG 5 HH12 ARG 5 14.817 -21.667 8.377 43 HH21 ARG 5 HH21 ARG 5 15.775 -18.969 6.372 44 HH22 ARG 5 HH22 ARG 5 16.306 -20.175 7.500 45 H LEU 6 HN LEU 6 12.084 -15.394 7.413 46 HA LEU 6 HA LEU 6 10.559 -13.918 5.324 47 HB2 LEU 6 HB2 LEU 6 12.874 -12.848 6.986 48 HB3 LEU 6 HB1 LEU 6 11.840 -11.941 5.895 49 HG LEU 6 HG LEU 6 11.024 -13.147 8.564 50 HD11 LEU 6 HD11 LEU 6 10.709 -10.834 9.304 51 HD12 LEU 6 HD12 LEU 6 11.283 -10.240 7.744 52 HD13 LEU 6 HD13 LEU 6 12.374 -11.129 8.809 53 HD21 LEU 6 HD21 LEU 6 9.164 -13.334 6.988 54 HD22 LEU 6 HD22 LEU 6 9.292 -11.620 6.597 55 HD23 LEU 6 HD23 LEU 6 8.817 -12.123 8.221 56 H ARG 7 HN ARG 7 11.283 -14.256 3.317 57 HA ARG 7 HA ARG 7 14.094 -15.140 2.872 58 HB2 ARG 7 HB2 ARG 7 13.296 -16.693 1.163 59 HB3 ARG 7 HB1 ARG 7 12.492 -17.030 2.690 60 HG2 ARG 7 HG2 ARG 7 10.451 -15.921 1.906 61 HG3 ARG 7 HG1 ARG 7 11.253 -15.462 0.405 62 HD2 ARG 7 HD2 ARG 7 11.564 -17.922 -0.076 63 HD3 ARG 7 HD1 ARG 7 10.547 -18.255 1.331 64 HE ARG 7 HE ARG 7 9.349 -16.474 -0.612 65 HH11 ARG 7 HH11 ARG 7 9.734 -19.833 0.358 66 HH12 ARG 7 HH12 ARG 7 8.393 -20.380 -0.593 67 HH21 ARG 7 HH21 ARG 7 7.605 -17.245 -1.870 68 HH22 ARG 7 HH22 ARG 7 7.195 -18.929 -1.830 69 H ASP 8 HN ASP 8 11.417 -13.140 1.747 70 HA ASP 8 HA ASP 8 12.879 -12.239 -0.647 71 HB2 ASP 8 HB2 ASP 8 9.973 -11.765 0.184 72 HB3 ASP 8 HB1 ASP 8 10.704 -11.254 -1.333 73 H ARG 9 HN ARG 9 12.027 -9.755 -0.998 74 HA ARG 9 HA ARG 9 12.336 -8.179 1.478 75 HB2 ARG 9 HB2 ARG 9 13.862 -7.581 -1.104 76 HB3 ARG 9 HB1 ARG 9 13.897 -6.618 0.374 77 HG2 ARG 9 HG2 ARG 9 15.017 -8.433 1.568 78 HG3 ARG 9 HG1 ARG 9 14.891 -9.478 0.151 79 HD2 ARG 9 HD2 ARG 9 16.296 -7.732 -1.090 80 HD3 ARG 9 HD1 ARG 9 16.593 -6.995 0.497 81 HE ARG 9 HE ARG 9 17.166 -9.776 0.567 82 HH11 ARG 9 HH11 ARG 9 18.560 -6.754 -0.584 83 HH12 ARG 9 HH12 ARG 9 20.173 -7.388 -0.655 84 HH21 ARG 9 HH21 ARG 9 19.282 -10.579 0.476 85 HH22 ARG 9 HH22 ARG 9 20.579 -9.547 -0.019 86 H ILE 10 HN ILE 10 11.209 -6.315 1.512 87 HA ILE 10 HA ILE 10 9.632 -5.413 -0.825 88 HB ILE 10 HB ILE 10 7.676 -4.989 0.638 89 HG12 ILE 10 HG12 ILE 10 9.168 -6.524 2.828 90 HG13 ILE 10 HG11 ILE 10 8.976 -4.778 2.799 91 HG21 ILE 10 HG21 ILE 10 8.521 -7.911 0.680 92 HG22 ILE 10 HG22 ILE 10 7.706 -7.075 -0.643 93 HG23 ILE 10 HG23 ILE 10 6.874 -7.311 0.894 94 HD11 ILE 10 HD11 ILE 10 6.748 -6.791 3.033 95 HD12 ILE 10 HD12 ILE 10 6.556 -5.036 3.015 96 HD13 ILE 10 HD13 ILE 10 7.430 -5.814 4.333 97 H THR 11 HN THR 11 8.749 -3.133 -0.349 98 HA THR 11 HA THR 11 10.538 -1.565 1.391 99 HB THR 11 HB THR 11 9.818 -0.600 -1.422 100 HG1 THR 11 HG1 THR 11 11.130 -2.574 -1.416 101 HG21 THR 11 HG21 THR 11 11.704 0.939 -1.083 102 HG22 THR 11 HG22 THR 11 12.054 0.205 0.485 103 HG23 THR 11 HG23 THR 11 10.556 1.119 0.249 104 H ILE 12 HN ILE 12 9.500 -0.022 2.495 105 HA ILE 12 HA ILE 12 6.609 0.237 2.288 106 HB ILE 12 HB ILE 12 8.560 1.653 4.159 107 HG12 ILE 12 HG12 ILE 12 8.580 -0.756 4.552 108 HG13 ILE 12 HG11 ILE 12 7.757 0.042 5.893 109 HG21 ILE 12 HG21 ILE 12 6.520 2.982 3.944 110 HG22 ILE 12 HG22 ILE 12 6.567 2.227 5.538 111 HG23 ILE 12 HG23 ILE 12 5.522 1.564 4.279 112 HD11 ILE 12 HD11 ILE 12 6.441 -1.469 3.633 113 HD12 ILE 12 HD12 ILE 12 5.585 -0.613 4.919 114 HD13 ILE 12 HD13 ILE 12 6.612 -1.989 5.310 115 H GLN 13 HN GLN 13 5.802 1.537 0.795 116 HA GLN 13 HA GLN 13 7.004 4.098 0.089 117 HB2 GLN 13 HB2 GLN 13 4.390 2.845 -0.879 118 HB3 GLN 13 HB1 GLN 13 5.123 4.329 -1.502 119 HG2 GLN 13 HG2 GLN 13 7.109 2.934 -2.204 120 HG3 GLN 13 HG1 GLN 13 6.184 1.494 -1.760 121 HE21 GLN 13 HE21 GLN 13 7.185 2.224 -4.368 122 HE22 GLN 13 HE22 GLN 13 5.828 2.347 -5.420 123 H THR 14 HN THR 14 6.822 5.427 1.579 124 HA THR 14 HA THR 14 4.610 5.646 3.443 125 HB THR 14 HB THR 14 6.985 7.542 3.173 126 HG1 THR 14 HG1 THR 14 6.884 4.883 4.071 127 HG21 THR 14 HG21 THR 14 5.210 8.192 4.770 128 HG22 THR 14 HG22 THR 14 6.715 7.781 5.595 129 HG23 THR 14 HG23 THR 14 5.375 6.632 5.578 130 H LEU 15 HN LEU 15 3.054 7.416 3.458 131 HA LEU 15 HA LEU 15 2.687 8.612 0.812 132 HB2 LEU 15 HB2 LEU 15 0.782 7.406 1.823 133 HB3 LEU 15 HB1 LEU 15 0.815 8.489 3.205 134 HG LEU 15 HG LEU 15 0.235 10.402 1.718 135 HD11 LEU 15 HD11 LEU 15 -0.039 8.344 -0.480 136 HD12 LEU 15 HD12 LEU 15 1.150 9.641 -0.399 137 HD13 LEU 15 HD13 LEU 15 -0.555 10.026 -0.572 138 HD21 LEU 15 HD21 LEU 15 -1.542 9.249 2.918 139 HD22 LEU 15 HD22 LEU 15 -1.743 8.118 1.577 140 HD23 LEU 15 HD23 LEU 15 -2.115 9.830 1.357 141 H LYS 16 HN LYS 16 3.999 10.356 0.704 142 HA LYS 16 HA LYS 16 4.346 12.283 2.794 143 HB2 LYS 16 HB2 LYS 16 6.037 11.513 1.002 144 HB3 LYS 16 HB1 LYS 16 5.149 12.512 -0.142 145 HG2 LYS 16 HG2 LYS 16 5.705 14.517 1.106 146 HG3 LYS 16 HG1 LYS 16 6.414 13.553 2.406 147 HD2 LYS 16 HD2 LYS 16 8.005 12.653 0.482 148 HD3 LYS 16 HD1 LYS 16 7.508 14.130 -0.356 149 HE2 LYS 16 HE2 LYS 16 9.602 14.484 0.875 150 HE3 LYS 16 HE1 LYS 16 8.312 15.467 1.566 151 HZ1 LYS 16 HZ1 LYS 16 9.247 12.861 2.654 152 HZ2 LYS 16 HZ2 LYS 16 8.042 13.837 3.322 153 HZ3 LYS 16 HZ3 LYS 16 9.642 14.384 3.276 154 H GLN 17 HN GLN 17 2.489 13.404 3.265 155 HA GLN 17 HA GLN 17 0.814 14.549 1.114 156 HB2 GLN 17 HB2 GLN 17 0.305 14.346 4.129 157 HB3 GLN 17 HB1 GLN 17 -0.826 15.009 2.947 158 HG2 GLN 17 HG2 GLN 17 -0.977 12.796 1.864 159 HG3 GLN 17 HG1 GLN 17 0.164 12.141 3.038 160 HE21 GLN 17 HE21 GLN 17 -3.089 13.320 2.550 161 HE22 GLN 17 HE22 GLN 17 -3.754 12.709 4.022 162 H THR 18 HN THR 18 2.397 16.115 0.518 163 HA THR 18 HA THR 18 3.201 18.128 2.517 164 HB THR 18 HB THR 18 4.295 17.667 -0.301 165 HG1 THR 18 HG1 THR 18 4.715 16.343 1.995 166 HG21 THR 18 HG21 THR 18 4.650 20.000 0.458 167 HG22 THR 18 HG22 THR 18 6.175 19.107 0.431 168 HG23 THR 18 HG23 THR 18 5.356 19.404 1.965 169 H ARG 19 HN ARG 19 2.333 20.091 2.486 170 HA ARG 19 HA ARG 19 0.132 20.710 0.760 171 HB2 ARG 19 HB2 ARG 19 0.240 21.125 3.247 172 HB3 ARG 19 HB1 ARG 19 1.391 22.414 2.940 173 HG2 ARG 19 HG2 ARG 19 -0.313 23.689 1.714 174 HG3 ARG 19 HG1 ARG 19 -1.465 22.365 1.901 175 HD2 ARG 19 HD2 ARG 19 -1.937 24.137 3.516 176 HD3 ARG 19 HD1 ARG 19 -1.414 22.677 4.356 177 HE ARG 19 HE ARG 19 0.902 23.983 4.146 178 HH11 ARG 19 HH11 ARG 19 -2.220 25.216 5.208 179 HH12 ARG 19 HH12 ARG 19 -1.515 26.411 6.248 180 HH21 ARG 19 HH21 ARG 19 1.799 25.561 5.481 181 HH22 ARG 19 HH22 ARG 19 0.766 26.611 6.396 182 H ASP 20 HN ASP 20 -0.082 22.970 -0.198 183 HA ASP 20 HA ASP 20 2.372 23.617 -1.766 184 HB2 ASP 20 HB2 ASP 20 0.368 22.461 -2.944 185 HB3 ASP 20 HB1 ASP 20 -0.515 23.950 -2.697 186 H ILE 21 HN ILE 21 2.504 25.927 -2.514 187 HA ILE 21 HA ILE 21 1.853 27.904 -0.660 188 HB ILE 21 HB ILE 21 3.685 28.033 -2.337 189 HG12 ILE 21 HG12 ILE 21 1.797 30.430 -2.532 190 HG13 ILE 21 HG11 ILE 21 2.893 30.117 -1.191 191 HG21 ILE 21 HG21 ILE 21 3.248 28.699 -4.672 192 HG22 ILE 21 HG22 ILE 21 1.511 28.581 -4.390 193 HG23 ILE 21 HG23 ILE 21 2.520 27.134 -4.298 194 HD11 ILE 21 HD11 ILE 21 3.703 30.707 -4.040 195 HD12 ILE 21 HD12 ILE 21 4.806 30.394 -2.695 196 HD13 ILE 21 HD13 ILE 21 3.768 31.819 -2.675 197 H THR 22 HN THR 22 -0.358 26.373 -2.816 198 HA THR 22 HA THR 22 -2.133 28.718 -3.043 199 HB THR 22 HB THR 22 -3.335 27.361 -4.771 200 HG1 THR 22 HG1 THR 22 -1.289 25.490 -5.010 201 HG21 THR 22 HG21 THR 22 -1.644 27.422 -6.572 202 HG22 THR 22 HG22 THR 22 -0.354 27.548 -5.376 203 HG23 THR 22 HG23 THR 22 -1.517 28.865 -5.563 204 H GLY 23 HN GLY 23 -1.482 25.703 -1.621 205 HA2 GLY 23 HA2 GLY 23 -2.387 25.006 0.473 206 HA3 GLY 23 HA1 GLY 23 -3.896 25.813 0.083 207 H GLU 24 HN GLU 24 -2.061 23.545 -1.962 208 HA GLU 24 HA GLU 24 -4.297 21.652 -1.998 209 HB2 GLU 24 HB2 GLU 24 -1.725 21.835 -3.658 210 HB3 GLU 24 HB1 GLU 24 -2.983 20.620 -3.870 211 HG2 GLU 24 HG2 GLU 24 -3.385 23.601 -4.250 212 HG3 GLU 24 HG1 GLU 24 -3.044 22.459 -5.548 213 H ILE 25 HN ILE 25 -3.967 19.493 -1.300 214 HA ILE 25 HA ILE 25 -1.523 18.947 0.277 215 HB ILE 25 HB ILE 25 -4.149 17.378 0.198 216 HG12 ILE 25 HG12 ILE 25 -4.485 19.587 1.233 217 HG13 ILE 25 HG11 ILE 25 -4.591 18.331 2.456 218 HG21 ILE 25 HG21 ILE 25 -3.283 16.173 2.180 219 HG22 ILE 25 HG22 ILE 25 -1.752 17.039 2.048 220 HG23 ILE 25 HG23 ILE 25 -2.250 15.925 0.772 221 HD11 ILE 25 HD11 ILE 25 -2.229 20.157 1.979 222 HD12 ILE 25 HD12 ILE 25 -2.320 18.891 3.207 223 HD13 ILE 25 HD13 ILE 25 -3.412 20.273 3.285 224 H LEU 26 HN LEU 26 0.022 18.242 -1.151 225 HA LEU 26 HA LEU 26 -0.617 16.581 -3.458 226 HB2 LEU 26 HB2 LEU 26 2.051 17.702 -2.485 227 HB3 LEU 26 HB1 LEU 26 1.875 16.708 -3.917 228 HG LEU 26 HG LEU 26 2.114 18.986 -4.618 229 HD11 LEU 26 HD11 LEU 26 0.549 17.667 -5.933 230 HD12 LEU 26 HD12 LEU 26 0.116 19.372 -5.939 231 HD13 LEU 26 HD13 LEU 26 -0.797 18.240 -4.940 232 HD21 LEU 26 HD21 LEU 26 -0.217 19.756 -2.845 233 HD22 LEU 26 HD22 LEU 26 0.659 20.821 -3.949 234 HD23 LEU 26 HD23 LEU 26 1.487 20.132 -2.557 235 H GLU 27 HN GLU 27 -1.268 14.673 -2.613 236 HA GLU 27 HA GLU 27 0.253 13.185 -0.645 237 HB2 GLU 27 HB2 GLU 27 -2.208 12.366 -2.262 238 HB3 GLU 27 HB1 GLU 27 -1.553 11.513 -0.856 239 HG2 GLU 27 HG2 GLU 27 -2.050 13.448 0.567 240 HG3 GLU 27 HG1 GLU 27 -2.646 14.342 -0.824 241 H THR 28 HN THR 28 2.027 12.217 -1.282 242 HA THR 28 HA THR 28 2.301 10.999 -3.971 243 HB THR 28 HB THR 28 4.734 11.809 -3.944 244 HG1 THR 28 HG1 THR 28 3.718 13.282 -1.741 245 HG21 THR 28 HG21 THR 28 2.645 14.016 -4.022 246 HG22 THR 28 HG22 THR 28 3.015 12.915 -5.352 247 HG23 THR 28 HG23 THR 28 4.239 14.059 -4.786 248 H TRP 29 HN TRP 29 4.277 9.467 -4.000 249 HA TRP 29 HA TRP 29 4.317 7.956 -1.448 250 HB2 TRP 29 HB2 TRP 29 4.296 6.867 -4.298 251 HB3 TRP 29 HB1 TRP 29 4.494 5.878 -2.848 252 HD1 TRP 29 HD1 TRP 29 1.823 7.566 -4.941 253 HE1 TRP 29 HE1 TRP 29 -0.487 7.089 -3.919 254 HE3 TRP 29 HE3 TRP 29 3.321 5.505 -0.520 255 HZ2 TRP 29 HZ2 TRP 29 -1.534 5.993 -1.527 256 HZ3 TRP 29 HZ3 TRP 29 1.614 4.774 1.087 257 HH2 TRP 29 HH2 TRP 29 -0.771 5.013 0.597 258 H GLU 30 HN GLU 30 6.125 8.438 -0.576 259 HA GLU 30 HA GLU 30 8.635 8.716 -2.071 260 HB2 GLU 30 HB2 GLU 30 9.648 9.383 0.117 261 HB3 GLU 30 HB1 GLU 30 8.308 10.410 -0.370 262 HG2 GLU 30 HG2 GLU 30 6.849 9.435 1.266 263 HG3 GLU 30 HG1 GLU 30 8.009 8.162 1.634 264 H ASP 31 HN ASP 31 9.839 7.037 -2.436 265 HA ASP 31 HA ASP 31 9.603 4.422 -1.427 266 HB2 ASP 31 HB2 ASP 31 10.780 4.816 -3.521 267 HB3 ASP 31 HB1 ASP 31 11.947 5.876 -2.736 268 H GLY 32 HN GLY 32 10.387 3.476 0.448 269 HA2 GLY 32 HA2 GLY 32 11.647 5.333 2.399 270 HA3 GLY 32 HA1 GLY 32 10.476 4.078 2.792 271 H HIS 33 HN HIS 33 11.252 2.183 3.513 272 HA HIS 33 HA HIS 33 14.127 1.583 3.121 273 HB2 HIS 33 HB2 HIS 33 12.499 1.103 5.638 274 HB3 HIS 33 HB1 HIS 33 14.171 0.620 5.403 275 HD1 HIS 33 HD1 HIS 33 15.908 2.291 6.069 276 HD2 HIS 33 HD2 HIS 33 12.138 3.991 5.750 277 HE1 HIS 33 HE1 HIS 33 16.149 4.623 6.966 278 HE2 HIS 33 HE2 HIS 33 13.893 5.684 6.604 279 H THR 34 HN THR 34 14.625 -0.395 2.418 280 HA THR 34 HA THR 34 12.535 -2.291 1.802 281 HB THR 34 HB THR 34 15.543 -2.443 1.295 282 HG1 THR 34 HG1 THR 34 13.389 -1.413 -0.270 283 HG21 THR 34 HG21 THR 34 14.374 -4.644 1.162 284 HG22 THR 34 HG22 THR 34 14.956 -4.106 -0.417 285 HG23 THR 34 HG23 THR 34 13.245 -3.948 -0.007 286 H LEU 35 HN LEU 35 11.881 -3.536 3.453 287 HA LEU 35 HA LEU 35 13.798 -4.588 5.422 288 HB2 LEU 35 HB2 LEU 35 11.951 -4.855 6.973 289 HB3 LEU 35 HB1 LEU 35 12.033 -3.196 6.428 290 HG LEU 35 HG LEU 35 10.015 -5.165 5.266 291 HD11 LEU 35 HD11 LEU 35 9.556 -3.323 7.642 292 HD12 LEU 35 HD12 LEU 35 9.641 -5.087 7.692 293 HD13 LEU 35 HD13 LEU 35 8.330 -4.297 6.821 294 HD21 LEU 35 HD21 LEU 35 10.178 -2.133 5.278 295 HD22 LEU 35 HD22 LEU 35 8.748 -3.039 4.775 296 HD23 LEU 35 HD23 LEU 35 10.249 -3.214 3.884 297 H TRP 36 HN TRP 36 13.236 -6.702 6.321 298 HA TRP 36 HA TRP 36 13.130 -8.638 4.204 299 HB2 TRP 36 HB2 TRP 36 13.120 -9.355 7.151 300 HB3 TRP 36 HB1 TRP 36 13.810 -10.261 5.809 301 HD1 TRP 36 HD1 TRP 36 15.098 -8.773 8.667 302 HE1 TRP 36 HE1 TRP 36 17.387 -7.648 8.371 303 HE3 TRP 36 HE3 TRP 36 15.185 -8.332 3.541 304 HZ2 TRP 36 HZ2 TRP 36 19.008 -6.713 6.294 305 HZ3 TRP 36 HZ3 TRP 36 17.164 -7.300 2.495 306 HH2 TRP 36 HH2 TRP 36 19.034 -6.506 3.847 307 H ALA 37 HN ALA 37 11.500 -9.796 3.538 308 HA ALA 37 HA ALA 37 9.117 -10.372 5.167 309 HB1 ALA 37 HB1 ALA 37 7.570 -9.613 3.403 310 HB2 ALA 37 HB2 ALA 37 8.939 -9.059 2.430 311 HB3 ALA 37 HB3 ALA 37 8.578 -8.281 3.970 312 H SER 38 HN SER 38 7.564 -11.864 3.802 313 HA SER 38 HA SER 38 8.887 -13.213 1.542 314 HB2 SER 38 HB2 SER 38 7.121 -14.467 3.696 315 HB3 SER 38 HB1 SER 38 7.669 -15.290 2.228 316 HG SER 38 HG SER 38 9.107 -14.494 4.488 317 H VAL 39 HN VAL 39 7.837 -12.406 -0.174 318 HA VAL 39 HA VAL 39 4.994 -11.622 0.037 319 HB VAL 39 HB VAL 39 6.316 -9.662 -0.404 320 HG11 VAL 39 HG11 VAL 39 8.417 -10.719 -1.112 321 HG12 VAL 39 HG12 VAL 39 7.952 -9.437 -2.227 322 HG13 VAL 39 HG13 VAL 39 7.708 -11.128 -2.676 323 HG21 VAL 39 HG21 VAL 39 5.499 -8.878 -2.597 324 HG22 VAL 39 HG22 VAL 39 4.249 -9.800 -1.761 325 HG23 VAL 39 HG23 VAL 39 5.151 -10.540 -3.085 326 H ASN 40 HN ASN 40 3.712 -13.051 -0.852 327 HA ASN 40 HA ASN 40 4.289 -14.317 -3.455 328 HB2 ASN 40 HB2 ASN 40 3.191 -15.675 -0.934 329 HB3 ASN 40 HB1 ASN 40 3.074 -16.382 -2.545 330 HD21 ASN 40 HD21 ASN 40 5.261 -15.525 0.067 331 HD22 ASN 40 HD22 ASN 40 6.578 -16.491 -0.484 332 H MET 41 HN MET 41 2.383 -14.713 -4.702 333 HA MET 41 HA MET 41 -0.049 -13.282 -3.915 334 HB2 MET 41 HB2 MET 41 0.448 -15.009 -6.385 335 HB3 MET 41 HB1 MET 41 -0.908 -13.915 -6.126 336 HG2 MET 41 HG2 MET 41 0.708 -12.015 -6.105 337 HG3 MET 41 HG1 MET 41 1.997 -13.155 -6.497 338 HE1 MET 41 HE1 MET 41 -1.743 -12.589 -7.773 339 HE2 MET 41 HE2 MET 41 -1.402 -11.839 -9.331 340 HE3 MET 41 HE3 MET 41 -0.954 -11.011 -7.843 341 H VAL 42 HN VAL 42 -1.866 -14.294 -3.127 342 HA VAL 42 HA VAL 42 -1.739 -16.963 -2.134 343 HB VAL 42 HB VAL 42 -4.028 -16.682 -1.367 344 HG11 VAL 42 HG11 VAL 42 -2.488 -14.096 -0.957 345 HG12 VAL 42 HG12 VAL 42 -2.306 -15.577 -0.014 346 HG13 VAL 42 HG13 VAL 42 -3.820 -14.671 0.053 347 HG21 VAL 42 HG21 VAL 42 -5.074 -15.646 -3.312 348 HG22 VAL 42 HG22 VAL 42 -4.177 -14.153 -3.039 349 HG23 VAL 42 HG23 VAL 42 -5.395 -14.675 -1.876 350 H SER 43 HN SER 43 -2.615 -18.808 -2.914 351 HA SER 43 HA SER 43 -3.326 -18.887 -5.763 352 HB2 SER 43 HB2 SER 43 -2.459 -21.094 -3.852 353 HB3 SER 43 HB1 SER 43 -2.654 -21.262 -5.600 354 HG SER 43 HG SER 43 -1.024 -19.177 -5.018 355 H SER 44 HN SER 44 -4.670 -21.131 -6.075 356 HA SER 44 HA SER 44 -7.335 -20.601 -5.547 357 HB2 SER 44 HB2 SER 44 -7.701 -23.008 -6.273 358 HB3 SER 44 HB1 SER 44 -6.686 -22.057 -7.363 359 HG SER 44 HG SER 44 -5.106 -23.366 -6.980 360 H LYS 45 HN LYS 45 -5.058 -22.526 -3.665 361 HA LYS 45 HA LYS 45 -6.670 -23.873 -1.871 362 HB2 LYS 45 HB2 LYS 45 -4.190 -24.069 -1.996 363 HB3 LYS 45 HB1 LYS 45 -4.035 -22.467 -1.282 364 HG2 LYS 45 HG2 LYS 45 -5.317 -23.447 0.748 365 HG3 LYS 45 HG1 LYS 45 -4.985 -25.030 0.034 366 HD2 LYS 45 HD2 LYS 45 -2.924 -22.960 0.901 367 HD3 LYS 45 HD1 LYS 45 -3.298 -24.466 1.738 368 HE2 LYS 45 HE2 LYS 45 -2.403 -25.768 -0.121 369 HE3 LYS 45 HE1 LYS 45 -2.157 -24.302 -1.072 370 HZ1 LYS 45 HZ1 LYS 45 -0.110 -25.035 -0.081 371 HZ2 LYS 45 HZ2 LYS 45 -0.784 -24.977 1.468 372 HZ3 LYS 45 HZ3 LYS 45 -0.563 -23.550 0.588 373 H GLU 46 HN GLU 46 -5.357 -20.593 -1.541 374 HA GLU 46 HA GLU 46 -6.623 -19.994 0.935 375 HB2 GLU 46 HB2 GLU 46 -5.383 -18.137 -1.133 376 HB3 GLU 46 HB1 GLU 46 -5.851 -17.667 0.500 377 HG2 GLU 46 HG2 GLU 46 -3.674 -19.629 -0.278 378 HG3 GLU 46 HG1 GLU 46 -3.461 -18.023 0.417 379 H ALA 47 HN ALA 47 -7.378 -19.131 -2.454 380 HA ALA 47 HA ALA 47 -9.628 -17.547 -2.093 381 HB1 ALA 47 HB1 ALA 47 -9.113 -19.547 -4.319 382 HB2 ALA 47 HB2 ALA 47 -8.517 -17.886 -4.260 383 HB3 ALA 47 HB3 ALA 47 -10.250 -18.194 -4.391 384 H ILE 48 HN ILE 48 -9.519 -21.088 -2.359 385 HA ILE 48 HA ILE 48 -12.320 -21.562 -2.083 386 HB ILE 48 HB ILE 48 -9.970 -23.457 -1.650 387 HG12 ILE 48 HG12 ILE 48 -11.800 -23.250 -4.077 388 HG13 ILE 48 HG11 ILE 48 -10.231 -22.461 -3.977 389 HG21 ILE 48 HG21 ILE 48 -11.585 -25.323 -1.934 390 HG22 ILE 48 HG22 ILE 48 -12.910 -24.163 -1.935 391 HG23 ILE 48 HG23 ILE 48 -11.923 -24.368 -0.485 392 HD11 ILE 48 HD11 ILE 48 -10.688 -25.445 -3.840 393 HD12 ILE 48 HD12 ILE 48 -9.128 -24.617 -3.825 394 HD13 ILE 48 HD13 ILE 48 -10.154 -24.539 -5.256 395 H SER 49 HN SER 49 -9.676 -21.233 0.191 396 HA SER 49 HA SER 49 -10.942 -22.430 2.459 397 HB2 SER 49 HB2 SER 49 -8.457 -22.235 2.130 398 HB3 SER 49 HB1 SER 49 -8.583 -20.503 2.410 399 HG SER 49 HG SER 49 -8.491 -22.530 4.189 400 H SER 50 HN SER 50 -10.518 -19.055 1.354 401 HA SER 50 HA SER 50 -12.041 -18.041 3.683 402 HB2 SER 50 HB2 SER 50 -11.008 -15.836 3.106 403 HB3 SER 50 HB1 SER 50 -9.804 -17.080 3.440 404 HG SER 50 HG SER 50 -9.194 -17.070 1.409 405 H GLY 51 HN GLY 51 -12.672 -18.883 0.525 406 HA2 GLY 51 HA2 GLY 51 -14.753 -18.677 -0.540 407 HA3 GLY 51 HA1 GLY 51 -15.168 -17.324 0.505 408 H ALA 52 HN ALA 52 -13.777 -15.297 0.132 409 HA ALA 52 HA ALA 52 -12.787 -14.918 -2.608 410 HB1 ALA 52 HB1 ALA 52 -15.214 -14.489 -2.768 411 HB2 ALA 52 HB2 ALA 52 -14.288 -13.014 -3.054 412 HB3 ALA 52 HB3 ALA 52 -15.092 -13.272 -1.502 413 H GLU 53 HN GLU 53 -12.413 -14.364 0.650 414 HA GLU 53 HA GLU 53 -11.570 -11.665 0.812 415 HB2 GLU 53 HB2 GLU 53 -12.199 -13.003 2.786 416 HB3 GLU 53 HB1 GLU 53 -10.819 -14.064 2.535 417 HG2 GLU 53 HG2 GLU 53 -9.297 -12.135 2.955 418 HG3 GLU 53 HG1 GLU 53 -10.711 -11.124 3.272 419 H LEU 54 HN LEU 54 -9.747 -14.702 0.555 420 HA LEU 54 HA LEU 54 -7.385 -13.270 -0.522 421 HB2 LEU 54 HB2 LEU 54 -7.566 -16.010 0.818 422 HB3 LEU 54 HB1 LEU 54 -6.091 -15.272 0.200 423 HG LEU 54 HG LEU 54 -7.746 -14.207 2.533 424 HD11 LEU 54 HD11 LEU 54 -6.631 -16.296 3.104 425 HD12 LEU 54 HD12 LEU 54 -5.895 -14.943 3.957 426 HD13 LEU 54 HD13 LEU 54 -5.080 -15.651 2.558 427 HD21 LEU 54 HD21 LEU 54 -6.623 -12.388 1.328 428 HD22 LEU 54 HD22 LEU 54 -5.075 -13.231 1.446 429 HD23 LEU 54 HD23 LEU 54 -5.878 -12.639 2.905 430 H ALA 55 HN ALA 55 -9.037 -13.338 -2.397 431 HA ALA 55 HA ALA 55 -9.312 -15.819 -3.854 432 HB1 ALA 55 HB1 ALA 55 -10.525 -14.430 -5.515 433 HB2 ALA 55 HB2 ALA 55 -10.095 -12.975 -4.607 434 HB3 ALA 55 HB3 ALA 55 -11.160 -14.180 -3.886 435 H ILE 56 HN ILE 56 -8.469 -15.938 -6.110 436 HA ILE 56 HA ILE 56 -5.685 -15.626 -5.948 437 HB ILE 56 HB ILE 56 -7.356 -16.247 -8.439 438 HG12 ILE 56 HG12 ILE 56 -6.040 -18.205 -6.495 439 HG13 ILE 56 HG11 ILE 56 -7.758 -17.825 -6.537 440 HG21 ILE 56 HG21 ILE 56 -5.069 -15.591 -9.072 441 HG22 ILE 56 HG22 ILE 56 -5.328 -17.305 -9.372 442 HG23 ILE 56 HG23 ILE 56 -4.400 -16.795 -7.962 443 HD11 ILE 56 HD11 ILE 56 -6.198 -19.158 -8.757 444 HD12 ILE 56 HD12 ILE 56 -7.923 -18.768 -8.787 445 HD13 ILE 56 HD13 ILE 56 -7.302 -19.935 -7.625 446 H GLY 57 HN GLY 57 -4.393 -13.947 -6.511 447 HA2 GLY 57 HA2 GLY 57 -3.792 -12.072 -7.973 448 HA3 GLY 57 HA1 GLY 57 -5.490 -11.604 -8.014 449 H THR 58 HN THR 58 -5.438 -12.467 -5.036 450 HA THR 58 HA THR 58 -4.622 -9.991 -3.781 451 HB THR 58 HB THR 58 -5.627 -12.631 -2.608 452 HG1 THR 58 HG1 THR 58 -7.257 -11.713 -3.761 453 HG21 THR 58 HG21 THR 58 -4.396 -11.380 -0.880 454 HG22 THR 58 HG22 THR 58 -6.126 -11.382 -0.540 455 HG23 THR 58 HG23 THR 58 -5.367 -9.940 -1.218 456 H VAL 59 HN VAL 59 -2.736 -9.739 -2.537 457 HA VAL 59 HA VAL 59 -0.654 -11.810 -2.872 458 HB VAL 59 HB VAL 59 -0.261 -8.805 -2.529 459 HG11 VAL 59 HG11 VAL 59 2.087 -9.274 -3.218 460 HG12 VAL 59 HG12 VAL 59 1.729 -11.000 -3.236 461 HG13 VAL 59 HG13 VAL 59 1.668 -10.103 -1.718 462 HG21 VAL 59 HG21 VAL 59 -1.381 -9.271 -4.670 463 HG22 VAL 59 HG22 VAL 59 -0.149 -10.473 -5.074 464 HG23 VAL 59 HG23 VAL 59 0.291 -8.770 -4.949 465 H ARG 60 HN ARG 60 -0.261 -12.866 -1.067 466 HA ARG 60 HA ARG 60 -0.560 -11.797 1.618 467 HB2 ARG 60 HB2 ARG 60 -1.180 -14.043 1.546 468 HB3 ARG 60 HB1 ARG 60 0.062 -14.472 0.384 469 HG2 ARG 60 HG2 ARG 60 1.700 -14.783 2.017 470 HG3 ARG 60 HG1 ARG 60 0.901 -13.713 3.172 471 HD2 ARG 60 HD2 ARG 60 -0.202 -16.416 2.334 472 HD3 ARG 60 HD1 ARG 60 0.799 -16.145 3.771 473 HE ARG 60 HE ARG 60 -0.971 -14.467 4.431 474 HH11 ARG 60 HH11 ARG 60 -1.820 -17.258 2.493 475 HH12 ARG 60 HH12 ARG 60 -3.444 -17.315 3.102 476 HH21 ARG 60 HH21 ARG 60 -3.040 -14.558 5.210 477 HH22 ARG 60 HH22 ARG 60 -4.137 -15.789 4.659 478 H ILE 61 HN ILE 61 1.052 -10.947 2.838 479 HA ILE 61 HA ILE 61 3.874 -11.226 2.008 480 HB ILE 61 HB ILE 61 2.599 -8.527 2.685 481 HG12 ILE 61 HG12 ILE 61 3.540 -9.547 -0.042 482 HG13 ILE 61 HG11 ILE 61 1.861 -9.398 0.447 483 HG21 ILE 61 HG21 ILE 61 4.950 -8.669 3.381 484 HG22 ILE 61 HG22 ILE 61 4.790 -7.571 2.009 485 HG23 ILE 61 HG23 ILE 61 5.420 -9.202 1.764 486 HD11 ILE 61 HD11 ILE 61 3.813 -7.157 0.048 487 HD12 ILE 61 HD12 ILE 61 2.157 -6.972 0.627 488 HD13 ILE 61 HD13 ILE 61 2.462 -7.601 -0.992 489 H TRP 62 HN TRP 62 4.746 -12.182 3.747 490 HA TRP 62 HA TRP 62 3.759 -11.591 6.467 491 HB2 TRP 62 HB2 TRP 62 5.302 -13.929 5.278 492 HB3 TRP 62 HB1 TRP 62 5.308 -13.649 7.020 493 HD1 TRP 62 HD1 TRP 62 2.144 -13.129 4.891 494 HE1 TRP 62 HE1 TRP 62 0.376 -14.819 5.663 495 HE3 TRP 62 HE3 TRP 62 4.994 -15.895 8.101 496 HZ2 TRP 62 HZ2 TRP 62 0.202 -17.035 7.366 497 HZ3 TRP 62 HZ3 TRP 62 3.944 -17.792 9.263 498 HH2 TRP 62 HH2 TRP 62 1.597 -18.351 8.900 499 H ILE 63 HN ILE 63 4.901 -10.442 7.853 500 HA ILE 63 HA ILE 63 7.851 -10.389 7.660 501 HB ILE 63 HB ILE 63 7.933 -8.088 8.543 502 HG12 ILE 63 HG12 ILE 63 4.930 -7.896 8.064 503 HG13 ILE 63 HG11 ILE 63 5.645 -8.153 9.649 504 HG21 ILE 63 HG21 ILE 63 7.290 -6.843 6.506 505 HG22 ILE 63 HG22 ILE 63 6.356 -8.234 5.950 506 HG23 ILE 63 HG23 ILE 63 8.108 -8.361 6.119 507 HD11 ILE 63 HD11 ILE 63 6.090 -5.751 7.889 508 HD12 ILE 63 HD12 ILE 63 6.784 -6.003 9.492 509 HD13 ILE 63 HD13 ILE 63 5.039 -5.836 9.301 510 H ARG 64 HN ARG 64 8.859 -10.323 9.796 511 HA ARG 64 HA ARG 64 7.464 -11.260 12.054 512 HB2 ARG 64 HB2 ARG 64 10.031 -9.626 11.873 513 HB3 ARG 64 HB1 ARG 64 9.440 -10.349 13.371 514 HG2 ARG 64 HG2 ARG 64 9.635 -12.596 12.401 515 HG3 ARG 64 HG1 ARG 64 10.145 -11.912 10.855 516 HD2 ARG 64 HD2 ARG 64 11.666 -11.661 13.474 517 HD3 ARG 64 HD1 ARG 64 12.043 -12.792 12.167 518 HE ARG 64 HE ARG 64 11.988 -9.959 11.459 519 HH11 ARG 64 HH11 ARG 64 14.008 -12.705 12.324 520 HH12 ARG 64 HH12 ARG 64 15.455 -11.972 11.707 521 HH21 ARG 64 HH21 ARG 64 13.880 -9.010 10.671 522 HH22 ARG 64 HH22 ARG 64 15.380 -9.878 10.778 523 H TYR 65 HN TYR 65 6.825 -10.110 14.006 524 HA TYR 65 HA TYR 65 4.881 -8.190 13.507 525 HB2 TYR 65 HB2 TYR 65 4.943 -9.767 15.455 526 HB3 TYR 65 HB1 TYR 65 6.199 -8.782 16.188 527 HD1 TYR 65 HD1 TYR 65 5.628 -6.475 17.080 528 HD2 TYR 65 HD2 TYR 65 2.601 -9.088 15.550 529 HE1 TYR 65 HE1 TYR 65 3.906 -5.107 18.154 530 HE2 TYR 65 HE2 TYR 65 0.882 -7.700 16.635 531 HH TYR 65 HH TYR 65 0.669 -6.118 18.475 532 H ARG 66 HN ARG 66 5.053 -6.092 13.030 533 HA ARG 66 HA ARG 66 7.078 -4.426 14.370 534 HB2 ARG 66 HB2 ARG 66 7.913 -5.055 12.068 535 HB3 ARG 66 HB1 ARG 66 6.507 -4.246 11.375 536 HG2 ARG 66 HG2 ARG 66 7.251 -2.102 12.321 537 HG3 ARG 66 HG1 ARG 66 8.622 -2.897 13.100 538 HD2 ARG 66 HD2 ARG 66 9.554 -3.471 10.895 539 HD3 ARG 66 HD1 ARG 66 8.160 -2.719 10.103 540 HE ARG 66 HE ARG 66 9.712 -1.030 11.918 541 HH11 ARG 66 HH11 ARG 66 9.128 -1.932 8.567 542 HH12 ARG 66 HH12 ARG 66 9.812 -0.477 7.936 543 HH21 ARG 66 HH21 ARG 66 10.621 0.858 11.070 544 HH22 ARG 66 HH22 ARG 66 10.670 1.100 9.353 545 H LYS 67 HN LYS 67 6.261 -2.613 15.145 546 HA LYS 67 HA LYS 67 3.406 -2.110 14.976 547 HB2 LYS 67 HB2 LYS 67 5.527 -0.646 16.604 548 HB3 LYS 67 HB1 LYS 67 3.778 -0.590 16.852 549 HG2 LYS 67 HG2 LYS 67 3.821 -3.018 17.428 550 HG3 LYS 67 HG1 LYS 67 5.581 -3.002 17.250 551 HD2 LYS 67 HD2 LYS 67 5.677 -1.245 19.056 552 HD3 LYS 67 HD1 LYS 67 3.937 -1.440 19.282 553 HE2 LYS 67 HE2 LYS 67 5.084 -2.730 20.969 554 HE3 LYS 67 HE1 LYS 67 4.341 -3.854 19.828 555 HZ1 LYS 67 HZ1 LYS 67 7.194 -3.029 19.826 556 HZ2 LYS 67 HZ2 LYS 67 6.487 -4.141 18.766 557 HZ3 LYS 67 HZ3 LYS 67 6.595 -4.496 20.415 558 H ASP 68 HN ASP 68 5.824 -1.136 12.990 559 HA ASP 68 HA ASP 68 5.182 1.723 12.793 560 HB2 ASP 68 HB2 ASP 68 7.227 0.016 11.296 561 HB3 ASP 68 HB1 ASP 68 7.042 1.761 11.107 562 H ILE 69 HN ILE 69 4.292 -1.251 11.299 563 HA ILE 69 HA ILE 69 3.947 -0.167 8.631 564 HB ILE 69 HB ILE 69 3.063 -2.920 9.597 565 HG12 ILE 69 HG12 ILE 69 5.458 -2.673 10.084 566 HG13 ILE 69 HG11 ILE 69 5.248 -3.755 8.721 567 HG21 ILE 69 HG21 ILE 69 3.259 -3.522 7.183 568 HG22 ILE 69 HG22 ILE 69 3.652 -1.845 6.803 569 HG23 ILE 69 HG23 ILE 69 2.063 -2.253 7.452 570 HD11 ILE 69 HD11 ILE 69 7.143 -2.287 8.406 571 HD12 ILE 69 HD12 ILE 69 6.107 -0.873 8.570 572 HD13 ILE 69 HD13 ILE 69 5.905 -1.959 7.194 573 H ASN 70 HN ASN 70 2.119 0.496 7.723 574 HA ASN 70 HA ASN 70 -0.434 0.422 9.220 575 HB2 ASN 70 HB2 ASN 70 0.898 2.619 9.519 576 HB3 ASN 70 HB1 ASN 70 0.647 2.894 7.795 577 HD21 ASN 70 HD21 ASN 70 -0.899 2.679 10.927 578 HD22 ASN 70 HD22 ASN 70 -2.378 3.439 10.468 579 H ALA 71 HN ALA 71 -2.299 0.890 7.850 580 HA ALA 71 HA ALA 71 -2.307 -0.635 5.473 581 HB1 ALA 71 HB1 ALA 71 -4.708 -0.034 5.341 582 HB2 ALA 71 HB2 ALA 71 -4.463 1.185 6.596 583 HB3 ALA 71 HB3 ALA 71 -4.248 -0.523 6.976 584 H THR 72 HN THR 72 -1.941 2.786 6.063 585 HA THR 72 HA THR 72 -2.530 3.644 3.376 586 HB THR 72 HB THR 72 -1.191 5.300 5.558 587 HG1 THR 72 HG1 THR 72 -3.981 4.737 5.314 588 HG21 THR 72 HG21 THR 72 -1.479 6.389 3.340 589 HG22 THR 72 HG22 THR 72 -2.464 7.154 4.587 590 HG23 THR 72 HG23 THR 72 -3.214 6.066 3.419 591 H SER 73 HN SER 73 -0.010 1.894 4.380 592 HA SER 73 HA SER 73 2.061 3.327 2.812 593 HB2 SER 73 HB2 SER 73 2.409 1.116 4.897 594 HB3 SER 73 HB1 SER 73 3.701 2.013 4.092 595 HG SER 73 HG SER 73 2.881 2.681 6.310 596 H ARG 74 HN ARG 74 2.427 2.482 0.808 597 HA ARG 74 HA ARG 74 1.224 -0.066 0.034 598 HB2 ARG 74 HB2 ARG 74 2.640 2.137 -1.508 599 HB3 ARG 74 HB1 ARG 74 2.217 0.605 -2.267 600 HG2 ARG 74 HG2 ARG 74 -0.103 0.982 -2.024 601 HG3 ARG 74 HG1 ARG 74 0.149 2.316 -0.897 602 HD2 ARG 74 HD2 ARG 74 -0.539 2.988 -3.234 603 HD3 ARG 74 HD1 ARG 74 0.911 3.765 -2.619 604 HE ARG 74 HE ARG 74 2.081 1.910 -3.985 605 HH11 ARG 74 HH11 ARG 74 -0.870 3.535 -4.969 606 HH12 ARG 74 HH12 ARG 74 -0.459 3.521 -6.654 607 HH21 ARG 74 HH21 ARG 74 2.615 1.919 -6.211 608 HH22 ARG 74 HH22 ARG 74 1.507 2.610 -7.358 609 H ILE 75 HN ILE 75 2.287 -1.902 -0.489 610 HA ILE 75 HA ILE 75 5.074 -2.131 0.404 611 HB ILE 75 HB ILE 75 3.066 -4.340 -0.234 612 HG12 ILE 75 HG12 ILE 75 2.203 -2.932 1.633 613 HG13 ILE 75 HG11 ILE 75 2.650 -4.540 2.192 614 HG21 ILE 75 HG21 ILE 75 5.386 -5.086 -0.316 615 HG22 ILE 75 HG22 ILE 75 4.587 -5.771 1.098 616 HG23 ILE 75 HG23 ILE 75 5.693 -4.410 1.287 617 HD11 ILE 75 HD11 ILE 75 4.728 -3.619 3.116 618 HD12 ILE 75 HD12 ILE 75 3.291 -2.844 3.780 619 HD13 ILE 75 HD13 ILE 75 4.254 -2.011 2.560 620 H LYS 76 HN LYS 76 6.374 -1.621 -1.310 621 HA LYS 76 HA LYS 76 5.911 -2.720 -3.993 622 HB2 LYS 76 HB2 LYS 76 6.631 -0.410 -3.927 623 HB3 LYS 76 HB1 LYS 76 7.989 -0.800 -2.875 624 HG2 LYS 76 HG2 LYS 76 9.108 -2.010 -4.668 625 HG3 LYS 76 HG1 LYS 76 7.708 -1.818 -5.725 626 HD2 LYS 76 HD2 LYS 76 9.662 -0.251 -6.181 627 HD3 LYS 76 HD1 LYS 76 8.088 0.525 -5.984 628 HE2 LYS 76 HE2 LYS 76 8.633 1.269 -3.779 629 HE3 LYS 76 HE1 LYS 76 10.096 0.279 -3.720 630 HZ1 LYS 76 HZ1 LYS 76 11.019 1.650 -5.496 631 HZ2 LYS 76 HZ2 LYS 76 10.632 2.569 -4.143 632 HZ3 LYS 76 HZ3 LYS 76 9.628 2.604 -5.500 633 H VAL 77 HN VAL 77 6.725 -4.623 -4.546 634 HA VAL 77 HA VAL 77 8.466 -6.137 -2.825 635 HB VAL 77 HB VAL 77 6.716 -7.337 -3.954 636 HG11 VAL 77 HG11 VAL 77 6.509 -7.520 -6.399 637 HG12 VAL 77 HG12 VAL 77 7.842 -6.383 -6.604 638 HG13 VAL 77 HG13 VAL 77 6.334 -5.852 -5.854 639 HG21 VAL 77 HG21 VAL 77 8.802 -8.621 -3.671 640 HG22 VAL 77 HG22 VAL 77 9.343 -8.118 -5.272 641 HG23 VAL 77 HG23 VAL 77 7.922 -9.151 -5.108 642 H SER 78 HN SER 78 10.575 -5.823 -2.753 643 HA SER 78 HA SER 78 12.172 -4.660 -4.863 644 HB2 SER 78 HB2 SER 78 13.063 -5.892 -2.232 645 HB3 SER 78 HB1 SER 78 14.013 -4.808 -3.252 646 HG SER 78 HG SER 78 12.987 -3.175 -2.425 647 H THR 79 HN THR 79 11.402 -7.868 -3.815 648 HA THR 79 HA THR 79 12.579 -9.139 -6.037 649 HB THR 79 HB THR 79 14.716 -8.873 -4.831 650 HG1 THR 79 HG1 THR 79 14.377 -10.768 -6.075 651 HG21 THR 79 HG21 THR 79 13.926 -8.815 -2.507 652 HG22 THR 79 HG22 THR 79 15.165 -10.054 -2.712 653 HG23 THR 79 HG23 THR 79 13.465 -10.516 -2.604 654 H GLY 80 HN GLY 80 11.691 -11.137 -6.326 655 HA2 GLY 80 HA2 GLY 80 10.547 -13.043 -4.901 656 HA3 GLY 80 HA1 GLY 80 9.373 -11.754 -4.635 657 HA PRO 81 HA PRO 81 8.225 -14.076 -8.559 658 HB2 PRO 81 HB2 PRO 81 5.612 -14.555 -7.966 659 HB3 PRO 81 HB1 PRO 81 6.914 -15.572 -7.325 660 HG2 PRO 81 HG2 PRO 81 5.454 -13.285 -5.993 661 HG3 PRO 81 HG1 PRO 81 5.835 -14.891 -5.332 662 HD2 PRO 81 HD2 PRO 81 7.343 -12.693 -4.772 663 HD3 PRO 81 HD1 PRO 81 8.049 -14.319 -4.875 664 H LEU 82 HN LEU 82 7.317 -11.155 -7.081 665 HA LEU 82 HA LEU 82 5.853 -10.169 -9.465 666 HB2 LEU 82 HB2 LEU 82 5.626 -9.304 -6.554 667 HB3 LEU 82 HB1 LEU 82 4.768 -8.549 -7.893 668 HG LEU 82 HG LEU 82 4.387 -11.448 -7.034 669 HD11 LEU 82 HD11 LEU 82 3.640 -9.919 -5.269 670 HD12 LEU 82 HD12 LEU 82 2.279 -10.731 -6.030 671 HD13 LEU 82 HD13 LEU 82 2.628 -9.049 -6.428 672 HD21 LEU 82 HD21 LEU 82 3.873 -11.085 -9.402 673 HD22 LEU 82 HD22 LEU 82 2.817 -9.728 -8.997 674 HD23 LEU 82 HD23 LEU 82 2.393 -11.365 -8.493 675 H ALA 83 HN ALA 83 8.847 -10.174 -8.412 676 HA ALA 83 HA ALA 83 9.682 -7.884 -7.215 677 HB1 ALA 83 HB1 ALA 83 11.918 -8.345 -8.093 678 HB2 ALA 83 HB2 ALA 83 11.232 -9.394 -9.341 679 HB3 ALA 83 HB3 ALA 83 11.108 -9.844 -7.637 680 H GLY 84 HN GLY 84 9.419 -5.809 -7.683 681 HA2 GLY 84 HA2 GLY 84 10.245 -3.926 -8.977 682 HA3 GLY 84 HA1 GLY 84 9.847 -4.801 -10.447 683 H ARG 85 HN ARG 85 7.281 -5.549 -8.667 684 HA ARG 85 HA ARG 85 5.668 -3.268 -9.632 685 HB2 ARG 85 HB2 ARG 85 4.785 -6.006 -8.586 686 HB3 ARG 85 HB1 ARG 85 3.701 -4.734 -9.160 687 HG2 ARG 85 HG2 ARG 85 4.976 -4.887 -11.393 688 HG3 ARG 85 HG1 ARG 85 5.668 -6.387 -10.768 689 HD2 ARG 85 HD2 ARG 85 3.710 -6.840 -12.191 690 HD3 ARG 85 HD1 ARG 85 3.391 -7.322 -10.523 691 HE ARG 85 HE ARG 85 1.887 -5.559 -10.284 692 HH11 ARG 85 HH11 ARG 85 3.260 -5.476 -13.519 693 HH12 ARG 85 HH12 ARG 85 2.091 -4.341 -14.107 694 HH21 ARG 85 HH21 ARG 85 0.369 -4.071 -11.070 695 HH22 ARG 85 HH22 ARG 85 0.461 -3.539 -12.725 696 H VAL 86 HN VAL 86 3.728 -2.755 -8.145 697 HA VAL 86 HA VAL 86 4.583 -2.572 -5.313 698 HB VAL 86 HB VAL 86 3.025 -0.400 -6.778 699 HG11 VAL 86 HG11 VAL 86 4.193 -0.488 -3.977 700 HG12 VAL 86 HG12 VAL 86 2.480 -0.572 -4.396 701 HG13 VAL 86 HG13 VAL 86 3.391 0.906 -4.708 702 HG21 VAL 86 HG21 VAL 86 5.329 -0.412 -7.628 703 HG22 VAL 86 HG22 VAL 86 5.954 -0.367 -5.980 704 HG23 VAL 86 HG23 VAL 86 5.050 1.007 -6.615 705 H LEU 87 HN LEU 87 3.280 -3.827 -4.216 706 HA LEU 87 HA LEU 87 0.455 -4.219 -4.892 707 HB2 LEU 87 HB2 LEU 87 1.926 -5.405 -2.498 708 HB3 LEU 87 HB1 LEU 87 0.427 -5.953 -3.220 709 HG LEU 87 HG LEU 87 1.946 -7.572 -3.916 710 HD11 LEU 87 HD11 LEU 87 1.945 -5.614 -6.218 711 HD12 LEU 87 HD12 LEU 87 0.708 -6.815 -5.842 712 HD13 LEU 87 HD13 LEU 87 2.318 -7.336 -6.320 713 HD21 LEU 87 HD21 LEU 87 3.997 -6.547 -3.095 714 HD22 LEU 87 HD22 LEU 87 4.050 -5.480 -4.503 715 HD23 LEU 87 HD23 LEU 87 4.222 -7.226 -4.706 716 H ASN 88 HN ASN 88 -1.245 -3.473 -3.635 717 HA ASN 88 HA ASN 88 -0.609 -1.345 -1.666 718 HB2 ASN 88 HB2 ASN 88 -3.091 -1.844 -3.377 719 HB3 ASN 88 HB1 ASN 88 -3.035 -0.654 -2.087 720 HD21 ASN 88 HD21 ASN 88 -0.329 -1.225 -4.341 721 HD22 ASN 88 HD22 ASN 88 -0.474 0.287 -5.147 722 H ILE 89 HN ILE 89 -1.729 -1.382 0.393 723 HA ILE 89 HA ILE 89 -2.241 -4.111 1.338 724 HB ILE 89 HB ILE 89 -2.245 -1.457 2.857 725 HG12 ILE 89 HG12 ILE 89 -0.220 -3.731 2.809 726 HG13 ILE 89 HG11 ILE 89 0.013 -2.112 2.154 727 HG21 ILE 89 HG21 ILE 89 -2.554 -4.260 4.017 728 HG22 ILE 89 HG22 ILE 89 -3.810 -3.022 3.955 729 HG23 ILE 89 HG23 ILE 89 -2.380 -2.769 4.954 730 HD11 ILE 89 HD11 ILE 89 -0.130 -1.191 4.444 731 HD12 ILE 89 HD12 ILE 89 1.186 -2.356 4.251 732 HD13 ILE 89 HD13 ILE 89 -0.297 -2.837 5.075 733 H ILE 90 HN ILE 90 -4.247 -4.944 1.629 734 HA ILE 90 HA ILE 90 -6.591 -3.193 1.211 735 HB ILE 90 HB ILE 90 -7.883 -5.336 0.790 736 HG12 ILE 90 HG12 ILE 90 -5.128 -6.646 0.580 737 HG13 ILE 90 HG11 ILE 90 -6.215 -6.888 1.933 738 HG21 ILE 90 HG21 ILE 90 -7.090 -3.880 -1.045 739 HG22 ILE 90 HG22 ILE 90 -7.083 -5.575 -1.529 740 HG23 ILE 90 HG23 ILE 90 -5.566 -4.774 -1.112 741 HD11 ILE 90 HD11 ILE 90 -6.727 -7.680 -0.927 742 HD12 ILE 90 HD12 ILE 90 -7.856 -7.904 0.414 743 HD13 ILE 90 HD13 ILE 90 -6.307 -8.745 0.412 744 H GLY 91 HN GLY 91 -7.942 -2.796 2.803 745 HA2 GLY 91 HA2 GLY 91 -9.065 -2.891 4.815 746 HA3 GLY 91 HA1 GLY 91 -8.337 -4.460 5.131 747 H GLN 92 HN GLN 92 -6.366 -4.574 6.176 748 HA GLN 92 HA GLN 92 -4.843 -2.299 7.043 749 HB2 GLN 92 HB2 GLN 92 -5.249 -2.541 9.467 750 HB3 GLN 92 HB1 GLN 92 -6.751 -2.139 8.641 751 HG2 GLN 92 HG2 GLN 92 -7.505 -4.455 8.793 752 HG3 GLN 92 HG1 GLN 92 -5.966 -4.942 9.498 753 HE21 GLN 92 HE21 GLN 92 -6.982 -5.769 11.359 754 HE22 GLN 92 HE22 GLN 92 -7.648 -4.739 12.578 755 HA PRO 93 HA PRO 93 -1.911 -5.763 7.567 756 HB2 PRO 93 HB2 PRO 93 -0.120 -4.709 9.367 757 HB3 PRO 93 HB1 PRO 93 -0.152 -4.244 7.659 758 HG2 PRO 93 HG2 PRO 93 -1.346 -2.837 10.035 759 HG3 PRO 93 HG1 PRO 93 -0.411 -2.151 8.687 760 HD2 PRO 93 HD2 PRO 93 -3.119 -2.005 8.772 761 HD3 PRO 93 HD1 PRO 93 -2.242 -2.183 7.236 762 H LEU 94 HN LEU 94 -2.775 -7.442 8.588 763 HA LEU 94 HA LEU 94 -4.135 -7.286 11.145 764 HB2 LEU 94 HB2 LEU 94 -4.996 -8.569 9.130 765 HB3 LEU 94 HB1 LEU 94 -3.671 -9.693 9.318 766 HG LEU 94 HG LEU 94 -5.975 -10.464 10.126 767 HD11 LEU 94 HD11 LEU 94 -3.937 -11.663 10.768 768 HD12 LEU 94 HD12 LEU 94 -5.175 -11.725 12.018 769 HD13 LEU 94 HD13 LEU 94 -3.786 -10.648 12.204 770 HD21 LEU 94 HD21 LEU 94 -6.692 -8.397 11.216 771 HD22 LEU 94 HD22 LEU 94 -5.439 -8.591 12.447 772 HD23 LEU 94 HD23 LEU 94 -6.754 -9.765 12.329 773 HA PRO 95 HA PRO 95 -0.214 -8.655 13.153 774 HB2 PRO 95 HB2 PRO 95 -0.951 -8.201 15.745 775 HB3 PRO 95 HB1 PRO 95 -0.454 -6.898 14.654 776 HG2 PRO 95 HG2 PRO 95 -3.230 -7.738 15.456 777 HG3 PRO 95 HG1 PRO 95 -2.565 -6.101 15.270 778 HD2 PRO 95 HD2 PRO 95 -4.115 -7.339 13.351 779 HD3 PRO 95 HD1 PRO 95 -2.899 -6.097 12.975 780 H ASP 96 HN ASP 96 0.381 -10.607 14.013 781 HA ASP 96 HA ASP 96 -1.315 -12.830 13.964 782 HB2 ASP 96 HB2 ASP 96 1.118 -12.929 13.670 783 HB3 ASP 96 HB1 ASP 96 1.369 -12.425 15.333 784 H ALA 97 HN ALA 97 -2.160 -14.145 15.592 785 HA ALA 97 HA ALA 97 -3.223 -12.919 17.953 786 HB1 ALA 97 HB1 ALA 97 -4.199 -15.139 18.401 787 HB2 ALA 97 HB2 ALA 97 -3.189 -15.848 17.135 788 HB3 ALA 97 HB3 ALA 97 -4.435 -14.671 16.716 789 H ALA 98 HN ALA 98 -0.452 -14.961 17.262 790 HA ALA 98 HA ALA 98 0.318 -15.169 20.096 791 HB1 ALA 98 HB1 ALA 98 1.670 -16.316 17.617 792 HB2 ALA 98 HB2 ALA 98 0.557 -17.183 18.678 793 HB3 ALA 98 HB3 ALA 98 2.118 -16.647 19.295 794 H ARG 99 HN ARG 99 0.654 -12.924 17.636 795 HA ARG 99 HA ARG 99 1.891 -11.105 17.221 796 HB2 ARG 99 HB2 ARG 99 2.541 -11.452 20.156 797 HB3 ARG 99 HB1 ARG 99 3.276 -10.154 19.232 798 HG2 ARG 99 HG2 ARG 99 1.405 -9.219 20.371 799 HG3 ARG 99 HG1 ARG 99 0.969 -9.321 18.668 800 HD2 ARG 99 HD2 ARG 99 -0.369 -11.342 19.136 801 HD3 ARG 99 HD1 ARG 99 0.079 -11.242 20.842 802 HE ARG 99 HE ARG 99 -1.063 -8.798 20.072 803 HH11 ARG 99 HH11 ARG 99 -2.124 -12.116 20.596 804 HH12 ARG 99 HH12 ARG 99 -3.747 -11.647 20.973 805 HH21 ARG 99 HH21 ARG 99 -3.167 -8.219 20.589 806 HH22 ARG 99 HH22 ARG 99 -4.330 -9.441 20.989 807 H THR 100 HN THR 100 3.224 -13.878 16.860 808 HA THR 100 HA THR 100 6.064 -13.291 17.065 809 HB THR 100 HB THR 100 6.459 -15.479 16.052 810 HG1 THR 100 HG1 THR 100 3.753 -15.246 15.315 811 HG21 THR 100 HG21 THR 100 5.841 -15.471 18.454 812 HG22 THR 100 HG22 THR 100 5.313 -16.946 17.646 813 HG23 THR 100 HG23 THR 100 4.142 -15.679 18.012 814 H ARG 101 HN ARG 101 3.655 -12.416 14.890 815 HA ARG 101 HA ARG 101 5.524 -11.550 12.839 816 HB2 ARG 101 HB2 ARG 101 4.490 -12.772 10.991 817 HB3 ARG 101 HB1 ARG 101 5.010 -13.942 12.206 818 HG2 ARG 101 HG2 ARG 101 2.661 -13.986 13.080 819 HG3 ARG 101 HG1 ARG 101 2.182 -12.940 11.744 820 HD2 ARG 101 HD2 ARG 101 1.613 -15.225 11.242 821 HD3 ARG 101 HD1 ARG 101 2.902 -14.699 10.160 822 HE ARG 101 HE ARG 101 4.482 -15.962 11.513 823 HH11 ARG 101 HH11 ARG 101 1.105 -16.748 12.096 824 HH12 ARG 101 HH12 ARG 101 1.459 -18.326 12.721 825 HH21 ARG 101 HH21 ARG 101 4.925 -18.001 12.357 826 HH22 ARG 101 HH22 ARG 101 3.631 -19.029 12.877 827 H LEU 102 HN LEU 102 4.097 -10.680 10.928 828 HA LEU 102 HA LEU 102 1.610 -9.395 11.770 829 HB2 LEU 102 HB2 LEU 102 3.953 -7.946 11.807 830 HB3 LEU 102 HB1 LEU 102 3.539 -7.742 10.129 831 HG LEU 102 HG LEU 102 2.698 -5.801 11.137 832 HD11 LEU 102 HD11 LEU 102 0.290 -7.627 11.119 833 HD12 LEU 102 HD12 LEU 102 0.990 -6.817 9.718 834 HD13 LEU 102 HD13 LEU 102 0.282 -5.863 11.017 835 HD21 LEU 102 HD21 LEU 102 1.596 -7.463 13.421 836 HD22 LEU 102 HD22 LEU 102 1.452 -5.710 13.250 837 HD23 LEU 102 HD23 LEU 102 3.037 -6.446 13.462 838 H GLU 103 HN GLU 103 0.205 -10.278 10.354 839 HA GLU 103 HA GLU 103 0.839 -11.170 7.691 840 HB2 GLU 103 HB2 GLU 103 -0.967 -12.286 8.951 841 HB3 GLU 103 HB1 GLU 103 -1.836 -10.773 9.133 842 HG2 GLU 103 HG2 GLU 103 -2.970 -12.053 7.463 843 HG3 GLU 103 HG1 GLU 103 -2.163 -10.720 6.644 844 H ILE 104 HN ILE 104 1.621 -9.365 6.532 845 HA ILE 104 HA ILE 104 -0.056 -7.017 6.180 846 HB ILE 104 HB ILE 104 2.369 -7.794 4.490 847 HG12 ILE 104 HG12 ILE 104 3.128 -7.830 6.816 848 HG13 ILE 104 HG11 ILE 104 3.781 -6.409 6.010 849 HG21 ILE 104 HG21 ILE 104 2.552 -5.364 4.080 850 HG22 ILE 104 HG22 ILE 104 1.117 -5.082 5.066 851 HG23 ILE 104 HG23 ILE 104 0.986 -5.997 3.564 852 HD11 ILE 104 HD11 ILE 104 1.468 -6.486 7.936 853 HD12 ILE 104 HD12 ILE 104 2.042 -5.049 7.088 854 HD13 ILE 104 HD13 ILE 104 3.091 -5.869 8.242 855 H LEU 105 HN LEU 105 -1.976 -8.021 5.414 856 HA LEU 105 HA LEU 105 -1.942 -9.528 2.939 857 HB2 LEU 105 HB2 LEU 105 -4.417 -9.444 2.992 858 HB3 LEU 105 HB1 LEU 105 -3.727 -10.153 4.437 859 HG LEU 105 HG LEU 105 -4.549 -7.237 4.468 860 HD11 LEU 105 HD11 LEU 105 -6.504 -8.385 3.562 861 HD12 LEU 105 HD12 LEU 105 -6.807 -7.867 5.216 862 HD13 LEU 105 HD13 LEU 105 -6.458 -9.565 4.878 863 HD21 LEU 105 HD21 LEU 105 -4.475 -9.384 6.618 864 HD22 LEU 105 HD22 LEU 105 -4.939 -7.695 6.854 865 HD23 LEU 105 HD23 LEU 105 -3.290 -8.092 6.384 866 H CYS 106 HN CYS 106 -2.505 -8.787 1.011 867 HA CYS 106 HA CYS 106 -2.890 -5.970 0.425 868 HB2 CYS 106 HB2 CYS 106 -0.345 -7.388 -0.535 869 HB3 CYS 106 HB1 CYS 106 -0.848 -5.754 -0.956 870 HG CYS 106 HG CYS 106 0.233 -6.868 2.078 871 H ARG 107 HN ARG 107 -3.083 -5.745 -1.969 872 HA ARG 107 HA ARG 107 -3.535 -8.224 -3.489 873 HB2 ARG 107 HB2 ARG 107 -5.742 -7.380 -2.517 874 HB3 ARG 107 HB1 ARG 107 -5.528 -5.904 -3.446 875 HG2 ARG 107 HG2 ARG 107 -5.802 -7.064 -5.526 876 HG3 ARG 107 HG1 ARG 107 -5.695 -8.641 -4.738 877 HD2 ARG 107 HD2 ARG 107 -8.028 -8.073 -5.317 878 HD3 ARG 107 HD1 ARG 107 -7.817 -8.239 -3.570 879 HE ARG 107 HE ARG 107 -7.764 -5.575 -4.846 880 HH11 ARG 107 HH11 ARG 107 -9.315 -7.754 -2.558 881 HH12 ARG 107 HH12 ARG 107 -10.309 -6.510 -1.873 882 HH21 ARG 107 HH21 ARG 107 -9.027 -3.959 -3.912 883 HH22 ARG 107 HH22 ARG 107 -10.152 -4.365 -2.655 884 H GLU 108 HN GLU 108 -2.986 -7.976 -5.677 885 HA GLU 108 HA GLU 108 -0.935 -6.444 -6.407 886 HB2 GLU 108 HB2 GLU 108 -2.258 -8.365 -7.686 887 HB3 GLU 108 HB1 GLU 108 -2.997 -7.024 -8.543 888 HG2 GLU 108 HG2 GLU 108 -0.029 -7.704 -8.459 889 HG3 GLU 108 HG1 GLU 108 -1.134 -7.950 -9.814 890 H GLY 109 HN GLY 109 -0.495 -4.372 -6.817 891 HA2 GLY 109 HA2 GLY 109 -2.646 -2.481 -6.230 892 HA3 GLY 109 HA1 GLY 109 -0.918 -2.200 -6.083 893 H ALA 110 HN ALA 110 -2.866 -3.353 -8.835 894 HA ALA 110 HA ALA 110 -1.749 -1.539 -10.718 895 HB1 ALA 110 HB1 ALA 110 -3.479 -2.392 -12.246 896 HB2 ALA 110 HB2 ALA 110 -4.311 -3.164 -10.894 897 HB3 ALA 110 HB3 ALA 110 -2.706 -3.718 -11.375 898 H GLU 111 HN GLU 111 -1.945 0.530 -9.864 899 HA GLU 111 HA GLU 111 -4.383 1.681 -8.912 900 HB2 GLU 111 HB2 GLU 111 -3.081 3.828 -8.947 901 HB3 GLU 111 HB1 GLU 111 -2.269 2.526 -8.089 902 HG2 GLU 111 HG2 GLU 111 -0.743 2.165 -9.944 903 HG3 GLU 111 HG1 GLU 111 -1.625 3.313 -10.946 904 H LYS 112 HN LYS 112 -2.816 1.448 -12.023 905 HA LYS 112 HA LYS 112 -5.067 2.725 -13.376 906 HB2 LYS 112 HB2 LYS 112 -3.542 4.185 -14.727 907 HB3 LYS 112 HB1 LYS 112 -3.579 4.605 -13.021 908 HG2 LYS 112 HG2 LYS 112 -1.396 3.417 -12.715 909 HG3 LYS 112 HG1 LYS 112 -1.344 3.132 -14.461 910 HD2 LYS 112 HD2 LYS 112 -1.350 5.581 -14.858 911 HD3 LYS 112 HD1 LYS 112 -1.433 5.864 -13.115 912 HE2 LYS 112 HE2 LYS 112 0.853 4.488 -14.562 913 HE3 LYS 112 HE1 LYS 112 0.856 6.159 -14.004 914 HZ1 LYS 112 HZ1 LYS 112 0.605 5.339 -11.726 915 HZ2 LYS 112 HZ2 LYS 112 2.011 4.736 -12.456 916 HZ3 LYS 112 HZ3 LYS 112 0.653 3.746 -12.287 Start of MODEL 13 1 H1 MET 1 HT1 MET 1 2.222 -23.345 12.827 2 H2 MET 1 HT2 MET 1 3.734 -22.863 12.269 3 H3 MET 1 HT3 MET 1 3.564 -24.359 13.029 4 HA MET 1 HA MET 1 2.134 -25.126 11.260 5 HB2 MET 1 HB2 MET 1 2.815 -22.442 9.984 6 HB3 MET 1 HB1 MET 1 2.003 -23.765 9.152 7 HG2 MET 1 HG2 MET 1 0.925 -22.229 11.531 8 HG3 MET 1 HG1 MET 1 0.398 -22.083 9.853 9 HE1 MET 1 HE1 MET 1 -2.150 -22.455 10.664 10 HE2 MET 1 HE2 MET 1 -1.622 -22.642 12.336 11 HE3 MET 1 HE3 MET 1 -2.676 -23.851 11.604 12 H ASN 2 HN ASN 2 4.811 -23.053 10.022 13 HA ASN 2 HA ASN 2 6.569 -25.369 9.693 14 HB2 ASN 2 HB2 ASN 2 6.847 -24.982 7.229 15 HB3 ASN 2 HB1 ASN 2 5.235 -25.541 7.649 16 HD21 ASN 2 HD21 ASN 2 4.282 -24.754 5.822 17 HD22 ASN 2 HD22 ASN 2 4.080 -23.073 5.484 18 H ILE 3 HN ILE 3 8.492 -24.307 8.056 19 HA ILE 3 HA ILE 3 9.737 -22.295 9.710 20 HB ILE 3 HB ILE 3 10.700 -23.313 6.999 21 HG12 ILE 3 HG12 ILE 3 10.373 -25.254 8.461 22 HG13 ILE 3 HG11 ILE 3 12.093 -24.962 8.262 23 HG21 ILE 3 HG21 ILE 3 12.963 -22.657 7.801 24 HG22 ILE 3 HG22 ILE 3 12.247 -22.012 9.281 25 HG23 ILE 3 HG23 ILE 3 11.866 -21.273 7.724 26 HD11 ILE 3 HD11 ILE 3 12.165 -23.927 10.485 27 HD12 ILE 3 HD12 ILE 3 11.574 -25.585 10.533 28 HD13 ILE 3 HD13 ILE 3 10.438 -24.245 10.683 29 H GLY 4 HN GLY 4 8.376 -20.521 9.601 30 HA2 GLY 4 HA2 GLY 4 7.685 -19.230 7.060 31 HA3 GLY 4 HA1 GLY 4 7.151 -18.763 8.672 32 H ARG 5 HN ARG 5 10.342 -19.262 7.260 33 HA ARG 5 HA ARG 5 11.558 -17.015 8.509 34 HB2 ARG 5 HB2 ARG 5 13.509 -17.586 7.023 35 HB3 ARG 5 HB1 ARG 5 12.903 -18.949 7.953 36 HG2 ARG 5 HG2 ARG 5 11.657 -19.731 5.924 37 HG3 ARG 5 HG1 ARG 5 12.401 -18.419 5.011 38 HD2 ARG 5 HD2 ARG 5 14.630 -19.366 5.428 39 HD3 ARG 5 HD1 ARG 5 13.909 -20.648 6.412 40 HE ARG 5 HE ARG 5 12.610 -20.964 4.079 41 HH11 ARG 5 HH11 ARG 5 16.074 -20.656 4.699 42 HH12 ARG 5 HH12 ARG 5 16.503 -21.685 3.368 43 HH21 ARG 5 HH21 ARG 5 13.200 -22.262 2.356 44 HH22 ARG 5 HH22 ARG 5 14.875 -22.591 2.038 45 H LEU 6 HN LEU 6 12.005 -15.007 7.715 46 HA LEU 6 HA LEU 6 10.359 -14.032 5.530 47 HB2 LEU 6 HB2 LEU 6 12.243 -12.577 7.430 48 HB3 LEU 6 HB1 LEU 6 11.250 -11.793 6.222 49 HG LEU 6 HG LEU 6 10.140 -11.473 8.291 50 HD11 LEU 6 HD11 LEU 6 8.685 -13.729 6.890 51 HD12 LEU 6 HD12 LEU 6 8.602 -12.011 6.493 52 HD13 LEU 6 HD13 LEU 6 7.978 -12.583 8.034 53 HD21 LEU 6 HD21 LEU 6 10.347 -14.440 8.873 54 HD22 LEU 6 HD22 LEU 6 9.532 -13.231 9.874 55 HD23 LEU 6 HD23 LEU 6 11.277 -13.150 9.645 56 H ARG 7 HN ARG 7 11.281 -15.070 3.803 57 HA ARG 7 HA ARG 7 14.119 -15.162 3.310 58 HB2 ARG 7 HB2 ARG 7 13.489 -16.562 1.356 59 HB3 ARG 7 HB1 ARG 7 12.706 -17.110 2.837 60 HG2 ARG 7 HG2 ARG 7 10.603 -16.042 2.173 61 HG3 ARG 7 HG1 ARG 7 11.371 -15.387 0.727 62 HD2 ARG 7 HD2 ARG 7 11.731 -17.684 -0.113 63 HD3 ARG 7 HD1 ARG 7 10.944 -18.331 1.332 64 HE ARG 7 HE ARG 7 9.585 -16.626 -0.685 65 HH11 ARG 7 HH11 ARG 7 9.404 -19.248 1.666 66 HH12 ARG 7 HH12 ARG 7 7.784 -19.673 1.227 67 HH21 ARG 7 HH21 ARG 7 7.478 -17.232 -1.250 68 HH22 ARG 7 HH22 ARG 7 6.709 -18.554 -0.426 69 H ASP 8 HN ASP 8 11.577 -13.049 2.322 70 HA ASP 8 HA ASP 8 12.953 -12.081 -0.082 71 HB2 ASP 8 HB2 ASP 8 10.069 -11.640 0.843 72 HB3 ASP 8 HB1 ASP 8 10.768 -11.021 -0.653 73 H ARG 9 HN ARG 9 12.201 -9.661 -0.378 74 HA ARG 9 HA ARG 9 12.231 -8.080 2.077 75 HB2 ARG 9 HB2 ARG 9 14.160 -7.732 -0.253 76 HB3 ARG 9 HB1 ARG 9 13.809 -6.439 0.892 77 HG2 ARG 9 HG2 ARG 9 14.701 -7.754 2.742 78 HG3 ARG 9 HG1 ARG 9 14.972 -9.134 1.670 79 HD2 ARG 9 HD2 ARG 9 16.332 -6.427 1.437 80 HD3 ARG 9 HD1 ARG 9 17.040 -7.885 2.123 81 HE ARG 9 HE ARG 9 16.665 -8.909 -0.159 82 HH11 ARG 9 HH11 ARG 9 17.216 -5.462 0.167 83 HH12 ARG 9 HH12 ARG 9 17.877 -5.294 -1.421 84 HH21 ARG 9 HH21 ARG 9 17.552 -8.683 -2.236 85 HH22 ARG 9 HH22 ARG 9 18.097 -7.126 -2.776 86 H ILE 10 HN ILE 10 11.193 -6.101 1.876 87 HA ILE 10 HA ILE 10 10.005 -5.306 -0.706 88 HB ILE 10 HB ILE 10 7.766 -5.064 0.056 89 HG12 ILE 10 HG12 ILE 10 8.034 -4.136 2.292 90 HG13 ILE 10 HG11 ILE 10 6.937 -5.500 2.390 91 HG21 ILE 10 HG21 ILE 10 8.220 -7.380 -0.549 92 HG22 ILE 10 HG22 ILE 10 6.994 -7.314 0.719 93 HG23 ILE 10 HG23 ILE 10 8.653 -7.764 1.121 94 HD11 ILE 10 HD11 ILE 10 8.365 -5.475 4.288 95 HD12 ILE 10 HD12 ILE 10 9.808 -5.402 3.282 96 HD13 ILE 10 HD13 ILE 10 8.810 -6.845 3.285 97 H THR 11 HN THR 11 9.734 -3.010 -0.860 98 HA THR 11 HA THR 11 10.904 -1.454 1.346 99 HB THR 11 HB THR 11 10.136 -0.408 -1.416 100 HG1 THR 11 HG1 THR 11 11.707 -2.195 -1.397 101 HG21 THR 11 HG21 THR 11 10.522 1.320 0.335 102 HG22 THR 11 HG22 THR 11 11.787 1.351 -0.891 103 HG23 THR 11 HG23 THR 11 12.106 0.612 0.679 104 H ILE 12 HN ILE 12 9.644 -0.471 2.733 105 HA ILE 12 HA ILE 12 6.774 -0.315 2.504 106 HB ILE 12 HB ILE 12 8.582 0.998 4.585 107 HG12 ILE 12 HG12 ILE 12 9.007 -1.430 4.537 108 HG13 ILE 12 HG11 ILE 12 8.183 -0.979 6.021 109 HG21 ILE 12 HG21 ILE 12 5.607 0.349 4.709 110 HG22 ILE 12 HG22 ILE 12 6.319 1.955 4.559 111 HG23 ILE 12 HG23 ILE 12 6.577 1.021 6.031 112 HD11 ILE 12 HD11 ILE 12 7.363 -3.077 5.153 113 HD12 ILE 12 HD12 ILE 12 6.926 -2.316 3.624 114 HD13 ILE 12 HD13 ILE 12 6.083 -1.863 5.109 115 H GLN 13 HN GLN 13 6.066 1.101 0.970 116 HA GLN 13 HA GLN 13 7.154 3.782 0.682 117 HB2 GLN 13 HB2 GLN 13 4.912 2.328 -0.768 118 HB3 GLN 13 HB1 GLN 13 5.374 4.003 -1.095 119 HG2 GLN 13 HG2 GLN 13 7.669 3.228 -1.659 120 HG3 GLN 13 HG1 GLN 13 7.144 1.557 -1.421 121 HE21 GLN 13 HE21 GLN 13 7.809 1.222 -3.578 122 HE22 GLN 13 HE22 GLN 13 6.794 1.659 -4.905 123 H THR 14 HN THR 14 6.725 4.812 2.457 124 HA THR 14 HA THR 14 4.119 4.962 3.745 125 HB THR 14 HB THR 14 5.321 6.832 5.121 126 HG1 THR 14 HG1 THR 14 7.132 6.509 3.235 127 HG21 THR 14 HG21 THR 14 6.470 4.008 5.156 128 HG22 THR 14 HG22 THR 14 4.995 4.526 5.983 129 HG23 THR 14 HG23 THR 14 6.560 5.176 6.477 130 H LEU 15 HN LEU 15 2.846 6.981 3.931 131 HA LEU 15 HA LEU 15 2.611 8.154 1.269 132 HB2 LEU 15 HB2 LEU 15 0.666 7.067 2.321 133 HB3 LEU 15 HB1 LEU 15 0.754 8.173 3.680 134 HG LEU 15 HG LEU 15 0.152 10.061 2.198 135 HD11 LEU 15 HD11 LEU 15 -0.615 9.662 -0.112 136 HD12 LEU 15 HD12 LEU 15 -0.052 7.998 -0.011 137 HD13 LEU 15 HD13 LEU 15 1.099 9.331 0.086 138 HD21 LEU 15 HD21 LEU 15 -1.633 8.858 3.363 139 HD22 LEU 15 HD22 LEU 15 -1.793 7.746 2.004 140 HD23 LEU 15 HD23 LEU 15 -2.191 9.452 1.800 141 H LYS 16 HN LYS 16 3.945 9.920 1.052 142 HA LYS 16 HA LYS 16 4.099 12.004 3.073 143 HB2 LYS 16 HB2 LYS 16 6.096 11.244 1.773 144 HB3 LYS 16 HB1 LYS 16 5.341 11.804 0.285 145 HG2 LYS 16 HG2 LYS 16 5.478 14.108 1.017 146 HG3 LYS 16 HG1 LYS 16 6.029 13.616 2.625 147 HD2 LYS 16 HD2 LYS 16 8.109 12.713 1.644 148 HD3 LYS 16 HD1 LYS 16 7.548 13.155 0.025 149 HE2 LYS 16 HE2 LYS 16 8.070 15.124 2.277 150 HE3 LYS 16 HE1 LYS 16 9.194 14.770 0.964 151 HZ1 LYS 16 HZ1 LYS 16 7.988 16.757 0.479 152 HZ2 LYS 16 HZ2 LYS 16 6.503 15.989 0.715 153 HZ3 LYS 16 HZ3 LYS 16 7.478 15.562 -0.596 154 H GLN 17 HN GLN 17 2.124 12.993 3.152 155 HA GLN 17 HA GLN 17 0.662 13.848 0.772 156 HB2 GLN 17 HB2 GLN 17 0.100 14.342 3.734 157 HB3 GLN 17 HB1 GLN 17 -1.025 14.642 2.406 158 HG2 GLN 17 HG2 GLN 17 -1.106 12.238 1.926 159 HG3 GLN 17 HG1 GLN 17 0.076 11.932 3.202 160 HE21 GLN 17 HE21 GLN 17 -3.232 12.847 2.524 161 HE22 GLN 17 HE22 GLN 17 -3.838 12.558 4.117 162 H THR 18 HN THR 18 1.704 15.511 -0.257 163 HA THR 18 HA THR 18 3.035 17.628 1.321 164 HB THR 18 HB THR 18 3.532 16.721 -1.562 165 HG1 THR 18 HG1 THR 18 4.153 15.245 0.200 166 HG21 THR 18 HG21 THR 18 5.111 18.672 0.175 167 HG22 THR 18 HG22 THR 18 4.135 19.100 -1.230 168 HG23 THR 18 HG23 THR 18 5.579 18.113 -1.439 169 H ARG 19 HN ARG 19 1.896 19.520 1.358 170 HA ARG 19 HA ARG 19 -0.297 20.034 -0.418 171 HB2 ARG 19 HB2 ARG 19 -0.150 20.802 1.995 172 HB3 ARG 19 HB1 ARG 19 1.034 22.003 1.493 173 HG2 ARG 19 HG2 ARG 19 -0.640 23.077 0.036 174 HG3 ARG 19 HG1 ARG 19 -1.820 21.832 0.456 175 HD2 ARG 19 HD2 ARG 19 -2.267 23.868 1.715 176 HD3 ARG 19 HD1 ARG 19 -1.757 22.576 2.806 177 HE ARG 19 HE ARG 19 0.291 24.447 1.878 178 HH11 ARG 19 HH11 ARG 19 -1.838 23.485 4.493 179 HH12 ARG 19 HH12 ARG 19 -0.954 24.363 5.701 180 HH21 ARG 19 HH21 ARG 19 1.434 25.605 3.455 181 HH22 ARG 19 HH22 ARG 19 0.909 25.564 5.107 182 H ASP 20 HN ASP 20 -0.441 22.133 -1.656 183 HA ASP 20 HA ASP 20 2.041 22.616 -3.223 184 HB2 ASP 20 HB2 ASP 20 0.184 21.315 -4.380 185 HB3 ASP 20 HB1 ASP 20 -0.852 22.729 -4.216 186 H ILE 21 HN ILE 21 2.174 24.815 -4.175 187 HA ILE 21 HA ILE 21 1.650 26.939 -2.519 188 HB ILE 21 HB ILE 21 3.355 26.963 -4.277 189 HG12 ILE 21 HG12 ILE 21 1.346 29.233 -4.685 190 HG13 ILE 21 HG11 ILE 21 2.557 29.162 -3.411 191 HG21 ILE 21 HG21 ILE 21 1.094 27.148 -6.299 192 HG22 ILE 21 HG22 ILE 21 2.148 25.752 -6.043 193 HG23 ILE 21 HG23 ILE 21 2.818 27.265 -6.664 194 HD11 ILE 21 HD11 ILE 21 3.240 30.659 -5.165 195 HD12 ILE 21 HD12 ILE 21 3.077 29.384 -6.369 196 HD13 ILE 21 HD13 ILE 21 4.321 29.267 -5.120 197 H THR 22 HN THR 22 -0.743 25.350 -4.558 198 HA THR 22 HA THR 22 -2.453 27.748 -4.733 199 HB THR 22 HB THR 22 -3.893 26.280 -6.186 200 HG1 THR 22 HG1 THR 22 -1.851 24.376 -6.438 201 HG21 THR 22 HG21 THR 22 -2.194 27.690 -7.291 202 HG22 THR 22 HG22 THR 22 -2.408 26.163 -8.149 203 HG23 THR 22 HG23 THR 22 -1.001 26.398 -7.110 204 H GLY 23 HN GLY 23 -1.753 24.995 -2.961 205 HA2 GLY 23 HA2 GLY 23 -2.582 24.465 -0.805 206 HA3 GLY 23 HA1 GLY 23 -4.083 25.291 -1.184 207 H GLU 24 HN GLU 24 -2.405 22.792 -3.096 208 HA GLU 24 HA GLU 24 -4.732 21.010 -2.871 209 HB2 GLU 24 HB2 GLU 24 -2.543 21.406 -4.939 210 HB3 GLU 24 HB1 GLU 24 -3.493 19.924 -4.907 211 HG2 GLU 24 HG2 GLU 24 -4.664 22.703 -5.192 212 HG3 GLU 24 HG1 GLU 24 -4.296 21.629 -6.543 213 H ILE 25 HN ILE 25 -4.450 18.945 -2.032 214 HA ILE 25 HA ILE 25 -1.907 18.397 -0.654 215 HB ILE 25 HB ILE 25 -4.549 16.872 -0.525 216 HG12 ILE 25 HG12 ILE 25 -4.882 19.164 0.304 217 HG13 ILE 25 HG11 ILE 25 -4.918 18.036 1.650 218 HG21 ILE 25 HG21 ILE 25 -2.675 15.450 0.169 219 HG22 ILE 25 HG22 ILE 25 -3.646 15.887 1.575 220 HG23 ILE 25 HG23 ILE 25 -2.107 16.695 1.286 221 HD11 ILE 25 HD11 ILE 25 -2.599 19.814 0.902 222 HD12 ILE 25 HD12 ILE 25 -2.646 18.695 2.266 223 HD13 ILE 25 HD13 ILE 25 -3.742 20.075 2.218 224 H LEU 26 HN LEU 26 -0.485 17.665 -2.204 225 HA LEU 26 HA LEU 26 -1.212 15.655 -4.184 226 HB2 LEU 26 HB2 LEU 26 1.356 17.193 -3.616 227 HB3 LEU 26 HB1 LEU 26 1.339 15.824 -4.715 228 HG LEU 26 HG LEU 26 -0.253 17.024 -6.200 229 HD11 LEU 26 HD11 LEU 26 0.049 19.367 -4.302 230 HD12 LEU 26 HD12 LEU 26 -1.422 18.431 -4.582 231 HD13 LEU 26 HD13 LEU 26 -0.741 19.412 -5.879 232 HD21 LEU 26 HD21 LEU 26 1.325 18.706 -7.071 233 HD22 LEU 26 HD22 LEU 26 2.152 17.212 -6.635 234 HD23 LEU 26 HD23 LEU 26 2.257 18.619 -5.573 235 H GLU 27 HN GLU 27 -1.628 13.793 -3.106 236 HA GLU 27 HA GLU 27 0.041 12.821 -0.957 237 HB2 GLU 27 HB2 GLU 27 -2.363 11.636 -2.397 238 HB3 GLU 27 HB1 GLU 27 -1.515 10.809 -1.096 239 HG2 GLU 27 HG2 GLU 27 -2.017 12.731 0.398 240 HG3 GLU 27 HG1 GLU 27 -2.956 13.463 -0.900 241 H THR 28 HN THR 28 1.843 11.856 -1.306 242 HA THR 28 HA THR 28 2.440 10.392 -3.801 243 HB THR 28 HB THR 28 4.760 11.361 -3.757 244 HG1 THR 28 HG1 THR 28 3.686 13.100 -1.774 245 HG21 THR 28 HG21 THR 28 4.218 13.606 -4.629 246 HG22 THR 28 HG22 THR 28 2.594 13.478 -3.950 247 HG23 THR 28 HG23 THR 28 3.096 12.391 -5.246 248 H TRP 29 HN TRP 29 4.596 9.133 -3.387 249 HA TRP 29 HA TRP 29 4.329 7.861 -0.717 250 HB2 TRP 29 HB2 TRP 29 4.767 6.449 -3.393 251 HB3 TRP 29 HB1 TRP 29 4.658 5.672 -1.812 252 HD1 TRP 29 HD1 TRP 29 2.486 7.108 -4.574 253 HE1 TRP 29 HE1 TRP 29 0.011 6.705 -4.032 254 HE3 TRP 29 HE3 TRP 29 2.967 5.457 0.240 255 HZ2 TRP 29 HZ2 TRP 29 -1.544 5.822 -1.867 256 HZ3 TRP 29 HZ3 TRP 29 0.926 4.851 1.471 257 HH2 TRP 29 HH2 TRP 29 -1.287 5.020 0.448 258 H GLU 30 HN GLU 30 6.057 8.346 0.334 259 HA GLU 30 HA GLU 30 8.705 8.593 -0.890 260 HB2 GLU 30 HB2 GLU 30 9.479 9.109 1.470 261 HB3 GLU 30 HB1 GLU 30 8.304 10.244 0.823 262 HG2 GLU 30 HG2 GLU 30 6.538 9.300 2.172 263 HG3 GLU 30 HG1 GLU 30 7.578 7.978 2.694 264 H ASP 31 HN ASP 31 9.797 6.828 -1.272 265 HA ASP 31 HA ASP 31 9.161 4.241 -0.280 266 HB2 ASP 31 HB2 ASP 31 11.131 3.452 -1.492 267 HB3 ASP 31 HB1 ASP 31 10.251 4.600 -2.491 268 H GLY 32 HN GLY 32 10.176 2.996 1.352 269 HA2 GLY 32 HA2 GLY 32 11.648 4.658 3.338 270 HA3 GLY 32 HA1 GLY 32 10.352 3.542 3.747 271 H HIS 33 HN HIS 33 10.994 1.650 4.523 272 HA HIS 33 HA HIS 33 13.874 0.996 4.351 273 HB2 HIS 33 HB2 HIS 33 11.801 -0.053 6.335 274 HB3 HIS 33 HB1 HIS 33 13.555 -0.197 6.452 275 HD1 HIS 33 HD1 HIS 33 10.984 1.562 8.001 276 HD2 HIS 33 HD2 HIS 33 14.622 2.760 6.392 277 HE1 HIS 33 HE1 HIS 33 11.498 3.774 9.081 278 HE2 HIS 33 HE2 HIS 33 13.561 4.588 7.890 279 H THR 34 HN THR 34 14.466 -0.774 3.127 280 HA THR 34 HA THR 34 12.414 -2.592 2.155 281 HB THR 34 HB THR 34 15.397 -2.745 1.551 282 HG1 THR 34 HG1 THR 34 13.425 -1.059 0.369 283 HG21 THR 34 HG21 THR 34 12.939 -3.472 -0.110 284 HG22 THR 34 HG22 THR 34 13.945 -4.636 0.758 285 HG23 THR 34 HG23 THR 34 14.621 -3.720 -0.591 286 H LEU 35 HN LEU 35 11.820 -3.906 3.920 287 HA LEU 35 HA LEU 35 13.978 -5.153 5.504 288 HB2 LEU 35 HB2 LEU 35 12.303 -5.282 7.347 289 HB3 LEU 35 HB1 LEU 35 12.709 -3.652 6.852 290 HG LEU 35 HG LEU 35 10.412 -4.090 5.372 291 HD11 LEU 35 HD11 LEU 35 9.973 -5.570 7.983 292 HD12 LEU 35 HD12 LEU 35 9.978 -6.282 6.366 293 HD13 LEU 35 HD13 LEU 35 8.728 -5.128 6.813 294 HD21 LEU 35 HD21 LEU 35 9.233 -2.711 7.059 295 HD22 LEU 35 HD22 LEU 35 10.835 -2.083 6.681 296 HD23 LEU 35 HD23 LEU 35 10.567 -2.962 8.188 297 H TRP 36 HN TRP 36 13.266 -7.120 6.653 298 HA TRP 36 HA TRP 36 13.013 -9.212 4.802 299 HB2 TRP 36 HB2 TRP 36 12.718 -9.429 7.820 300 HB3 TRP 36 HB1 TRP 36 13.211 -10.705 6.710 301 HD1 TRP 36 HD1 TRP 36 14.703 -8.395 9.087 302 HE1 TRP 36 HE1 TRP 36 17.211 -8.036 8.648 303 HE3 TRP 36 HE3 TRP 36 15.000 -10.345 4.355 304 HZ2 TRP 36 HZ2 TRP 36 19.069 -8.500 6.589 305 HZ3 TRP 36 HZ3 TRP 36 17.179 -10.337 3.223 306 HH2 TRP 36 HH2 TRP 36 19.175 -9.434 4.315 307 H ALA 37 HN ALA 37 11.296 -10.011 3.878 308 HA ALA 37 HA ALA 37 8.757 -10.431 5.324 309 HB1 ALA 37 HB1 ALA 37 8.946 -9.136 2.583 310 HB2 ALA 37 HB2 ALA 37 8.428 -8.363 4.084 311 HB3 ALA 37 HB3 ALA 37 7.446 -9.641 3.373 312 H SER 38 HN SER 38 7.240 -11.953 4.022 313 HA SER 38 HA SER 38 8.530 -13.353 1.780 314 HB2 SER 38 HB2 SER 38 6.737 -14.618 3.909 315 HB3 SER 38 HB1 SER 38 7.402 -15.435 2.491 316 HG SER 38 HG SER 38 9.335 -14.210 3.943 317 H VAL 39 HN VAL 39 7.412 -12.682 0.028 318 HA VAL 39 HA VAL 39 4.592 -11.814 0.299 319 HB VAL 39 HB VAL 39 5.887 -9.901 -0.256 320 HG11 VAL 39 HG11 VAL 39 7.288 -11.455 -2.470 321 HG12 VAL 39 HG12 VAL 39 7.992 -11.029 -0.908 322 HG13 VAL 39 HG13 VAL 39 7.563 -9.761 -2.054 323 HG21 VAL 39 HG21 VAL 39 4.812 -10.870 -2.942 324 HG22 VAL 39 HG22 VAL 39 5.059 -9.196 -2.447 325 HG23 VAL 39 HG23 VAL 39 3.823 -10.171 -1.658 326 H ASN 40 HN ASN 40 3.244 -13.362 -0.446 327 HA ASN 40 HA ASN 40 3.761 -14.632 -3.070 328 HB2 ASN 40 HB2 ASN 40 2.595 -16.006 -0.595 329 HB3 ASN 40 HB1 ASN 40 2.705 -16.725 -2.200 330 HD21 ASN 40 HD21 ASN 40 4.547 -15.652 0.595 331 HD22 ASN 40 HD22 ASN 40 5.983 -16.532 0.216 332 H MET 41 HN MET 41 1.973 -14.676 -4.406 333 HA MET 41 HA MET 41 -0.315 -13.059 -3.705 334 HB2 MET 41 HB2 MET 41 0.209 -14.750 -6.188 335 HB3 MET 41 HB1 MET 41 -1.142 -13.639 -5.996 336 HG2 MET 41 HG2 MET 41 0.534 -11.782 -5.701 337 HG3 MET 41 HG1 MET 41 1.796 -12.937 -6.120 338 HE1 MET 41 HE1 MET 41 -1.388 -11.009 -7.383 339 HE2 MET 41 HE2 MET 41 -1.851 -12.684 -7.677 340 HE3 MET 41 HE3 MET 41 -1.547 -11.609 -9.038 341 H VAL 42 HN VAL 42 -2.451 -13.750 -3.464 342 HA VAL 42 HA VAL 42 -2.804 -16.279 -2.176 343 HB VAL 42 HB VAL 42 -5.046 -15.604 -1.648 344 HG11 VAL 42 HG11 VAL 42 -3.322 -13.106 -1.555 345 HG12 VAL 42 HG12 VAL 42 -3.328 -14.416 -0.371 346 HG13 VAL 42 HG13 VAL 42 -4.762 -13.410 -0.574 347 HG21 VAL 42 HG21 VAL 42 -4.882 -13.405 -3.746 348 HG22 VAL 42 HG22 VAL 42 -6.217 -13.636 -2.614 349 HG23 VAL 42 HG23 VAL 42 -5.873 -14.864 -3.832 350 H SER 43 HN SER 43 -3.593 -18.129 -2.989 351 HA SER 43 HA SER 43 -4.005 -18.381 -5.870 352 HB2 SER 43 HB2 SER 43 -3.825 -20.489 -3.659 353 HB3 SER 43 HB1 SER 43 -3.791 -20.809 -5.397 354 HG SER 43 HG SER 43 -1.928 -19.074 -5.106 355 H SER 44 HN SER 44 -5.707 -20.349 -6.262 356 HA SER 44 HA SER 44 -8.291 -19.291 -6.023 357 HB2 SER 44 HB2 SER 44 -9.036 -21.561 -6.867 358 HB3 SER 44 HB1 SER 44 -7.748 -20.823 -7.824 359 HG SER 44 HG SER 44 -7.008 -22.810 -7.530 360 H LYS 45 HN LYS 45 -6.575 -21.645 -4.029 361 HA LYS 45 HA LYS 45 -8.544 -22.636 -2.350 362 HB2 LYS 45 HB2 LYS 45 -6.245 -23.439 -2.237 363 HB3 LYS 45 HB1 LYS 45 -5.674 -21.867 -1.700 364 HG2 LYS 45 HG2 LYS 45 -5.706 -23.434 0.173 365 HG3 LYS 45 HG1 LYS 45 -6.880 -22.148 0.448 366 HD2 LYS 45 HD2 LYS 45 -7.845 -24.296 1.118 367 HD3 LYS 45 HD1 LYS 45 -8.710 -23.682 -0.293 368 HE2 LYS 45 HE2 LYS 45 -7.412 -25.213 -1.743 369 HE3 LYS 45 HE1 LYS 45 -6.546 -25.824 -0.330 370 HZ1 LYS 45 HZ1 LYS 45 -8.341 -27.280 -0.982 371 HZ2 LYS 45 HZ2 LYS 45 -9.468 -26.037 -0.797 372 HZ3 LYS 45 HZ3 LYS 45 -8.638 -26.631 0.548 373 H GLU 46 HN GLU 46 -6.737 -19.618 -2.066 374 HA GLU 46 HA GLU 46 -7.733 -18.820 0.464 375 HB2 GLU 46 HB2 GLU 46 -6.573 -17.057 -1.724 376 HB3 GLU 46 HB1 GLU 46 -6.638 -16.699 0.004 377 HG2 GLU 46 HG2 GLU 46 -5.017 -18.899 -1.319 378 HG3 GLU 46 HG1 GLU 46 -4.381 -17.374 -0.705 379 H ALA 47 HN ALA 47 -8.623 -17.898 -2.851 380 HA ALA 47 HA ALA 47 -10.638 -16.022 -2.264 381 HB1 ALA 47 HB1 ALA 47 -11.371 -16.379 -4.587 382 HB2 ALA 47 HB2 ALA 47 -10.369 -17.829 -4.686 383 HB3 ALA 47 HB3 ALA 47 -9.615 -16.246 -4.484 384 H ILE 48 HN ILE 48 -10.892 -19.477 -3.052 385 HA ILE 48 HA ILE 48 -13.695 -19.759 -2.840 386 HB ILE 48 HB ILE 48 -11.451 -21.816 -2.673 387 HG12 ILE 48 HG12 ILE 48 -13.390 -21.178 -4.940 388 HG13 ILE 48 HG11 ILE 48 -11.735 -20.588 -4.844 389 HG21 ILE 48 HG21 ILE 48 -13.130 -23.597 -3.050 390 HG22 ILE 48 HG22 ILE 48 -14.424 -22.415 -2.865 391 HG23 ILE 48 HG23 ILE 48 -13.370 -22.785 -1.500 392 HD11 ILE 48 HD11 ILE 48 -12.557 -23.482 -5.062 393 HD12 ILE 48 HD12 ILE 48 -10.900 -22.871 -5.014 394 HD13 ILE 48 HD13 ILE 48 -11.952 -22.470 -6.376 395 H SER 49 HN SER 49 -11.131 -20.111 -0.418 396 HA SER 49 HA SER 49 -12.832 -21.251 1.625 397 HB2 SER 49 HB2 SER 49 -10.375 -21.717 1.467 398 HB3 SER 49 HB1 SER 49 -10.047 -20.049 1.937 399 HG SER 49 HG SER 49 -11.575 -21.888 3.474 400 H SER 50 HN SER 50 -11.850 -18.019 0.700 401 HA SER 50 HA SER 50 -12.924 -16.785 3.147 402 HB2 SER 50 HB2 SER 50 -11.516 -15.551 0.753 403 HB3 SER 50 HB1 SER 50 -11.975 -14.696 2.224 404 HG SER 50 HG SER 50 -10.083 -16.782 1.932 405 H GLY 51 HN GLY 51 -14.061 -17.705 0.102 406 HA2 GLY 51 HA2 GLY 51 -16.148 -17.447 -0.857 407 HA3 GLY 51 HA1 GLY 51 -16.567 -16.275 0.383 408 H ALA 52 HN ALA 52 -15.580 -14.107 0.171 409 HA ALA 52 HA ALA 52 -14.535 -13.309 -2.448 410 HB1 ALA 52 HB1 ALA 52 -16.988 -13.072 -2.690 411 HB2 ALA 52 HB2 ALA 52 -16.191 -11.497 -2.735 412 HB3 ALA 52 HB3 ALA 52 -17.031 -12.020 -1.273 413 H GLU 53 HN GLU 53 -14.213 -13.255 0.804 414 HA GLU 53 HA GLU 53 -13.640 -10.561 1.476 415 HB2 GLU 53 HB2 GLU 53 -13.961 -12.735 2.982 416 HB3 GLU 53 HB1 GLU 53 -12.221 -12.905 2.803 417 HG2 GLU 53 HG2 GLU 53 -13.685 -10.546 4.034 418 HG3 GLU 53 HG1 GLU 53 -12.847 -11.816 4.914 419 H LEU 54 HN LEU 54 -11.340 -13.238 1.016 420 HA LEU 54 HA LEU 54 -9.432 -11.500 -0.389 421 HB2 LEU 54 HB2 LEU 54 -9.166 -14.433 0.443 422 HB3 LEU 54 HB1 LEU 54 -7.896 -13.437 -0.259 423 HG LEU 54 HG LEU 54 -9.173 -12.996 2.475 424 HD11 LEU 54 HD11 LEU 54 -7.740 -14.981 2.452 425 HD12 LEU 54 HD12 LEU 54 -7.027 -13.691 3.417 426 HD13 LEU 54 HD13 LEU 54 -6.399 -14.030 1.802 427 HD21 LEU 54 HD21 LEU 54 -7.428 -11.277 2.816 428 HD22 LEU 54 HD22 LEU 54 -8.504 -10.862 1.482 429 HD23 LEU 54 HD23 LEU 54 -6.886 -11.490 1.148 430 H ALA 55 HN ALA 55 -8.980 -11.823 -2.568 431 HA ALA 55 HA ALA 55 -10.415 -13.913 -4.070 432 HB1 ALA 55 HB1 ALA 55 -11.869 -11.916 -4.139 433 HB2 ALA 55 HB2 ALA 55 -11.195 -12.251 -5.734 434 HB3 ALA 55 HB3 ALA 55 -10.530 -10.943 -4.750 435 H ILE 56 HN ILE 56 -9.456 -14.349 -6.137 436 HA ILE 56 HA ILE 56 -6.674 -14.546 -6.089 437 HB ILE 56 HB ILE 56 -8.519 -14.763 -8.516 438 HG12 ILE 56 HG12 ILE 56 -7.470 -16.981 -6.687 439 HG13 ILE 56 HG11 ILE 56 -9.086 -16.291 -6.585 440 HG21 ILE 56 HG21 ILE 56 -6.754 -16.158 -9.556 441 HG22 ILE 56 HG22 ILE 56 -5.689 -15.841 -8.184 442 HG23 ILE 56 HG23 ILE 56 -6.179 -14.519 -9.243 443 HD11 ILE 56 HD11 ILE 56 -7.957 -17.828 -8.921 444 HD12 ILE 56 HD12 ILE 56 -9.574 -17.126 -8.839 445 HD13 ILE 56 HD13 ILE 56 -9.114 -18.414 -7.728 446 H GLY 57 HN GLY 57 -5.110 -13.104 -6.496 447 HA2 GLY 57 HA2 GLY 57 -4.106 -11.396 -7.941 448 HA3 GLY 57 HA1 GLY 57 -5.681 -10.623 -8.057 449 H THR 58 HN THR 58 -5.951 -11.372 -5.050 450 HA THR 58 HA THR 58 -4.637 -9.149 -3.774 451 HB THR 58 HB THR 58 -5.995 -11.619 -2.576 452 HG1 THR 58 HG1 THR 58 -7.281 -10.090 -3.873 453 HG21 THR 58 HG21 THR 58 -6.200 -10.318 -0.468 454 HG22 THR 58 HG22 THR 58 -5.229 -9.021 -1.172 455 HG23 THR 58 HG23 THR 58 -4.507 -10.606 -0.883 456 H VAL 59 HN VAL 59 -2.913 -9.474 -2.128 457 HA VAL 59 HA VAL 59 -1.060 -11.688 -2.706 458 HB VAL 59 HB VAL 59 -0.188 -8.751 -2.527 459 HG11 VAL 59 HG11 VAL 59 1.975 -9.603 -3.392 460 HG12 VAL 59 HG12 VAL 59 1.336 -11.248 -3.387 461 HG13 VAL 59 HG13 VAL 59 1.543 -10.380 -1.863 462 HG21 VAL 59 HG21 VAL 59 -0.571 -10.411 -5.054 463 HG22 VAL 59 HG22 VAL 59 0.200 -8.824 -4.989 464 HG23 VAL 59 HG23 VAL 59 -1.511 -8.995 -4.586 465 H ARG 60 HN ARG 60 -0.711 -12.644 -0.767 466 HA ARG 60 HA ARG 60 -0.979 -11.158 1.739 467 HB2 ARG 60 HB2 ARG 60 -1.939 -13.472 1.467 468 HB3 ARG 60 HB1 ARG 60 -0.300 -14.098 1.304 469 HG2 ARG 60 HG2 ARG 60 0.215 -13.233 3.600 470 HG3 ARG 60 HG1 ARG 60 -1.470 -12.725 3.754 471 HD2 ARG 60 HD2 ARG 60 -0.419 -15.553 3.450 472 HD3 ARG 60 HD1 ARG 60 -1.188 -14.853 4.879 473 HE ARG 60 HE ARG 60 -2.507 -15.621 2.359 474 HH11 ARG 60 HH11 ARG 60 -2.816 -14.597 5.685 475 HH12 ARG 60 HH12 ARG 60 -4.511 -14.912 5.733 476 HH21 ARG 60 HH21 ARG 60 -4.712 -16.083 2.466 477 HH22 ARG 60 HH22 ARG 60 -5.579 -15.767 3.933 478 H ILE 61 HN ILE 61 0.734 -10.636 3.026 479 HA ILE 61 HA ILE 61 3.502 -11.137 2.124 480 HB ILE 61 HB ILE 61 2.445 -8.290 2.583 481 HG12 ILE 61 HG12 ILE 61 3.122 -9.647 -0.069 482 HG13 ILE 61 HG11 ILE 61 1.495 -9.303 0.490 483 HG21 ILE 61 HG21 ILE 61 5.147 -9.279 1.551 484 HG22 ILE 61 HG22 ILE 61 4.837 -8.589 3.148 485 HG23 ILE 61 HG23 ILE 61 4.660 -7.591 1.707 486 HD11 ILE 61 HD11 ILE 61 2.140 -7.731 -1.165 487 HD12 ILE 61 HD12 ILE 61 3.603 -7.313 -0.279 488 HD13 ILE 61 HD13 ILE 61 2.021 -6.896 0.383 489 H TRP 62 HN TRP 62 4.341 -11.987 3.976 490 HA TRP 62 HA TRP 62 3.517 -10.938 6.617 491 HB2 TRP 62 HB2 TRP 62 5.308 -13.325 5.942 492 HB3 TRP 62 HB1 TRP 62 4.744 -12.877 7.551 493 HD1 TRP 62 HD1 TRP 62 3.327 -14.131 4.185 494 HE1 TRP 62 HE1 TRP 62 1.214 -15.479 4.678 495 HE3 TRP 62 HE3 TRP 62 2.915 -13.256 9.199 496 HZ2 TRP 62 HZ2 TRP 62 -0.420 -16.134 6.885 497 HZ3 TRP 62 HZ3 TRP 62 1.051 -14.281 10.435 498 HH2 TRP 62 HH2 TRP 62 -0.593 -15.691 9.298 499 H ILE 63 HN ILE 63 4.773 -9.468 7.612 500 HA ILE 63 HA ILE 63 7.655 -9.199 6.862 501 HB ILE 63 HB ILE 63 7.510 -6.806 7.536 502 HG12 ILE 63 HG12 ILE 63 4.477 -7.167 7.610 503 HG13 ILE 63 HG11 ILE 63 5.484 -7.049 9.048 504 HG21 ILE 63 HG21 ILE 63 5.598 -7.553 5.291 505 HG22 ILE 63 HG22 ILE 63 7.349 -7.334 5.168 506 HG23 ILE 63 HG23 ILE 63 6.317 -5.953 5.536 507 HD11 ILE 63 HD11 ILE 63 4.409 -4.938 8.555 508 HD12 ILE 63 HD12 ILE 63 5.125 -4.919 6.946 509 HD13 ILE 63 HD13 ILE 63 6.157 -4.785 8.373 510 H ARG 64 HN ARG 64 9.085 -8.639 8.694 511 HA ARG 64 HA ARG 64 8.613 -9.494 11.244 512 HB2 ARG 64 HB2 ARG 64 10.224 -7.018 10.484 513 HB3 ARG 64 HB1 ARG 64 10.338 -7.866 12.026 514 HG2 ARG 64 HG2 ARG 64 11.109 -8.938 9.300 515 HG3 ARG 64 HG1 ARG 64 12.208 -8.488 10.609 516 HD2 ARG 64 HD2 ARG 64 10.246 -10.811 10.563 517 HD3 ARG 64 HD1 ARG 64 12.006 -10.908 10.547 518 HE ARG 64 HE ARG 64 11.196 -9.557 12.888 519 HH11 ARG 64 HH11 ARG 64 11.063 -12.783 11.542 520 HH12 ARG 64 HH12 ARG 64 11.052 -13.556 13.089 521 HH21 ARG 64 HH21 ARG 64 11.137 -10.568 14.891 522 HH22 ARG 64 HH22 ARG 64 11.081 -12.298 14.996 523 H TYR 65 HN TYR 65 7.788 -8.677 13.140 524 HA TYR 65 HA TYR 65 5.309 -7.413 13.030 525 HB2 TYR 65 HB2 TYR 65 6.158 -8.982 14.821 526 HB3 TYR 65 HB1 TYR 65 7.111 -7.659 15.482 527 HD1 TYR 65 HD2 TYR 65 3.691 -8.947 14.974 528 HD2 TYR 65 HD1 TYR 65 6.008 -5.900 16.851 529 HE1 TYR 65 HE2 TYR 65 1.757 -8.321 16.333 530 HE2 TYR 65 HE1 TYR 65 4.055 -5.271 18.215 531 HH TYR 65 HH TYR 65 1.325 -7.224 18.511 532 H ARG 66 HN ARG 66 4.638 -5.334 13.118 533 HA ARG 66 HA ARG 66 6.268 -3.180 14.193 534 HB2 ARG 66 HB2 ARG 66 5.696 -3.470 11.226 535 HB3 ARG 66 HB1 ARG 66 5.802 -1.857 11.927 536 HG2 ARG 66 HG2 ARG 66 8.070 -2.201 12.615 537 HG3 ARG 66 HG1 ARG 66 7.993 -3.917 12.233 538 HD2 ARG 66 HD2 ARG 66 7.858 -3.423 9.840 539 HD3 ARG 66 HD1 ARG 66 7.789 -1.692 10.182 540 HE ARG 66 HE ARG 66 10.047 -1.700 10.234 541 HH11 ARG 66 HH11 ARG 66 9.081 -4.973 11.137 542 HH12 ARG 66 HH12 ARG 66 10.720 -5.513 11.318 543 HH21 ARG 66 HH21 ARG 66 12.161 -2.458 10.465 544 HH22 ARG 66 HH22 ARG 66 12.449 -4.106 10.925 545 H LYS 67 HN LYS 67 5.022 -1.815 15.221 546 HA LYS 67 HA LYS 67 2.144 -1.730 14.989 547 HB2 LYS 67 HB2 LYS 67 4.110 -0.113 16.667 548 HB3 LYS 67 HB1 LYS 67 2.361 0.068 16.767 549 HG2 LYS 67 HG2 LYS 67 3.918 -2.455 17.440 550 HG3 LYS 67 HG1 LYS 67 3.264 -1.287 18.598 551 HD2 LYS 67 HD2 LYS 67 0.958 -1.777 17.634 552 HD3 LYS 67 HD1 LYS 67 1.704 -3.087 16.707 553 HE2 LYS 67 HE2 LYS 67 0.666 -3.948 18.746 554 HE3 LYS 67 HE1 LYS 67 2.413 -4.159 18.816 555 HZ1 LYS 67 HZ1 LYS 67 0.889 -1.992 20.151 556 HZ2 LYS 67 HZ2 LYS 67 2.559 -2.220 20.230 557 HZ3 LYS 67 HZ3 LYS 67 1.520 -3.367 20.903 558 H ASP 68 HN ASP 68 4.736 -0.193 13.376 559 HA ASP 68 HA ASP 68 3.405 2.395 13.023 560 HB2 ASP 68 HB2 ASP 68 5.465 3.145 11.930 561 HB3 ASP 68 HB1 ASP 68 5.858 2.360 13.452 562 H ILE 69 HN ILE 69 3.786 -0.592 11.337 563 HA ILE 69 HA ILE 69 3.192 0.410 8.699 564 HB ILE 69 HB ILE 69 3.090 -2.444 9.775 565 HG12 ILE 69 HG12 ILE 69 5.360 -1.513 9.881 566 HG13 ILE 69 HG11 ILE 69 5.284 -2.702 8.594 567 HG21 ILE 69 HG21 ILE 69 3.125 -3.157 7.380 568 HG22 ILE 69 HG22 ILE 69 2.942 -1.472 6.891 569 HG23 ILE 69 HG23 ILE 69 1.657 -2.270 7.799 570 HD11 ILE 69 HD11 ILE 69 5.271 0.292 8.258 571 HD12 ILE 69 HD12 ILE 69 5.152 -0.887 6.949 572 HD13 ILE 69 HD13 ILE 69 6.610 -0.811 7.937 573 H ASN 70 HN ASN 70 1.288 0.779 7.828 574 HA ASN 70 HA ASN 70 -1.218 -0.219 8.968 575 HB2 ASN 70 HB2 ASN 70 -0.668 2.081 9.955 576 HB3 ASN 70 HB1 ASN 70 -0.793 2.734 8.326 577 HD21 ASN 70 HD21 ASN 70 -2.582 3.982 8.627 578 HD22 ASN 70 HD22 ASN 70 -4.140 3.387 9.068 579 H ALA 71 HN ALA 71 -3.067 0.322 7.448 580 HA ALA 71 HA ALA 71 -2.543 -0.519 4.818 581 HB1 ALA 71 HB1 ALA 71 -4.658 -0.971 5.992 582 HB2 ALA 71 HB2 ALA 71 -4.950 -0.193 4.435 583 HB3 ALA 71 HB3 ALA 71 -5.065 0.745 5.928 584 H THR 72 HN THR 72 -2.081 2.526 6.121 585 HA THR 72 HA THR 72 -2.676 4.115 3.783 586 HB THR 72 HB THR 72 -1.732 5.985 5.217 587 HG1 THR 72 HG1 THR 72 -0.709 5.485 7.015 588 HG21 THR 72 HG21 THR 72 -4.158 5.448 5.301 589 HG22 THR 72 HG22 THR 72 -3.555 6.015 6.855 590 HG23 THR 72 HG23 THR 72 -3.851 4.295 6.601 591 H SER 73 HN SER 73 -0.462 1.933 3.917 592 HA SER 73 HA SER 73 1.511 3.539 2.431 593 HB2 SER 73 HB2 SER 73 2.098 1.291 4.397 594 HB3 SER 73 HB1 SER 73 3.294 1.947 3.270 595 HG SER 73 HG SER 73 2.176 4.009 4.484 596 H ARG 74 HN ARG 74 2.889 2.068 1.016 597 HA ARG 74 HA ARG 74 1.292 -0.110 -0.200 598 HB2 ARG 74 HB2 ARG 74 3.266 1.750 -1.623 599 HB3 ARG 74 HB1 ARG 74 2.337 0.445 -2.371 600 HG2 ARG 74 HG2 ARG 74 0.249 1.649 -1.905 601 HG3 ARG 74 HG1 ARG 74 1.167 2.953 -1.142 602 HD2 ARG 74 HD2 ARG 74 0.612 3.630 -3.385 603 HD3 ARG 74 HD1 ARG 74 2.347 3.324 -3.326 604 HE ARG 74 HE ARG 74 1.262 0.956 -4.180 605 HH11 ARG 74 HH11 ARG 74 1.141 4.260 -5.385 606 HH12 ARG 74 HH12 ARG 74 0.889 3.775 -7.029 607 HH21 ARG 74 HH21 ARG 74 0.901 0.341 -6.320 608 HH22 ARG 74 HH22 ARG 74 0.759 1.548 -7.557 609 H ILE 75 HN ILE 75 2.348 -2.009 -0.541 610 HA ILE 75 HA ILE 75 5.120 -2.317 0.407 611 HB ILE 75 HB ILE 75 3.008 -4.408 -0.299 612 HG12 ILE 75 HG12 ILE 75 2.398 -3.160 1.756 613 HG13 ILE 75 HG11 ILE 75 2.815 -4.824 2.133 614 HG21 ILE 75 HG21 ILE 75 5.756 -4.779 0.928 615 HG22 ILE 75 HG22 ILE 75 5.244 -5.295 -0.678 616 HG23 ILE 75 HG23 ILE 75 4.544 -6.044 0.755 617 HD11 ILE 75 HD11 ILE 75 4.571 -2.411 2.559 618 HD12 ILE 75 HD12 ILE 75 5.010 -4.082 2.930 619 HD13 ILE 75 HD13 ILE 75 3.683 -3.303 3.794 620 H LYS 76 HN LYS 76 6.506 -1.795 -1.283 621 HA LYS 76 HA LYS 76 6.009 -2.864 -3.976 622 HB2 LYS 76 HB2 LYS 76 6.947 -0.560 -3.724 623 HB3 LYS 76 HB1 LYS 76 8.382 -1.241 -2.956 624 HG2 LYS 76 HG2 LYS 76 8.885 -2.494 -5.045 625 HG3 LYS 76 HG1 LYS 76 7.447 -1.791 -5.802 626 HD2 LYS 76 HD2 LYS 76 8.448 0.477 -5.513 627 HD3 LYS 76 HD1 LYS 76 9.896 -0.264 -4.823 628 HE2 LYS 76 HE2 LYS 76 10.294 -1.441 -6.959 629 HE3 LYS 76 HE1 LYS 76 8.851 -0.704 -7.646 630 HZ1 LYS 76 HZ1 LYS 76 11.276 0.721 -6.727 631 HZ2 LYS 76 HZ2 LYS 76 9.886 1.465 -7.326 632 HZ3 LYS 76 HZ3 LYS 76 10.809 0.473 -8.331 633 H VAL 77 HN VAL 77 6.993 -4.711 -4.703 634 HA VAL 77 HA VAL 77 8.449 -6.341 -2.783 635 HB VAL 77 HB VAL 77 7.559 -6.955 -5.632 636 HG11 VAL 77 HG11 VAL 77 9.423 -8.423 -4.993 637 HG12 VAL 77 HG12 VAL 77 7.919 -9.345 -5.025 638 HG13 VAL 77 HG13 VAL 77 8.612 -8.836 -3.483 639 HG21 VAL 77 HG21 VAL 77 5.658 -6.508 -4.142 640 HG22 VAL 77 HG22 VAL 77 6.276 -7.681 -2.979 641 HG23 VAL 77 HG23 VAL 77 5.721 -8.224 -4.565 642 H SER 78 HN SER 78 10.572 -6.355 -2.650 643 HA SER 78 HA SER 78 12.337 -5.335 -4.730 644 HB2 SER 78 HB2 SER 78 12.807 -4.818 -2.340 645 HB3 SER 78 HB1 SER 78 12.980 -6.538 -1.991 646 HG SER 78 HG SER 78 14.602 -4.966 -3.710 647 H THR 79 HN THR 79 11.342 -8.416 -3.322 648 HA THR 79 HA THR 79 12.705 -9.985 -5.352 649 HB THR 79 HB THR 79 13.684 -11.547 -3.625 650 HG1 THR 79 HG1 THR 79 12.409 -10.903 -1.861 651 HG21 THR 79 HG21 THR 79 15.663 -10.232 -3.001 652 HG22 THR 79 HG22 THR 79 14.801 -8.740 -3.382 653 HG23 THR 79 HG23 THR 79 15.191 -9.881 -4.669 654 H GLY 80 HN GLY 80 11.296 -11.596 -5.916 655 HA2 GLY 80 HA2 GLY 80 9.789 -13.367 -4.651 656 HA3 GLY 80 HA1 GLY 80 8.801 -11.932 -4.395 657 HA PRO 81 HA PRO 81 7.602 -13.874 -8.516 658 HB2 PRO 81 HB2 PRO 81 4.953 -14.223 -8.060 659 HB3 PRO 81 HB1 PRO 81 6.155 -15.383 -7.470 660 HG2 PRO 81 HG2 PRO 81 4.813 -13.119 -5.969 661 HG3 PRO 81 HG1 PRO 81 5.027 -14.811 -5.459 662 HD2 PRO 81 HD2 PRO 81 6.702 -12.833 -4.618 663 HD3 PRO 81 HD1 PRO 81 7.277 -14.492 -4.888 664 H LEU 82 HN LEU 82 7.058 -11.003 -6.870 665 HA LEU 82 HA LEU 82 5.821 -9.681 -9.215 666 HB2 LEU 82 HB2 LEU 82 5.302 -9.092 -6.271 667 HB3 LEU 82 HB1 LEU 82 4.681 -8.140 -7.613 668 HG LEU 82 HG LEU 82 3.945 -11.043 -7.060 669 HD11 LEU 82 HD11 LEU 82 2.378 -8.510 -6.494 670 HD12 LEU 82 HD12 LEU 82 3.082 -9.605 -5.301 671 HD13 LEU 82 HD13 LEU 82 1.762 -10.154 -6.329 672 HD21 LEU 82 HD21 LEU 82 2.776 -9.076 -9.067 673 HD22 LEU 82 HD22 LEU 82 2.163 -10.699 -8.739 674 HD23 LEU 82 HD23 LEU 82 3.761 -10.493 -9.448 675 H ALA 83 HN ALA 83 8.617 -10.036 -8.600 676 HA ALA 83 HA ALA 83 9.812 -7.940 -7.141 677 HB1 ALA 83 HB1 ALA 83 10.968 -10.047 -7.710 678 HB2 ALA 83 HB2 ALA 83 11.901 -8.638 -8.220 679 HB3 ALA 83 HB3 ALA 83 10.995 -9.572 -9.410 680 H GLY 84 HN GLY 84 9.402 -5.853 -7.591 681 HA2 GLY 84 HA2 GLY 84 10.263 -3.956 -8.895 682 HA3 GLY 84 HA1 GLY 84 9.797 -4.811 -10.356 683 H ARG 85 HN ARG 85 7.280 -5.635 -8.727 684 HA ARG 85 HA ARG 85 5.595 -3.413 -9.544 685 HB2 ARG 85 HB2 ARG 85 4.999 -6.199 -8.471 686 HB3 ARG 85 HB1 ARG 85 3.732 -5.006 -8.765 687 HG2 ARG 85 HG2 ARG 85 4.271 -4.927 -11.138 688 HG3 ARG 85 HG1 ARG 85 5.654 -6.001 -10.901 689 HD2 ARG 85 HD2 ARG 85 4.234 -7.853 -10.378 690 HD3 ARG 85 HD1 ARG 85 2.814 -6.813 -10.230 691 HE ARG 85 HE ARG 85 4.200 -7.335 -12.803 692 HH11 ARG 85 HH11 ARG 85 1.237 -6.839 -10.987 693 HH12 ARG 85 HH12 ARG 85 0.208 -7.153 -12.349 694 HH21 ARG 85 HH21 ARG 85 2.867 -7.690 -14.596 695 HH22 ARG 85 HH22 ARG 85 1.141 -7.630 -14.415 696 H VAL 86 HN VAL 86 3.905 -2.612 -8.115 697 HA VAL 86 HA VAL 86 4.796 -2.313 -5.319 698 HB VAL 86 HB VAL 86 5.580 -0.336 -6.441 699 HG11 VAL 86 HG11 VAL 86 4.182 -0.361 -8.461 700 HG12 VAL 86 HG12 VAL 86 4.155 1.232 -7.702 701 HG13 VAL 86 HG13 VAL 86 2.780 0.142 -7.515 702 HG21 VAL 86 HG21 VAL 86 4.658 -0.002 -4.180 703 HG22 VAL 86 HG22 VAL 86 3.069 0.342 -4.865 704 HG23 VAL 86 HG23 VAL 86 4.413 1.440 -5.173 705 H LEU 87 HN LEU 87 3.360 -3.482 -4.394 706 HA LEU 87 HA LEU 87 0.515 -3.485 -4.987 707 HB2 LEU 87 HB2 LEU 87 2.112 -4.897 -2.802 708 HB3 LEU 87 HB1 LEU 87 0.400 -5.133 -3.100 709 HG LEU 87 HG LEU 87 1.574 -7.017 -4.013 710 HD11 LEU 87 HD11 LEU 87 0.895 -6.994 -6.356 711 HD12 LEU 87 HD12 LEU 87 0.716 -5.236 -6.305 712 HD13 LEU 87 HD13 LEU 87 -0.335 -6.263 -5.321 713 HD21 LEU 87 HD21 LEU 87 3.813 -6.045 -4.252 714 HD22 LEU 87 HD22 LEU 87 3.282 -5.125 -5.662 715 HD23 LEU 87 HD23 LEU 87 3.317 -6.891 -5.715 716 H ASN 88 HN ASN 88 -1.088 -2.776 -3.544 717 HA ASN 88 HA ASN 88 -0.301 -0.721 -1.564 718 HB2 ASN 88 HB2 ASN 88 -2.946 -0.971 -3.075 719 HB3 ASN 88 HB1 ASN 88 -2.500 0.329 -1.974 720 HD21 ASN 88 HD21 ASN 88 -2.444 2.074 -3.293 721 HD22 ASN 88 HD22 ASN 88 -1.533 2.193 -4.754 722 H ILE 89 HN ILE 89 -1.408 -0.746 0.503 723 HA ILE 89 HA ILE 89 -1.986 -3.505 1.294 724 HB ILE 89 HB ILE 89 -1.798 -1.029 3.071 725 HG12 ILE 89 HG12 ILE 89 0.366 -3.123 2.567 726 HG13 ILE 89 HG11 ILE 89 0.351 -1.523 1.829 727 HG21 ILE 89 HG21 ILE 89 -3.060 -2.874 4.134 728 HG22 ILE 89 HG22 ILE 89 -1.505 -2.657 4.935 729 HG23 ILE 89 HG23 ILE 89 -1.733 -3.996 3.807 730 HD11 ILE 89 HD11 ILE 89 0.586 -2.139 4.774 731 HD12 ILE 89 HD12 ILE 89 0.490 -0.511 4.081 732 HD13 ILE 89 HD13 ILE 89 1.860 -1.561 3.702 733 H ILE 90 HN ILE 90 -4.010 -3.984 0.644 734 HA ILE 90 HA ILE 90 -6.269 -2.199 0.990 735 HB ILE 90 HB ILE 90 -7.634 -4.109 0.092 736 HG12 ILE 90 HG12 ILE 90 -4.970 -5.557 -0.313 737 HG13 ILE 90 HG11 ILE 90 -6.093 -5.957 0.971 738 HG21 ILE 90 HG21 ILE 90 -6.735 -4.018 -2.221 739 HG22 ILE 90 HG22 ILE 90 -5.211 -3.372 -1.602 740 HG23 ILE 90 HG23 ILE 90 -6.695 -2.431 -1.447 741 HD11 ILE 90 HD11 ILE 90 -6.614 -6.182 -1.986 742 HD12 ILE 90 HD12 ILE 90 -7.773 -6.582 -0.711 743 HD13 ILE 90 HD13 ILE 90 -6.276 -7.503 -0.869 744 H GLY 91 HN GLY 91 -7.979 -2.489 2.441 745 HA2 GLY 91 HA2 GLY 91 -9.174 -3.253 4.265 746 HA3 GLY 91 HA1 GLY 91 -8.134 -4.669 4.322 747 H GLN 92 HN GLN 92 -6.531 -4.744 5.845 748 HA GLN 92 HA GLN 92 -5.461 -2.433 7.199 749 HB2 GLN 92 HB2 GLN 92 -6.312 -2.990 9.467 750 HB3 GLN 92 HB1 GLN 92 -7.632 -2.587 8.376 751 HG2 GLN 92 HG2 GLN 92 -8.239 -4.925 8.141 752 HG3 GLN 92 HG1 GLN 92 -6.823 -5.430 9.061 753 HE21 GLN 92 HE21 GLN 92 -8.125 -6.553 10.562 754 HE22 GLN 92 HE22 GLN 92 -9.082 -5.726 11.737 755 HA PRO 93 HA PRO 93 -2.262 -5.613 7.882 756 HB2 PRO 93 HB2 PRO 93 -0.725 -4.348 9.766 757 HB3 PRO 93 HB1 PRO 93 -0.719 -3.873 8.061 758 HG2 PRO 93 HG2 PRO 93 -2.253 -2.654 10.357 759 HG3 PRO 93 HG1 PRO 93 -1.283 -1.850 9.103 760 HD2 PRO 93 HD2 PRO 93 -3.977 -1.980 8.907 761 HD3 PRO 93 HD1 PRO 93 -2.939 -2.092 7.470 762 H LEU 94 HN LEU 94 -2.529 -7.416 9.078 763 HA LEU 94 HA LEU 94 -3.873 -7.274 11.717 764 HB2 LEU 94 HB2 LEU 94 -5.036 -8.368 9.677 765 HB3 LEU 94 HB1 LEU 94 -3.854 -9.650 9.812 766 HG LEU 94 HG LEU 94 -6.129 -10.146 10.785 767 HD11 LEU 94 HD11 LEU 94 -3.861 -10.354 12.773 768 HD12 LEU 94 HD12 LEU 94 -4.211 -11.482 11.460 769 HD13 LEU 94 HD13 LEU 94 -5.356 -11.296 12.786 770 HD21 LEU 94 HD21 LEU 94 -6.765 -9.211 12.957 771 HD22 LEU 94 HD22 LEU 94 -6.631 -7.944 11.739 772 HD23 LEU 94 HD23 LEU 94 -5.351 -8.153 12.941 773 HA PRO 95 HA PRO 95 0.280 -8.663 13.190 774 HB2 PRO 95 HB2 PRO 95 -1.397 -8.939 15.705 775 HB3 PRO 95 HB1 PRO 95 0.217 -8.235 15.492 776 HG2 PRO 95 HG2 PRO 95 -1.874 -6.632 15.742 777 HG3 PRO 95 HG1 PRO 95 -0.618 -6.263 14.539 778 HD2 PRO 95 HD2 PRO 95 -3.357 -7.465 14.108 779 HD3 PRO 95 HD1 PRO 95 -2.493 -6.249 13.140 780 H ASP 96 HN ASP 96 1.151 -10.692 13.349 781 HA ASP 96 HA ASP 96 -0.113 -13.089 12.905 782 HB2 ASP 96 HB2 ASP 96 2.268 -12.845 12.709 783 HB3 ASP 96 HB1 ASP 96 2.432 -12.409 14.403 784 H ALA 97 HN ALA 97 -0.563 -14.935 14.245 785 HA ALA 97 HA ALA 97 -2.190 -14.511 16.503 786 HB1 ALA 97 HB1 ALA 97 -2.254 -16.969 16.683 787 HB2 ALA 97 HB2 ALA 97 -0.876 -17.090 15.582 788 HB3 ALA 97 HB3 ALA 97 -2.411 -16.444 15.001 789 H ALA 98 HN ALA 98 1.226 -15.432 16.268 790 HA ALA 98 HA ALA 98 1.543 -15.477 19.198 791 HB1 ALA 98 HB1 ALA 98 3.809 -16.340 18.752 792 HB2 ALA 98 HB2 ALA 98 3.550 -16.139 17.016 793 HB3 ALA 98 HB3 ALA 98 2.587 -17.306 17.920 794 H ARG 99 HN ARG 99 1.675 -13.233 16.717 795 HA ARG 99 HA ARG 99 2.385 -11.116 16.444 796 HB2 ARG 99 HB2 ARG 99 2.721 -11.268 19.459 797 HB3 ARG 99 HB1 ARG 99 3.057 -9.797 18.563 798 HG2 ARG 99 HG2 ARG 99 0.877 -9.525 19.433 799 HG3 ARG 99 HG1 ARG 99 0.652 -9.879 17.721 800 HD2 ARG 99 HD2 ARG 99 -0.994 -11.069 19.099 801 HD3 ARG 99 HD1 ARG 99 0.072 -12.212 18.279 802 HE ARG 99 HE ARG 99 1.270 -11.887 20.698 803 HH11 ARG 99 HH11 ARG 99 -2.021 -12.732 19.824 804 HH12 ARG 99 HH12 ARG 99 -2.258 -13.711 21.231 805 HH21 ARG 99 HH21 ARG 99 0.924 -13.163 22.548 806 HH22 ARG 99 HH22 ARG 99 -0.610 -13.950 22.766 807 H THR 100 HN THR 100 4.335 -13.359 16.220 808 HA THR 100 HA THR 100 6.946 -12.236 16.903 809 HB THR 100 HB THR 100 7.856 -14.260 15.753 810 HG1 THR 100 HG1 THR 100 5.109 -14.623 15.088 811 HG21 THR 100 HG21 THR 100 5.560 -14.915 17.655 812 HG22 THR 100 HG22 THR 100 7.204 -14.480 18.134 813 HG23 THR 100 HG23 THR 100 6.906 -15.986 17.265 814 H ARG 101 HN ARG 101 4.775 -11.453 14.614 815 HA ARG 101 HA ARG 101 6.401 -10.275 12.628 816 HB2 ARG 101 HB2 ARG 101 5.562 -11.849 10.722 817 HB3 ARG 101 HB1 ARG 101 6.877 -12.458 11.719 818 HG2 ARG 101 HG2 ARG 101 5.489 -13.952 12.885 819 HG3 ARG 101 HG1 ARG 101 4.031 -13.101 12.414 820 HD2 ARG 101 HD2 ARG 101 4.254 -13.886 10.140 821 HD3 ARG 101 HD1 ARG 101 5.744 -14.757 10.563 822 HE ARG 101 HE ARG 101 3.641 -15.504 12.304 823 HH11 ARG 101 HH11 ARG 101 4.647 -16.105 8.994 824 HH12 ARG 101 HH12 ARG 101 3.737 -17.572 8.883 825 HH21 ARG 101 HH21 ARG 101 2.458 -17.337 12.139 826 HH22 ARG 101 HH22 ARG 101 2.495 -18.281 10.685 827 H LEU 102 HN LEU 102 4.651 -10.054 10.557 828 HA LEU 102 HA LEU 102 2.074 -9.195 11.679 829 HB2 LEU 102 HB2 LEU 102 4.140 -7.383 11.410 830 HB3 LEU 102 HB1 LEU 102 3.449 -7.259 9.812 831 HG LEU 102 HG LEU 102 2.548 -5.474 11.108 832 HD11 LEU 102 HD11 LEU 102 0.371 -7.569 10.992 833 HD12 LEU 102 HD12 LEU 102 0.891 -6.528 9.668 834 HD13 LEU 102 HD13 LEU 102 0.144 -5.818 11.094 835 HD21 LEU 102 HD21 LEU 102 1.773 -7.471 13.249 836 HD22 LEU 102 HD22 LEU 102 1.407 -5.744 13.267 837 HD23 LEU 102 HD23 LEU 102 3.081 -6.289 13.336 838 H GLU 103 HN GLU 103 0.546 -10.096 10.415 839 HA GLU 103 HA GLU 103 1.058 -10.957 7.698 840 HB2 GLU 103 HB2 GLU 103 -0.377 -12.329 9.184 841 HB3 GLU 103 HB1 GLU 103 -1.519 -10.997 9.334 842 HG2 GLU 103 HG2 GLU 103 -1.897 -11.142 6.845 843 HG3 GLU 103 HG1 GLU 103 -0.889 -12.592 6.830 844 H ILE 104 HN ILE 104 1.163 -9.376 6.224 845 HA ILE 104 HA ILE 104 -0.808 -7.169 6.184 846 HB ILE 104 HB ILE 104 1.621 -7.545 4.349 847 HG12 ILE 104 HG12 ILE 104 2.428 -7.386 6.687 848 HG13 ILE 104 HG11 ILE 104 2.881 -5.959 5.764 849 HG21 ILE 104 HG21 ILE 104 -0.024 -5.051 4.936 850 HG22 ILE 104 HG22 ILE 104 -0.067 -6.003 3.447 851 HG23 ILE 104 HG23 ILE 104 1.397 -5.124 3.889 852 HD11 ILE 104 HD11 ILE 104 2.192 -5.366 7.988 853 HD12 ILE 104 HD12 ILE 104 0.633 -6.154 7.757 854 HD13 ILE 104 HD13 ILE 104 1.047 -4.718 6.817 855 H LEU 105 HN LEU 105 -2.095 -6.883 4.274 856 HA LEU 105 HA LEU 105 -1.890 -8.901 2.146 857 HB2 LEU 105 HB2 LEU 105 -4.259 -9.198 1.934 858 HB3 LEU 105 HB1 LEU 105 -3.841 -9.530 3.603 859 HG LEU 105 HG LEU 105 -5.134 -6.935 2.643 860 HD11 LEU 105 HD11 LEU 105 -6.675 -8.806 2.335 861 HD12 LEU 105 HD12 LEU 105 -7.212 -7.755 3.644 862 HD13 LEU 105 HD13 LEU 105 -6.441 -9.302 4.015 863 HD21 LEU 105 HD21 LEU 105 -3.835 -6.633 4.710 864 HD22 LEU 105 HD22 LEU 105 -4.712 -7.959 5.473 865 HD23 LEU 105 HD23 LEU 105 -5.565 -6.480 5.017 866 H CYS 106 HN CYS 106 -2.608 -8.100 0.151 867 HA CYS 106 HA CYS 106 -2.695 -5.214 -0.235 868 HB2 CYS 106 HB2 CYS 106 -0.229 -6.828 -1.041 869 HB3 CYS 106 HB1 CYS 106 -0.551 -5.166 -1.534 870 HG CYS 106 HG CYS 106 -0.787 -4.948 1.617 871 H ARG 107 HN ARG 107 -2.627 -4.694 -2.607 872 HA ARG 107 HA ARG 107 -2.832 -6.822 -4.549 873 HB2 ARG 107 HB2 ARG 107 -5.189 -6.654 -3.636 874 HB3 ARG 107 HB1 ARG 107 -5.235 -4.960 -4.114 875 HG2 ARG 107 HG2 ARG 107 -5.067 -5.583 -6.476 876 HG3 ARG 107 HG1 ARG 107 -4.873 -7.284 -6.043 877 HD2 ARG 107 HD2 ARG 107 -7.147 -7.268 -5.049 878 HD3 ARG 107 HD1 ARG 107 -7.341 -5.583 -5.555 879 HE ARG 107 HE ARG 107 -6.744 -6.768 -7.884 880 HH11 ARG 107 HH11 ARG 107 -9.081 -7.705 -5.432 881 HH12 ARG 107 HH12 ARG 107 -10.156 -8.427 -6.588 882 HH21 ARG 107 HH21 ARG 107 -8.153 -7.706 -9.363 883 HH22 ARG 107 HH22 ARG 107 -9.623 -8.435 -8.803 884 H GLU 108 HN GLU 108 -2.787 -5.902 -6.741 885 HA GLU 108 HA GLU 108 -0.957 -3.969 -7.287 886 HB2 GLU 108 HB2 GLU 108 -3.306 -4.925 -8.947 887 HB3 GLU 108 HB1 GLU 108 -2.182 -3.736 -9.582 888 HG2 GLU 108 HG2 GLU 108 -1.469 -6.536 -8.682 889 HG3 GLU 108 HG1 GLU 108 -1.633 -6.001 -10.353 890 H GLY 109 HN GLY 109 -1.008 -1.829 -8.118 891 HA2 GLY 109 HA2 GLY 109 -2.786 -0.083 -6.599 892 HA3 GLY 109 HA1 GLY 109 -1.304 0.369 -7.434 893 H ALA 110 HN ALA 110 -4.029 -1.389 -8.738 894 HA ALA 110 HA ALA 110 -4.732 0.809 -10.580 895 HB1 ALA 110 HB1 ALA 110 -5.283 -2.179 -10.786 896 HB2 ALA 110 HB2 ALA 110 -4.040 -1.303 -11.678 897 HB3 ALA 110 HB3 ALA 110 -5.744 -0.962 -11.980 898 H GLU 111 HN GLU 111 -7.066 0.980 -11.014 899 HA GLU 111 HA GLU 111 -9.281 1.098 -10.587 900 HB2 GLU 111 HB2 GLU 111 -8.812 -1.319 -8.787 901 HB3 GLU 111 HB1 GLU 111 -10.372 -0.778 -9.409 902 HG2 GLU 111 HG2 GLU 111 -9.667 -1.288 -11.704 903 HG3 GLU 111 HG1 GLU 111 -8.062 -1.737 -11.129 904 H LYS 112 HN LYS 112 -7.171 2.294 -8.654 905 HA LYS 112 HA LYS 112 -9.020 3.318 -6.645 906 HB2 LYS 112 HB2 LYS 112 -8.004 1.289 -5.571 907 HB3 LYS 112 HB1 LYS 112 -6.399 1.947 -5.860 908 HG2 LYS 112 HG2 LYS 112 -7.140 3.948 -4.420 909 HG3 LYS 112 HG1 LYS 112 -8.523 2.964 -3.941 910 HD2 LYS 112 HD2 LYS 112 -5.574 2.320 -3.488 911 HD3 LYS 112 HD1 LYS 112 -6.742 2.822 -2.262 912 HE2 LYS 112 HE2 LYS 112 -8.020 0.727 -2.639 913 HE3 LYS 112 HE1 LYS 112 -6.831 0.230 -3.844 914 HZ1 LYS 112 HZ1 LYS 112 -5.151 0.237 -2.109 915 HZ2 LYS 112 HZ2 LYS 112 -6.428 -0.801 -1.718 916 HZ3 LYS 112 HZ3 LYS 112 -6.307 0.703 -0.968 Start of MODEL 14 1 H1 MET 1 HT1 MET 1 15.602 -22.147 13.493 2 H2 MET 1 HT2 MET 1 15.694 -22.334 11.818 3 H3 MET 1 HT3 MET 1 14.220 -22.553 12.616 4 HA MET 1 HA MET 1 15.720 -20.021 12.395 5 HB2 MET 1 HB2 MET 1 13.070 -20.863 11.122 6 HB3 MET 1 HB1 MET 1 13.766 -19.246 11.024 7 HG2 MET 1 HG2 MET 1 14.206 -20.364 8.956 8 HG3 MET 1 HG1 MET 1 15.733 -20.231 9.821 9 HE1 MET 1 HE1 MET 1 13.346 -24.184 9.362 10 HE2 MET 1 HE2 MET 1 12.860 -22.656 8.631 11 HE3 MET 1 HE3 MET 1 12.763 -22.869 10.383 12 H ASN 2 HN ASN 2 14.823 -18.236 13.487 13 HA ASN 2 HA ASN 2 12.330 -18.575 15.002 14 HB2 ASN 2 HB2 ASN 2 14.226 -19.067 16.604 15 HB3 ASN 2 HB1 ASN 2 14.863 -17.454 16.296 16 HD21 ASN 2 HD21 ASN 2 12.241 -19.279 17.739 17 HD22 ASN 2 HD22 ASN 2 11.622 -18.002 18.722 18 H ILE 3 HN ILE 3 11.107 -17.104 14.059 19 HA ILE 3 HA ILE 3 10.204 -15.226 13.258 20 HB ILE 3 HB ILE 3 12.633 -13.682 14.255 21 HG12 ILE 3 HG12 ILE 3 9.948 -14.142 15.643 22 HG13 ILE 3 HG11 ILE 3 11.474 -14.881 16.113 23 HG21 ILE 3 HG21 ILE 3 11.179 -11.673 14.162 24 HG22 ILE 3 HG22 ILE 3 9.882 -12.651 13.466 25 HG23 ILE 3 HG23 ILE 3 11.383 -12.409 12.570 26 HD11 ILE 3 HD11 ILE 3 10.816 -11.933 16.230 27 HD12 ILE 3 HD12 ILE 3 12.359 -12.661 16.696 28 HD13 ILE 3 HD13 ILE 3 10.889 -13.052 17.591 29 H GLY 4 HN GLY 4 13.511 -15.957 12.272 30 HA2 GLY 4 HA2 GLY 4 13.436 -14.466 9.791 31 HA3 GLY 4 HA1 GLY 4 14.698 -15.557 10.337 32 H ARG 5 HN ARG 5 11.220 -15.986 9.711 33 HA ARG 5 HA ARG 5 11.559 -18.336 8.025 34 HB2 ARG 5 HB2 ARG 5 9.109 -16.597 8.609 35 HB3 ARG 5 HB1 ARG 5 9.071 -18.158 7.797 36 HG2 ARG 5 HG2 ARG 5 10.045 -17.786 10.648 37 HG3 ARG 5 HG1 ARG 5 8.368 -18.152 10.231 38 HD2 ARG 5 HD2 ARG 5 10.765 -19.899 9.548 39 HD3 ARG 5 HD1 ARG 5 9.632 -20.187 10.870 40 HE ARG 5 HE ARG 5 9.212 -20.676 8.052 41 HH11 ARG 5 HH11 ARG 5 7.546 -20.270 11.123 42 HH12 ARG 5 HH12 ARG 5 6.131 -21.118 10.599 43 HH21 ARG 5 HH21 ARG 5 7.319 -21.782 7.393 44 HH22 ARG 5 HH22 ARG 5 5.994 -21.953 8.499 45 H LEU 6 HN LEU 6 11.800 -15.006 7.635 46 HA LEU 6 HA LEU 6 10.345 -14.708 5.125 47 HB2 LEU 6 HB2 LEU 6 11.750 -12.621 6.829 48 HB3 LEU 6 HB1 LEU 6 10.532 -12.342 5.594 49 HG LEU 6 HG LEU 6 10.047 -13.758 8.246 50 HD11 LEU 6 HD11 LEU 6 10.482 -11.392 8.563 51 HD12 LEU 6 HD12 LEU 6 8.804 -11.782 8.913 52 HD13 LEU 6 HD13 LEU 6 9.222 -10.974 7.398 53 HD21 LEU 6 HD21 LEU 6 8.562 -14.631 6.521 54 HD22 LEU 6 HD22 LEU 6 8.052 -12.997 6.086 55 HD23 LEU 6 HD23 LEU 6 7.651 -13.658 7.675 56 H ARG 7 HN ARG 7 11.380 -14.802 3.227 57 HA ARG 7 HA ARG 7 14.350 -14.671 3.169 58 HB2 ARG 7 HB2 ARG 7 12.508 -16.447 1.518 59 HB3 ARG 7 HB1 ARG 7 14.270 -16.423 1.425 60 HG2 ARG 7 HG2 ARG 7 14.455 -17.303 3.685 61 HG3 ARG 7 HG1 ARG 7 12.708 -17.177 3.920 62 HD2 ARG 7 HD2 ARG 7 14.126 -19.012 1.954 63 HD3 ARG 7 HD1 ARG 7 13.347 -19.499 3.464 64 HE ARG 7 HE ARG 7 11.971 -18.500 1.034 65 HH11 ARG 7 HH11 ARG 7 11.786 -20.233 4.094 66 HH12 ARG 7 HH12 ARG 7 10.171 -20.787 3.805 67 HH21 ARG 7 HH21 ARG 7 9.864 -19.242 0.695 68 HH22 ARG 7 HH22 ARG 7 9.088 -20.234 1.888 69 H ASP 8 HN ASP 8 11.747 -12.954 2.181 70 HA ASP 8 HA ASP 8 12.976 -11.934 -0.305 71 HB2 ASP 8 HB2 ASP 8 10.055 -11.695 0.606 72 HB3 ASP 8 HB1 ASP 8 10.722 -11.082 -0.905 73 H ARG 9 HN ARG 9 11.941 -9.519 -0.522 74 HA ARG 9 HA ARG 9 11.926 -8.063 2.031 75 HB2 ARG 9 HB2 ARG 9 13.453 -7.087 -0.424 76 HB3 ARG 9 HB1 ARG 9 13.268 -6.225 1.107 77 HG2 ARG 9 HG2 ARG 9 14.629 -7.952 2.220 78 HG3 ARG 9 HG1 ARG 9 14.819 -8.798 0.678 79 HD2 ARG 9 HD2 ARG 9 15.807 -6.003 1.363 80 HD3 ARG 9 HD1 ARG 9 16.785 -7.447 1.110 81 HE ARG 9 HE ARG 9 15.123 -6.669 -1.151 82 HH11 ARG 9 HH11 ARG 9 18.323 -6.456 0.265 83 HH12 ARG 9 HH12 ARG 9 19.065 -5.907 -1.201 84 HH21 ARG 9 HH21 ARG 9 16.087 -5.930 -3.047 85 HH22 ARG 9 HH22 ARG 9 17.793 -5.610 -3.091 86 H ILE 10 HN ILE 10 10.789 -6.059 1.894 87 HA ILE 10 HA ILE 10 9.449 -5.388 -0.637 88 HB ILE 10 HB ILE 10 7.268 -5.029 0.258 89 HG12 ILE 10 HG12 ILE 10 7.704 -4.107 2.458 90 HG13 ILE 10 HG11 ILE 10 6.555 -5.426 2.606 91 HG21 ILE 10 HG21 ILE 10 7.641 -7.339 -0.371 92 HG22 ILE 10 HG22 ILE 10 6.496 -7.253 0.970 93 HG23 ILE 10 HG23 ILE 10 8.169 -7.736 1.267 94 HD11 ILE 10 HD11 ILE 10 9.462 -5.429 3.378 95 HD12 ILE 10 HD12 ILE 10 8.422 -6.847 3.417 96 HD13 ILE 10 HD13 ILE 10 8.053 -5.464 4.437 97 H THR 11 HN THR 11 9.496 -3.278 -1.037 98 HA THR 11 HA THR 11 10.594 -1.375 0.860 99 HB THR 11 HB THR 11 9.795 -1.051 -2.069 100 HG1 THR 11 HG1 THR 11 12.358 -1.348 -0.840 101 HG21 THR 11 HG21 THR 11 9.808 1.123 -0.861 102 HG22 THR 11 HG22 THR 11 11.156 1.011 -1.995 103 HG23 THR 11 HG23 THR 11 11.437 0.778 -0.267 104 H ILE 12 HN ILE 12 9.266 -0.469 2.192 105 HA ILE 12 HA ILE 12 6.416 -0.290 1.959 106 HB ILE 12 HB ILE 12 8.439 0.769 3.986 107 HG12 ILE 12 HG12 ILE 12 8.280 -1.669 3.882 108 HG13 ILE 12 HG11 ILE 12 7.597 -1.101 5.395 109 HG21 ILE 12 HG21 ILE 12 5.418 0.881 4.288 110 HG22 ILE 12 HG22 ILE 12 6.499 2.266 4.125 111 HG23 ILE 12 HG23 ILE 12 6.591 1.239 5.556 112 HD11 ILE 12 HD11 ILE 12 6.045 -1.997 2.972 113 HD12 ILE 12 HD12 ILE 12 5.343 -1.422 4.488 114 HD13 ILE 12 HD13 ILE 12 6.296 -2.907 4.462 115 H GLN 13 HN GLN 13 5.666 1.079 0.409 116 HA GLN 13 HA GLN 13 6.767 3.663 -0.126 117 HB2 GLN 13 HB2 GLN 13 4.209 2.300 -1.026 118 HB3 GLN 13 HB1 GLN 13 4.505 4.002 -1.376 119 HG2 GLN 13 HG2 GLN 13 6.636 3.344 -2.506 120 HG3 GLN 13 HG1 GLN 13 6.189 1.651 -2.272 121 HE21 GLN 13 HE21 GLN 13 6.323 1.493 -4.560 122 HE22 GLN 13 HE22 GLN 13 5.012 1.996 -5.570 123 H THR 14 HN THR 14 6.805 4.980 1.386 124 HA THR 14 HA THR 14 4.724 5.288 3.385 125 HB THR 14 HB THR 14 7.193 7.051 3.050 126 HG1 THR 14 HG1 THR 14 7.883 5.303 4.762 127 HG21 THR 14 HG21 THR 14 5.621 6.160 5.492 128 HG22 THR 14 HG22 THR 14 5.485 7.746 4.721 129 HG23 THR 14 HG23 THR 14 7.000 7.264 5.493 130 H LEU 15 HN LEU 15 3.204 6.978 3.393 131 HA LEU 15 HA LEU 15 2.858 8.440 0.907 132 HB2 LEU 15 HB2 LEU 15 0.906 7.354 1.995 133 HB3 LEU 15 HB1 LEU 15 1.154 8.340 3.428 134 HG LEU 15 HG LEU 15 0.666 10.389 2.092 135 HD11 LEU 15 HD11 LEU 15 1.350 9.690 -0.120 136 HD12 LEU 15 HD12 LEU 15 -0.336 10.192 -0.162 137 HD13 LEU 15 HD13 LEU 15 0.069 8.479 -0.181 138 HD21 LEU 15 HD21 LEU 15 -1.743 10.062 1.913 139 HD22 LEU 15 HD22 LEU 15 -1.115 9.299 3.371 140 HD23 LEU 15 HD23 LEU 15 -1.531 8.309 1.968 141 H LYS 16 HN LYS 16 4.404 10.010 0.858 142 HA LYS 16 HA LYS 16 4.987 11.685 3.122 143 HB2 LYS 16 HB2 LYS 16 6.660 10.910 1.350 144 HB3 LYS 16 HB1 LYS 16 5.905 12.042 0.240 145 HG2 LYS 16 HG2 LYS 16 7.030 12.990 2.891 146 HG3 LYS 16 HG1 LYS 16 8.081 12.719 1.508 147 HD2 LYS 16 HD2 LYS 16 6.681 14.334 0.188 148 HD3 LYS 16 HD1 LYS 16 5.768 14.682 1.662 149 HE2 LYS 16 HE2 LYS 16 7.525 16.376 1.233 150 HE3 LYS 16 HE1 LYS 16 7.807 15.515 2.749 151 HZ1 LYS 16 HZ1 LYS 16 9.480 14.187 1.701 152 HZ2 LYS 16 HZ2 LYS 16 9.825 15.807 1.369 153 HZ3 LYS 16 HZ3 LYS 16 9.135 14.825 0.176 154 H GLN 17 HN GLN 17 3.414 12.940 3.662 155 HA GLN 17 HA GLN 17 1.519 14.153 1.832 156 HB2 GLN 17 HB2 GLN 17 1.826 14.434 4.862 157 HB3 GLN 17 HB1 GLN 17 0.422 14.919 3.913 158 HG2 GLN 17 HG2 GLN 17 -0.058 12.583 3.358 159 HG3 GLN 17 HG1 GLN 17 1.416 12.061 4.177 160 HE21 GLN 17 HE21 GLN 17 -1.848 13.225 4.612 161 HE22 GLN 17 HE22 GLN 17 -1.953 12.865 6.300 162 H THR 18 HN THR 18 2.391 15.786 0.673 163 HA THR 18 HA THR 18 4.340 17.658 1.826 164 HB THR 18 HB THR 18 3.412 17.632 -1.079 165 HG1 THR 18 HG1 THR 18 4.064 15.442 -0.383 166 HG21 THR 18 HG21 THR 18 6.090 18.311 0.202 167 HG22 THR 18 HG22 THR 18 4.920 19.471 -0.432 168 HG23 THR 18 HG23 THR 18 5.748 18.364 -1.530 169 H ARG 19 HN ARG 19 3.831 20.071 0.868 170 HA ARG 19 HA ARG 19 0.916 20.585 0.937 171 HB2 ARG 19 HB2 ARG 19 2.273 21.182 3.091 172 HB3 ARG 19 HB1 ARG 19 2.970 22.481 2.134 173 HG2 ARG 19 HG2 ARG 19 0.472 23.165 1.693 174 HG3 ARG 19 HG1 ARG 19 0.113 22.133 3.077 175 HD2 ARG 19 HD2 ARG 19 0.329 24.441 3.806 176 HD3 ARG 19 HD1 ARG 19 1.692 23.506 4.445 177 HE ARG 19 HE ARG 19 2.893 24.383 2.353 178 HH11 ARG 19 HH11 ARG 19 0.581 26.282 4.160 179 HH12 ARG 19 HH12 ARG 19 1.228 27.792 3.616 180 HH21 ARG 19 HH21 ARG 19 3.716 26.324 1.625 181 HH22 ARG 19 HH22 ARG 19 3.047 27.818 2.198 182 H ASP 20 HN ASP 20 0.377 22.698 -0.066 183 HA ASP 20 HA ASP 20 2.095 23.393 -2.392 184 HB2 ASP 20 HB2 ASP 20 -0.305 22.554 -2.768 185 HB3 ASP 20 HB1 ASP 20 -0.870 23.993 -1.949 186 H ILE 21 HN ILE 21 2.335 25.738 -2.870 187 HA ILE 21 HA ILE 21 2.740 27.504 -0.837 188 HB ILE 21 HB ILE 21 3.575 27.731 -3.167 189 HG12 ILE 21 HG12 ILE 21 2.154 30.244 -2.166 190 HG13 ILE 21 HG11 ILE 21 3.724 29.670 -1.616 191 HG21 ILE 21 HG21 ILE 21 1.528 27.207 -4.405 192 HG22 ILE 21 HG22 ILE 21 2.184 28.758 -4.929 193 HG23 ILE 21 HG23 ILE 21 0.786 28.713 -3.855 194 HD11 ILE 21 HD11 ILE 21 4.656 30.076 -3.835 195 HD12 ILE 21 HD12 ILE 21 3.921 31.535 -3.178 196 HD13 ILE 21 HD13 ILE 21 3.077 30.607 -4.418 197 H THR 22 HN THR 22 -0.440 26.507 -1.808 198 HA THR 22 HA THR 22 -1.705 29.049 -0.980 199 HB THR 22 HB THR 22 -3.779 28.078 -1.966 200 HG1 THR 22 HG1 THR 22 -2.347 26.025 -3.223 201 HG21 THR 22 HG21 THR 22 -1.440 28.019 -3.910 202 HG22 THR 22 HG22 THR 22 -2.337 29.465 -3.427 203 HG23 THR 22 HG23 THR 22 -3.144 28.190 -4.348 204 H GLY 23 HN GLY 23 -0.667 26.175 0.232 205 HA2 GLY 23 HA2 GLY 23 -0.821 25.323 2.371 206 HA3 GLY 23 HA1 GLY 23 -2.130 26.436 2.703 207 H GLU 24 HN GLU 24 -1.666 23.747 0.387 208 HA GLU 24 HA GLU 24 -3.901 22.297 1.643 209 HB2 GLU 24 HB2 GLU 24 -4.701 21.556 -0.566 210 HB3 GLU 24 HB1 GLU 24 -4.737 23.312 -0.466 211 HG2 GLU 24 HG2 GLU 24 -2.673 23.449 -1.761 212 HG3 GLU 24 HG1 GLU 24 -2.576 21.692 -1.838 213 H ILE 25 HN ILE 25 -3.605 20.025 1.734 214 HA ILE 25 HA ILE 25 -0.837 19.202 1.782 215 HB ILE 25 HB ILE 25 -3.343 17.600 2.467 216 HG12 ILE 25 HG12 ILE 25 -3.083 19.590 3.933 217 HG13 ILE 25 HG11 ILE 25 -2.817 18.105 4.835 218 HG21 ILE 25 HG21 ILE 25 -1.824 16.068 3.685 219 HG22 ILE 25 HG22 ILE 25 -0.433 16.986 3.102 220 HG23 ILE 25 HG23 ILE 25 -1.456 16.117 1.961 221 HD11 ILE 25 HD11 ILE 25 -0.401 18.473 4.740 222 HD12 ILE 25 HD12 ILE 25 -1.253 19.836 5.465 223 HD13 ILE 25 HD13 ILE 25 -0.664 19.955 3.810 224 H LEU 26 HN LEU 26 0.134 18.573 -0.071 225 HA LEU 26 HA LEU 26 -1.314 17.141 -2.197 226 HB2 LEU 26 HB2 LEU 26 1.511 18.301 -2.177 227 HB3 LEU 26 HB1 LEU 26 0.687 17.610 -3.570 228 HG LEU 26 HG LEU 26 -0.141 20.166 -2.127 229 HD11 LEU 26 HD11 LEU 26 1.260 19.791 -4.794 230 HD12 LEU 26 HD12 LEU 26 1.942 20.484 -3.318 231 HD13 LEU 26 HD13 LEU 26 0.643 21.322 -4.161 232 HD21 LEU 26 HD21 LEU 26 -2.089 19.014 -3.096 233 HD22 LEU 26 HD22 LEU 26 -1.287 18.933 -4.667 234 HD23 LEU 26 HD23 LEU 26 -1.733 20.499 -3.978 235 H GLU 27 HN GLU 27 -1.443 15.051 -1.419 236 HA GLU 27 HA GLU 27 0.752 13.787 0.004 237 HB2 GLU 27 HB2 GLU 27 -1.986 12.727 -0.842 238 HB3 GLU 27 HB1 GLU 27 -0.841 11.870 0.192 239 HG2 GLU 27 HG2 GLU 27 -0.989 13.609 1.883 240 HG3 GLU 27 HG1 GLU 27 -2.038 14.572 0.849 241 H THR 28 HN THR 28 2.136 12.282 -0.794 242 HA THR 28 HA THR 28 1.946 11.337 -3.579 243 HB THR 28 HB THR 28 4.469 11.990 -3.821 244 HG1 THR 28 HG1 THR 28 4.382 12.712 -1.436 245 HG21 THR 28 HG21 THR 28 2.674 13.080 -5.134 246 HG22 THR 28 HG22 THR 28 3.946 14.228 -4.709 247 HG23 THR 28 HG23 THR 28 2.420 14.237 -3.824 248 H TRP 29 HN TRP 29 3.661 9.672 -4.037 249 HA TRP 29 HA TRP 29 4.012 7.965 -1.644 250 HB2 TRP 29 HB2 TRP 29 3.440 7.179 -4.535 251 HB3 TRP 29 HB1 TRP 29 3.819 6.036 -3.249 252 HD1 TRP 29 HD1 TRP 29 0.915 7.904 -4.745 253 HE1 TRP 29 HE1 TRP 29 -1.214 7.371 -3.407 254 HE3 TRP 29 HE3 TRP 29 3.043 5.630 -0.680 255 HZ2 TRP 29 HZ2 TRP 29 -1.911 6.159 -0.968 256 HZ3 TRP 29 HZ3 TRP 29 1.568 4.817 1.119 257 HH2 TRP 29 HH2 TRP 29 -0.861 5.078 0.975 258 H GLU 30 HN GLU 30 5.992 7.709 -1.116 259 HA GLU 30 HA GLU 30 8.139 7.469 -3.163 260 HB2 GLU 30 HB2 GLU 30 9.729 8.570 -1.610 261 HB3 GLU 30 HB1 GLU 30 8.431 9.641 -2.120 262 HG2 GLU 30 HG2 GLU 30 7.318 9.390 0.030 263 HG3 GLU 30 HG1 GLU 30 8.525 8.208 0.552 264 H ASP 31 HN ASP 31 10.070 6.363 -2.357 265 HA ASP 31 HA ASP 31 9.369 3.828 -1.170 266 HB2 ASP 31 HB2 ASP 31 11.650 3.130 -1.638 267 HB3 ASP 31 HB1 ASP 31 11.046 4.001 -3.037 268 H GLY 32 HN GLY 32 9.960 3.074 0.888 269 HA2 GLY 32 HA2 GLY 32 10.801 5.160 2.842 270 HA3 GLY 32 HA1 GLY 32 9.548 3.961 3.143 271 H HIS 33 HN HIS 33 10.104 2.101 4.062 272 HA HIS 33 HA HIS 33 12.982 1.528 4.539 273 HB2 HIS 33 HB2 HIS 33 10.599 0.622 6.229 274 HB3 HIS 33 HB1 HIS 33 12.309 0.551 6.656 275 HD1 HIS 33 HD1 HIS 33 9.440 2.437 7.435 276 HD2 HIS 33 HD2 HIS 33 13.376 3.461 6.612 277 HE1 HIS 33 HE1 HIS 33 9.742 4.737 8.387 278 HE2 HIS 33 HE2 HIS 33 12.080 5.400 7.740 279 H THR 34 HN THR 34 13.767 -0.440 3.778 280 HA THR 34 HA THR 34 11.823 -2.285 2.529 281 HB THR 34 HB THR 34 14.802 -2.007 1.948 282 HG1 THR 34 HG1 THR 34 13.422 -0.117 1.427 283 HG21 THR 34 HG21 THR 34 14.305 -3.235 -0.115 284 HG22 THR 34 HG22 THR 34 12.597 -3.324 0.321 285 HG23 THR 34 HG23 THR 34 13.800 -4.196 1.281 286 H LEU 35 HN LEU 35 11.322 -3.729 4.183 287 HA LEU 35 HA LEU 35 13.561 -4.919 5.740 288 HB2 LEU 35 HB2 LEU 35 11.873 -5.523 7.450 289 HB3 LEU 35 HB1 LEU 35 12.030 -3.797 7.219 290 HG LEU 35 HG LEU 35 9.780 -5.253 5.803 291 HD11 LEU 35 HD11 LEU 35 9.646 -4.400 8.714 292 HD12 LEU 35 HD12 LEU 35 9.612 -6.060 8.114 293 HD13 LEU 35 HD13 LEU 35 8.292 -4.961 7.727 294 HD21 LEU 35 HD21 LEU 35 10.164 -2.884 5.273 295 HD22 LEU 35 HD22 LEU 35 9.996 -2.458 6.978 296 HD23 LEU 35 HD23 LEU 35 8.617 -3.108 6.087 297 H TRP 36 HN TRP 36 13.047 -7.133 6.617 298 HA TRP 36 HA TRP 36 12.856 -9.004 4.493 299 HB2 TRP 36 HB2 TRP 36 12.637 -9.639 7.468 300 HB3 TRP 36 HB1 TRP 36 13.096 -10.751 6.184 301 HD1 TRP 36 HD1 TRP 36 14.707 -9.178 8.914 302 HE1 TRP 36 HE1 TRP 36 17.194 -8.685 8.508 303 HE3 TRP 36 HE3 TRP 36 14.841 -9.620 3.793 304 HZ2 TRP 36 HZ2 TRP 36 18.975 -8.492 6.350 305 HZ3 TRP 36 HZ3 TRP 36 16.994 -9.263 2.650 306 HH2 TRP 36 HH2 TRP 36 19.015 -8.712 3.904 307 H ALA 37 HN ALA 37 11.168 -9.981 3.636 308 HA ALA 37 HA ALA 37 8.732 -10.574 5.173 309 HB1 ALA 37 HB1 ALA 37 8.221 -8.491 4.009 310 HB2 ALA 37 HB2 ALA 37 7.279 -9.805 3.315 311 HB3 ALA 37 HB3 ALA 37 8.706 -9.191 2.467 312 H SER 38 HN SER 38 7.320 -12.205 4.025 313 HA SER 38 HA SER 38 8.550 -13.500 1.684 314 HB2 SER 38 HB2 SER 38 6.893 -14.781 3.902 315 HB3 SER 38 HB1 SER 38 7.362 -15.591 2.403 316 HG SER 38 HG SER 38 8.792 -16.016 4.152 317 H VAL 39 HN VAL 39 7.402 -12.878 -0.049 318 HA VAL 39 HA VAL 39 4.632 -11.916 0.287 319 HB VAL 39 HB VAL 39 6.112 -10.188 -0.518 320 HG11 VAL 39 HG11 VAL 39 7.978 -11.558 -1.363 321 HG12 VAL 39 HG12 VAL 39 7.502 -10.336 -2.541 322 HG13 VAL 39 HG13 VAL 39 7.018 -12.016 -2.773 323 HG21 VAL 39 HG21 VAL 39 4.479 -11.221 -2.862 324 HG22 VAL 39 HG22 VAL 39 5.093 -9.577 -2.689 325 HG23 VAL 39 HG23 VAL 39 3.894 -10.190 -1.553 326 H ASN 40 HN ASN 40 3.354 -13.701 -0.002 327 HA ASN 40 HA ASN 40 3.800 -15.503 -2.313 328 HB2 ASN 40 HB2 ASN 40 2.214 -16.086 0.234 329 HB3 ASN 40 HB1 ASN 40 2.689 -17.233 -1.015 330 HD21 ASN 40 HD21 ASN 40 5.420 -16.047 -1.198 331 HD22 ASN 40 HD22 ASN 40 6.240 -16.607 0.206 332 H MET 41 HN MET 41 2.404 -15.041 -3.950 333 HA MET 41 HA MET 41 -0.054 -13.664 -3.725 334 HB2 MET 41 HB2 MET 41 0.841 -15.587 -5.912 335 HB3 MET 41 HB1 MET 41 -0.530 -14.489 -6.026 336 HG2 MET 41 HG2 MET 41 1.132 -12.587 -5.716 337 HG3 MET 41 HG1 MET 41 2.405 -13.785 -5.912 338 HE1 MET 41 HE1 MET 41 -0.662 -12.709 -9.200 339 HE2 MET 41 HE2 MET 41 -0.606 -11.930 -7.621 340 HE3 MET 41 HE3 MET 41 -1.096 -13.621 -7.755 341 H VAL 42 HN VAL 42 -2.108 -14.388 -3.353 342 HA VAL 42 HA VAL 42 -2.420 -16.851 -1.960 343 HB VAL 42 HB VAL 42 -4.688 -16.258 -1.568 344 HG11 VAL 42 HG11 VAL 42 -3.084 -13.686 -1.633 345 HG12 VAL 42 HG12 VAL 42 -3.088 -14.888 -0.340 346 HG13 VAL 42 HG13 VAL 42 -4.547 -13.958 -0.682 347 HG21 VAL 42 HG21 VAL 42 -5.930 -14.451 -2.752 348 HG22 VAL 42 HG22 VAL 42 -5.476 -15.767 -3.833 349 HG23 VAL 42 HG23 VAL 42 -4.568 -14.256 -3.858 350 H SER 43 HN SER 43 -3.809 -18.622 -2.518 351 HA SER 43 HA SER 43 -3.693 -19.383 -5.329 352 HB2 SER 43 HB2 SER 43 -4.682 -20.887 -2.860 353 HB3 SER 43 HB1 SER 43 -4.451 -21.593 -4.464 354 HG SER 43 HG SER 43 -2.217 -20.304 -3.723 355 H SER 44 HN SER 44 -5.676 -20.522 -6.252 356 HA SER 44 HA SER 44 -7.964 -18.902 -6.402 357 HB2 SER 44 HB2 SER 44 -8.994 -20.913 -7.538 358 HB3 SER 44 HB1 SER 44 -7.416 -20.468 -8.182 359 HG SER 44 HG SER 44 -7.707 -22.744 -7.793 360 H LYS 45 HN LYS 45 -7.089 -21.500 -4.263 361 HA LYS 45 HA LYS 45 -9.342 -22.291 -2.935 362 HB2 LYS 45 HB2 LYS 45 -7.157 -23.213 -2.414 363 HB3 LYS 45 HB1 LYS 45 -6.566 -21.660 -1.850 364 HG2 LYS 45 HG2 LYS 45 -6.967 -23.177 0.022 365 HG3 LYS 45 HG1 LYS 45 -8.050 -21.782 0.114 366 HD2 LYS 45 HD2 LYS 45 -9.886 -23.182 -0.839 367 HD3 LYS 45 HD1 LYS 45 -8.788 -24.567 -0.888 368 HE2 LYS 45 HE2 LYS 45 -10.298 -24.611 1.094 369 HE3 LYS 45 HE1 LYS 45 -8.595 -24.549 1.551 370 HZ1 LYS 45 HZ1 LYS 45 -8.811 -22.193 1.967 371 HZ2 LYS 45 HZ2 LYS 45 -9.962 -23.034 2.866 372 HZ3 LYS 45 HZ3 LYS 45 -10.419 -22.207 1.469 373 H GLU 46 HN GLU 46 -7.521 -19.288 -2.361 374 HA GLU 46 HA GLU 46 -8.979 -18.450 -0.064 375 HB2 GLU 46 HB2 GLU 46 -7.256 -16.853 -1.989 376 HB3 GLU 46 HB1 GLU 46 -7.829 -16.261 -0.424 377 HG2 GLU 46 HG2 GLU 46 -5.951 -18.605 -0.903 378 HG3 GLU 46 HG1 GLU 46 -5.508 -17.018 -0.282 379 H ALA 47 HN ALA 47 -9.256 -17.711 -3.510 380 HA ALA 47 HA ALA 47 -11.285 -15.730 -3.331 381 HB1 ALA 47 HB1 ALA 47 -10.613 -17.592 -5.636 382 HB2 ALA 47 HB2 ALA 47 -9.893 -16.007 -5.338 383 HB3 ALA 47 HB3 ALA 47 -11.606 -16.135 -5.742 384 H ILE 48 HN ILE 48 -11.463 -19.197 -4.127 385 HA ILE 48 HA ILE 48 -14.205 -19.552 -4.364 386 HB ILE 48 HB ILE 48 -12.106 -21.546 -3.394 387 HG12 ILE 48 HG12 ILE 48 -13.330 -21.173 -6.174 388 HG13 ILE 48 HG11 ILE 48 -11.737 -20.606 -5.692 389 HG21 ILE 48 HG21 ILE 48 -13.684 -23.353 -4.031 390 HG22 ILE 48 HG22 ILE 48 -14.929 -22.150 -4.365 391 HG23 ILE 48 HG23 ILE 48 -14.330 -22.363 -2.720 392 HD11 ILE 48 HD11 ILE 48 -11.015 -22.926 -5.350 393 HD12 ILE 48 HD12 ILE 48 -11.579 -22.636 -6.995 394 HD13 ILE 48 HD13 ILE 48 -12.612 -23.493 -5.853 395 H SER 49 HN SER 49 -12.228 -20.021 -1.423 396 HA SER 49 HA SER 49 -14.406 -20.878 0.213 397 HB2 SER 49 HB2 SER 49 -11.609 -19.987 1.004 398 HB3 SER 49 HB1 SER 49 -12.743 -20.854 2.044 399 HG SER 49 HG SER 49 -12.679 -22.329 -0.041 400 H SER 50 HN SER 50 -12.986 -17.734 -0.439 401 HA SER 50 HA SER 50 -14.572 -16.418 1.669 402 HB2 SER 50 HB2 SER 50 -12.651 -15.251 -0.390 403 HB3 SER 50 HB1 SER 50 -13.378 -14.374 0.956 404 HG SER 50 HG SER 50 -11.258 -16.126 0.936 405 H GLY 51 HN GLY 51 -15.035 -17.432 -1.511 406 HA2 GLY 51 HA2 GLY 51 -16.882 -17.266 -2.868 407 HA3 GLY 51 HA1 GLY 51 -17.615 -16.173 -1.706 408 H ALA 52 HN ALA 52 -17.128 -13.925 -1.818 409 HA ALA 52 HA ALA 52 -15.907 -12.956 -4.352 410 HB1 ALA 52 HB1 ALA 52 -18.365 -11.806 -2.979 411 HB2 ALA 52 HB2 ALA 52 -18.386 -12.795 -4.440 412 HB3 ALA 52 HB3 ALA 52 -17.623 -11.201 -4.465 413 H GLU 53 HN GLU 53 -15.716 -12.956 -1.003 414 HA GLU 53 HA GLU 53 -15.057 -10.263 -0.370 415 HB2 GLU 53 HB2 GLU 53 -15.740 -11.959 1.317 416 HB3 GLU 53 HB1 GLU 53 -14.249 -12.844 1.040 417 HG2 GLU 53 HG2 GLU 53 -14.101 -11.566 3.100 418 HG3 GLU 53 HG1 GLU 53 -12.943 -10.955 1.918 419 H LEU 54 HN LEU 54 -12.938 -13.110 -0.880 420 HA LEU 54 HA LEU 54 -10.724 -11.343 -1.746 421 HB2 LEU 54 HB2 LEU 54 -10.664 -14.259 -0.855 422 HB3 LEU 54 HB1 LEU 54 -9.269 -13.384 -1.478 423 HG LEU 54 HG LEU 54 -10.751 -12.774 1.122 424 HD11 LEU 54 HD11 LEU 54 -8.703 -13.509 2.246 425 HD12 LEU 54 HD12 LEU 54 -7.971 -13.918 0.691 426 HD13 LEU 54 HD13 LEU 54 -9.387 -14.805 1.264 427 HD21 LEU 54 HD21 LEU 54 -9.924 -10.692 0.108 428 HD22 LEU 54 HD22 LEU 54 -8.305 -11.381 -0.044 429 HD23 LEU 54 HD23 LEU 54 -9.000 -11.092 1.554 430 H ALA 55 HN ALA 55 -9.576 -11.967 -3.647 431 HA ALA 55 HA ALA 55 -10.963 -13.732 -5.568 432 HB1 ALA 55 HB1 ALA 55 -10.753 -12.049 -7.349 433 HB2 ALA 55 HB2 ALA 55 -10.070 -10.893 -6.200 434 HB3 ALA 55 HB3 ALA 55 -11.741 -11.432 -6.022 435 H ILE 56 HN ILE 56 -9.527 -13.815 -7.646 436 HA ILE 56 HA ILE 56 -6.870 -14.712 -6.833 437 HB ILE 56 HB ILE 56 -8.264 -14.839 -9.555 438 HG12 ILE 56 HG12 ILE 56 -7.929 -17.020 -7.441 439 HG13 ILE 56 HG11 ILE 56 -9.421 -16.143 -7.757 440 HG21 ILE 56 HG21 ILE 56 -6.544 -16.508 -10.177 441 HG22 ILE 56 HG22 ILE 56 -5.722 -16.244 -8.637 442 HG23 ILE 56 HG23 ILE 56 -5.820 -14.936 -9.822 443 HD11 ILE 56 HD11 ILE 56 -8.019 -18.010 -9.671 444 HD12 ILE 56 HD12 ILE 56 -9.508 -17.116 -10.001 445 HD13 ILE 56 HD13 ILE 56 -9.477 -18.342 -8.737 446 H GLY 57 HN GLY 57 -4.972 -13.770 -7.484 447 HA2 GLY 57 HA2 GLY 57 -3.616 -12.125 -8.592 448 HA3 GLY 57 HA1 GLY 57 -5.034 -11.092 -8.783 449 H THR 58 HN THR 58 -5.620 -12.150 -5.878 450 HA THR 58 HA THR 58 -4.506 -10.004 -4.363 451 HB THR 58 HB THR 58 -5.980 -12.527 -3.483 452 HG1 THR 58 HG1 THR 58 -7.620 -11.437 -4.210 453 HG21 THR 58 HG21 THR 58 -6.423 -11.418 -1.330 454 HG22 THR 58 HG22 THR 58 -5.428 -10.044 -1.813 455 HG23 THR 58 HG23 THR 58 -4.685 -11.624 -1.565 456 H VAL 59 HN VAL 59 -2.895 -10.111 -2.786 457 HA VAL 59 HA VAL 59 -1.009 -12.377 -2.867 458 HB VAL 59 HB VAL 59 -0.251 -9.413 -2.771 459 HG11 VAL 59 HG11 VAL 59 1.363 -10.863 -1.616 460 HG12 VAL 59 HG12 VAL 59 2.066 -10.234 -3.107 461 HG13 VAL 59 HG13 VAL 59 1.483 -11.898 -3.042 462 HG21 VAL 59 HG21 VAL 59 -0.071 -11.330 -5.129 463 HG22 VAL 59 HG22 VAL 59 0.597 -9.699 -5.091 464 HG23 VAL 59 HG23 VAL 59 -1.150 -9.939 -4.999 465 H ARG 60 HN ARG 60 -0.518 -13.125 -0.861 466 HA ARG 60 HA ARG 60 -1.084 -11.460 1.518 467 HB2 ARG 60 HB2 ARG 60 -2.210 -13.643 1.510 468 HB3 ARG 60 HB1 ARG 60 -0.679 -14.467 1.227 469 HG2 ARG 60 HG2 ARG 60 0.117 -13.933 3.428 470 HG3 ARG 60 HG1 ARG 60 -1.233 -12.830 3.724 471 HD2 ARG 60 HD2 ARG 60 -1.524 -15.825 3.277 472 HD3 ARG 60 HD1 ARG 60 -1.450 -15.053 4.864 473 HE ARG 60 HE ARG 60 -3.496 -13.846 4.286 474 HH11 ARG 60 HH11 ARG 60 -2.837 -16.738 2.376 475 HH12 ARG 60 HH12 ARG 60 -4.511 -17.001 2.002 476 HH21 ARG 60 HH21 ARG 60 -5.669 -14.185 3.730 477 HH22 ARG 60 HH22 ARG 60 -6.111 -15.562 2.767 478 H ILE 61 HN ILE 61 0.554 -11.154 3.039 479 HA ILE 61 HA ILE 61 3.339 -11.667 2.225 480 HB ILE 61 HB ILE 61 2.278 -8.853 2.836 481 HG12 ILE 61 HG12 ILE 61 3.261 -9.893 0.140 482 HG13 ILE 61 HG11 ILE 61 1.561 -9.746 0.570 483 HG21 ILE 61 HG21 ILE 61 5.071 -9.714 1.989 484 HG22 ILE 61 HG22 ILE 61 4.596 -9.168 3.600 485 HG23 ILE 61 HG23 ILE 61 4.537 -8.047 2.236 486 HD11 ILE 61 HD11 ILE 61 3.521 -7.477 0.399 487 HD12 ILE 61 HD12 ILE 61 1.798 -7.347 0.757 488 HD13 ILE 61 HD13 ILE 61 2.333 -7.918 -0.823 489 H TRP 62 HN TRP 62 4.683 -11.778 4.015 490 HA TRP 62 HA TRP 62 3.571 -11.151 6.688 491 HB2 TRP 62 HB2 TRP 62 5.106 -13.666 5.875 492 HB3 TRP 62 HB1 TRP 62 4.830 -13.192 7.549 493 HD1 TRP 62 HD1 TRP 62 2.942 -14.531 4.483 494 HE1 TRP 62 HE1 TRP 62 0.677 -15.444 5.263 495 HE3 TRP 62 HE3 TRP 62 3.047 -12.930 9.334 496 HZ2 TRP 62 HZ2 TRP 62 -0.859 -15.518 7.638 497 HZ3 TRP 62 HZ3 TRP 62 1.145 -13.470 10.804 498 HH2 TRP 62 HH2 TRP 62 -0.776 -14.735 9.970 499 H ILE 63 HN ILE 63 4.865 -9.943 7.877 500 HA ILE 63 HA ILE 63 7.708 -9.494 7.109 501 HB ILE 63 HB ILE 63 7.421 -7.091 7.689 502 HG12 ILE 63 HG12 ILE 63 4.414 -7.599 7.797 503 HG13 ILE 63 HG11 ILE 63 5.412 -7.497 9.239 504 HG21 ILE 63 HG21 ILE 63 6.152 -6.344 5.707 505 HG22 ILE 63 HG22 ILE 63 5.475 -7.966 5.525 506 HG23 ILE 63 HG23 ILE 63 7.210 -7.704 5.326 507 HD11 ILE 63 HD11 ILE 63 6.004 -5.201 8.642 508 HD12 ILE 63 HD12 ILE 63 4.270 -5.443 8.848 509 HD13 ILE 63 HD13 ILE 63 4.952 -5.319 7.228 510 H ARG 64 HN ARG 64 9.058 -9.017 9.009 511 HA ARG 64 HA ARG 64 8.304 -9.874 11.553 512 HB2 ARG 64 HB2 ARG 64 10.400 -7.769 10.870 513 HB3 ARG 64 HB1 ARG 64 10.242 -8.556 12.439 514 HG2 ARG 64 HG2 ARG 64 10.622 -10.773 11.248 515 HG3 ARG 64 HG1 ARG 64 11.028 -9.838 9.810 516 HD2 ARG 64 HD2 ARG 64 12.885 -8.770 11.006 517 HD3 ARG 64 HD1 ARG 64 12.451 -9.647 12.481 518 HE ARG 64 HE ARG 64 13.163 -11.136 10.037 519 HH11 ARG 64 HH11 ARG 64 13.891 -10.369 13.389 520 HH12 ARG 64 HH12 ARG 64 15.143 -11.565 13.507 521 HH21 ARG 64 HH21 ARG 64 14.805 -12.671 10.201 522 HH22 ARG 64 HH22 ARG 64 15.655 -12.874 11.696 523 H TYR 65 HN TYR 65 7.626 -8.799 13.462 524 HA TYR 65 HA TYR 65 5.464 -7.037 13.146 525 HB2 TYR 65 HB2 TYR 65 5.768 -8.617 15.070 526 HB3 TYR 65 HB1 TYR 65 7.034 -7.584 15.715 527 HD1 TYR 65 HD1 TYR 65 6.399 -5.229 16.557 528 HD2 TYR 65 HD2 TYR 65 3.432 -8.120 15.481 529 HE1 TYR 65 HE1 TYR 65 4.700 -3.950 17.777 530 HE2 TYR 65 HE2 TYR 65 1.743 -6.836 16.716 531 HH TYR 65 HH TYR 65 1.587 -5.196 18.487 532 H ARG 66 HN ARG 66 5.333 -4.865 13.019 533 HA ARG 66 HA ARG 66 7.473 -3.105 13.905 534 HB2 ARG 66 HB2 ARG 66 8.204 -4.042 11.675 535 HB3 ARG 66 HB1 ARG 66 6.782 -3.304 10.940 536 HG2 ARG 66 HG2 ARG 66 7.634 -1.063 11.528 537 HG3 ARG 66 HG1 ARG 66 9.027 -1.799 12.332 538 HD2 ARG 66 HD2 ARG 66 9.666 -2.841 10.141 539 HD3 ARG 66 HD1 ARG 66 8.358 -1.941 9.375 540 HE ARG 66 HE ARG 66 9.627 0.096 10.356 541 HH11 ARG 66 HH11 ARG 66 11.146 -2.780 9.053 542 HH12 ARG 66 HH12 ARG 66 12.579 -1.947 8.555 543 HH21 ARG 66 HH21 ARG 66 11.504 1.184 9.697 544 HH22 ARG 66 HH22 ARG 66 12.779 0.307 8.913 545 H LYS 67 HN LYS 67 6.540 -1.356 14.704 546 HA LYS 67 HA LYS 67 3.770 -0.687 14.479 547 HB2 LYS 67 HB2 LYS 67 6.126 0.771 15.749 548 HB3 LYS 67 HB1 LYS 67 4.453 1.291 15.928 549 HG2 LYS 67 HG2 LYS 67 5.436 -1.442 16.807 550 HG3 LYS 67 HG1 LYS 67 5.449 -0.023 17.863 551 HD2 LYS 67 HD2 LYS 67 2.978 0.186 17.562 552 HD3 LYS 67 HD1 LYS 67 2.991 -1.274 16.562 553 HE2 LYS 67 HE2 LYS 67 2.294 -1.708 18.916 554 HE3 LYS 67 HE1 LYS 67 3.728 -2.614 18.447 555 HZ1 LYS 67 HZ1 LYS 67 5.100 -1.021 19.625 556 HZ2 LYS 67 HZ2 LYS 67 3.932 -1.664 20.663 557 HZ3 LYS 67 HZ3 LYS 67 3.737 -0.105 20.040 558 H ASP 68 HN ASP 68 6.218 -0.097 12.338 559 HA ASP 68 HA ASP 68 5.608 2.655 11.578 560 HB2 ASP 68 HB2 ASP 68 7.940 2.157 11.569 561 HB3 ASP 68 HB1 ASP 68 7.694 0.585 10.843 562 H ILE 69 HN ILE 69 4.768 -0.560 10.695 563 HA ILE 69 HA ILE 69 4.041 0.046 7.946 564 HB ILE 69 HB ILE 69 3.613 -2.571 9.436 565 HG12 ILE 69 HG12 ILE 69 5.981 -2.059 9.617 566 HG13 ILE 69 HG11 ILE 69 5.795 -3.300 8.397 567 HG21 ILE 69 HG21 ILE 69 3.646 -3.565 7.144 568 HG22 ILE 69 HG22 ILE 69 3.755 -1.943 6.458 569 HG23 ILE 69 HG23 ILE 69 2.317 -2.422 7.368 570 HD11 ILE 69 HD11 ILE 69 6.330 -0.385 7.928 571 HD12 ILE 69 HD12 ILE 69 6.034 -1.573 6.658 572 HD13 ILE 69 HD13 ILE 69 7.440 -1.736 7.706 573 H ASN 70 HN ASN 70 2.043 0.523 7.288 574 HA ASN 70 HA ASN 70 -0.310 -0.308 8.801 575 HB2 ASN 70 HB2 ASN 70 0.347 2.041 9.587 576 HB3 ASN 70 HB1 ASN 70 0.022 2.597 7.950 577 HD21 ASN 70 HD21 ASN 70 -1.681 3.900 8.507 578 HD22 ASN 70 HD22 ASN 70 -3.181 3.343 9.133 579 H ALA 71 HN ALA 71 -2.321 0.105 7.527 580 HA ALA 71 HA ALA 71 -2.254 -0.822 4.892 581 HB1 ALA 71 HB1 ALA 71 -4.643 -0.245 4.836 582 HB2 ALA 71 HB2 ALA 71 -4.442 0.735 6.293 583 HB3 ALA 71 HB3 ALA 71 -4.207 -1.012 6.364 584 H THR 72 HN THR 72 -1.930 2.387 6.169 585 HA THR 72 HA THR 72 -2.518 3.915 3.828 586 HB THR 72 HB THR 72 -1.392 5.789 5.113 587 HG1 THR 72 HG1 THR 72 0.111 4.441 6.275 588 HG21 THR 72 HG21 THR 72 -3.424 4.192 6.721 589 HG22 THR 72 HG22 THR 72 -3.809 5.340 5.436 590 HG23 THR 72 HG23 THR 72 -3.055 5.907 6.927 591 H SER 73 HN SER 73 0.028 1.824 4.388 592 HA SER 73 HA SER 73 1.888 3.223 2.576 593 HB2 SER 73 HB2 SER 73 2.903 2.196 4.582 594 HB3 SER 73 HB1 SER 73 2.191 0.633 4.183 595 HG SER 73 HG SER 73 4.247 2.043 2.854 596 H ARG 74 HN ARG 74 2.673 2.029 0.699 597 HA ARG 74 HA ARG 74 0.921 -0.156 -0.320 598 HB2 ARG 74 HB2 ARG 74 2.747 1.615 -2.020 599 HB3 ARG 74 HB1 ARG 74 1.520 0.479 -2.586 600 HG2 ARG 74 HG2 ARG 74 -0.255 1.908 -1.736 601 HG3 ARG 74 HG1 ARG 74 0.927 3.000 -1.015 602 HD2 ARG 74 HD2 ARG 74 0.231 4.060 -3.011 603 HD3 ARG 74 HD1 ARG 74 1.821 3.389 -3.376 604 HE ARG 74 HE ARG 74 -0.601 1.899 -4.102 605 HH11 ARG 74 HH11 ARG 74 2.321 3.531 -5.147 606 HH12 ARG 74 HH12 ARG 74 2.070 3.163 -6.825 607 HH21 ARG 74 HH21 ARG 74 -0.935 1.433 -6.285 608 HH22 ARG 74 HH22 ARG 74 0.218 1.965 -7.470 609 H ILE 75 HN ILE 75 2.005 -2.005 -1.149 610 HA ILE 75 HA ILE 75 4.745 -2.383 -0.158 611 HB ILE 75 HB ILE 75 2.759 -4.424 -1.242 612 HG12 ILE 75 HG12 ILE 75 1.925 -3.481 0.865 613 HG13 ILE 75 HG11 ILE 75 2.474 -5.128 1.141 614 HG21 ILE 75 HG21 ILE 75 5.426 -4.857 0.143 615 HG22 ILE 75 HG22 ILE 75 5.075 -5.156 -1.558 616 HG23 ILE 75 HG23 ILE 75 4.294 -6.122 -0.321 617 HD11 ILE 75 HD11 ILE 75 3.923 -2.595 1.895 618 HD12 ILE 75 HD12 ILE 75 4.549 -4.230 2.122 619 HD13 ILE 75 HD13 ILE 75 3.095 -3.716 2.974 620 H LYS 76 HN LYS 76 6.125 -1.507 -1.716 621 HA LYS 76 HA LYS 76 5.954 -2.528 -4.476 622 HB2 LYS 76 HB2 LYS 76 6.531 -0.101 -4.074 623 HB3 LYS 76 HB1 LYS 76 8.036 -0.631 -3.319 624 HG2 LYS 76 HG2 LYS 76 8.722 -1.714 -5.443 625 HG3 LYS 76 HG1 LYS 76 7.197 -1.206 -6.176 626 HD2 LYS 76 HD2 LYS 76 7.913 1.199 -5.623 627 HD3 LYS 76 HD1 LYS 76 9.509 0.527 -5.283 628 HE2 LYS 76 HE2 LYS 76 8.024 0.376 -7.933 629 HE3 LYS 76 HE1 LYS 76 9.414 1.405 -7.574 630 HZ1 LYS 76 HZ1 LYS 76 9.456 -1.564 -7.486 631 HZ2 LYS 76 HZ2 LYS 76 10.780 -0.529 -7.303 632 HZ3 LYS 76 HZ3 LYS 76 9.984 -0.636 -8.788 633 H VAL 77 HN VAL 77 6.714 -4.557 -4.648 634 HA VAL 77 HA VAL 77 8.306 -5.739 -2.559 635 HB VAL 77 HB VAL 77 7.326 -6.861 -5.208 636 HG11 VAL 77 HG11 VAL 77 9.368 -8.107 -4.610 637 HG12 VAL 77 HG12 VAL 77 7.942 -9.119 -4.385 638 HG13 VAL 77 HG13 VAL 77 8.735 -8.393 -2.985 639 HG21 VAL 77 HG21 VAL 77 5.589 -6.335 -3.521 640 HG22 VAL 77 HG22 VAL 77 6.408 -7.385 -2.360 641 HG23 VAL 77 HG23 VAL 77 5.709 -8.070 -3.830 642 H SER 78 HN SER 78 10.406 -5.897 -2.396 643 HA SER 78 HA SER 78 12.172 -4.695 -4.347 644 HB2 SER 78 HB2 SER 78 12.483 -4.212 -1.963 645 HB3 SER 78 HB1 SER 78 12.686 -5.925 -1.610 646 HG SER 78 HG SER 78 14.418 -4.216 -3.059 647 H THR 79 HN THR 79 11.510 -7.893 -3.052 648 HA THR 79 HA THR 79 13.015 -9.236 -5.169 649 HB THR 79 HB THR 79 13.990 -10.805 -3.302 650 HG1 THR 79 HG1 THR 79 14.190 -9.961 -1.300 651 HG21 THR 79 HG21 THR 79 16.042 -9.474 -3.029 652 HG22 THR 79 HG22 THR 79 15.194 -8.035 -3.601 653 HG23 THR 79 HG23 THR 79 15.461 -9.394 -4.697 654 H GLY 80 HN GLY 80 11.943 -11.042 -5.805 655 HA2 GLY 80 HA2 GLY 80 10.619 -13.028 -4.687 656 HA3 GLY 80 HA1 GLY 80 9.431 -11.756 -4.435 657 HA PRO 81 HA PRO 81 8.568 -13.680 -8.686 658 HB2 PRO 81 HB2 PRO 81 5.793 -13.731 -7.525 659 HB3 PRO 81 HB1 PRO 81 6.650 -14.977 -8.449 660 HG2 PRO 81 HG2 PRO 81 6.303 -15.291 -5.836 661 HG3 PRO 81 HG1 PRO 81 7.861 -15.710 -6.572 662 HD2 PRO 81 HD2 PRO 81 7.113 -13.183 -5.072 663 HD3 PRO 81 HD1 PRO 81 8.540 -14.230 -4.854 664 H LEU 82 HN LEU 82 7.511 -11.111 -6.704 665 HA LEU 82 HA LEU 82 6.235 -9.610 -8.916 666 HB2 LEU 82 HB2 LEU 82 5.883 -9.244 -5.909 667 HB3 LEU 82 HB1 LEU 82 4.931 -8.496 -7.187 668 HG LEU 82 HG LEU 82 4.961 -11.499 -6.616 669 HD11 LEU 82 HD11 LEU 82 3.996 -10.289 -4.727 670 HD12 LEU 82 HD12 LEU 82 2.767 -11.206 -5.586 671 HD13 LEU 82 HD13 LEU 82 2.869 -9.456 -5.800 672 HD21 LEU 82 HD21 LEU 82 2.978 -11.587 -8.076 673 HD22 LEU 82 HD22 LEU 82 4.383 -10.976 -8.943 674 HD23 LEU 82 HD23 LEU 82 3.125 -9.857 -8.411 675 H ALA 83 HN ALA 83 9.143 -9.880 -8.174 676 HA ALA 83 HA ALA 83 10.131 -7.644 -6.743 677 HB1 ALA 83 HB1 ALA 83 11.558 -9.307 -8.857 678 HB2 ALA 83 HB2 ALA 83 11.453 -9.689 -7.138 679 HB3 ALA 83 HB3 ALA 83 12.326 -8.251 -7.665 680 H GLY 84 HN GLY 84 9.711 -5.629 -7.335 681 HA2 GLY 84 HA2 GLY 84 10.633 -3.794 -8.691 682 HA3 GLY 84 HA1 GLY 84 10.147 -4.702 -10.121 683 H ARG 85 HN ARG 85 7.622 -5.561 -8.764 684 HA ARG 85 HA ARG 85 6.057 -3.262 -9.656 685 HB2 ARG 85 HB2 ARG 85 5.301 -6.159 -9.112 686 HB3 ARG 85 HB1 ARG 85 4.144 -4.921 -9.597 687 HG2 ARG 85 HG2 ARG 85 5.728 -4.550 -11.643 688 HG3 ARG 85 HG1 ARG 85 6.409 -6.118 -11.201 689 HD2 ARG 85 HD2 ARG 85 3.508 -5.546 -11.899 690 HD3 ARG 85 HD1 ARG 85 4.691 -6.322 -12.951 691 HE ARG 85 HE ARG 85 4.781 -8.137 -11.203 692 HH11 ARG 85 HH11 ARG 85 1.899 -6.153 -11.459 693 HH12 ARG 85 HH12 ARG 85 0.819 -7.449 -11.065 694 HH21 ARG 85 HH21 ARG 85 3.338 -9.833 -10.679 695 HH22 ARG 85 HH22 ARG 85 1.632 -9.526 -10.610 696 H VAL 86 HN VAL 86 3.799 -3.114 -8.493 697 HA VAL 86 HA VAL 86 4.321 -2.579 -5.633 698 HB VAL 86 HB VAL 86 2.776 -0.724 -7.482 699 HG11 VAL 86 HG11 VAL 86 2.027 -0.612 -5.141 700 HG12 VAL 86 HG12 VAL 86 2.877 0.874 -5.566 701 HG13 VAL 86 HG13 VAL 86 3.689 -0.358 -4.597 702 HG21 VAL 86 HG21 VAL 86 5.166 -0.689 -8.111 703 HG22 VAL 86 HG22 VAL 86 5.603 -0.318 -6.441 704 HG23 VAL 86 HG23 VAL 86 4.670 0.842 -7.386 705 H LEU 87 HN LEU 87 3.089 -4.113 -4.779 706 HA LEU 87 HA LEU 87 0.284 -4.505 -5.439 707 HB2 LEU 87 HB2 LEU 87 1.950 -5.652 -3.150 708 HB3 LEU 87 HB1 LEU 87 0.314 -6.136 -3.558 709 HG LEU 87 HG LEU 87 1.757 -7.850 -4.371 710 HD11 LEU 87 HD11 LEU 87 -0.055 -7.303 -5.899 711 HD12 LEU 87 HD12 LEU 87 1.355 -7.913 -6.762 712 HD13 LEU 87 HD13 LEU 87 0.996 -6.182 -6.775 713 HD21 LEU 87 HD21 LEU 87 3.873 -6.629 -4.344 714 HD22 LEU 87 HD22 LEU 87 3.424 -5.782 -5.824 715 HD23 LEU 87 HD23 LEU 87 3.662 -7.532 -5.840 716 H ASN 88 HN ASN 88 -1.400 -3.806 -4.176 717 HA ASN 88 HA ASN 88 -0.888 -1.547 -2.333 718 HB2 ASN 88 HB2 ASN 88 -3.258 -2.185 -4.165 719 HB3 ASN 88 HB1 ASN 88 -3.194 -0.819 -3.053 720 HD21 ASN 88 HD21 ASN 88 -1.231 -2.250 -5.694 721 HD22 ASN 88 HD22 ASN 88 -0.831 -0.746 -6.433 722 H ILE 89 HN ILE 89 -2.139 -1.476 -0.341 723 HA ILE 89 HA ILE 89 -2.694 -4.153 0.677 724 HB ILE 89 HB ILE 89 -2.669 -1.468 2.132 725 HG12 ILE 89 HG12 ILE 89 -0.511 -3.627 1.974 726 HG13 ILE 89 HG11 ILE 89 -0.428 -2.018 1.264 727 HG21 ILE 89 HG21 ILE 89 -4.078 -3.101 3.321 728 HG22 ILE 89 HG22 ILE 89 -2.606 -2.769 4.231 729 HG23 ILE 89 HG23 ILE 89 -2.754 -4.271 3.317 730 HD11 ILE 89 HD11 ILE 89 -0.461 -2.671 4.220 731 HD12 ILE 89 HD12 ILE 89 -0.426 -1.041 3.533 732 HD13 ILE 89 HD13 ILE 89 0.925 -2.141 3.264 733 H ILE 90 HN ILE 90 -4.667 -4.907 0.256 734 HA ILE 90 HA ILE 90 -6.979 -3.131 -0.078 735 HB ILE 90 HB ILE 90 -8.150 -5.193 -0.913 736 HG12 ILE 90 HG12 ILE 90 -5.440 -6.593 -0.816 737 HG13 ILE 90 HG11 ILE 90 -6.665 -6.831 0.414 738 HG21 ILE 90 HG21 ILE 90 -6.957 -5.315 -3.070 739 HG22 ILE 90 HG22 ILE 90 -5.551 -4.537 -2.340 740 HG23 ILE 90 HG23 ILE 90 -7.071 -3.653 -2.485 741 HD11 ILE 90 HD11 ILE 90 -8.183 -7.756 -1.254 742 HD12 ILE 90 HD12 ILE 90 -6.653 -8.630 -1.213 743 HD13 ILE 90 HD13 ILE 90 -6.973 -7.483 -2.512 744 H GLY 91 HN GLY 91 -6.096 -3.260 2.570 745 HA2 GLY 91 HA2 GLY 91 -8.426 -3.808 4.026 746 HA3 GLY 91 HA1 GLY 91 -7.351 -5.194 4.209 747 H GLN 92 HN GLN 92 -6.546 -5.027 6.193 748 HA GLN 92 HA GLN 92 -5.206 -2.564 7.121 749 HB2 GLN 92 HB2 GLN 92 -7.075 -4.290 8.836 750 HB3 GLN 92 HB1 GLN 92 -6.171 -2.882 9.392 751 HG2 GLN 92 HG2 GLN 92 -7.518 -1.451 7.874 752 HG3 GLN 92 HG1 GLN 92 -8.440 -2.862 7.368 753 HE21 GLN 92 HE21 GLN 92 -9.341 -0.381 8.666 754 HE22 GLN 92 HE22 GLN 92 -10.147 -0.865 10.116 755 HA PRO 93 HA PRO 93 -2.013 -5.673 7.865 756 HB2 PRO 93 HB2 PRO 93 -0.280 -4.265 9.432 757 HB3 PRO 93 HB1 PRO 93 -0.490 -3.911 7.713 758 HG2 PRO 93 HG2 PRO 93 -1.766 -2.538 10.083 759 HG3 PRO 93 HG1 PRO 93 -0.945 -1.816 8.684 760 HD2 PRO 93 HD2 PRO 93 -3.636 -1.966 8.791 761 HD3 PRO 93 HD1 PRO 93 -2.762 -2.178 7.257 762 H LEU 94 HN LEU 94 -2.589 -7.363 9.124 763 HA LEU 94 HA LEU 94 -3.465 -6.906 11.914 764 HB2 LEU 94 HB2 LEU 94 -4.926 -8.062 9.955 765 HB3 LEU 94 HB1 LEU 94 -4.061 -9.492 10.471 766 HG LEU 94 HG LEU 94 -6.291 -9.334 11.511 767 HD11 LEU 94 HD11 LEU 94 -5.717 -9.696 13.849 768 HD12 LEU 94 HD12 LEU 94 -4.117 -8.991 13.582 769 HD13 LEU 94 HD13 LEU 94 -4.565 -10.499 12.779 770 HD21 LEU 94 HD21 LEU 94 -6.536 -6.899 11.530 771 HD22 LEU 94 HD22 LEU 94 -5.321 -6.772 12.805 772 HD23 LEU 94 HD23 LEU 94 -6.858 -7.582 13.124 773 HA PRO 95 HA PRO 95 0.584 -8.920 12.980 774 HB2 PRO 95 HB2 PRO 95 -0.651 -8.423 15.693 775 HB3 PRO 95 HB1 PRO 95 1.001 -8.113 15.134 776 HG2 PRO 95 HG2 PRO 95 -0.712 -6.097 15.410 777 HG3 PRO 95 HG1 PRO 95 0.399 -6.140 14.025 778 HD2 PRO 95 HD2 PRO 95 -2.542 -6.793 14.110 779 HD3 PRO 95 HD1 PRO 95 -1.614 -5.938 12.861 780 H ASP 96 HN ASP 96 1.076 -10.972 13.810 781 HA ASP 96 HA ASP 96 -1.025 -12.928 13.714 782 HB2 ASP 96 HB2 ASP 96 0.713 -14.564 13.899 783 HB3 ASP 96 HB1 ASP 96 1.365 -13.275 12.900 784 H ALA 97 HN ALA 97 -0.969 -14.691 15.508 785 HA ALA 97 HA ALA 97 -2.125 -13.651 17.842 786 HB1 ALA 97 HB1 ALA 97 -2.117 -15.976 18.654 787 HB2 ALA 97 HB2 ALA 97 -0.972 -16.424 17.384 788 HB3 ALA 97 HB3 ALA 97 -2.602 -15.897 16.957 789 H ALA 98 HN ALA 98 1.231 -14.490 17.164 790 HA ALA 98 HA ALA 98 2.038 -14.399 19.986 791 HB1 ALA 98 HB1 ALA 98 4.214 -15.189 19.200 792 HB2 ALA 98 HB2 ALA 98 3.712 -14.983 17.516 793 HB3 ALA 98 HB3 ALA 98 2.923 -16.192 18.533 794 H ARG 99 HN ARG 99 1.746 -12.149 17.443 795 HA ARG 99 HA ARG 99 2.387 -10.012 17.087 796 HB2 ARG 99 HB2 ARG 99 2.921 -10.195 20.062 797 HB3 ARG 99 HB1 ARG 99 3.369 -8.737 19.198 798 HG2 ARG 99 HG2 ARG 99 1.209 -8.434 20.275 799 HG3 ARG 99 HG1 ARG 99 1.015 -8.392 18.522 800 HD2 ARG 99 HD2 ARG 99 0.186 -10.723 18.564 801 HD3 ARG 99 HD1 ARG 99 0.405 -10.770 20.315 802 HE ARG 99 HE ARG 99 -1.244 -8.773 20.237 803 HH11 ARG 99 HH11 ARG 99 -1.449 -11.579 18.150 804 HH12 ARG 99 HH12 ARG 99 -3.174 -11.491 18.029 805 HH21 ARG 99 HH21 ARG 99 -3.461 -8.676 20.062 806 HH22 ARG 99 HH22 ARG 99 -4.314 -9.852 19.119 807 H THR 100 HN THR 100 4.238 -12.159 16.518 808 HA THR 100 HA THR 100 6.901 -10.908 16.800 809 HB THR 100 HB THR 100 7.735 -13.148 15.949 810 HG1 THR 100 HG1 THR 100 5.001 -13.548 15.695 811 HG21 THR 100 HG21 THR 100 6.001 -13.266 18.454 812 HG22 THR 100 HG22 THR 100 7.657 -12.659 18.382 813 HG23 THR 100 HG23 THR 100 7.327 -14.362 18.063 814 H ARG 101 HN ARG 101 4.380 -11.026 14.574 815 HA ARG 101 HA ARG 101 5.772 -9.993 12.362 816 HB2 ARG 101 HB2 ARG 101 5.383 -12.057 10.777 817 HB3 ARG 101 HB1 ARG 101 6.796 -12.012 11.806 818 HG2 ARG 101 HG2 ARG 101 6.170 -14.192 12.148 819 HG3 ARG 101 HG1 ARG 101 5.267 -13.433 13.455 820 HD2 ARG 101 HD2 ARG 101 3.265 -13.374 11.918 821 HD3 ARG 101 HD1 ARG 101 4.207 -14.320 10.760 822 HE ARG 101 HE ARG 101 3.833 -15.340 13.489 823 HH11 ARG 101 HH11 ARG 101 3.174 -15.760 10.040 824 HH12 ARG 101 HH12 ARG 101 2.459 -17.320 10.262 825 HH21 ARG 101 HH21 ARG 101 2.909 -17.374 13.735 826 HH22 ARG 101 HH22 ARG 101 2.295 -18.228 12.352 827 H LEU 102 HN LEU 102 4.415 -9.232 10.723 828 HA LEU 102 HA LEU 102 1.530 -9.217 11.369 829 HB2 LEU 102 HB2 LEU 102 3.406 -7.255 10.051 830 HB3 LEU 102 HB1 LEU 102 1.754 -7.236 9.511 831 HG LEU 102 HG LEU 102 1.034 -6.780 11.886 832 HD11 LEU 102 HD11 LEU 102 3.019 -7.637 13.036 833 HD12 LEU 102 HD12 LEU 102 2.655 -5.973 13.489 834 HD13 LEU 102 HD13 LEU 102 3.976 -6.312 12.365 835 HD21 LEU 102 HD21 LEU 102 2.883 -4.725 10.622 836 HD22 LEU 102 HD22 LEU 102 1.634 -4.399 11.829 837 HD23 LEU 102 HD23 LEU 102 1.179 -4.976 10.227 838 H GLU 103 HN GLU 103 0.051 -10.024 9.957 839 HA GLU 103 HA GLU 103 0.823 -10.927 7.296 840 HB2 GLU 103 HB2 GLU 103 -0.895 -12.219 8.582 841 HB3 GLU 103 HB1 GLU 103 -1.949 -10.805 8.593 842 HG2 GLU 103 HG2 GLU 103 -1.917 -10.887 6.046 843 HG3 GLU 103 HG1 GLU 103 -1.070 -12.428 6.174 844 H ILE 104 HN ILE 104 1.178 -9.287 5.915 845 HA ILE 104 HA ILE 104 -0.648 -6.997 5.746 846 HB ILE 104 HB ILE 104 1.808 -7.577 4.014 847 HG12 ILE 104 HG12 ILE 104 2.589 -7.476 6.339 848 HG13 ILE 104 HG11 ILE 104 3.082 -6.017 5.490 849 HG21 ILE 104 HG21 ILE 104 0.303 -4.981 4.542 850 HG22 ILE 104 HG22 ILE 104 0.271 -5.930 3.051 851 HG23 ILE 104 HG23 ILE 104 1.766 -5.142 3.558 852 HD11 ILE 104 HD11 ILE 104 1.236 -4.797 6.551 853 HD12 ILE 104 HD12 ILE 104 2.354 -5.502 7.716 854 HD13 ILE 104 HD13 ILE 104 0.790 -6.263 7.430 855 H LEU 105 HN LEU 105 -2.526 -7.659 4.750 856 HA LEU 105 HA LEU 105 -2.458 -9.420 2.427 857 HB2 LEU 105 HB2 LEU 105 -4.838 -9.398 2.403 858 HB3 LEU 105 HB1 LEU 105 -4.362 -9.555 4.084 859 HG LEU 105 HG LEU 105 -5.271 -6.924 2.842 860 HD11 LEU 105 HD11 LEU 105 -7.088 -8.524 2.671 861 HD12 LEU 105 HD12 LEU 105 -7.450 -7.294 3.877 862 HD13 LEU 105 HD13 LEU 105 -6.953 -8.911 4.391 863 HD21 LEU 105 HD21 LEU 105 -5.626 -6.189 5.157 864 HD22 LEU 105 HD22 LEU 105 -3.944 -6.630 4.879 865 HD23 LEU 105 HD23 LEU 105 -5.007 -7.733 5.760 866 H CYS 106 HN CYS 106 -2.835 -8.772 0.368 867 HA CYS 106 HA CYS 106 -3.016 -5.981 -0.391 868 HB2 CYS 106 HB2 CYS 106 -0.454 -7.554 -0.952 869 HB3 CYS 106 HB1 CYS 106 -0.863 -6.010 -1.687 870 HG CYS 106 HG CYS 106 -1.136 -5.435 1.439 871 H ARG 107 HN ARG 107 -2.861 -5.849 -2.817 872 HA ARG 107 HA ARG 107 -3.097 -8.302 -4.371 873 HB2 ARG 107 HB2 ARG 107 -5.452 -7.807 -3.621 874 HB3 ARG 107 HB1 ARG 107 -5.342 -6.213 -4.356 875 HG2 ARG 107 HG2 ARG 107 -5.251 -7.165 -6.574 876 HG3 ARG 107 HG1 ARG 107 -5.069 -8.794 -5.920 877 HD2 ARG 107 HD2 ARG 107 -7.384 -8.484 -4.870 878 HD3 ARG 107 HD1 ARG 107 -7.532 -7.026 -5.872 879 HE ARG 107 HE ARG 107 -6.739 -9.394 -7.321 880 HH11 ARG 107 HH11 ARG 107 -9.541 -7.563 -6.265 881 HH12 ARG 107 HH12 ARG 107 -10.568 -8.238 -7.486 882 HH21 ARG 107 HH21 ARG 107 -8.080 -10.277 -8.853 883 HH22 ARG 107 HH22 ARG 107 -9.742 -9.801 -8.935 884 H GLU 108 HN GLU 108 -2.815 -7.842 -6.687 885 HA GLU 108 HA GLU 108 -1.288 -5.570 -7.408 886 HB2 GLU 108 HB2 GLU 108 -1.508 -7.815 -8.679 887 HB3 GLU 108 HB1 GLU 108 -3.008 -7.186 -9.348 888 HG2 GLU 108 HG2 GLU 108 -0.412 -5.656 -9.648 889 HG3 GLU 108 HG1 GLU 108 -0.774 -7.014 -10.706 890 H GLY 109 HN GLY 109 -2.074 -3.568 -7.100 891 HA2 GLY 109 HA2 GLY 109 -4.996 -3.166 -6.982 892 HA3 GLY 109 HA1 GLY 109 -3.770 -2.203 -6.176 893 H ALA 110 HN ALA 110 -4.152 -3.198 -9.566 894 HA ALA 110 HA ALA 110 -4.470 -2.117 -11.501 895 HB1 ALA 110 HB1 ALA 110 -5.885 -0.120 -11.573 896 HB2 ALA 110 HB2 ALA 110 -5.697 0.096 -9.830 897 HB3 ALA 110 HB3 ALA 110 -6.548 -1.315 -10.457 898 H GLU 111 HN GLU 111 -2.125 -2.105 -11.473 899 HA GLU 111 HA GLU 111 -0.645 0.350 -11.097 900 HB2 GLU 111 HB2 GLU 111 0.137 -2.134 -12.700 901 HB3 GLU 111 HB1 GLU 111 1.228 -0.893 -12.084 902 HG2 GLU 111 HG2 GLU 111 0.876 -1.580 -9.822 903 HG3 GLU 111 HG1 GLU 111 -0.458 -2.644 -10.278 904 H LYS 112 HN LYS 112 -2.621 -0.965 -13.550 905 HA LYS 112 HA LYS 112 -1.495 0.619 -15.759 906 HB2 LYS 112 HB2 LYS 112 -3.659 -1.547 -15.817 907 HB3 LYS 112 HB1 LYS 112 -2.977 -0.739 -17.219 908 HG2 LYS 112 HG2 LYS 112 -1.937 -2.855 -17.174 909 HG3 LYS 112 HG1 LYS 112 -0.720 -1.740 -16.545 910 HD2 LYS 112 HD2 LYS 112 -1.330 -2.430 -14.221 911 HD3 LYS 112 HD1 LYS 112 -2.495 -3.575 -14.882 912 HE2 LYS 112 HE2 LYS 112 -0.644 -4.798 -15.982 913 HE3 LYS 112 HE1 LYS 112 0.509 -3.654 -15.289 914 HZ1 LYS 112 HZ1 LYS 112 -0.190 -4.348 -13.082 915 HZ2 LYS 112 HZ2 LYS 112 0.368 -5.662 -13.978 916 HZ3 LYS 112 HZ3 LYS 112 -1.293 -5.442 -13.751 Start of MODEL 15 1 H1 MET 1 HT1 MET 1 16.010 -24.056 15.626 2 H2 MET 1 HT2 MET 1 16.014 -24.461 13.989 3 H3 MET 1 HT3 MET 1 15.208 -25.448 15.100 4 HA MET 1 HA MET 1 13.703 -24.114 13.807 5 HB2 MET 1 HB2 MET 1 13.847 -23.418 16.768 6 HB3 MET 1 HB1 MET 1 12.457 -23.064 15.747 7 HG2 MET 1 HG2 MET 1 13.531 -25.815 16.408 8 HG3 MET 1 HG1 MET 1 12.050 -25.074 17.026 9 HE1 MET 1 HE1 MET 1 10.782 -27.935 14.606 10 HE2 MET 1 HE2 MET 1 10.682 -27.294 16.244 11 HE3 MET 1 HE3 MET 1 12.202 -27.972 15.651 12 H ASN 2 HN ASN 2 13.158 -22.254 12.917 13 HA ASN 2 HA ASN 2 14.187 -19.644 13.605 14 HB2 ASN 2 HB2 ASN 2 16.148 -20.601 12.366 15 HB3 ASN 2 HB1 ASN 2 15.112 -21.000 11.004 16 HD21 ASN 2 HD21 ASN 2 16.287 -19.753 9.556 17 HD22 ASN 2 HD22 ASN 2 16.289 -18.023 9.588 18 H ILE 3 HN ILE 3 13.113 -17.981 12.285 19 HA ILE 3 HA ILE 3 10.459 -18.685 11.466 20 HB ILE 3 HB ILE 3 11.959 -16.035 11.128 21 HG12 ILE 3 HG12 ILE 3 10.322 -15.265 12.968 22 HG13 ILE 3 HG11 ILE 3 9.914 -16.956 13.213 23 HG21 ILE 3 HG21 ILE 3 9.011 -16.609 10.638 24 HG22 ILE 3 HG22 ILE 3 10.216 -16.194 9.413 25 HG23 ILE 3 HG23 ILE 3 9.746 -15.008 10.633 26 HD11 ILE 3 HD11 ILE 3 12.624 -15.695 13.618 27 HD12 ILE 3 HD12 ILE 3 12.229 -17.395 13.891 28 HD13 ILE 3 HD13 ILE 3 11.477 -16.140 14.877 29 H GLY 4 HN GLY 4 10.463 -20.071 9.786 30 HA2 GLY 4 HA2 GLY 4 12.125 -19.744 7.423 31 HA3 GLY 4 HA1 GLY 4 10.990 -21.045 7.756 32 H ARG 5 HN ARG 5 10.758 -17.509 7.411 33 HA ARG 5 HA ARG 5 8.691 -17.840 5.318 34 HB2 ARG 5 HB2 ARG 5 8.614 -15.876 7.662 35 HB3 ARG 5 HB1 ARG 5 7.502 -15.840 6.295 36 HG2 ARG 5 HG2 ARG 5 7.773 -18.111 8.289 37 HG3 ARG 5 HG1 ARG 5 6.512 -16.876 8.306 38 HD2 ARG 5 HD2 ARG 5 5.685 -17.668 6.131 39 HD3 ARG 5 HD1 ARG 5 6.976 -18.879 6.060 40 HE ARG 5 HE ARG 5 5.711 -19.414 8.411 41 HH11 ARG 5 HH11 ARG 5 4.522 -19.125 5.114 42 HH12 ARG 5 HH12 ARG 5 3.253 -20.280 5.356 43 HH21 ARG 5 HH21 ARG 5 4.069 -20.923 8.696 44 HH22 ARG 5 HH22 ARG 5 2.987 -21.289 7.395 45 H LEU 6 HN LEU 6 10.757 -15.412 6.971 46 HA LEU 6 HA LEU 6 10.555 -13.551 4.820 47 HB2 LEU 6 HB2 LEU 6 12.189 -13.558 7.366 48 HB3 LEU 6 HB1 LEU 6 12.337 -12.293 6.174 49 HG LEU 6 HG LEU 6 9.891 -11.782 6.464 50 HD11 LEU 6 HD11 LEU 6 9.100 -13.907 7.353 51 HD12 LEU 6 HD12 LEU 6 8.674 -12.567 8.414 52 HD13 LEU 6 HD13 LEU 6 10.010 -13.642 8.843 53 HD21 LEU 6 HD21 LEU 6 11.630 -10.451 7.581 54 HD22 LEU 6 HD22 LEU 6 11.533 -11.502 8.994 55 HD23 LEU 6 HD23 LEU 6 10.149 -10.528 8.511 56 H ARG 7 HN ARG 7 11.314 -14.364 2.982 57 HA ARG 7 HA ARG 7 14.161 -15.196 2.732 58 HB2 ARG 7 HB2 ARG 7 13.357 -16.742 0.912 59 HB3 ARG 7 HB1 ARG 7 12.722 -17.143 2.503 60 HG2 ARG 7 HG2 ARG 7 10.578 -15.997 1.893 61 HG3 ARG 7 HG1 ARG 7 11.223 -15.720 0.276 62 HD2 ARG 7 HD2 ARG 7 10.818 -18.459 1.536 63 HD3 ARG 7 HD1 ARG 7 9.702 -17.684 0.405 64 HE ARG 7 HE ARG 7 12.102 -17.680 -0.899 65 HH11 ARG 7 HH11 ARG 7 10.140 -20.220 0.473 66 HH12 ARG 7 HH12 ARG 7 10.675 -21.407 -0.668 67 HH21 ARG 7 HH21 ARG 7 12.749 -19.232 -2.412 68 HH22 ARG 7 HH22 ARG 7 12.135 -20.849 -2.294 69 H ASP 8 HN ASP 8 11.749 -13.021 1.702 70 HA ASP 8 HA ASP 8 13.224 -12.137 -0.686 71 HB2 ASP 8 HB2 ASP 8 10.248 -12.093 0.001 72 HB3 ASP 8 HB1 ASP 8 10.919 -11.082 -1.276 73 H ARG 9 HN ARG 9 12.205 -9.710 -1.032 74 HA ARG 9 HA ARG 9 12.396 -8.130 1.426 75 HB2 ARG 9 HB2 ARG 9 14.004 -7.683 -1.120 76 HB3 ARG 9 HB1 ARG 9 13.707 -6.397 0.047 77 HG2 ARG 9 HG2 ARG 9 14.836 -7.810 1.793 78 HG3 ARG 9 HG1 ARG 9 15.257 -8.958 0.516 79 HD2 ARG 9 HD2 ARG 9 16.099 -6.041 0.652 80 HD3 ARG 9 HD1 ARG 9 17.116 -7.439 0.996 81 HE ARG 9 HE ARG 9 16.766 -8.098 -1.387 82 HH11 ARG 9 HH11 ARG 9 16.505 -4.700 -0.506 83 HH12 ARG 9 HH12 ARG 9 16.880 -4.141 -2.103 84 HH21 ARG 9 HH21 ARG 9 17.287 -7.343 -3.462 85 HH22 ARG 9 HH22 ARG 9 17.323 -5.638 -3.776 86 H ILE 10 HN ILE 10 11.144 -6.317 1.435 87 HA ILE 10 HA ILE 10 9.594 -5.537 -0.948 88 HB ILE 10 HB ILE 10 7.484 -5.453 0.147 89 HG12 ILE 10 HG12 ILE 10 8.021 -4.681 2.384 90 HG13 ILE 10 HG11 ILE 10 7.014 -6.110 2.509 91 HG21 ILE 10 HG21 ILE 10 8.003 -7.661 -0.717 92 HG22 ILE 10 HG22 ILE 10 6.955 -7.788 0.696 93 HG23 ILE 10 HG23 ILE 10 8.677 -8.151 0.840 94 HD11 ILE 10 HD11 ILE 10 9.939 -5.833 3.101 95 HD12 ILE 10 HD12 ILE 10 9.120 -7.387 2.993 96 HD13 ILE 10 HD13 ILE 10 8.620 -6.212 4.206 97 H THR 11 HN THR 11 9.050 -3.345 -0.994 98 HA THR 11 HA THR 11 10.603 -1.604 0.805 99 HB THR 11 HB THR 11 9.429 -0.814 -1.913 100 HG1 THR 11 HG1 THR 11 10.885 -2.626 -2.123 101 HG21 THR 11 HG21 THR 11 11.761 0.308 -0.313 102 HG22 THR 11 HG22 THR 11 10.156 1.046 -0.422 103 HG23 THR 11 HG23 THR 11 11.165 0.919 -1.865 104 H ILE 12 HN ILE 12 9.473 -0.558 2.280 105 HA ILE 12 HA ILE 12 6.568 -0.481 2.291 106 HB ILE 12 HB ILE 12 8.482 0.726 4.342 107 HG12 ILE 12 HG12 ILE 12 9.036 -1.629 4.184 108 HG13 ILE 12 HG11 ILE 12 8.098 -1.409 5.652 109 HG21 ILE 12 HG21 ILE 12 5.540 -0.035 4.595 110 HG22 ILE 12 HG22 ILE 12 6.201 1.603 4.548 111 HG23 ILE 12 HG23 ILE 12 6.567 0.548 5.914 112 HD11 ILE 12 HD11 ILE 12 7.088 -2.543 3.046 113 HD12 ILE 12 HD12 ILE 12 6.127 -2.315 4.512 114 HD13 ILE 12 HD13 ILE 12 7.485 -3.441 4.509 115 H GLN 13 HN GLN 13 5.938 0.908 0.688 116 HA GLN 13 HA GLN 13 7.064 3.566 0.405 117 HB2 GLN 13 HB2 GLN 13 6.473 2.176 -1.587 118 HB3 GLN 13 HB1 GLN 13 4.777 2.231 -1.105 119 HG2 GLN 13 HG2 GLN 13 4.851 4.712 -1.353 120 HG3 GLN 13 HG1 GLN 13 6.498 4.579 -1.971 121 HE21 GLN 13 HE21 GLN 13 6.823 3.643 -4.043 122 HE22 GLN 13 HE22 GLN 13 5.520 3.463 -5.164 123 H THR 14 HN THR 14 6.533 4.658 2.130 124 HA THR 14 HA THR 14 3.890 4.715 3.343 125 HB THR 14 HB THR 14 4.984 6.498 4.853 126 HG1 THR 14 HG1 THR 14 6.755 6.552 2.964 127 HG21 THR 14 HG21 THR 14 6.375 3.789 4.678 128 HG22 THR 14 HG22 THR 14 4.861 4.104 5.529 129 HG23 THR 14 HG23 THR 14 6.357 4.853 6.089 130 H LEU 15 HN LEU 15 2.631 6.739 3.646 131 HA LEU 15 HA LEU 15 2.351 8.078 1.081 132 HB2 LEU 15 HB2 LEU 15 0.371 7.131 2.207 133 HB3 LEU 15 HB1 LEU 15 0.674 8.124 3.622 134 HG LEU 15 HG LEU 15 0.232 10.172 2.241 135 HD11 LEU 15 HD11 LEU 15 -0.620 8.235 0.073 136 HD12 LEU 15 HD12 LEU 15 0.784 9.302 0.030 137 HD13 LEU 15 HD13 LEU 15 -0.837 9.985 0.059 138 HD21 LEU 15 HD21 LEU 15 -2.199 9.932 2.164 139 HD22 LEU 15 HD22 LEU 15 -1.542 9.217 3.637 140 HD23 LEU 15 HD23 LEU 15 -2.051 8.178 2.303 141 H LYS 16 HN LYS 16 3.703 9.790 0.806 142 HA LYS 16 HA LYS 16 4.397 11.603 2.937 143 HB2 LYS 16 HB2 LYS 16 5.945 10.863 1.046 144 HB3 LYS 16 HB1 LYS 16 4.967 11.826 -0.055 145 HG2 LYS 16 HG2 LYS 16 5.571 13.861 1.106 146 HG3 LYS 16 HG1 LYS 16 6.387 12.941 2.375 147 HD2 LYS 16 HD2 LYS 16 7.966 12.073 0.561 148 HD3 LYS 16 HD1 LYS 16 7.247 13.276 -0.520 149 HE2 LYS 16 HE2 LYS 16 9.303 14.156 0.457 150 HE3 LYS 16 HE1 LYS 16 7.921 15.063 1.075 151 HZ1 LYS 16 HZ1 LYS 16 9.524 14.493 2.809 152 HZ2 LYS 16 HZ2 LYS 16 9.282 12.846 2.508 153 HZ3 LYS 16 HZ3 LYS 16 8.015 13.789 3.105 154 H GLN 17 HN GLN 17 2.462 12.647 3.543 155 HA GLN 17 HA GLN 17 0.897 14.134 1.558 156 HB2 GLN 17 HB2 GLN 17 0.598 13.925 4.594 157 HB3 GLN 17 HB1 GLN 17 -0.480 14.843 3.538 158 HG2 GLN 17 HG2 GLN 17 -0.934 12.655 2.316 159 HG3 GLN 17 HG1 GLN 17 -0.073 11.847 3.622 160 HE21 GLN 17 HE21 GLN 17 -2.939 13.658 2.773 161 HE22 GLN 17 HE22 GLN 17 -3.873 13.225 4.154 162 H THR 18 HN THR 18 1.802 15.950 0.856 163 HA THR 18 HA THR 18 3.240 17.758 2.713 164 HB THR 18 HB THR 18 4.103 17.143 -0.160 165 HG1 THR 18 HG1 THR 18 5.008 16.156 2.343 166 HG21 THR 18 HG21 THR 18 4.731 19.422 0.567 167 HG22 THR 18 HG22 THR 18 6.166 18.393 0.477 168 HG23 THR 18 HG23 THR 18 5.446 18.765 2.043 169 H ARG 19 HN ARG 19 2.429 19.777 2.625 170 HA ARG 19 HA ARG 19 0.406 20.557 0.760 171 HB2 ARG 19 HB2 ARG 19 0.482 21.328 3.122 172 HB3 ARG 19 HB1 ARG 19 1.956 22.225 2.777 173 HG2 ARG 19 HG2 ARG 19 0.729 23.666 1.198 174 HG3 ARG 19 HG1 ARG 19 -0.754 22.761 1.499 175 HD2 ARG 19 HD2 ARG 19 -0.714 24.889 2.732 176 HD3 ARG 19 HD1 ARG 19 -0.747 23.514 3.838 177 HE ARG 19 HE ARG 19 1.814 23.889 3.873 178 HH11 ARG 19 HH11 ARG 19 -0.519 26.514 3.696 179 HH12 ARG 19 HH12 ARG 19 0.527 27.643 4.492 180 HH21 ARG 19 HH21 ARG 19 3.155 25.358 4.936 181 HH22 ARG 19 HH22 ARG 19 2.611 26.988 5.193 182 H ASP 20 HN ASP 20 0.548 22.267 -0.776 183 HA ASP 20 HA ASP 20 3.179 22.415 -2.139 184 HB2 ASP 20 HB2 ASP 20 1.196 21.357 -3.356 185 HB3 ASP 20 HB1 ASP 20 0.405 22.927 -3.316 186 H ILE 21 HN ILE 21 3.603 24.614 -3.296 187 HA ILE 21 HA ILE 21 3.238 26.856 -1.721 188 HB ILE 21 HB ILE 21 5.005 26.560 -3.436 189 HG12 ILE 21 HG12 ILE 21 3.388 29.109 -3.919 190 HG13 ILE 21 HG11 ILE 21 4.485 28.856 -2.565 191 HG21 ILE 21 HG21 ILE 21 4.557 26.976 -5.828 192 HG22 ILE 21 HG22 ILE 21 2.829 27.090 -5.484 193 HG23 ILE 21 HG23 ILE 21 3.679 25.561 -5.235 194 HD11 ILE 21 HD11 ILE 21 6.370 28.701 -4.132 195 HD12 ILE 21 HD12 ILE 21 5.504 30.228 -4.284 196 HD13 ILE 21 HD13 ILE 21 5.264 28.959 -5.484 197 H THR 22 HN THR 22 0.799 25.356 -3.666 198 HA THR 22 HA THR 22 -0.740 27.815 -4.124 199 HB THR 22 HB THR 22 -2.305 26.227 -5.303 200 HG1 THR 22 HG1 THR 22 -1.767 24.080 -5.481 201 HG21 THR 22 HG21 THR 22 -0.862 25.721 -7.240 202 HG22 THR 22 HG22 THR 22 0.578 26.033 -6.268 203 HG23 THR 22 HG23 THR 22 -0.545 27.348 -6.633 204 H GLY 23 HN GLY 23 -0.173 25.436 -1.892 205 HA2 GLY 23 HA2 GLY 23 -0.995 25.278 0.305 206 HA3 GLY 23 HA1 GLY 23 -2.424 26.176 -0.170 207 H GLU 24 HN GLU 24 -1.466 23.396 -2.095 208 HA GLU 24 HA GLU 24 -3.938 22.028 -1.300 209 HB2 GLU 24 HB2 GLU 24 -2.058 21.485 -3.648 210 HB3 GLU 24 HB1 GLU 24 -3.589 20.662 -3.344 211 HG2 GLU 24 HG2 GLU 24 -4.795 22.780 -3.701 212 HG3 GLU 24 HG1 GLU 24 -3.260 23.607 -3.982 213 H ILE 25 HN ILE 25 -3.854 20.148 -0.115 214 HA ILE 25 HA ILE 25 -1.326 19.086 0.807 215 HB ILE 25 HB ILE 25 -4.144 17.953 1.188 216 HG12 ILE 25 HG12 ILE 25 -3.979 20.203 2.179 217 HG13 ILE 25 HG11 ILE 25 -4.073 18.995 3.452 218 HG21 ILE 25 HG21 ILE 25 -3.189 16.644 3.062 219 HG22 ILE 25 HG22 ILE 25 -1.576 17.243 2.665 220 HG23 ILE 25 HG23 ILE 25 -2.443 16.214 1.521 221 HD11 ILE 25 HD11 ILE 25 -1.584 20.437 2.543 222 HD12 ILE 25 HD12 ILE 25 -1.651 19.206 3.808 223 HD13 ILE 25 HD13 ILE 25 -2.503 20.735 4.017 224 H LEU 26 HN LEU 26 -0.210 18.292 -0.948 225 HA LEU 26 HA LEU 26 -1.410 16.526 -2.914 226 HB2 LEU 26 HB2 LEU 26 1.512 17.319 -2.538 227 HB3 LEU 26 HB1 LEU 26 0.847 16.468 -3.923 228 HG LEU 26 HG LEU 26 0.391 19.373 -3.139 229 HD11 LEU 26 HD11 LEU 26 2.485 18.884 -4.325 230 HD12 LEU 26 HD12 LEU 26 1.404 19.881 -5.290 231 HD13 LEU 26 HD13 LEU 26 1.579 18.161 -5.656 232 HD21 LEU 26 HD21 LEU 26 -1.768 18.505 -3.875 233 HD22 LEU 26 HD22 LEU 26 -1.042 17.844 -5.343 234 HD23 LEU 26 HD23 LEU 26 -1.100 19.592 -5.095 235 H GLU 27 HN GLU 27 -1.835 14.505 -2.280 236 HA GLU 27 HA GLU 27 -0.235 13.097 -0.305 237 HB2 GLU 27 HB2 GLU 27 -2.731 12.275 -1.847 238 HB3 GLU 27 HB1 GLU 27 -1.938 11.277 -0.622 239 HG2 GLU 27 HG2 GLU 27 -2.311 13.075 1.054 240 HG3 GLU 27 HG1 GLU 27 -3.168 14.013 -0.172 241 H THR 28 HN THR 28 1.636 12.583 -1.082 242 HA THR 28 HA THR 28 1.973 11.227 -3.698 243 HB THR 28 HB THR 28 4.341 12.069 -3.654 244 HG1 THR 28 HG1 THR 28 3.439 13.542 -1.392 245 HG21 THR 28 HG21 THR 28 2.300 14.308 -3.441 246 HG22 THR 28 HG22 THR 28 2.636 13.362 -4.894 247 HG23 THR 28 HG23 THR 28 3.882 14.412 -4.221 248 H TRP 29 HN TRP 29 4.386 10.016 -3.375 249 HA TRP 29 HA TRP 29 3.988 8.265 -1.013 250 HB2 TRP 29 HB2 TRP 29 4.391 7.427 -3.922 251 HB3 TRP 29 HB1 TRP 29 4.419 6.329 -2.550 252 HD1 TRP 29 HD1 TRP 29 2.000 8.058 -4.885 253 HE1 TRP 29 HE1 TRP 29 -0.410 7.451 -4.234 254 HE3 TRP 29 HE3 TRP 29 2.923 5.761 -0.402 255 HZ2 TRP 29 HZ2 TRP 29 -1.756 6.186 -2.099 256 HZ3 TRP 29 HZ3 TRP 29 1.019 4.883 0.882 257 HH2 TRP 29 HH2 TRP 29 -1.272 5.092 0.055 258 H GLU 30 HN GLU 30 5.762 8.446 0.161 259 HA GLU 30 HA GLU 30 8.428 8.510 -1.120 260 HB2 GLU 30 HB2 GLU 30 9.313 8.919 1.198 261 HB3 GLU 30 HB1 GLU 30 8.235 10.170 0.611 262 HG2 GLU 30 HG2 GLU 30 6.451 9.405 2.048 263 HG3 GLU 30 HG1 GLU 30 7.385 7.989 2.528 264 H ASP 31 HN ASP 31 9.092 6.550 -1.694 265 HA ASP 31 HA ASP 31 8.501 4.090 -0.413 266 HB2 ASP 31 HB2 ASP 31 10.248 3.081 -1.801 267 HB3 ASP 31 HB1 ASP 31 9.284 4.191 -2.768 268 H GLY 32 HN GLY 32 9.743 2.878 1.164 269 HA2 GLY 32 HA2 GLY 32 11.176 4.785 2.942 270 HA3 GLY 32 HA1 GLY 32 10.008 3.592 3.485 271 H HIS 33 HN HIS 33 10.796 1.751 4.269 272 HA HIS 33 HA HIS 33 13.661 1.117 3.834 273 HB2 HIS 33 HB2 HIS 33 11.731 0.367 6.078 274 HB3 HIS 33 HB1 HIS 33 13.340 -0.339 5.912 275 HD1 HIS 33 HD1 HIS 33 11.586 2.653 7.175 276 HD2 HIS 33 HD2 HIS 33 15.488 1.532 6.292 277 HE1 HIS 33 HE1 HIS 33 13.047 4.333 8.341 278 HE2 HIS 33 HE2 HIS 33 15.379 3.788 7.560 279 H THR 34 HN THR 34 14.246 -0.767 2.839 280 HA THR 34 HA THR 34 12.132 -2.638 2.019 281 HB THR 34 HB THR 34 15.007 -2.433 1.013 282 HG1 THR 34 HG1 THR 34 12.992 -1.718 -0.712 283 HG21 THR 34 HG21 THR 34 13.980 -4.660 0.651 284 HG22 THR 34 HG22 THR 34 14.199 -3.799 -0.874 285 HG23 THR 34 HG23 THR 34 12.598 -3.890 -0.135 286 H LEU 35 HN LEU 35 11.847 -3.997 3.765 287 HA LEU 35 HA LEU 35 14.234 -5.329 4.926 288 HB2 LEU 35 HB2 LEU 35 12.865 -5.881 6.873 289 HB3 LEU 35 HB1 LEU 35 12.902 -4.149 6.618 290 HG LEU 35 HG LEU 35 10.542 -5.676 5.504 291 HD11 LEU 35 HD11 LEU 35 9.319 -5.574 7.609 292 HD12 LEU 35 HD12 LEU 35 10.760 -4.989 8.445 293 HD13 LEU 35 HD13 LEU 35 10.737 -6.616 7.757 294 HD21 LEU 35 HD21 LEU 35 9.334 -3.615 6.051 295 HD22 LEU 35 HD22 LEU 35 10.750 -3.273 5.059 296 HD23 LEU 35 HD23 LEU 35 10.789 -2.939 6.794 297 H TRP 36 HN TRP 36 13.463 -7.532 5.895 298 HA TRP 36 HA TRP 36 13.020 -9.279 3.685 299 HB2 TRP 36 HB2 TRP 36 13.025 -10.108 6.603 300 HB3 TRP 36 HB1 TRP 36 13.513 -11.056 5.206 301 HD1 TRP 36 HD1 TRP 36 14.938 -9.057 7.949 302 HE1 TRP 36 HE1 TRP 36 17.419 -8.548 7.532 303 HE3 TRP 36 HE3 TRP 36 15.210 -10.346 3.018 304 HZ2 TRP 36 HZ2 TRP 36 19.253 -8.657 5.400 305 HZ3 TRP 36 HZ3 TRP 36 17.352 -10.093 1.858 306 HH2 TRP 36 HH2 TRP 36 19.343 -9.270 3.020 307 H ALA 37 HN ALA 37 11.336 -10.618 3.236 308 HA ALA 37 HA ALA 37 8.955 -10.943 4.934 309 HB1 ALA 37 HB1 ALA 37 7.351 -10.189 3.209 310 HB2 ALA 37 HB2 ALA 37 8.698 -9.690 2.178 311 HB3 ALA 37 HB3 ALA 37 8.419 -8.886 3.721 312 H SER 38 HN SER 38 7.378 -12.575 4.100 313 HA SER 38 HA SER 38 8.336 -14.247 1.879 314 HB2 SER 38 HB2 SER 38 7.890 -15.396 4.112 315 HB3 SER 38 HB1 SER 38 6.204 -14.914 3.960 316 HG SER 38 HG SER 38 7.564 -16.379 1.948 317 H VAL 39 HN VAL 39 7.511 -13.132 0.125 318 HA VAL 39 HA VAL 39 4.788 -12.030 0.264 319 HB VAL 39 HB VAL 39 6.453 -10.400 -0.368 320 HG11 VAL 39 HG11 VAL 39 7.348 -12.199 -2.647 321 HG12 VAL 39 HG12 VAL 39 8.252 -11.893 -1.166 322 HG13 VAL 39 HG13 VAL 39 7.952 -10.576 -2.295 323 HG21 VAL 39 HG21 VAL 39 4.887 -11.230 -2.832 324 HG22 VAL 39 HG22 VAL 39 5.615 -9.649 -2.559 325 HG23 VAL 39 HG23 VAL 39 4.308 -10.207 -1.520 326 H ASN 40 HN ASN 40 3.570 -13.874 -0.004 327 HA ASN 40 HA ASN 40 3.884 -15.433 -2.511 328 HB2 ASN 40 HB2 ASN 40 2.660 -16.251 0.174 329 HB3 ASN 40 HB1 ASN 40 2.498 -17.201 -1.295 330 HD21 ASN 40 HD21 ASN 40 5.409 -15.541 -0.061 331 HD22 ASN 40 HD22 ASN 40 6.337 -16.979 0.101 332 H MET 41 HN MET 41 2.300 -15.121 -3.973 333 HA MET 41 HA MET 41 -0.057 -13.599 -3.482 334 HB2 MET 41 HB2 MET 41 0.508 -15.514 -5.784 335 HB3 MET 41 HB1 MET 41 -0.766 -14.296 -5.747 336 HG2 MET 41 HG2 MET 41 1.065 -12.542 -5.563 337 HG3 MET 41 HG1 MET 41 2.228 -13.831 -5.856 338 HE1 MET 41 HE1 MET 41 -0.628 -11.598 -7.354 339 HE2 MET 41 HE2 MET 41 -1.363 -13.204 -7.411 340 HE3 MET 41 HE3 MET 41 -0.932 -12.381 -8.908 341 H VAL 42 HN VAL 42 -2.128 -14.294 -3.053 342 HA VAL 42 HA VAL 42 -2.356 -16.581 -1.398 343 HB VAL 42 HB VAL 42 -4.647 -15.934 -1.003 344 HG11 VAL 42 HG11 VAL 42 -4.367 -13.599 -0.240 345 HG12 VAL 42 HG12 VAL 42 -2.919 -13.443 -1.238 346 HG13 VAL 42 HG13 VAL 42 -2.938 -14.576 0.114 347 HG21 VAL 42 HG21 VAL 42 -5.800 -14.117 -2.267 348 HG22 VAL 42 HG22 VAL 42 -5.429 -15.502 -3.293 349 HG23 VAL 42 HG23 VAL 42 -4.440 -14.043 -3.388 350 H SER 43 HN SER 43 -3.932 -18.303 -1.600 351 HA SER 43 HA SER 43 -4.139 -19.472 -4.251 352 HB2 SER 43 HB2 SER 43 -5.177 -20.456 -1.547 353 HB3 SER 43 HB1 SER 43 -5.055 -21.418 -3.024 354 HG SER 43 HG SER 43 -3.216 -21.882 -1.997 355 H SER 44 HN SER 44 -6.310 -20.447 -4.879 356 HA SER 44 HA SER 44 -8.248 -18.437 -5.290 357 HB2 SER 44 HB2 SER 44 -9.605 -20.282 -6.313 358 HB3 SER 44 HB1 SER 44 -7.941 -20.269 -6.887 359 HG SER 44 HG SER 44 -9.018 -22.348 -6.145 360 H LYS 45 HN LYS 45 -7.807 -20.697 -2.750 361 HA LYS 45 HA LYS 45 -10.242 -21.232 -1.620 362 HB2 LYS 45 HB2 LYS 45 -8.120 -22.141 -0.774 363 HB3 LYS 45 HB1 LYS 45 -7.628 -20.549 -0.212 364 HG2 LYS 45 HG2 LYS 45 -8.338 -21.879 1.685 365 HG3 LYS 45 HG1 LYS 45 -9.485 -20.567 1.438 366 HD2 LYS 45 HD2 LYS 45 -10.914 -22.369 1.857 367 HD3 LYS 45 HD1 LYS 45 -10.878 -22.349 0.096 368 HE2 LYS 45 HE2 LYS 45 -9.273 -24.198 1.900 369 HE3 LYS 45 HE1 LYS 45 -10.702 -24.641 0.967 370 HZ1 LYS 45 HZ1 LYS 45 -8.750 -25.373 -0.159 371 HZ2 LYS 45 HZ2 LYS 45 -8.052 -23.834 -0.101 372 HZ3 LYS 45 HZ3 LYS 45 -9.425 -24.108 -1.051 373 H GLU 46 HN GLU 46 -8.450 -18.189 -1.434 374 HA GLU 46 HA GLU 46 -9.809 -16.960 0.711 375 HB2 GLU 46 HB2 GLU 46 -8.517 -15.595 -1.685 376 HB3 GLU 46 HB1 GLU 46 -8.845 -14.861 -0.112 377 HG2 GLU 46 HG2 GLU 46 -6.844 -17.045 -0.757 378 HG3 GLU 46 HG1 GLU 46 -6.503 -15.393 -0.254 379 H ALA 47 HN ALA 47 -10.405 -16.829 -2.782 380 HA ALA 47 HA ALA 47 -12.631 -15.023 -2.662 381 HB1 ALA 47 HB1 ALA 47 -11.257 -15.219 -4.692 382 HB2 ALA 47 HB2 ALA 47 -12.944 -15.591 -5.050 383 HB3 ALA 47 HB3 ALA 47 -11.763 -16.895 -4.894 384 H ILE 48 HN ILE 48 -12.304 -18.541 -3.067 385 HA ILE 48 HA ILE 48 -14.980 -19.271 -3.398 386 HB ILE 48 HB ILE 48 -12.755 -20.898 -2.080 387 HG12 ILE 48 HG12 ILE 48 -13.639 -20.854 -5.005 388 HG13 ILE 48 HG11 ILE 48 -12.193 -20.071 -4.378 389 HG21 ILE 48 HG21 ILE 48 -14.039 -22.913 -2.734 390 HG22 ILE 48 HG22 ILE 48 -15.353 -21.894 -3.322 391 HG23 ILE 48 HG23 ILE 48 -14.950 -21.907 -1.604 392 HD11 ILE 48 HD11 ILE 48 -12.732 -23.040 -4.394 393 HD12 ILE 48 HD12 ILE 48 -11.281 -22.254 -3.764 394 HD13 ILE 48 HD13 ILE 48 -11.661 -22.154 -5.482 395 H SER 49 HN SER 49 -13.096 -19.001 -0.386 396 HA SER 49 HA SER 49 -15.161 -20.026 1.337 397 HB2 SER 49 HB2 SER 49 -12.709 -20.324 1.813 398 HB3 SER 49 HB1 SER 49 -12.574 -18.589 2.091 399 HG SER 49 HG SER 49 -14.580 -19.553 3.580 400 H SER 50 HN SER 50 -14.040 -16.828 0.350 401 HA SER 50 HA SER 50 -15.461 -15.343 2.365 402 HB2 SER 50 HB2 SER 50 -13.472 -14.393 1.286 403 HB3 SER 50 HB1 SER 50 -14.260 -14.440 -0.288 404 HG SER 50 HG SER 50 -15.182 -12.947 1.951 405 H GLY 51 HN GLY 51 -16.065 -16.157 -1.040 406 HA2 GLY 51 HA2 GLY 51 -18.315 -16.516 -1.856 407 HA3 GLY 51 HA1 GLY 51 -18.876 -15.232 -0.793 408 H ALA 52 HN ALA 52 -17.908 -13.012 -1.226 409 HA ALA 52 HA ALA 52 -17.264 -12.457 -4.041 410 HB1 ALA 52 HB1 ALA 52 -19.717 -12.648 -4.031 411 HB2 ALA 52 HB2 ALA 52 -19.224 -10.985 -4.354 412 HB3 ALA 52 HB3 ALA 52 -19.827 -11.435 -2.752 413 H GLU 53 HN GLU 53 -16.304 -11.928 -1.083 414 HA GLU 53 HA GLU 53 -16.040 -8.984 -1.179 415 HB2 GLU 53 HB2 GLU 53 -16.891 -10.049 0.924 416 HB3 GLU 53 HB1 GLU 53 -15.364 -10.906 1.090 417 HG2 GLU 53 HG2 GLU 53 -14.170 -8.755 1.290 418 HG3 GLU 53 HG1 GLU 53 -15.702 -7.896 1.116 419 H LEU 54 HN LEU 54 -13.938 -11.728 -0.204 420 HA LEU 54 HA LEU 54 -11.519 -10.458 -1.177 421 HB2 LEU 54 HB2 LEU 54 -11.928 -13.329 -0.218 422 HB3 LEU 54 HB1 LEU 54 -10.383 -12.525 -0.460 423 HG LEU 54 HG LEU 54 -12.441 -11.899 1.696 424 HD11 LEU 54 HD11 LEU 54 -11.150 -13.931 2.123 425 HD12 LEU 54 HD12 LEU 54 -10.726 -12.663 3.266 426 HD13 LEU 54 HD13 LEU 54 -9.636 -13.042 1.928 427 HD21 LEU 54 HD21 LEU 54 -10.845 -10.235 2.581 428 HD22 LEU 54 HD22 LEU 54 -11.421 -9.796 0.976 429 HD23 LEU 54 HD23 LEU 54 -9.803 -10.475 1.173 430 H ALA 55 HN ALA 55 -10.243 -11.241 -2.910 431 HA ALA 55 HA ALA 55 -11.505 -13.053 -4.865 432 HB1 ALA 55 HB1 ALA 55 -12.098 -10.750 -5.559 433 HB2 ALA 55 HB2 ALA 55 -11.009 -11.511 -6.720 434 HB3 ALA 55 HB3 ALA 55 -10.388 -10.307 -5.583 435 H ILE 56 HN ILE 56 -9.958 -13.628 -6.604 436 HA ILE 56 HA ILE 56 -7.411 -14.454 -5.517 437 HB ILE 56 HB ILE 56 -8.397 -14.764 -8.401 438 HG12 ILE 56 HG12 ILE 56 -8.873 -16.698 -6.080 439 HG13 ILE 56 HG11 ILE 56 -10.107 -15.691 -6.828 440 HG21 ILE 56 HG21 ILE 56 -6.395 -16.425 -6.825 441 HG22 ILE 56 HG22 ILE 56 -6.002 -15.247 -8.078 442 HG23 ILE 56 HG23 ILE 56 -6.893 -16.708 -8.497 443 HD11 ILE 56 HD11 ILE 56 -8.611 -17.968 -8.140 444 HD12 ILE 56 HD12 ILE 56 -9.795 -16.936 -8.948 445 HD13 ILE 56 HD13 ILE 56 -10.290 -17.963 -7.605 446 H GLY 57 HN GLY 57 -5.344 -13.951 -6.616 447 HA2 GLY 57 HA2 GLY 57 -3.899 -12.588 -7.889 448 HA3 GLY 57 HA1 GLY 57 -5.195 -11.432 -8.147 449 H THR 58 HN THR 58 -5.644 -11.943 -5.094 450 HA THR 58 HA THR 58 -4.256 -9.767 -3.954 451 HB THR 58 HB THR 58 -5.639 -12.157 -2.657 452 HG1 THR 58 HG1 THR 58 -7.447 -11.095 -2.951 453 HG21 THR 58 HG21 THR 58 -4.965 -9.486 -1.364 454 HG22 THR 58 HG22 THR 58 -4.192 -11.026 -0.987 455 HG23 THR 58 HG23 THR 58 -5.903 -10.789 -0.628 456 H VAL 59 HN VAL 59 -2.536 -9.870 -2.363 457 HA VAL 59 HA VAL 59 -0.735 -12.188 -2.531 458 HB VAL 59 HB VAL 59 0.150 -9.266 -2.493 459 HG11 VAL 59 HG11 VAL 59 2.405 -10.166 -2.929 460 HG12 VAL 59 HG12 VAL 59 1.775 -11.814 -2.893 461 HG13 VAL 59 HG13 VAL 59 1.750 -10.827 -1.430 462 HG21 VAL 59 HG21 VAL 59 0.843 -9.600 -4.863 463 HG22 VAL 59 HG22 VAL 59 -0.903 -9.749 -4.661 464 HG23 VAL 59 HG23 VAL 59 0.091 -11.194 -4.850 465 H ARG 60 HN ARG 60 -0.282 -12.980 -0.582 466 HA ARG 60 HA ARG 60 -0.693 -11.409 1.863 467 HB2 ARG 60 HB2 ARG 60 -1.706 -13.692 1.615 468 HB3 ARG 60 HB1 ARG 60 -0.086 -14.373 1.509 469 HG2 ARG 60 HG2 ARG 60 0.396 -13.606 3.803 470 HG3 ARG 60 HG1 ARG 60 -1.217 -12.890 3.907 471 HD2 ARG 60 HD2 ARG 60 -0.559 -15.839 3.587 472 HD3 ARG 60 HD1 ARG 60 -1.211 -15.050 5.032 473 HE ARG 60 HE ARG 60 -2.650 -15.313 2.452 474 HH11 ARG 60 HH11 ARG 60 -2.695 -15.267 5.952 475 HH12 ARG 60 HH12 ARG 60 -4.418 -15.450 6.043 476 HH21 ARG 60 HH21 ARG 60 -4.900 -15.504 2.582 477 HH22 ARG 60 HH22 ARG 60 -5.658 -15.583 4.135 478 H ILE 61 HN ILE 61 0.995 -10.909 3.212 479 HA ILE 61 HA ILE 61 3.762 -11.445 2.306 480 HB ILE 61 HB ILE 61 2.639 -8.647 2.834 481 HG12 ILE 61 HG12 ILE 61 3.604 -9.878 0.208 482 HG13 ILE 61 HG11 ILE 61 1.917 -9.646 0.642 483 HG21 ILE 61 HG21 ILE 61 4.864 -7.800 2.156 484 HG22 ILE 61 HG22 ILE 61 5.458 -9.455 2.014 485 HG23 ILE 61 HG23 ILE 61 4.977 -8.822 3.591 486 HD11 ILE 61 HD11 ILE 61 3.957 -7.499 0.130 487 HD12 ILE 61 HD12 ILE 61 2.299 -7.215 0.668 488 HD13 ILE 61 HD13 ILE 61 2.604 -7.965 -0.896 489 H TRP 62 HN TRP 62 4.590 -12.434 4.022 490 HA TRP 62 HA TRP 62 3.829 -11.712 6.772 491 HB2 TRP 62 HB2 TRP 62 5.236 -14.114 5.553 492 HB3 TRP 62 HB1 TRP 62 5.283 -13.823 7.288 493 HD1 TRP 62 HD1 TRP 62 2.119 -13.408 5.053 494 HE1 TRP 62 HE1 TRP 62 0.341 -15.034 5.939 495 HE3 TRP 62 HE3 TRP 62 4.872 -15.839 8.600 496 HZ2 TRP 62 HZ2 TRP 62 0.107 -17.077 7.833 497 HZ3 TRP 62 HZ3 TRP 62 3.795 -17.620 9.912 498 HH2 TRP 62 HH2 TRP 62 1.461 -18.232 9.530 499 H ILE 63 HN ILE 63 5.041 -10.370 7.890 500 HA ILE 63 HA ILE 63 7.985 -10.334 7.563 501 HB ILE 63 HB ILE 63 8.026 -7.901 8.070 502 HG12 ILE 63 HG12 ILE 63 4.996 -7.914 7.691 503 HG13 ILE 63 HG11 ILE 63 5.793 -7.793 9.253 504 HG21 ILE 63 HG21 ILE 63 6.372 -8.528 5.604 505 HG22 ILE 63 HG22 ILE 63 8.132 -8.577 5.719 506 HG23 ILE 63 HG23 ILE 63 7.285 -7.040 5.882 507 HD11 ILE 63 HD11 ILE 63 6.004 -5.795 7.002 508 HD12 ILE 63 HD12 ILE 63 6.809 -5.671 8.570 509 HD13 ILE 63 HD13 ILE 63 5.048 -5.630 8.474 510 H ARG 64 HN ARG 64 9.094 -9.744 9.617 511 HA ARG 64 HA ARG 64 8.107 -10.523 12.064 512 HB2 ARG 64 HB2 ARG 64 10.125 -8.296 11.508 513 HB3 ARG 64 HB1 ARG 64 9.858 -9.012 13.094 514 HG2 ARG 64 HG2 ARG 64 10.950 -10.424 10.640 515 HG3 ARG 64 HG1 ARG 64 11.863 -9.944 12.071 516 HD2 ARG 64 HD2 ARG 64 9.613 -11.996 12.008 517 HD3 ARG 64 HD1 ARG 64 11.340 -12.365 12.071 518 HE ARG 64 HE ARG 64 10.955 -10.768 14.243 519 HH11 ARG 64 HH11 ARG 64 9.264 -13.659 13.192 520 HH12 ARG 64 HH12 ARG 64 9.003 -14.236 14.804 521 HH21 ARG 64 HH21 ARG 64 10.601 -11.540 16.342 522 HH22 ARG 64 HH22 ARG 64 9.780 -13.047 16.587 523 H TYR 65 HN TYR 65 7.401 -9.262 13.943 524 HA TYR 65 HA TYR 65 5.191 -7.583 13.430 525 HB2 TYR 65 HB2 TYR 65 5.460 -8.991 15.491 526 HB3 TYR 65 HB1 TYR 65 6.715 -7.897 16.065 527 HD1 TYR 65 HD1 TYR 65 6.100 -5.617 16.894 528 HD2 TYR 65 HD2 TYR 65 3.081 -8.325 15.550 529 HE1 TYR 65 HE1 TYR 65 4.377 -4.195 17.906 530 HE2 TYR 65 HE2 TYR 65 1.363 -6.896 16.578 531 HH TYR 65 HH TYR 65 1.249 -5.189 18.431 532 H ARG 66 HN ARG 66 5.672 -5.811 12.251 533 HA ARG 66 HA ARG 66 7.682 -3.884 13.240 534 HB2 ARG 66 HB2 ARG 66 8.161 -4.780 10.992 535 HB3 ARG 66 HB1 ARG 66 6.580 -4.254 10.417 536 HG2 ARG 66 HG2 ARG 66 7.199 -1.926 10.639 537 HG3 ARG 66 HG1 ARG 66 8.700 -2.344 11.466 538 HD2 ARG 66 HD2 ARG 66 9.605 -3.335 9.442 539 HD3 ARG 66 HD1 ARG 66 8.069 -3.123 8.602 540 HE ARG 66 HE ARG 66 8.415 -0.733 8.635 541 HH11 ARG 66 HH11 ARG 66 11.279 -2.587 9.522 542 HH12 ARG 66 HH12 ARG 66 12.373 -1.306 9.103 543 HH21 ARG 66 HH21 ARG 66 9.865 0.938 8.114 544 HH22 ARG 66 HH22 ARG 66 11.570 0.681 8.323 545 H LYS 67 HN LYS 67 6.882 -2.229 14.231 546 HA LYS 67 HA LYS 67 4.081 -1.525 14.291 547 HB2 LYS 67 HB2 LYS 67 6.430 -0.068 15.590 548 HB3 LYS 67 HB1 LYS 67 4.734 0.003 16.071 549 HG2 LYS 67 HG2 LYS 67 4.848 -2.393 16.744 550 HG3 LYS 67 HG1 LYS 67 6.556 -2.421 16.295 551 HD2 LYS 67 HD2 LYS 67 7.041 -0.709 18.020 552 HD3 LYS 67 HD1 LYS 67 5.333 -0.657 18.458 553 HE2 LYS 67 HE2 LYS 67 6.516 -2.017 20.081 554 HE3 LYS 67 HE1 LYS 67 5.477 -3.072 19.125 555 HZ1 LYS 67 HZ1 LYS 67 7.643 -4.057 19.445 556 HZ2 LYS 67 HZ2 LYS 67 8.403 -2.709 18.773 557 HZ3 LYS 67 HZ3 LYS 67 7.431 -3.695 17.806 558 H ASP 68 HN ASP 68 6.317 -0.838 12.028 559 HA ASP 68 HA ASP 68 5.997 2.065 11.763 560 HB2 ASP 68 HB2 ASP 68 8.252 1.066 11.610 561 HB3 ASP 68 HB1 ASP 68 7.726 0.003 10.319 562 H ILE 69 HN ILE 69 4.650 -0.849 10.499 563 HA ILE 69 HA ILE 69 3.963 0.133 7.858 564 HB ILE 69 HB ILE 69 2.768 -2.346 9.184 565 HG12 ILE 69 HG12 ILE 69 5.208 -2.546 9.375 566 HG13 ILE 69 HG11 ILE 69 4.601 -3.678 8.175 567 HG21 ILE 69 HG21 ILE 69 2.522 -3.144 6.842 568 HG22 ILE 69 HG22 ILE 69 3.215 -1.636 6.248 569 HG23 ILE 69 HG23 ILE 69 1.669 -1.622 7.097 570 HD11 ILE 69 HD11 ILE 69 6.657 -2.689 7.444 571 HD12 ILE 69 HD12 ILE 69 5.998 -1.066 7.625 572 HD13 ILE 69 HD13 ILE 69 5.345 -2.153 6.396 573 H ASN 70 HN ASN 70 2.120 1.127 7.293 574 HA ASN 70 HA ASN 70 -0.320 0.856 8.957 575 HB2 ASN 70 HB2 ASN 70 0.798 3.195 9.124 576 HB3 ASN 70 HB1 ASN 70 0.406 3.393 7.417 577 HD21 ASN 70 HD21 ASN 70 -0.934 3.076 10.656 578 HD22 ASN 70 HD22 ASN 70 -2.502 3.691 10.276 579 H ALA 71 HN ALA 71 -2.321 1.238 7.576 580 HA ALA 71 HA ALA 71 -2.289 -0.276 5.180 581 HB1 ALA 71 HB1 ALA 71 -4.458 1.599 6.206 582 HB2 ALA 71 HB2 ALA 71 -4.293 -0.107 6.619 583 HB3 ALA 71 HB3 ALA 71 -4.666 0.360 4.960 584 H THR 72 HN THR 72 -1.785 3.082 5.831 585 HA THR 72 HA THR 72 -2.075 4.006 3.092 586 HB THR 72 HB THR 72 -1.180 6.173 4.016 587 HG1 THR 72 HG1 THR 72 -1.393 5.252 6.636 588 HG21 THR 72 HG21 THR 72 -3.111 6.685 5.468 589 HG22 THR 72 HG22 THR 72 -3.459 4.962 5.629 590 HG23 THR 72 HG23 THR 72 -3.612 5.751 4.056 591 H SER 73 HN SER 73 0.059 1.913 4.098 592 HA SER 73 HA SER 73 2.290 3.014 2.506 593 HB2 SER 73 HB2 SER 73 2.224 0.476 4.212 594 HB3 SER 73 HB1 SER 73 3.644 1.189 3.440 595 HG SER 73 HG SER 73 2.604 3.097 4.908 596 H ARG 74 HN ARG 74 2.777 2.052 0.543 597 HA ARG 74 HA ARG 74 1.189 -0.253 -0.397 598 HB2 ARG 74 HB2 ARG 74 2.767 1.846 -1.974 599 HB3 ARG 74 HB1 ARG 74 1.923 0.468 -2.698 600 HG2 ARG 74 HG2 ARG 74 -0.209 1.344 -2.150 601 HG3 ARG 74 HG1 ARG 74 0.466 2.511 -1.014 602 HD2 ARG 74 HD2 ARG 74 -0.245 3.642 -3.038 603 HD3 ARG 74 HD1 ARG 74 1.509 3.735 -2.867 604 HE ARG 74 HE ARG 74 0.558 1.583 -4.553 605 HH11 ARG 74 HH11 ARG 74 1.655 4.926 -4.469 606 HH12 ARG 74 HH12 ARG 74 1.958 4.993 -6.172 607 HH21 ARG 74 HH21 ARG 74 0.957 1.713 -6.791 608 HH22 ARG 74 HH22 ARG 74 1.549 3.188 -7.473 609 H ILE 75 HN ILE 75 2.271 -2.109 -0.907 610 HA ILE 75 HA ILE 75 5.034 -2.283 0.064 611 HB ILE 75 HB ILE 75 3.065 -4.530 -0.534 612 HG12 ILE 75 HG12 ILE 75 2.142 -3.115 1.264 613 HG13 ILE 75 HG11 ILE 75 2.676 -4.655 1.924 614 HG21 ILE 75 HG21 ILE 75 5.688 -4.527 0.991 615 HG22 ILE 75 HG22 ILE 75 5.374 -5.287 -0.571 616 HG23 ILE 75 HG23 ILE 75 4.576 -5.897 0.879 617 HD11 ILE 75 HD11 ILE 75 3.221 -2.831 3.404 618 HD12 ILE 75 HD12 ILE 75 4.135 -2.021 2.135 619 HD13 ILE 75 HD13 ILE 75 4.703 -3.564 2.786 620 H LYS 76 HN LYS 76 6.216 -1.562 -1.718 621 HA LYS 76 HA LYS 76 5.858 -2.793 -4.351 622 HB2 LYS 76 HB2 LYS 76 6.345 -0.362 -4.217 623 HB3 LYS 76 HB1 LYS 76 7.889 -0.699 -3.435 624 HG2 LYS 76 HG2 LYS 76 8.653 -1.884 -5.463 625 HG3 LYS 76 HG1 LYS 76 7.103 -1.569 -6.242 626 HD2 LYS 76 HD2 LYS 76 8.797 0.005 -7.038 627 HD3 LYS 76 HD1 LYS 76 7.539 0.854 -6.140 628 HE2 LYS 76 HE2 LYS 76 9.744 1.744 -5.576 629 HE3 LYS 76 HE1 LYS 76 9.036 0.961 -4.167 630 HZ1 LYS 76 HZ1 LYS 76 11.395 0.451 -4.499 631 HZ2 LYS 76 HZ2 LYS 76 11.022 -0.299 -5.966 632 HZ3 LYS 76 HZ3 LYS 76 10.424 -0.929 -4.518 633 H VAL 77 HN VAL 77 6.727 -4.751 -4.638 634 HA VAL 77 HA VAL 77 8.626 -5.822 -2.730 635 HB VAL 77 HB VAL 77 7.250 -7.131 -5.115 636 HG11 VAL 77 HG11 VAL 77 7.866 -9.297 -4.075 637 HG12 VAL 77 HG12 VAL 77 8.821 -8.444 -2.857 638 HG13 VAL 77 HG13 VAL 77 9.287 -8.370 -4.560 639 HG21 VAL 77 HG21 VAL 77 5.693 -8.062 -3.487 640 HG22 VAL 77 HG22 VAL 77 5.708 -6.305 -3.337 641 HG23 VAL 77 HG23 VAL 77 6.565 -7.304 -2.160 642 H SER 78 HN SER 78 10.727 -6.175 -3.021 643 HA SER 78 HA SER 78 12.054 -5.059 -5.368 644 HB2 SER 78 HB2 SER 78 13.207 -6.039 -2.723 645 HB3 SER 78 HB1 SER 78 14.071 -5.095 -3.945 646 HG SER 78 HG SER 78 12.419 -3.454 -3.611 647 H THR 79 HN THR 79 11.283 -8.198 -4.249 648 HA THR 79 HA THR 79 13.250 -9.488 -6.058 649 HB THR 79 HB THR 79 13.633 -11.275 -4.290 650 HG1 THR 79 HG1 THR 79 11.868 -10.890 -2.988 651 HG21 THR 79 HG21 THR 79 15.356 -9.526 -4.599 652 HG22 THR 79 HG22 THR 79 15.229 -10.003 -2.901 653 HG23 THR 79 HG23 THR 79 14.506 -8.488 -3.448 654 H GLY 80 HN GLY 80 12.703 -12.024 -5.981 655 HA2 GLY 80 HA2 GLY 80 11.269 -13.767 -6.308 656 HA3 GLY 80 HA1 GLY 80 10.061 -12.876 -5.400 657 HA PRO 81 HA PRO 81 8.471 -13.197 -9.746 658 HB2 PRO 81 HB2 PRO 81 5.909 -13.832 -9.196 659 HB3 PRO 81 HB1 PRO 81 7.207 -15.020 -8.992 660 HG2 PRO 81 HG2 PRO 81 5.884 -13.287 -6.902 661 HG3 PRO 81 HG1 PRO 81 6.226 -15.029 -6.840 662 HD2 PRO 81 HD2 PRO 81 7.845 -13.132 -5.670 663 HD3 PRO 81 HD1 PRO 81 8.460 -14.693 -6.262 664 H LEU 82 HN LEU 82 7.720 -11.049 -7.174 665 HA LEU 82 HA LEU 82 6.051 -9.296 -8.890 666 HB2 LEU 82 HB2 LEU 82 6.204 -9.362 -5.849 667 HB3 LEU 82 HB1 LEU 82 5.129 -8.365 -6.817 668 HG LEU 82 HG LEU 82 5.015 -11.399 -6.561 669 HD11 LEU 82 HD11 LEU 82 2.895 -11.027 -5.394 670 HD12 LEU 82 HD12 LEU 82 3.118 -9.279 -5.511 671 HD13 LEU 82 HD13 LEU 82 4.241 -10.252 -4.559 672 HD21 LEU 82 HD21 LEU 82 2.934 -11.291 -7.891 673 HD22 LEU 82 HD22 LEU 82 4.330 -10.750 -8.817 674 HD23 LEU 82 HD23 LEU 82 3.194 -9.567 -8.166 675 H ALA 83 HN ALA 83 9.064 -9.531 -8.676 676 HA ALA 83 HA ALA 83 10.143 -7.267 -7.338 677 HB1 ALA 83 HB1 ALA 83 12.180 -7.713 -8.658 678 HB2 ALA 83 HB2 ALA 83 11.279 -8.841 -9.680 679 HB3 ALA 83 HB3 ALA 83 11.517 -9.195 -7.966 680 H GLY 84 HN GLY 84 9.480 -5.266 -7.810 681 HA2 GLY 84 HA2 GLY 84 9.816 -3.342 -9.265 682 HA3 GLY 84 HA1 GLY 84 9.276 -4.323 -10.624 683 H ARG 85 HN ARG 85 7.124 -5.556 -8.877 684 HA ARG 85 HA ARG 85 5.037 -3.720 -9.629 685 HB2 ARG 85 HB2 ARG 85 5.101 -6.460 -8.355 686 HB3 ARG 85 HB1 ARG 85 3.617 -5.527 -8.219 687 HG2 ARG 85 HG2 ARG 85 3.430 -5.413 -10.664 688 HG3 ARG 85 HG1 ARG 85 4.957 -6.291 -10.840 689 HD2 ARG 85 HD2 ARG 85 3.995 -8.270 -9.801 690 HD3 ARG 85 HD1 ARG 85 2.498 -7.408 -9.432 691 HE ARG 85 HE ARG 85 2.217 -7.217 -11.923 692 HH11 ARG 85 HH11 ARG 85 4.141 -9.875 -10.651 693 HH12 ARG 85 HH12 ARG 85 3.673 -10.978 -11.903 694 HH21 ARG 85 HH21 ARG 85 1.593 -8.662 -13.548 695 HH22 ARG 85 HH22 ARG 85 2.190 -10.288 -13.542 696 H VAL 86 HN VAL 86 3.810 -2.423 -8.375 697 HA VAL 86 HA VAL 86 4.588 -2.036 -5.556 698 HB VAL 86 HB VAL 86 5.007 -0.052 -6.893 699 HG11 VAL 86 HG11 VAL 86 3.257 1.233 -8.073 700 HG12 VAL 86 HG12 VAL 86 2.084 -0.035 -7.709 701 HG13 VAL 86 HG13 VAL 86 3.456 -0.384 -8.760 702 HG21 VAL 86 HG21 VAL 86 3.752 1.621 -5.573 703 HG22 VAL 86 HG22 VAL 86 4.289 0.277 -4.565 704 HG23 VAL 86 HG23 VAL 86 2.603 0.374 -5.075 705 H LEU 87 HN LEU 87 3.404 -3.587 -4.709 706 HA LEU 87 HA LEU 87 0.612 -4.056 -5.107 707 HB2 LEU 87 HB2 LEU 87 2.448 -4.936 -2.831 708 HB3 LEU 87 HB1 LEU 87 0.800 -5.488 -3.029 709 HG LEU 87 HG LEU 87 2.356 -7.222 -3.729 710 HD11 LEU 87 HD11 LEU 87 1.514 -7.736 -5.941 711 HD12 LEU 87 HD12 LEU 87 0.951 -6.073 -6.140 712 HD13 LEU 87 HD13 LEU 87 0.241 -7.108 -4.899 713 HD21 LEU 87 HD21 LEU 87 3.904 -7.035 -5.570 714 HD22 LEU 87 HD22 LEU 87 4.275 -5.806 -4.362 715 HD23 LEU 87 HD23 LEU 87 3.441 -5.350 -5.848 716 H ASN 88 HN ASN 88 -1.082 -3.579 -3.625 717 HA ASN 88 HA ASN 88 -0.690 -1.177 -1.914 718 HB2 ASN 88 HB2 ASN 88 -3.096 -1.822 -3.705 719 HB3 ASN 88 HB1 ASN 88 -2.931 -0.411 -2.662 720 HD21 ASN 88 HD21 ASN 88 -1.555 -2.017 -5.483 721 HD22 ASN 88 HD22 ASN 88 -0.957 -0.592 -6.244 722 H ILE 89 HN ILE 89 -1.888 -1.209 0.058 723 HA ILE 89 HA ILE 89 -2.433 -3.920 0.994 724 HB ILE 89 HB ILE 89 -2.398 -1.277 2.537 725 HG12 ILE 89 HG12 ILE 89 -0.355 -3.540 2.423 726 HG13 ILE 89 HG11 ILE 89 -0.169 -1.944 1.703 727 HG21 ILE 89 HG21 ILE 89 -2.444 -2.632 4.611 728 HG22 ILE 89 HG22 ILE 89 -2.636 -4.103 3.655 729 HG23 ILE 89 HG23 ILE 89 -3.905 -2.877 3.656 730 HD11 ILE 89 HD11 ILE 89 1.121 -2.133 3.740 731 HD12 ILE 89 HD12 ILE 89 -0.322 -2.552 4.662 732 HD13 ILE 89 HD13 ILE 89 -0.159 -0.940 3.950 733 H ILE 90 HN ILE 90 -4.337 -4.521 0.082 734 HA ILE 90 HA ILE 90 -6.709 -2.852 0.079 735 HB ILE 90 HB ILE 90 -7.846 -4.860 -0.949 736 HG12 ILE 90 HG12 ILE 90 -5.085 -6.150 -1.127 737 HG13 ILE 90 HG11 ILE 90 -6.232 -6.585 0.127 738 HG21 ILE 90 HG21 ILE 90 -5.305 -3.932 -2.329 739 HG22 ILE 90 HG22 ILE 90 -6.871 -3.116 -2.356 740 HG23 ILE 90 HG23 ILE 90 -6.689 -4.692 -3.129 741 HD11 ILE 90 HD11 ILE 90 -6.252 -8.170 -1.701 742 HD12 ILE 90 HD12 ILE 90 -6.673 -6.894 -2.838 743 HD13 ILE 90 HD13 ILE 90 -7.811 -7.356 -1.569 744 H GLY 91 HN GLY 91 -6.412 -2.662 2.478 745 HA2 GLY 91 HA2 GLY 91 -8.373 -3.569 4.050 746 HA3 GLY 91 HA1 GLY 91 -7.201 -4.879 4.181 747 H GLN 92 HN GLN 92 -5.827 -4.692 5.822 748 HA GLN 92 HA GLN 92 -4.500 -2.259 6.547 749 HB2 GLN 92 HB2 GLN 92 -5.393 -2.201 8.912 750 HB3 GLN 92 HB1 GLN 92 -6.572 -1.746 7.688 751 HG2 GLN 92 HG2 GLN 92 -7.538 -4.055 7.825 752 HG3 GLN 92 HG1 GLN 92 -6.408 -4.405 9.134 753 HE21 GLN 92 HE21 GLN 92 -9.240 -2.580 8.193 754 HE22 GLN 92 HE22 GLN 92 -9.748 -2.148 9.789 755 HA PRO 93 HA PRO 93 -1.460 -5.342 7.606 756 HB2 PRO 93 HB2 PRO 93 0.052 -3.981 9.493 757 HB3 PRO 93 HB1 PRO 93 0.156 -3.675 7.753 758 HG2 PRO 93 HG2 PRO 93 -1.424 -2.198 9.852 759 HG3 PRO 93 HG1 PRO 93 -0.400 -1.535 8.554 760 HD2 PRO 93 HD2 PRO 93 -3.069 -1.611 8.288 761 HD3 PRO 93 HD1 PRO 93 -2.023 -1.967 6.895 762 H LEU 94 HN LEU 94 -1.952 -7.098 8.754 763 HA LEU 94 HA LEU 94 -3.541 -6.886 11.220 764 HB2 LEU 94 HB2 LEU 94 -4.375 -8.147 9.177 765 HB3 LEU 94 HB1 LEU 94 -3.084 -9.305 9.407 766 HG LEU 94 HG LEU 94 -5.412 -10.004 10.179 767 HD11 LEU 94 HD11 LEU 94 -3.420 -11.220 10.912 768 HD12 LEU 94 HD12 LEU 94 -4.686 -11.215 12.136 769 HD13 LEU 94 HD13 LEU 94 -3.278 -10.161 12.315 770 HD21 LEU 94 HD21 LEU 94 -6.223 -9.209 12.342 771 HD22 LEU 94 HD22 LEU 94 -6.112 -7.891 11.181 772 HD23 LEU 94 HD23 LEU 94 -4.888 -8.059 12.444 773 HA PRO 95 HA PRO 95 0.271 -8.466 13.341 774 HB2 PRO 95 HB2 PRO 95 -0.426 -7.653 15.845 775 HB3 PRO 95 HB1 PRO 95 0.246 -6.532 14.654 776 HG2 PRO 95 HG2 PRO 95 -2.642 -6.950 15.432 777 HG3 PRO 95 HG1 PRO 95 -1.755 -5.427 15.204 778 HD2 PRO 95 HD2 PRO 95 -3.375 -6.497 13.264 779 HD3 PRO 95 HD1 PRO 95 -1.938 -5.516 12.883 780 H ASP 96 HN ASP 96 0.411 -10.573 14.195 781 HA ASP 96 HA ASP 96 -2.045 -12.102 14.289 782 HB2 ASP 96 HB2 ASP 96 -0.722 -14.057 14.406 783 HB3 ASP 96 HB1 ASP 96 0.235 -12.956 13.424 784 H ALA 97 HN ALA 97 -2.142 -13.813 16.233 785 HA ALA 97 HA ALA 97 -3.053 -12.261 18.455 786 HB1 ALA 97 HB1 ALA 97 -3.880 -14.384 19.358 787 HB2 ALA 97 HB2 ALA 97 -2.937 -15.278 18.160 788 HB3 ALA 97 HB3 ALA 97 -4.264 -14.238 17.639 789 H ALA 98 HN ALA 98 -0.102 -14.039 17.876 790 HA ALA 98 HA ALA 98 0.708 -13.896 20.715 791 HB1 ALA 98 HB1 ALA 98 1.224 -15.962 19.459 792 HB2 ALA 98 HB2 ALA 98 2.693 -15.158 20.006 793 HB3 ALA 98 HB3 ALA 98 2.201 -15.040 18.314 794 H ARG 99 HN ARG 99 0.879 -11.975 17.889 795 HA ARG 99 HA ARG 99 1.973 -10.115 17.233 796 HB2 ARG 99 HB2 ARG 99 2.577 -9.876 20.204 797 HB3 ARG 99 HB1 ARG 99 3.081 -8.661 19.039 798 HG2 ARG 99 HG2 ARG 99 1.091 -7.836 20.030 799 HG3 ARG 99 HG1 ARG 99 0.650 -8.360 18.408 800 HD2 ARG 99 HD2 ARG 99 -0.437 -10.334 19.274 801 HD3 ARG 99 HD1 ARG 99 0.202 -10.041 20.895 802 HE ARG 99 HE ARG 99 -1.365 -7.831 20.038 803 HH11 ARG 99 HH11 ARG 99 -1.815 -11.149 21.104 804 HH12 ARG 99 HH12 ARG 99 -3.328 -10.812 21.875 805 HH21 ARG 99 HH21 ARG 99 -3.349 -7.419 21.078 806 HH22 ARG 99 HH22 ARG 99 -4.185 -8.721 21.866 807 H THR 100 HN THR 100 3.285 -12.661 17.113 808 HA THR 100 HA THR 100 6.142 -12.173 17.421 809 HB THR 100 HB THR 100 5.262 -14.428 17.908 810 HG1 THR 100 HG1 THR 100 7.369 -13.893 16.533 811 HG21 THR 100 HG21 THR 100 4.464 -15.929 16.134 812 HG22 THR 100 HG22 THR 100 4.548 -14.612 14.963 813 HG23 THR 100 HG23 THR 100 3.393 -14.531 16.294 814 H ARG 101 HN ARG 101 3.757 -11.562 15.098 815 HA ARG 101 HA ARG 101 5.660 -10.915 12.994 816 HB2 ARG 101 HB2 ARG 101 4.701 -12.334 11.279 817 HB3 ARG 101 HB1 ARG 101 5.089 -13.380 12.646 818 HG2 ARG 101 HG2 ARG 101 2.712 -13.327 13.347 819 HG3 ARG 101 HG1 ARG 101 2.335 -12.290 11.972 820 HD2 ARG 101 HD2 ARG 101 1.669 -14.537 11.464 821 HD3 ARG 101 HD1 ARG 101 3.061 -14.121 10.460 822 HE ARG 101 HE ARG 101 4.362 -15.665 11.601 823 HH11 ARG 101 HH11 ARG 101 1.231 -15.424 13.233 824 HH12 ARG 101 HH12 ARG 101 1.485 -16.858 14.172 825 HH21 ARG 101 HH21 ARG 101 4.677 -17.518 12.872 826 HH22 ARG 101 HH22 ARG 101 3.444 -18.044 13.972 827 H LEU 102 HN LEU 102 4.605 -9.845 11.193 828 HA LEU 102 HA LEU 102 1.935 -8.695 11.702 829 HB2 LEU 102 HB2 LEU 102 4.378 -7.278 11.469 830 HB3 LEU 102 HB1 LEU 102 3.709 -7.159 9.863 831 HG LEU 102 HG LEU 102 3.054 -5.184 10.980 832 HD11 LEU 102 HD11 LEU 102 1.252 -6.172 9.671 833 HD12 LEU 102 HD12 LEU 102 0.633 -5.244 11.030 834 HD13 LEU 102 HD13 LEU 102 0.648 -7.007 11.104 835 HD21 LEU 102 HD21 LEU 102 1.961 -5.099 13.174 836 HD22 LEU 102 HD22 LEU 102 3.548 -5.854 13.271 837 HD23 LEU 102 HD23 LEU 102 2.097 -6.855 13.322 838 H GLU 103 HN GLU 103 0.635 -9.888 10.408 839 HA GLU 103 HA GLU 103 1.465 -10.847 7.779 840 HB2 GLU 103 HB2 GLU 103 0.095 -12.331 9.253 841 HB3 GLU 103 HB1 GLU 103 -1.219 -11.161 9.200 842 HG2 GLU 103 HG2 GLU 103 -1.452 -11.498 6.779 843 HG3 GLU 103 HG1 GLU 103 -0.105 -12.631 6.788 844 H ILE 104 HN ILE 104 1.608 -9.188 6.395 845 HA ILE 104 HA ILE 104 -0.399 -7.102 6.122 846 HB ILE 104 HB ILE 104 1.882 -7.698 4.166 847 HG12 ILE 104 HG12 ILE 104 2.949 -7.593 6.384 848 HG13 ILE 104 HG11 ILE 104 3.362 -6.156 5.453 849 HG21 ILE 104 HG21 ILE 104 0.221 -6.055 3.404 850 HG22 ILE 104 HG22 ILE 104 1.783 -5.280 3.671 851 HG23 ILE 104 HG23 ILE 104 0.485 -5.084 4.852 852 HD11 ILE 104 HD11 ILE 104 1.342 -6.332 7.684 853 HD12 ILE 104 HD12 ILE 104 1.686 -4.886 6.730 854 HD13 ILE 104 HD13 ILE 104 2.942 -5.589 7.745 855 H LEU 105 HN LEU 105 -1.912 -7.001 4.424 856 HA LEU 105 HA LEU 105 -1.891 -9.131 2.366 857 HB2 LEU 105 HB2 LEU 105 -4.299 -9.119 2.222 858 HB3 LEU 105 HB1 LEU 105 -3.847 -9.456 3.881 859 HG LEU 105 HG LEU 105 -4.796 -6.721 2.923 860 HD11 LEU 105 HD11 LEU 105 -6.457 -8.865 4.279 861 HD12 LEU 105 HD12 LEU 105 -6.576 -8.369 2.589 862 HD13 LEU 105 HD13 LEU 105 -6.979 -7.229 3.866 863 HD21 LEU 105 HD21 LEU 105 -4.522 -7.821 5.744 864 HD22 LEU 105 HD22 LEU 105 -5.168 -6.236 5.303 865 HD23 LEU 105 HD23 LEU 105 -3.477 -6.617 4.985 866 H CYS 106 HN CYS 106 -2.407 -8.454 0.301 867 HA CYS 106 HA CYS 106 -2.478 -5.615 -0.369 868 HB2 CYS 106 HB2 CYS 106 -0.005 -7.296 -0.968 869 HB3 CYS 106 HB1 CYS 106 -0.310 -5.690 -1.629 870 HG CYS 106 HG CYS 106 -0.617 -5.092 1.431 871 H ARG 107 HN ARG 107 -2.311 -5.348 -2.843 872 HA ARG 107 HA ARG 107 -2.393 -7.723 -4.482 873 HB2 ARG 107 HB2 ARG 107 -4.825 -7.404 -3.776 874 HB3 ARG 107 HB1 ARG 107 -4.805 -5.841 -4.590 875 HG2 ARG 107 HG2 ARG 107 -4.267 -7.021 -6.735 876 HG3 ARG 107 HG1 ARG 107 -4.427 -8.563 -5.890 877 HD2 ARG 107 HD2 ARG 107 -6.608 -6.486 -6.220 878 HD3 ARG 107 HD1 ARG 107 -6.454 -7.974 -7.158 879 HE ARG 107 HE ARG 107 -6.566 -8.698 -4.471 880 HH11 ARG 107 HH11 ARG 107 -8.667 -7.215 -6.882 881 HH12 ARG 107 HH12 ARG 107 -10.129 -7.698 -6.074 882 HH21 ARG 107 HH21 ARG 107 -8.491 -9.305 -3.427 883 HH22 ARG 107 HH22 ARG 107 -10.026 -8.867 -4.111 884 H GLU 108 HN GLU 108 -2.138 -7.220 -6.722 885 HA GLU 108 HA GLU 108 -0.389 -5.164 -7.397 886 HB2 GLU 108 HB2 GLU 108 -2.249 -6.772 -9.202 887 HB3 GLU 108 HB1 GLU 108 -0.883 -5.815 -9.765 888 HG2 GLU 108 HG2 GLU 108 0.692 -7.262 -8.625 889 HG3 GLU 108 HG1 GLU 108 -0.621 -8.144 -7.844 890 H GLY 109 HN GLY 109 -0.598 -3.178 -8.371 891 HA2 GLY 109 HA2 GLY 109 -3.207 -1.857 -8.397 892 HA3 GLY 109 HA1 GLY 109 -1.637 -1.110 -8.647 893 H ALA 110 HN ALA 110 -2.838 -3.955 -10.297 894 HA ALA 110 HA ALA 110 -3.662 -2.767 -12.742 895 HB1 ALA 110 HB1 ALA 110 -1.244 -2.350 -13.001 896 HB2 ALA 110 HB2 ALA 110 -1.797 -3.544 -14.177 897 HB3 ALA 110 HB3 ALA 110 -0.899 -4.060 -12.742 898 H GLU 111 HN GLU 111 -5.396 -4.142 -12.444 899 HA GLU 111 HA GLU 111 -4.995 -7.074 -12.539 900 HB2 GLU 111 HB2 GLU 111 -7.450 -5.403 -11.828 901 HB3 GLU 111 HB1 GLU 111 -7.403 -7.167 -11.859 902 HG2 GLU 111 HG2 GLU 111 -5.741 -7.170 -10.044 903 HG3 GLU 111 HG1 GLU 111 -5.751 -5.404 -10.019 904 H LYS 112 HN LYS 112 -5.342 -4.624 -14.663 905 HA LYS 112 HA LYS 112 -6.931 -6.168 -16.608 906 HB2 LYS 112 HB2 LYS 112 -7.674 -3.682 -17.387 907 HB3 LYS 112 HB1 LYS 112 -8.594 -4.639 -16.250 908 HG2 LYS 112 HG2 LYS 112 -8.458 -2.342 -15.474 909 HG3 LYS 112 HG1 LYS 112 -7.608 -3.409 -14.360 910 HD2 LYS 112 HD2 LYS 112 -6.358 -1.340 -14.649 911 HD3 LYS 112 HD1 LYS 112 -5.448 -2.687 -15.333 912 HE2 LYS 112 HE2 LYS 112 -6.281 -2.002 -17.611 913 HE3 LYS 112 HE1 LYS 112 -7.032 -0.589 -16.857 914 HZ1 LYS 112 HZ1 LYS 112 -4.876 0.153 -16.132 915 HZ2 LYS 112 HZ2 LYS 112 -4.854 -0.104 -17.800 916 HZ3 LYS 112 HZ3 LYS 112 -4.136 -1.228 -16.765 Start of MODEL 16 1 H1 MET 1 HT1 MET 1 11.500 -28.375 5.258 2 H2 MET 1 HT2 MET 1 11.899 -26.736 5.196 3 H3 MET 1 HT3 MET 1 11.116 -27.457 3.892 4 HA MET 1 HA MET 1 9.171 -27.856 5.224 5 HB2 MET 1 HB2 MET 1 10.675 -26.259 7.349 6 HB3 MET 1 HB1 MET 1 9.009 -26.820 7.466 7 HG2 MET 1 HG2 MET 1 11.500 -28.538 7.389 8 HG3 MET 1 HG1 MET 1 10.419 -28.275 8.764 9 HE1 MET 1 HE1 MET 1 9.831 -32.064 7.685 10 HE2 MET 1 HE2 MET 1 10.177 -31.017 9.060 11 HE3 MET 1 HE3 MET 1 11.332 -31.136 7.730 12 H ASN 2 HN ASN 2 7.683 -26.519 4.304 13 HA ASN 2 HA ASN 2 8.410 -23.827 3.449 14 HB2 ASN 2 HB2 ASN 2 7.088 -25.286 1.913 15 HB3 ASN 2 HB1 ASN 2 5.775 -25.334 3.088 16 HD21 ASN 2 HD21 ASN 2 4.277 -24.346 1.741 17 HD22 ASN 2 HD22 ASN 2 4.387 -22.704 1.215 18 H ILE 3 HN ILE 3 8.740 -23.148 5.642 19 HA ILE 3 HA ILE 3 6.334 -22.449 7.199 20 HB ILE 3 HB ILE 3 8.014 -21.637 8.920 21 HG12 ILE 3 HG12 ILE 3 10.061 -22.898 7.027 22 HG13 ILE 3 HG11 ILE 3 9.927 -21.186 7.411 23 HG21 ILE 3 HG21 ILE 3 8.310 -24.558 8.106 24 HG22 ILE 3 HG22 ILE 3 7.012 -23.884 9.093 25 HG23 ILE 3 HG23 ILE 3 8.665 -23.887 9.703 26 HD11 ILE 3 HD11 ILE 3 11.778 -22.225 8.573 27 HD12 ILE 3 HD12 ILE 3 10.679 -23.370 9.340 28 HD13 ILE 3 HD13 ILE 3 10.566 -21.650 9.714 29 H GLY 4 HN GLY 4 6.160 -20.146 7.922 30 HA2 GLY 4 HA2 GLY 4 6.358 -18.422 5.578 31 HA3 GLY 4 HA1 GLY 4 5.448 -18.121 7.048 32 H ARG 5 HN ARG 5 8.793 -18.999 7.306 33 HA ARG 5 HA ARG 5 9.620 -16.724 8.706 34 HB2 ARG 5 HB2 ARG 5 11.926 -17.591 8.376 35 HB3 ARG 5 HB1 ARG 5 10.815 -18.861 8.876 36 HG2 ARG 5 HG2 ARG 5 10.742 -19.801 6.657 37 HG3 ARG 5 HG1 ARG 5 11.602 -18.418 5.974 38 HD2 ARG 5 HD2 ARG 5 12.786 -20.341 8.005 39 HD3 ARG 5 HD1 ARG 5 13.013 -20.461 6.258 40 HE ARG 5 HE ARG 5 14.047 -18.207 6.381 41 HH11 ARG 5 HH11 ARG 5 14.118 -20.225 9.245 42 HH12 ARG 5 HH12 ARG 5 15.523 -19.450 9.901 43 HH21 ARG 5 HH21 ARG 5 15.840 -17.162 7.253 44 HH22 ARG 5 HH22 ARG 5 16.506 -17.701 8.765 45 H LEU 6 HN LEU 6 10.942 -14.981 8.079 46 HA LEU 6 HA LEU 6 9.988 -13.773 5.677 47 HB2 LEU 6 HB2 LEU 6 12.010 -12.673 7.667 48 HB3 LEU 6 HB1 LEU 6 11.151 -11.760 6.446 49 HG LEU 6 HG LEU 6 9.971 -11.183 8.351 50 HD11 LEU 6 HD11 LEU 6 8.371 -12.001 6.694 51 HD12 LEU 6 HD12 LEU 6 7.775 -12.214 8.336 52 HD13 LEU 6 HD13 LEU 6 8.395 -13.604 7.437 53 HD21 LEU 6 HD21 LEU 6 9.384 -12.628 10.222 54 HD22 LEU 6 HD22 LEU 6 11.122 -12.631 9.936 55 HD23 LEU 6 HD23 LEU 6 10.144 -14.011 9.425 56 H ARG 7 HN ARG 7 10.792 -14.570 3.861 57 HA ARG 7 HA ARG 7 13.652 -15.264 3.566 58 HB2 ARG 7 HB2 ARG 7 12.804 -16.508 1.488 59 HB3 ARG 7 HB1 ARG 7 12.273 -17.129 3.043 60 HG2 ARG 7 HG2 ARG 7 10.061 -16.421 2.748 61 HG3 ARG 7 HG1 ARG 7 10.493 -15.201 1.552 62 HD2 ARG 7 HD2 ARG 7 10.799 -18.160 0.980 63 HD3 ARG 7 HD1 ARG 7 9.280 -17.302 0.709 64 HE ARG 7 HE ARG 7 11.098 -15.758 -0.568 65 HH11 ARG 7 HH11 ARG 7 10.430 -19.195 -0.857 66 HH12 ARG 7 HH12 ARG 7 10.754 -19.221 -2.559 67 HH21 ARG 7 HH21 ARG 7 11.463 -15.791 -2.757 68 HH22 ARG 7 HH22 ARG 7 11.346 -17.280 -3.643 69 H ASP 8 HN ASP 8 11.182 -13.187 2.181 70 HA ASP 8 HA ASP 8 12.852 -12.312 -0.067 71 HB2 ASP 8 HB2 ASP 8 9.896 -11.812 0.537 72 HB3 ASP 8 HB1 ASP 8 10.741 -11.295 -0.916 73 H ARG 9 HN ARG 9 11.936 -9.763 -0.424 74 HA ARG 9 HA ARG 9 11.738 -8.290 2.082 75 HB2 ARG 9 HB2 ARG 9 14.016 -7.821 0.120 76 HB3 ARG 9 HB1 ARG 9 13.443 -6.546 1.192 77 HG2 ARG 9 HG2 ARG 9 13.984 -7.995 3.150 78 HG3 ARG 9 HG1 ARG 9 14.655 -9.195 2.042 79 HD2 ARG 9 HD2 ARG 9 15.641 -6.343 2.394 80 HD3 ARG 9 HD1 ARG 9 16.413 -7.792 3.039 81 HE ARG 9 HE ARG 9 16.624 -8.500 0.619 82 HH11 ARG 9 HH11 ARG 9 16.693 -5.113 1.544 83 HH12 ARG 9 HH12 ARG 9 17.604 -4.634 0.151 84 HH21 ARG 9 HH21 ARG 9 17.840 -7.859 -1.170 85 HH22 ARG 9 HH22 ARG 9 18.251 -6.190 -1.391 86 H ILE 10 HN ILE 10 10.697 -6.331 1.891 87 HA ILE 10 HA ILE 10 9.827 -5.417 -0.794 88 HB ILE 10 HB ILE 10 7.613 -4.921 -0.121 89 HG12 ILE 10 HG12 ILE 10 8.021 -3.913 2.110 90 HG13 ILE 10 HG11 ILE 10 6.679 -5.040 2.169 91 HG21 ILE 10 HG21 ILE 10 6.644 -7.044 0.684 92 HG22 ILE 10 HG22 ILE 10 8.257 -7.602 1.132 93 HG23 ILE 10 HG23 ILE 10 7.869 -7.288 -0.560 94 HD11 ILE 10 HD11 ILE 10 8.067 -6.663 3.279 95 HD12 ILE 10 HD12 ILE 10 8.096 -5.130 4.137 96 HD13 ILE 10 HD13 ILE 10 9.470 -5.606 3.142 97 H THR 11 HN THR 11 9.676 -3.170 -1.011 98 HA THR 11 HA THR 11 10.759 -1.542 1.177 99 HB THR 11 HB THR 11 10.247 -0.586 -1.669 100 HG1 THR 11 HG1 THR 11 11.990 -1.619 -2.303 101 HG21 THR 11 HG21 THR 11 12.181 0.303 0.507 102 HG22 THR 11 HG22 THR 11 10.684 1.141 0.064 103 HG23 THR 11 HG23 THR 11 12.016 1.035 -1.092 104 H ILE 12 HN ILE 12 9.387 -0.437 2.359 105 HA ILE 12 HA ILE 12 6.556 -0.305 1.884 106 HB ILE 12 HB ILE 12 8.229 1.136 4.004 107 HG12 ILE 12 HG12 ILE 12 8.512 -1.306 4.178 108 HG13 ILE 12 HG11 ILE 12 7.584 -0.700 5.541 109 HG21 ILE 12 HG21 ILE 12 6.123 1.345 5.302 110 HG22 ILE 12 HG22 ILE 12 5.224 0.645 3.953 111 HG23 ILE 12 HG23 ILE 12 6.028 2.205 3.761 112 HD11 ILE 12 HD11 ILE 12 6.480 -2.146 3.139 113 HD12 ILE 12 HD12 ILE 12 5.529 -1.524 4.492 114 HD13 ILE 12 HD13 ILE 12 6.712 -2.804 4.758 115 H GLN 13 HN GLN 13 5.683 1.102 0.469 116 HA GLN 13 HA GLN 13 6.849 3.714 -0.085 117 HB2 GLN 13 HB2 GLN 13 4.296 2.398 -1.099 118 HB3 GLN 13 HB1 GLN 13 4.763 4.053 -1.492 119 HG2 GLN 13 HG2 GLN 13 6.884 3.113 -2.496 120 HG3 GLN 13 HG1 GLN 13 6.195 1.499 -2.288 121 HE21 GLN 13 HE21 GLN 13 6.913 2.995 -4.745 122 HE22 GLN 13 HE22 GLN 13 5.481 3.023 -5.704 123 H THR 14 HN THR 14 6.747 4.854 1.674 124 HA THR 14 HA THR 14 4.352 5.229 3.297 125 HB THR 14 HB THR 14 5.917 7.111 4.324 126 HG1 THR 14 HG1 THR 14 7.408 6.536 2.333 127 HG21 THR 14 HG21 THR 14 5.371 4.989 5.487 128 HG22 THR 14 HG22 THR 14 7.052 5.458 5.755 129 HG23 THR 14 HG23 THR 14 6.667 4.171 4.607 130 H LEU 15 HN LEU 15 3.062 7.149 3.312 131 HA LEU 15 HA LEU 15 3.152 8.678 0.774 132 HB2 LEU 15 HB2 LEU 15 1.228 7.160 0.948 133 HB3 LEU 15 HB1 LEU 15 0.798 7.822 2.514 134 HG LEU 15 HG LEU 15 0.223 9.994 1.450 135 HD11 LEU 15 HD11 LEU 15 0.094 10.164 -1.023 136 HD12 LEU 15 HD12 LEU 15 0.950 8.632 -1.156 137 HD13 LEU 15 HD13 LEU 15 1.745 10.026 -0.425 138 HD21 LEU 15 HD21 LEU 15 -1.817 9.264 0.277 139 HD22 LEU 15 HD22 LEU 15 -1.546 8.317 1.739 140 HD23 LEU 15 HD23 LEU 15 -1.171 7.624 0.160 141 H LYS 16 HN LYS 16 3.937 10.676 1.215 142 HA LYS 16 HA LYS 16 3.091 12.074 3.663 143 HB2 LYS 16 HB2 LYS 16 5.510 12.029 3.203 144 HB3 LYS 16 HB1 LYS 16 5.252 12.791 1.637 145 HG2 LYS 16 HG2 LYS 16 4.552 14.854 2.667 146 HG3 LYS 16 HG1 LYS 16 4.491 14.114 4.266 147 HD2 LYS 16 HD2 LYS 16 7.097 14.246 2.709 148 HD3 LYS 16 HD1 LYS 16 6.535 15.632 3.644 149 HE2 LYS 16 HE2 LYS 16 8.125 14.330 4.964 150 HE3 LYS 16 HE1 LYS 16 6.530 14.228 5.701 151 HZ1 LYS 16 HZ1 LYS 16 7.821 12.147 4.028 152 HZ2 LYS 16 HZ2 LYS 16 6.278 12.031 4.703 153 HZ3 LYS 16 HZ3 LYS 16 7.635 12.106 5.702 154 H GLN 17 HN GLN 17 1.272 13.134 3.460 155 HA GLN 17 HA GLN 17 0.308 14.436 1.078 156 HB2 GLN 17 HB2 GLN 17 -0.571 14.802 3.991 157 HB3 GLN 17 HB1 GLN 17 -1.474 15.306 2.565 158 HG2 GLN 17 HG2 GLN 17 -1.647 12.865 1.921 159 HG3 GLN 17 HG1 GLN 17 -0.902 12.473 3.473 160 HE21 GLN 17 HE21 GLN 17 -3.783 13.651 1.895 161 HE22 GLN 17 HE22 GLN 17 -4.818 13.544 3.273 162 H THR 18 HN THR 18 1.926 15.855 0.430 163 HA THR 18 HA THR 18 3.167 17.704 2.322 164 HB THR 18 HB THR 18 3.757 17.312 -0.654 165 HG1 THR 18 HG1 THR 18 4.147 15.379 0.479 166 HG21 THR 18 HG21 THR 18 4.584 19.467 0.280 167 HG22 THR 18 HG22 THR 18 5.924 18.391 -0.128 168 HG23 THR 18 HG23 THR 18 5.432 18.590 1.557 169 H ARG 19 HN ARG 19 2.021 19.542 2.684 170 HA ARG 19 HA ARG 19 0.093 20.606 0.856 171 HB2 ARG 19 HB2 ARG 19 -0.058 20.750 3.343 172 HB3 ARG 19 HB1 ARG 19 1.281 21.885 3.352 173 HG2 ARG 19 HG2 ARG 19 -0.013 23.572 2.238 174 HG3 ARG 19 HG1 ARG 19 -1.292 22.425 1.839 175 HD2 ARG 19 HD2 ARG 19 -1.957 23.917 3.678 176 HD3 ARG 19 HD1 ARG 19 -1.899 22.231 4.195 177 HE ARG 19 HE ARG 19 0.570 23.471 4.785 178 HH11 ARG 19 HH11 ARG 19 -2.778 23.566 5.885 179 HH12 ARG 19 HH12 ARG 19 -2.354 24.037 7.498 180 HH21 ARG 19 HH21 ARG 19 1.101 24.059 6.913 181 HH22 ARG 19 HH22 ARG 19 -0.155 24.311 8.085 182 H ASP 20 HN ASP 20 0.177 22.882 0.047 183 HA ASP 20 HA ASP 20 2.855 23.502 -1.088 184 HB2 ASP 20 HB2 ASP 20 1.192 22.642 -2.759 185 HB3 ASP 20 HB1 ASP 20 0.110 23.966 -2.348 186 H ILE 21 HN ILE 21 3.169 25.836 -1.625 187 HA ILE 21 HA ILE 21 2.644 27.639 0.434 188 HB ILE 21 HB ILE 21 4.570 27.710 -1.148 189 HG12 ILE 21 HG12 ILE 21 2.997 30.334 -1.082 190 HG13 ILE 21 HG11 ILE 21 4.024 29.732 0.212 191 HG21 ILE 21 HG21 ILE 21 2.571 28.745 -3.197 192 HG22 ILE 21 HG22 ILE 21 3.400 27.186 -3.238 193 HG23 ILE 21 HG23 ILE 21 4.325 28.679 -3.417 194 HD11 ILE 21 HD11 ILE 21 4.944 30.535 -2.542 195 HD12 ILE 21 HD12 ILE 21 5.976 29.941 -1.236 196 HD13 ILE 21 HD13 ILE 21 5.121 31.475 -1.060 197 H THR 22 HN THR 22 0.383 26.630 -1.918 198 HA THR 22 HA THR 22 -1.158 29.150 -1.874 199 HB THR 22 HB THR 22 -2.396 28.266 -3.821 200 HG1 THR 22 HG1 THR 22 -0.754 26.158 -4.429 201 HG21 THR 22 HG21 THR 22 -0.337 29.544 -4.349 202 HG22 THR 22 HG22 THR 22 -0.633 28.284 -5.547 203 HG23 THR 22 HG23 THR 22 0.599 28.047 -4.309 204 H GLY 23 HN GLY 23 -0.874 25.842 -1.064 205 HA2 GLY 23 HA2 GLY 23 -1.862 24.905 0.918 206 HA3 GLY 23 HA1 GLY 23 -3.277 25.914 0.670 207 H GLU 24 HN GLU 24 -1.565 23.734 -1.612 208 HA GLU 24 HA GLU 24 -4.023 22.140 -1.933 209 HB2 GLU 24 HB2 GLU 24 -1.577 22.456 -3.741 210 HB3 GLU 24 HB1 GLU 24 -2.971 21.432 -4.089 211 HG2 GLU 24 HG2 GLU 24 -4.417 23.374 -4.262 212 HG3 GLU 24 HG1 GLU 24 -3.105 24.440 -3.752 213 H ILE 25 HN ILE 25 -3.764 19.823 -1.881 214 HA ILE 25 HA ILE 25 -1.569 18.960 -0.105 215 HB ILE 25 HB ILE 25 -4.190 17.515 -0.723 216 HG12 ILE 25 HG12 ILE 25 -4.723 19.634 0.395 217 HG13 ILE 25 HG11 ILE 25 -4.950 18.318 1.533 218 HG21 ILE 25 HG21 ILE 25 -2.139 17.024 1.476 219 HG22 ILE 25 HG22 ILE 25 -2.421 15.996 0.069 220 HG23 ILE 25 HG23 ILE 25 -3.678 16.175 1.293 221 HD11 ILE 25 HD11 ILE 25 -2.595 20.208 1.458 222 HD12 ILE 25 HD12 ILE 25 -2.819 18.882 2.604 223 HD13 ILE 25 HD13 ILE 25 -3.942 20.241 2.596 224 H LEU 26 HN LEU 26 0.112 18.347 -1.362 225 HA LEU 26 HA LEU 26 -0.226 16.715 -3.771 226 HB2 LEU 26 HB2 LEU 26 2.263 18.006 -2.556 227 HB3 LEU 26 HB1 LEU 26 2.282 16.994 -3.989 228 HG LEU 26 HG LEU 26 2.413 19.249 -4.734 229 HD11 LEU 26 HD11 LEU 26 0.968 17.825 -6.096 230 HD12 LEU 26 HD12 LEU 26 0.464 19.511 -6.161 231 HD13 LEU 26 HD13 LEU 26 -0.446 18.357 -5.182 232 HD21 LEU 26 HD21 LEU 26 0.807 21.016 -4.159 233 HD22 LEU 26 HD22 LEU 26 1.657 20.420 -2.739 234 HD23 LEU 26 HD23 LEU 26 -0.011 19.924 -3.039 235 H GLU 27 HN GLU 27 -0.869 14.785 -2.904 236 HA GLU 27 HA GLU 27 0.592 13.415 -0.825 237 HB2 GLU 27 HB2 GLU 27 -1.626 12.454 -2.687 238 HB3 GLU 27 HB1 GLU 27 -0.987 11.555 -1.311 239 HG2 GLU 27 HG2 GLU 27 -1.682 13.412 0.192 240 HG3 GLU 27 HG1 GLU 27 -2.410 14.218 -1.191 241 H THR 28 HN THR 28 2.304 12.176 -1.159 242 HA THR 28 HA THR 28 3.118 11.267 -3.842 243 HB THR 28 HB THR 28 5.512 12.237 -3.112 244 HG1 THR 28 HG1 THR 28 3.680 13.899 -1.691 245 HG21 THR 28 HG21 THR 28 5.103 14.321 -4.357 246 HG22 THR 28 HG22 THR 28 3.360 14.098 -4.190 247 HG23 THR 28 HG23 THR 28 4.305 12.964 -5.157 248 H TRP 29 HN TRP 29 4.538 9.500 -3.810 249 HA TRP 29 HA TRP 29 4.506 7.980 -1.286 250 HB2 TRP 29 HB2 TRP 29 4.565 7.021 -4.189 251 HB3 TRP 29 HB1 TRP 29 4.690 5.955 -2.789 252 HD1 TRP 29 HD1 TRP 29 2.141 8.000 -4.763 253 HE1 TRP 29 HE1 TRP 29 -0.218 7.430 -3.926 254 HE3 TRP 29 HE3 TRP 29 3.378 5.181 -0.686 255 HZ2 TRP 29 HZ2 TRP 29 -1.410 5.995 -1.818 256 HZ3 TRP 29 HZ3 TRP 29 1.569 4.236 0.692 257 HH2 TRP 29 HH2 TRP 29 -0.783 4.635 0.140 258 H GLU 30 HN GLU 30 6.337 8.317 -0.334 259 HA GLU 30 HA GLU 30 8.902 8.477 -1.741 260 HB2 GLU 30 HB2 GLU 30 9.821 8.941 0.612 261 HB3 GLU 30 HB1 GLU 30 8.747 10.152 -0.083 262 HG2 GLU 30 HG2 GLU 30 6.869 9.175 1.278 263 HG3 GLU 30 HG1 GLU 30 8.049 8.112 2.056 264 H ASP 31 HN ASP 31 10.204 6.867 -1.947 265 HA ASP 31 HA ASP 31 9.523 4.179 -1.260 266 HB2 ASP 31 HB2 ASP 31 10.727 4.951 -3.366 267 HB3 ASP 31 HB1 ASP 31 12.143 5.293 -2.379 268 H GLY 32 HN GLY 32 10.101 3.117 0.674 269 HA2 GLY 32 HA2 GLY 32 11.239 4.998 2.671 270 HA3 GLY 32 HA1 GLY 32 10.030 3.762 2.973 271 H HIS 33 HN HIS 33 10.689 1.876 3.833 272 HA HIS 33 HA HIS 33 13.600 1.274 3.885 273 HB2 HIS 33 HB2 HIS 33 12.898 1.941 6.104 274 HB3 HIS 33 HB1 HIS 33 11.498 0.881 6.052 275 HD1 HIS 33 HD1 HIS 33 11.804 -1.208 7.335 276 HD2 HIS 33 HD2 HIS 33 15.441 0.274 5.968 277 HE1 HIS 33 HE1 HIS 33 13.553 -2.778 8.230 278 HE2 HIS 33 HE2 HIS 33 15.749 -1.760 7.527 279 H THR 34 HN THR 34 14.237 -0.781 3.439 280 HA THR 34 HA THR 34 12.259 -2.617 2.319 281 HB THR 34 HB THR 34 15.287 -2.661 1.956 282 HG1 THR 34 HG1 THR 34 13.452 -1.613 0.068 283 HG21 THR 34 HG21 THR 34 14.084 -4.778 1.365 284 HG22 THR 34 HG22 THR 34 14.779 -3.995 -0.055 285 HG23 THR 34 HG23 THR 34 13.050 -3.856 0.266 286 H LEU 35 HN LEU 35 11.554 -3.883 4.072 287 HA LEU 35 HA LEU 35 13.608 -5.096 5.825 288 HB2 LEU 35 HB2 LEU 35 11.849 -5.536 7.451 289 HB3 LEU 35 HB1 LEU 35 11.945 -3.828 7.082 290 HG LEU 35 HG LEU 35 9.862 -5.529 5.691 291 HD11 LEU 35 HD11 LEU 35 8.266 -5.072 7.499 292 HD12 LEU 35 HD12 LEU 35 9.569 -4.400 8.484 293 HD13 LEU 35 HD13 LEU 35 9.590 -6.106 8.029 294 HD21 LEU 35 HD21 LEU 35 9.890 -2.619 6.557 295 HD22 LEU 35 HD22 LEU 35 8.582 -3.424 5.683 296 HD23 LEU 35 HD23 LEU 35 10.154 -3.219 4.921 297 H TRP 36 HN TRP 36 13.227 -7.218 6.602 298 HA TRP 36 HA TRP 36 12.918 -9.214 4.684 299 HB2 TRP 36 HB2 TRP 36 12.573 -9.623 7.679 300 HB3 TRP 36 HB1 TRP 36 13.107 -10.809 6.496 301 HD1 TRP 36 HD1 TRP 36 14.478 -8.555 9.049 302 HE1 TRP 36 HE1 TRP 36 17.010 -8.234 8.747 303 HE3 TRP 36 HE3 TRP 36 14.990 -10.482 4.331 304 HZ2 TRP 36 HZ2 TRP 36 18.964 -8.719 6.775 305 HZ3 TRP 36 HZ3 TRP 36 17.222 -10.502 3.309 306 HH2 TRP 36 HH2 TRP 36 19.171 -9.642 4.503 307 H ALA 37 HN ALA 37 11.204 -10.026 3.775 308 HA ALA 37 HA ALA 37 8.591 -10.279 5.161 309 HB1 ALA 37 HB1 ALA 37 8.970 -9.271 2.319 310 HB2 ALA 37 HB2 ALA 37 8.495 -8.297 3.711 311 HB3 ALA 37 HB3 ALA 37 7.417 -9.561 3.118 312 H SER 38 HN SER 38 7.108 -11.901 3.937 313 HA SER 38 HA SER 38 8.443 -13.497 1.870 314 HB2 SER 38 HB2 SER 38 6.520 -14.520 4.021 315 HB3 SER 38 HB1 SER 38 7.245 -15.481 2.726 316 HG SER 38 HG SER 38 8.273 -15.516 4.890 317 H VAL 39 HN VAL 39 7.412 -12.880 0.056 318 HA VAL 39 HA VAL 39 4.584 -12.019 0.132 319 HB VAL 39 HB VAL 39 6.760 -11.434 -1.941 320 HG11 VAL 39 HG11 VAL 39 5.142 -9.816 -2.910 321 HG12 VAL 39 HG12 VAL 39 3.917 -10.331 -1.750 322 HG13 VAL 39 HG13 VAL 39 4.506 -11.460 -2.971 323 HG21 VAL 39 HG21 VAL 39 5.538 -9.626 0.168 324 HG22 VAL 39 HG22 VAL 39 6.729 -9.147 -1.042 325 HG23 VAL 39 HG23 VAL 39 7.166 -10.306 0.211 326 H ASN 40 HN ASN 40 3.137 -13.344 -0.853 327 HA ASN 40 HA ASN 40 3.836 -14.543 -3.404 328 HB2 ASN 40 HB2 ASN 40 2.975 -16.770 -2.878 329 HB3 ASN 40 HB1 ASN 40 4.298 -16.391 -1.793 330 HD21 ASN 40 HD21 ASN 40 2.687 -14.779 0.087 331 HD22 ASN 40 HD22 ASN 40 1.659 -15.894 0.899 332 H MET 41 HN MET 41 1.900 -15.058 -4.665 333 HA MET 41 HA MET 41 -0.424 -13.478 -4.179 334 HB2 MET 41 HB2 MET 41 0.211 -15.750 -6.104 335 HB3 MET 41 HB1 MET 41 -1.401 -15.037 -6.036 336 HG2 MET 41 HG2 MET 41 1.134 -13.477 -6.613 337 HG3 MET 41 HG1 MET 41 0.012 -14.089 -7.839 338 HE1 MET 41 HE1 MET 41 -0.402 -11.665 -8.861 339 HE2 MET 41 HE2 MET 41 0.734 -10.960 -7.712 340 HE3 MET 41 HE3 MET 41 -0.874 -10.270 -7.898 341 H VAL 42 HN VAL 42 -2.494 -14.162 -3.544 342 HA VAL 42 HA VAL 42 -2.596 -15.976 -1.384 343 HB VAL 42 HB VAL 42 -5.045 -15.643 -1.337 344 HG11 VAL 42 HG11 VAL 42 -3.641 -13.961 -0.255 345 HG12 VAL 42 HG12 VAL 42 -5.070 -13.195 -0.949 346 HG13 VAL 42 HG13 VAL 42 -3.511 -13.050 -1.764 347 HG21 VAL 42 HG21 VAL 42 -5.572 -15.636 -3.745 348 HG22 VAL 42 HG22 VAL 42 -4.727 -14.101 -3.960 349 HG23 VAL 42 HG23 VAL 42 -6.202 -14.169 -2.992 350 H SER 43 HN SER 43 -3.600 -17.950 -1.193 351 HA SER 43 HA SER 43 -3.189 -19.718 -3.411 352 HB2 SER 43 HB2 SER 43 -2.598 -20.367 -1.095 353 HB3 SER 43 HB1 SER 43 -4.281 -20.214 -0.606 354 HG SER 43 HG SER 43 -3.013 -22.285 -1.775 355 H SER 44 HN SER 44 -4.826 -21.301 -4.050 356 HA SER 44 HA SER 44 -7.213 -20.183 -5.022 357 HB2 SER 44 HB2 SER 44 -7.747 -22.613 -5.614 358 HB3 SER 44 HB1 SER 44 -6.189 -22.031 -6.199 359 HG SER 44 HG SER 44 -6.522 -24.176 -4.896 360 H LYS 45 HN LYS 45 -6.455 -21.975 -2.099 361 HA LYS 45 HA LYS 45 -9.045 -22.629 -1.203 362 HB2 LYS 45 HB2 LYS 45 -8.041 -22.957 0.985 363 HB3 LYS 45 HB1 LYS 45 -6.931 -23.547 -0.247 364 HG2 LYS 45 HG2 LYS 45 -5.659 -21.375 -0.040 365 HG3 LYS 45 HG1 LYS 45 -6.713 -20.944 1.307 366 HD2 LYS 45 HD2 LYS 45 -4.600 -21.839 2.145 367 HD3 LYS 45 HD1 LYS 45 -5.923 -22.932 2.555 368 HE2 LYS 45 HE2 LYS 45 -5.288 -24.420 0.682 369 HE3 LYS 45 HE1 LYS 45 -3.994 -23.313 0.226 370 HZ1 LYS 45 HZ1 LYS 45 -2.934 -23.737 2.330 371 HZ2 LYS 45 HZ2 LYS 45 -3.182 -25.181 1.489 372 HZ3 LYS 45 HZ3 LYS 45 -4.184 -24.779 2.790 373 H GLU 46 HN GLU 46 -7.208 -19.601 -1.034 374 HA GLU 46 HA GLU 46 -8.841 -18.325 0.988 375 HB2 GLU 46 HB2 GLU 46 -6.752 -17.163 -0.924 376 HB3 GLU 46 HB1 GLU 46 -7.503 -16.281 0.410 377 HG2 GLU 46 HG2 GLU 46 -6.513 -17.914 2.013 378 HG3 GLU 46 HG1 GLU 46 -5.732 -18.736 0.658 379 H ALA 47 HN ALA 47 -8.373 -17.847 -2.517 380 HA ALA 47 HA ALA 47 -10.399 -16.021 -3.067 381 HB1 ALA 47 HB1 ALA 47 -8.625 -16.668 -4.646 382 HB2 ALA 47 HB2 ALA 47 -10.217 -16.812 -5.387 383 HB3 ALA 47 HB3 ALA 47 -9.362 -18.259 -4.843 384 H ILE 48 HN ILE 48 -10.594 -19.562 -3.430 385 HA ILE 48 HA ILE 48 -13.353 -19.701 -4.033 386 HB ILE 48 HB ILE 48 -11.494 -21.898 -3.026 387 HG12 ILE 48 HG12 ILE 48 -12.359 -21.186 -5.876 388 HG13 ILE 48 HG11 ILE 48 -10.789 -20.811 -5.176 389 HG21 ILE 48 HG21 ILE 48 -13.114 -23.524 -3.972 390 HG22 ILE 48 HG22 ILE 48 -14.225 -22.201 -4.341 391 HG23 ILE 48 HG23 ILE 48 -13.832 -22.581 -2.663 392 HD11 ILE 48 HD11 ILE 48 -11.875 -23.574 -5.709 393 HD12 ILE 48 HD12 ILE 48 -10.303 -23.202 -4.997 394 HD13 ILE 48 HD13 ILE 48 -10.659 -22.713 -6.651 395 H SER 49 HN SER 49 -11.686 -19.658 -0.901 396 HA SER 49 HA SER 49 -13.758 -20.530 0.799 397 HB2 SER 49 HB2 SER 49 -11.471 -20.095 1.636 398 HB3 SER 49 HB1 SER 49 -11.676 -18.366 1.360 399 HG SER 49 HG SER 49 -13.025 -20.029 3.222 400 H SER 50 HN SER 50 -12.986 -17.228 -0.334 401 HA SER 50 HA SER 50 -15.420 -16.063 0.723 402 HB2 SER 50 HB2 SER 50 -14.592 -14.004 -0.392 403 HB3 SER 50 HB1 SER 50 -13.331 -14.767 0.576 404 HG SER 50 HG SER 50 -12.731 -15.819 -1.524 405 H GLY 51 HN GLY 51 -14.636 -17.815 -2.097 406 HA2 GLY 51 HA2 GLY 51 -16.123 -18.629 -3.686 407 HA3 GLY 51 HA1 GLY 51 -17.303 -17.416 -3.214 408 H ALA 52 HN ALA 52 -16.815 -15.143 -3.861 409 HA ALA 52 HA ALA 52 -15.214 -14.916 -6.346 410 HB1 ALA 52 HB1 ALA 52 -17.066 -13.746 -7.462 411 HB2 ALA 52 HB2 ALA 52 -18.082 -13.959 -6.033 412 HB3 ALA 52 HB3 ALA 52 -17.564 -15.363 -6.968 413 H GLU 53 HN GLU 53 -15.587 -13.775 -3.299 414 HA GLU 53 HA GLU 53 -15.565 -10.905 -3.750 415 HB2 GLU 53 HB2 GLU 53 -14.886 -12.406 -1.175 416 HB3 GLU 53 HB1 GLU 53 -15.337 -10.707 -1.333 417 HG2 GLU 53 HG2 GLU 53 -17.593 -11.367 -2.078 418 HG3 GLU 53 HG1 GLU 53 -17.150 -13.068 -1.933 419 H LEU 54 HN LEU 54 -13.164 -12.907 -1.988 420 HA LEU 54 HA LEU 54 -10.902 -11.396 -3.036 421 HB2 LEU 54 HB2 LEU 54 -10.833 -13.995 -1.425 422 HB3 LEU 54 HB1 LEU 54 -9.524 -12.836 -1.634 423 HG LEU 54 HG LEU 54 -12.076 -12.395 -0.022 424 HD11 LEU 54 HD11 LEU 54 -10.613 -12.391 1.955 425 HD12 LEU 54 HD12 LEU 54 -9.218 -12.766 0.939 426 HD13 LEU 54 HD13 LEU 54 -10.536 -13.930 1.096 427 HD21 LEU 54 HD21 LEU 54 -11.069 -10.255 0.699 428 HD22 LEU 54 HD22 LEU 54 -11.372 -10.291 -1.035 429 HD23 LEU 54 HD23 LEU 54 -9.730 -10.506 -0.426 430 H ALA 55 HN ALA 55 -9.468 -12.217 -4.607 431 HA ALA 55 HA ALA 55 -10.060 -14.806 -5.878 432 HB1 ALA 55 HB1 ALA 55 -10.093 -13.785 -8.125 433 HB2 ALA 55 HB2 ALA 55 -9.928 -12.176 -7.413 434 HB3 ALA 55 HB3 ALA 55 -11.384 -13.127 -7.118 435 H ILE 56 HN ILE 56 -8.301 -15.595 -7.217 436 HA ILE 56 HA ILE 56 -5.717 -15.148 -6.156 437 HB ILE 56 HB ILE 56 -6.500 -16.506 -8.789 438 HG12 ILE 56 HG12 ILE 56 -5.918 -17.710 -6.037 439 HG13 ILE 56 HG11 ILE 56 -7.509 -17.572 -6.777 440 HG21 ILE 56 HG21 ILE 56 -3.844 -16.648 -7.303 441 HG22 ILE 56 HG22 ILE 56 -4.132 -15.866 -8.861 442 HG23 ILE 56 HG23 ILE 56 -4.287 -17.615 -8.712 443 HD11 ILE 56 HD11 ILE 56 -6.690 -19.829 -6.950 444 HD12 ILE 56 HD12 ILE 56 -5.223 -19.279 -7.753 445 HD13 ILE 56 HD13 ILE 56 -6.785 -19.118 -8.559 446 H GLY 57 HN GLY 57 -4.121 -13.716 -6.795 447 HA2 GLY 57 HA2 GLY 57 -3.206 -12.025 -8.343 448 HA3 GLY 57 HA1 GLY 57 -4.862 -11.632 -8.805 449 H THR 58 HN THR 58 -5.607 -12.050 -5.865 450 HA THR 58 HA THR 58 -4.650 -9.683 -4.527 451 HB THR 58 HB THR 58 -6.053 -12.165 -3.402 452 HG1 THR 58 HG1 THR 58 -7.857 -10.436 -3.485 453 HG21 THR 58 HG21 THR 58 -5.005 -10.826 -1.616 454 HG22 THR 58 HG22 THR 58 -6.764 -10.711 -1.538 455 HG23 THR 58 HG23 THR 58 -5.824 -9.379 -2.214 456 H VAL 59 HN VAL 59 -3.219 -9.896 -2.567 457 HA VAL 59 HA VAL 59 -1.108 -11.934 -2.954 458 HB VAL 59 HB VAL 59 -0.665 -8.971 -2.355 459 HG11 VAL 59 HG11 VAL 59 1.718 -9.470 -2.831 460 HG12 VAL 59 HG12 VAL 59 1.314 -11.173 -3.046 461 HG13 VAL 59 HG13 VAL 59 1.116 -10.414 -1.466 462 HG21 VAL 59 HG21 VAL 59 -1.557 -9.242 -4.633 463 HG22 VAL 59 HG22 VAL 59 -0.301 -10.428 -5.000 464 HG23 VAL 59 HG23 VAL 59 0.137 -8.752 -4.675 465 H ARG 60 HN ARG 60 -0.642 -13.028 -1.099 466 HA ARG 60 HA ARG 60 -1.215 -11.850 1.531 467 HB2 ARG 60 HB2 ARG 60 -1.975 -14.187 1.004 468 HB3 ARG 60 HB1 ARG 60 -0.292 -14.669 0.830 469 HG2 ARG 60 HG2 ARG 60 -1.097 -15.331 3.019 470 HG3 ARG 60 HG1 ARG 60 0.112 -14.061 3.208 471 HD2 ARG 60 HD2 ARG 60 -1.843 -13.758 4.727 472 HD3 ARG 60 HD1 ARG 60 -1.623 -12.399 3.616 473 HE ARG 60 HE ARG 60 -3.411 -14.187 2.413 474 HH11 ARG 60 HH11 ARG 60 -3.431 -12.251 5.336 475 HH12 ARG 60 HH12 ARG 60 -5.124 -11.906 5.220 476 HH21 ARG 60 HH21 ARG 60 -5.596 -13.732 2.288 477 HH22 ARG 60 HH22 ARG 60 -6.349 -12.737 3.496 478 H ILE 61 HN ILE 61 0.380 -11.163 2.861 479 HA ILE 61 HA ILE 61 3.226 -11.550 2.177 480 HB ILE 61 HB ILE 61 1.982 -8.791 2.679 481 HG12 ILE 61 HG12 ILE 61 3.214 -9.910 0.120 482 HG13 ILE 61 HG11 ILE 61 1.492 -9.708 0.400 483 HG21 ILE 61 HG21 ILE 61 4.248 -7.858 2.235 484 HG22 ILE 61 HG22 ILE 61 4.893 -9.496 2.102 485 HG23 ILE 61 HG23 ILE 61 4.252 -8.927 3.643 486 HD11 ILE 61 HD11 ILE 61 2.286 -7.956 -0.989 487 HD12 ILE 61 HD12 ILE 61 3.553 -7.545 0.159 488 HD13 ILE 61 HD13 ILE 61 1.862 -7.270 0.581 489 H TRP 62 HN TRP 62 4.550 -11.557 3.972 490 HA TRP 62 HA TRP 62 3.445 -10.958 6.656 491 HB2 TRP 62 HB2 TRP 62 5.090 -13.463 5.972 492 HB3 TRP 62 HB1 TRP 62 4.492 -13.022 7.570 493 HD1 TRP 62 HD1 TRP 62 3.167 -14.216 4.127 494 HE1 TRP 62 HE1 TRP 62 0.912 -15.353 4.484 495 HE3 TRP 62 HE3 TRP 62 2.529 -13.335 9.126 496 HZ2 TRP 62 HZ2 TRP 62 -0.891 -15.885 6.556 497 HZ3 TRP 62 HZ3 TRP 62 0.515 -14.217 10.230 498 HH2 TRP 62 HH2 TRP 62 -1.169 -15.468 8.966 499 H ILE 63 HN ILE 63 4.821 -9.602 7.660 500 HA ILE 63 HA ILE 63 7.638 -9.393 6.739 501 HB ILE 63 HB ILE 63 7.591 -6.972 7.104 502 HG12 ILE 63 HG12 ILE 63 4.586 -7.158 7.570 503 HG13 ILE 63 HG11 ILE 63 5.753 -6.990 8.871 504 HG21 ILE 63 HG21 ILE 63 6.152 -6.267 5.215 505 HG22 ILE 63 HG22 ILE 63 5.374 -7.851 5.232 506 HG23 ILE 63 HG23 ILE 63 7.091 -7.714 4.849 507 HD11 ILE 63 HD11 ILE 63 5.266 -5.012 6.653 508 HD12 ILE 63 HD12 ILE 63 6.460 -4.829 7.941 509 HD13 ILE 63 HD13 ILE 63 4.739 -4.868 8.328 510 H ARG 64 HN ARG 64 9.129 -8.548 8.414 511 HA ARG 64 HA ARG 64 9.047 -9.224 11.012 512 HB2 ARG 64 HB2 ARG 64 10.070 -6.556 9.944 513 HB3 ARG 64 HB1 ARG 64 10.545 -7.275 11.483 514 HG2 ARG 64 HG2 ARG 64 11.042 -8.549 8.770 515 HG3 ARG 64 HG1 ARG 64 12.221 -7.571 9.650 516 HD2 ARG 64 HD2 ARG 64 10.998 -10.183 10.632 517 HD3 ARG 64 HD1 ARG 64 12.627 -9.990 9.973 518 HE ARG 64 HE ARG 64 11.656 -8.822 12.528 519 HH11 ARG 64 HH11 ARG 64 14.322 -9.973 10.549 520 HH12 ARG 64 HH12 ARG 64 15.498 -9.766 11.804 521 HH21 ARG 64 HH21 ARG 64 13.213 -8.487 14.138 522 HH22 ARG 64 HH22 ARG 64 14.863 -8.936 13.852 523 H TYR 65 HN TYR 65 8.424 -8.316 13.017 524 HA TYR 65 HA TYR 65 5.788 -7.244 13.058 525 HB2 TYR 65 HB2 TYR 65 6.830 -8.830 14.790 526 HB3 TYR 65 HB1 TYR 65 7.664 -7.443 15.466 527 HD1 TYR 65 HD1 TYR 65 6.229 -5.530 16.489 528 HD2 TYR 65 HD2 TYR 65 4.536 -9.273 15.327 529 HE1 TYR 65 HE1 TYR 65 4.230 -5.051 17.844 530 HE2 TYR 65 HE2 TYR 65 2.544 -8.792 16.672 531 HH TYR 65 HH TYR 65 1.891 -7.409 18.592 532 H ARG 66 HN ARG 66 5.436 -5.175 12.479 533 HA ARG 66 HA ARG 66 6.581 -3.068 14.126 534 HB2 ARG 66 HB2 ARG 66 6.993 -1.591 12.092 535 HB3 ARG 66 HB1 ARG 66 8.152 -2.893 12.348 536 HG2 ARG 66 HG2 ARG 66 7.045 -4.208 10.563 537 HG3 ARG 66 HG1 ARG 66 5.895 -2.886 10.321 538 HD2 ARG 66 HD2 ARG 66 7.731 -2.822 8.661 539 HD3 ARG 66 HD1 ARG 66 7.712 -1.373 9.672 540 HE ARG 66 HE ARG 66 9.544 -3.647 10.202 541 HH11 ARG 66 HH11 ARG 66 9.132 -0.181 9.721 542 HH12 ARG 66 HH12 ARG 66 10.774 0.174 10.132 543 HH21 ARG 66 HH21 ARG 66 11.643 -3.143 10.761 544 HH22 ARG 66 HH22 ARG 66 12.199 -1.502 10.707 545 H LYS 67 HN LYS 67 5.065 -1.784 14.773 546 HA LYS 67 HA LYS 67 2.349 -1.919 13.752 547 HB2 LYS 67 HB2 LYS 67 3.487 -0.296 16.065 548 HB3 LYS 67 HB1 LYS 67 1.779 -0.612 15.760 549 HG2 LYS 67 HG2 LYS 67 3.881 -2.689 16.483 550 HG3 LYS 67 HG1 LYS 67 2.675 -2.023 17.583 551 HD2 LYS 67 HD2 LYS 67 2.029 -3.643 15.080 552 HD3 LYS 67 HD1 LYS 67 2.111 -4.312 16.710 553 HE2 LYS 67 HE2 LYS 67 0.182 -2.160 15.780 554 HE3 LYS 67 HE1 LYS 67 -0.210 -3.861 16.038 555 HZ1 LYS 67 HZ1 LYS 67 0.690 -1.943 18.123 556 HZ2 LYS 67 HZ2 LYS 67 0.383 -3.583 18.386 557 HZ3 LYS 67 HZ3 LYS 67 -0.872 -2.552 17.931 558 H ASP 68 HN ASP 68 4.764 -0.416 12.422 559 HA ASP 68 HA ASP 68 3.931 2.374 12.333 560 HB2 ASP 68 HB2 ASP 68 6.148 0.954 10.774 561 HB3 ASP 68 HB1 ASP 68 5.944 2.695 10.957 562 H ILE 69 HN ILE 69 3.412 -0.542 10.589 563 HA ILE 69 HA ILE 69 2.956 0.585 7.978 564 HB ILE 69 HB ILE 69 1.928 -2.107 9.002 565 HG12 ILE 69 HG12 ILE 69 4.305 -2.058 9.490 566 HG13 ILE 69 HG11 ILE 69 4.053 -3.086 8.089 567 HG21 ILE 69 HG21 ILE 69 2.045 -2.780 6.618 568 HG22 ILE 69 HG22 ILE 69 2.582 -1.159 6.177 569 HG23 ILE 69 HG23 ILE 69 0.967 -1.402 6.849 570 HD11 ILE 69 HD11 ILE 69 5.118 -0.261 8.070 571 HD12 ILE 69 HD12 ILE 69 4.846 -1.256 6.636 572 HD13 ILE 69 HD13 ILE 69 6.038 -1.744 7.839 573 H ASN 70 HN ASN 70 1.055 1.216 7.085 574 HA ASN 70 HA ASN 70 -1.456 1.084 8.648 575 HB2 ASN 70 HB2 ASN 70 -0.252 3.399 8.653 576 HB3 ASN 70 HB1 ASN 70 -0.643 3.479 6.937 577 HD21 ASN 70 HD21 ASN 70 -1.942 3.434 10.184 578 HD22 ASN 70 HD22 ASN 70 -3.501 4.060 9.783 579 H ALA 71 HN ALA 71 -3.392 1.226 7.238 580 HA ALA 71 HA ALA 71 -3.187 -0.462 4.972 581 HB1 ALA 71 HB1 ALA 71 -5.601 -0.118 4.706 582 HB2 ALA 71 HB2 ALA 71 -5.540 1.243 5.832 583 HB3 ALA 71 HB3 ALA 71 -5.187 -0.387 6.402 584 H THR 72 HN THR 72 -2.939 2.973 5.311 585 HA THR 72 HA THR 72 -3.273 3.511 2.448 586 HB THR 72 HB THR 72 -2.901 5.909 3.105 587 HG1 THR 72 HG1 THR 72 -3.131 5.366 5.823 588 HG21 THR 72 HG21 THR 72 -4.993 6.233 4.367 589 HG22 THR 72 HG22 THR 72 -5.028 4.518 4.786 590 HG23 THR 72 HG23 THR 72 -5.213 5.020 3.101 591 H SER 73 HN SER 73 -1.017 1.855 3.591 592 HA SER 73 HA SER 73 1.207 3.271 2.245 593 HB2 SER 73 HB2 SER 73 1.762 2.372 4.504 594 HB3 SER 73 HB1 SER 73 1.294 0.756 3.982 595 HG SER 73 HG SER 73 3.403 2.341 2.945 596 H ARG 74 HN ARG 74 2.447 1.940 0.701 597 HA ARG 74 HA ARG 74 0.907 -0.254 -0.560 598 HB2 ARG 74 HB2 ARG 74 2.314 2.089 -1.887 599 HB3 ARG 74 HB1 ARG 74 2.042 0.581 -2.758 600 HG2 ARG 74 HG2 ARG 74 -0.293 0.827 -2.731 601 HG3 ARG 74 HG1 ARG 74 -0.259 1.999 -1.417 602 HD2 ARG 74 HD2 ARG 74 -0.834 2.966 -3.653 603 HD3 ARG 74 HD1 ARG 74 0.536 3.723 -2.850 604 HE ARG 74 HE ARG 74 1.489 1.772 -4.635 605 HH11 ARG 74 HH11 ARG 74 -0.138 4.881 -4.726 606 HH12 ARG 74 HH12 ARG 74 0.654 5.392 -6.182 607 HH21 ARG 74 HH21 ARG 74 2.521 2.478 -6.579 608 HH22 ARG 74 HH22 ARG 74 2.141 4.042 -7.220 609 H ILE 75 HN ILE 75 1.981 -2.062 -0.772 610 HA ILE 75 HA ILE 75 4.752 -2.264 0.118 611 HB ILE 75 HB ILE 75 2.757 -4.447 -0.659 612 HG12 ILE 75 HG12 ILE 75 1.929 -3.177 1.295 613 HG13 ILE 75 HG11 ILE 75 2.402 -4.803 1.761 614 HG21 ILE 75 HG21 ILE 75 5.041 -5.258 -0.832 615 HG22 ILE 75 HG22 ILE 75 4.282 -5.970 0.588 616 HG23 ILE 75 HG23 ILE 75 5.424 -4.646 0.778 617 HD11 ILE 75 HD11 ILE 75 3.972 -2.279 2.248 618 HD12 ILE 75 HD12 ILE 75 4.491 -3.909 2.688 619 HD13 ILE 75 HD13 ILE 75 3.055 -3.208 3.434 620 H LYS 76 HN LYS 76 6.015 -1.504 -1.608 621 HA LYS 76 HA LYS 76 5.703 -2.813 -4.242 622 HB2 LYS 76 HB2 LYS 76 6.037 -0.338 -4.220 623 HB3 LYS 76 HB1 LYS 76 7.599 -0.555 -3.429 624 HG2 LYS 76 HG2 LYS 76 8.504 -1.688 -5.366 625 HG3 LYS 76 HG1 LYS 76 6.915 -1.763 -6.133 626 HD2 LYS 76 HD2 LYS 76 8.297 -0.017 -7.167 627 HD3 LYS 76 HD1 LYS 76 6.894 0.692 -6.363 628 HE2 LYS 76 HE2 LYS 76 8.924 2.026 -5.968 629 HE3 LYS 76 HE1 LYS 76 8.313 1.350 -4.458 630 HZ1 LYS 76 HZ1 LYS 76 10.716 1.176 -4.675 631 HZ2 LYS 76 HZ2 LYS 76 10.537 0.209 -6.050 632 HZ3 LYS 76 HZ3 LYS 76 9.989 -0.340 -4.557 633 H VAL 77 HN VAL 77 6.709 -4.700 -4.422 634 HA VAL 77 HA VAL 77 8.479 -5.643 -2.359 635 HB VAL 77 HB VAL 77 7.502 -7.034 -4.893 636 HG11 VAL 77 HG11 VAL 77 8.088 -9.165 -3.735 637 HG12 VAL 77 HG12 VAL 77 8.825 -8.238 -2.428 638 HG13 VAL 77 HG13 VAL 77 9.516 -8.172 -4.050 639 HG21 VAL 77 HG21 VAL 77 5.660 -6.347 -3.393 640 HG22 VAL 77 HG22 VAL 77 6.433 -7.189 -2.048 641 HG23 VAL 77 HG23 VAL 77 5.830 -8.102 -3.431 642 H SER 78 HN SER 78 10.613 -5.597 -2.368 643 HA SER 78 HA SER 78 12.118 -4.556 -4.610 644 HB2 SER 78 HB2 SER 78 12.523 -3.799 -2.265 645 HB3 SER 78 HB1 SER 78 13.082 -5.418 -1.850 646 HG SER 78 HG SER 78 14.240 -3.588 -3.683 647 H THR 79 HN THR 79 11.490 -7.668 -3.182 648 HA THR 79 HA THR 79 12.769 -9.075 -5.285 649 HB THR 79 HB THR 79 14.812 -8.591 -3.937 650 HG1 THR 79 HG1 THR 79 13.919 -11.239 -4.334 651 HG21 THR 79 HG21 THR 79 13.872 -8.591 -1.650 652 HG22 THR 79 HG22 THR 79 15.208 -9.739 -1.777 653 HG23 THR 79 HG23 THR 79 13.539 -10.317 -1.771 654 H GLY 80 HN GLY 80 11.780 -10.991 -5.562 655 HA2 GLY 80 HA2 GLY 80 10.748 -12.907 -4.023 656 HA3 GLY 80 HA1 GLY 80 9.529 -11.650 -3.815 657 HA PRO 81 HA PRO 81 8.321 -14.010 -7.694 658 HB2 PRO 81 HB2 PRO 81 5.713 -14.436 -7.024 659 HB3 PRO 81 HB1 PRO 81 7.004 -15.517 -6.474 660 HG2 PRO 81 HG2 PRO 81 5.689 -13.229 -5.002 661 HG3 PRO 81 HG1 PRO 81 6.014 -14.877 -4.420 662 HD2 PRO 81 HD2 PRO 81 7.647 -12.805 -3.792 663 HD3 PRO 81 HD1 PRO 81 8.298 -14.439 -4.066 664 H LEU 82 HN LEU 82 7.378 -11.187 -5.993 665 HA LEU 82 HA LEU 82 6.080 -9.984 -8.371 666 HB2 LEU 82 HB2 LEU 82 5.470 -9.538 -5.419 667 HB3 LEU 82 HB1 LEU 82 4.763 -8.610 -6.733 668 HG LEU 82 HG LEU 82 4.363 -11.610 -6.339 669 HD11 LEU 82 HD11 LEU 82 3.267 -10.370 -4.546 670 HD12 LEU 82 HD12 LEU 82 2.082 -11.079 -5.639 671 HD13 LEU 82 HD13 LEU 82 2.439 -9.350 -5.728 672 HD21 LEU 82 HD21 LEU 82 4.194 -10.948 -8.689 673 HD22 LEU 82 HD22 LEU 82 3.013 -9.697 -8.275 674 HD23 LEU 82 HD23 LEU 82 2.614 -11.406 -8.053 675 H ALA 83 HN ALA 83 8.897 -10.062 -7.687 676 HA ALA 83 HA ALA 83 9.835 -7.665 -6.490 677 HB1 ALA 83 HB1 ALA 83 12.003 -8.252 -7.501 678 HB2 ALA 83 HB2 ALA 83 11.215 -9.468 -8.511 679 HB3 ALA 83 HB3 ALA 83 11.247 -9.666 -6.758 680 H GLY 84 HN GLY 84 9.905 -5.640 -7.284 681 HA2 GLY 84 HA2 GLY 84 10.111 -3.883 -8.787 682 HA3 GLY 84 HA1 GLY 84 10.074 -5.021 -10.123 683 H ARG 85 HN ARG 85 7.529 -5.483 -7.862 684 HA ARG 85 HA ARG 85 5.609 -3.981 -9.565 685 HB2 ARG 85 HB2 ARG 85 5.013 -6.598 -8.099 686 HB3 ARG 85 HB1 ARG 85 3.983 -5.760 -9.263 687 HG2 ARG 85 HG2 ARG 85 5.567 -6.253 -11.071 688 HG3 ARG 85 HG1 ARG 85 6.680 -6.999 -9.924 689 HD2 ARG 85 HD2 ARG 85 4.700 -8.627 -9.421 690 HD3 ARG 85 HD1 ARG 85 4.032 -8.030 -10.946 691 HE ARG 85 HE ARG 85 6.679 -8.762 -11.430 692 HH11 ARG 85 HH11 ARG 85 3.650 -10.390 -10.678 693 HH12 ARG 85 HH12 ARG 85 4.200 -11.926 -11.266 694 HH21 ARG 85 HH21 ARG 85 7.381 -10.777 -12.180 695 HH22 ARG 85 HH22 ARG 85 6.315 -12.145 -12.124 696 H VAL 86 HN VAL 86 3.779 -3.074 -8.458 697 HA VAL 86 HA VAL 86 4.364 -2.430 -5.627 698 HB VAL 86 HB VAL 86 4.785 -0.476 -6.980 699 HG11 VAL 86 HG11 VAL 86 1.963 -0.692 -8.082 700 HG12 VAL 86 HG12 VAL 86 3.452 -1.021 -8.971 701 HG13 VAL 86 HG13 VAL 86 3.105 0.616 -8.406 702 HG21 VAL 86 HG21 VAL 86 3.775 -0.070 -4.774 703 HG22 VAL 86 HG22 VAL 86 2.155 -0.147 -5.476 704 HG23 VAL 86 HG23 VAL 86 3.253 1.163 -5.925 705 H LEU 87 HN LEU 87 3.116 -3.816 -4.624 706 HA LEU 87 HA LEU 87 0.275 -4.157 -5.188 707 HB2 LEU 87 HB2 LEU 87 1.933 -5.319 -2.901 708 HB3 LEU 87 HB1 LEU 87 0.306 -5.796 -3.351 709 HG LEU 87 HG LEU 87 1.687 -7.523 -4.181 710 HD11 LEU 87 HD11 LEU 87 1.195 -5.745 -6.578 711 HD12 LEU 87 HD12 LEU 87 0.030 -6.843 -5.834 712 HD13 LEU 87 HD13 LEU 87 1.477 -7.489 -6.606 713 HD21 LEU 87 HD21 LEU 87 3.571 -5.494 -5.411 714 HD22 LEU 87 HD22 LEU 87 3.714 -7.253 -5.508 715 HD23 LEU 87 HD23 LEU 87 3.865 -6.443 -3.952 716 H ASN 88 HN ASN 88 -1.382 -3.439 -3.878 717 HA ASN 88 HA ASN 88 -0.795 -1.195 -2.033 718 HB2 ASN 88 HB2 ASN 88 -3.267 -1.862 -3.705 719 HB3 ASN 88 HB1 ASN 88 -3.283 -0.642 -2.443 720 HD21 ASN 88 HD21 ASN 88 -0.516 -1.128 -4.622 721 HD22 ASN 88 HD22 ASN 88 -0.721 0.349 -5.477 722 H ILE 89 HN ILE 89 -1.829 -1.175 0.060 723 HA ILE 89 HA ILE 89 -2.396 -3.856 1.116 724 HB ILE 89 HB ILE 89 -2.326 -1.165 2.565 725 HG12 ILE 89 HG12 ILE 89 -0.210 -3.359 2.397 726 HG13 ILE 89 HG11 ILE 89 -0.118 -1.785 1.612 727 HG21 ILE 89 HG21 ILE 89 -2.223 -2.492 4.665 728 HG22 ILE 89 HG22 ILE 89 -2.398 -3.985 3.741 729 HG23 ILE 89 HG23 ILE 89 -3.719 -2.817 3.784 730 HD11 ILE 89 HD11 ILE 89 -0.103 -2.322 4.575 731 HD12 ILE 89 HD12 ILE 89 -0.096 -0.714 3.830 732 HD13 ILE 89 HD13 ILE 89 1.259 -1.820 3.572 733 H ILE 90 HN ILE 90 -4.377 -4.591 1.547 734 HA ILE 90 HA ILE 90 -6.726 -2.849 1.047 735 HB ILE 90 HB ILE 90 -7.917 -5.011 0.363 736 HG12 ILE 90 HG12 ILE 90 -5.090 -6.138 0.105 737 HG13 ILE 90 HG11 ILE 90 -6.164 -6.553 1.429 738 HG21 ILE 90 HG21 ILE 90 -6.990 -5.012 -1.943 739 HG22 ILE 90 HG22 ILE 90 -5.573 -4.127 -1.377 740 HG23 ILE 90 HG23 ILE 90 -7.164 -3.368 -1.317 741 HD11 ILE 90 HD11 ILE 90 -6.640 -7.107 -1.486 742 HD12 ILE 90 HD12 ILE 90 -7.716 -7.552 -0.158 743 HD13 ILE 90 HD13 ILE 90 -6.108 -8.261 -0.266 744 H GLY 91 HN GLY 91 -8.225 -2.721 2.605 745 HA2 GLY 91 HA2 GLY 91 -9.452 -3.186 4.506 746 HA3 GLY 91 HA1 GLY 91 -8.536 -4.676 4.729 747 H GLN 92 HN GLN 92 -6.350 -4.496 5.632 748 HA GLN 92 HA GLN 92 -5.410 -2.168 6.988 749 HB2 GLN 92 HB2 GLN 92 -5.918 -2.811 9.314 750 HB3 GLN 92 HB1 GLN 92 -7.414 -2.612 8.406 751 HG2 GLN 92 HG2 GLN 92 -7.542 -5.096 8.141 752 HG3 GLN 92 HG1 GLN 92 -6.100 -5.253 9.146 753 HE21 GLN 92 HE21 GLN 92 -8.726 -6.372 9.666 754 HE22 GLN 92 HE22 GLN 92 -9.281 -5.693 11.154 755 HA PRO 93 HA PRO 93 -2.049 -5.283 7.816 756 HB2 PRO 93 HB2 PRO 93 -0.505 -3.869 9.565 757 HB3 PRO 93 HB1 PRO 93 -0.498 -3.534 7.827 758 HG2 PRO 93 HG2 PRO 93 -1.970 -2.090 10.026 759 HG3 PRO 93 HG1 PRO 93 -1.055 -1.410 8.665 760 HD2 PRO 93 HD2 PRO 93 -3.789 -1.623 8.655 761 HD3 PRO 93 HD1 PRO 93 -2.814 -1.695 7.170 762 H LEU 94 HN LEU 94 -1.695 -6.766 9.535 763 HA LEU 94 HA LEU 94 -3.000 -6.378 12.125 764 HB2 LEU 94 HB2 LEU 94 -4.595 -7.441 10.200 765 HB3 LEU 94 HB1 LEU 94 -3.763 -8.915 10.642 766 HG LEU 94 HG LEU 94 -5.940 -8.737 11.763 767 HD11 LEU 94 HD11 LEU 94 -3.728 -8.467 13.810 768 HD12 LEU 94 HD12 LEU 94 -4.188 -9.950 12.972 769 HD13 LEU 94 HD13 LEU 94 -5.326 -9.177 14.074 770 HD21 LEU 94 HD21 LEU 94 -4.904 -6.208 13.076 771 HD22 LEU 94 HD22 LEU 94 -6.443 -7.007 13.426 772 HD23 LEU 94 HD23 LEU 94 -6.157 -6.303 11.834 773 HA PRO 95 HA PRO 95 0.842 -8.726 13.123 774 HB2 PRO 95 HB2 PRO 95 -0.586 -9.044 15.766 775 HB3 PRO 95 HB1 PRO 95 1.066 -8.503 15.435 776 HG2 PRO 95 HG2 PRO 95 -0.813 -6.740 16.139 777 HG3 PRO 95 HG1 PRO 95 0.396 -6.325 14.906 778 HD2 PRO 95 HD2 PRO 95 -2.493 -7.112 14.537 779 HD3 PRO 95 HD1 PRO 95 -1.536 -5.888 13.670 780 H ASP 96 HN ASP 96 1.346 -10.996 13.440 781 HA ASP 96 HA ASP 96 -0.706 -12.837 12.595 782 HB2 ASP 96 HB2 ASP 96 0.995 -14.530 12.591 783 HB3 ASP 96 HB1 ASP 96 1.758 -13.054 12.005 784 H ALA 97 HN ALA 97 -0.691 -15.066 13.915 785 HA ALA 97 HA ALA 97 -2.264 -14.635 16.213 786 HB1 ALA 97 HB1 ALA 97 -0.976 -17.214 15.256 787 HB2 ALA 97 HB2 ALA 97 -2.528 -16.572 14.718 788 HB3 ALA 97 HB3 ALA 97 -2.324 -17.088 16.394 789 H ALA 98 HN ALA 98 1.164 -15.448 15.871 790 HA ALA 98 HA ALA 98 1.517 -15.933 18.752 791 HB1 ALA 98 HB1 ALA 98 2.637 -17.441 17.143 792 HB2 ALA 98 HB2 ALA 98 3.815 -16.593 18.148 793 HB3 ALA 98 HB3 ALA 98 3.538 -16.075 16.480 794 H ARG 99 HN ARG 99 1.695 -13.282 16.598 795 HA ARG 99 HA ARG 99 2.442 -11.168 16.645 796 HB2 ARG 99 HB2 ARG 99 2.522 -11.653 19.645 797 HB3 ARG 99 HB1 ARG 99 2.961 -10.103 18.941 798 HG2 ARG 99 HG2 ARG 99 0.700 -9.896 19.645 799 HG3 ARG 99 HG1 ARG 99 0.666 -10.008 17.884 800 HD2 ARG 99 HD2 ARG 99 -0.009 -12.365 18.039 801 HD3 ARG 99 HD1 ARG 99 0.097 -12.293 19.801 802 HE ARG 99 HE ARG 99 -1.723 -10.399 18.532 803 HH11 ARG 99 HH11 ARG 99 -1.440 -13.536 20.072 804 HH12 ARG 99 HH12 ARG 99 -3.110 -13.590 20.536 805 HH21 ARG 99 HH21 ARG 99 -3.920 -10.501 19.106 806 HH22 ARG 99 HH22 ARG 99 -4.515 -11.878 19.978 807 H THR 100 HN THR 100 4.260 -13.228 16.035 808 HA THR 100 HA THR 100 6.886 -12.220 16.928 809 HB THR 100 HB THR 100 6.511 -14.695 16.982 810 HG1 THR 100 HG1 THR 100 8.586 -13.432 15.991 811 HG21 THR 100 HG21 THR 100 6.379 -15.989 14.893 812 HG22 THR 100 HG22 THR 100 6.321 -14.498 13.952 813 HG23 THR 100 HG23 THR 100 4.988 -14.909 15.035 814 H ARG 101 HN ARG 101 4.718 -11.319 14.684 815 HA ARG 101 HA ARG 101 6.473 -10.048 12.881 816 HB2 ARG 101 HB2 ARG 101 6.135 -11.291 10.833 817 HB3 ARG 101 HB1 ARG 101 6.700 -12.450 12.032 818 HG2 ARG 101 HG2 ARG 101 4.447 -13.302 12.342 819 HG3 ARG 101 HG1 ARG 101 3.782 -12.049 11.292 820 HD2 ARG 101 HD2 ARG 101 3.864 -14.112 10.091 821 HD3 ARG 101 HD1 ARG 101 5.058 -13.014 9.397 822 HE ARG 101 HE ARG 101 6.670 -14.305 10.952 823 HH11 ARG 101 HH11 ARG 101 3.989 -15.744 9.217 824 HH12 ARG 101 HH12 ARG 101 4.722 -17.308 9.143 825 HH21 ARG 101 HH21 ARG 101 7.629 -16.331 10.854 826 HH22 ARG 101 HH22 ARG 101 6.810 -17.642 10.069 827 H LEU 102 HN LEU 102 4.958 -9.488 10.782 828 HA LEU 102 HA LEU 102 2.319 -8.624 11.770 829 HB2 LEU 102 HB2 LEU 102 4.524 -6.933 11.361 830 HB3 LEU 102 HB1 LEU 102 3.685 -6.790 9.839 831 HG LEU 102 HG LEU 102 3.031 -4.976 11.286 832 HD11 LEU 102 HD11 LEU 102 0.724 -6.925 11.084 833 HD12 LEU 102 HD12 LEU 102 1.281 -5.832 9.818 834 HD13 LEU 102 HD13 LEU 102 0.605 -5.175 11.303 835 HD21 LEU 102 HD21 LEU 102 3.570 -5.983 13.451 836 HD22 LEU 102 HD22 LEU 102 2.161 -7.039 13.335 837 HD23 LEU 102 HD23 LEU 102 1.949 -5.290 13.463 838 H GLU 103 HN GLU 103 0.858 -9.736 10.552 839 HA GLU 103 HA GLU 103 1.331 -10.635 7.862 840 HB2 GLU 103 HB2 GLU 103 -0.245 -11.898 9.257 841 HB3 GLU 103 HB1 GLU 103 -1.244 -10.471 9.491 842 HG2 GLU 103 HG2 GLU 103 -1.745 -10.453 7.044 843 HG3 GLU 103 HG1 GLU 103 -0.821 -11.945 6.866 844 H ILE 104 HN ILE 104 1.344 -9.273 6.145 845 HA ILE 104 HA ILE 104 -0.513 -6.957 6.107 846 HB ILE 104 HB ILE 104 1.864 -7.432 4.238 847 HG12 ILE 104 HG12 ILE 104 2.744 -7.230 6.545 848 HG13 ILE 104 HG11 ILE 104 3.155 -5.804 5.604 849 HG21 ILE 104 HG21 ILE 104 0.245 -4.917 4.839 850 HG22 ILE 104 HG22 ILE 104 0.143 -5.895 3.374 851 HG23 ILE 104 HG23 ILE 104 1.624 -5.017 3.741 852 HD11 ILE 104 HD11 ILE 104 0.964 -6.009 7.665 853 HD12 ILE 104 HD12 ILE 104 1.341 -4.575 6.704 854 HD13 ILE 104 HD13 ILE 104 2.524 -5.207 7.849 855 H LEU 105 HN LEU 105 -2.323 -7.326 4.968 856 HA LEU 105 HA LEU 105 -2.289 -9.259 2.732 857 HB2 LEU 105 HB2 LEU 105 -4.836 -8.959 2.777 858 HB3 LEU 105 HB1 LEU 105 -4.111 -9.861 4.089 859 HG LEU 105 HG LEU 105 -4.816 -6.923 4.444 860 HD11 LEU 105 HD11 LEU 105 -6.874 -8.028 3.682 861 HD12 LEU 105 HD12 LEU 105 -6.989 -7.576 5.378 862 HD13 LEU 105 HD13 LEU 105 -6.702 -9.261 4.936 863 HD21 LEU 105 HD21 LEU 105 -4.975 -7.551 6.837 864 HD22 LEU 105 HD22 LEU 105 -3.383 -7.912 6.182 865 HD23 LEU 105 HD23 LEU 105 -4.542 -9.220 6.443 866 H CYS 106 HN CYS 106 -2.737 -8.605 0.733 867 HA CYS 106 HA CYS 106 -2.955 -5.794 0.041 868 HB2 CYS 106 HB2 CYS 106 -0.435 -7.361 -0.694 869 HB3 CYS 106 HB1 CYS 106 -0.851 -5.752 -1.271 870 HG CYS 106 HG CYS 106 -1.018 -5.309 1.834 871 H ARG 107 HN ARG 107 -2.882 -5.591 -2.357 872 HA ARG 107 HA ARG 107 -3.287 -8.008 -3.962 873 HB2 ARG 107 HB2 ARG 107 -5.556 -7.366 -3.213 874 HB3 ARG 107 HB1 ARG 107 -5.302 -5.710 -3.752 875 HG2 ARG 107 HG2 ARG 107 -5.230 -6.467 -6.091 876 HG3 ARG 107 HG1 ARG 107 -5.403 -8.143 -5.565 877 HD2 ARG 107 HD2 ARG 107 -7.644 -7.692 -4.713 878 HD3 ARG 107 HD1 ARG 107 -7.470 -5.972 -5.084 879 HE ARG 107 HE ARG 107 -7.887 -6.402 -7.297 880 HH11 ARG 107 HH11 ARG 107 -7.371 -9.509 -5.706 881 HH12 ARG 107 HH12 ARG 107 -7.821 -10.419 -7.113 882 HH21 ARG 107 HH21 ARG 107 -8.446 -7.617 -9.104 883 HH22 ARG 107 HH22 ARG 107 -8.438 -9.350 -9.023 884 H GLU 108 HN GLU 108 -2.973 -7.507 -6.307 885 HA GLU 108 HA GLU 108 -1.128 -5.715 -7.162 886 HB2 GLU 108 HB2 GLU 108 -2.170 -7.463 -8.602 887 HB3 GLU 108 HB1 GLU 108 -3.635 -6.489 -8.719 888 HG2 GLU 108 HG2 GLU 108 -2.254 -4.677 -9.794 889 HG3 GLU 108 HG1 GLU 108 -0.885 -5.793 -9.793 890 H GLY 109 HN GLY 109 -1.099 -3.567 -8.018 891 HA2 GLY 109 HA2 GLY 109 -2.854 -1.786 -6.514 892 HA3 GLY 109 HA1 GLY 109 -1.363 -1.357 -7.344 893 H ALA 110 HN ALA 110 -4.330 -2.921 -8.528 894 HA ALA 110 HA ALA 110 -4.636 -1.101 -10.735 895 HB1 ALA 110 HB1 ALA 110 -6.688 -2.377 -11.218 896 HB2 ALA 110 HB2 ALA 110 -6.526 -3.245 -9.688 897 HB3 ALA 110 HB3 ALA 110 -5.316 -3.456 -10.959 898 H GLU 111 HN GLU 111 -4.800 0.925 -9.782 899 HA GLU 111 HA GLU 111 -6.739 1.584 -7.740 900 HB2 GLU 111 HB2 GLU 111 -4.918 3.365 -9.435 901 HB3 GLU 111 HB1 GLU 111 -5.839 3.889 -8.025 902 HG2 GLU 111 HG2 GLU 111 -4.505 2.515 -6.547 903 HG3 GLU 111 HG1 GLU 111 -3.699 1.736 -7.908 904 H LYS 112 HN LYS 112 -8.512 0.681 -9.049 905 HA LYS 112 HA LYS 112 -9.720 2.584 -10.966 906 HB2 LYS 112 HB2 LYS 112 -9.697 -0.468 -11.194 907 HB3 LYS 112 HB1 LYS 112 -10.604 0.619 -12.239 908 HG2 LYS 112 HG2 LYS 112 -8.446 1.590 -13.036 909 HG3 LYS 112 HG1 LYS 112 -7.582 0.420 -12.038 910 HD2 LYS 112 HD2 LYS 112 -7.660 -0.332 -14.374 911 HD3 LYS 112 HD1 LYS 112 -8.578 -1.437 -13.347 912 HE2 LYS 112 HE2 LYS 112 -10.688 -0.408 -14.093 913 HE3 LYS 112 HE1 LYS 112 -9.800 0.774 -15.056 914 HZ1 LYS 112 HZ1 LYS 112 -9.772 -2.163 -15.486 915 HZ2 LYS 112 HZ2 LYS 112 -8.966 -1.011 -16.424 916 HZ3 LYS 112 HZ3 LYS 112 -10.653 -1.042 -16.391 Start of MODEL 17 1 H1 MET 1 HT1 MET 1 10.915 -19.212 19.460 2 H2 MET 1 HT2 MET 1 12.396 -18.603 18.924 3 H3 MET 1 HT3 MET 1 11.797 -20.044 18.282 4 HA MET 1 HA MET 1 9.952 -18.887 17.293 5 HB2 MET 1 HB2 MET 1 11.338 -16.411 18.418 6 HB3 MET 1 HB1 MET 1 10.001 -16.367 17.277 7 HG2 MET 1 HG2 MET 1 8.502 -17.332 18.912 8 HG3 MET 1 HG1 MET 1 9.831 -17.576 20.048 9 HE1 MET 1 HE1 MET 1 8.444 -16.347 21.957 10 HE2 MET 1 HE2 MET 1 7.096 -16.069 20.851 11 HE3 MET 1 HE3 MET 1 7.759 -14.730 21.787 12 H ASN 2 HN ASN 2 10.465 -19.252 15.228 13 HA ASN 2 HA ASN 2 13.065 -18.967 14.090 14 HB2 ASN 2 HB2 ASN 2 10.334 -19.393 12.811 15 HB3 ASN 2 HB1 ASN 2 11.838 -19.409 11.900 16 HD21 ASN 2 HD21 ASN 2 13.231 -21.180 12.098 17 HD22 ASN 2 HD22 ASN 2 12.760 -22.648 12.876 18 H ILE 3 HN ILE 3 13.943 -17.015 13.857 19 HA ILE 3 HA ILE 3 12.396 -14.643 13.155 20 HB ILE 3 HB ILE 3 14.401 -13.330 13.458 21 HG12 ILE 3 HG12 ILE 3 16.069 -14.945 12.415 22 HG13 ILE 3 HG11 ILE 3 16.634 -14.158 13.879 23 HG21 ILE 3 HG21 ILE 3 13.195 -13.915 15.472 24 HG22 ILE 3 HG22 ILE 3 14.919 -13.830 15.829 25 HG23 ILE 3 HG23 ILE 3 14.131 -15.402 15.663 26 HD11 ILE 3 HD11 ILE 3 15.625 -16.991 13.668 27 HD12 ILE 3 HD12 ILE 3 16.212 -16.214 15.140 28 HD13 ILE 3 HD13 ILE 3 17.312 -16.485 13.788 29 H GLY 4 HN GLY 4 14.062 -17.102 11.503 30 HA2 GLY 4 HA2 GLY 4 14.514 -15.515 9.057 31 HA3 GLY 4 HA1 GLY 4 15.112 -17.135 9.386 32 H ARG 5 HN ARG 5 11.777 -16.115 9.938 33 HA ARG 5 HA ARG 5 10.678 -18.068 8.109 34 HB2 ARG 5 HB2 ARG 5 9.299 -15.778 9.593 35 HB3 ARG 5 HB1 ARG 5 8.464 -17.051 8.700 36 HG2 ARG 5 HG2 ARG 5 9.437 -18.732 10.268 37 HG3 ARG 5 HG1 ARG 5 10.156 -17.412 11.189 38 HD2 ARG 5 HD2 ARG 5 8.149 -18.077 12.316 39 HD3 ARG 5 HD1 ARG 5 7.820 -16.517 11.563 40 HE ARG 5 HE ARG 5 6.777 -17.908 9.703 41 HH11 ARG 5 HH11 ARG 5 6.709 -18.929 13.065 42 HH12 ARG 5 HH12 ARG 5 5.302 -19.917 12.863 43 HH21 ARG 5 HH21 ARG 5 4.937 -19.204 9.449 44 HH22 ARG 5 HH22 ARG 5 4.294 -20.069 10.812 45 H LEU 6 HN LEU 6 11.919 -14.963 7.766 46 HA LEU 6 HA LEU 6 10.108 -14.044 5.669 47 HB2 LEU 6 HB2 LEU 6 12.474 -12.622 6.958 48 HB3 LEU 6 HB1 LEU 6 11.288 -11.904 5.889 49 HG LEU 6 HG LEU 6 10.719 -11.140 8.047 50 HD11 LEU 6 HD11 LEU 6 8.841 -13.447 7.513 51 HD12 LEU 6 HD12 LEU 6 8.765 -11.837 6.792 52 HD13 LEU 6 HD13 LEU 6 8.512 -12.035 8.523 53 HD21 LEU 6 HD21 LEU 6 10.435 -12.540 10.043 54 HD22 LEU 6 HD22 LEU 6 12.069 -12.652 9.399 55 HD23 LEU 6 HD23 LEU 6 10.926 -13.968 9.125 56 H ARG 7 HN ARG 7 10.541 -14.889 3.762 57 HA ARG 7 HA ARG 7 13.167 -15.867 2.981 58 HB2 ARG 7 HB2 ARG 7 11.937 -16.759 0.982 59 HB3 ARG 7 HB1 ARG 7 11.222 -17.248 2.512 60 HG2 ARG 7 HG2 ARG 7 9.523 -15.424 2.246 61 HG3 ARG 7 HG1 ARG 7 10.192 -15.082 0.651 62 HD2 ARG 7 HD2 ARG 7 8.985 -17.739 1.489 63 HD3 ARG 7 HD1 ARG 7 8.113 -16.467 0.627 64 HE ARG 7 HE ARG 7 10.546 -17.360 -0.666 65 HH11 ARG 7 HH11 ARG 7 7.070 -17.873 -0.412 66 HH12 ARG 7 HH12 ARG 7 6.961 -18.651 -1.955 67 HH21 ARG 7 HH21 ARG 7 10.362 -18.380 -2.683 68 HH22 ARG 7 HH22 ARG 7 8.816 -18.942 -3.229 69 H ASP 8 HN ASP 8 11.037 -13.248 2.068 70 HA ASP 8 HA ASP 8 12.677 -12.439 -0.245 71 HB2 ASP 8 HB2 ASP 8 10.163 -13.258 -0.411 72 HB3 ASP 8 HB1 ASP 8 9.758 -11.705 0.315 73 H ARG 9 HN ARG 9 11.903 -9.862 -0.596 74 HA ARG 9 HA ARG 9 11.917 -8.334 1.910 75 HB2 ARG 9 HB2 ARG 9 13.990 -7.985 -0.298 76 HB3 ARG 9 HB1 ARG 9 13.638 -6.728 0.884 77 HG2 ARG 9 HG2 ARG 9 14.358 -8.258 2.703 78 HG3 ARG 9 HG1 ARG 9 14.765 -9.480 1.490 79 HD2 ARG 9 HD2 ARG 9 16.011 -6.716 1.737 80 HD3 ARG 9 HD1 ARG 9 16.753 -8.248 2.199 81 HE ARG 9 HE ARG 9 16.629 -8.881 -0.199 82 HH11 ARG 9 HH11 ARG 9 16.707 -5.444 0.595 83 HH12 ARG 9 HH12 ARG 9 17.314 -4.993 -0.966 84 HH21 ARG 9 HH21 ARG 9 17.437 -8.258 -2.216 85 HH22 ARG 9 HH22 ARG 9 17.729 -6.581 -2.552 86 H ILE 10 HN ILE 10 10.996 -6.310 1.723 87 HA ILE 10 HA ILE 10 9.920 -5.400 -0.873 88 HB ILE 10 HB ILE 10 7.760 -4.882 -0.048 89 HG12 ILE 10 HG12 ILE 10 8.285 -3.945 2.161 90 HG13 ILE 10 HG11 ILE 10 6.960 -5.084 2.280 91 HG21 ILE 10 HG21 ILE 10 8.399 -7.614 1.087 92 HG22 ILE 10 HG22 ILE 10 7.964 -7.239 -0.582 93 HG23 ILE 10 HG23 ILE 10 6.787 -6.999 0.710 94 HD11 ILE 10 HD11 ILE 10 8.529 -6.726 3.216 95 HD12 ILE 10 HD12 ILE 10 8.384 -5.265 4.178 96 HD13 ILE 10 HD13 ILE 10 9.804 -5.514 3.160 97 H THR 11 HN THR 11 9.640 -3.136 -1.008 98 HA THR 11 HA THR 11 10.835 -1.467 1.113 99 HB THR 11 HB THR 11 10.274 -0.613 -1.771 100 HG1 THR 11 HG1 THR 11 12.077 -2.372 -0.937 101 HG21 THR 11 HG21 THR 11 11.911 1.151 -1.284 102 HG22 THR 11 HG22 THR 11 12.177 0.489 0.329 103 HG23 THR 11 HG23 THR 11 10.614 1.206 -0.083 104 H ILE 12 HN ILE 12 9.430 -0.283 2.281 105 HA ILE 12 HA ILE 12 6.587 -0.276 1.655 106 HB ILE 12 HB ILE 12 7.890 1.228 3.963 107 HG12 ILE 12 HG12 ILE 12 8.640 -1.126 4.096 108 HG13 ILE 12 HG11 ILE 12 7.515 -0.758 5.395 109 HG21 ILE 12 HG21 ILE 12 5.551 1.838 3.511 110 HG22 ILE 12 HG22 ILE 12 5.680 0.990 5.051 111 HG23 ILE 12 HG23 ILE 12 5.060 0.147 3.630 112 HD11 ILE 12 HD11 ILE 12 6.864 -2.276 2.871 113 HD12 ILE 12 HD12 ILE 12 5.741 -1.926 4.192 114 HD13 ILE 12 HD13 ILE 12 7.141 -2.959 4.471 115 H GLN 13 HN GLN 13 5.625 1.255 0.515 116 HA GLN 13 HA GLN 13 6.719 3.915 0.110 117 HB2 GLN 13 HB2 GLN 13 4.323 2.468 -1.071 118 HB3 GLN 13 HB1 GLN 13 4.490 4.213 -1.240 119 HG2 GLN 13 HG2 GLN 13 5.320 3.073 -3.230 120 HG3 GLN 13 HG1 GLN 13 6.630 3.915 -2.403 121 HE21 GLN 13 HE21 GLN 13 8.299 2.659 -3.168 122 HE22 GLN 13 HE22 GLN 13 8.493 0.985 -2.783 123 H THR 14 HN THR 14 6.602 4.931 1.921 124 HA THR 14 HA THR 14 4.171 5.239 3.515 125 HB THR 14 HB THR 14 5.623 6.962 4.745 126 HG1 THR 14 HG1 THR 14 7.109 6.822 2.634 127 HG21 THR 14 HG21 THR 14 6.730 4.129 4.517 128 HG22 THR 14 HG22 THR 14 5.430 4.649 5.594 129 HG23 THR 14 HG23 THR 14 7.067 5.257 5.834 130 H LEU 15 HN LEU 15 2.913 7.232 3.586 131 HA LEU 15 HA LEU 15 2.876 8.575 0.986 132 HB2 LEU 15 HB2 LEU 15 0.800 7.539 1.839 133 HB3 LEU 15 HB1 LEU 15 0.863 8.560 3.267 134 HG LEU 15 HG LEU 15 0.561 10.577 1.813 135 HD11 LEU 15 HD11 LEU 15 0.105 8.624 -0.458 136 HD12 LEU 15 HD12 LEU 15 1.523 9.654 -0.266 137 HD13 LEU 15 HD13 LEU 15 -0.056 10.377 -0.516 138 HD21 LEU 15 HD21 LEU 15 -1.383 9.552 2.899 139 HD22 LEU 15 HD22 LEU 15 -1.624 8.493 1.508 140 HD23 LEU 15 HD23 LEU 15 -1.821 10.239 1.335 141 H LYS 16 HN LYS 16 4.275 10.298 0.976 142 HA LYS 16 HA LYS 16 4.389 12.243 3.101 143 HB2 LYS 16 HB2 LYS 16 6.363 11.715 1.667 144 HB3 LYS 16 HB1 LYS 16 5.499 12.323 0.257 145 HG2 LYS 16 HG2 LYS 16 5.436 14.587 1.304 146 HG3 LYS 16 HG1 LYS 16 6.337 13.955 2.688 147 HD2 LYS 16 HD2 LYS 16 8.245 13.421 1.218 148 HD3 LYS 16 HD1 LYS 16 7.345 14.004 -0.186 149 HE2 LYS 16 HE2 LYS 16 7.342 16.281 0.743 150 HE3 LYS 16 HE1 LYS 16 8.179 15.713 2.194 151 HZ1 LYS 16 HZ1 LYS 16 10.056 15.086 0.809 152 HZ2 LYS 16 HZ2 LYS 16 9.703 16.730 0.626 153 HZ3 LYS 16 HZ3 LYS 16 9.251 15.627 -0.575 154 H GLN 17 HN GLN 17 2.321 13.063 3.327 155 HA GLN 17 HA GLN 17 0.845 14.296 1.172 156 HB2 GLN 17 HB2 GLN 17 0.608 14.557 4.209 157 HB3 GLN 17 HB1 GLN 17 -0.546 15.224 3.051 158 HG2 GLN 17 HG2 GLN 17 -1.153 12.989 2.297 159 HG3 GLN 17 HG1 GLN 17 0.101 12.270 3.312 160 HE21 GLN 17 HE21 GLN 17 -2.987 13.926 3.323 161 HE22 GLN 17 HE22 GLN 17 -3.467 13.451 4.912 162 H THR 18 HN THR 18 2.166 15.743 0.147 163 HA THR 18 HA THR 18 3.867 17.630 1.602 164 HB THR 18 HB THR 18 3.619 17.289 -1.434 165 HG1 THR 18 HG1 THR 18 4.148 15.281 -0.178 166 HG21 THR 18 HG21 THR 18 5.959 18.217 0.278 167 HG22 THR 18 HG22 THR 18 4.914 19.272 -0.676 168 HG23 THR 18 HG23 THR 18 5.948 18.090 -1.483 169 H ARG 19 HN ARG 19 3.779 19.984 0.974 170 HA ARG 19 HA ARG 19 1.202 20.842 -0.183 171 HB2 ARG 19 HB2 ARG 19 1.368 21.167 2.325 172 HB3 ARG 19 HB1 ARG 19 2.701 22.282 2.043 173 HG2 ARG 19 HG2 ARG 19 1.239 23.819 0.852 174 HG3 ARG 19 HG1 ARG 19 -0.102 22.672 0.924 175 HD2 ARG 19 HD2 ARG 19 -0.404 24.425 2.583 176 HD3 ARG 19 HD1 ARG 19 -0.114 22.882 3.391 177 HE ARG 19 HE ARG 19 2.330 24.257 3.074 178 HH11 ARG 19 HH11 ARG 19 -0.607 24.439 4.972 179 HH12 ARG 19 HH12 ARG 19 0.161 25.240 6.304 180 HH21 ARG 19 HH21 ARG 19 3.332 25.295 4.825 181 HH22 ARG 19 HH22 ARG 19 2.396 25.715 6.221 182 H ASP 20 HN ASP 20 1.250 22.910 -1.214 183 HA ASP 20 HA ASP 20 3.771 23.429 -2.697 184 HB2 ASP 20 HB2 ASP 20 1.765 22.594 -4.013 185 HB3 ASP 20 HB1 ASP 20 0.866 24.009 -3.493 186 H ILE 21 HN ILE 21 4.179 25.759 -3.232 187 HA ILE 21 HA ILE 21 3.967 27.513 -1.081 188 HB ILE 21 HB ILE 21 5.711 27.510 -2.883 189 HG12 ILE 21 HG12 ILE 21 4.416 30.241 -2.409 190 HG13 ILE 21 HG11 ILE 21 5.521 29.435 -1.302 191 HG21 ILE 21 HG21 ILE 21 5.319 28.681 -5.011 192 HG22 ILE 21 HG22 ILE 21 3.628 28.934 -4.578 193 HG23 ILE 21 HG23 ILE 21 4.235 27.297 -4.844 194 HD11 ILE 21 HD11 ILE 21 6.647 31.181 -2.544 195 HD12 ILE 21 HD12 ILE 21 6.192 30.429 -4.071 196 HD13 ILE 21 HD13 ILE 21 7.307 29.605 -2.979 197 H THR 22 HN THR 22 1.412 26.786 -3.249 198 HA THR 22 HA THR 22 0.089 29.401 -2.815 199 HB THR 22 HB THR 22 -1.378 28.838 -4.744 200 HG1 THR 22 HG1 THR 22 0.375 26.731 -5.458 201 HG21 THR 22 HG21 THR 22 0.239 29.197 -6.558 202 HG22 THR 22 HG22 THR 22 1.568 28.727 -5.497 203 HG23 THR 22 HG23 THR 22 0.652 30.202 -5.165 204 H GLY 23 HN GLY 23 0.354 26.314 -1.815 205 HA2 GLY 23 HA2 GLY 23 -0.624 25.603 0.223 206 HA3 GLY 23 HA1 GLY 23 -2.053 26.551 -0.135 207 H GLU 24 HN GLU 24 -0.585 24.249 -2.431 208 HA GLU 24 HA GLU 24 -3.115 22.758 -2.498 209 HB2 GLU 24 HB2 GLU 24 -0.680 22.547 -4.334 210 HB3 GLU 24 HB1 GLU 24 -2.264 21.818 -4.594 211 HG2 GLU 24 HG2 GLU 24 -1.656 24.789 -4.584 212 HG3 GLU 24 HG1 GLU 24 -1.895 23.785 -6.012 213 H ILE 25 HN ILE 25 -3.227 20.665 -1.710 214 HA ILE 25 HA ILE 25 -0.817 19.498 -0.509 215 HB ILE 25 HB ILE 25 -3.660 18.386 -0.413 216 HG12 ILE 25 HG12 ILE 25 -3.545 20.613 0.702 217 HG13 ILE 25 HG11 ILE 25 -3.798 19.325 1.873 218 HG21 ILE 25 HG21 ILE 25 -1.963 16.653 -0.020 219 HG22 ILE 25 HG22 ILE 25 -2.806 17.011 1.485 220 HG23 ILE 25 HG23 ILE 25 -1.185 17.650 1.216 221 HD11 ILE 25 HD11 ILE 25 -1.168 20.701 1.318 222 HD12 ILE 25 HD12 ILE 25 -1.440 19.429 2.515 223 HD13 ILE 25 HD13 ILE 25 -2.241 20.989 2.685 224 H LEU 26 HN LEU 26 0.420 18.212 -1.685 225 HA LEU 26 HA LEU 26 -0.695 16.556 -3.859 226 HB2 LEU 26 HB2 LEU 26 2.246 17.240 -3.353 227 HB3 LEU 26 HB1 LEU 26 1.586 16.408 -4.746 228 HG LEU 26 HG LEU 26 2.121 18.548 -5.538 229 HD11 LEU 26 HD11 LEU 26 -0.083 17.849 -6.274 230 HD12 LEU 26 HD12 LEU 26 0.047 19.601 -6.181 231 HD13 LEU 26 HD13 LEU 26 -0.831 18.718 -4.930 232 HD21 LEU 26 HD21 LEU 26 1.548 20.686 -4.468 233 HD22 LEU 26 HD22 LEU 26 2.557 19.683 -3.429 234 HD23 LEU 26 HD23 LEU 26 0.827 19.823 -3.106 235 H GLU 27 HN GLU 27 -1.265 14.644 -2.958 236 HA GLU 27 HA GLU 27 0.282 13.368 -0.873 237 HB2 GLU 27 HB2 GLU 27 -1.990 12.227 -2.579 238 HB3 GLU 27 HB1 GLU 27 -1.275 11.461 -1.174 239 HG2 GLU 27 HG2 GLU 27 -3.156 12.336 -0.214 240 HG3 GLU 27 HG1 GLU 27 -2.038 13.661 0.070 241 H THR 28 HN THR 28 2.085 12.356 -1.286 242 HA THR 28 HA THR 28 2.640 11.086 -3.898 243 HB THR 28 HB THR 28 5.054 11.948 -3.637 244 HG1 THR 28 HG1 THR 28 3.755 13.558 -1.694 245 HG21 THR 28 HG21 THR 28 2.912 14.044 -4.132 246 HG22 THR 28 HG22 THR 28 3.548 12.910 -5.326 247 HG23 THR 28 HG23 THR 28 4.598 14.158 -4.647 248 H TRP 29 HN TRP 29 4.285 9.437 -3.715 249 HA TRP 29 HA TRP 29 4.166 8.122 -1.068 250 HB2 TRP 29 HB2 TRP 29 4.218 6.906 -3.865 251 HB3 TRP 29 HB1 TRP 29 4.378 5.969 -2.381 252 HD1 TRP 29 HD1 TRP 29 1.764 7.779 -4.495 253 HE1 TRP 29 HE1 TRP 29 -0.571 7.314 -3.517 254 HE3 TRP 29 HE3 TRP 29 3.134 5.475 -0.147 255 HZ2 TRP 29 HZ2 TRP 29 -1.689 6.135 -1.214 256 HZ3 TRP 29 HZ3 TRP 29 1.374 4.708 1.393 257 HH2 TRP 29 HH2 TRP 29 -0.996 5.031 0.875 258 H GLU 30 HN GLU 30 5.968 8.529 -0.112 259 HA GLU 30 HA GLU 30 8.548 8.620 -1.539 260 HB2 GLU 30 HB2 GLU 30 9.536 9.303 0.662 261 HB3 GLU 30 HB1 GLU 30 8.296 10.408 0.089 262 HG2 GLU 30 HG2 GLU 30 6.727 9.670 1.720 263 HG3 GLU 30 HG1 GLU 30 7.695 8.251 2.123 264 H ASP 31 HN ASP 31 9.856 6.901 -1.597 265 HA ASP 31 HA ASP 31 9.104 4.377 -0.490 266 HB2 ASP 31 HB2 ASP 31 11.171 3.487 -1.415 267 HB3 ASP 31 HB1 ASP 31 10.476 4.597 -2.590 268 H GLY 32 HN GLY 32 10.153 3.226 1.215 269 HA2 GLY 32 HA2 GLY 32 11.243 5.025 3.312 270 HA3 GLY 32 HA1 GLY 32 10.085 3.731 3.601 271 H HIS 33 HN HIS 33 10.804 1.744 3.984 272 HA HIS 33 HA HIS 33 13.746 1.331 4.088 273 HB2 HIS 33 HB2 HIS 33 11.559 0.426 6.031 274 HB3 HIS 33 HB1 HIS 33 13.248 -0.069 6.126 275 HD1 HIS 33 HD1 HIS 33 10.942 2.667 7.045 276 HD2 HIS 33 HD2 HIS 33 15.046 2.057 6.848 277 HE1 HIS 33 HE1 HIS 33 11.959 4.577 8.320 278 HE2 HIS 33 HE2 HIS 33 14.442 4.289 7.997 279 H THR 34 HN THR 34 14.482 -0.534 3.092 280 HA THR 34 HA THR 34 12.534 -2.416 2.002 281 HB THR 34 HB THR 34 15.561 -2.360 1.612 282 HG1 THR 34 HG1 THR 34 13.932 -1.439 -0.432 283 HG21 THR 34 HG21 THR 34 15.074 -3.654 -0.434 284 HG22 THR 34 HG22 THR 34 13.348 -3.609 -0.063 285 HG23 THR 34 HG23 THR 34 14.455 -4.507 0.984 286 H LEU 35 HN LEU 35 11.865 -3.668 3.759 287 HA LEU 35 HA LEU 35 13.938 -5.005 5.387 288 HB2 LEU 35 HB2 LEU 35 12.194 -5.298 7.133 289 HB3 LEU 35 HB1 LEU 35 12.577 -3.620 6.817 290 HG LEU 35 HG LEU 35 10.124 -4.873 5.533 291 HD11 LEU 35 HD11 LEU 35 9.909 -5.405 7.915 292 HD12 LEU 35 HD12 LEU 35 8.755 -4.159 7.449 293 HD13 LEU 35 HD13 LEU 35 10.213 -3.718 8.343 294 HD21 LEU 35 HD21 LEU 35 10.807 -2.641 4.756 295 HD22 LEU 35 HD22 LEU 35 10.753 -2.032 6.409 296 HD23 LEU 35 HD23 LEU 35 9.270 -2.565 5.614 297 H TRP 36 HN TRP 36 13.171 -7.066 6.331 298 HA TRP 36 HA TRP 36 12.812 -8.962 4.250 299 HB2 TRP 36 HB2 TRP 36 13.184 -9.079 7.240 300 HB3 TRP 36 HB1 TRP 36 12.750 -10.537 6.375 301 HD1 TRP 36 HD1 TRP 36 14.822 -11.965 6.175 302 HE1 TRP 36 HE1 TRP 36 17.308 -11.632 5.622 303 HE3 TRP 36 HE3 TRP 36 14.869 -6.890 5.586 304 HZ2 TRP 36 HZ2 TRP 36 19.055 -9.528 4.999 305 HZ3 TRP 36 HZ3 TRP 36 16.995 -5.786 5.005 306 HH2 TRP 36 HH2 TRP 36 19.048 -7.086 4.713 307 H ALA 37 HN ALA 37 11.109 -9.878 3.554 308 HA ALA 37 HA ALA 37 8.619 -10.199 5.135 309 HB1 ALA 37 HB1 ALA 37 8.742 -9.234 2.255 310 HB2 ALA 37 HB2 ALA 37 8.208 -8.312 3.659 311 HB3 ALA 37 HB3 ALA 37 7.264 -9.688 3.109 312 H SER 38 HN SER 38 7.092 -11.896 4.071 313 HA SER 38 HA SER 38 8.390 -13.648 2.106 314 HB2 SER 38 HB2 SER 38 6.453 -14.412 4.343 315 HB3 SER 38 HB1 SER 38 7.070 -15.511 3.106 316 HG SER 38 HG SER 38 8.147 -15.299 5.314 317 H VAL 39 HN VAL 39 7.456 -12.897 0.265 318 HA VAL 39 HA VAL 39 4.689 -11.931 0.245 319 HB VAL 39 HB VAL 39 6.857 -11.805 -1.907 320 HG11 VAL 39 HG11 VAL 39 4.181 -10.351 -1.769 321 HG12 VAL 39 HG12 VAL 39 4.579 -11.679 -2.860 322 HG13 VAL 39 HG13 VAL 39 5.418 -10.140 -3.015 323 HG21 VAL 39 HG21 VAL 39 7.504 -10.521 0.094 324 HG22 VAL 39 HG22 VAL 39 5.965 -9.659 0.056 325 HG23 VAL 39 HG23 VAL 39 7.131 -9.436 -1.250 326 H ASN 40 HN ASN 40 3.345 -13.663 0.101 327 HA ASN 40 HA ASN 40 3.779 -15.682 -2.004 328 HB2 ASN 40 HB2 ASN 40 2.183 -15.941 0.595 329 HB3 ASN 40 HB1 ASN 40 2.421 -17.204 -0.611 330 HD21 ASN 40 HD21 ASN 40 3.897 -15.393 1.978 331 HD22 ASN 40 HD22 ASN 40 5.295 -16.391 2.155 332 H MET 41 HN MET 41 2.674 -14.885 -3.705 333 HA MET 41 HA MET 41 0.127 -13.701 -3.822 334 HB2 MET 41 HB2 MET 41 1.573 -15.539 -5.787 335 HB3 MET 41 HB1 MET 41 0.083 -14.688 -6.172 336 HG2 MET 41 HG2 MET 41 2.615 -13.256 -5.348 337 HG3 MET 41 HG1 MET 41 2.219 -13.641 -7.025 338 HE1 MET 41 HE1 MET 41 0.228 -12.530 -8.387 339 HE2 MET 41 HE2 MET 41 -0.979 -11.467 -7.668 340 HE3 MET 41 HE3 MET 41 -0.929 -13.174 -7.222 341 H VAL 42 HN VAL 42 -1.781 -14.571 -3.158 342 HA VAL 42 HA VAL 42 -1.949 -17.263 -2.228 343 HB VAL 42 HB VAL 42 -4.183 -16.810 -1.497 344 HG11 VAL 42 HG11 VAL 42 -3.938 -14.758 -0.136 345 HG12 VAL 42 HG12 VAL 42 -2.569 -14.261 -1.133 346 HG13 VAL 42 HG13 VAL 42 -2.456 -15.717 -0.144 347 HG21 VAL 42 HG21 VAL 42 -5.174 -15.828 -3.497 348 HG22 VAL 42 HG22 VAL 42 -4.228 -14.353 -3.291 349 HG23 VAL 42 HG23 VAL 42 -5.483 -14.767 -2.121 350 H SER 43 HN SER 43 -3.410 -18.876 -2.922 351 HA SER 43 HA SER 43 -3.831 -19.058 -5.796 352 HB2 SER 43 HB2 SER 43 -2.959 -20.990 -4.433 353 HB3 SER 43 HB1 SER 43 -4.501 -21.054 -3.584 354 HG SER 43 HG SER 43 -4.176 -22.508 -5.454 355 H SER 44 HN SER 44 -6.047 -20.164 -6.344 356 HA SER 44 HA SER 44 -8.097 -18.283 -6.136 357 HB2 SER 44 HB2 SER 44 -8.405 -21.239 -6.796 358 HB3 SER 44 HB1 SER 44 -9.464 -19.922 -7.311 359 HG SER 44 HG SER 44 -8.186 -19.677 -8.946 360 H LYS 45 HN LYS 45 -7.301 -20.995 -4.094 361 HA LYS 45 HA LYS 45 -9.621 -21.725 -2.835 362 HB2 LYS 45 HB2 LYS 45 -8.211 -22.444 -0.922 363 HB3 LYS 45 HB1 LYS 45 -7.519 -22.898 -2.474 364 HG2 LYS 45 HG2 LYS 45 -5.839 -21.186 -2.348 365 HG3 LYS 45 HG1 LYS 45 -6.615 -20.423 -0.958 366 HD2 LYS 45 HD2 LYS 45 -5.246 -23.145 -0.997 367 HD3 LYS 45 HD1 LYS 45 -4.617 -21.665 -0.268 368 HE2 LYS 45 HE2 LYS 45 -6.575 -21.659 1.294 369 HE3 LYS 45 HE1 LYS 45 -7.078 -23.208 0.613 370 HZ1 LYS 45 HZ1 LYS 45 -5.022 -24.176 1.389 371 HZ2 LYS 45 HZ2 LYS 45 -5.858 -23.457 2.670 372 HZ3 LYS 45 HZ3 LYS 45 -4.510 -22.684 2.004 373 H GLU 46 HN GLU 46 -7.582 -18.943 -1.981 374 HA GLU 46 HA GLU 46 -8.824 -18.290 0.483 375 HB2 GLU 46 HB2 GLU 46 -7.179 -16.567 -1.420 376 HB3 GLU 46 HB1 GLU 46 -7.658 -16.061 0.201 377 HG2 GLU 46 HG2 GLU 46 -5.891 -18.430 -0.484 378 HG3 GLU 46 HG1 GLU 46 -5.344 -16.877 0.145 379 H ALA 47 HN ALA 47 -9.309 -17.190 -2.812 380 HA ALA 47 HA ALA 47 -11.248 -15.159 -2.333 381 HB1 ALA 47 HB1 ALA 47 -11.606 -15.238 -4.768 382 HB2 ALA 47 HB2 ALA 47 -10.688 -16.742 -4.872 383 HB3 ALA 47 HB3 ALA 47 -9.881 -15.245 -4.394 384 H ILE 48 HN ILE 48 -11.471 -18.557 -3.338 385 HA ILE 48 HA ILE 48 -14.255 -18.794 -3.628 386 HB ILE 48 HB ILE 48 -12.258 -20.960 -2.817 387 HG12 ILE 48 HG12 ILE 48 -13.346 -20.274 -5.588 388 HG13 ILE 48 HG11 ILE 48 -11.756 -19.813 -4.998 389 HG21 ILE 48 HG21 ILE 48 -13.914 -22.601 -3.687 390 HG22 ILE 48 HG22 ILE 48 -15.071 -21.294 -3.939 391 HG23 ILE 48 HG23 ILE 48 -14.550 -21.703 -2.304 392 HD11 ILE 48 HD11 ILE 48 -11.614 -21.718 -6.479 393 HD12 ILE 48 HD12 ILE 48 -12.727 -22.633 -5.462 394 HD13 ILE 48 HD13 ILE 48 -11.136 -22.180 -4.847 395 H SER 49 HN SER 49 -12.201 -19.261 -0.769 396 HA SER 49 HA SER 49 -14.225 -20.291 0.958 397 HB2 SER 49 HB2 SER 49 -11.528 -19.042 1.639 398 HB3 SER 49 HB1 SER 49 -12.534 -19.972 2.756 399 HG SER 49 HG SER 49 -10.797 -20.859 0.908 400 H SER 50 HN SER 50 -13.022 -17.021 0.315 401 HA SER 50 HA SER 50 -14.586 -15.793 2.441 402 HB2 SER 50 HB2 SER 50 -13.739 -13.651 1.475 403 HB3 SER 50 HB1 SER 50 -12.437 -14.790 1.798 404 HG SER 50 HG SER 50 -12.123 -15.075 -0.303 405 H GLY 51 HN GLY 51 -14.973 -16.478 -0.972 406 HA2 GLY 51 HA2 GLY 51 -17.155 -16.681 -1.955 407 HA3 GLY 51 HA1 GLY 51 -17.719 -15.329 -0.981 408 H ALA 52 HN ALA 52 -16.346 -13.260 -1.373 409 HA ALA 52 HA ALA 52 -15.254 -12.821 -4.020 410 HB1 ALA 52 HB1 ALA 52 -16.938 -11.140 -4.717 411 HB2 ALA 52 HB2 ALA 52 -17.907 -11.501 -3.283 412 HB3 ALA 52 HB3 ALA 52 -17.668 -12.732 -4.523 413 H GLU 53 HN GLU 53 -14.846 -12.431 -0.960 414 HA GLU 53 HA GLU 53 -14.503 -9.552 -0.652 415 HB2 GLU 53 HB2 GLU 53 -15.378 -10.922 1.216 416 HB3 GLU 53 HB1 GLU 53 -13.882 -11.854 1.243 417 HG2 GLU 53 HG2 GLU 53 -12.644 -9.788 1.863 418 HG3 GLU 53 HG1 GLU 53 -14.172 -8.900 1.886 419 H LEU 54 HN LEU 54 -12.388 -12.437 -0.335 420 HA LEU 54 HA LEU 54 -10.011 -10.958 -1.125 421 HB2 LEU 54 HB2 LEU 54 -10.463 -13.924 -0.582 422 HB3 LEU 54 HB1 LEU 54 -8.908 -13.249 -1.052 423 HG LEU 54 HG LEU 54 -10.409 -12.581 1.520 424 HD11 LEU 54 HD11 LEU 54 -7.940 -14.312 1.131 425 HD12 LEU 54 HD12 LEU 54 -9.556 -14.877 1.559 426 HD13 LEU 54 HD13 LEU 54 -8.659 -13.860 2.682 427 HD21 LEU 54 HD21 LEU 54 -9.069 -10.674 0.761 428 HD22 LEU 54 HD22 LEU 54 -7.643 -11.700 0.595 429 HD23 LEU 54 HD23 LEU 54 -8.334 -11.399 2.192 430 H ALA 55 HN ALA 55 -8.733 -11.781 -2.987 431 HA ALA 55 HA ALA 55 -10.439 -12.476 -5.308 432 HB1 ALA 55 HB1 ALA 55 -8.245 -10.364 -5.213 433 HB2 ALA 55 HB2 ALA 55 -9.980 -10.053 -5.300 434 HB3 ALA 55 HB3 ALA 55 -9.164 -10.842 -6.647 435 H ILE 56 HN ILE 56 -9.391 -13.618 -6.995 436 HA ILE 56 HA ILE 56 -7.121 -15.233 -6.312 437 HB ILE 56 HB ILE 56 -8.264 -14.754 -9.114 438 HG12 ILE 56 HG12 ILE 56 -9.066 -16.915 -7.100 439 HG13 ILE 56 HG11 ILE 56 -10.059 -15.536 -7.567 440 HG21 ILE 56 HG21 ILE 56 -6.030 -15.811 -9.126 441 HG22 ILE 56 HG22 ILE 56 -7.259 -16.948 -9.678 442 HG23 ILE 56 HG23 ILE 56 -6.604 -17.081 -8.043 443 HD11 ILE 56 HD11 ILE 56 -10.160 -16.412 -9.865 444 HD12 ILE 56 HD12 ILE 56 -10.796 -17.546 -8.676 445 HD13 ILE 56 HD13 ILE 56 -9.194 -17.804 -9.364 446 H GLY 57 HN GLY 57 -5.140 -14.338 -6.130 447 HA2 GLY 57 HA2 GLY 57 -3.215 -13.280 -7.148 448 HA3 GLY 57 HA1 GLY 57 -4.292 -12.166 -7.980 449 H THR 58 HN THR 58 -5.366 -12.668 -4.808 450 HA THR 58 HA THR 58 -4.508 -10.185 -3.743 451 HB THR 58 HB THR 58 -5.605 -12.683 -2.383 452 HG1 THR 58 HG1 THR 58 -6.833 -11.096 -3.842 453 HG21 THR 58 HG21 THR 58 -4.278 -11.478 -0.682 454 HG22 THR 58 HG22 THR 58 -6.001 -11.315 -0.356 455 HG23 THR 58 HG23 THR 58 -5.115 -9.971 -1.079 456 H VAL 59 HN VAL 59 -2.585 -9.639 -3.007 457 HA VAL 59 HA VAL 59 -0.420 -11.563 -2.788 458 HB VAL 59 HB VAL 59 -0.340 -8.533 -2.446 459 HG11 VAL 59 HG11 VAL 59 1.653 -9.670 -1.578 460 HG12 VAL 59 HG12 VAL 59 2.054 -8.769 -3.041 461 HG13 VAL 59 HG13 VAL 59 1.860 -10.521 -3.110 462 HG21 VAL 59 HG21 VAL 59 0.028 -10.123 -5.016 463 HG22 VAL 59 HG22 VAL 59 0.287 -8.392 -4.833 464 HG23 VAL 59 HG23 VAL 59 -1.329 -9.063 -4.632 465 H ARG 60 HN ARG 60 -0.455 -12.637 -0.826 466 HA ARG 60 HA ARG 60 -0.834 -11.139 1.675 467 HB2 ARG 60 HB2 ARG 60 -1.919 -13.337 1.499 468 HB3 ARG 60 HB1 ARG 60 -0.371 -14.109 1.169 469 HG2 ARG 60 HG2 ARG 60 0.404 -13.744 3.403 470 HG3 ARG 60 HG1 ARG 60 -0.927 -12.636 3.766 471 HD2 ARG 60 HD2 ARG 60 -1.308 -15.590 3.129 472 HD3 ARG 60 HD1 ARG 60 -1.167 -14.939 4.765 473 HE ARG 60 HE ARG 60 -3.173 -13.509 4.117 474 HH11 ARG 60 HH11 ARG 60 -2.708 -16.705 2.726 475 HH12 ARG 60 HH12 ARG 60 -4.411 -17.021 2.629 476 HH21 ARG 60 HH21 ARG 60 -5.395 -13.947 3.932 477 HH22 ARG 60 HH22 ARG 60 -5.920 -15.476 3.293 478 H ILE 61 HN ILE 61 0.831 -10.709 3.081 479 HA ILE 61 HA ILE 61 3.622 -11.181 2.222 480 HB ILE 61 HB ILE 61 2.448 -8.410 2.774 481 HG12 ILE 61 HG12 ILE 61 3.619 -9.496 0.165 482 HG13 ILE 61 HG11 ILE 61 1.895 -9.387 0.501 483 HG21 ILE 61 HG21 ILE 61 5.320 -9.179 2.098 484 HG22 ILE 61 HG22 ILE 61 4.749 -8.569 3.651 485 HG23 ILE 61 HG23 ILE 61 4.707 -7.523 2.234 486 HD11 ILE 61 HD11 ILE 61 3.825 -7.099 0.248 487 HD12 ILE 61 HD12 ILE 61 2.124 -6.946 0.694 488 HD13 ILE 61 HD13 ILE 61 2.569 -7.578 -0.889 489 H TRP 62 HN TRP 62 4.643 -11.943 3.987 490 HA TRP 62 HA TRP 62 3.635 -11.300 6.690 491 HB2 TRP 62 HB2 TRP 62 5.414 -13.572 5.706 492 HB3 TRP 62 HB1 TRP 62 4.933 -13.332 7.384 493 HD1 TRP 62 HD1 TRP 62 3.434 -14.275 3.961 494 HE1 TRP 62 HE1 TRP 62 1.234 -15.523 4.378 495 HE3 TRP 62 HE3 TRP 62 3.057 -13.639 9.022 496 HZ2 TRP 62 HZ2 TRP 62 -0.439 -16.164 6.535 497 HZ3 TRP 62 HZ3 TRP 62 1.110 -14.597 10.191 498 HH2 TRP 62 HH2 TRP 62 -0.611 -15.837 8.966 499 H ILE 63 HN ILE 63 4.752 -9.848 7.816 500 HA ILE 63 HA ILE 63 7.701 -9.589 7.464 501 HB ILE 63 HB ILE 63 7.488 -7.161 8.033 502 HG12 ILE 63 HG12 ILE 63 4.473 -7.542 7.657 503 HG13 ILE 63 HG11 ILE 63 5.264 -7.300 9.211 504 HG21 ILE 63 HG21 ILE 63 7.688 -7.794 5.664 505 HG22 ILE 63 HG22 ILE 63 6.681 -6.358 5.837 506 HG23 ILE 63 HG23 ILE 63 5.931 -7.926 5.533 507 HD11 ILE 63 HD11 ILE 63 4.244 -5.263 8.432 508 HD12 ILE 63 HD12 ILE 63 5.165 -5.335 6.932 509 HD13 ILE 63 HD13 ILE 63 5.996 -5.079 8.469 510 H ARG 64 HN ARG 64 8.805 -9.235 9.518 511 HA ARG 64 HA ARG 64 7.650 -10.110 11.904 512 HB2 ARG 64 HB2 ARG 64 9.991 -8.195 11.538 513 HB3 ARG 64 HB1 ARG 64 9.560 -8.957 13.070 514 HG2 ARG 64 HG2 ARG 64 9.892 -11.193 11.994 515 HG3 ARG 64 HG1 ARG 64 10.439 -10.368 10.535 516 HD2 ARG 64 HD2 ARG 64 12.384 -11.068 11.730 517 HD3 ARG 64 HD1 ARG 64 12.271 -9.318 11.924 518 HE ARG 64 HE ARG 64 11.002 -10.276 14.130 519 HH11 ARG 64 HH11 ARG 64 14.202 -10.827 12.787 520 HH12 ARG 64 HH12 ARG 64 14.908 -11.212 14.323 521 HH21 ARG 64 HH21 ARG 64 11.935 -10.779 16.125 522 HH22 ARG 64 HH22 ARG 64 13.619 -11.187 16.214 523 H TYR 65 HN TYR 65 7.400 -8.743 13.963 524 HA TYR 65 HA TYR 65 5.003 -7.345 13.644 525 HB2 TYR 65 HB2 TYR 65 5.798 -8.558 15.736 526 HB3 TYR 65 HB1 TYR 65 6.837 -7.179 16.083 527 HD1 TYR 65 HD2 TYR 65 3.357 -8.387 15.992 528 HD2 TYR 65 HD1 TYR 65 5.843 -5.028 16.880 529 HE1 TYR 65 HE2 TYR 65 1.480 -7.302 17.141 530 HE2 TYR 65 HE1 TYR 65 3.959 -3.948 18.034 531 HH TYR 65 HH TYR 65 1.469 -4.042 17.984 532 H ARG 66 HN ARG 66 4.927 -5.529 12.469 533 HA ARG 66 HA ARG 66 6.761 -3.278 13.077 534 HB2 ARG 66 HB2 ARG 66 6.969 -4.445 10.766 535 HB3 ARG 66 HB1 ARG 66 5.391 -3.765 10.400 536 HG2 ARG 66 HG2 ARG 66 6.991 -2.316 9.417 537 HG3 ARG 66 HG1 ARG 66 6.384 -1.468 10.839 538 HD2 ARG 66 HD2 ARG 66 8.399 -2.136 12.088 539 HD3 ARG 66 HD1 ARG 66 8.998 -3.003 10.667 540 HE ARG 66 HE ARG 66 8.438 -0.108 10.482 541 HH11 ARG 66 HH11 ARG 66 10.823 -2.691 10.472 542 HH12 ARG 66 HH12 ARG 66 12.096 -1.672 9.894 543 HH21 ARG 66 HH21 ARG 66 10.133 1.212 9.730 544 HH22 ARG 66 HH22 ARG 66 11.707 0.535 9.492 545 H LYS 67 HN LYS 67 5.649 -1.832 14.230 546 HA LYS 67 HA LYS 67 2.832 -1.931 14.638 547 HB2 LYS 67 HB2 LYS 67 4.807 0.221 15.501 548 HB3 LYS 67 HB1 LYS 67 3.210 -0.060 16.198 549 HG2 LYS 67 HG2 LYS 67 3.952 -2.257 17.032 550 HG3 LYS 67 HG1 LYS 67 5.541 -2.007 16.304 551 HD2 LYS 67 HD2 LYS 67 4.309 -0.364 18.561 552 HD3 LYS 67 HD1 LYS 67 5.611 -1.549 18.718 553 HE2 LYS 67 HE2 LYS 67 5.747 1.084 17.198 554 HE3 LYS 67 HE1 LYS 67 6.523 0.720 18.739 555 HZ1 LYS 67 HZ1 LYS 67 8.065 0.575 16.886 556 HZ2 LYS 67 HZ2 LYS 67 7.117 -0.616 16.159 557 HZ3 LYS 67 HZ3 LYS 67 7.883 -0.932 17.629 558 H ASP 68 HN ASP 68 4.748 -0.128 12.411 559 HA ASP 68 HA ASP 68 2.947 2.186 12.287 560 HB2 ASP 68 HB2 ASP 68 4.738 3.158 10.794 561 HB3 ASP 68 HB1 ASP 68 5.274 2.766 12.423 562 H ILE 69 HN ILE 69 3.544 -0.719 10.490 563 HA ILE 69 HA ILE 69 2.653 0.156 7.916 564 HB ILE 69 HB ILE 69 2.495 -2.665 9.080 565 HG12 ILE 69 HG12 ILE 69 4.795 -1.858 9.114 566 HG13 ILE 69 HG11 ILE 69 4.627 -3.067 7.855 567 HG21 ILE 69 HG21 ILE 69 1.019 -2.486 7.140 568 HG22 ILE 69 HG22 ILE 69 2.433 -3.444 6.708 569 HG23 ILE 69 HG23 ILE 69 2.309 -1.765 6.169 570 HD11 ILE 69 HD11 ILE 69 4.792 -0.087 7.477 571 HD12 ILE 69 HD12 ILE 69 4.550 -1.260 6.178 572 HD13 ILE 69 HD13 ILE 69 6.035 -1.286 7.127 573 H ASN 70 HN ASN 70 0.655 0.405 7.125 574 HA ASN 70 HA ASN 70 -1.744 -0.619 8.401 575 HB2 ASN 70 HB2 ASN 70 -1.129 1.561 9.650 576 HB3 ASN 70 HB1 ASN 70 -1.418 2.410 8.133 577 HD21 ASN 70 HD21 ASN 70 -2.951 0.379 10.594 578 HD22 ASN 70 HD22 ASN 70 -4.557 0.962 10.329 579 H ALA 71 HN ALA 71 -3.713 0.263 7.044 580 HA ALA 71 HA ALA 71 -3.488 -0.430 4.379 581 HB1 ALA 71 HB1 ALA 71 -5.714 0.575 4.060 582 HB2 ALA 71 HB2 ALA 71 -5.545 1.443 5.590 583 HB3 ALA 71 HB3 ALA 71 -5.633 -0.318 5.582 584 H THR 72 HN THR 72 -2.783 2.618 5.887 585 HA THR 72 HA THR 72 -2.904 4.266 3.534 586 HB THR 72 HB THR 72 -1.899 6.010 5.137 587 HG1 THR 72 HG1 THR 72 -0.929 4.948 6.745 588 HG21 THR 72 HG21 THR 72 -3.976 6.272 6.451 589 HG22 THR 72 HG22 THR 72 -4.465 4.630 6.031 590 HG23 THR 72 HG23 THR 72 -4.346 5.862 4.773 591 H SER 73 HN SER 73 -0.704 1.966 4.197 592 HA SER 73 HA SER 73 1.393 3.425 2.689 593 HB2 SER 73 HB2 SER 73 2.973 1.615 3.538 594 HB3 SER 73 HB1 SER 73 2.357 2.692 4.786 595 HG SER 73 HG SER 73 0.797 0.469 4.389 596 H ARG 74 HN ARG 74 2.379 2.261 0.939 597 HA ARG 74 HA ARG 74 0.874 -0.073 -0.113 598 HB2 ARG 74 HB2 ARG 74 2.557 1.952 -1.669 599 HB3 ARG 74 HB1 ARG 74 1.714 0.562 -2.370 600 HG2 ARG 74 HG2 ARG 74 -0.430 1.527 -1.922 601 HG3 ARG 74 HG1 ARG 74 0.274 2.791 -0.909 602 HD2 ARG 74 HD2 ARG 74 -0.339 3.706 -3.074 603 HD3 ARG 74 HD1 ARG 74 1.413 3.742 -2.874 604 HE ARG 74 HE ARG 74 0.646 1.391 -4.237 605 HH11 ARG 74 HH11 ARG 74 0.968 4.857 -4.769 606 HH12 ARG 74 HH12 ARG 74 1.125 4.701 -6.488 607 HH21 ARG 74 HH21 ARG 74 0.817 1.215 -6.497 608 HH22 ARG 74 HH22 ARG 74 1.017 2.640 -7.459 609 H ILE 75 HN ILE 75 2.195 -1.734 -1.101 610 HA ILE 75 HA ILE 75 4.896 -1.947 0.087 611 HB ILE 75 HB ILE 75 3.028 -4.264 -0.583 612 HG12 ILE 75 HG12 ILE 75 1.951 -2.901 1.206 613 HG13 ILE 75 HG11 ILE 75 2.447 -4.475 1.803 614 HG21 ILE 75 HG21 ILE 75 5.375 -4.878 -0.511 615 HG22 ILE 75 HG22 ILE 75 4.556 -5.558 0.893 616 HG23 ILE 75 HG23 ILE 75 5.569 -4.126 1.074 617 HD11 ILE 75 HD11 ILE 75 3.864 -1.860 2.286 618 HD12 ILE 75 HD12 ILE 75 4.386 -3.439 2.881 619 HD13 ILE 75 HD13 ILE 75 2.860 -2.750 3.432 620 H LYS 76 HN LYS 76 6.232 -1.407 -1.676 621 HA LYS 76 HA LYS 76 5.798 -2.806 -4.241 622 HB2 LYS 76 HB2 LYS 76 6.428 -0.416 -4.420 623 HB3 LYS 76 HB1 LYS 76 7.926 -0.737 -3.549 624 HG2 LYS 76 HG2 LYS 76 8.684 -2.223 -5.378 625 HG3 LYS 76 HG1 LYS 76 7.161 -1.957 -6.233 626 HD2 LYS 76 HD2 LYS 76 8.939 -0.600 -7.213 627 HD3 LYS 76 HD1 LYS 76 7.711 0.434 -6.482 628 HE2 LYS 76 HE2 LYS 76 9.173 0.783 -4.516 629 HE3 LYS 76 HE1 LYS 76 10.388 -0.285 -5.218 630 HZ1 LYS 76 HZ1 LYS 76 10.646 1.255 -7.043 631 HZ2 LYS 76 HZ2 LYS 76 10.903 2.046 -5.574 632 HZ3 LYS 76 HZ3 LYS 76 9.449 2.268 -6.407 633 H VAL 77 HN VAL 77 6.565 -4.782 -4.328 634 HA VAL 77 HA VAL 77 8.425 -5.805 -2.407 635 HB VAL 77 HB VAL 77 7.119 -7.101 -4.832 636 HG11 VAL 77 HG11 VAL 77 9.137 -8.343 -4.294 637 HG12 VAL 77 HG12 VAL 77 7.727 -9.272 -3.783 638 HG13 VAL 77 HG13 VAL 77 8.685 -8.403 -2.582 639 HG21 VAL 77 HG21 VAL 77 5.569 -8.103 -3.210 640 HG22 VAL 77 HG22 VAL 77 5.526 -6.344 -3.093 641 HG23 VAL 77 HG23 VAL 77 6.391 -7.289 -1.880 642 H SER 78 HN SER 78 10.529 -6.059 -2.589 643 HA SER 78 HA SER 78 11.950 -4.682 -4.681 644 HB2 SER 78 HB2 SER 78 13.036 -6.098 -2.213 645 HB3 SER 78 HB1 SER 78 13.881 -4.891 -3.193 646 HG SER 78 HG SER 78 11.737 -3.674 -2.612 647 H THR 79 HN THR 79 11.281 -7.975 -4.012 648 HA THR 79 HA THR 79 12.983 -8.962 -6.154 649 HB THR 79 HB THR 79 14.646 -8.855 -4.381 650 HG1 THR 79 HG1 THR 79 14.653 -11.454 -4.109 651 HG21 THR 79 HG21 THR 79 13.190 -8.876 -2.397 652 HG22 THR 79 HG22 THR 79 14.448 -10.106 -2.263 653 HG23 THR 79 HG23 THR 79 12.804 -10.576 -2.689 654 H GLY 80 HN GLY 80 12.830 -11.575 -6.048 655 HA2 GLY 80 HA2 GLY 80 11.509 -13.467 -6.057 656 HA3 GLY 80 HA1 GLY 80 10.345 -12.635 -5.038 657 HA PRO 81 HA PRO 81 8.336 -13.230 -9.154 658 HB2 PRO 81 HB2 PRO 81 5.777 -13.534 -8.295 659 HB3 PRO 81 HB1 PRO 81 6.982 -14.817 -8.100 660 HG2 PRO 81 HG2 PRO 81 6.052 -12.773 -6.078 661 HG3 PRO 81 HG1 PRO 81 6.260 -14.527 -5.869 662 HD2 PRO 81 HD2 PRO 81 8.140 -12.717 -5.062 663 HD3 PRO 81 HD1 PRO 81 8.570 -14.351 -5.620 664 H LEU 82 HN LEU 82 7.715 -10.779 -6.743 665 HA LEU 82 HA LEU 82 6.222 -9.111 -8.690 666 HB2 LEU 82 HB2 LEU 82 6.037 -9.142 -5.654 667 HB3 LEU 82 HB1 LEU 82 5.183 -8.021 -6.706 668 HG LEU 82 HG LEU 82 4.751 -11.033 -6.586 669 HD11 LEU 82 HD11 LEU 82 2.974 -8.754 -5.664 670 HD12 LEU 82 HD12 LEU 82 3.881 -9.862 -4.633 671 HD13 LEU 82 HD13 LEU 82 2.568 -10.470 -5.630 672 HD21 LEU 82 HD21 LEU 82 2.856 -10.663 -8.131 673 HD22 LEU 82 HD22 LEU 82 4.390 -10.225 -8.877 674 HD23 LEU 82 HD23 LEU 82 3.305 -8.962 -8.288 675 H ALA 83 HN ALA 83 9.110 -9.322 -8.388 676 HA ALA 83 HA ALA 83 10.214 -7.089 -7.031 677 HB1 ALA 83 HB1 ALA 83 11.529 -9.051 -7.668 678 HB2 ALA 83 HB2 ALA 83 12.236 -7.580 -8.338 679 HB3 ALA 83 HB3 ALA 83 11.311 -8.667 -9.377 680 H GLY 84 HN GLY 84 9.163 -5.192 -7.512 681 HA2 GLY 84 HA2 GLY 84 9.607 -3.185 -8.912 682 HA3 GLY 84 HA1 GLY 84 9.241 -4.174 -10.316 683 H ARG 85 HN ARG 85 7.050 -5.428 -8.453 684 HA ARG 85 HA ARG 85 4.877 -3.735 -9.380 685 HB2 ARG 85 HB2 ARG 85 4.773 -6.248 -7.640 686 HB3 ARG 85 HB1 ARG 85 3.405 -5.482 -8.446 687 HG2 ARG 85 HG2 ARG 85 5.764 -6.812 -9.814 688 HG3 ARG 85 HG1 ARG 85 4.148 -7.498 -9.632 689 HD2 ARG 85 HD2 ARG 85 3.232 -5.656 -11.022 690 HD3 ARG 85 HD1 ARG 85 4.859 -5.002 -11.216 691 HE ARG 85 HE ARG 85 5.461 -6.992 -12.453 692 HH11 ARG 85 HH11 ARG 85 1.994 -6.547 -12.016 693 HH12 ARG 85 HH12 ARG 85 1.585 -7.505 -13.406 694 HH21 ARG 85 HH21 ARG 85 4.911 -8.216 -14.274 695 HH22 ARG 85 HH22 ARG 85 3.241 -8.435 -14.692 696 H VAL 86 HN VAL 86 3.800 -2.222 -8.180 697 HA VAL 86 HA VAL 86 4.559 -1.893 -5.340 698 HB VAL 86 HB VAL 86 5.154 0.043 -6.692 699 HG11 VAL 86 HG11 VAL 86 2.240 0.353 -7.470 700 HG12 VAL 86 HG12 VAL 86 3.542 -0.170 -8.535 701 HG13 VAL 86 HG13 VAL 86 3.548 1.468 -7.880 702 HG21 VAL 86 HG21 VAL 86 4.507 0.472 -4.366 703 HG22 VAL 86 HG22 VAL 86 2.819 0.675 -4.843 704 HG23 VAL 86 HG23 VAL 86 4.032 1.838 -5.381 705 H LEU 87 HN LEU 87 3.200 -3.476 -4.678 706 HA LEU 87 HA LEU 87 0.421 -3.690 -5.255 707 HB2 LEU 87 HB2 LEU 87 1.924 -4.875 -2.881 708 HB3 LEU 87 HB1 LEU 87 0.313 -5.333 -3.403 709 HG LEU 87 HG LEU 87 1.686 -7.078 -4.173 710 HD11 LEU 87 HD11 LEU 87 1.410 -5.278 -6.581 711 HD12 LEU 87 HD12 LEU 87 0.168 -6.344 -5.924 712 HD13 LEU 87 HD13 LEU 87 1.644 -7.030 -6.597 713 HD21 LEU 87 HD21 LEU 87 3.805 -6.884 -5.299 714 HD22 LEU 87 HD22 LEU 87 3.853 -6.003 -3.774 715 HD23 LEU 87 HD23 LEU 87 3.693 -5.122 -5.292 716 H ASN 88 HN ASN 88 -1.329 -3.395 -3.778 717 HA ASN 88 HA ASN 88 -1.008 -1.070 -1.961 718 HB2 ASN 88 HB2 ASN 88 -3.320 -1.693 -3.874 719 HB3 ASN 88 HB1 ASN 88 -3.260 -0.340 -2.749 720 HD21 ASN 88 HD21 ASN 88 -1.611 -1.735 -5.552 721 HD22 ASN 88 HD22 ASN 88 -1.072 -0.239 -6.218 722 H ILE 89 HN ILE 89 -2.247 -1.176 -0.036 723 HA ILE 89 HA ILE 89 -2.735 -3.923 0.829 724 HB ILE 89 HB ILE 89 -2.791 -1.324 2.431 725 HG12 ILE 89 HG12 ILE 89 -0.593 -3.437 2.188 726 HG13 ILE 89 HG11 ILE 89 -0.547 -1.827 1.476 727 HG21 ILE 89 HG21 ILE 89 -2.687 -2.738 4.455 728 HG22 ILE 89 HG22 ILE 89 -2.769 -4.194 3.461 729 HG23 ILE 89 HG23 ILE 89 -4.144 -3.090 3.521 730 HD11 ILE 89 HD11 ILE 89 -0.560 -2.462 4.430 731 HD12 ILE 89 HD12 ILE 89 -0.533 -0.839 3.719 732 HD13 ILE 89 HD13 ILE 89 0.823 -1.942 3.460 733 H ILE 90 HN ILE 90 -4.651 -4.705 0.271 734 HA ILE 90 HA ILE 90 -7.011 -3.054 -0.127 735 HB ILE 90 HB ILE 90 -8.094 -5.167 -0.920 736 HG12 ILE 90 HG12 ILE 90 -5.367 -6.497 -0.563 737 HG13 ILE 90 HG11 ILE 90 -6.687 -6.724 0.561 738 HG21 ILE 90 HG21 ILE 90 -6.937 -3.692 -2.498 739 HG22 ILE 90 HG22 ILE 90 -6.783 -5.378 -2.993 740 HG23 ILE 90 HG23 ILE 90 -5.421 -4.560 -2.224 741 HD11 ILE 90 HD11 ILE 90 -6.468 -8.580 -0.997 742 HD12 ILE 90 HD12 ILE 90 -6.738 -7.486 -2.351 743 HD13 ILE 90 HD13 ILE 90 -8.023 -7.772 -1.175 744 H GLY 91 HN GLY 91 -5.834 -3.875 2.642 745 HA2 GLY 91 HA2 GLY 91 -8.400 -3.888 3.955 746 HA3 GLY 91 HA1 GLY 91 -7.467 -5.368 4.199 747 H GLN 92 HN GLN 92 -6.960 -5.107 6.313 748 HA GLN 92 HA GLN 92 -5.186 -2.877 7.057 749 HB2 GLN 92 HB2 GLN 92 -6.205 -2.846 9.319 750 HB3 GLN 92 HB1 GLN 92 -7.392 -2.460 8.079 751 HG2 GLN 92 HG2 GLN 92 -8.190 -4.840 8.196 752 HG3 GLN 92 HG1 GLN 92 -7.102 -5.086 9.559 753 HE21 GLN 92 HE21 GLN 92 -10.007 -5.312 9.422 754 HE22 GLN 92 HE22 GLN 92 -10.630 -4.242 10.625 755 HA PRO 93 HA PRO 93 -2.496 -6.359 8.054 756 HB2 PRO 93 HB2 PRO 93 -0.583 -5.043 9.507 757 HB3 PRO 93 HB1 PRO 93 -0.739 -4.857 7.757 758 HG2 PRO 93 HG2 PRO 93 -1.814 -3.079 9.946 759 HG3 PRO 93 HG1 PRO 93 -0.900 -2.628 8.488 760 HD2 PRO 93 HD2 PRO 93 -3.585 -2.411 8.581 761 HD3 PRO 93 HD1 PRO 93 -2.757 -2.894 7.083 762 H LEU 94 HN LEU 94 -2.136 -7.794 9.776 763 HA LEU 94 HA LEU 94 -3.109 -7.131 12.457 764 HB2 LEU 94 HB2 LEU 94 -5.020 -7.960 10.794 765 HB3 LEU 94 HB1 LEU 94 -4.344 -9.545 11.090 766 HG LEU 94 HG LEU 94 -6.368 -8.998 12.469 767 HD11 LEU 94 HD11 LEU 94 -4.865 -10.738 13.235 768 HD12 LEU 94 HD12 LEU 94 -5.561 -9.867 14.600 769 HD13 LEU 94 HD13 LEU 94 -3.892 -9.552 14.106 770 HD21 LEU 94 HD21 LEU 94 -6.231 -7.453 14.349 771 HD22 LEU 94 HD22 LEU 94 -5.927 -6.603 12.835 772 HD23 LEU 94 HD23 LEU 94 -4.580 -7.009 13.901 773 HA PRO 95 HA PRO 95 0.482 -9.857 13.167 774 HB2 PRO 95 HB2 PRO 95 0.429 -9.742 15.928 775 HB3 PRO 95 HB1 PRO 95 1.119 -8.479 14.905 776 HG2 PRO 95 HG2 PRO 95 -1.613 -8.602 16.169 777 HG3 PRO 95 HG1 PRO 95 -0.473 -7.243 16.107 778 HD2 PRO 95 HD2 PRO 95 -2.574 -7.389 14.420 779 HD3 PRO 95 HD1 PRO 95 -1.005 -6.737 13.879 780 H ASP 96 HN ASP 96 0.907 -11.903 14.072 781 HA ASP 96 HA ASP 96 -1.258 -13.781 13.953 782 HB2 ASP 96 HB2 ASP 96 0.473 -15.474 14.166 783 HB3 ASP 96 HB1 ASP 96 1.068 -14.223 13.081 784 H ALA 97 HN ALA 97 -1.007 -15.680 15.726 785 HA ALA 97 HA ALA 97 -2.280 -14.779 18.052 786 HB1 ALA 97 HB1 ALA 97 -2.118 -17.105 18.818 787 HB2 ALA 97 HB2 ALA 97 -0.916 -17.442 17.566 788 HB3 ALA 97 HB3 ALA 97 -2.568 -17.022 17.111 789 H ALA 98 HN ALA 98 1.142 -15.393 17.440 790 HA ALA 98 HA ALA 98 1.867 -15.097 20.277 791 HB1 ALA 98 HB1 ALA 98 4.120 -15.763 19.577 792 HB2 ALA 98 HB2 ALA 98 3.625 -15.729 17.879 793 HB3 ALA 98 HB3 ALA 98 2.920 -16.911 18.986 794 H ARG 99 HN ARG 99 1.526 -13.082 17.536 795 HA ARG 99 HA ARG 99 1.991 -10.923 17.070 796 HB2 ARG 99 HB2 ARG 99 2.382 -10.949 20.032 797 HB3 ARG 99 HB1 ARG 99 3.168 -9.617 19.211 798 HG2 ARG 99 HG2 ARG 99 0.956 -8.977 20.053 799 HG3 ARG 99 HG1 ARG 99 1.039 -8.858 18.296 800 HD2 ARG 99 HD2 ARG 99 -0.120 -11.069 18.143 801 HD3 ARG 99 HD1 ARG 99 -0.287 -11.060 19.901 802 HE ARG 99 HE ARG 99 -1.455 -8.777 19.400 803 HH11 ARG 99 HH11 ARG 99 -1.870 -11.766 17.590 804 HH12 ARG 99 HH12 ARG 99 -3.440 -11.320 17.016 805 HH21 ARG 99 HH21 ARG 99 -3.499 -8.233 18.630 806 HH22 ARG 99 HH22 ARG 99 -4.358 -9.339 17.601 807 H THR 100 HN THR 100 4.046 -13.106 16.816 808 HA THR 100 HA THR 100 6.654 -11.896 17.065 809 HB THR 100 HB THR 100 7.388 -13.923 15.699 810 HG1 THR 100 HG1 THR 100 4.617 -14.149 15.464 811 HG21 THR 100 HG21 THR 100 7.351 -14.059 18.163 812 HG22 THR 100 HG22 THR 100 6.884 -15.601 17.444 813 HG23 THR 100 HG23 THR 100 5.651 -14.536 18.123 814 H ARG 101 HN ARG 101 4.147 -11.472 14.793 815 HA ARG 101 HA ARG 101 5.579 -10.134 12.817 816 HB2 ARG 101 HB2 ARG 101 5.269 -11.908 10.914 817 HB3 ARG 101 HB1 ARG 101 6.634 -12.046 11.995 818 HG2 ARG 101 HG2 ARG 101 5.883 -14.253 11.722 819 HG3 ARG 101 HG1 ARG 101 5.278 -13.775 13.309 820 HD2 ARG 101 HD2 ARG 101 3.058 -13.308 12.259 821 HD3 ARG 101 HD1 ARG 101 3.697 -13.913 10.724 822 HE ARG 101 HE ARG 101 3.141 -15.485 13.152 823 HH11 ARG 101 HH11 ARG 101 4.347 -15.542 9.869 824 HH12 ARG 101 HH12 ARG 101 3.872 -17.184 9.599 825 HH21 ARG 101 HH21 ARG 101 2.555 -17.649 12.804 826 HH22 ARG 101 HH22 ARG 101 2.857 -18.376 11.260 827 H LEU 102 HN LEU 102 4.239 -9.332 11.117 828 HA LEU 102 HA LEU 102 1.347 -9.446 11.645 829 HB2 LEU 102 HB2 LEU 102 3.206 -7.353 10.536 830 HB3 LEU 102 HB1 LEU 102 1.608 -7.406 9.831 831 HG LEU 102 HG LEU 102 0.629 -7.108 12.143 832 HD11 LEU 102 HD11 LEU 102 2.037 -6.271 13.934 833 HD12 LEU 102 HD12 LEU 102 3.477 -6.510 12.945 834 HD13 LEU 102 HD13 LEU 102 2.525 -7.901 13.467 835 HD21 LEU 102 HD21 LEU 102 1.050 -4.703 12.243 836 HD22 LEU 102 HD22 LEU 102 0.831 -5.225 10.575 837 HD23 LEU 102 HD23 LEU 102 2.451 -4.879 11.183 838 H GLU 103 HN GLU 103 0.030 -10.444 10.224 839 HA GLU 103 HA GLU 103 0.895 -11.144 7.531 840 HB2 GLU 103 HB2 GLU 103 -0.656 -12.690 8.710 841 HB3 GLU 103 HB1 GLU 103 -1.848 -11.397 8.859 842 HG2 GLU 103 HG2 GLU 103 -1.886 -11.291 6.308 843 HG3 GLU 103 HG1 GLU 103 -0.916 -12.763 6.306 844 H ILE 104 HN ILE 104 0.936 -9.577 6.063 845 HA ILE 104 HA ILE 104 -0.983 -7.344 6.083 846 HB ILE 104 HB ILE 104 1.306 -7.711 4.089 847 HG12 ILE 104 HG12 ILE 104 2.414 -7.819 6.279 848 HG13 ILE 104 HG11 ILE 104 2.776 -6.274 5.520 849 HG21 ILE 104 HG21 ILE 104 -0.132 -5.211 5.049 850 HG22 ILE 104 HG22 ILE 104 -0.368 -6.027 3.505 851 HG23 ILE 104 HG23 ILE 104 1.176 -5.251 3.858 852 HD11 ILE 104 HD11 ILE 104 2.380 -6.019 7.874 853 HD12 ILE 104 HD12 ILE 104 0.789 -6.761 7.725 854 HD13 ILE 104 HD13 ILE 104 1.112 -5.202 6.959 855 H LEU 105 HN LEU 105 -2.698 -7.415 4.658 856 HA LEU 105 HA LEU 105 -2.560 -9.305 2.382 857 HB2 LEU 105 HB2 LEU 105 -4.966 -9.256 2.193 858 HB3 LEU 105 HB1 LEU 105 -4.526 -9.719 3.826 859 HG LEU 105 HG LEU 105 -5.436 -6.899 3.100 860 HD11 LEU 105 HD11 LEU 105 -7.667 -7.479 3.931 861 HD12 LEU 105 HD12 LEU 105 -7.177 -9.162 4.136 862 HD13 LEU 105 HD13 LEU 105 -7.240 -8.450 2.521 863 HD21 LEU 105 HD21 LEU 105 -5.297 -8.312 5.792 864 HD22 LEU 105 HD22 LEU 105 -5.899 -6.673 5.506 865 HD23 LEU 105 HD23 LEU 105 -4.202 -7.052 5.219 866 H CYS 106 HN CYS 106 -2.859 -8.567 0.397 867 HA CYS 106 HA CYS 106 -3.087 -5.748 -0.239 868 HB2 CYS 106 HB2 CYS 106 -0.454 -7.208 -0.818 869 HB3 CYS 106 HB1 CYS 106 -0.881 -5.602 -1.399 870 HG CYS 106 HG CYS 106 -1.255 -5.321 1.742 871 H ARG 107 HN ARG 107 -2.861 -5.494 -2.634 872 HA ARG 107 HA ARG 107 -2.822 -7.771 -4.380 873 HB2 ARG 107 HB2 ARG 107 -5.209 -7.821 -3.632 874 HB3 ARG 107 HB1 ARG 107 -5.395 -6.141 -4.112 875 HG2 ARG 107 HG2 ARG 107 -5.008 -6.819 -6.493 876 HG3 ARG 107 HG1 ARG 107 -4.947 -8.507 -5.965 877 HD2 ARG 107 HD2 ARG 107 -7.259 -8.411 -5.208 878 HD3 ARG 107 HD1 ARG 107 -7.331 -6.668 -5.496 879 HE ARG 107 HE ARG 107 -7.619 -8.791 -7.429 880 HH11 ARG 107 HH11 ARG 107 -6.777 -5.382 -7.100 881 HH12 ARG 107 HH12 ARG 107 -7.258 -4.999 -8.720 882 HH21 ARG 107 HH21 ARG 107 -8.247 -8.248 -9.529 883 HH22 ARG 107 HH22 ARG 107 -8.083 -6.616 -10.091 884 H GLU 108 HN GLU 108 -2.661 -7.073 -6.587 885 HA GLU 108 HA GLU 108 -1.353 -4.514 -6.877 886 HB2 GLU 108 HB2 GLU 108 -0.698 -6.622 -8.143 887 HB3 GLU 108 HB1 GLU 108 -2.147 -6.415 -9.121 888 HG2 GLU 108 HG2 GLU 108 -1.336 -4.284 -9.958 889 HG3 GLU 108 HG1 GLU 108 0.049 -4.336 -8.870 890 H GLY 109 HN GLY 109 -2.250 -2.636 -7.576 891 HA2 GLY 109 HA2 GLY 109 -5.153 -2.555 -8.016 892 HA3 GLY 109 HA1 GLY 109 -4.082 -1.183 -7.752 893 H ALA 110 HN ALA 110 -3.326 -3.656 -10.069 894 HA ALA 110 HA ALA 110 -2.942 -3.747 -12.270 895 HB1 ALA 110 HB1 ALA 110 -5.283 -1.829 -12.476 896 HB2 ALA 110 HB2 ALA 110 -5.389 -3.592 -12.429 897 HB3 ALA 110 HB3 ALA 110 -4.615 -2.792 -13.797 898 H GLU 111 HN GLU 111 -1.016 -2.911 -12.900 899 HA GLU 111 HA GLU 111 -0.205 -0.188 -12.694 900 HB2 GLU 111 HB2 GLU 111 0.889 -2.328 -14.568 901 HB3 GLU 111 HB1 GLU 111 1.693 -0.825 -14.125 902 HG2 GLU 111 HG2 GLU 111 1.940 -1.602 -11.826 903 HG3 GLU 111 HG1 GLU 111 1.051 -3.084 -12.202 904 H LYS 112 HN LYS 112 -1.862 1.081 -13.646 905 HA LYS 112 HA LYS 112 -2.850 0.398 -16.306 906 HB2 LYS 112 HB2 LYS 112 -4.368 0.934 -14.352 907 HB3 LYS 112 HB1 LYS 112 -3.804 2.597 -14.426 908 HG2 LYS 112 HG2 LYS 112 -5.969 2.352 -15.523 909 HG3 LYS 112 HG1 LYS 112 -4.732 2.831 -16.695 910 HD2 LYS 112 HD2 LYS 112 -4.578 0.496 -17.500 911 HD3 LYS 112 HD1 LYS 112 -5.743 -0.024 -16.278 912 HE2 LYS 112 HE2 LYS 112 -6.795 0.197 -18.496 913 HE3 LYS 112 HE1 LYS 112 -7.489 1.338 -17.346 914 HZ1 LYS 112 HZ1 LYS 112 -7.086 2.358 -19.496 915 HZ2 LYS 112 HZ2 LYS 112 -5.439 1.994 -19.397 916 HZ3 LYS 112 HZ3 LYS 112 -6.132 3.079 -18.305 Start of MODEL 18 1 H1 MET 1 HT1 MET 1 5.947 -28.863 13.356 2 H2 MET 1 HT2 MET 1 7.477 -28.242 12.995 3 H3 MET 1 HT3 MET 1 6.310 -28.360 11.784 4 HA MET 1 HA MET 1 4.937 -26.749 12.838 5 HB2 MET 1 HB2 MET 1 5.725 -25.537 14.854 6 HB3 MET 1 HB1 MET 1 5.533 -27.252 15.174 7 HG2 MET 1 HG2 MET 1 8.001 -27.528 14.908 8 HG3 MET 1 HG1 MET 1 8.139 -25.778 14.737 9 HE1 MET 1 HE1 MET 1 5.954 -24.741 16.884 10 HE2 MET 1 HE2 MET 1 7.571 -24.048 16.726 11 HE3 MET 1 HE3 MET 1 6.977 -24.557 18.308 12 H ASN 2 HN ASN 2 5.066 -24.750 11.855 13 HA ASN 2 HA ASN 2 7.577 -24.015 10.528 14 HB2 ASN 2 HB2 ASN 2 6.222 -22.375 9.268 15 HB3 ASN 2 HB1 ASN 2 5.508 -23.981 9.169 16 HD21 ASN 2 HD21 ASN 2 5.172 -20.776 10.544 17 HD22 ASN 2 HD22 ASN 2 3.504 -20.919 10.962 18 H ILE 3 HN ILE 3 8.590 -22.050 10.820 19 HA ILE 3 HA ILE 3 8.053 -20.580 13.327 20 HB ILE 3 HB ILE 3 10.568 -20.707 11.579 21 HG12 ILE 3 HG12 ILE 3 10.188 -22.842 12.761 22 HG13 ILE 3 HG11 ILE 3 11.581 -22.013 13.446 23 HG21 ILE 3 HG21 ILE 3 11.751 -19.520 13.402 24 HG22 ILE 3 HG22 ILE 3 10.220 -19.308 14.255 25 HG23 ILE 3 HG23 ILE 3 10.472 -18.531 12.690 26 HD11 ILE 3 HD11 ILE 3 10.262 -23.030 15.176 27 HD12 ILE 3 HD12 ILE 3 8.815 -22.168 14.647 28 HD13 ILE 3 HD13 ILE 3 10.178 -21.275 15.335 29 H GLY 4 HN GLY 4 8.073 -18.247 13.264 30 HA2 GLY 4 HA2 GLY 4 6.885 -17.053 10.905 31 HA3 GLY 4 HA1 GLY 4 7.181 -16.285 12.454 32 H ARG 5 HN ARG 5 9.386 -17.849 10.126 33 HA ARG 5 HA ARG 5 11.127 -15.498 10.144 34 HB2 ARG 5 HB2 ARG 5 12.818 -17.037 9.066 35 HB3 ARG 5 HB1 ARG 5 12.335 -17.469 10.690 36 HG2 ARG 5 HG2 ARG 5 12.549 -19.502 9.486 37 HG3 ARG 5 HG1 ARG 5 10.820 -19.230 9.702 38 HD2 ARG 5 HD2 ARG 5 11.421 -20.088 7.437 39 HD3 ARG 5 HD1 ARG 5 10.588 -18.540 7.399 40 HE ARG 5 HE ARG 5 13.017 -17.618 7.219 41 HH11 ARG 5 HH11 ARG 5 11.834 -20.520 5.638 42 HH12 ARG 5 HH12 ARG 5 12.911 -20.368 4.291 43 HH21 ARG 5 HH21 ARG 5 14.407 -17.412 5.454 44 HH22 ARG 5 HH22 ARG 5 14.376 -18.594 4.181 45 H LEU 6 HN LEU 6 12.212 -14.976 8.036 46 HA LEU 6 HA LEU 6 10.239 -14.928 5.823 47 HB2 LEU 6 HB2 LEU 6 12.033 -12.630 6.740 48 HB3 LEU 6 HB1 LEU 6 10.941 -12.590 5.373 49 HG LEU 6 HG LEU 6 9.834 -11.349 7.039 50 HD11 LEU 6 HD11 LEU 6 8.620 -14.107 7.279 51 HD12 LEU 6 HD12 LEU 6 8.333 -12.957 5.971 52 HD13 LEU 6 HD13 LEU 6 7.822 -12.565 7.611 53 HD21 LEU 6 HD21 LEU 6 10.471 -13.484 9.089 54 HD22 LEU 6 HD22 LEU 6 9.526 -12.020 9.373 55 HD23 LEU 6 HD23 LEU 6 11.233 -11.896 8.950 56 H ARG 7 HN ARG 7 11.355 -14.173 3.724 57 HA ARG 7 HA ARG 7 14.086 -15.284 3.439 58 HB2 ARG 7 HB2 ARG 7 13.356 -16.534 1.392 59 HB3 ARG 7 HB1 ARG 7 12.641 -17.138 2.879 60 HG2 ARG 7 HG2 ARG 7 10.516 -16.091 2.366 61 HG3 ARG 7 HG1 ARG 7 11.203 -15.275 0.957 62 HD2 ARG 7 HD2 ARG 7 9.833 -17.283 0.373 63 HD3 ARG 7 HD1 ARG 7 11.499 -17.397 -0.189 64 HE ARG 7 HE ARG 7 11.963 -18.956 1.558 65 HH11 ARG 7 HH11 ARG 7 8.527 -18.283 1.276 66 HH12 ARG 7 HH12 ARG 7 8.060 -19.755 2.070 67 HH21 ARG 7 HH21 ARG 7 11.339 -20.869 2.583 68 HH22 ARG 7 HH22 ARG 7 9.651 -21.215 2.803 69 H ASP 8 HN ASP 8 11.679 -13.055 2.351 70 HA ASP 8 HA ASP 8 13.226 -12.113 0.035 71 HB2 ASP 8 HB2 ASP 8 10.245 -11.819 0.671 72 HB3 ASP 8 HB1 ASP 8 11.048 -11.172 -0.757 73 H ARG 9 HN ARG 9 12.235 -9.655 -0.346 74 HA ARG 9 HA ARG 9 12.216 -8.083 2.156 75 HB2 ARG 9 HB2 ARG 9 13.918 -7.279 -0.258 76 HB3 ARG 9 HB1 ARG 9 13.785 -6.418 1.278 77 HG2 ARG 9 HG2 ARG 9 14.973 -8.220 2.423 78 HG3 ARG 9 HG1 ARG 9 15.020 -9.171 0.935 79 HD2 ARG 9 HD2 ARG 9 16.314 -7.209 -0.092 80 HD3 ARG 9 HD1 ARG 9 16.469 -6.584 1.550 81 HE ARG 9 HE ARG 9 17.389 -9.322 1.013 82 HH11 ARG 9 HH11 ARG 9 18.259 -6.001 1.753 83 HH12 ARG 9 HH12 ARG 9 19.945 -6.357 1.954 84 HH21 ARG 9 HH21 ARG 9 19.587 -9.794 1.310 85 HH22 ARG 9 HH22 ARG 9 20.702 -8.530 1.709 86 H ILE 10 HN ILE 10 10.963 -6.180 1.973 87 HA ILE 10 HA ILE 10 9.921 -5.395 -0.678 88 HB ILE 10 HB ILE 10 7.683 -5.096 -0.011 89 HG12 ILE 10 HG12 ILE 10 7.875 -4.183 2.238 90 HG13 ILE 10 HG11 ILE 10 6.732 -5.514 2.261 91 HG21 ILE 10 HG21 ILE 10 6.863 -7.335 0.609 92 HG22 ILE 10 HG22 ILE 10 8.505 -7.799 1.061 93 HG23 ILE 10 HG23 ILE 10 8.136 -7.389 -0.613 94 HD11 ILE 10 HD11 ILE 10 9.549 -5.510 3.315 95 HD12 ILE 10 HD12 ILE 10 8.510 -6.924 3.250 96 HD13 ILE 10 HD13 ILE 10 8.049 -5.547 4.237 97 H THR 11 HN THR 11 9.230 -3.185 -0.791 98 HA THR 11 HA THR 11 10.453 -1.445 1.255 99 HB THR 11 HB THR 11 9.997 -0.758 -1.683 100 HG1 THR 11 HG1 THR 11 12.299 -1.730 -0.302 101 HG21 THR 11 HG21 THR 11 11.662 0.560 0.515 102 HG22 THR 11 HG22 THR 11 10.156 1.198 -0.154 103 HG23 THR 11 HG23 THR 11 11.592 1.086 -1.172 104 H ILE 12 HN ILE 12 9.077 -0.264 2.350 105 HA ILE 12 HA ILE 12 6.252 -0.097 1.780 106 HB ILE 12 HB ILE 12 7.892 1.103 4.064 107 HG12 ILE 12 HG12 ILE 12 8.065 -1.335 4.101 108 HG13 ILE 12 HG11 ILE 12 7.017 -0.825 5.416 109 HG21 ILE 12 HG21 ILE 12 5.782 2.327 3.844 110 HG22 ILE 12 HG22 ILE 12 5.749 1.322 5.299 111 HG23 ILE 12 HG23 ILE 12 4.870 0.814 3.851 112 HD11 ILE 12 HD11 ILE 12 6.132 -2.025 2.791 113 HD12 ILE 12 HD12 ILE 12 5.055 -1.478 4.080 114 HD13 ILE 12 HD13 ILE 12 6.167 -2.815 4.365 115 H GLN 13 HN GLN 13 5.667 1.319 0.222 116 HA GLN 13 HA GLN 13 6.808 3.969 -0.046 117 HB2 GLN 13 HB2 GLN 13 4.460 2.642 -1.483 118 HB3 GLN 13 HB1 GLN 13 4.940 4.313 -1.762 119 HG2 GLN 13 HG2 GLN 13 5.895 2.972 -3.502 120 HG3 GLN 13 HG1 GLN 13 7.202 3.512 -2.446 121 HE21 GLN 13 HE21 GLN 13 8.654 1.876 -2.733 122 HE22 GLN 13 HE22 GLN 13 8.345 0.214 -2.378 123 H THR 14 HN THR 14 6.507 5.046 1.609 124 HA THR 14 HA THR 14 4.045 5.272 3.121 125 HB THR 14 HB THR 14 6.531 7.037 3.355 126 HG1 THR 14 HG1 THR 14 6.118 4.340 4.098 127 HG21 THR 14 HG21 THR 14 4.549 6.044 5.427 128 HG22 THR 14 HG22 THR 14 4.556 7.665 4.729 129 HG23 THR 14 HG23 THR 14 5.911 7.133 5.720 130 H LEU 15 HN LEU 15 2.712 7.253 3.151 131 HA LEU 15 HA LEU 15 2.748 8.597 0.533 132 HB2 LEU 15 HB2 LEU 15 0.707 7.332 1.196 133 HB3 LEU 15 HB1 LEU 15 0.536 8.361 2.610 134 HG LEU 15 HG LEU 15 0.257 10.341 1.064 135 HD11 LEU 15 HD11 LEU 15 0.136 8.245 -1.121 136 HD12 LEU 15 HD12 LEU 15 1.383 9.477 -0.920 137 HD13 LEU 15 HD13 LEU 15 -0.265 9.953 -1.303 138 HD21 LEU 15 HD21 LEU 15 -1.778 8.123 0.738 139 HD22 LEU 15 HD22 LEU 15 -2.063 9.842 0.453 140 HD23 LEU 15 HD23 LEU 15 -1.687 9.271 2.078 141 H LYS 16 HN LYS 16 4.100 10.342 0.795 142 HA LYS 16 HA LYS 16 3.971 12.094 3.095 143 HB2 LYS 16 HB2 LYS 16 6.109 11.566 1.883 144 HB3 LYS 16 HB1 LYS 16 5.488 12.407 0.466 145 HG2 LYS 16 HG2 LYS 16 5.388 14.509 1.769 146 HG3 LYS 16 HG1 LYS 16 6.031 13.660 3.181 147 HD2 LYS 16 HD2 LYS 16 8.128 13.213 1.997 148 HD3 LYS 16 HD1 LYS 16 7.481 13.931 0.517 149 HE2 LYS 16 HE2 LYS 16 9.003 15.475 1.706 150 HE3 LYS 16 HE1 LYS 16 7.366 16.126 1.598 151 HZ1 LYS 16 HZ1 LYS 16 6.979 15.431 3.871 152 HZ2 LYS 16 HZ2 LYS 16 8.327 16.442 3.786 153 HZ3 LYS 16 HZ3 LYS 16 8.538 14.778 3.968 154 H GLN 17 HN GLN 17 2.134 13.277 3.205 155 HA GLN 17 HA GLN 17 0.934 14.565 0.866 156 HB2 GLN 17 HB2 GLN 17 0.108 14.600 3.813 157 HB3 GLN 17 HB1 GLN 17 -0.826 15.289 2.488 158 HG2 GLN 17 HG2 GLN 17 -1.074 13.023 1.507 159 HG3 GLN 17 HG1 GLN 17 -0.153 12.353 2.846 160 HE21 GLN 17 HE21 GLN 17 -3.208 13.780 1.899 161 HE22 GLN 17 HE22 GLN 17 -4.092 13.311 3.306 162 H THR 18 HN THR 18 2.478 16.056 0.257 163 HA THR 18 HA THR 18 3.686 17.899 2.192 164 HB THR 18 HB THR 18 4.315 17.648 -0.793 165 HG1 THR 18 HG1 THR 18 4.986 16.022 1.359 166 HG21 THR 18 HG21 THR 18 5.211 19.694 0.305 167 HG22 THR 18 HG22 THR 18 6.512 18.592 -0.148 168 HG23 THR 18 HG23 THR 18 5.988 18.694 1.532 169 H ARG 19 HN ARG 19 3.155 20.052 2.262 170 HA ARG 19 HA ARG 19 0.937 21.021 0.737 171 HB2 ARG 19 HB2 ARG 19 1.318 21.737 3.087 172 HB3 ARG 19 HB1 ARG 19 2.800 22.545 2.606 173 HG2 ARG 19 HG2 ARG 19 1.687 24.420 1.971 174 HG3 ARG 19 HG1 ARG 19 0.536 23.503 1.005 175 HD2 ARG 19 HD2 ARG 19 -0.646 24.767 2.720 176 HD3 ARG 19 HD1 ARG 19 -0.797 23.039 3.057 177 HE ARG 19 HE ARG 19 1.375 23.839 4.513 178 HH11 ARG 19 HH11 ARG 19 -1.981 24.877 4.441 179 HH12 ARG 19 HH12 ARG 19 -1.991 25.297 6.121 180 HH21 ARG 19 HH21 ARG 19 1.332 24.388 6.690 181 HH22 ARG 19 HH22 ARG 19 -0.126 25.011 7.396 182 H ASP 20 HN ASP 20 0.943 22.743 -0.765 183 HA ASP 20 HA ASP 20 3.391 22.950 -2.427 184 HB2 ASP 20 HB2 ASP 20 1.176 22.224 -3.467 185 HB3 ASP 20 HB1 ASP 20 0.540 23.823 -3.114 186 H ILE 21 HN ILE 21 3.950 25.200 -3.283 187 HA ILE 21 HA ILE 21 3.941 27.217 -1.380 188 HB ILE 21 HB ILE 21 5.564 26.902 -3.268 189 HG12 ILE 21 HG12 ILE 21 4.378 29.716 -3.090 190 HG13 ILE 21 HG11 ILE 21 5.535 29.027 -1.957 191 HG21 ILE 21 HG21 ILE 21 5.065 27.781 -5.504 192 HG22 ILE 21 HG22 ILE 21 3.416 28.171 -5.005 193 HG23 ILE 21 HG23 ILE 21 3.942 26.483 -5.076 194 HD11 ILE 21 HD11 ILE 21 6.016 29.653 -4.863 195 HD12 ILE 21 HD12 ILE 21 7.184 28.889 -3.786 196 HD13 ILE 21 HD13 ILE 21 6.636 30.533 -3.469 197 H THR 22 HN THR 22 1.228 26.311 -3.317 198 HA THR 22 HA THR 22 0.008 29.007 -3.180 199 HB THR 22 HB THR 22 -1.786 28.019 -4.638 200 HG1 THR 22 HG1 THR 22 -0.164 25.806 -5.199 201 HG21 THR 22 HG21 THR 22 1.017 27.679 -5.783 202 HG22 THR 22 HG22 THR 22 0.106 29.193 -5.732 203 HG23 THR 22 HG23 THR 22 -0.468 27.849 -6.724 204 H GLY 23 HN GLY 23 0.377 26.262 -1.477 205 HA2 GLY 23 HA2 GLY 23 -0.427 25.698 0.635 206 HA3 GLY 23 HA1 GLY 23 -1.701 26.891 0.446 207 H GLU 24 HN GLU 24 -0.870 24.119 -1.626 208 HA GLU 24 HA GLU 24 -3.519 22.912 -1.164 209 HB2 GLU 24 HB2 GLU 24 -1.459 22.290 -3.329 210 HB3 GLU 24 HB1 GLU 24 -3.102 21.648 -3.239 211 HG2 GLU 24 HG2 GLU 24 -4.022 23.869 -3.633 212 HG3 GLU 24 HG1 GLU 24 -2.402 24.574 -3.618 213 H ILE 25 HN ILE 25 -3.388 20.357 -1.274 214 HA ILE 25 HA ILE 25 -1.061 19.377 0.292 215 HB ILE 25 HB ILE 25 -3.954 18.408 0.474 216 HG12 ILE 25 HG12 ILE 25 -3.592 20.558 1.664 217 HG13 ILE 25 HG11 ILE 25 -3.903 19.254 2.800 218 HG21 ILE 25 HG21 ILE 25 -1.492 17.367 1.943 219 HG22 ILE 25 HG22 ILE 25 -2.426 16.502 0.718 220 HG23 ILE 25 HG23 ILE 25 -3.161 16.882 2.275 221 HD11 ILE 25 HD11 ILE 25 -1.195 20.432 2.172 222 HD12 ILE 25 HD12 ILE 25 -1.522 19.140 3.334 223 HD13 ILE 25 HD13 ILE 25 -2.174 20.756 3.602 224 H LEU 26 HN LEU 26 0.166 18.411 -1.162 225 HA LEU 26 HA LEU 26 -0.887 16.830 -3.388 226 HB2 LEU 26 HB2 LEU 26 1.864 17.983 -2.758 227 HB3 LEU 26 HB1 LEU 26 1.643 16.778 -4.017 228 HG LEU 26 HG LEU 26 0.124 18.328 -5.239 229 HD11 LEU 26 HD11 LEU 26 0.840 20.378 -3.129 230 HD12 LEU 26 HD12 LEU 26 -0.751 19.654 -3.379 231 HD13 LEU 26 HD13 LEU 26 -0.053 20.686 -4.626 232 HD21 LEU 26 HD21 LEU 26 1.856 19.870 -6.040 233 HD22 LEU 26 HD22 LEU 26 2.512 18.250 -5.801 234 HD23 LEU 26 HD23 LEU 26 2.844 19.517 -4.615 235 H GLU 27 HN GLU 27 -1.319 14.794 -2.798 236 HA GLU 27 HA GLU 27 0.236 13.309 -0.865 237 HB2 GLU 27 HB2 GLU 27 -1.931 12.326 -2.779 238 HB3 GLU 27 HB1 GLU 27 -1.264 11.437 -1.411 239 HG2 GLU 27 HG2 GLU 27 -2.129 13.201 0.110 240 HG3 GLU 27 HG1 GLU 27 -2.878 13.979 -1.272 241 H THR 28 HN THR 28 2.074 12.388 -1.353 242 HA THR 28 HA THR 28 2.702 11.381 -4.063 243 HB THR 28 HB THR 28 5.104 12.221 -3.711 244 HG1 THR 28 HG1 THR 28 3.809 13.776 -1.706 245 HG21 THR 28 HG21 THR 28 4.665 14.508 -4.510 246 HG22 THR 28 HG22 THR 28 2.974 14.359 -4.014 247 HG23 THR 28 HG23 THR 28 3.609 13.335 -5.308 248 H TRP 29 HN TRP 29 4.515 9.796 -4.033 249 HA TRP 29 HA TRP 29 4.265 8.125 -1.603 250 HB2 TRP 29 HB2 TRP 29 4.866 7.314 -4.488 251 HB3 TRP 29 HB1 TRP 29 4.806 6.205 -3.117 252 HD1 TRP 29 HD1 TRP 29 2.582 7.860 -5.650 253 HE1 TRP 29 HE1 TRP 29 0.132 7.226 -5.190 254 HE3 TRP 29 HE3 TRP 29 3.134 5.740 -1.020 255 HZ2 TRP 29 HZ2 TRP 29 -1.378 6.005 -3.144 256 HZ3 TRP 29 HZ3 TRP 29 1.135 4.869 0.126 257 HH2 TRP 29 HH2 TRP 29 -1.081 5.001 -0.914 258 H GLU 30 HN GLU 30 5.956 8.682 -0.374 259 HA GLU 30 HA GLU 30 8.659 8.916 -1.461 260 HB2 GLU 30 HB2 GLU 30 9.368 9.310 0.891 261 HB3 GLU 30 HB1 GLU 30 8.128 10.434 0.364 262 HG2 GLU 30 HG2 GLU 30 6.465 9.424 1.717 263 HG3 GLU 30 HG1 GLU 30 7.433 7.979 1.984 264 H ASP 31 HN ASP 31 9.925 7.246 -1.729 265 HA ASP 31 HA ASP 31 9.182 4.549 -1.075 266 HB2 ASP 31 HB2 ASP 31 10.469 5.287 -3.136 267 HB3 ASP 31 HB1 ASP 31 11.852 5.639 -2.098 268 H GLY 32 HN GLY 32 9.697 3.485 0.900 269 HA2 GLY 32 HA2 GLY 32 10.983 5.272 2.908 270 HA3 GLY 32 HA1 GLY 32 9.569 4.271 3.205 271 H HIS 33 HN HIS 33 9.974 2.493 4.360 272 HA HIS 33 HA HIS 33 12.699 1.636 4.902 273 HB2 HIS 33 HB2 HIS 33 10.009 0.586 5.908 274 HB3 HIS 33 HB1 HIS 33 11.574 0.001 6.475 275 HD1 HIS 33 HD1 HIS 33 9.075 1.923 7.764 276 HD2 HIS 33 HD2 HIS 33 13.100 2.713 7.173 277 HE1 HIS 33 HE1 HIS 33 9.655 3.717 9.416 278 HE2 HIS 33 HE2 HIS 33 12.013 4.356 8.843 279 H THR 34 HN THR 34 13.382 -0.669 4.721 280 HA THR 34 HA THR 34 11.908 -2.283 2.764 281 HB THR 34 HB THR 34 14.909 -1.764 2.499 282 HG1 THR 34 HG1 THR 34 13.246 -0.099 1.789 283 HG21 THR 34 HG21 THR 34 14.736 -3.062 0.401 284 HG22 THR 34 HG22 THR 34 13.021 -3.361 0.713 285 HG23 THR 34 HG23 THR 34 14.248 -4.055 1.780 286 H LEU 35 HN LEU 35 11.302 -3.757 4.246 287 HA LEU 35 HA LEU 35 13.347 -4.976 6.009 288 HB2 LEU 35 HB2 LEU 35 11.445 -5.606 7.499 289 HB3 LEU 35 HB1 LEU 35 11.702 -3.879 7.361 290 HG LEU 35 HG LEU 35 9.554 -5.200 5.668 291 HD11 LEU 35 HD11 LEU 35 9.108 -5.991 7.943 292 HD12 LEU 35 HD12 LEU 35 7.895 -4.821 7.427 293 HD13 LEU 35 HD13 LEU 35 9.171 -4.332 8.547 294 HD21 LEU 35 HD21 LEU 35 9.768 -2.425 6.894 295 HD22 LEU 35 HD22 LEU 35 8.472 -2.999 5.839 296 HD23 LEU 35 HD23 LEU 35 10.109 -2.839 5.211 297 H TRP 36 HN TRP 36 12.819 -7.168 6.710 298 HA TRP 36 HA TRP 36 12.751 -8.989 4.555 299 HB2 TRP 36 HB2 TRP 36 12.352 -9.721 7.484 300 HB3 TRP 36 HB1 TRP 36 13.019 -10.731 6.203 301 HD1 TRP 36 HD1 TRP 36 14.148 -8.763 9.059 302 HE1 TRP 36 HE1 TRP 36 16.642 -8.183 8.895 303 HE3 TRP 36 HE3 TRP 36 14.950 -9.830 4.093 304 HZ2 TRP 36 HZ2 TRP 36 18.675 -8.153 6.957 305 HZ3 TRP 36 HZ3 TRP 36 17.199 -9.487 3.186 306 HH2 TRP 36 HH2 TRP 36 19.028 -8.667 4.578 307 H ALA 37 HN ALA 37 11.125 -10.049 3.625 308 HA ALA 37 HA ALA 37 8.547 -10.528 4.978 309 HB1 ALA 37 HB1 ALA 37 7.291 -9.901 2.919 310 HB2 ALA 37 HB2 ALA 37 8.803 -9.326 2.201 311 HB3 ALA 37 HB3 ALA 37 8.153 -8.544 3.637 312 H SER 38 HN SER 38 7.170 -12.146 3.629 313 HA SER 38 HA SER 38 8.603 -13.600 1.534 314 HB2 SER 38 HB2 SER 38 6.865 -14.869 3.719 315 HB3 SER 38 HB1 SER 38 7.642 -15.720 2.380 316 HG SER 38 HG SER 38 8.777 -14.555 4.669 317 H VAL 39 HN VAL 39 7.425 -13.014 -0.245 318 HA VAL 39 HA VAL 39 4.648 -12.078 0.095 319 HB VAL 39 HB VAL 39 6.534 -11.773 -2.291 320 HG11 VAL 39 HG11 VAL 39 3.835 -10.450 -1.744 321 HG12 VAL 39 HG12 VAL 39 4.164 -11.651 -2.997 322 HG13 VAL 39 HG13 VAL 39 4.908 -10.053 -3.094 323 HG21 VAL 39 HG21 VAL 39 7.377 -10.561 -0.312 324 HG22 VAL 39 HG22 VAL 39 5.813 -9.761 -0.126 325 HG23 VAL 39 HG23 VAL 39 6.811 -9.426 -1.544 326 H ASN 40 HN ASN 40 3.099 -13.608 -0.264 327 HA ASN 40 HA ASN 40 3.375 -15.455 -2.564 328 HB2 ASN 40 HB2 ASN 40 2.094 -16.237 0.107 329 HB3 ASN 40 HB1 ASN 40 2.414 -17.281 -1.274 330 HD21 ASN 40 HD21 ASN 40 3.817 -15.600 1.448 331 HD22 ASN 40 HD22 ASN 40 5.313 -16.461 1.463 332 H MET 41 HN MET 41 1.674 -15.145 -3.935 333 HA MET 41 HA MET 41 -0.609 -13.539 -3.303 334 HB2 MET 41 HB2 MET 41 -0.238 -15.509 -5.610 335 HB3 MET 41 HB1 MET 41 -1.487 -14.269 -5.511 336 HG2 MET 41 HG2 MET 41 0.326 -12.538 -5.511 337 HG3 MET 41 HG1 MET 41 1.498 -13.828 -5.762 338 HE1 MET 41 HE1 MET 41 -2.150 -13.564 -7.325 339 HE2 MET 41 HE2 MET 41 -1.797 -12.742 -8.843 340 HE3 MET 41 HE3 MET 41 -1.586 -11.893 -7.314 341 H VAL 42 HN VAL 42 -2.624 -14.149 -2.554 342 HA VAL 42 HA VAL 42 -2.932 -16.674 -1.258 343 HB VAL 42 HB VAL 42 -5.049 -15.958 -0.465 344 HG11 VAL 42 HG11 VAL 42 -3.235 -14.686 0.542 345 HG12 VAL 42 HG12 VAL 42 -4.685 -13.689 0.436 346 HG13 VAL 42 HG13 VAL 42 -3.367 -13.448 -0.714 347 HG21 VAL 42 HG21 VAL 42 -5.210 -13.863 -2.667 348 HG22 VAL 42 HG22 VAL 42 -6.375 -14.043 -1.357 349 HG23 VAL 42 HG23 VAL 42 -6.181 -15.332 -2.542 350 H SER 43 HN SER 43 -4.435 -18.321 -1.721 351 HA SER 43 HA SER 43 -5.286 -18.604 -4.528 352 HB2 SER 43 HB2 SER 43 -3.917 -20.427 -3.464 353 HB3 SER 43 HB1 SER 43 -5.189 -20.665 -2.266 354 HG SER 43 HG SER 43 -5.607 -22.142 -3.804 355 H SER 44 HN SER 44 -7.433 -20.141 -4.395 356 HA SER 44 HA SER 44 -9.585 -18.445 -3.951 357 HB2 SER 44 HB2 SER 44 -10.979 -20.601 -4.240 358 HB3 SER 44 HB1 SER 44 -9.847 -20.205 -5.535 359 HG SER 44 HG SER 44 -9.207 -22.183 -5.197 360 H LYS 45 HN LYS 45 -8.114 -20.741 -1.764 361 HA LYS 45 HA LYS 45 -10.025 -21.286 0.142 362 HB2 LYS 45 HB2 LYS 45 -7.757 -22.272 0.103 363 HB3 LYS 45 HB1 LYS 45 -7.060 -20.727 0.581 364 HG2 LYS 45 HG2 LYS 45 -8.318 -20.884 2.744 365 HG3 LYS 45 HG1 LYS 45 -8.890 -22.480 2.258 366 HD2 LYS 45 HD2 LYS 45 -5.972 -21.693 2.662 367 HD3 LYS 45 HD1 LYS 45 -6.958 -22.592 3.820 368 HE2 LYS 45 HE2 LYS 45 -6.194 -23.524 1.031 369 HE3 LYS 45 HE1 LYS 45 -5.497 -24.099 2.548 370 HZ1 LYS 45 HZ1 LYS 45 -7.116 -25.651 1.804 371 HZ2 LYS 45 HZ2 LYS 45 -8.299 -24.459 1.621 372 HZ3 LYS 45 HZ3 LYS 45 -7.745 -24.875 3.166 373 H GLU 46 HN GLU 46 -7.878 -18.425 0.065 374 HA GLU 46 HA GLU 46 -8.780 -17.332 2.551 375 HB2 GLU 46 HB2 GLU 46 -7.341 -15.882 0.297 376 HB3 GLU 46 HB1 GLU 46 -7.422 -15.384 1.989 377 HG2 GLU 46 HG2 GLU 46 -5.925 -17.725 0.792 378 HG3 GLU 46 HG1 GLU 46 -5.250 -16.308 1.591 379 H ALA 47 HN ALA 47 -9.607 -16.795 -0.823 380 HA ALA 47 HA ALA 47 -11.280 -14.529 -0.570 381 HB1 ALA 47 HB1 ALA 47 -11.365 -16.770 -2.631 382 HB2 ALA 47 HB2 ALA 47 -10.364 -15.323 -2.724 383 HB3 ALA 47 HB3 ALA 47 -12.117 -15.178 -2.803 384 H ILE 48 HN ILE 48 -11.895 -17.976 -0.385 385 HA ILE 48 HA ILE 48 -14.724 -17.926 -0.072 386 HB ILE 48 HB ILE 48 -12.683 -20.045 0.738 387 HG12 ILE 48 HG12 ILE 48 -14.558 -19.947 -1.672 388 HG13 ILE 48 HG11 ILE 48 -12.853 -19.517 -1.718 389 HG21 ILE 48 HG21 ILE 48 -15.711 -20.348 0.625 390 HG22 ILE 48 HG22 ILE 48 -14.718 -20.392 2.082 391 HG23 ILE 48 HG23 ILE 48 -14.562 -21.663 0.870 392 HD11 ILE 48 HD11 ILE 48 -13.978 -22.247 -1.093 393 HD12 ILE 48 HD12 ILE 48 -12.264 -21.821 -1.139 394 HD13 ILE 48 HD13 ILE 48 -13.235 -21.736 -2.608 395 H SER 49 HN SER 49 -12.056 -18.036 2.274 396 HA SER 49 HA SER 49 -13.703 -18.225 4.607 397 HB2 SER 49 HB2 SER 49 -11.405 -19.097 4.541 398 HB3 SER 49 HB1 SER 49 -10.769 -17.467 4.325 399 HG SER 49 HG SER 49 -11.453 -16.949 6.388 400 H SER 50 HN SER 50 -12.520 -15.533 2.736 401 HA SER 50 HA SER 50 -13.358 -13.572 4.792 402 HB2 SER 50 HB2 SER 50 -11.833 -13.151 2.189 403 HB3 SER 50 HB1 SER 50 -12.133 -11.934 3.429 404 HG SER 50 HG SER 50 -10.344 -14.059 3.416 405 H GLY 51 HN GLY 51 -14.620 -15.184 2.137 406 HA2 GLY 51 HA2 GLY 51 -16.707 -15.052 1.182 407 HA3 GLY 51 HA1 GLY 51 -17.029 -13.613 2.136 408 H ALA 52 HN ALA 52 -16.456 -11.571 1.294 409 HA ALA 52 HA ALA 52 -15.934 -11.455 -1.635 410 HB1 ALA 52 HB1 ALA 52 -17.622 -9.574 0.064 411 HB2 ALA 52 HB2 ALA 52 -18.244 -10.803 -1.038 412 HB3 ALA 52 HB3 ALA 52 -17.342 -9.426 -1.674 413 H GLU 53 HN GLU 53 -14.743 -10.703 1.422 414 HA GLU 53 HA GLU 53 -13.672 -8.110 1.120 415 HB2 GLU 53 HB2 GLU 53 -14.075 -9.412 3.287 416 HB3 GLU 53 HB1 GLU 53 -12.613 -10.316 2.931 417 HG2 GLU 53 HG2 GLU 53 -12.118 -8.588 4.532 418 HG3 GLU 53 HG1 GLU 53 -11.298 -8.232 3.010 419 H LEU 54 HN LEU 54 -11.907 -11.242 1.134 420 HA LEU 54 HA LEU 54 -9.824 -10.168 -0.638 421 HB2 LEU 54 HB2 LEU 54 -10.016 -12.897 0.714 422 HB3 LEU 54 HB1 LEU 54 -8.658 -12.330 -0.250 423 HG LEU 54 HG LEU 54 -9.531 -11.296 2.477 424 HD11 LEU 54 HD11 LEU 54 -8.258 -13.387 2.544 425 HD12 LEU 54 HD12 LEU 54 -7.324 -12.057 3.223 426 HD13 LEU 54 HD13 LEU 54 -6.958 -12.650 1.601 427 HD21 LEU 54 HD21 LEU 54 -7.622 -9.718 2.356 428 HD22 LEU 54 HD22 LEU 54 -8.860 -9.358 1.159 429 HD23 LEU 54 HD23 LEU 54 -7.368 -10.162 0.667 430 H ALA 55 HN ALA 55 -9.192 -11.527 -2.498 431 HA ALA 55 HA ALA 55 -11.345 -13.096 -3.750 432 HB1 ALA 55 HB1 ALA 55 -11.702 -10.771 -4.498 433 HB2 ALA 55 HB2 ALA 55 -11.193 -11.802 -5.840 434 HB3 ALA 55 HB3 ALA 55 -10.041 -10.692 -5.082 435 H ILE 56 HN ILE 56 -10.574 -14.178 -5.748 436 HA ILE 56 HA ILE 56 -8.024 -15.447 -5.398 437 HB ILE 56 HB ILE 56 -9.887 -15.512 -7.834 438 HG12 ILE 56 HG12 ILE 56 -9.786 -17.438 -5.462 439 HG13 ILE 56 HG11 ILE 56 -11.016 -16.201 -5.698 440 HG21 ILE 56 HG21 ILE 56 -7.627 -16.337 -8.385 441 HG22 ILE 56 HG22 ILE 56 -8.795 -17.660 -8.400 442 HG23 ILE 56 HG23 ILE 56 -7.696 -17.470 -7.032 443 HD11 ILE 56 HD11 ILE 56 -10.529 -18.574 -7.504 444 HD12 ILE 56 HD12 ILE 56 -11.781 -17.346 -7.717 445 HD13 ILE 56 HD13 ILE 56 -11.816 -18.407 -6.311 446 H GLY 57 HN GLY 57 -6.126 -14.465 -5.902 447 HA2 GLY 57 HA2 GLY 57 -4.686 -13.451 -7.616 448 HA3 GLY 57 HA1 GLY 57 -6.036 -12.417 -8.083 449 H THR 58 HN THR 58 -6.501 -12.343 -4.952 450 HA THR 58 HA THR 58 -5.164 -9.947 -4.265 451 HB THR 58 HB THR 58 -6.473 -12.120 -2.591 452 HG1 THR 58 HG1 THR 58 -7.658 -10.548 -4.025 453 HG21 THR 58 HG21 THR 58 -6.439 -10.632 -0.635 454 HG22 THR 58 HG22 THR 58 -5.474 -9.457 -1.523 455 HG23 THR 58 HG23 THR 58 -4.793 -11.035 -1.130 456 H VAL 59 HN VAL 59 -3.195 -9.583 -3.241 457 HA VAL 59 HA VAL 59 -1.313 -11.867 -3.114 458 HB VAL 59 HB VAL 59 -0.673 -8.890 -3.334 459 HG11 VAL 59 HG11 VAL 59 1.132 -10.170 -2.237 460 HG12 VAL 59 HG12 VAL 59 1.639 -9.659 -3.846 461 HG13 VAL 59 HG13 VAL 59 1.143 -11.329 -3.571 462 HG21 VAL 59 HG21 VAL 59 -1.787 -9.643 -5.386 463 HG22 VAL 59 HG22 VAL 59 -0.691 -11.018 -5.511 464 HG23 VAL 59 HG23 VAL 59 -0.070 -9.380 -5.709 465 H ARG 60 HN ARG 60 -0.571 -12.470 -1.132 466 HA ARG 60 HA ARG 60 -0.936 -10.620 1.152 467 HB2 ARG 60 HB2 ARG 60 -2.224 -12.710 1.251 468 HB3 ARG 60 HB1 ARG 60 -0.744 -13.650 1.129 469 HG2 ARG 60 HG2 ARG 60 -0.038 -13.032 3.310 470 HG3 ARG 60 HG1 ARG 60 -1.205 -11.706 3.401 471 HD2 ARG 60 HD2 ARG 60 -1.863 -13.698 4.754 472 HD3 ARG 60 HD1 ARG 60 -3.056 -13.249 3.534 473 HE ARG 60 HE ARG 60 -1.401 -15.195 2.412 474 HH11 ARG 60 HH11 ARG 60 -3.644 -15.018 5.096 475 HH12 ARG 60 HH12 ARG 60 -4.201 -16.649 4.883 476 HH21 ARG 60 HH21 ARG 60 -2.068 -17.336 2.188 477 HH22 ARG 60 HH22 ARG 60 -3.279 -17.977 3.249 478 H ILE 61 HN ILE 61 0.728 -10.469 2.664 479 HA ILE 61 HA ILE 61 3.470 -10.934 1.677 480 HB ILE 61 HB ILE 61 2.313 -8.189 2.405 481 HG12 ILE 61 HG12 ILE 61 3.406 -8.958 -0.337 482 HG13 ILE 61 HG11 ILE 61 1.719 -9.224 0.073 483 HG21 ILE 61 HG21 ILE 61 4.524 -7.260 1.767 484 HG22 ILE 61 HG22 ILE 61 5.142 -8.896 1.519 485 HG23 ILE 61 HG23 ILE 61 4.649 -8.373 3.131 486 HD11 ILE 61 HD11 ILE 61 3.103 -6.567 0.113 487 HD12 ILE 61 HD12 ILE 61 1.392 -6.867 0.428 488 HD13 ILE 61 HD13 ILE 61 2.067 -7.179 -1.171 489 H TRP 62 HN TRP 62 4.274 -12.013 3.375 490 HA TRP 62 HA TRP 62 3.376 -11.428 6.128 491 HB2 TRP 62 HB2 TRP 62 5.074 -13.733 5.038 492 HB3 TRP 62 HB1 TRP 62 4.451 -13.602 6.679 493 HD1 TRP 62 HD1 TRP 62 3.023 -13.835 3.054 494 HE1 TRP 62 HE1 TRP 62 0.825 -15.134 3.163 495 HE3 TRP 62 HE3 TRP 62 2.730 -14.553 8.092 496 HZ2 TRP 62 HZ2 TRP 62 -0.805 -16.367 5.102 497 HZ3 TRP 62 HZ3 TRP 62 0.828 -15.815 9.001 498 HH2 TRP 62 HH2 TRP 62 -0.909 -16.705 7.531 499 H ILE 63 HN ILE 63 4.638 -10.044 7.263 500 HA ILE 63 HA ILE 63 7.508 -9.749 6.502 501 HB ILE 63 HB ILE 63 7.411 -7.388 7.168 502 HG12 ILE 63 HG12 ILE 63 4.394 -7.687 7.523 503 HG13 ILE 63 HG11 ILE 63 5.521 -7.691 8.868 504 HG21 ILE 63 HG21 ILE 63 6.014 -6.470 5.331 505 HG22 ILE 63 HG22 ILE 63 5.222 -8.040 5.150 506 HG23 ILE 63 HG23 ILE 63 6.945 -7.874 4.812 507 HD11 ILE 63 HD11 ILE 63 5.060 -5.432 6.943 508 HD12 ILE 63 HD12 ILE 63 6.221 -5.422 8.274 509 HD13 ILE 63 HD13 ILE 63 4.493 -5.540 8.607 510 H ARG 64 HN ARG 64 8.989 -9.510 8.264 511 HA ARG 64 HA ARG 64 8.498 -10.452 10.801 512 HB2 ARG 64 HB2 ARG 64 10.735 -9.721 9.595 513 HB3 ARG 64 HB1 ARG 64 10.454 -8.155 10.345 514 HG2 ARG 64 HG2 ARG 64 10.620 -10.734 11.944 515 HG3 ARG 64 HG1 ARG 64 12.047 -9.787 11.537 516 HD2 ARG 64 HD2 ARG 64 11.284 -7.928 12.859 517 HD3 ARG 64 HD1 ARG 64 9.694 -8.654 13.085 518 HE ARG 64 HE ARG 64 11.323 -10.506 14.176 519 HH11 ARG 64 HH11 ARG 64 11.104 -7.031 14.697 520 HH12 ARG 64 HH12 ARG 64 11.557 -7.139 16.367 521 HH21 ARG 64 HH21 ARG 64 11.894 -10.614 16.363 522 HH22 ARG 64 HH22 ARG 64 11.982 -9.164 17.311 523 H TYR 65 HN TYR 65 7.894 -9.523 12.771 524 HA TYR 65 HA TYR 65 5.750 -7.857 12.932 525 HB2 TYR 65 HB2 TYR 65 6.608 -9.337 14.766 526 HB3 TYR 65 HB1 TYR 65 7.860 -8.149 15.117 527 HD1 TYR 65 HD2 TYR 65 4.210 -8.826 15.237 528 HD2 TYR 65 HD1 TYR 65 7.303 -6.089 16.352 529 HE1 TYR 65 HE2 TYR 65 2.647 -7.655 16.734 530 HE2 TYR 65 HE1 TYR 65 5.742 -4.938 17.825 531 HH TYR 65 HH TYR 65 2.578 -6.184 18.539 532 H ARG 66 HN ARG 66 5.358 -5.725 12.832 533 HA ARG 66 HA ARG 66 7.439 -3.710 13.070 534 HB2 ARG 66 HB2 ARG 66 7.603 -4.706 10.726 535 HB3 ARG 66 HB1 ARG 66 5.969 -4.133 10.428 536 HG2 ARG 66 HG2 ARG 66 7.399 -2.544 9.424 537 HG3 ARG 66 HG1 ARG 66 6.827 -1.783 10.905 538 HD2 ARG 66 HD2 ARG 66 9.527 -3.161 10.623 539 HD3 ARG 66 HD1 ARG 66 9.273 -1.430 10.417 540 HE ARG 66 HE ARG 66 8.283 -1.955 12.915 541 HH11 ARG 66 HH11 ARG 66 11.412 -2.474 11.420 542 HH12 ARG 66 HH12 ARG 66 12.272 -2.278 12.909 543 HH21 ARG 66 HH21 ARG 66 9.403 -1.740 14.825 544 HH22 ARG 66 HH22 ARG 66 11.130 -1.881 14.840 545 H LYS 67 HN LYS 67 6.445 -2.184 14.253 546 HA LYS 67 HA LYS 67 3.561 -1.787 14.286 547 HB2 LYS 67 HB2 LYS 67 5.785 -0.342 15.804 548 HB3 LYS 67 HB1 LYS 67 4.060 -0.154 16.116 549 HG2 LYS 67 HG2 LYS 67 3.877 -2.404 16.952 550 HG3 LYS 67 HG1 LYS 67 5.508 -2.806 16.395 551 HD2 LYS 67 HD2 LYS 67 6.429 -1.119 18.011 552 HD3 LYS 67 HD1 LYS 67 4.788 -0.835 18.608 553 HE2 LYS 67 HE2 LYS 67 4.652 -3.151 19.388 554 HE3 LYS 67 HE1 LYS 67 6.241 -3.503 18.704 555 HZ1 LYS 67 HZ1 LYS 67 6.444 -3.133 21.034 556 HZ2 LYS 67 HZ2 LYS 67 5.639 -1.652 20.935 557 HZ3 LYS 67 HZ3 LYS 67 7.167 -1.830 20.234 558 H ASP 68 HN ASP 68 5.617 -0.874 12.035 559 HA ASP 68 HA ASP 68 5.200 2.029 11.906 560 HB2 ASP 68 HB2 ASP 68 7.483 1.246 11.570 561 HB3 ASP 68 HB1 ASP 68 6.965 0.084 10.359 562 H ILE 69 HN ILE 69 3.940 -0.871 10.504 563 HA ILE 69 HA ILE 69 3.405 0.146 7.869 564 HB ILE 69 HB ILE 69 2.225 -2.354 9.147 565 HG12 ILE 69 HG12 ILE 69 4.648 -2.484 9.373 566 HG13 ILE 69 HG11 ILE 69 4.134 -3.578 8.100 567 HG21 ILE 69 HG21 ILE 69 2.632 -1.645 6.209 568 HG22 ILE 69 HG22 ILE 69 1.088 -1.689 7.065 569 HG23 ILE 69 HG23 ILE 69 2.001 -3.179 6.822 570 HD11 ILE 69 HD11 ILE 69 6.187 -2.449 7.521 571 HD12 ILE 69 HD12 ILE 69 5.412 -0.877 7.707 572 HD13 ILE 69 HD13 ILE 69 4.900 -1.969 6.414 573 H ASN 70 HN ASN 70 1.716 1.344 7.260 574 HA ASN 70 HA ASN 70 -0.880 1.105 8.679 575 HB2 ASN 70 HB2 ASN 70 0.286 3.382 8.939 576 HB3 ASN 70 HB1 ASN 70 0.106 3.587 7.191 577 HD21 ASN 70 HD21 ASN 70 -1.605 3.333 10.244 578 HD22 ASN 70 HD22 ASN 70 -3.098 3.995 9.688 579 H ALA 71 HN ALA 71 -2.746 1.434 7.247 580 HA ALA 71 HA ALA 71 -2.494 -0.191 4.916 581 HB1 ALA 71 HB1 ALA 71 -4.931 -0.044 4.803 582 HB2 ALA 71 HB2 ALA 71 -4.924 1.253 6.005 583 HB3 ALA 71 HB3 ALA 71 -4.402 -0.373 6.453 584 H THR 72 HN THR 72 -2.320 3.214 5.382 585 HA THR 72 HA THR 72 -3.091 4.000 2.710 586 HB THR 72 HB THR 72 -1.931 6.195 3.308 587 HG1 THR 72 HG1 THR 72 -1.845 5.512 5.993 588 HG21 THR 72 HG21 THR 72 -4.018 5.213 5.284 589 HG22 THR 72 HG22 THR 72 -4.350 5.902 3.691 590 HG23 THR 72 HG23 THR 72 -3.618 6.900 4.950 591 H SER 73 HN SER 73 -0.210 2.797 4.234 592 HA SER 73 HA SER 73 1.683 3.585 2.228 593 HB2 SER 73 HB2 SER 73 1.868 1.303 4.250 594 HB3 SER 73 HB1 SER 73 3.213 2.047 3.380 595 HG SER 73 HG SER 73 2.415 4.068 4.459 596 H ARG 74 HN ARG 74 2.673 2.203 0.661 597 HA ARG 74 HA ARG 74 1.162 -0.215 -0.138 598 HB2 ARG 74 HB2 ARG 74 2.928 1.572 -1.871 599 HB3 ARG 74 HB1 ARG 74 2.070 0.128 -2.415 600 HG2 ARG 74 HG2 ARG 74 -0.088 1.265 -1.897 601 HG3 ARG 74 HG1 ARG 74 0.816 2.717 -1.455 602 HD2 ARG 74 HD2 ARG 74 0.721 1.395 -4.191 603 HD3 ARG 74 HD1 ARG 74 -0.037 2.923 -3.733 604 HE ARG 74 HE ARG 74 2.773 3.035 -3.299 605 HH11 ARG 74 HH11 ARG 74 0.395 3.242 -5.879 606 HH12 ARG 74 HH12 ARG 74 1.480 4.057 -6.953 607 HH21 ARG 74 HH21 ARG 74 4.144 4.101 -4.711 608 HH22 ARG 74 HH22 ARG 74 3.592 4.542 -6.287 609 H ILE 75 HN ILE 75 2.457 -1.912 -1.011 610 HA ILE 75 HA ILE 75 5.242 -2.120 -0.077 611 HB ILE 75 HB ILE 75 3.076 -4.225 -0.536 612 HG12 ILE 75 HG12 ILE 75 3.897 -5.008 1.800 613 HG13 ILE 75 HG11 ILE 75 4.786 -3.495 1.884 614 HG21 ILE 75 HG21 ILE 75 4.958 -5.160 -1.679 615 HG22 ILE 75 HG22 ILE 75 4.836 -5.989 -0.125 616 HG23 ILE 75 HG23 ILE 75 6.045 -4.732 -0.363 617 HD11 ILE 75 HD11 ILE 75 1.790 -3.796 1.672 618 HD12 ILE 75 HD12 ILE 75 2.666 -2.267 1.748 619 HD13 ILE 75 HD13 ILE 75 2.714 -3.375 3.114 620 H LYS 76 HN LYS 76 6.691 -1.996 -1.712 621 HA LYS 76 HA LYS 76 6.040 -3.167 -4.357 622 HB2 LYS 76 HB2 LYS 76 6.533 -0.750 -4.502 623 HB3 LYS 76 HB1 LYS 76 8.054 -0.993 -3.649 624 HG2 LYS 76 HG2 LYS 76 8.816 -2.440 -5.581 625 HG3 LYS 76 HG1 LYS 76 7.328 -1.990 -6.423 626 HD2 LYS 76 HD2 LYS 76 9.193 -0.581 -7.175 627 HD3 LYS 76 HD1 LYS 76 7.986 0.392 -6.330 628 HE2 LYS 76 HE2 LYS 76 9.401 0.358 -4.284 629 HE3 LYS 76 HE1 LYS 76 10.604 -0.614 -5.129 630 HZ1 LYS 76 HZ1 LYS 76 9.775 2.120 -5.912 631 HZ2 LYS 76 HZ2 LYS 76 11.004 1.203 -6.622 632 HZ3 LYS 76 HZ3 LYS 76 11.165 1.739 -5.027 633 H VAL 77 HN VAL 77 7.042 -5.073 -4.633 634 HA VAL 77 HA VAL 77 8.619 -6.186 -2.545 635 HB VAL 77 HB VAL 77 8.099 -7.332 -5.330 636 HG11 VAL 77 HG11 VAL 77 8.494 -9.538 -4.290 637 HG12 VAL 77 HG12 VAL 77 8.887 -8.753 -2.757 638 HG13 VAL 77 HG13 VAL 77 9.923 -8.508 -4.164 639 HG21 VAL 77 HG21 VAL 77 6.196 -8.524 -4.312 640 HG22 VAL 77 HG22 VAL 77 5.991 -6.776 -4.185 641 HG23 VAL 77 HG23 VAL 77 6.492 -7.707 -2.771 642 H SER 78 HN SER 78 10.655 -5.654 -2.211 643 HA SER 78 HA SER 78 12.497 -4.574 -4.102 644 HB2 SER 78 HB2 SER 78 12.497 -4.000 -1.672 645 HB3 SER 78 HB1 SER 78 12.992 -5.649 -1.291 646 HG SER 78 HG SER 78 14.840 -5.062 -2.822 647 H THR 79 HN THR 79 11.844 -7.776 -2.905 648 HA THR 79 HA THR 79 13.118 -9.030 -5.114 649 HB THR 79 HB THR 79 15.164 -8.694 -3.659 650 HG1 THR 79 HG1 THR 79 14.482 -11.449 -3.952 651 HG21 THR 79 HG21 THR 79 13.843 -10.685 -1.777 652 HG22 THR 79 HG22 THR 79 14.124 -8.980 -1.425 653 HG23 THR 79 HG23 THR 79 15.491 -10.070 -1.650 654 H GLY 80 HN GLY 80 12.203 -11.039 -5.458 655 HA2 GLY 80 HA2 GLY 80 11.126 -12.929 -3.905 656 HA3 GLY 80 HA1 GLY 80 9.886 -11.682 -3.801 657 HA PRO 81 HA PRO 81 8.939 -14.292 -7.571 658 HB2 PRO 81 HB2 PRO 81 6.351 -14.852 -7.035 659 HB3 PRO 81 HB1 PRO 81 7.656 -15.721 -6.208 660 HG2 PRO 81 HG2 PRO 81 6.050 -13.350 -5.227 661 HG3 PRO 81 HG1 PRO 81 6.403 -14.872 -4.378 662 HD2 PRO 81 HD2 PRO 81 7.849 -12.596 -3.955 663 HD3 PRO 81 HD1 PRO 81 8.584 -14.211 -3.838 664 H LEU 82 HN LEU 82 7.744 -11.390 -6.200 665 HA LEU 82 HA LEU 82 6.570 -10.460 -8.752 666 HB2 LEU 82 HB2 LEU 82 5.714 -9.701 -5.920 667 HB3 LEU 82 HB1 LEU 82 5.009 -9.090 -7.412 668 HG LEU 82 HG LEU 82 4.830 -11.961 -6.392 669 HD11 LEU 82 HD11 LEU 82 2.453 -11.500 -6.049 670 HD12 LEU 82 HD12 LEU 82 2.673 -9.828 -6.574 671 HD13 LEU 82 HD13 LEU 82 3.450 -10.403 -5.096 672 HD21 LEU 82 HD21 LEU 82 4.880 -11.935 -8.846 673 HD22 LEU 82 HD22 LEU 82 3.571 -10.750 -8.886 674 HD23 LEU 82 HD23 LEU 82 3.277 -12.376 -8.260 675 H ALA 83 HN ALA 83 9.334 -10.321 -7.900 676 HA ALA 83 HA ALA 83 10.068 -7.942 -6.572 677 HB1 ALA 83 HB1 ALA 83 12.332 -8.383 -7.427 678 HB2 ALA 83 HB2 ALA 83 11.688 -9.562 -8.573 679 HB3 ALA 83 HB3 ALA 83 11.585 -9.870 -6.837 680 H GLY 84 HN GLY 84 9.292 -6.010 -7.291 681 HA2 GLY 84 HA2 GLY 84 9.984 -4.132 -8.747 682 HA3 GLY 84 HA1 GLY 84 9.809 -5.212 -10.121 683 H ARG 85 HN ARG 85 7.327 -5.933 -8.033 684 HA ARG 85 HA ARG 85 5.405 -4.208 -9.504 685 HB2 ARG 85 HB2 ARG 85 4.850 -6.837 -8.044 686 HB3 ARG 85 HB1 ARG 85 3.738 -5.948 -9.095 687 HG2 ARG 85 HG2 ARG 85 5.142 -6.408 -11.037 688 HG3 ARG 85 HG1 ARG 85 6.371 -7.154 -10.011 689 HD2 ARG 85 HD2 ARG 85 5.250 -8.959 -10.945 690 HD3 ARG 85 HD1 ARG 85 4.537 -8.832 -9.350 691 HE ARG 85 HE ARG 85 2.688 -7.554 -10.589 692 HH11 ARG 85 HH11 ARG 85 4.471 -10.243 -11.970 693 HH12 ARG 85 HH12 ARG 85 3.185 -10.698 -13.032 694 HH21 ARG 85 HH21 ARG 85 1.016 -8.171 -11.995 695 HH22 ARG 85 HH22 ARG 85 1.232 -9.531 -13.051 696 H VAL 86 HN VAL 86 3.394 -3.687 -8.202 697 HA VAL 86 HA VAL 86 4.199 -2.770 -5.505 698 HB VAL 86 HB VAL 86 4.683 -0.937 -7.049 699 HG11 VAL 86 HG11 VAL 86 2.934 0.304 -8.281 700 HG12 VAL 86 HG12 VAL 86 1.740 -0.906 -7.805 701 HG13 VAL 86 HG13 VAL 86 3.084 -1.363 -8.850 702 HG21 VAL 86 HG21 VAL 86 2.345 -0.311 -5.207 703 HG22 VAL 86 HG22 VAL 86 3.463 0.883 -5.872 704 HG23 VAL 86 HG23 VAL 86 4.054 -0.355 -4.763 705 H LEU 87 HN LEU 87 2.956 -3.938 -4.346 706 HA LEU 87 HA LEU 87 0.110 -4.342 -4.776 707 HB2 LEU 87 HB2 LEU 87 1.816 -5.286 -2.429 708 HB3 LEU 87 HB1 LEU 87 0.209 -5.840 -2.860 709 HG LEU 87 HG LEU 87 1.627 -7.586 -3.520 710 HD11 LEU 87 HD11 LEU 87 1.211 -6.014 -6.071 711 HD12 LEU 87 HD12 LEU 87 0.014 -7.036 -5.271 712 HD13 LEU 87 HD13 LEU 87 1.481 -7.757 -5.931 713 HD21 LEU 87 HD21 LEU 87 3.521 -5.627 -4.834 714 HD22 LEU 87 HD22 LEU 87 3.696 -7.385 -4.785 715 HD23 LEU 87 HD23 LEU 87 3.771 -6.453 -3.292 716 H ASN 88 HN ASN 88 -1.377 -3.075 -3.924 717 HA ASN 88 HA ASN 88 -0.789 -1.103 -1.831 718 HB2 ASN 88 HB2 ASN 88 -3.248 -1.414 -3.621 719 HB3 ASN 88 HB1 ASN 88 -2.957 -0.094 -2.500 720 HD21 ASN 88 HD21 ASN 88 -0.632 -1.541 -4.822 721 HD22 ASN 88 HD22 ASN 88 -0.441 -0.108 -5.748 722 H ILE 89 HN ILE 89 -2.118 -1.046 0.107 723 HA ILE 89 HA ILE 89 -2.753 -3.748 1.013 724 HB ILE 89 HB ILE 89 -2.779 -1.106 2.554 725 HG12 ILE 89 HG12 ILE 89 -0.665 -3.308 2.496 726 HG13 ILE 89 HG11 ILE 89 -0.509 -1.731 1.728 727 HG21 ILE 89 HG21 ILE 89 -2.823 -2.484 4.616 728 HG22 ILE 89 HG22 ILE 89 -2.943 -3.950 3.642 729 HG23 ILE 89 HG23 ILE 89 -4.257 -2.773 3.628 730 HD11 ILE 89 HD11 ILE 89 -0.701 -2.259 4.697 731 HD12 ILE 89 HD12 ILE 89 -0.575 -0.665 3.944 732 HD13 ILE 89 HD13 ILE 89 0.748 -1.823 3.791 733 H ILE 90 HN ILE 90 -4.756 -4.547 0.768 734 HA ILE 90 HA ILE 90 -7.104 -2.748 0.700 735 HB ILE 90 HB ILE 90 -8.354 -4.759 -0.237 736 HG12 ILE 90 HG12 ILE 90 -5.573 -5.921 -0.744 737 HG13 ILE 90 HG11 ILE 90 -6.645 -6.501 0.519 738 HG21 ILE 90 HG21 ILE 90 -6.042 -3.682 -1.885 739 HG22 ILE 90 HG22 ILE 90 -7.609 -2.899 -1.646 740 HG23 ILE 90 HG23 ILE 90 -7.513 -4.426 -2.526 741 HD11 ILE 90 HD11 ILE 90 -7.181 -6.600 -2.444 742 HD12 ILE 90 HD12 ILE 90 -8.280 -7.169 -1.183 743 HD13 ILE 90 HD13 ILE 90 -6.714 -7.945 -1.407 744 H GLY 91 HN GLY 91 -6.723 -2.541 3.023 745 HA2 GLY 91 HA2 GLY 91 -8.632 -3.420 4.634 746 HA3 GLY 91 HA1 GLY 91 -7.526 -4.791 4.722 747 H GLN 92 HN GLN 92 -6.008 -4.706 6.252 748 HA GLN 92 HA GLN 92 -4.656 -2.349 7.121 749 HB2 GLN 92 HB2 GLN 92 -5.543 -2.361 9.482 750 HB3 GLN 92 HB1 GLN 92 -6.724 -1.860 8.284 751 HG2 GLN 92 HG2 GLN 92 -7.745 -4.122 8.353 752 HG3 GLN 92 HG1 GLN 92 -6.595 -4.586 9.607 753 HE21 GLN 92 HE21 GLN 92 -8.272 -5.020 11.069 754 HE22 GLN 92 HE22 GLN 92 -9.178 -3.763 11.830 755 HA PRO 93 HA PRO 93 -1.708 -5.553 8.029 756 HB2 PRO 93 HB2 PRO 93 -0.161 -4.347 9.991 757 HB3 PRO 93 HB1 PRO 93 -0.059 -3.951 8.273 758 HG2 PRO 93 HG2 PRO 93 -1.599 -2.541 10.449 759 HG3 PRO 93 HG1 PRO 93 -0.551 -1.845 9.192 760 HD2 PRO 93 HD2 PRO 93 -3.215 -1.816 8.915 761 HD3 PRO 93 HD1 PRO 93 -2.170 -2.132 7.508 762 H LEU 94 HN LEU 94 -2.053 -7.397 9.098 763 HA LEU 94 HA LEU 94 -3.542 -7.401 11.669 764 HB2 LEU 94 HB2 LEU 94 -4.608 -8.222 9.400 765 HB3 LEU 94 HB1 LEU 94 -3.589 -9.632 9.593 766 HG LEU 94 HG LEU 94 -5.909 -10.063 10.286 767 HD11 LEU 94 HD11 LEU 94 -5.558 -11.106 12.445 768 HD12 LEU 94 HD12 LEU 94 -4.084 -10.163 12.693 769 HD13 LEU 94 HD13 LEU 94 -4.161 -11.356 11.394 770 HD21 LEU 94 HD21 LEU 94 -5.525 -7.934 12.410 771 HD22 LEU 94 HD22 LEU 94 -6.925 -9.003 12.248 772 HD23 LEU 94 HD23 LEU 94 -6.565 -7.824 10.987 773 HA PRO 95 HA PRO 95 0.417 -9.485 12.897 774 HB2 PRO 95 HB2 PRO 95 0.121 -9.271 15.604 775 HB3 PRO 95 HB1 PRO 95 0.603 -7.899 14.589 776 HG2 PRO 95 HG2 PRO 95 -2.147 -8.593 15.649 777 HG3 PRO 95 HG1 PRO 95 -1.310 -7.026 15.668 778 HD2 PRO 95 HD2 PRO 95 -3.176 -7.634 13.780 779 HD3 PRO 95 HD1 PRO 95 -1.774 -6.595 13.417 780 H ASP 96 HN ASP 96 0.962 -11.522 13.762 781 HA ASP 96 HA ASP 96 -1.180 -13.507 13.796 782 HB2 ASP 96 HB2 ASP 96 0.550 -15.149 13.637 783 HB3 ASP 96 HB1 ASP 96 1.063 -13.814 12.613 784 H ALA 97 HN ALA 97 -0.884 -15.331 15.512 785 HA ALA 97 HA ALA 97 -1.553 -14.268 18.062 786 HB1 ALA 97 HB1 ALA 97 -1.757 -16.620 18.770 787 HB2 ALA 97 HB2 ALA 97 -0.923 -17.144 17.302 788 HB3 ALA 97 HB3 ALA 97 -2.505 -16.370 17.188 789 H ALA 98 HN ALA 98 1.461 -15.580 16.762 790 HA ALA 98 HA ALA 98 2.789 -15.713 19.356 791 HB1 ALA 98 HB1 ALA 98 3.330 -17.377 17.607 792 HB2 ALA 98 HB2 ALA 98 4.760 -16.466 18.097 793 HB3 ALA 98 HB3 ALA 98 3.953 -16.091 16.571 794 H ARG 99 HN ARG 99 2.152 -13.263 17.096 795 HA ARG 99 HA ARG 99 2.679 -11.075 16.922 796 HB2 ARG 99 HB2 ARG 99 4.012 -11.301 19.654 797 HB3 ARG 99 HB1 ARG 99 3.366 -9.842 18.912 798 HG2 ARG 99 HG2 ARG 99 1.759 -12.224 19.898 799 HG3 ARG 99 HG1 ARG 99 1.899 -10.664 20.703 800 HD2 ARG 99 HD2 ARG 99 0.692 -9.571 18.883 801 HD3 ARG 99 HD1 ARG 99 0.653 -11.084 17.970 802 HE ARG 99 HE ARG 99 -0.575 -11.123 20.622 803 HH11 ARG 99 HH11 ARG 99 -1.137 -10.889 17.159 804 HH12 ARG 99 HH12 ARG 99 -2.818 -11.291 17.290 805 HH21 ARG 99 HH21 ARG 99 -2.750 -11.659 20.765 806 HH22 ARG 99 HH22 ARG 99 -3.730 -11.735 19.336 807 H THR 100 HN THR 100 4.506 -13.061 15.897 808 HA THR 100 HA THR 100 7.179 -11.820 16.137 809 HB THR 100 HB THR 100 7.123 -14.236 16.595 810 HG1 THR 100 HG1 THR 100 8.335 -13.838 14.034 811 HG21 THR 100 HG21 THR 100 5.146 -14.859 15.250 812 HG22 THR 100 HG22 THR 100 6.529 -15.882 14.853 813 HG23 THR 100 HG23 THR 100 6.053 -14.576 13.764 814 H ARG 101 HN ARG 101 4.489 -11.520 14.198 815 HA ARG 101 HA ARG 101 5.903 -10.454 11.941 816 HB2 ARG 101 HB2 ARG 101 4.872 -12.008 10.233 817 HB3 ARG 101 HB1 ARG 101 6.101 -12.772 11.236 818 HG2 ARG 101 HG2 ARG 101 4.550 -14.084 12.389 819 HG3 ARG 101 HG1 ARG 101 3.206 -13.011 12.022 820 HD2 ARG 101 HD2 ARG 101 2.989 -15.110 10.814 821 HD3 ARG 101 HD1 ARG 101 3.195 -13.766 9.694 822 HE ARG 101 HE ARG 101 5.622 -14.521 9.609 823 HH11 ARG 101 HH11 ARG 101 3.039 -16.822 10.257 824 HH12 ARG 101 HH12 ARG 101 3.851 -18.131 9.459 825 HH21 ARG 101 HH21 ARG 101 6.658 -16.245 8.562 826 HH22 ARG 101 HH22 ARG 101 5.898 -17.802 8.504 827 H LEU 102 HN LEU 102 4.549 -9.355 10.492 828 HA LEU 102 HA LEU 102 1.717 -8.978 11.287 829 HB2 LEU 102 HB2 LEU 102 3.830 -7.140 10.212 830 HB3 LEU 102 HB1 LEU 102 2.243 -6.921 9.514 831 HG LEU 102 HG LEU 102 2.741 -5.359 11.396 832 HD11 LEU 102 HD11 LEU 102 0.430 -5.851 10.816 833 HD12 LEU 102 HD12 LEU 102 0.601 -5.577 12.547 834 HD13 LEU 102 HD13 LEU 102 0.412 -7.223 11.926 835 HD21 LEU 102 HD21 LEU 102 4.067 -6.901 12.804 836 HD22 LEU 102 HD22 LEU 102 2.597 -7.788 13.204 837 HD23 LEU 102 HD23 LEU 102 2.775 -6.102 13.695 838 H GLU 103 HN GLU 103 0.453 -10.283 10.066 839 HA GLU 103 HA GLU 103 1.072 -11.084 7.361 840 HB2 GLU 103 HB2 GLU 103 -0.247 -12.528 8.906 841 HB3 GLU 103 HB1 GLU 103 -1.515 -11.307 8.966 842 HG2 GLU 103 HG2 GLU 103 -1.901 -11.621 6.537 843 HG3 GLU 103 HG1 GLU 103 -0.662 -12.876 6.512 844 H ILE 104 HN ILE 104 1.023 -9.498 5.826 845 HA ILE 104 HA ILE 104 -0.926 -7.290 6.001 846 HB ILE 104 HB ILE 104 1.340 -7.557 3.955 847 HG12 ILE 104 HG12 ILE 104 2.395 -7.630 6.195 848 HG13 ILE 104 HG11 ILE 104 2.753 -6.103 5.398 849 HG21 ILE 104 HG21 ILE 104 1.124 -5.102 3.755 850 HG22 ILE 104 HG22 ILE 104 -0.188 -5.112 4.938 851 HG23 ILE 104 HG23 ILE 104 -0.396 -5.918 3.380 852 HD11 ILE 104 HD11 ILE 104 0.730 -6.550 7.585 853 HD12 ILE 104 HD12 ILE 104 1.039 -5.014 6.769 854 HD13 ILE 104 HD13 ILE 104 2.307 -5.771 7.731 855 H LEU 105 HN LEU 105 -2.579 -7.131 4.565 856 HA LEU 105 HA LEU 105 -2.806 -9.113 2.381 857 HB2 LEU 105 HB2 LEU 105 -5.224 -8.994 2.554 858 HB3 LEU 105 HB1 LEU 105 -4.538 -9.454 4.098 859 HG LEU 105 HG LEU 105 -5.619 -6.667 3.454 860 HD11 LEU 105 HD11 LEU 105 -7.532 -7.237 4.870 861 HD12 LEU 105 HD12 LEU 105 -6.926 -8.885 5.056 862 HD13 LEU 105 HD13 LEU 105 -7.431 -8.300 3.469 863 HD21 LEU 105 HD21 LEU 105 -3.911 -6.592 5.213 864 HD22 LEU 105 HD22 LEU 105 -4.773 -7.830 6.130 865 HD23 LEU 105 HD23 LEU 105 -5.511 -6.244 5.869 866 H CYS 106 HN CYS 106 -3.208 -8.370 0.393 867 HA CYS 106 HA CYS 106 -3.378 -5.558 -0.253 868 HB2 CYS 106 HB2 CYS 106 -0.735 -7.013 -0.774 869 HB3 CYS 106 HB1 CYS 106 -1.148 -5.392 -1.327 870 HG CYS 106 HG CYS 106 -1.583 -5.022 1.746 871 H ARG 107 HN ARG 107 -2.944 -5.282 -2.658 872 HA ARG 107 HA ARG 107 -2.841 -7.610 -4.355 873 HB2 ARG 107 HB2 ARG 107 -4.892 -7.189 -5.600 874 HB3 ARG 107 HB1 ARG 107 -5.314 -7.425 -3.907 875 HG2 ARG 107 HG2 ARG 107 -5.682 -5.055 -3.593 876 HG3 ARG 107 HG1 ARG 107 -5.022 -4.683 -5.188 877 HD2 ARG 107 HD2 ARG 107 -7.565 -6.260 -4.659 878 HD3 ARG 107 HD1 ARG 107 -7.486 -4.572 -5.170 879 HE ARG 107 HE ARG 107 -6.448 -5.332 -7.253 880 HH11 ARG 107 HH11 ARG 107 -8.216 -7.742 -5.417 881 HH12 ARG 107 HH12 ARG 107 -8.468 -8.772 -6.786 882 HH21 ARG 107 HH21 ARG 107 -6.761 -6.690 -9.035 883 HH22 ARG 107 HH22 ARG 107 -7.634 -8.177 -8.846 884 H GLU 108 HN GLU 108 -2.618 -6.884 -6.645 885 HA GLU 108 HA GLU 108 -0.830 -4.732 -6.953 886 HB2 GLU 108 HB2 GLU 108 -2.514 -6.097 -9.099 887 HB3 GLU 108 HB1 GLU 108 -1.105 -5.078 -9.381 888 HG2 GLU 108 HG2 GLU 108 0.236 -6.746 -7.993 889 HG3 GLU 108 HG1 GLU 108 -1.175 -7.807 -8.076 890 H GLY 109 HN GLY 109 -1.067 -2.646 -7.807 891 HA2 GLY 109 HA2 GLY 109 -3.666 -1.367 -7.401 892 HA3 GLY 109 HA1 GLY 109 -2.125 -0.566 -7.701 893 H ALA 110 HN ALA 110 -4.004 -3.025 -9.431 894 HA ALA 110 HA ALA 110 -3.257 -2.049 -12.017 895 HB1 ALA 110 HB1 ALA 110 -4.614 -3.925 -12.856 896 HB2 ALA 110 HB2 ALA 110 -5.239 -4.218 -11.231 897 HB3 ALA 110 HB3 ALA 110 -3.524 -4.455 -11.575 898 H GLU 111 HN GLU 111 -4.124 -0.106 -12.537 899 HA GLU 111 HA GLU 111 -6.751 0.809 -11.914 900 HB2 GLU 111 HB2 GLU 111 -6.158 2.685 -13.553 901 HB3 GLU 111 HB1 GLU 111 -5.057 2.474 -12.198 902 HG2 GLU 111 HG2 GLU 111 -3.424 1.346 -13.628 903 HG3 GLU 111 HG1 GLU 111 -4.537 1.391 -14.991 904 H LYS 112 HN LYS 112 -8.011 -1.013 -12.659 905 HA LYS 112 HA LYS 112 -9.100 -0.665 -15.311 906 HB2 LYS 112 HB2 LYS 112 -7.030 -2.226 -15.564 907 HB3 LYS 112 HB1 LYS 112 -7.935 -3.419 -14.646 908 HG2 LYS 112 HG2 LYS 112 -8.982 -2.224 -17.234 909 HG3 LYS 112 HG1 LYS 112 -7.917 -3.633 -17.210 910 HD2 LYS 112 HD2 LYS 112 -9.578 -4.907 -15.916 911 HD3 LYS 112 HD1 LYS 112 -10.628 -3.493 -15.817 912 HE2 LYS 112 HE2 LYS 112 -10.900 -3.538 -18.279 913 HE3 LYS 112 HE1 LYS 112 -9.871 -4.970 -18.361 914 HZ1 LYS 112 HZ1 LYS 112 -11.492 -6.184 -17.071 915 HZ2 LYS 112 HZ2 LYS 112 -12.245 -5.502 -18.414 916 HZ3 LYS 112 HZ3 LYS 112 -12.455 -4.805 -16.895 Start of MODEL 19 1 H1 MET 1 HT1 MET 1 5.849 -24.640 9.373 2 H2 MET 1 HT2 MET 1 6.214 -23.748 10.756 3 H3 MET 1 HT3 MET 1 7.373 -23.932 9.536 4 HA MET 1 HA MET 1 4.790 -22.526 9.253 5 HB2 MET 1 HB2 MET 1 7.602 -21.355 9.418 6 HB3 MET 1 HB1 MET 1 6.122 -20.441 9.152 7 HG2 MET 1 HG2 MET 1 5.324 -21.186 11.402 8 HG3 MET 1 HG1 MET 1 6.896 -21.937 11.668 9 HE1 MET 1 HE1 MET 1 9.236 -18.733 11.689 10 HE2 MET 1 HE2 MET 1 8.838 -19.707 10.273 11 HE3 MET 1 HE3 MET 1 9.193 -20.494 11.813 12 H ASN 2 HN ASN 2 4.259 -23.493 7.298 13 HA ASN 2 HA ASN 2 6.142 -23.979 5.189 14 HB2 ASN 2 HB2 ASN 2 4.102 -25.373 5.499 15 HB3 ASN 2 HB1 ASN 2 3.091 -23.984 5.116 16 HD21 ASN 2 HD21 ASN 2 5.374 -26.322 3.802 17 HD22 ASN 2 HD22 ASN 2 4.977 -26.065 2.141 18 H ILE 3 HN ILE 3 7.113 -22.184 4.462 19 HA ILE 3 HA ILE 3 7.572 -20.359 3.236 20 HB ILE 3 HB ILE 3 4.635 -20.298 2.385 21 HG12 ILE 3 HG12 ILE 3 6.978 -21.699 0.993 22 HG13 ILE 3 HG11 ILE 3 5.727 -22.521 1.914 23 HG21 ILE 3 HG21 ILE 3 5.805 -18.204 1.834 24 HG22 ILE 3 HG22 ILE 3 5.435 -19.104 0.365 25 HG23 ILE 3 HG23 ILE 3 7.077 -19.109 1.010 26 HD11 ILE 3 HD11 ILE 3 5.347 -22.733 -0.459 27 HD12 ILE 3 HD12 ILE 3 5.311 -20.982 -0.653 28 HD13 ILE 3 HD13 ILE 3 4.049 -21.797 0.278 29 H GLY 4 HN GLY 4 5.861 -20.356 5.972 30 HA2 GLY 4 HA2 GLY 4 5.253 -17.501 6.243 31 HA3 GLY 4 HA1 GLY 4 4.958 -18.770 7.427 32 H ARG 5 HN ARG 5 7.779 -17.606 5.669 33 HA ARG 5 HA ARG 5 9.189 -16.756 8.074 34 HB2 ARG 5 HB2 ARG 5 11.196 -18.115 7.589 35 HB3 ARG 5 HB1 ARG 5 9.811 -19.146 7.926 36 HG2 ARG 5 HG2 ARG 5 9.549 -19.698 5.585 37 HG3 ARG 5 HG1 ARG 5 10.760 -18.501 5.111 38 HD2 ARG 5 HD2 ARG 5 11.273 -21.023 6.734 39 HD3 ARG 5 HD1 ARG 5 11.696 -20.768 5.038 40 HE ARG 5 HE ARG 5 13.158 -18.890 5.884 41 HH11 ARG 5 HH11 ARG 5 12.466 -21.635 7.963 42 HH12 ARG 5 HH12 ARG 5 13.954 -21.496 8.838 43 HH21 ARG 5 HH21 ARG 5 15.082 -18.703 7.039 44 HH22 ARG 5 HH22 ARG 5 15.445 -19.821 8.313 45 H LEU 6 HN LEU 6 11.144 -15.506 7.478 46 HA LEU 6 HA LEU 6 10.381 -13.770 5.297 47 HB2 LEU 6 HB2 LEU 6 12.695 -13.486 7.248 48 HB3 LEU 6 HB1 LEU 6 12.142 -12.261 6.126 49 HG LEU 6 HG LEU 6 11.186 -11.531 8.117 50 HD11 LEU 6 HD11 LEU 6 8.790 -11.851 8.037 51 HD12 LEU 6 HD12 LEU 6 8.981 -13.264 6.998 52 HD13 LEU 6 HD13 LEU 6 9.449 -11.666 6.414 53 HD21 LEU 6 HD21 LEU 6 10.484 -14.373 8.895 54 HD22 LEU 6 HD22 LEU 6 10.160 -12.919 9.847 55 HD23 LEU 6 HD23 LEU 6 11.823 -13.410 9.533 56 H ARG 7 HN ARG 7 10.784 -14.652 3.396 57 HA ARG 7 HA ARG 7 13.401 -15.799 2.705 58 HB2 ARG 7 HB2 ARG 7 10.716 -15.810 1.259 59 HB3 ARG 7 HB1 ARG 7 12.183 -16.567 0.636 60 HG2 ARG 7 HG2 ARG 7 10.757 -17.337 3.211 61 HG3 ARG 7 HG1 ARG 7 10.668 -18.209 1.676 62 HD2 ARG 7 HD2 ARG 7 13.192 -17.786 3.327 63 HD3 ARG 7 HD1 ARG 7 12.253 -19.278 3.241 64 HE ARG 7 HE ARG 7 12.841 -19.411 0.869 65 HH11 ARG 7 HH11 ARG 7 14.895 -17.358 2.855 66 HH12 ARG 7 HH12 ARG 7 16.241 -17.459 1.769 67 HH21 ARG 7 HH21 ARG 7 14.605 -19.521 -0.531 68 HH22 ARG 7 HH22 ARG 7 16.077 -18.688 -0.142 69 H ASP 8 HN ASP 8 11.183 -13.210 1.798 70 HA ASP 8 HA ASP 8 12.920 -12.224 -0.353 71 HB2 ASP 8 HB2 ASP 8 9.969 -11.668 0.262 72 HB3 ASP 8 HB1 ASP 8 10.866 -11.000 -1.099 73 H ARG 9 HN ARG 9 12.132 -9.652 -0.501 74 HA ARG 9 HA ARG 9 12.048 -8.320 2.105 75 HB2 ARG 9 HB2 ARG 9 14.205 -7.812 0.005 76 HB3 ARG 9 HB1 ARG 9 13.782 -6.611 1.221 77 HG2 ARG 9 HG2 ARG 9 14.492 -8.117 3.013 78 HG3 ARG 9 HG1 ARG 9 14.833 -9.390 1.837 79 HD2 ARG 9 HD2 ARG 9 16.240 -6.698 1.947 80 HD3 ARG 9 HD1 ARG 9 16.872 -8.208 2.593 81 HE ARG 9 HE ARG 9 16.904 -9.090 0.306 82 HH11 ARG 9 HH11 ARG 9 16.782 -5.585 0.616 83 HH12 ARG 9 HH12 ARG 9 17.429 -5.302 -0.966 84 HH21 ARG 9 HH21 ARG 9 17.747 -8.679 -1.790 85 HH22 ARG 9 HH22 ARG 9 17.962 -7.044 -2.324 86 H ILE 10 HN ILE 10 11.103 -6.224 1.979 87 HA ILE 10 HA ILE 10 10.253 -5.214 -0.663 88 HB ILE 10 HB ILE 10 7.992 -4.777 -0.127 89 HG12 ILE 10 HG12 ILE 10 8.169 -3.935 2.173 90 HG13 ILE 10 HG11 ILE 10 6.871 -5.108 2.055 91 HG21 ILE 10 HG21 ILE 10 6.974 -6.947 0.415 92 HG22 ILE 10 HG22 ILE 10 8.547 -7.545 0.937 93 HG23 ILE 10 HG23 ILE 10 8.297 -7.082 -0.746 94 HD11 ILE 10 HD11 ILE 10 8.135 -5.251 4.129 95 HD12 ILE 10 HD12 ILE 10 9.598 -5.647 3.221 96 HD13 ILE 10 HD13 ILE 10 8.211 -6.741 3.202 97 H THR 11 HN THR 11 10.260 -3.025 -0.806 98 HA THR 11 HA THR 11 11.062 -1.396 1.469 99 HB THR 11 HB THR 11 10.381 -0.353 -1.320 100 HG1 THR 11 HG1 THR 11 11.869 -2.091 -1.546 101 HG21 THR 11 HG21 THR 11 10.814 1.300 0.507 102 HG22 THR 11 HG22 THR 11 12.045 1.367 -0.760 103 HG23 THR 11 HG23 THR 11 12.391 0.558 0.776 104 H ILE 12 HN ILE 12 9.555 -0.491 2.726 105 HA ILE 12 HA ILE 12 6.744 -0.537 2.192 106 HB ILE 12 HB ILE 12 8.301 1.002 4.332 107 HG12 ILE 12 HG12 ILE 12 8.562 -1.434 4.583 108 HG13 ILE 12 HG11 ILE 12 7.562 -0.803 5.884 109 HG21 ILE 12 HG21 ILE 12 6.146 2.093 3.993 110 HG22 ILE 12 HG22 ILE 12 6.121 1.222 5.527 111 HG23 ILE 12 HG23 ILE 12 5.302 0.544 4.119 112 HD11 ILE 12 HD11 ILE 12 6.584 -2.268 3.436 113 HD12 ILE 12 HD12 ILE 12 5.563 -1.621 4.725 114 HD13 ILE 12 HD13 ILE 12 6.715 -2.910 5.075 115 H GLN 13 HN GLN 13 5.963 0.682 0.584 116 HA GLN 13 HA GLN 13 7.037 3.269 -0.113 117 HB2 GLN 13 HB2 GLN 13 6.168 1.694 -1.869 118 HB3 GLN 13 HB1 GLN 13 4.549 1.876 -1.197 119 HG2 GLN 13 HG2 GLN 13 4.585 4.273 -1.699 120 HG3 GLN 13 HG1 GLN 13 6.221 4.131 -2.335 121 HE21 GLN 13 HE21 GLN 13 6.532 3.099 -4.342 122 HE22 GLN 13 HE22 GLN 13 5.232 2.855 -5.453 123 H THR 14 HN THR 14 6.778 4.548 1.403 124 HA THR 14 HA THR 14 4.475 4.785 3.134 125 HB THR 14 HB THR 14 7.033 6.450 3.016 126 HG1 THR 14 HG1 THR 14 6.399 4.047 4.408 127 HG21 THR 14 HG21 THR 14 6.556 6.942 5.379 128 HG22 THR 14 HG22 THR 14 5.059 6.018 5.269 129 HG23 THR 14 HG23 THR 14 5.244 7.508 4.342 130 H LEU 15 HN LEU 15 3.032 6.628 3.212 131 HA LEU 15 HA LEU 15 2.883 8.141 0.688 132 HB2 LEU 15 HB2 LEU 15 0.902 6.792 1.278 133 HB3 LEU 15 HB1 LEU 15 0.778 7.606 2.826 134 HG LEU 15 HG LEU 15 0.208 9.723 1.718 135 HD11 LEU 15 HD11 LEU 15 0.467 8.240 -0.911 136 HD12 LEU 15 HD12 LEU 15 1.497 9.550 -0.329 137 HD13 LEU 15 HD13 LEU 15 -0.191 9.864 -0.707 138 HD21 LEU 15 HD21 LEU 15 -1.513 7.439 0.707 139 HD22 LEU 15 HD22 LEU 15 -2.002 9.132 0.839 140 HD23 LEU 15 HD23 LEU 15 -1.626 8.210 2.293 141 H LYS 16 HN LYS 16 4.070 9.951 0.948 142 HA LYS 16 HA LYS 16 3.851 11.584 3.366 143 HB2 LYS 16 HB2 LYS 16 6.083 11.045 2.235 144 HB3 LYS 16 HB1 LYS 16 5.578 12.069 0.896 145 HG2 LYS 16 HG2 LYS 16 5.497 14.018 2.353 146 HG3 LYS 16 HG1 LYS 16 5.833 13.013 3.770 147 HD2 LYS 16 HD2 LYS 16 8.041 12.377 2.621 148 HD3 LYS 16 HD1 LYS 16 7.698 13.667 1.462 149 HE2 LYS 16 HE2 LYS 16 7.679 15.315 3.294 150 HE3 LYS 16 HE1 LYS 16 7.983 14.030 4.468 151 HZ1 LYS 16 HZ1 LYS 16 10.025 15.090 3.981 152 HZ2 LYS 16 HZ2 LYS 16 9.787 14.967 2.315 153 HZ3 LYS 16 HZ3 LYS 16 10.073 13.575 3.231 154 H GLN 17 HN GLN 17 2.452 13.244 3.423 155 HA GLN 17 HA GLN 17 1.187 14.218 0.931 156 HB2 GLN 17 HB2 GLN 17 0.282 14.420 3.839 157 HB3 GLN 17 HB1 GLN 17 -0.599 15.069 2.457 158 HG2 GLN 17 HG2 GLN 17 -0.822 12.763 1.548 159 HG3 GLN 17 HG1 GLN 17 0.013 12.146 2.974 160 HE21 GLN 17 HE21 GLN 17 -2.954 13.536 1.768 161 HE22 GLN 17 HE22 GLN 17 -3.920 13.175 3.154 162 H THR 18 HN THR 18 2.363 15.845 0.181 163 HA THR 18 HA THR 18 3.510 17.892 1.981 164 HB THR 18 HB THR 18 4.434 16.956 -0.787 165 HG1 THR 18 HG1 THR 18 5.761 16.787 1.738 166 HG21 THR 18 HG21 THR 18 5.639 19.066 1.048 167 HG22 THR 18 HG22 THR 18 4.896 19.369 -0.523 168 HG23 THR 18 HG23 THR 18 6.394 18.441 -0.425 169 H ARG 19 HN ARG 19 2.517 19.827 1.868 170 HA ARG 19 HA ARG 19 0.387 20.389 0.065 171 HB2 ARG 19 HB2 ARG 19 0.663 21.189 2.489 172 HB3 ARG 19 HB1 ARG 19 1.818 22.374 1.891 173 HG2 ARG 19 HG2 ARG 19 0.071 23.439 0.535 174 HG3 ARG 19 HG1 ARG 19 -1.084 22.191 1.003 175 HD2 ARG 19 HD2 ARG 19 -1.521 24.198 2.280 176 HD3 ARG 19 HD1 ARG 19 -0.899 22.957 3.371 177 HE ARG 19 HE ARG 19 1.226 24.589 2.425 178 HH11 ARG 19 HH11 ARG 19 -1.423 24.604 4.733 179 HH12 ARG 19 HH12 ARG 19 -0.750 25.891 5.674 180 HH21 ARG 19 HH21 ARG 19 2.110 26.247 3.694 181 HH22 ARG 19 HH22 ARG 19 1.262 26.824 5.092 182 H ASP 20 HN ASP 20 0.297 22.455 -1.215 183 HA ASP 20 HA ASP 20 2.819 23.018 -2.686 184 HB2 ASP 20 HB2 ASP 20 1.082 21.857 -4.089 185 HB3 ASP 20 HB1 ASP 20 -0.051 23.154 -3.738 186 H ILE 21 HN ILE 21 2.906 25.287 -3.535 187 HA ILE 21 HA ILE 21 2.322 27.275 -1.652 188 HB ILE 21 HB ILE 21 4.231 27.160 -3.317 189 HG12 ILE 21 HG12 ILE 21 2.716 29.810 -3.270 190 HG13 ILE 21 HG11 ILE 21 3.771 29.225 -1.991 191 HG21 ILE 21 HG21 ILE 21 3.913 28.056 -5.584 192 HG22 ILE 21 HG22 ILE 21 2.179 28.210 -5.298 193 HG23 ILE 21 HG23 ILE 21 2.929 26.610 -5.331 194 HD11 ILE 21 HD11 ILE 21 5.674 29.325 -3.542 195 HD12 ILE 21 HD12 ILE 21 4.885 30.888 -3.335 196 HD13 ILE 21 HD13 ILE 21 4.598 29.947 -4.799 197 H THR 22 HN THR 22 -0.036 25.853 -3.576 198 HA THR 22 HA THR 22 -1.671 28.296 -3.835 199 HB THR 22 HB THR 22 -3.261 26.711 -5.027 200 HG1 THR 22 HG1 THR 22 -1.227 24.830 -5.343 201 HG21 THR 22 HG21 THR 22 -0.448 26.830 -6.193 202 HG22 THR 22 HG22 THR 22 -1.712 28.049 -6.400 203 HG23 THR 22 HG23 THR 22 -1.913 26.443 -7.095 204 H GLY 23 HN GLY 23 -0.938 25.763 -1.806 205 HA2 GLY 23 HA2 GLY 23 -1.717 25.308 0.365 206 HA3 GLY 23 HA1 GLY 23 -3.173 26.229 0.026 207 H GLU 24 HN GLU 24 -1.967 23.632 -2.050 208 HA GLU 24 HA GLU 24 -4.352 22.004 -1.453 209 HB2 GLU 24 HB2 GLU 24 -2.477 22.027 -3.871 210 HB3 GLU 24 HB1 GLU 24 -3.835 20.926 -3.668 211 HG2 GLU 24 HG2 GLU 24 -4.058 23.943 -3.904 212 HG3 GLU 24 HG1 GLU 24 -4.280 22.808 -5.231 213 H ILE 25 HN ILE 25 -4.016 19.943 -0.568 214 HA ILE 25 HA ILE 25 -1.324 19.127 0.191 215 HB ILE 25 HB ILE 25 -4.016 17.740 0.631 216 HG12 ILE 25 HG12 ILE 25 -3.853 19.861 1.885 217 HG13 ILE 25 HG11 ILE 25 -3.785 18.503 2.996 218 HG21 ILE 25 HG21 ILE 25 -1.299 17.009 1.792 219 HG22 ILE 25 HG22 ILE 25 -2.224 16.066 0.623 220 HG23 ILE 25 HG23 ILE 25 -2.844 16.285 2.258 221 HD11 ILE 25 HD11 ILE 25 -1.472 20.196 2.071 222 HD12 ILE 25 HD12 ILE 25 -1.332 18.782 3.121 223 HD13 ILE 25 HD13 ILE 25 -2.233 20.197 3.664 224 H LEU 26 HN LEU 26 -0.038 18.137 -1.282 225 HA LEU 26 HA LEU 26 -1.192 16.453 -3.419 226 HB2 LEU 26 HB2 LEU 26 1.525 17.775 -3.045 227 HB3 LEU 26 HB1 LEU 26 1.334 16.447 -4.174 228 HG LEU 26 HG LEU 26 -0.367 17.778 -5.430 229 HD11 LEU 26 HD11 LEU 26 0.374 20.064 -3.590 230 HD12 LEU 26 HD12 LEU 26 -1.184 19.236 -3.655 231 HD13 LEU 26 HD13 LEU 26 -0.630 20.173 -5.039 232 HD21 LEU 26 HD21 LEU 26 1.962 17.737 -6.174 233 HD22 LEU 26 HD22 LEU 26 2.337 19.126 -5.150 234 HD23 LEU 26 HD23 LEU 26 1.226 19.303 -6.509 235 H GLU 27 HN GLU 27 -1.337 14.350 -3.017 236 HA GLU 27 HA GLU 27 0.207 13.022 -0.936 237 HB2 GLU 27 HB2 GLU 27 -1.962 12.035 -2.836 238 HB3 GLU 27 HB1 GLU 27 -1.212 11.045 -1.588 239 HG2 GLU 27 HG2 GLU 27 -2.073 12.536 0.155 240 HG3 GLU 27 HG1 GLU 27 -2.775 13.589 -1.070 241 H THR 28 HN THR 28 2.075 12.100 -1.336 242 HA THR 28 HA THR 28 2.847 11.195 -4.047 243 HB THR 28 HB THR 28 5.203 12.085 -3.511 244 HG1 THR 28 HG1 THR 28 4.203 12.627 -1.203 245 HG21 THR 28 HG21 THR 28 3.002 14.143 -3.929 246 HG22 THR 28 HG22 THR 28 3.782 13.180 -5.185 247 HG23 THR 28 HG23 THR 28 4.721 14.378 -4.293 248 H TRP 29 HN TRP 29 4.556 9.583 -4.045 249 HA TRP 29 HA TRP 29 4.344 7.840 -1.663 250 HB2 TRP 29 HB2 TRP 29 4.482 7.121 -4.622 251 HB3 TRP 29 HB1 TRP 29 4.556 5.949 -3.312 252 HD1 TRP 29 HD1 TRP 29 2.064 7.929 -5.368 253 HE1 TRP 29 HE1 TRP 29 -0.316 7.366 -4.567 254 HE3 TRP 29 HE3 TRP 29 3.202 5.383 -1.066 255 HZ2 TRP 29 HZ2 TRP 29 -1.560 6.049 -2.408 256 HZ3 TRP 29 HZ3 TRP 29 1.360 4.509 0.317 257 HH2 TRP 29 HH2 TRP 29 -0.981 4.837 -0.342 258 H GLU 30 HN GLU 30 6.147 8.074 -0.630 259 HA GLU 30 HA GLU 30 8.789 8.220 -1.942 260 HB2 GLU 30 HB2 GLU 30 9.688 8.719 0.291 261 HB3 GLU 30 HB1 GLU 30 8.336 9.789 -0.051 262 HG2 GLU 30 HG2 GLU 30 6.875 8.545 1.405 263 HG3 GLU 30 HG1 GLU 30 8.069 7.269 1.603 264 H ASP 31 HN ASP 31 10.425 6.642 -1.508 265 HA ASP 31 HA ASP 31 9.492 3.997 -0.666 266 HB2 ASP 31 HB2 ASP 31 11.683 3.138 -1.334 267 HB3 ASP 31 HB1 ASP 31 11.050 4.151 -2.621 268 H GLY 32 HN GLY 32 9.996 3.082 1.296 269 HA2 GLY 32 HA2 GLY 32 10.889 5.017 3.369 270 HA3 GLY 32 HA1 GLY 32 9.719 3.722 3.593 271 H HIS 33 HN HIS 33 10.438 1.937 4.550 272 HA HIS 33 HA HIS 33 13.363 1.430 4.687 273 HB2 HIS 33 HB2 HIS 33 11.145 0.924 6.714 274 HB3 HIS 33 HB1 HIS 33 12.726 0.162 6.834 275 HD1 HIS 33 HD1 HIS 33 11.122 3.590 6.945 276 HD2 HIS 33 HD2 HIS 33 14.681 1.708 7.990 277 HE1 HIS 33 HE1 HIS 33 12.397 5.275 8.295 278 HE2 HIS 33 HE2 HIS 33 14.456 4.044 9.080 279 H THR 34 HN THR 34 14.101 -0.555 4.049 280 HA THR 34 HA THR 34 12.178 -2.435 2.900 281 HB THR 34 HB THR 34 15.207 -2.306 2.563 282 HG1 THR 34 HG1 THR 34 13.262 -1.493 0.676 283 HG21 THR 34 HG21 THR 34 14.231 -4.543 2.033 284 HG22 THR 34 HG22 THR 34 14.805 -3.730 0.576 285 HG23 THR 34 HG23 THR 34 13.081 -3.766 0.939 286 H LEU 35 HN LEU 35 11.519 -3.910 4.421 287 HA LEU 35 HA LEU 35 13.568 -5.151 6.161 288 HB2 LEU 35 HB2 LEU 35 11.711 -5.852 7.660 289 HB3 LEU 35 HB1 LEU 35 11.929 -4.120 7.569 290 HG LEU 35 HG LEU 35 9.748 -5.494 5.958 291 HD11 LEU 35 HD11 LEU 35 8.168 -5.046 7.797 292 HD12 LEU 35 HD12 LEU 35 9.507 -4.543 8.834 293 HD13 LEU 35 HD13 LEU 35 9.404 -6.214 8.268 294 HD21 LEU 35 HD21 LEU 35 10.245 -3.150 5.383 295 HD22 LEU 35 HD22 LEU 35 9.999 -2.670 7.061 296 HD23 LEU 35 HD23 LEU 35 8.648 -3.293 6.111 297 H TRP 36 HN TRP 36 13.216 -7.301 6.788 298 HA TRP 36 HA TRP 36 13.141 -9.224 4.801 299 HB2 TRP 36 HB2 TRP 36 12.521 -9.704 7.743 300 HB3 TRP 36 HB1 TRP 36 13.212 -10.849 6.605 301 HD1 TRP 36 HD1 TRP 36 14.254 -8.610 9.309 302 HE1 TRP 36 HE1 TRP 36 16.787 -8.242 9.288 303 HE3 TRP 36 HE3 TRP 36 15.303 -10.361 4.616 304 HZ2 TRP 36 HZ2 TRP 36 18.946 -8.608 7.541 305 HZ3 TRP 36 HZ3 TRP 36 17.634 -10.293 3.849 306 HH2 TRP 36 HH2 TRP 36 19.419 -9.438 5.279 307 H ALA 37 HN ALA 37 11.521 -10.098 3.701 308 HA ALA 37 HA ALA 37 8.750 -10.228 4.754 309 HB1 ALA 37 HB1 ALA 37 7.905 -9.486 2.577 310 HB2 ALA 37 HB2 ALA 37 9.551 -9.407 1.934 311 HB3 ALA 37 HB3 ALA 37 9.048 -8.301 3.205 312 H SER 38 HN SER 38 7.342 -11.806 3.439 313 HA SER 38 HA SER 38 8.704 -13.422 1.411 314 HB2 SER 38 HB2 SER 38 8.575 -14.756 3.527 315 HB3 SER 38 HB1 SER 38 6.838 -14.473 3.600 316 HG SER 38 HG SER 38 7.199 -16.475 2.695 317 H VAL 39 HN VAL 39 7.642 -12.644 -0.388 318 HA VAL 39 HA VAL 39 4.839 -11.731 -0.195 319 HB VAL 39 HB VAL 39 6.875 -11.262 -2.435 320 HG11 VAL 39 HG11 VAL 39 4.524 -11.130 -3.236 321 HG12 VAL 39 HG12 VAL 39 5.285 -9.540 -3.254 322 HG13 VAL 39 HG13 VAL 39 4.152 -9.954 -1.969 323 HG21 VAL 39 HG21 VAL 39 7.098 -8.978 -1.549 324 HG22 VAL 39 HG22 VAL 39 7.593 -10.174 -0.351 325 HG23 VAL 39 HG23 VAL 39 6.021 -9.383 -0.210 326 H ASN 40 HN ASN 40 3.380 -13.276 -0.779 327 HA ASN 40 HA ASN 40 3.924 -14.979 -3.142 328 HB2 ASN 40 HB2 ASN 40 2.659 -15.926 -0.516 329 HB3 ASN 40 HB1 ASN 40 2.908 -16.902 -1.959 330 HD21 ASN 40 HD21 ASN 40 4.480 -15.330 0.747 331 HD22 ASN 40 HD22 ASN 40 5.964 -16.205 0.647 332 H MET 41 HN MET 41 2.296 -14.862 -4.578 333 HA MET 41 HA MET 41 -0.188 -13.538 -4.248 334 HB2 MET 41 HB2 MET 41 0.738 -15.669 -6.221 335 HB3 MET 41 HB1 MET 41 -0.810 -14.850 -6.355 336 HG2 MET 41 HG2 MET 41 1.862 -13.425 -6.438 337 HG3 MET 41 HG1 MET 41 0.966 -13.963 -7.860 338 HE1 MET 41 HE1 MET 41 -2.117 -13.329 -6.691 339 HE2 MET 41 HE2 MET 41 -1.586 -13.109 -8.360 340 HE3 MET 41 HE3 MET 41 -2.340 -11.773 -7.498 341 H VAL 42 HN VAL 42 -2.138 -14.281 -3.409 342 HA VAL 42 HA VAL 42 -2.190 -16.735 -1.921 343 HB VAL 42 HB VAL 42 -4.396 -16.171 -1.176 344 HG11 VAL 42 HG11 VAL 42 -2.857 -13.572 -1.458 345 HG12 VAL 42 HG12 VAL 42 -2.653 -14.784 -0.191 346 HG13 VAL 42 HG13 VAL 42 -4.160 -13.878 -0.302 347 HG21 VAL 42 HG21 VAL 42 -5.814 -14.353 -2.132 348 HG22 VAL 42 HG22 VAL 42 -5.527 -15.655 -3.286 349 HG23 VAL 42 HG23 VAL 42 -4.637 -14.141 -3.433 350 H SER 43 HN SER 43 -3.519 -18.556 -2.273 351 HA SER 43 HA SER 43 -4.149 -19.261 -4.995 352 HB2 SER 43 HB2 SER 43 -4.849 -20.708 -2.404 353 HB3 SER 43 HB1 SER 43 -4.874 -21.401 -4.027 354 HG SER 43 HG SER 43 -2.505 -20.517 -3.851 355 H SER 44 HN SER 44 -6.367 -20.160 -5.495 356 HA SER 44 HA SER 44 -8.397 -18.230 -5.269 357 HB2 SER 44 HB2 SER 44 -9.864 -20.067 -6.238 358 HB3 SER 44 HB1 SER 44 -8.388 -19.750 -7.144 359 HG SER 44 HG SER 44 -8.375 -21.741 -5.155 360 H LYS 45 HN LYS 45 -7.483 -20.785 -3.141 361 HA LYS 45 HA LYS 45 -9.732 -21.539 -1.739 362 HB2 LYS 45 HB2 LYS 45 -8.237 -22.111 0.115 363 HB3 LYS 45 HB1 LYS 45 -7.452 -22.496 -1.412 364 HG2 LYS 45 HG2 LYS 45 -6.195 -20.314 -1.236 365 HG3 LYS 45 HG1 LYS 45 -6.885 -20.104 0.373 366 HD2 LYS 45 HD2 LYS 45 -5.102 -22.408 -0.493 367 HD3 LYS 45 HD1 LYS 45 -4.582 -20.997 0.425 368 HE2 LYS 45 HE2 LYS 45 -6.685 -22.951 1.402 369 HE3 LYS 45 HE1 LYS 45 -4.971 -23.059 1.808 370 HZ1 LYS 45 HZ1 LYS 45 -5.079 -20.951 2.890 371 HZ2 LYS 45 HZ2 LYS 45 -6.319 -21.922 3.505 372 HZ3 LYS 45 HZ3 LYS 45 -6.671 -20.697 2.392 373 H GLU 46 HN GLU 46 -7.895 -18.519 -1.406 374 HA GLU 46 HA GLU 46 -9.062 -17.676 1.056 375 HB2 GLU 46 HB2 GLU 46 -7.644 -16.034 -1.083 376 HB3 GLU 46 HB1 GLU 46 -8.062 -15.441 0.527 377 HG2 GLU 46 HG2 GLU 46 -6.113 -17.654 -0.163 378 HG3 GLU 46 HG1 GLU 46 -5.714 -16.055 0.454 379 H ALA 47 HN ALA 47 -9.708 -16.953 -2.357 380 HA ALA 47 HA ALA 47 -11.869 -15.151 -2.055 381 HB1 ALA 47 HB1 ALA 47 -10.651 -15.417 -4.188 382 HB2 ALA 47 HB2 ALA 47 -12.383 -15.677 -4.420 383 HB3 ALA 47 HB3 ALA 47 -11.282 -17.058 -4.353 384 H ILE 48 HN ILE 48 -11.747 -18.674 -2.459 385 HA ILE 48 HA ILE 48 -14.479 -19.326 -2.411 386 HB ILE 48 HB ILE 48 -12.091 -20.960 -1.431 387 HG12 ILE 48 HG12 ILE 48 -13.538 -21.080 -4.119 388 HG13 ILE 48 HG11 ILE 48 -12.000 -20.274 -3.843 389 HG21 ILE 48 HG21 ILE 48 -13.504 -22.979 -1.686 390 HG22 ILE 48 HG22 ILE 48 -14.895 -21.962 -2.059 391 HG23 ILE 48 HG23 ILE 48 -14.152 -21.885 -0.461 392 HD11 ILE 48 HD11 ILE 48 -11.678 -22.427 -4.901 393 HD12 ILE 48 HD12 ILE 48 -12.514 -23.237 -3.577 394 HD13 ILE 48 HD13 ILE 48 -10.971 -22.429 -3.285 395 H SER 49 HN SER 49 -12.143 -18.953 0.223 396 HA SER 49 HA SER 49 -13.764 -19.858 2.371 397 HB2 SER 49 HB2 SER 49 -11.264 -19.746 2.423 398 HB3 SER 49 HB1 SER 49 -11.349 -17.986 2.458 399 HG SER 49 HG SER 49 -12.241 -19.829 4.430 400 H SER 50 HN SER 50 -13.211 -16.682 0.934 401 HA SER 50 HA SER 50 -14.861 -15.280 2.908 402 HB2 SER 50 HB2 SER 50 -14.176 -13.259 1.633 403 HB3 SER 50 HB1 SER 50 -12.781 -14.217 2.109 404 HG SER 50 HG SER 50 -12.393 -14.688 0.070 405 H GLY 51 HN GLY 51 -15.409 -17.042 0.094 406 HA2 GLY 51 HA2 GLY 51 -17.494 -17.558 -0.825 407 HA3 GLY 51 HA1 GLY 51 -18.179 -16.110 -0.105 408 H ALA 52 HN ALA 52 -17.278 -14.015 -1.024 409 HA ALA 52 HA ALA 52 -16.233 -14.014 -3.726 410 HB1 ALA 52 HB1 ALA 52 -18.158 -12.814 -4.724 411 HB2 ALA 52 HB2 ALA 52 -19.065 -13.003 -3.218 412 HB3 ALA 52 HB3 ALA 52 -18.623 -14.423 -4.168 413 H GLU 53 HN GLU 53 -15.900 -12.894 -0.834 414 HA GLU 53 HA GLU 53 -16.013 -10.012 -1.145 415 HB2 GLU 53 HB2 GLU 53 -16.372 -11.122 1.062 416 HB3 GLU 53 HB1 GLU 53 -14.717 -11.705 1.038 417 HG2 GLU 53 HG2 GLU 53 -14.843 -9.803 2.505 418 HG3 GLU 53 HG1 GLU 53 -13.913 -9.343 1.079 419 H LEU 54 HN LEU 54 -13.246 -12.165 -0.335 420 HA LEU 54 HA LEU 54 -11.281 -10.494 -1.609 421 HB2 LEU 54 HB2 LEU 54 -11.082 -13.368 -0.611 422 HB3 LEU 54 HB1 LEU 54 -9.717 -12.419 -1.184 423 HG LEU 54 HG LEU 54 -11.381 -11.796 1.293 424 HD11 LEU 54 HD11 LEU 54 -9.381 -12.444 2.574 425 HD12 LEU 54 HD12 LEU 54 -8.567 -12.929 1.085 426 HD13 LEU 54 HD13 LEU 54 -10.010 -13.789 1.627 427 HD21 LEU 54 HD21 LEU 54 -10.544 -9.746 0.255 428 HD22 LEU 54 HD22 LEU 54 -8.905 -10.401 0.210 429 HD23 LEU 54 HD23 LEU 54 -9.681 -10.063 1.761 430 H ALA 55 HN ALA 55 -10.053 -11.089 -3.465 431 HA ALA 55 HA ALA 55 -11.445 -12.830 -5.420 432 HB1 ALA 55 HB1 ALA 55 -11.828 -10.435 -5.926 433 HB2 ALA 55 HB2 ALA 55 -10.832 -11.195 -7.166 434 HB3 ALA 55 HB3 ALA 55 -10.085 -10.148 -5.953 435 H ILE 56 HN ILE 56 -10.038 -13.751 -7.067 436 HA ILE 56 HA ILE 56 -7.404 -14.460 -6.136 437 HB ILE 56 HB ILE 56 -8.484 -14.825 -8.978 438 HG12 ILE 56 HG12 ILE 56 -8.742 -16.814 -6.675 439 HG13 ILE 56 HG11 ILE 56 -10.056 -15.812 -7.279 440 HG21 ILE 56 HG21 ILE 56 -6.313 -16.356 -7.484 441 HG22 ILE 56 HG22 ILE 56 -6.052 -15.171 -8.765 442 HG23 ILE 56 HG23 ILE 56 -6.868 -16.690 -9.127 443 HD11 ILE 56 HD11 ILE 56 -8.605 -17.948 -8.851 444 HD12 ILE 56 HD12 ILE 56 -9.927 -16.943 -9.451 445 HD13 ILE 56 HD13 ILE 56 -10.210 -18.079 -8.134 446 H GLY 57 HN GLY 57 -5.455 -13.450 -6.759 447 HA2 GLY 57 HA2 GLY 57 -4.238 -11.727 -8.020 448 HA3 GLY 57 HA1 GLY 57 -5.734 -10.803 -8.108 449 H THR 58 HN THR 58 -6.056 -11.921 -5.167 450 HA THR 58 HA THR 58 -4.898 -9.767 -3.683 451 HB THR 58 HB THR 58 -6.203 -12.392 -2.834 452 HG1 THR 58 HG1 THR 58 -7.509 -10.762 -3.866 453 HG21 THR 58 HG21 THR 58 -5.441 -10.068 -1.021 454 HG22 THR 58 HG22 THR 58 -4.730 -11.683 -0.985 455 HG23 THR 58 HG23 THR 58 -6.425 -11.452 -0.549 456 H VAL 59 HN VAL 59 -3.053 -9.817 -2.357 457 HA VAL 59 HA VAL 59 -1.137 -12.039 -2.757 458 HB VAL 59 HB VAL 59 -0.408 -9.078 -2.506 459 HG11 VAL 59 HG11 VAL 59 1.846 -9.828 -3.254 460 HG12 VAL 59 HG12 VAL 59 1.286 -11.500 -3.250 461 HG13 VAL 59 HG13 VAL 59 1.373 -10.598 -1.735 462 HG21 VAL 59 HG21 VAL 59 0.093 -9.136 -4.945 463 HG22 VAL 59 HG22 VAL 59 -1.620 -9.389 -4.608 464 HG23 VAL 59 HG23 VAL 59 -0.596 -10.759 -5.034 465 H ARG 60 HN ARG 60 -0.381 -12.892 -0.910 466 HA ARG 60 HA ARG 60 -0.818 -11.526 1.665 467 HB2 ARG 60 HB2 ARG 60 -1.641 -13.963 1.080 468 HB3 ARG 60 HB1 ARG 60 0.026 -14.422 1.381 469 HG2 ARG 60 HG2 ARG 60 -0.139 -13.564 3.677 470 HG3 ARG 60 HG1 ARG 60 -1.786 -13.011 3.363 471 HD2 ARG 60 HD2 ARG 60 -2.208 -15.550 2.730 472 HD3 ARG 60 HD1 ARG 60 -0.756 -15.819 3.699 473 HE ARG 60 HE ARG 60 -1.915 -14.783 5.577 474 HH11 ARG 60 HH11 ARG 60 -3.869 -16.066 2.975 475 HH12 ARG 60 HH12 ARG 60 -5.345 -15.991 3.875 476 HH21 ARG 60 HH21 ARG 60 -3.853 -14.667 6.750 477 HH22 ARG 60 HH22 ARG 60 -5.336 -15.209 6.033 478 H ILE 61 HN ILE 61 0.901 -10.893 2.856 479 HA ILE 61 HA ILE 61 3.651 -11.296 1.793 480 HB ILE 61 HB ILE 61 2.384 -8.597 2.478 481 HG12 ILE 61 HG12 ILE 61 3.397 -9.391 -0.280 482 HG13 ILE 61 HG11 ILE 61 1.765 -9.813 0.218 483 HG21 ILE 61 HG21 ILE 61 4.506 -7.584 1.687 484 HG22 ILE 61 HG22 ILE 61 5.199 -9.196 1.490 485 HG23 ILE 61 HG23 ILE 61 4.754 -8.615 3.096 486 HD11 ILE 61 HD11 ILE 61 1.794 -7.802 -1.094 487 HD12 ILE 61 HD12 ILE 61 2.873 -7.030 0.058 488 HD13 ILE 61 HD13 ILE 61 1.237 -7.468 0.542 489 H TRP 62 HN TRP 62 4.625 -12.253 3.476 490 HA TRP 62 HA TRP 62 3.818 -11.644 6.250 491 HB2 TRP 62 HB2 TRP 62 5.551 -13.922 5.147 492 HB3 TRP 62 HB1 TRP 62 4.990 -13.766 6.808 493 HD1 TRP 62 HD1 TRP 62 3.173 -13.791 3.350 494 HE1 TRP 62 HE1 TRP 62 1.170 -15.352 3.524 495 HE3 TRP 62 HE3 TRP 62 3.766 -15.358 8.171 496 HZ2 TRP 62 HZ2 TRP 62 -0.019 -17.060 5.415 497 HZ3 TRP 62 HZ3 TRP 62 2.154 -16.973 9.092 498 HH2 TRP 62 HH2 TRP 62 0.292 -17.813 7.740 499 H ILE 63 HN ILE 63 5.007 -10.158 7.244 500 HA ILE 63 HA ILE 63 7.901 -9.874 6.602 501 HB ILE 63 HB ILE 63 7.764 -7.449 6.889 502 HG12 ILE 63 HG12 ILE 63 4.735 -7.705 7.132 503 HG13 ILE 63 HG11 ILE 63 5.802 -7.445 8.500 504 HG21 ILE 63 HG21 ILE 63 6.473 -6.826 4.869 505 HG22 ILE 63 HG22 ILE 63 5.693 -8.411 4.878 506 HG23 ILE 63 HG23 ILE 63 7.432 -8.282 4.623 507 HD11 ILE 63 HD11 ILE 63 5.402 -5.574 6.165 508 HD12 ILE 63 HD12 ILE 63 6.498 -5.292 7.522 509 HD13 ILE 63 HD13 ILE 63 4.758 -5.378 7.795 510 H ARG 64 HN ARG 64 9.233 -9.364 8.429 511 HA ARG 64 HA ARG 64 8.530 -10.232 10.944 512 HB2 ARG 64 HB2 ARG 64 10.524 -9.099 11.798 513 HB3 ARG 64 HB1 ARG 64 10.869 -9.840 10.239 514 HG2 ARG 64 HG2 ARG 64 10.784 -7.675 9.125 515 HG3 ARG 64 HG1 ARG 64 10.245 -6.891 10.614 516 HD2 ARG 64 HD2 ARG 64 12.942 -8.224 10.194 517 HD3 ARG 64 HD1 ARG 64 12.632 -6.485 10.175 518 HE ARG 64 HE ARG 64 12.046 -8.079 12.591 519 HH11 ARG 64 HH11 ARG 64 13.853 -5.446 11.097 520 HH12 ARG 64 HH12 ARG 64 14.536 -4.909 12.597 521 HH21 ARG 64 HH21 ARG 64 12.955 -7.348 14.551 522 HH22 ARG 64 HH22 ARG 64 14.027 -5.984 14.552 523 H TYR 65 HN TYR 65 8.193 -9.075 12.964 524 HA TYR 65 HA TYR 65 5.904 -7.416 12.824 525 HB2 TYR 65 HB2 TYR 65 6.387 -9.040 14.667 526 HB3 TYR 65 HB1 TYR 65 7.672 -7.993 15.251 527 HD1 TYR 65 HD2 TYR 65 3.998 -8.385 14.924 528 HD2 TYR 65 HD1 TYR 65 7.134 -5.938 16.492 529 HE1 TYR 65 HE2 TYR 65 2.364 -7.168 16.300 530 HE2 TYR 65 HE1 TYR 65 5.501 -4.731 17.866 531 HH TYR 65 HH TYR 65 2.380 -5.827 18.423 532 H ARG 66 HN ARG 66 5.662 -5.235 12.993 533 HA ARG 66 HA ARG 66 7.771 -3.458 13.824 534 HB2 ARG 66 HB2 ARG 66 8.372 -4.135 11.439 535 HB3 ARG 66 HB1 ARG 66 6.894 -3.350 10.900 536 HG2 ARG 66 HG2 ARG 66 7.703 -1.186 11.645 537 HG3 ARG 66 HG1 ARG 66 9.126 -1.929 12.386 538 HD2 ARG 66 HD2 ARG 66 9.824 -2.707 10.089 539 HD3 ARG 66 HD1 ARG 66 8.471 -1.782 9.419 540 HE ARG 66 HE ARG 66 10.661 -0.559 10.999 541 HH11 ARG 66 HH11 ARG 66 8.603 -0.522 8.148 542 HH12 ARG 66 HH12 ARG 66 9.065 1.082 7.695 543 HH21 ARG 66 HH21 ARG 66 11.274 1.503 10.387 544 HH22 ARG 66 HH22 ARG 66 10.589 2.228 8.970 545 H LYS 67 HN LYS 67 6.974 -1.463 14.410 546 HA LYS 67 HA LYS 67 4.095 -1.345 14.836 547 HB2 LYS 67 HB2 LYS 67 6.305 0.520 15.804 548 HB3 LYS 67 HB1 LYS 67 4.634 0.522 16.370 549 HG2 LYS 67 HG2 LYS 67 6.649 -1.725 16.741 550 HG3 LYS 67 HG1 LYS 67 6.118 -0.589 17.983 551 HD2 LYS 67 HD2 LYS 67 4.323 -2.615 16.569 552 HD3 LYS 67 HD1 LYS 67 5.010 -2.815 18.179 553 HE2 LYS 67 HE2 LYS 67 3.715 -0.902 18.998 554 HE3 LYS 67 HE1 LYS 67 3.081 -0.614 17.375 555 HZ1 LYS 67 HZ1 LYS 67 1.513 -1.809 18.758 556 HZ2 LYS 67 HZ2 LYS 67 2.627 -3.056 18.995 557 HZ3 LYS 67 HZ3 LYS 67 1.999 -2.768 17.451 558 H ASP 68 HN ASP 68 6.034 -0.267 12.382 559 HA ASP 68 HA ASP 68 4.915 2.424 12.033 560 HB2 ASP 68 HB2 ASP 68 7.055 0.901 10.473 561 HB3 ASP 68 HB1 ASP 68 6.599 2.586 10.209 562 H ILE 69 HN ILE 69 4.370 -0.779 10.928 563 HA ILE 69 HA ILE 69 3.707 -0.256 8.200 564 HB ILE 69 HB ILE 69 2.821 -2.697 9.802 565 HG12 ILE 69 HG12 ILE 69 5.239 -2.448 10.130 566 HG13 ILE 69 HG11 ILE 69 4.945 -3.792 9.037 567 HG21 ILE 69 HG21 ILE 69 2.870 -3.824 7.586 568 HG22 ILE 69 HG22 ILE 69 3.309 -2.299 6.817 569 HG23 ILE 69 HG23 ILE 69 1.738 -2.471 7.606 570 HD11 ILE 69 HD11 ILE 69 5.569 -2.370 7.140 571 HD12 ILE 69 HD12 ILE 69 6.853 -2.483 8.340 572 HD13 ILE 69 HD13 ILE 69 5.865 -1.028 8.249 573 H ASN 70 HN ASN 70 1.868 0.541 7.393 574 HA ASN 70 HA ASN 70 -0.622 0.601 8.980 575 HB2 ASN 70 HB2 ASN 70 0.803 2.739 9.268 576 HB3 ASN 70 HB1 ASN 70 0.513 3.052 7.560 577 HD21 ASN 70 HD21 ASN 70 -0.983 2.840 10.734 578 HD22 ASN 70 HD22 ASN 70 -2.425 3.692 10.316 579 H ALA 71 HN ALA 71 -2.500 1.225 7.632 580 HA ALA 71 HA ALA 71 -2.658 -0.236 5.237 581 HB1 ALA 71 HB1 ALA 71 -4.952 0.654 5.067 582 HB2 ALA 71 HB2 ALA 71 -4.581 1.841 6.320 583 HB3 ALA 71 HB3 ALA 71 -4.586 0.121 6.709 584 H THR 72 HN THR 72 -1.927 3.126 5.839 585 HA THR 72 HA THR 72 -2.323 4.094 3.170 586 HB THR 72 HB THR 72 -1.002 6.105 3.974 587 HG1 THR 72 HG1 THR 72 -0.877 5.675 6.559 588 HG21 THR 72 HG21 THR 72 -2.603 6.872 5.691 589 HG22 THR 72 HG22 THR 72 -3.199 5.223 5.884 590 HG23 THR 72 HG23 THR 72 -3.440 6.077 4.359 591 H SER 73 HN SER 73 0.105 2.205 4.609 592 HA SER 73 HA SER 73 2.308 3.145 2.909 593 HB2 SER 73 HB2 SER 73 2.309 1.110 5.181 594 HB3 SER 73 HB1 SER 73 3.717 1.868 4.433 595 HG SER 73 HG SER 73 1.929 3.705 5.352 596 H ARG 74 HN ARG 74 2.164 2.219 0.904 597 HA ARG 74 HA ARG 74 1.105 -0.400 0.407 598 HB2 ARG 74 HB2 ARG 74 2.676 1.471 -1.414 599 HB3 ARG 74 HB1 ARG 74 1.879 -0.013 -1.941 600 HG2 ARG 74 HG2 ARG 74 -0.305 0.905 -1.403 601 HG3 ARG 74 HG1 ARG 74 0.435 2.366 -0.739 602 HD2 ARG 74 HD2 ARG 74 -0.413 2.803 -2.984 603 HD3 ARG 74 HD1 ARG 74 1.350 2.906 -2.976 604 HE ARG 74 HE ARG 74 0.275 0.323 -3.756 605 HH11 ARG 74 HH11 ARG 74 1.527 3.395 -4.873 606 HH12 ARG 74 HH12 ARG 74 1.626 2.905 -6.529 607 HH21 ARG 74 HH21 ARG 74 0.394 -0.323 -5.934 608 HH22 ARG 74 HH22 ARG 74 0.980 0.783 -7.135 609 H ILE 75 HN ILE 75 2.339 -2.113 -0.753 610 HA ILE 75 HA ILE 75 5.009 -2.551 0.455 611 HB ILE 75 HB ILE 75 2.960 -4.539 -0.633 612 HG12 ILE 75 HG12 ILE 75 2.244 -3.514 1.520 613 HG13 ILE 75 HG11 ILE 75 2.586 -5.229 1.699 614 HG21 ILE 75 HG21 ILE 75 4.441 -6.294 0.328 615 HG22 ILE 75 HG22 ILE 75 5.642 -5.056 0.676 616 HG23 ILE 75 HG23 ILE 75 5.193 -5.402 -0.993 617 HD11 ILE 75 HD11 ILE 75 4.379 -2.960 2.544 618 HD12 ILE 75 HD12 ILE 75 4.745 -4.679 2.724 619 HD13 ILE 75 HD13 ILE 75 3.387 -3.969 3.594 620 H LYS 76 HN LYS 76 6.484 -1.784 -1.077 621 HA LYS 76 HA LYS 76 6.203 -2.618 -3.899 622 HB2 LYS 76 HB2 LYS 76 6.744 -0.246 -3.512 623 HB3 LYS 76 HB1 LYS 76 8.188 -0.694 -2.608 624 HG2 LYS 76 HG2 LYS 76 9.267 -1.545 -4.585 625 HG3 LYS 76 HG1 LYS 76 7.768 -1.469 -5.512 626 HD2 LYS 76 HD2 LYS 76 9.287 0.367 -6.134 627 HD3 LYS 76 HD1 LYS 76 7.791 0.979 -5.427 628 HE2 LYS 76 HE2 LYS 76 9.635 2.261 -4.568 629 HE3 LYS 76 HE1 LYS 76 9.006 1.264 -3.257 630 HZ1 LYS 76 HZ1 LYS 76 11.409 0.665 -4.906 631 HZ2 LYS 76 HZ2 LYS 76 10.816 -0.302 -3.653 632 HZ3 LYS 76 HZ3 LYS 76 11.422 1.239 -3.314 633 H VAL 77 HN VAL 77 7.090 -4.512 -4.428 634 HA VAL 77 HA VAL 77 8.691 -5.968 -2.532 635 HB VAL 77 HB VAL 77 8.018 -6.755 -5.397 636 HG11 VAL 77 HG11 VAL 77 8.836 -8.488 -3.032 637 HG12 VAL 77 HG12 VAL 77 9.819 -8.140 -4.456 638 HG13 VAL 77 HG13 VAL 77 8.337 -9.083 -4.619 639 HG21 VAL 77 HG21 VAL 77 6.106 -7.983 -4.456 640 HG22 VAL 77 HG22 VAL 77 5.977 -6.249 -4.147 641 HG23 VAL 77 HG23 VAL 77 6.482 -7.338 -2.854 642 H SER 78 HN SER 78 10.803 -5.800 -2.284 643 HA SER 78 HA SER 78 12.614 -4.663 -4.209 644 HB2 SER 78 HB2 SER 78 13.184 -6.049 -1.559 645 HB3 SER 78 HB1 SER 78 14.346 -5.094 -2.490 646 HG SER 78 HG SER 78 13.582 -3.486 -1.400 647 H THR 79 HN THR 79 11.593 -7.872 -3.416 648 HA THR 79 HA THR 79 12.874 -9.081 -5.634 649 HB THR 79 HB THR 79 14.906 -8.978 -4.236 650 HG1 THR 79 HG1 THR 79 14.412 -10.866 -5.603 651 HG21 THR 79 HG21 THR 79 15.121 -10.261 -2.137 652 HG22 THR 79 HG22 THR 79 13.403 -10.659 -2.202 653 HG23 THR 79 HG23 THR 79 13.910 -8.983 -1.980 654 H GLY 80 HN GLY 80 11.816 -10.939 -6.167 655 HA2 GLY 80 HA2 GLY 80 10.649 -12.968 -4.984 656 HA3 GLY 80 HA1 GLY 80 9.522 -11.709 -4.489 657 HA PRO 81 HA PRO 81 8.143 -13.452 -8.618 658 HB2 PRO 81 HB2 PRO 81 5.577 -14.029 -7.998 659 HB3 PRO 81 HB1 PRO 81 6.899 -15.097 -7.498 660 HG2 PRO 81 HG2 PRO 81 5.477 -12.963 -5.887 661 HG3 PRO 81 HG1 PRO 81 5.858 -14.635 -5.415 662 HD2 PRO 81 HD2 PRO 81 7.402 -12.505 -4.662 663 HD3 PRO 81 HD1 PRO 81 8.084 -14.123 -4.940 664 H LEU 82 HN LEU 82 7.390 -10.744 -6.745 665 HA LEU 82 HA LEU 82 5.946 -9.392 -8.944 666 HB2 LEU 82 HB2 LEU 82 5.393 -9.118 -5.954 667 HB3 LEU 82 HB1 LEU 82 4.607 -8.189 -7.222 668 HG LEU 82 HG LEU 82 4.360 -11.210 -6.896 669 HD11 LEU 82 HD11 LEU 82 2.097 -10.809 -6.061 670 HD12 LEU 82 HD12 LEU 82 2.364 -9.064 -6.126 671 HD13 LEU 82 HD13 LEU 82 3.307 -10.063 -5.018 672 HD21 LEU 82 HD21 LEU 82 2.528 -11.048 -8.534 673 HD22 LEU 82 HD22 LEU 82 4.053 -10.495 -9.219 674 HD23 LEU 82 HD23 LEU 82 2.836 -9.317 -8.723 675 H ALA 83 HN ALA 83 8.822 -9.498 -8.182 676 HA ALA 83 HA ALA 83 9.666 -7.249 -6.691 677 HB1 ALA 83 HB1 ALA 83 11.896 -7.686 -7.611 678 HB2 ALA 83 HB2 ALA 83 11.201 -8.742 -8.847 679 HB3 ALA 83 HB3 ALA 83 11.111 -9.198 -7.143 680 H GLY 84 HN GLY 84 9.131 -5.224 -7.187 681 HA2 GLY 84 HA2 GLY 84 9.753 -3.302 -8.638 682 HA3 GLY 84 HA1 GLY 84 9.203 -4.261 -10.010 683 H ARG 85 HN ARG 85 6.927 -5.398 -8.777 684 HA ARG 85 HA ARG 85 5.008 -3.286 -9.163 685 HB2 ARG 85 HB2 ARG 85 4.608 -6.203 -8.356 686 HB3 ARG 85 HB1 ARG 85 3.306 -5.085 -8.774 687 HG2 ARG 85 HG2 ARG 85 4.209 -4.871 -11.061 688 HG3 ARG 85 HG1 ARG 85 5.539 -5.956 -10.641 689 HD2 ARG 85 HD2 ARG 85 3.913 -7.772 -10.220 690 HD3 ARG 85 HD1 ARG 85 2.591 -6.688 -10.669 691 HE ARG 85 HE ARG 85 4.330 -6.671 -12.816 692 HH11 ARG 85 HH11 ARG 85 2.400 -9.120 -11.189 693 HH12 ARG 85 HH12 ARG 85 2.257 -10.103 -12.610 694 HH21 ARG 85 HH21 ARG 85 4.122 -7.977 -14.660 695 HH22 ARG 85 HH22 ARG 85 3.216 -9.454 -14.569 696 H VAL 86 HN VAL 86 3.735 -2.314 -7.677 697 HA VAL 86 HA VAL 86 4.401 -2.655 -4.828 698 HB VAL 86 HB VAL 86 3.002 -0.235 -6.009 699 HG11 VAL 86 HG11 VAL 86 4.634 -0.569 -3.478 700 HG12 VAL 86 HG12 VAL 86 2.872 -0.515 -3.570 701 HG13 VAL 86 HG13 VAL 86 3.819 0.908 -4.003 702 HG21 VAL 86 HG21 VAL 86 5.995 -0.575 -5.769 703 HG22 VAL 86 HG22 VAL 86 5.168 0.935 -6.148 704 HG23 VAL 86 HG23 VAL 86 5.078 -0.427 -7.265 705 H LEU 87 HN LEU 87 2.976 -3.917 -3.907 706 HA LEU 87 HA LEU 87 0.211 -4.207 -4.618 707 HB2 LEU 87 HB2 LEU 87 1.576 -5.127 -2.050 708 HB3 LEU 87 HB1 LEU 87 0.020 -5.663 -2.653 709 HG LEU 87 HG LEU 87 1.418 -7.465 -3.147 710 HD11 LEU 87 HD11 LEU 87 1.486 -5.850 -5.698 711 HD12 LEU 87 HD12 LEU 87 0.156 -6.861 -5.129 712 HD13 LEU 87 HD13 LEU 87 1.695 -7.600 -5.559 713 HD21 LEU 87 HD21 LEU 87 3.584 -5.608 -4.141 714 HD22 LEU 87 HD22 LEU 87 3.666 -7.369 -4.032 715 HD23 LEU 87 HD23 LEU 87 3.543 -6.401 -2.564 716 H ASN 88 HN ASN 88 -1.588 -3.625 -3.379 717 HA ASN 88 HA ASN 88 -1.286 -1.254 -1.613 718 HB2 ASN 88 HB2 ASN 88 -3.511 -2.043 -3.566 719 HB3 ASN 88 HB1 ASN 88 -3.634 -0.697 -2.433 720 HD21 ASN 88 HD21 ASN 88 -2.875 1.260 -3.106 721 HD22 ASN 88 HD22 ASN 88 -1.915 1.511 -4.520 722 H ILE 89 HN ILE 89 -2.443 -1.312 0.383 723 HA ILE 89 HA ILE 89 -2.980 -4.038 1.309 724 HB ILE 89 HB ILE 89 -2.881 -1.419 2.881 725 HG12 ILE 89 HG12 ILE 89 -0.820 -3.669 2.675 726 HG13 ILE 89 HG11 ILE 89 -0.659 -2.051 1.994 727 HG21 ILE 89 HG21 ILE 89 -2.871 -2.829 4.928 728 HG22 ILE 89 HG22 ILE 89 -3.097 -4.271 3.939 729 HG23 ILE 89 HG23 ILE 89 -4.360 -3.041 4.002 730 HD11 ILE 89 HD11 ILE 89 0.646 -2.290 4.025 731 HD12 ILE 89 HD12 ILE 89 -0.801 -2.725 4.936 732 HD13 ILE 89 HD13 ILE 89 -0.639 -1.098 4.248 733 H ILE 90 HN ILE 90 -4.962 -4.825 1.315 734 HA ILE 90 HA ILE 90 -7.338 -3.190 1.030 735 HB ILE 90 HB ILE 90 -8.352 -5.741 1.626 736 HG12 ILE 90 HG12 ILE 90 -5.801 -6.214 0.008 737 HG13 ILE 90 HG11 ILE 90 -6.042 -6.722 1.671 738 HG21 ILE 90 HG21 ILE 90 -8.806 -5.971 -0.773 739 HG22 ILE 90 HG22 ILE 90 -7.643 -4.695 -1.136 740 HG23 ILE 90 HG23 ILE 90 -9.102 -4.323 -0.218 741 HD11 ILE 90 HD11 ILE 90 -7.877 -8.204 0.918 742 HD12 ILE 90 HD12 ILE 90 -6.318 -8.586 0.189 743 HD13 ILE 90 HD13 ILE 90 -7.537 -7.727 -0.749 744 H GLY 91 HN GLY 91 -8.425 -2.330 2.638 745 HA2 GLY 91 HA2 GLY 91 -9.287 -1.818 4.686 746 HA3 GLY 91 HA1 GLY 91 -8.893 -3.447 5.216 747 H GLN 92 HN GLN 92 -6.769 -3.856 6.027 748 HA GLN 92 HA GLN 92 -4.852 -1.847 6.654 749 HB2 GLN 92 HB2 GLN 92 -5.203 -1.902 9.163 750 HB3 GLN 92 HB1 GLN 92 -6.472 -1.054 8.285 751 HG2 GLN 92 HG2 GLN 92 -7.959 -2.981 8.496 752 HG3 GLN 92 HG1 GLN 92 -6.684 -3.913 9.278 753 HE21 GLN 92 HE21 GLN 92 -9.395 -3.117 10.217 754 HE22 GLN 92 HE22 GLN 92 -9.134 -2.331 11.733 755 HA PRO 93 HA PRO 93 -2.550 -5.685 7.128 756 HB2 PRO 93 HB2 PRO 93 -0.363 -4.889 8.561 757 HB3 PRO 93 HB1 PRO 93 -0.608 -4.431 6.871 758 HG2 PRO 93 HG2 PRO 93 -1.182 -2.840 9.368 759 HG3 PRO 93 HG1 PRO 93 -0.377 -2.316 7.873 760 HD2 PRO 93 HD2 PRO 93 -2.997 -1.769 8.367 761 HD3 PRO 93 HD1 PRO 93 -2.394 -2.065 6.721 762 H LEU 94 HN LEU 94 -1.832 -7.289 8.725 763 HA LEU 94 HA LEU 94 -3.275 -7.084 11.308 764 HB2 LEU 94 HB2 LEU 94 -4.643 -8.235 9.555 765 HB3 LEU 94 HB1 LEU 94 -3.371 -9.413 9.343 766 HG LEU 94 HG LEU 94 -5.496 -10.066 10.698 767 HD11 LEU 94 HD11 LEU 94 -2.788 -10.715 11.868 768 HD12 LEU 94 HD12 LEU 94 -3.591 -11.545 10.534 769 HD13 LEU 94 HD13 LEU 94 -4.287 -11.606 12.151 770 HD21 LEU 94 HD21 LEU 94 -5.477 -9.605 13.093 771 HD22 LEU 94 HD22 LEU 94 -5.587 -8.115 12.159 772 HD23 LEU 94 HD23 LEU 94 -4.053 -8.574 12.906 773 HA PRO 95 HA PRO 95 0.809 -8.813 12.731 774 HB2 PRO 95 HB2 PRO 95 -0.583 -8.286 15.355 775 HB3 PRO 95 HB1 PRO 95 1.056 -7.856 14.844 776 HG2 PRO 95 HG2 PRO 95 -0.843 -5.978 15.010 777 HG3 PRO 95 HG1 PRO 95 0.354 -5.942 13.696 778 HD2 PRO 95 HD2 PRO 95 -2.523 -6.869 13.616 779 HD3 PRO 95 HD1 PRO 95 -1.614 -5.900 12.430 780 H ASP 96 HN ASP 96 1.093 -10.995 13.157 781 HA ASP 96 HA ASP 96 -1.137 -12.757 12.941 782 HB2 ASP 96 HB2 ASP 96 0.430 -14.551 12.982 783 HB3 ASP 96 HB1 ASP 96 1.263 -13.227 12.174 784 H ALA 97 HN ALA 97 -1.236 -14.733 14.552 785 HA ALA 97 HA ALA 97 -2.507 -13.897 16.892 786 HB1 ALA 97 HB1 ALA 97 -1.350 -16.642 16.275 787 HB2 ALA 97 HB2 ALA 97 -2.929 -16.047 15.758 788 HB3 ALA 97 HB3 ALA 97 -2.600 -16.289 17.475 789 H ALA 98 HN ALA 98 0.868 -14.889 16.423 790 HA ALA 98 HA ALA 98 1.454 -14.930 19.302 791 HB1 ALA 98 HB1 ALA 98 2.468 -16.656 17.861 792 HB2 ALA 98 HB2 ALA 98 3.710 -15.657 18.614 793 HB3 ALA 98 HB3 ALA 98 3.286 -15.408 16.916 794 H ARG 99 HN ARG 99 1.429 -12.604 16.803 795 HA ARG 99 HA ARG 99 2.215 -10.516 16.461 796 HB2 ARG 99 HB2 ARG 99 2.473 -10.593 19.484 797 HB3 ARG 99 HB1 ARG 99 3.002 -9.183 18.577 798 HG2 ARG 99 HG2 ARG 99 0.783 -8.768 19.444 799 HG3 ARG 99 HG1 ARG 99 0.696 -8.898 17.688 800 HD2 ARG 99 HD2 ARG 99 -0.216 -11.152 17.865 801 HD3 ARG 99 HD1 ARG 99 0.000 -11.137 19.610 802 HE ARG 99 HE ARG 99 -1.797 -9.632 19.831 803 HH11 ARG 99 HH11 ARG 99 -1.391 -10.533 16.461 804 HH12 ARG 99 HH12 ARG 99 -3.025 -10.147 16.044 805 HH21 ARG 99 HH21 ARG 99 -3.934 -9.165 19.271 806 HH22 ARG 99 HH22 ARG 99 -4.472 -9.393 17.640 807 H THR 100 HN THR 100 3.966 -12.783 16.186 808 HA THR 100 HA THR 100 6.668 -11.782 16.753 809 HB THR 100 HB THR 100 6.105 -14.189 17.199 810 HG1 THR 100 HG1 THR 100 8.264 -13.276 16.251 811 HG21 THR 100 HG21 THR 100 5.858 -15.776 15.340 812 HG22 THR 100 HG22 THR 100 5.894 -14.448 14.180 813 HG23 THR 100 HG23 THR 100 4.545 -14.594 15.311 814 H ARG 101 HN ARG 101 4.387 -11.251 14.452 815 HA ARG 101 HA ARG 101 6.200 -10.189 12.523 816 HB2 ARG 101 HB2 ARG 101 5.639 -11.536 10.589 817 HB3 ARG 101 HB1 ARG 101 6.186 -12.638 11.848 818 HG2 ARG 101 HG2 ARG 101 3.890 -13.270 12.351 819 HG3 ARG 101 HG1 ARG 101 3.277 -12.083 11.201 820 HD2 ARG 101 HD2 ARG 101 3.205 -14.361 10.290 821 HD3 ARG 101 HD1 ARG 101 4.276 -13.314 9.352 822 HE ARG 101 HE ARG 101 6.164 -14.364 10.507 823 HH11 ARG 101 HH11 ARG 101 3.138 -16.166 10.570 824 HH12 ARG 101 HH12 ARG 101 3.925 -17.674 10.872 825 HH21 ARG 101 HH21 ARG 101 7.144 -16.353 10.931 826 HH22 ARG 101 HH22 ARG 101 6.182 -17.784 11.060 827 H LEU 102 HN LEU 102 5.012 -9.206 10.712 828 HA LEU 102 HA LEU 102 2.200 -8.511 11.256 829 HB2 LEU 102 HB2 LEU 102 4.534 -6.925 10.449 830 HB3 LEU 102 HB1 LEU 102 3.314 -6.809 9.207 831 HG LEU 102 HG LEU 102 3.179 -4.935 10.764 832 HD11 LEU 102 HD11 LEU 102 1.130 -5.653 9.675 833 HD12 LEU 102 HD12 LEU 102 0.796 -5.000 11.276 834 HD13 LEU 102 HD13 LEU 102 0.766 -6.747 11.014 835 HD21 LEU 102 HD21 LEU 102 2.599 -6.959 12.950 836 HD22 LEU 102 HD22 LEU 102 2.545 -5.200 13.111 837 HD23 LEU 102 HD23 LEU 102 4.074 -6.005 12.776 838 H GLU 103 HN GLU 103 0.949 -9.935 10.128 839 HA GLU 103 HA GLU 103 1.727 -10.905 7.484 840 HB2 GLU 103 HB2 GLU 103 0.569 -12.458 9.062 841 HB3 GLU 103 HB1 GLU 103 -0.839 -11.398 9.067 842 HG2 GLU 103 HG2 GLU 103 -1.004 -11.768 6.563 843 HG3 GLU 103 HG1 GLU 103 0.252 -12.994 6.728 844 H ILE 104 HN ILE 104 1.389 -9.588 5.807 845 HA ILE 104 HA ILE 104 -0.577 -7.406 5.979 846 HB ILE 104 HB ILE 104 1.582 -7.719 3.836 847 HG12 ILE 104 HG12 ILE 104 2.784 -7.768 5.976 848 HG13 ILE 104 HG11 ILE 104 3.053 -6.217 5.192 849 HG21 ILE 104 HG21 ILE 104 -0.199 -6.105 3.345 850 HG22 ILE 104 HG22 ILE 104 1.332 -5.270 3.608 851 HG23 ILE 104 HG23 ILE 104 0.101 -5.272 4.875 852 HD11 ILE 104 HD11 ILE 104 1.192 -6.772 7.484 853 HD12 ILE 104 HD12 ILE 104 1.384 -5.212 6.678 854 HD13 ILE 104 HD13 ILE 104 2.740 -5.932 7.543 855 H LEU 105 HN LEU 105 -2.506 -7.892 5.077 856 HA LEU 105 HA LEU 105 -2.669 -9.526 2.651 857 HB2 LEU 105 HB2 LEU 105 -5.094 -9.293 2.788 858 HB3 LEU 105 HB1 LEU 105 -4.447 -9.907 4.295 859 HG LEU 105 HG LEU 105 -5.115 -6.962 4.000 860 HD11 LEU 105 HD11 LEU 105 -7.099 -9.115 4.781 861 HD12 LEU 105 HD12 LEU 105 -7.127 -8.143 3.307 862 HD13 LEU 105 HD13 LEU 105 -7.360 -7.369 4.870 863 HD21 LEU 105 HD21 LEU 105 -5.059 -8.778 6.442 864 HD22 LEU 105 HD22 LEU 105 -5.439 -7.052 6.435 865 HD23 LEU 105 HD23 LEU 105 -3.824 -7.596 5.990 866 H CYS 106 HN CYS 106 -3.114 -8.730 0.711 867 HA CYS 106 HA CYS 106 -3.406 -5.908 0.121 868 HB2 CYS 106 HB2 CYS 106 -0.793 -7.337 -0.567 869 HB3 CYS 106 HB1 CYS 106 -1.293 -5.800 -1.264 870 HG CYS 106 HG CYS 106 -1.464 -5.386 1.929 871 H ARG 107 HN ARG 107 -3.192 -5.646 -2.372 872 HA ARG 107 HA ARG 107 -3.375 -8.109 -3.932 873 HB2 ARG 107 HB2 ARG 107 -5.364 -7.514 -5.157 874 HB3 ARG 107 HB1 ARG 107 -5.769 -7.452 -3.452 875 HG2 ARG 107 HG2 ARG 107 -5.192 -5.020 -5.181 876 HG3 ARG 107 HG1 ARG 107 -6.802 -5.640 -4.816 877 HD2 ARG 107 HD2 ARG 107 -6.363 -5.225 -2.391 878 HD3 ARG 107 HD1 ARG 107 -4.802 -4.518 -2.828 879 HE ARG 107 HE ARG 107 -6.924 -3.265 -4.252 880 HH11 ARG 107 HH11 ARG 107 -5.435 -3.285 -1.072 881 HH12 ARG 107 HH12 ARG 107 -5.954 -1.675 -0.692 882 HH21 ARG 107 HH21 ARG 107 -7.560 -1.159 -3.738 883 HH22 ARG 107 HH22 ARG 107 -7.151 -0.478 -2.199 884 H GLU 108 HN GLU 108 -2.741 -7.796 -6.152 885 HA GLU 108 HA GLU 108 -0.749 -5.896 -6.547 886 HB2 GLU 108 HB2 GLU 108 -0.926 -8.072 -7.738 887 HB3 GLU 108 HB1 GLU 108 -2.244 -7.418 -8.710 888 HG2 GLU 108 HG2 GLU 108 -0.704 -5.689 -9.595 889 HG3 GLU 108 HG1 GLU 108 0.606 -6.382 -8.640 890 H GLY 109 HN GLY 109 -1.082 -3.797 -6.514 891 HA2 GLY 109 HA2 GLY 109 -3.380 -2.521 -7.811 892 HA3 GLY 109 HA1 GLY 109 -2.200 -1.764 -6.757 893 H ALA 110 HN ALA 110 -1.335 -3.792 -9.468 894 HA ALA 110 HA ALA 110 -0.170 -1.537 -10.985 895 HB1 ALA 110 HB1 ALA 110 1.023 -3.295 -12.247 896 HB2 ALA 110 HB2 ALA 110 0.157 -4.550 -11.357 897 HB3 ALA 110 HB3 ALA 110 1.292 -3.497 -10.514 898 H GLU 111 HN GLU 111 -2.946 -1.643 -10.860 899 HA GLU 111 HA GLU 111 -4.143 -3.436 -12.762 900 HB2 GLU 111 HB2 GLU 111 -5.371 -1.135 -11.177 901 HB3 GLU 111 HB1 GLU 111 -6.271 -2.393 -12.024 902 HG2 GLU 111 HG2 GLU 111 -5.363 -4.100 -10.534 903 HG3 GLU 111 HG1 GLU 111 -4.351 -2.905 -9.729 904 H LYS 112 HN LYS 112 -3.313 -0.011 -12.694 905 HA LYS 112 HA LYS 112 -4.565 0.688 -15.193 906 HB2 LYS 112 HB2 LYS 112 -2.327 2.129 -13.683 907 HB3 LYS 112 HB1 LYS 112 -3.266 2.804 -15.015 908 HG2 LYS 112 HG2 LYS 112 -4.361 1.995 -12.300 909 HG3 LYS 112 HG1 LYS 112 -4.023 3.650 -12.822 910 HD2 LYS 112 HD2 LYS 112 -5.764 3.493 -14.554 911 HD3 LYS 112 HD1 LYS 112 -6.039 1.791 -14.158 912 HE2 LYS 112 HE2 LYS 112 -6.534 4.124 -12.267 913 HE3 LYS 112 HE1 LYS 112 -7.773 3.270 -13.190 914 HZ1 LYS 112 HZ1 LYS 112 -7.680 2.424 -10.953 915 HZ2 LYS 112 HZ2 LYS 112 -6.030 2.091 -11.101 916 HZ3 LYS 112 HZ3 LYS 112 -7.151 1.228 -12.023 Start of MODEL 20 1 H1 MET 1 HT1 MET 1 1.519 -27.514 4.958 2 H2 MET 1 HT2 MET 1 2.981 -26.906 5.545 3 H3 MET 1 HT3 MET 1 2.880 -27.452 3.953 4 HA MET 1 HA MET 1 1.389 -25.712 3.362 5 HB2 MET 1 HB2 MET 1 0.824 -23.911 4.972 6 HB3 MET 1 HB1 MET 1 0.216 -25.467 5.512 7 HG2 MET 1 HG2 MET 1 2.066 -25.648 7.121 8 HG3 MET 1 HG1 MET 1 2.716 -24.110 6.554 9 HE1 MET 1 HE1 MET 1 -1.339 -24.474 8.779 10 HE2 MET 1 HE2 MET 1 -0.356 -25.864 8.308 11 HE3 MET 1 HE3 MET 1 -1.166 -24.893 7.076 12 H ASN 2 HN ASN 2 2.139 -23.497 2.844 13 HA ASN 2 HA ASN 2 5.040 -23.282 2.861 14 HB2 ASN 2 HB2 ASN 2 4.714 -21.322 1.380 15 HB3 ASN 2 HB1 ASN 2 3.877 -22.741 0.773 16 HD21 ASN 2 HD21 ASN 2 3.522 -19.500 1.946 17 HD22 ASN 2 HD22 ASN 2 1.825 -19.356 1.650 18 H ILE 3 HN ILE 3 5.829 -22.713 4.792 19 HA ILE 3 HA ILE 3 4.657 -21.059 6.749 20 HB ILE 3 HB ILE 3 7.599 -21.733 6.245 21 HG12 ILE 3 HG12 ILE 3 5.586 -22.983 8.171 22 HG13 ILE 3 HG11 ILE 3 6.180 -23.717 6.684 23 HG21 ILE 3 HG21 ILE 3 6.382 -20.514 8.752 24 HG22 ILE 3 HG22 ILE 3 7.485 -19.711 7.633 25 HG23 ILE 3 HG23 ILE 3 8.051 -21.077 8.591 26 HD11 ILE 3 HD11 ILE 3 7.836 -23.108 9.147 27 HD12 ILE 3 HD12 ILE 3 8.444 -23.823 7.650 28 HD13 ILE 3 HD13 ILE 3 7.260 -24.692 8.624 29 H GLY 4 HN GLY 4 4.793 -18.845 7.132 30 HA2 GLY 4 HA2 GLY 4 5.496 -17.106 4.919 31 HA3 GLY 4 HA1 GLY 4 4.789 -16.638 6.455 32 H ARG 5 HN ARG 5 7.794 -18.452 6.005 33 HA ARG 5 HA ARG 5 9.349 -16.662 7.614 34 HB2 ARG 5 HB2 ARG 5 11.252 -18.185 7.029 35 HB3 ARG 5 HB1 ARG 5 9.859 -19.031 7.695 36 HG2 ARG 5 HG2 ARG 5 9.196 -19.667 5.352 37 HG3 ARG 5 HG1 ARG 5 10.699 -18.933 4.779 38 HD2 ARG 5 HD2 ARG 5 12.019 -20.530 6.056 39 HD3 ARG 5 HD1 ARG 5 10.563 -21.192 6.807 40 HE ARG 5 HE ARG 5 10.755 -21.351 3.893 41 HH11 ARG 5 HH11 ARG 5 11.064 -23.037 6.982 42 HH12 ARG 5 HH12 ARG 5 11.058 -24.612 6.255 43 HH21 ARG 5 HH21 ARG 5 10.761 -23.404 2.970 44 HH22 ARG 5 HH22 ARG 5 10.896 -24.817 3.965 45 H LEU 6 HN LEU 6 11.194 -15.495 6.895 46 HA LEU 6 HA LEU 6 10.296 -13.832 4.708 47 HB2 LEU 6 HB2 LEU 6 12.618 -13.374 6.596 48 HB3 LEU 6 HB1 LEU 6 11.757 -12.171 5.647 49 HG LEU 6 HG LEU 6 10.631 -13.716 8.021 50 HD11 LEU 6 HD11 LEU 6 12.236 -12.042 8.702 51 HD12 LEU 6 HD12 LEU 6 10.607 -11.582 9.183 52 HD13 LEU 6 HD13 LEU 6 11.368 -10.795 7.797 53 HD21 LEU 6 HD21 LEU 6 8.848 -13.305 6.392 54 HD22 LEU 6 HD22 LEU 6 9.237 -11.583 6.369 55 HD23 LEU 6 HD23 LEU 6 8.614 -12.333 7.842 56 H ARG 7 HN ARG 7 10.853 -14.803 2.804 57 HA ARG 7 HA ARG 7 13.646 -15.612 2.265 58 HB2 ARG 7 HB2 ARG 7 11.087 -16.129 0.680 59 HB3 ARG 7 HB1 ARG 7 12.691 -16.727 0.244 60 HG2 ARG 7 HG2 ARG 7 12.737 -17.991 2.422 61 HG3 ARG 7 HG1 ARG 7 11.065 -17.489 2.695 62 HD2 ARG 7 HD2 ARG 7 12.039 -19.129 0.323 63 HD3 ARG 7 HD1 ARG 7 11.236 -19.775 1.754 64 HE ARG 7 HE ARG 7 9.501 -17.895 0.802 65 HH11 ARG 7 HH11 ARG 7 10.934 -20.788 -0.577 66 HH12 ARG 7 HH12 ARG 7 9.583 -21.098 -1.619 67 HH21 ARG 7 HH21 ARG 7 7.732 -18.331 -0.557 68 HH22 ARG 7 HH22 ARG 7 7.777 -19.701 -1.621 69 H ASP 8 HN ASP 8 11.335 -13.167 1.475 70 HA ASP 8 HA ASP 8 12.814 -12.182 -0.869 71 HB2 ASP 8 HB2 ASP 8 9.951 -11.532 0.004 72 HB3 ASP 8 HB1 ASP 8 10.715 -11.088 -1.522 73 H ARG 9 HN ARG 9 12.128 -9.632 -0.987 74 HA ARG 9 HA ARG 9 12.303 -8.291 1.619 75 HB2 ARG 9 HB2 ARG 9 14.677 -8.734 0.714 76 HB3 ARG 9 HB1 ARG 9 14.285 -7.656 -0.617 77 HG2 ARG 9 HG2 ARG 9 13.865 -5.844 1.095 78 HG3 ARG 9 HG1 ARG 9 14.493 -6.946 2.323 79 HD2 ARG 9 HD2 ARG 9 16.284 -5.487 1.650 80 HD3 ARG 9 HD1 ARG 9 16.636 -7.087 0.993 81 HE ARG 9 HE ARG 9 15.224 -5.580 -0.939 82 HH11 ARG 9 HH11 ARG 9 18.404 -5.705 0.521 83 HH12 ARG 9 HH12 ARG 9 19.181 -4.930 -0.818 84 HH21 ARG 9 HH21 ARG 9 16.269 -4.562 -2.698 85 HH22 ARG 9 HH22 ARG 9 17.977 -4.285 -2.629 86 H ILE 10 HN ILE 10 11.094 -6.403 1.572 87 HA ILE 10 HA ILE 10 10.120 -5.374 -1.028 88 HB ILE 10 HB ILE 10 7.853 -5.295 -0.383 89 HG12 ILE 10 HG12 ILE 10 7.960 -4.449 1.900 90 HG13 ILE 10 HG11 ILE 10 6.929 -5.868 1.877 91 HG21 ILE 10 HG21 ILE 10 8.854 -7.972 0.632 92 HG22 ILE 10 HG22 ILE 10 8.485 -7.549 -1.042 93 HG23 ILE 10 HG23 ILE 10 7.190 -7.613 0.155 94 HD11 ILE 10 HD11 ILE 10 8.190 -5.956 3.839 95 HD12 ILE 10 HD12 ILE 10 9.694 -5.581 3.006 96 HD13 ILE 10 HD13 ILE 10 8.926 -7.147 2.772 97 H THR 11 HN THR 11 9.423 -3.190 -0.993 98 HA THR 11 HA THR 11 10.698 -1.498 1.058 99 HB THR 11 HB THR 11 9.788 -0.785 -1.774 100 HG1 THR 11 HG1 THR 11 12.349 -1.374 -0.667 101 HG21 THR 11 HG21 THR 11 11.468 0.779 0.246 102 HG22 THR 11 HG22 THR 11 9.833 1.200 -0.277 103 HG23 THR 11 HG23 THR 11 11.165 1.269 -1.430 104 H ILE 12 HN ILE 12 9.406 -0.501 2.452 105 HA ILE 12 HA ILE 12 6.520 -0.417 2.147 106 HB ILE 12 HB ILE 12 8.260 0.729 4.381 107 HG12 ILE 12 HG12 ILE 12 8.556 -1.691 4.262 108 HG13 ILE 12 HG11 ILE 12 7.556 -1.322 5.659 109 HG21 ILE 12 HG21 ILE 12 6.069 1.838 4.338 110 HG22 ILE 12 HG22 ILE 12 6.170 0.759 5.729 111 HG23 ILE 12 HG23 ILE 12 5.247 0.271 4.306 112 HD11 ILE 12 HD11 ILE 12 6.601 -2.398 3.005 113 HD12 ILE 12 HD12 ILE 12 5.567 -2.002 4.383 114 HD13 ILE 12 HD13 ILE 12 6.763 -3.290 4.518 115 H GLN 13 HN GLN 13 5.564 1.115 1.080 116 HA GLN 13 HA GLN 13 6.756 3.744 0.612 117 HB2 GLN 13 HB2 GLN 13 4.442 2.350 -0.801 118 HB3 GLN 13 HB1 GLN 13 5.082 3.942 -1.218 119 HG2 GLN 13 HG2 GLN 13 7.274 2.886 -1.749 120 HG3 GLN 13 HG1 GLN 13 6.572 1.303 -1.403 121 HE21 GLN 13 HE21 GLN 13 7.712 2.454 -3.908 122 HE22 GLN 13 HE22 GLN 13 6.475 2.252 -5.101 123 H THR 14 HN THR 14 6.348 4.793 2.288 124 HA THR 14 HA THR 14 3.826 4.889 3.722 125 HB THR 14 HB THR 14 6.154 6.828 4.122 126 HG1 THR 14 HG1 THR 14 6.002 4.087 4.927 127 HG21 THR 14 HG21 THR 14 5.504 6.662 6.482 128 HG22 THR 14 HG22 THR 14 4.289 5.444 6.080 129 HG23 THR 14 HG23 THR 14 4.098 7.107 5.509 130 H LEU 15 HN LEU 15 2.320 6.730 3.689 131 HA LEU 15 HA LEU 15 2.423 8.149 1.118 132 HB2 LEU 15 HB2 LEU 15 0.392 6.836 1.609 133 HB3 LEU 15 HB1 LEU 15 0.104 7.784 3.056 134 HG LEU 15 HG LEU 15 -0.334 9.797 1.708 135 HD11 LEU 15 HD11 LEU 15 -0.427 9.736 -0.751 136 HD12 LEU 15 HD12 LEU 15 0.231 8.100 -0.738 137 HD13 LEU 15 HD13 LEU 15 1.201 9.450 -0.148 138 HD21 LEU 15 HD21 LEU 15 -1.908 7.416 0.686 139 HD22 LEU 15 HD22 LEU 15 -2.414 9.107 0.606 140 HD23 LEU 15 HD23 LEU 15 -2.227 8.319 2.171 141 H LYS 16 HN LYS 16 3.702 9.872 1.441 142 HA LYS 16 HA LYS 16 3.395 11.663 3.713 143 HB2 LYS 16 HB2 LYS 16 5.656 11.061 2.829 144 HB3 LYS 16 HB1 LYS 16 5.247 11.804 1.285 145 HG2 LYS 16 HG2 LYS 16 5.038 14.005 2.407 146 HG3 LYS 16 HG1 LYS 16 5.451 13.249 3.953 147 HD2 LYS 16 HD2 LYS 16 7.663 12.575 2.979 148 HD3 LYS 16 HD1 LYS 16 7.248 13.434 1.493 149 HE2 LYS 16 HE2 LYS 16 7.171 15.558 2.726 150 HE3 LYS 16 HE1 LYS 16 7.495 14.714 4.243 151 HZ1 LYS 16 HZ1 LYS 16 9.479 15.729 3.327 152 HZ2 LYS 16 HZ2 LYS 16 9.326 14.819 1.910 153 HZ3 LYS 16 HZ3 LYS 16 9.636 14.048 3.381 154 H GLN 17 HN GLN 17 1.634 12.962 3.574 155 HA GLN 17 HA GLN 17 0.816 14.181 1.026 156 HB2 GLN 17 HB2 GLN 17 -0.423 14.357 3.815 157 HB3 GLN 17 HB1 GLN 17 -1.108 15.063 2.345 158 HG2 GLN 17 HG2 GLN 17 -1.262 12.749 1.385 159 HG3 GLN 17 HG1 GLN 17 -0.706 12.113 2.934 160 HE21 GLN 17 HE21 GLN 17 -3.329 13.712 1.267 161 HE22 GLN 17 HE22 GLN 17 -4.533 13.421 2.469 162 H THR 18 HN THR 18 2.204 15.776 0.504 163 HA THR 18 HA THR 18 3.016 17.787 2.525 164 HB THR 18 HB THR 18 4.357 17.159 -0.161 165 HG1 THR 18 HG1 THR 18 4.849 16.265 2.488 166 HG21 THR 18 HG21 THR 18 6.241 18.498 0.738 167 HG22 THR 18 HG22 THR 18 5.310 18.849 2.194 168 HG23 THR 18 HG23 THR 18 4.776 19.481 0.634 169 H ARG 19 HN ARG 19 1.995 19.737 2.324 170 HA ARG 19 HA ARG 19 0.400 20.366 0.001 171 HB2 ARG 19 HB2 ARG 19 -0.306 20.876 2.343 172 HB3 ARG 19 HB1 ARG 19 0.985 22.065 2.462 173 HG2 ARG 19 HG2 ARG 19 -0.063 23.495 0.837 174 HG3 ARG 19 HG1 ARG 19 -1.206 22.238 0.366 175 HD2 ARG 19 HD2 ARG 19 -2.299 23.956 1.723 176 HD3 ARG 19 HD1 ARG 19 -2.306 22.402 2.561 177 HE ARG 19 HE ARG 19 -0.157 23.485 3.653 178 HH11 ARG 19 HH11 ARG 19 -3.212 25.081 2.977 179 HH12 ARG 19 HH12 ARG 19 -3.116 26.116 4.363 180 HH21 ARG 19 HH21 ARG 19 -0.057 24.813 5.482 181 HH22 ARG 19 HH22 ARG 19 -1.307 25.981 5.776 182 H ASP 20 HN ASP 20 0.614 22.529 -1.077 183 HA ASP 20 HA ASP 20 3.446 22.862 -1.940 184 HB2 ASP 20 HB2 ASP 20 1.795 21.937 -3.624 185 HB3 ASP 20 HB1 ASP 20 0.877 23.423 -3.491 186 H ILE 21 HN ILE 21 3.923 25.150 -2.818 187 HA ILE 21 HA ILE 21 3.352 27.167 -0.937 188 HB ILE 21 HB ILE 21 5.450 26.922 -2.314 189 HG12 ILE 21 HG12 ILE 21 4.142 29.676 -2.508 190 HG13 ILE 21 HG11 ILE 21 4.968 29.038 -1.092 191 HG21 ILE 21 HG21 ILE 21 4.442 26.431 -4.502 192 HG22 ILE 21 HG22 ILE 21 5.542 27.805 -4.616 193 HG23 ILE 21 HG23 ILE 21 3.798 28.074 -4.593 194 HD11 ILE 21 HD11 ILE 21 6.248 29.658 -3.758 195 HD12 ILE 21 HD12 ILE 21 7.077 29.003 -2.344 196 HD13 ILE 21 HD13 ILE 21 6.367 30.615 -2.281 197 H THR 22 HN THR 22 1.266 26.031 -3.333 198 HA THR 22 HA THR 22 -0.178 28.611 -3.543 199 HB THR 22 HB THR 22 -1.396 27.542 -5.486 200 HG1 THR 22 HG1 THR 22 0.655 25.600 -5.574 201 HG21 THR 22 HG21 THR 22 0.508 29.051 -5.953 202 HG22 THR 22 HG22 THR 22 0.403 27.760 -7.151 203 HG23 THR 22 HG23 THR 22 1.613 27.677 -5.869 204 H GLY 23 HN GLY 23 -0.153 25.268 -2.776 205 HA2 GLY 23 HA2 GLY 23 -1.283 24.586 -0.695 206 HA3 GLY 23 HA1 GLY 23 -2.688 25.486 -1.223 207 H GLU 24 HN GLU 24 -0.862 23.344 -3.395 208 HA GLU 24 HA GLU 24 -3.090 21.569 -3.791 209 HB2 GLU 24 HB2 GLU 24 -0.188 21.493 -4.735 210 HB3 GLU 24 HB1 GLU 24 -1.460 20.420 -5.308 211 HG2 GLU 24 HG2 GLU 24 -1.450 23.432 -5.677 212 HG3 GLU 24 HG1 GLU 24 -0.866 22.279 -6.877 213 H ILE 25 HN ILE 25 -3.180 19.404 -2.990 214 HA ILE 25 HA ILE 25 -1.252 18.704 -0.872 215 HB ILE 25 HB ILE 25 -3.832 17.227 -1.568 216 HG12 ILE 25 HG12 ILE 25 -4.430 19.489 -0.827 217 HG13 ILE 25 HG11 ILE 25 -4.799 18.348 0.459 218 HG21 ILE 25 HG21 ILE 25 -2.030 17.053 0.889 219 HG22 ILE 25 HG22 ILE 25 -2.186 15.827 -0.373 220 HG23 ILE 25 HG23 ILE 25 -3.559 16.190 0.672 221 HD11 ILE 25 HD11 ILE 25 -2.754 19.040 1.636 222 HD12 ILE 25 HD12 ILE 25 -3.869 20.374 1.353 223 HD13 ILE 25 HD13 ILE 25 -2.427 20.211 0.354 224 H LEU 26 HN LEU 26 0.511 17.899 -1.768 225 HA LEU 26 HA LEU 26 0.513 16.069 -4.015 226 HB2 LEU 26 HB2 LEU 26 2.784 17.156 -2.288 227 HB3 LEU 26 HB1 LEU 26 3.022 16.009 -3.595 228 HG LEU 26 HG LEU 26 2.183 17.723 -5.221 229 HD11 LEU 26 HD11 LEU 26 0.785 19.091 -3.744 230 HD12 LEU 26 HD12 LEU 26 1.995 20.078 -4.559 231 HD13 LEU 26 HD13 LEU 26 2.218 19.632 -2.867 232 HD21 LEU 26 HD21 LEU 26 4.212 19.110 -5.194 233 HD22 LEU 26 HD22 LEU 26 4.585 17.422 -4.856 234 HD23 LEU 26 HD23 LEU 26 4.549 18.596 -3.538 235 H GLU 27 HN GLU 27 -0.638 14.316 -3.177 236 HA GLU 27 HA GLU 27 0.343 12.822 -0.897 237 HB2 GLU 27 HB2 GLU 27 -1.674 12.053 -3.063 238 HB3 GLU 27 HB1 GLU 27 -1.275 11.067 -1.654 239 HG2 GLU 27 HG2 GLU 27 -2.063 12.873 -0.175 240 HG3 GLU 27 HG1 GLU 27 -2.507 13.832 -1.584 241 H THR 28 HN THR 28 2.213 11.864 -1.068 242 HA THR 28 HA THR 28 3.170 10.734 -3.635 243 HB THR 28 HB THR 28 5.505 11.502 -2.938 244 HG1 THR 28 HG1 THR 28 3.968 12.931 -1.023 245 HG21 THR 28 HG21 THR 28 3.496 13.722 -3.459 246 HG22 THR 28 HG22 THR 28 4.234 12.696 -4.689 247 HG23 THR 28 HG23 THR 28 5.234 13.810 -3.755 248 H TRP 29 HN TRP 29 4.783 9.073 -3.368 249 HA TRP 29 HA TRP 29 4.320 7.509 -0.894 250 HB2 TRP 29 HB2 TRP 29 4.839 6.570 -3.757 251 HB3 TRP 29 HB1 TRP 29 4.675 5.507 -2.357 252 HD1 TRP 29 HD1 TRP 29 2.580 7.429 -4.865 253 HE1 TRP 29 HE1 TRP 29 0.087 7.017 -4.380 254 HE3 TRP 29 HE3 TRP 29 3.014 5.132 -0.330 255 HZ2 TRP 29 HZ2 TRP 29 -1.490 5.895 -2.322 256 HZ3 TRP 29 HZ3 TRP 29 0.979 4.433 0.840 257 HH2 TRP 29 HH2 TRP 29 -1.236 4.806 -0.126 258 H GLU 30 HN GLU 30 6.003 8.089 0.288 259 HA GLU 30 HA GLU 30 8.709 8.368 -0.770 260 HB2 GLU 30 HB2 GLU 30 9.365 8.887 1.567 261 HB3 GLU 30 HB1 GLU 30 8.034 9.893 1.016 262 HG2 GLU 30 HG2 GLU 30 6.447 8.711 2.363 263 HG3 GLU 30 HG1 GLU 30 7.603 7.429 2.724 264 H ASP 31 HN ASP 31 10.208 6.777 -0.793 265 HA ASP 31 HA ASP 31 9.486 4.101 0.002 266 HB2 ASP 31 HB2 ASP 31 11.619 3.383 -0.902 267 HB3 ASP 31 HB1 ASP 31 10.926 4.555 -2.011 268 H GLY 32 HN GLY 32 10.044 3.077 1.879 269 HA2 GLY 32 HA2 GLY 32 11.022 4.865 4.033 270 HA3 GLY 32 HA1 GLY 32 9.768 3.640 4.206 271 H HIS 33 HN HIS 33 10.350 1.708 4.965 272 HA HIS 33 HA HIS 33 13.246 1.054 5.072 273 HB2 HIS 33 HB2 HIS 33 12.122 1.249 7.279 274 HB3 HIS 33 HB1 HIS 33 10.974 0.004 6.812 275 HD1 HIS 33 HD1 HIS 33 14.746 0.370 7.213 276 HD2 HIS 33 HD2 HIS 33 11.757 -2.488 7.598 277 HE1 HIS 33 HE1 HIS 33 15.906 -1.708 8.014 278 HE2 HIS 33 HE2 HIS 33 14.087 -3.447 8.189 279 H THR 34 HN THR 34 13.950 -0.739 4.064 280 HA THR 34 HA THR 34 12.003 -2.364 2.569 281 HB THR 34 HB THR 34 14.982 -1.927 2.034 282 HG1 THR 34 HG1 THR 34 14.359 -0.172 1.047 283 HG21 THR 34 HG21 THR 34 14.517 -2.913 -0.177 284 HG22 THR 34 HG22 THR 34 12.833 -3.178 0.283 285 HG23 THR 34 HG23 THR 34 14.124 -4.063 1.099 286 H LEU 35 HN LEU 35 11.493 -3.967 4.038 287 HA LEU 35 HA LEU 35 13.692 -5.358 5.451 288 HB2 LEU 35 HB2 LEU 35 12.155 -6.018 7.184 289 HB3 LEU 35 HB1 LEU 35 12.092 -4.286 6.988 290 HG LEU 35 HG LEU 35 9.952 -6.139 5.852 291 HD11 LEU 35 HD11 LEU 35 8.570 -5.604 7.801 292 HD12 LEU 35 HD12 LEU 35 9.906 -4.705 8.528 293 HD13 LEU 35 HD13 LEU 35 10.039 -6.449 8.284 294 HD21 LEU 35 HD21 LEU 35 8.548 -4.069 5.905 295 HD22 LEU 35 HD22 LEU 35 9.906 -3.966 4.799 296 HD23 LEU 35 HD23 LEU 35 9.983 -3.142 6.356 297 H TRP 36 HN TRP 36 13.221 -7.582 6.059 298 HA TRP 36 HA TRP 36 12.826 -9.242 3.813 299 HB2 TRP 36 HB2 TRP 36 12.954 -10.063 6.739 300 HB3 TRP 36 HB1 TRP 36 13.306 -11.080 5.343 301 HD1 TRP 36 HD1 TRP 36 15.108 -9.252 7.914 302 HE1 TRP 36 HE1 TRP 36 17.508 -8.701 7.189 303 HE3 TRP 36 HE3 TRP 36 14.692 -10.144 2.889 304 HZ2 TRP 36 HZ2 TRP 36 19.027 -8.636 4.817 305 HZ3 TRP 36 HZ3 TRP 36 16.658 -9.812 1.472 306 HH2 TRP 36 HH2 TRP 36 18.786 -9.076 2.413 307 H ALA 37 HN ALA 37 11.119 -10.320 3.103 308 HA ALA 37 HA ALA 37 8.647 -10.650 4.706 309 HB1 ALA 37 HB1 ALA 37 8.292 -8.669 3.335 310 HB2 ALA 37 HB2 ALA 37 7.252 -9.974 2.777 311 HB3 ALA 37 HB3 ALA 37 8.718 -9.557 1.877 312 H SER 38 HN SER 38 7.140 -12.303 3.828 313 HA SER 38 HA SER 38 8.148 -13.981 1.643 314 HB2 SER 38 HB2 SER 38 7.893 -15.148 3.856 315 HB3 SER 38 HB1 SER 38 6.204 -14.650 3.909 316 HG SER 38 HG SER 38 7.472 -16.478 2.173 317 H VAL 39 HN VAL 39 7.224 -12.833 -0.053 318 HA VAL 39 HA VAL 39 4.481 -11.788 0.253 319 HB VAL 39 HB VAL 39 6.057 -10.098 -0.439 320 HG11 VAL 39 HG11 VAL 39 7.409 -10.176 -2.489 321 HG12 VAL 39 HG12 VAL 39 6.843 -11.814 -2.817 322 HG13 VAL 39 HG13 VAL 39 7.840 -11.496 -1.398 323 HG21 VAL 39 HG21 VAL 39 3.803 -9.971 -1.449 324 HG22 VAL 39 HG22 VAL 39 4.378 -10.863 -2.858 325 HG23 VAL 39 HG23 VAL 39 5.024 -9.261 -2.503 326 H ASN 40 HN ASN 40 3.235 -13.563 -0.014 327 HA ASN 40 HA ASN 40 3.645 -15.361 -2.319 328 HB2 ASN 40 HB2 ASN 40 1.968 -15.946 0.168 329 HB3 ASN 40 HB1 ASN 40 2.545 -17.089 -1.045 330 HD21 ASN 40 HD21 ASN 40 5.279 -15.883 -1.025 331 HD22 ASN 40 HD22 ASN 40 5.997 -16.442 0.437 332 H MET 41 HN MET 41 2.271 -14.972 -3.958 333 HA MET 41 HA MET 41 -0.205 -13.563 -3.728 334 HB2 MET 41 HB2 MET 41 0.705 -15.441 -5.955 335 HB3 MET 41 HB1 MET 41 -0.607 -14.269 -6.055 336 HG2 MET 41 HG2 MET 41 1.091 -12.449 -5.680 337 HG3 MET 41 HG1 MET 41 2.350 -13.677 -5.788 338 HE1 MET 41 HE1 MET 41 -0.441 -11.684 -7.718 339 HE2 MET 41 HE2 MET 41 -1.017 -13.345 -7.866 340 HE3 MET 41 HE3 MET 41 -0.433 -12.487 -9.289 341 H VAL 42 HN VAL 42 -2.318 -14.396 -3.627 342 HA VAL 42 HA VAL 42 -2.623 -16.753 -2.064 343 HB VAL 42 HB VAL 42 -5.015 -16.340 -2.063 344 HG11 VAL 42 HG11 VAL 42 -3.685 -14.887 -0.614 345 HG12 VAL 42 HG12 VAL 42 -5.093 -14.012 -1.220 346 HG13 VAL 42 HG13 VAL 42 -3.500 -13.709 -1.922 347 HG21 VAL 42 HG21 VAL 42 -5.402 -15.870 -4.455 348 HG22 VAL 42 HG22 VAL 42 -4.585 -14.313 -4.303 349 HG23 VAL 42 HG23 VAL 42 -6.109 -14.596 -3.460 350 H SER 43 HN SER 43 -3.902 -18.630 -2.577 351 HA SER 43 HA SER 43 -3.268 -19.782 -5.139 352 HB2 SER 43 HB2 SER 43 -4.968 -20.908 -2.867 353 HB3 SER 43 HB1 SER 43 -4.222 -21.827 -4.175 354 HG SER 43 HG SER 43 -2.403 -20.313 -2.833 355 H SER 44 HN SER 44 -4.913 -20.881 -6.487 356 HA SER 44 HA SER 44 -7.027 -19.234 -7.348 357 HB2 SER 44 HB2 SER 44 -6.661 -22.220 -7.871 358 HB3 SER 44 HB1 SER 44 -7.606 -21.088 -8.847 359 HG SER 44 HG SER 44 -5.822 -20.290 -9.687 360 H LYS 45 HN LYS 45 -6.901 -21.998 -5.158 361 HA LYS 45 HA LYS 45 -9.670 -22.425 -4.774 362 HB2 LYS 45 HB2 LYS 45 -9.030 -23.774 -2.885 363 HB3 LYS 45 HB1 LYS 45 -7.808 -24.000 -4.130 364 HG2 LYS 45 HG2 LYS 45 -6.337 -22.357 -2.920 365 HG3 LYS 45 HG1 LYS 45 -7.543 -22.281 -1.633 366 HD2 LYS 45 HD2 LYS 45 -7.245 -24.701 -1.231 367 HD3 LYS 45 HD1 LYS 45 -6.019 -24.761 -2.501 368 HE2 LYS 45 HE2 LYS 45 -4.792 -24.623 -0.467 369 HE3 LYS 45 HE1 LYS 45 -4.745 -22.987 -1.129 370 HZ1 LYS 45 HZ1 LYS 45 -6.516 -23.972 1.039 371 HZ2 LYS 45 HZ2 LYS 45 -6.610 -22.436 0.346 372 HZ3 LYS 45 HZ3 LYS 45 -5.228 -22.881 1.192 373 H GLU 46 HN GLU 46 -7.460 -20.059 -3.445 374 HA GLU 46 HA GLU 46 -8.987 -19.386 -1.123 375 HB2 GLU 46 HB2 GLU 46 -6.795 -17.849 -2.584 376 HB3 GLU 46 HB1 GLU 46 -7.476 -17.366 -1.029 377 HG2 GLU 46 HG2 GLU 46 -6.001 -19.962 -1.582 378 HG3 GLU 46 HG1 GLU 46 -5.320 -18.540 -0.790 379 H ALA 47 HN ALA 47 -8.603 -17.975 -4.367 380 HA ALA 47 HA ALA 47 -10.428 -15.868 -4.265 381 HB1 ALA 47 HB1 ALA 47 -10.579 -16.148 -6.717 382 HB2 ALA 47 HB2 ALA 47 -9.820 -17.736 -6.581 383 HB3 ALA 47 HB3 ALA 47 -8.910 -16.285 -6.158 384 H ILE 48 HN ILE 48 -10.997 -19.222 -5.298 385 HA ILE 48 HA ILE 48 -13.746 -19.175 -5.753 386 HB ILE 48 HB ILE 48 -12.036 -21.523 -4.811 387 HG12 ILE 48 HG12 ILE 48 -12.884 -20.716 -7.633 388 HG13 ILE 48 HG11 ILE 48 -11.285 -20.453 -6.948 389 HG21 ILE 48 HG21 ILE 48 -14.796 -21.613 -6.089 390 HG22 ILE 48 HG22 ILE 48 -14.407 -22.053 -4.425 391 HG23 ILE 48 HG23 ILE 48 -13.773 -23.016 -5.759 392 HD11 ILE 48 HD11 ILE 48 -12.560 -23.133 -7.502 393 HD12 ILE 48 HD12 ILE 48 -10.962 -22.882 -6.794 394 HD13 ILE 48 HD13 ILE 48 -11.290 -22.350 -8.443 395 H SER 49 HN SER 49 -12.049 -19.969 -2.727 396 HA SER 49 HA SER 49 -14.386 -20.751 -1.268 397 HB2 SER 49 HB2 SER 49 -12.091 -21.625 -0.789 398 HB3 SER 49 HB1 SER 49 -11.622 -20.027 -0.207 399 HG SER 49 HG SER 49 -13.303 -20.258 1.396 400 H SER 50 HN SER 50 -12.622 -17.759 -1.673 401 HA SER 50 HA SER 50 -14.082 -16.344 0.440 402 HB2 SER 50 HB2 SER 50 -11.598 -16.006 -0.013 403 HB3 SER 50 HB1 SER 50 -12.042 -15.248 -1.541 404 HG SER 50 HG SER 50 -13.162 -14.329 0.873 405 H GLY 51 HN GLY 51 -14.517 -17.133 -2.823 406 HA2 GLY 51 HA2 GLY 51 -16.251 -16.699 -4.249 407 HA3 GLY 51 HA1 GLY 51 -16.957 -15.657 -3.028 408 H ALA 52 HN ALA 52 -16.710 -13.478 -3.192 409 HA ALA 52 HA ALA 52 -15.457 -12.428 -5.662 410 HB1 ALA 52 HB1 ALA 52 -17.747 -11.267 -4.035 411 HB2 ALA 52 HB2 ALA 52 -17.917 -12.193 -5.527 412 HB3 ALA 52 HB3 ALA 52 -17.116 -10.621 -5.552 413 H GLU 53 HN GLU 53 -14.930 -12.553 -2.340 414 HA GLU 53 HA GLU 53 -13.966 -9.862 -1.887 415 HB2 GLU 53 HB2 GLU 53 -14.764 -11.115 0.020 416 HB3 GLU 53 HB1 GLU 53 -13.666 -12.445 -0.306 417 HG2 GLU 53 HG2 GLU 53 -12.888 -11.170 1.610 418 HG3 GLU 53 HG1 GLU 53 -11.742 -11.018 0.281 419 H LEU 54 HN LEU 54 -12.020 -12.882 -1.584 420 HA LEU 54 HA LEU 54 -9.671 -11.536 -2.668 421 HB2 LEU 54 HB2 LEU 54 -9.969 -14.462 -1.849 422 HB3 LEU 54 HB1 LEU 54 -8.463 -13.623 -2.193 423 HG LEU 54 HG LEU 54 -10.296 -13.174 0.197 424 HD11 LEU 54 HD11 LEU 54 -7.470 -14.269 0.062 425 HD12 LEU 54 HD12 LEU 54 -8.944 -15.191 0.371 426 HD13 LEU 54 HD13 LEU 54 -8.411 -13.981 1.532 427 HD21 LEU 54 HD21 LEU 54 -9.404 -11.010 -0.487 428 HD22 LEU 54 HD22 LEU 54 -7.761 -11.655 -0.495 429 HD23 LEU 54 HD23 LEU 54 -8.659 -11.533 1.021 430 H ALA 55 HN ALA 55 -8.621 -12.142 -4.530 431 HA ALA 55 HA ALA 55 -9.995 -13.860 -6.502 432 HB1 ALA 55 HB1 ALA 55 -10.665 -11.522 -6.988 433 HB2 ALA 55 HB2 ALA 55 -9.622 -12.154 -8.260 434 HB3 ALA 55 HB3 ALA 55 -8.969 -11.035 -7.058 435 H ILE 56 HN ILE 56 -8.501 -14.460 -8.293 436 HA ILE 56 HA ILE 56 -5.812 -14.998 -7.426 437 HB ILE 56 HB ILE 56 -6.910 -15.129 -10.287 438 HG12 ILE 56 HG12 ILE 56 -6.794 -17.391 -8.232 439 HG13 ILE 56 HG11 ILE 56 -8.255 -16.515 -8.669 440 HG21 ILE 56 HG21 ILE 56 -4.487 -16.507 -9.053 441 HG22 ILE 56 HG22 ILE 56 -4.449 -15.163 -10.197 442 HG23 ILE 56 HG23 ILE 56 -5.070 -16.732 -10.706 443 HD11 ILE 56 HD11 ILE 56 -8.161 -18.675 -9.760 444 HD12 ILE 56 HD12 ILE 56 -6.624 -18.260 -10.517 445 HD13 ILE 56 HD13 ILE 56 -8.092 -17.381 -10.957 446 H GLY 57 HN GLY 57 -4.182 -13.528 -7.463 447 HA2 GLY 57 HA2 GLY 57 -2.956 -11.683 -8.540 448 HA3 GLY 57 HA1 GLY 57 -4.504 -10.963 -8.957 449 H THR 58 HN THR 58 -5.341 -12.020 -6.116 450 HA THR 58 HA THR 58 -4.559 -9.798 -4.457 451 HB THR 58 HB THR 58 -5.891 -12.449 -3.709 452 HG1 THR 58 HG1 THR 58 -6.865 -10.526 -5.087 453 HG21 THR 58 HG21 THR 58 -6.572 -11.363 -1.601 454 HG22 THR 58 HG22 THR 58 -5.676 -9.908 -2.035 455 HG23 THR 58 HG23 THR 58 -4.810 -11.413 -1.715 456 H VAL 59 HN VAL 59 -2.970 -9.798 -2.862 457 HA VAL 59 HA VAL 59 -1.034 -12.038 -2.860 458 HB VAL 59 HB VAL 59 -0.326 -9.062 -2.870 459 HG11 VAL 59 HG11 VAL 59 1.469 -11.518 -3.059 460 HG12 VAL 59 HG12 VAL 59 1.321 -10.454 -1.658 461 HG13 VAL 59 HG13 VAL 59 2.009 -9.839 -3.162 462 HG21 VAL 59 HG21 VAL 59 -1.226 -9.719 -5.075 463 HG22 VAL 59 HG22 VAL 59 -0.095 -11.074 -5.151 464 HG23 VAL 59 HG23 VAL 59 0.512 -9.416 -5.182 465 H ARG 60 HN ARG 60 -0.465 -12.716 -0.871 466 HA ARG 60 HA ARG 60 -0.988 -11.062 1.520 467 HB2 ARG 60 HB2 ARG 60 -0.316 -14.018 1.185 468 HB3 ARG 60 HB1 ARG 60 -0.438 -13.218 2.755 469 HG2 ARG 60 HG2 ARG 60 -2.790 -12.715 2.360 470 HG3 ARG 60 HG1 ARG 60 -2.691 -13.385 0.730 471 HD2 ARG 60 HD2 ARG 60 -2.252 -15.614 1.638 472 HD3 ARG 60 HD1 ARG 60 -2.259 -14.969 3.285 473 HE ARG 60 HE ARG 60 -4.640 -14.299 2.799 474 HH11 ARG 60 HH11 ARG 60 -3.214 -17.064 1.144 475 HH12 ARG 60 HH12 ARG 60 -4.732 -17.891 0.979 476 HH21 ARG 60 HH21 ARG 60 -6.608 -15.369 2.567 477 HH22 ARG 60 HH22 ARG 60 -6.666 -16.924 1.787 478 H ILE 61 HN ILE 61 0.690 -10.550 2.902 479 HA ILE 61 HA ILE 61 3.470 -10.839 1.931 480 HB ILE 61 HB ILE 61 2.219 -8.154 2.707 481 HG12 ILE 61 HG12 ILE 61 3.110 -9.001 -0.091 482 HG13 ILE 61 HG11 ILE 61 1.440 -9.093 0.453 483 HG21 ILE 61 HG21 ILE 61 4.367 -7.168 1.932 484 HG22 ILE 61 HG22 ILE 61 5.003 -8.789 1.643 485 HG23 ILE 61 HG23 ILE 61 4.601 -8.278 3.283 486 HD11 ILE 61 HD11 ILE 61 1.858 -7.124 -0.881 487 HD12 ILE 61 HD12 ILE 61 3.073 -6.585 0.273 488 HD13 ILE 61 HD13 ILE 61 1.384 -6.699 0.762 489 H TRP 62 HN TRP 62 4.374 -11.828 3.593 490 HA TRP 62 HA TRP 62 3.509 -11.303 6.374 491 HB2 TRP 62 HB2 TRP 62 5.161 -13.643 5.258 492 HB3 TRP 62 HB1 TRP 62 4.509 -13.509 6.888 493 HD1 TRP 62 HD1 TRP 62 2.657 -13.151 3.446 494 HE1 TRP 62 HE1 TRP 62 0.688 -14.779 3.438 495 HE3 TRP 62 HE3 TRP 62 3.431 -15.399 7.955 496 HZ2 TRP 62 HZ2 TRP 62 -0.399 -16.789 5.085 497 HZ3 TRP 62 HZ3 TRP 62 1.887 -17.183 8.672 498 HH2 TRP 62 HH2 TRP 62 0.006 -17.869 7.261 499 H ILE 63 HN ILE 63 4.829 -9.913 7.452 500 HA ILE 63 HA ILE 63 7.716 -9.692 6.674 501 HB ILE 63 HB ILE 63 7.588 -7.235 7.121 502 HG12 ILE 63 HG12 ILE 63 4.556 -7.615 7.210 503 HG13 ILE 63 HG11 ILE 63 5.563 -7.267 8.611 504 HG21 ILE 63 HG21 ILE 63 6.441 -6.568 5.033 505 HG22 ILE 63 HG22 ILE 63 5.698 -8.167 4.940 506 HG23 ILE 63 HG23 ILE 63 7.449 -7.999 4.813 507 HD11 ILE 63 HD11 ILE 63 6.184 -5.107 7.602 508 HD12 ILE 63 HD12 ILE 63 4.447 -5.270 7.848 509 HD13 ILE 63 HD13 ILE 63 5.126 -5.458 6.232 510 H ARG 64 HN ARG 64 9.140 -8.927 8.506 511 HA ARG 64 HA ARG 64 8.561 -9.629 11.089 512 HB2 ARG 64 HB2 ARG 64 10.330 -7.400 10.029 513 HB3 ARG 64 HB1 ARG 64 10.146 -7.607 11.768 514 HG2 ARG 64 HG2 ARG 64 11.191 -9.704 9.844 515 HG3 ARG 64 HG1 ARG 64 12.177 -8.712 10.919 516 HD2 ARG 64 HD2 ARG 64 11.261 -9.766 12.874 517 HD3 ARG 64 HD1 ARG 64 9.985 -10.556 11.941 518 HE ARG 64 HE ARG 64 12.695 -11.302 11.218 519 HH11 ARG 64 HH11 ARG 64 9.903 -12.106 13.204 520 HH12 ARG 64 HH12 ARG 64 10.382 -13.759 13.415 521 HH21 ARG 64 HH21 ARG 64 13.316 -13.477 11.522 522 HH22 ARG 64 HH22 ARG 64 12.322 -14.535 12.477 523 H TYR 65 HN TYR 65 7.501 -8.846 12.809 524 HA TYR 65 HA TYR 65 5.285 -7.165 12.636 525 HB2 TYR 65 HB2 TYR 65 5.684 -8.902 14.413 526 HB3 TYR 65 HB1 TYR 65 6.901 -7.860 15.140 527 HD1 TYR 65 HD1 TYR 65 6.128 -5.562 16.055 528 HD2 TYR 65 HD2 TYR 65 3.363 -8.637 14.981 529 HE1 TYR 65 HE1 TYR 65 4.390 -4.460 17.361 530 HE2 TYR 65 HE2 TYR 65 1.620 -7.518 16.302 531 HH TYR 65 HH TYR 65 1.453 -5.933 18.173 532 H ARG 66 HN ARG 66 5.218 -5.032 12.358 533 HA ARG 66 HA ARG 66 7.286 -3.275 13.491 534 HB2 ARG 66 HB2 ARG 66 7.939 -3.930 11.145 535 HB3 ARG 66 HB1 ARG 66 6.436 -3.233 10.558 536 HG2 ARG 66 HG2 ARG 66 7.158 -0.999 11.287 537 HG3 ARG 66 HG1 ARG 66 8.645 -1.680 11.959 538 HD2 ARG 66 HD2 ARG 66 9.305 -2.419 9.670 539 HD3 ARG 66 HD1 ARG 66 7.833 -1.679 9.025 540 HE ARG 66 HE ARG 66 9.978 -0.155 10.398 541 HH11 ARG 66 HH11 ARG 66 7.671 -0.386 7.749 542 HH12 ARG 66 HH12 ARG 66 8.037 1.195 7.148 543 HH21 ARG 66 HH21 ARG 66 10.449 1.895 9.575 544 HH22 ARG 66 HH22 ARG 66 9.612 2.482 8.172 545 H LYS 67 HN LYS 67 6.346 -1.674 14.508 546 HA LYS 67 HA LYS 67 3.525 -1.265 14.630 547 HB2 LYS 67 HB2 LYS 67 5.867 0.302 15.788 548 HB3 LYS 67 HB1 LYS 67 4.187 0.644 16.180 549 HG2 LYS 67 HG2 LYS 67 5.508 -2.033 16.722 550 HG3 LYS 67 HG1 LYS 67 5.472 -0.703 17.884 551 HD2 LYS 67 HD2 LYS 67 2.923 -0.750 17.690 552 HD3 LYS 67 HD1 LYS 67 3.097 -2.240 16.756 553 HE2 LYS 67 HE2 LYS 67 2.595 -2.719 19.127 554 HE3 LYS 67 HE1 LYS 67 4.184 -3.330 18.681 555 HZ1 LYS 67 HZ1 LYS 67 3.659 -0.806 20.159 556 HZ2 LYS 67 HZ2 LYS 67 5.183 -1.381 19.712 557 HZ3 LYS 67 HZ3 LYS 67 4.249 -2.246 20.824 558 H ASP 68 HN ASP 68 5.792 -0.096 12.398 559 HA ASP 68 HA ASP 68 4.688 2.602 12.085 560 HB2 ASP 68 HB2 ASP 68 7.164 2.244 12.055 561 HB3 ASP 68 HB1 ASP 68 6.996 1.207 10.644 562 H ILE 69 HN ILE 69 4.308 -0.543 10.687 563 HA ILE 69 HA ILE 69 3.566 0.212 8.019 564 HB ILE 69 HB ILE 69 2.727 -2.334 9.490 565 HG12 ILE 69 HG12 ILE 69 5.180 -2.073 9.596 566 HG13 ILE 69 HG11 ILE 69 4.746 -3.393 8.520 567 HG21 ILE 69 HG21 ILE 69 2.964 -1.722 6.507 568 HG22 ILE 69 HG22 ILE 69 1.462 -1.930 7.412 569 HG23 ILE 69 HG23 ILE 69 2.556 -3.296 7.198 570 HD11 ILE 69 HD11 ILE 69 5.617 -0.631 7.698 571 HD12 ILE 69 HD12 ILE 69 5.157 -1.932 6.596 572 HD13 ILE 69 HD13 ILE 69 6.571 -2.110 7.629 573 H ASN 70 HN ASN 70 1.772 1.237 7.456 574 HA ASN 70 HA ASN 70 -0.707 1.031 9.079 575 HB2 ASN 70 HB2 ASN 70 0.513 3.309 9.019 576 HB3 ASN 70 HB1 ASN 70 0.108 3.385 7.308 577 HD21 ASN 70 HD21 ASN 70 -1.215 3.363 10.571 578 HD22 ASN 70 HD22 ASN 70 -2.741 4.055 10.152 579 H ALA 71 HN ALA 71 -2.708 1.420 7.696 580 HA ALA 71 HA ALA 71 -2.862 -0.302 5.448 581 HB1 ALA 71 HB1 ALA 71 -4.848 1.801 6.380 582 HB2 ALA 71 HB2 ALA 71 -4.768 0.136 6.960 583 HB3 ALA 71 HB3 ALA 71 -5.199 0.463 5.277 584 H THR 72 HN THR 72 -2.184 3.083 5.800 585 HA THR 72 HA THR 72 -2.391 3.697 2.948 586 HB THR 72 HB THR 72 -1.698 5.998 3.639 587 HG1 THR 72 HG1 THR 72 -1.992 5.482 6.348 588 HG21 THR 72 HG21 THR 72 -3.709 6.582 4.939 589 HG22 THR 72 HG22 THR 72 -3.978 4.879 5.322 590 HG23 THR 72 HG23 THR 72 -4.106 5.445 3.650 591 H SER 73 HN SER 73 -0.247 1.882 4.432 592 HA SER 73 HA SER 73 2.168 3.016 3.127 593 HB2 SER 73 HB2 SER 73 2.031 0.923 5.361 594 HB3 SER 73 HB1 SER 73 3.494 1.652 4.691 595 HG SER 73 HG SER 73 2.200 3.702 5.398 596 H ARG 74 HN ARG 74 2.050 2.178 1.064 597 HA ARG 74 HA ARG 74 1.123 -0.469 0.454 598 HB2 ARG 74 HB2 ARG 74 2.745 1.427 -1.293 599 HB3 ARG 74 HB1 ARG 74 1.920 -0.029 -1.848 600 HG2 ARG 74 HG2 ARG 74 -0.253 1.017 -1.162 601 HG3 ARG 74 HG1 ARG 74 0.631 2.493 -0.778 602 HD2 ARG 74 HD2 ARG 74 0.270 1.193 -3.490 603 HD3 ARG 74 HD1 ARG 74 -0.308 2.775 -2.964 604 HE ARG 74 HE ARG 74 2.576 2.505 -2.927 605 HH11 ARG 74 HH11 ARG 74 -0.169 3.484 -4.843 606 HH12 ARG 74 HH12 ARG 74 0.789 4.305 -6.029 607 HH21 ARG 74 HH21 ARG 74 3.839 3.511 -4.505 608 HH22 ARG 74 HH22 ARG 74 3.078 4.291 -5.852 609 H ILE 75 HN ILE 75 2.439 -2.063 -0.692 610 HA ILE 75 HA ILE 75 5.276 -2.220 0.157 611 HB ILE 75 HB ILE 75 3.136 -4.360 -0.212 612 HG12 ILE 75 HG12 ILE 75 4.179 -5.208 2.015 613 HG13 ILE 75 HG11 ILE 75 5.061 -3.692 2.060 614 HG21 ILE 75 HG21 ILE 75 4.908 -6.123 -0.072 615 HG22 ILE 75 HG22 ILE 75 6.116 -4.862 -0.314 616 HG23 ILE 75 HG23 ILE 75 4.933 -5.197 -1.577 617 HD11 ILE 75 HD11 ILE 75 2.057 -3.993 2.128 618 HD12 ILE 75 HD12 ILE 75 2.948 -2.470 2.190 619 HD13 ILE 75 HD13 ILE 75 3.114 -3.641 3.495 620 H LYS 76 HN LYS 76 6.698 -2.091 -1.537 621 HA LYS 76 HA LYS 76 5.873 -3.192 -4.169 622 HB2 LYS 76 HB2 LYS 76 6.169 -0.711 -4.321 623 HB3 LYS 76 HB1 LYS 76 7.827 -0.881 -3.742 624 HG2 LYS 76 HG2 LYS 76 8.358 -2.284 -5.744 625 HG3 LYS 76 HG1 LYS 76 6.706 -2.057 -6.312 626 HD2 LYS 76 HD2 LYS 76 8.225 -0.559 -7.499 627 HD3 LYS 76 HD1 LYS 76 7.108 0.380 -6.506 628 HE2 LYS 76 HE2 LYS 76 8.833 0.785 -4.846 629 HE3 LYS 76 HE1 LYS 76 9.934 -0.340 -5.645 630 HZ1 LYS 76 HZ1 LYS 76 8.942 2.210 -6.795 631 HZ2 LYS 76 HZ2 LYS 76 10.009 1.131 -7.547 632 HZ3 LYS 76 HZ3 LYS 76 10.476 1.944 -6.140 633 H VAL 77 HN VAL 77 6.962 -5.018 -4.560 634 HA VAL 77 HA VAL 77 8.871 -5.968 -2.657 635 HB VAL 77 HB VAL 77 8.036 -7.220 -5.298 636 HG11 VAL 77 HG11 VAL 77 9.349 -8.532 -2.890 637 HG12 VAL 77 HG12 VAL 77 10.110 -8.242 -4.457 638 HG13 VAL 77 HG13 VAL 77 8.759 -9.371 -4.330 639 HG21 VAL 77 HG21 VAL 77 6.903 -7.667 -2.517 640 HG22 VAL 77 HG22 VAL 77 6.420 -8.523 -3.986 641 HG23 VAL 77 HG23 VAL 77 6.110 -6.794 -3.831 642 H SER 78 HN SER 78 10.928 -5.494 -2.616 643 HA SER 78 HA SER 78 12.413 -4.343 -4.785 644 HB2 SER 78 HB2 SER 78 12.725 -3.668 -2.412 645 HB3 SER 78 HB1 SER 78 13.360 -5.270 -2.039 646 HG SER 78 HG SER 78 14.491 -3.539 -3.984 647 H THR 79 HN THR 79 11.980 -7.552 -3.586 648 HA THR 79 HA THR 79 13.245 -8.753 -5.829 649 HB THR 79 HB THR 79 15.366 -8.391 -4.641 650 HG1 THR 79 HG1 THR 79 14.834 -11.151 -4.313 651 HG21 THR 79 HG21 THR 79 14.576 -8.300 -2.307 652 HG22 THR 79 HG22 THR 79 15.888 -9.467 -2.484 653 HG23 THR 79 HG23 THR 79 14.220 -10.033 -2.352 654 H GLY 80 HN GLY 80 12.257 -10.653 -6.238 655 HA2 GLY 80 HA2 GLY 80 11.374 -12.728 -4.824 656 HA3 GLY 80 HA1 GLY 80 10.161 -11.527 -4.392 657 HA PRO 81 HA PRO 81 8.743 -13.673 -8.343 658 HB2 PRO 81 HB2 PRO 81 6.183 -14.205 -7.555 659 HB3 PRO 81 HB1 PRO 81 7.536 -15.268 -7.133 660 HG2 PRO 81 HG2 PRO 81 6.242 -13.100 -5.462 661 HG3 PRO 81 HG1 PRO 81 6.659 -14.762 -4.994 662 HD2 PRO 81 HD2 PRO 81 8.261 -12.662 -4.358 663 HD3 PRO 81 HD1 PRO 81 8.939 -14.260 -4.745 664 H LEU 82 HN LEU 82 7.795 -10.957 -6.483 665 HA LEU 82 HA LEU 82 6.313 -9.729 -8.732 666 HB2 LEU 82 HB2 LEU 82 5.867 -9.443 -5.731 667 HB3 LEU 82 HB1 LEU 82 5.070 -8.449 -6.943 668 HG LEU 82 HG LEU 82 4.749 -11.467 -6.703 669 HD11 LEU 82 HD11 LEU 82 2.501 -10.975 -5.831 670 HD12 LEU 82 HD12 LEU 82 2.875 -9.251 -5.817 671 HD13 LEU 82 HD13 LEU 82 3.770 -10.363 -4.777 672 HD21 LEU 82 HD21 LEU 82 4.425 -10.701 -9.006 673 HD22 LEU 82 HD22 LEU 82 3.273 -9.476 -8.471 674 HD23 LEU 82 HD23 LEU 82 2.885 -11.192 -8.305 675 H ALA 83 HN ALA 83 9.174 -9.650 -8.286 676 HA ALA 83 HA ALA 83 10.085 -7.281 -7.056 677 HB1 ALA 83 HB1 ALA 83 12.118 -7.562 -8.427 678 HB2 ALA 83 HB2 ALA 83 11.284 -8.750 -9.435 679 HB3 ALA 83 HB3 ALA 83 11.600 -9.103 -7.733 680 H GLY 84 HN GLY 84 9.370 -5.285 -7.522 681 HA2 GLY 84 HA2 GLY 84 9.495 -3.337 -8.930 682 HA3 GLY 84 HA1 GLY 84 9.164 -4.343 -10.328 683 H ARG 85 HN ARG 85 7.079 -5.652 -8.414 684 HA ARG 85 HA ARG 85 4.814 -4.123 -9.424 685 HB2 ARG 85 HB2 ARG 85 4.749 -6.645 -7.697 686 HB3 ARG 85 HB1 ARG 85 3.468 -6.026 -8.745 687 HG2 ARG 85 HG2 ARG 85 6.155 -6.919 -9.809 688 HG3 ARG 85 HG1 ARG 85 4.823 -8.044 -9.571 689 HD2 ARG 85 HD2 ARG 85 4.294 -5.589 -11.226 690 HD3 ARG 85 HD1 ARG 85 5.291 -6.866 -11.929 691 HE ARG 85 HE ARG 85 2.451 -6.981 -11.324 692 HH11 ARG 85 HH11 ARG 85 5.331 -8.873 -12.113 693 HH12 ARG 85 HH12 ARG 85 4.422 -10.240 -12.673 694 HH21 ARG 85 HH21 ARG 85 1.297 -8.813 -12.030 695 HH22 ARG 85 HH22 ARG 85 2.148 -10.191 -12.651 696 H VAL 86 HN VAL 86 3.545 -2.786 -8.204 697 HA VAL 86 HA VAL 86 4.190 -2.442 -5.359 698 HB VAL 86 HB VAL 86 4.448 -0.398 -6.628 699 HG11 VAL 86 HG11 VAL 86 2.601 0.762 -7.798 700 HG12 VAL 86 HG12 VAL 86 1.538 -0.614 -7.493 701 HG13 VAL 86 HG13 VAL 86 2.950 -0.809 -8.528 702 HG21 VAL 86 HG21 VAL 86 1.972 -0.242 -4.861 703 HG22 VAL 86 HG22 VAL 86 3.021 1.110 -5.293 704 HG23 VAL 86 HG23 VAL 86 3.649 -0.212 -4.311 705 H LEU 87 HN LEU 87 3.035 -3.830 -4.261 706 HA LEU 87 HA LEU 87 0.243 -4.408 -4.705 707 HB2 LEU 87 HB2 LEU 87 1.939 -5.229 -2.312 708 HB3 LEU 87 HB1 LEU 87 0.396 -5.904 -2.795 709 HG LEU 87 HG LEU 87 1.946 -7.542 -3.437 710 HD11 LEU 87 HD11 LEU 87 1.934 -7.666 -5.860 711 HD12 LEU 87 HD12 LEU 87 1.523 -5.953 -5.974 712 HD13 LEU 87 HD13 LEU 87 0.384 -7.090 -5.249 713 HD21 LEU 87 HD21 LEU 87 3.995 -6.245 -3.097 714 HD22 LEU 87 HD22 LEU 87 3.762 -5.451 -4.657 715 HD23 LEU 87 HD23 LEU 87 4.049 -7.192 -4.581 716 H ASN 88 HN ASN 88 -1.396 -3.336 -3.886 717 HA ASN 88 HA ASN 88 -1.050 -1.240 -1.836 718 HB2 ASN 88 HB2 ASN 88 -3.259 -1.755 -3.887 719 HB3 ASN 88 HB1 ASN 88 -3.362 -0.517 -2.643 720 HD21 ASN 88 HD21 ASN 88 -0.405 -1.270 -4.467 721 HD22 ASN 88 HD22 ASN 88 -0.365 0.222 -5.319 722 H ILE 89 HN ILE 89 -2.410 -1.231 0.041 723 HA ILE 89 HA ILE 89 -3.060 -3.920 0.967 724 HB ILE 89 HB ILE 89 -3.142 -1.238 2.437 725 HG12 ILE 89 HG12 ILE 89 -1.132 -3.530 2.488 726 HG13 ILE 89 HG11 ILE 89 -0.849 -1.898 1.894 727 HG21 ILE 89 HG21 ILE 89 -4.794 -2.772 3.456 728 HG22 ILE 89 HG22 ILE 89 -3.422 -2.521 4.536 729 HG23 ILE 89 HG23 ILE 89 -3.549 -4.019 3.613 730 HD11 ILE 89 HD11 ILE 89 -1.101 -1.049 4.200 731 HD12 ILE 89 HD12 ILE 89 0.213 -2.210 4.037 732 HD13 ILE 89 HD13 ILE 89 -1.312 -2.707 4.772 733 H ILE 90 HN ILE 90 -5.059 -4.759 1.024 734 HA ILE 90 HA ILE 90 -7.424 -3.008 0.624 735 HB ILE 90 HB ILE 90 -8.601 -5.208 -0.102 736 HG12 ILE 90 HG12 ILE 90 -5.723 -6.131 -0.564 737 HG13 ILE 90 HG11 ILE 90 -6.776 -6.762 0.687 738 HG21 ILE 90 HG21 ILE 90 -8.076 -3.376 -1.652 739 HG22 ILE 90 HG22 ILE 90 -7.887 -4.942 -2.445 740 HG23 ILE 90 HG23 ILE 90 -6.461 -4.039 -1.919 741 HD11 ILE 90 HD11 ILE 90 -7.201 -7.014 -2.289 742 HD12 ILE 90 HD12 ILE 90 -8.292 -7.627 -1.042 743 HD13 ILE 90 HD13 ILE 90 -6.659 -8.275 -1.181 744 H GLY 91 HN GLY 91 -7.018 -2.613 2.955 745 HA2 GLY 91 HA2 GLY 91 -8.951 -3.269 4.620 746 HA3 GLY 91 HA1 GLY 91 -7.942 -4.702 4.808 747 H GLN 92 HN GLN 92 -6.695 -4.574 6.563 748 HA GLN 92 HA GLN 92 -5.205 -2.120 7.197 749 HB2 GLN 92 HB2 GLN 92 -5.813 -2.112 9.528 750 HB3 GLN 92 HB1 GLN 92 -7.315 -2.169 8.627 751 HG2 GLN 92 HG2 GLN 92 -6.008 -4.549 9.983 752 HG3 GLN 92 HG1 GLN 92 -7.328 -3.601 10.657 753 HE21 GLN 92 HE21 GLN 92 -7.151 -6.485 9.962 754 HE22 GLN 92 HE22 GLN 92 -8.499 -6.766 8.924 755 HA PRO 93 HA PRO 93 -1.937 -5.181 7.728 756 HB2 PRO 93 HB2 PRO 93 -0.257 -3.860 9.473 757 HB3 PRO 93 HB1 PRO 93 -0.371 -3.476 7.749 758 HG2 PRO 93 HG2 PRO 93 -1.730 -2.125 10.077 759 HG3 PRO 93 HG1 PRO 93 -0.865 -1.387 8.706 760 HD2 PRO 93 HD2 PRO 93 -3.551 -1.518 8.732 761 HD3 PRO 93 HD1 PRO 93 -2.647 -1.765 7.218 762 H LEU 94 HN LEU 94 -2.809 -6.885 8.753 763 HA LEU 94 HA LEU 94 -3.918 -6.771 11.427 764 HB2 LEU 94 HB2 LEU 94 -4.942 -8.031 9.472 765 HB3 LEU 94 HB1 LEU 94 -3.609 -9.159 9.545 766 HG LEU 94 HG LEU 94 -5.832 -9.920 10.541 767 HD11 LEU 94 HD11 LEU 94 -4.869 -11.147 12.385 768 HD12 LEU 94 HD12 LEU 94 -3.456 -10.086 12.388 769 HD13 LEU 94 HD13 LEU 94 -3.779 -11.129 10.999 770 HD21 LEU 94 HD21 LEU 94 -6.443 -7.842 11.678 771 HD22 LEU 94 HD22 LEU 94 -5.103 -8.054 12.810 772 HD23 LEU 94 HD23 LEU 94 -6.434 -9.214 12.785 773 HA PRO 95 HA PRO 95 0.236 -7.913 13.055 774 HB2 PRO 95 HB2 PRO 95 -1.083 -7.840 15.740 775 HB3 PRO 95 HB1 PRO 95 0.291 -6.906 15.132 776 HG2 PRO 95 HG2 PRO 95 -2.104 -5.739 15.502 777 HG3 PRO 95 HG1 PRO 95 -1.049 -5.276 14.150 778 HD2 PRO 95 HD2 PRO 95 -3.462 -7.107 14.116 779 HD3 PRO 95 HD1 PRO 95 -3.019 -5.800 12.989 780 H ASP 96 HN ASP 96 1.065 -9.947 13.346 781 HA ASP 96 HA ASP 96 -0.448 -12.291 13.502 782 HB2 ASP 96 HB2 ASP 96 1.870 -12.161 12.729 783 HB3 ASP 96 HB1 ASP 96 2.415 -11.713 14.340 784 H ALA 97 HN ALA 97 -0.940 -13.707 15.189 785 HA ALA 97 HA ALA 97 -1.718 -12.530 17.672 786 HB1 ALA 97 HB1 ALA 97 -3.060 -14.264 16.553 787 HB2 ALA 97 HB2 ALA 97 -2.636 -14.753 18.195 788 HB3 ALA 97 HB3 ALA 97 -1.774 -15.445 16.814 789 H ALA 98 HN ALA 98 1.064 -14.398 16.670 790 HA ALA 98 HA ALA 98 2.034 -14.735 19.438 791 HB1 ALA 98 HB1 ALA 98 3.879 -16.007 18.406 792 HB2 ALA 98 HB2 ALA 98 3.278 -15.608 16.796 793 HB3 ALA 98 HB3 ALA 98 2.319 -16.628 17.869 794 H ARG 99 HN ARG 99 2.031 -12.322 17.108 795 HA ARG 99 HA ARG 99 3.134 -10.412 16.697 796 HB2 ARG 99 HB2 ARG 99 4.064 -10.886 19.542 797 HB3 ARG 99 HB1 ARG 99 4.630 -9.491 18.639 798 HG2 ARG 99 HG2 ARG 99 2.809 -8.797 20.046 799 HG3 ARG 99 HG1 ARG 99 2.269 -8.731 18.370 800 HD2 ARG 99 HD2 ARG 99 1.050 -10.852 18.681 801 HD3 ARG 99 HD1 ARG 99 1.625 -10.943 20.350 802 HE ARG 99 HE ARG 99 0.353 -8.506 20.127 803 HH11 ARG 99 HH11 ARG 99 -0.632 -11.843 19.743 804 HH12 ARG 99 HH12 ARG 99 -2.260 -11.540 20.235 805 HH21 ARG 99 HH21 ARG 99 -1.752 -8.118 20.761 806 HH22 ARG 99 HH22 ARG 99 -2.896 -9.419 20.825 807 H THR 100 HN THR 100 4.399 -13.013 15.976 808 HA THR 100 HA THR 100 7.281 -12.519 16.024 809 HB THR 100 HB THR 100 7.414 -14.698 14.789 810 HG1 THR 100 HG1 THR 100 4.615 -14.942 15.149 811 HG21 THR 100 HG21 THR 100 5.625 -14.796 17.244 812 HG22 THR 100 HG22 THR 100 7.389 -14.741 17.257 813 HG23 THR 100 HG23 THR 100 6.553 -16.149 16.598 814 H ARG 101 HN ARG 101 4.676 -11.538 14.135 815 HA ARG 101 HA ARG 101 6.264 -10.463 12.017 816 HB2 ARG 101 HB2 ARG 101 5.175 -11.694 10.160 817 HB3 ARG 101 HB1 ARG 101 6.110 -12.779 11.184 818 HG2 ARG 101 HG2 ARG 101 4.090 -13.611 12.242 819 HG3 ARG 101 HG1 ARG 101 3.109 -12.417 11.385 820 HD2 ARG 101 HD2 ARG 101 2.893 -14.581 10.333 821 HD3 ARG 101 HD1 ARG 101 3.710 -13.450 9.257 822 HE ARG 101 HE ARG 101 5.834 -14.545 9.862 823 HH11 ARG 101 HH11 ARG 101 2.899 -16.388 10.460 824 HH12 ARG 101 HH12 ARG 101 3.699 -17.922 10.368 825 HH21 ARG 101 HH21 ARG 101 6.881 -16.553 9.793 826 HH22 ARG 101 HH22 ARG 101 5.972 -18.016 10.009 827 H LEU 102 HN LEU 102 4.561 -9.709 10.197 828 HA LEU 102 HA LEU 102 2.077 -8.711 11.419 829 HB2 LEU 102 HB2 LEU 102 4.254 -7.055 10.891 830 HB3 LEU 102 HB1 LEU 102 3.395 -6.944 9.374 831 HG LEU 102 HG LEU 102 2.711 -5.067 10.648 832 HD11 LEU 102 HD11 LEU 102 0.493 -7.093 10.969 833 HD12 LEU 102 HD12 LEU 102 0.850 -6.148 9.525 834 HD13 LEU 102 HD13 LEU 102 0.323 -5.334 10.991 835 HD21 LEU 102 HD21 LEU 102 1.883 -5.139 12.955 836 HD22 LEU 102 HD22 LEU 102 3.529 -5.756 12.836 837 HD23 LEU 102 HD23 LEU 102 2.180 -6.881 13.019 838 H GLU 103 HN GLU 103 0.458 -9.589 10.317 839 HA GLU 103 HA GLU 103 0.790 -10.805 7.706 840 HB2 GLU 103 HB2 GLU 103 -0.511 -11.954 9.476 841 HB3 GLU 103 HB1 GLU 103 -1.634 -10.605 9.551 842 HG2 GLU 103 HG2 GLU 103 -2.657 -12.426 8.319 843 HG3 GLU 103 HG1 GLU 103 -2.346 -11.079 7.223 844 H ILE 104 HN ILE 104 0.900 -9.297 6.091 845 HA ILE 104 HA ILE 104 -1.036 -7.077 5.993 846 HB ILE 104 HB ILE 104 1.256 -7.562 4.032 847 HG12 ILE 104 HG12 ILE 104 2.281 -7.472 6.270 848 HG13 ILE 104 HG11 ILE 104 2.681 -6.024 5.358 849 HG21 ILE 104 HG21 ILE 104 -0.239 -5.018 4.782 850 HG22 ILE 104 HG22 ILE 104 -0.459 -5.962 3.305 851 HG23 ILE 104 HG23 ILE 104 1.073 -5.141 3.601 852 HD11 ILE 104 HD11 ILE 104 0.619 -6.245 7.542 853 HD12 ILE 104 HD12 ILE 104 0.990 -4.785 6.620 854 HD13 ILE 104 HD13 ILE 104 2.215 -5.509 7.656 855 H LEU 105 HN LEU 105 -2.805 -7.303 4.746 856 HA LEU 105 HA LEU 105 -2.835 -9.261 2.532 857 HB2 LEU 105 HB2 LEU 105 -5.231 -9.264 2.582 858 HB3 LEU 105 HB1 LEU 105 -4.667 -9.526 4.217 859 HG LEU 105 HG LEU 105 -5.814 -6.904 3.161 860 HD11 LEU 105 HD11 LEU 105 -7.801 -7.413 4.493 861 HD12 LEU 105 HD12 LEU 105 -7.120 -8.981 4.941 862 HD13 LEU 105 HD13 LEU 105 -7.524 -8.636 3.256 863 HD21 LEU 105 HD21 LEU 105 -4.247 -6.480 4.996 864 HD22 LEU 105 HD22 LEU 105 -5.086 -7.654 6.016 865 HD23 LEU 105 HD23 LEU 105 -5.907 -6.171 5.508 866 H CYS 106 HN CYS 106 -3.244 -8.586 0.488 867 HA CYS 106 HA CYS 106 -3.484 -5.795 -0.237 868 HB2 CYS 106 HB2 CYS 106 -0.805 -7.210 -0.692 869 HB3 CYS 106 HB1 CYS 106 -1.267 -5.667 -1.396 870 HG CYS 106 HG CYS 106 -1.720 -5.111 1.686 871 H ARG 107 HN ARG 107 -3.072 -5.573 -2.636 872 HA ARG 107 HA ARG 107 -3.319 -8.003 -4.293 873 HB2 ARG 107 HB2 ARG 107 -5.017 -6.851 -5.716 874 HB3 ARG 107 HB1 ARG 107 -5.619 -7.135 -4.085 875 HG2 ARG 107 HG2 ARG 107 -5.528 -4.857 -3.492 876 HG3 ARG 107 HG1 ARG 107 -4.375 -4.458 -4.765 877 HD2 ARG 107 HD2 ARG 107 -7.253 -5.270 -5.281 878 HD3 ARG 107 HD1 ARG 107 -6.696 -3.600 -5.171 879 HE ARG 107 HE ARG 107 -5.150 -4.214 -7.063 880 HH11 ARG 107 HH11 ARG 107 -8.302 -5.747 -6.748 881 HH12 ARG 107 HH12 ARG 107 -8.405 -6.135 -8.436 882 HH21 ARG 107 HH21 ARG 107 -5.288 -4.703 -9.241 883 HH22 ARG 107 HH22 ARG 107 -6.684 -5.530 -9.859 884 H GLU 108 HN GLU 108 -2.486 -7.552 -6.524 885 HA GLU 108 HA GLU 108 -0.485 -5.625 -6.861 886 HB2 GLU 108 HB2 GLU 108 -0.738 -7.515 -8.411 887 HB3 GLU 108 HB1 GLU 108 -2.266 -6.853 -8.999 888 HG2 GLU 108 HG2 GLU 108 -0.986 -4.811 -9.761 889 HG3 GLU 108 HG1 GLU 108 0.500 -5.663 -9.329 890 H GLY 109 HN GLY 109 -0.563 -3.469 -7.095 891 HA2 GLY 109 HA2 GLY 109 -3.149 -2.115 -6.973 892 HA3 GLY 109 HA1 GLY 109 -1.570 -1.432 -6.626 893 H ALA 110 HN ALA 110 -2.595 -3.139 -9.545 894 HA ALA 110 HA ALA 110 -2.651 -2.617 -11.733 895 HB1 ALA 110 HB1 ALA 110 -4.806 -1.738 -10.910 896 HB2 ALA 110 HB2 ALA 110 -4.220 -0.827 -12.302 897 HB3 ALA 110 HB3 ALA 110 -4.070 -0.150 -10.678 898 H GLU 111 HN GLU 111 -0.175 -2.239 -11.133 899 HA GLU 111 HA GLU 111 0.806 0.397 -11.807 900 HB2 GLU 111 HB2 GLU 111 3.081 -0.976 -11.956 901 HB3 GLU 111 HB1 GLU 111 2.350 -0.594 -10.411 902 HG2 GLU 111 HG2 GLU 111 3.215 -2.876 -10.421 903 HG3 GLU 111 HG1 GLU 111 1.466 -2.869 -10.219 904 H LYS 112 HN LYS 112 -0.073 -2.453 -13.540 905 HA LYS 112 HA LYS 112 0.999 -1.569 -16.084 906 HB2 LYS 112 HB2 LYS 112 -0.551 -3.461 -16.974 907 HB3 LYS 112 HB1 LYS 112 0.822 -3.913 -15.976 908 HG2 LYS 112 HG2 LYS 112 -0.703 -4.143 -14.015 909 HG3 LYS 112 HG1 LYS 112 -2.068 -3.753 -15.058 910 HD2 LYS 112 HD2 LYS 112 -1.884 -6.187 -14.688 911 HD3 LYS 112 HD1 LYS 112 -1.663 -5.781 -16.392 912 HE2 LYS 112 HE2 LYS 112 -0.048 -7.496 -15.650 913 HE3 LYS 112 HE1 LYS 112 0.773 -6.021 -16.154 914 HZ1 LYS 112 HZ1 LYS 112 1.093 -5.418 -13.864 915 HZ2 LYS 112 HZ2 LYS 112 1.690 -6.980 -14.107 916 HZ3 LYS 112 HZ3 LYS 112 0.204 -6.755 -13.326
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