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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
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6103 |
1ig6 ![]() ![]() |
4100 | cing | recoord | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H ARG 1 H1 ARG 1 -7.726 1.154 -6.745 2 2H ARG 1 H2 ARG 1 -6.901 0.026 -7.620 3 3H ARG 1 H3 ARG 1 -7.064 1.542 -8.190 4 HA ARG 1 HA ARG 1 -4.859 1.258 -7.427 5 1HB ARG 1 HB2 ARG 1 -5.944 3.463 -7.156 6 2HB ARG 1 HB3 ARG 1 -6.438 3.054 -5.526 7 1HG ARG 1 HG2 ARG 1 -3.497 2.841 -6.200 8 2HG ARG 1 HG3 ARG 1 -4.207 4.452 -6.117 9 1HD ARG 1 HD2 ARG 1 -4.970 4.091 -3.822 10 2HD ARG 1 HD3 ARG 1 -4.402 2.424 -3.857 11 HE ARG 1 H3T ARG 1 -2.191 3.095 -3.649 12 1HH1 ARG 1 2HH2 ARG 1 -4.099 6.031 -3.965 13 2HH1 ARG 1 1HH2 ARG 1 -2.756 7.021 -3.461 14 1HH2 ARG 1 2HH1 ARG 1 -0.625 4.330 -3.064 15 2HH2 ARG 1 1HH1 ARG 1 -0.795 6.073 -2.948 16 H ALA 2 H ALA 2 -7.027 0.719 -4.594 17 HA ALA 2 HA ALA 2 -4.765 0.106 -2.910 18 1HB ALA 2 HB1 ALA 2 -6.856 1.107 -2.062 19 2HB ALA 2 HB2 ALA 2 -7.749 -0.369 -2.502 20 3HB ALA 2 HB3 ALA 2 -6.497 -0.425 -1.244 21 H ASP 3 H ASP 3 -7.062 -1.961 -4.729 22 HA ASP 3 HA ASP 3 -6.104 -4.417 -3.544 23 1HB ASP 3 HB2 ASP 3 -8.359 -4.055 -4.557 24 2HB ASP 3 HB3 ASP 3 -7.602 -3.939 -6.147 25 H GLU 4 H GLU 4 -4.984 -2.441 -6.292 26 HA GLU 4 HA GLU 4 -3.318 -4.550 -7.545 27 1HB GLU 4 HB2 GLU 4 -3.102 -1.542 -7.753 28 2HB GLU 4 HB3 GLU 4 -2.302 -2.765 -8.735 29 1HG GLU 4 HG2 GLU 4 -3.979 -2.321 -10.176 30 2HG GLU 4 HG3 GLU 4 -4.852 -3.516 -9.224 31 H GLN 5 H GLN 5 -2.943 -1.845 -5.181 32 HA GLN 5 HA GLN 5 -0.126 -2.346 -4.801 33 1HB GLN 5 HB2 GLN 5 -2.147 -0.824 -3.111 34 2HB GLN 5 HB3 GLN 5 -0.451 -1.043 -2.667 35 1HG GLN 5 HG2 GLN 5 -0.075 -0.150 -5.205 36 2HG GLN 5 HG3 GLN 5 -1.625 0.620 -4.878 37 1HE2 GLN 5 2HE2 GLN 5 1.718 0.209 -3.555 38 2HE2 GLN 5 1HE2 GLN 5 1.744 1.787 -2.782 39 H ALA 6 H ALA 6 -3.034 -3.449 -2.948 40 HA ALA 6 HA ALA 6 -1.641 -5.030 -1.067 41 1HB ALA 6 HB1 ALA 6 -3.769 -6.244 -0.839 42 2HB ALA 6 HB2 ALA 6 -4.045 -4.495 -0.943 43 3HB ALA 6 HB3 ALA 6 -4.359 -5.531 -2.354 44 H PHE 7 H PHE 7 -2.832 -6.053 -4.366 45 HA PHE 7 HA PHE 7 -1.586 -8.639 -4.005 46 1HB PHE 7 HB2 PHE 7 -2.519 -9.337 -5.917 47 2HB PHE 7 HB3 PHE 7 -3.676 -8.188 -5.292 48 HD1 PHE 7 HD1 PHE 7 -4.824 -7.030 -6.937 49 HD2 PHE 7 HD2 PHE 7 -0.770 -8.252 -7.747 50 HE1 PHE 7 HE1 PHE 7 -5.035 -6.208 -9.261 51 HE2 PHE 7 HE2 PHE 7 -1.003 -7.487 -10.061 52 HZ PHE 7 HZ PHE 7 -3.123 -6.424 -10.838 53 H LEU 8 H LEU 8 -0.062 -5.675 -4.660 54 HA LEU 8 HA LEU 8 2.095 -7.134 -6.147 55 1HB LEU 8 HB2 LEU 8 1.086 -4.432 -6.492 56 2HB LEU 8 HB3 LEU 8 2.713 -4.352 -5.891 57 HG LEU 8 HG LEU 8 2.449 -4.316 -8.356 58 1HD1 LEU 8 1HD1 LEU 8 4.572 -4.836 -7.355 59 2HD1 LEU 8 2HD1 LEU 8 4.145 -6.550 -7.211 60 3HD1 LEU 8 3HD1 LEU 8 4.343 -5.812 -8.811 61 1HD2 LEU 8 1HD2 LEU 8 2.078 -6.344 -9.640 62 2HD2 LEU 8 2HD2 LEU 8 1.805 -7.295 -8.193 63 3HD2 LEU 8 3HD2 LEU 8 0.662 -6.002 -8.629 64 H VAL 9 H VAL 9 1.075 -5.891 -3.062 65 HA VAL 9 HA VAL 9 3.793 -6.051 -1.918 66 HB VAL 9 H5T VAL 9 1.030 -5.809 -0.694 67 1HG1 VAL 9 1HG1 VAL 9 2.176 -5.541 1.504 68 2HG1 VAL 9 2HG1 VAL 9 2.301 -7.186 0.883 69 3HG1 VAL 9 3HG1 VAL 9 3.696 -6.087 0.763 70 1HG2 VAL 9 1HG2 VAL 9 2.108 -3.760 -1.692 71 2HG2 VAL 9 2HG2 VAL 9 1.876 -3.636 0.056 72 3HG2 VAL 9 3HG2 VAL 9 3.487 -3.992 -0.607 73 H ALA 10 H ALA 10 0.907 -8.156 -2.289 74 HA ALA 10 HA ALA 10 2.075 -10.469 -1.060 75 1HB ALA 10 HB1 ALA 10 -0.341 -10.209 -1.551 76 2HB ALA 10 HB2 ALA 10 0.006 -10.250 -3.295 77 3HB ALA 10 HB3 ALA 10 0.322 -11.678 -2.290 78 H LEU 11 H LEU 11 2.065 -9.410 -4.575 79 HA LEU 11 HA LEU 11 3.882 -11.444 -5.379 80 1HB LEU 11 HB2 LEU 11 2.748 -10.037 -7.049 81 2HB LEU 11 HB3 LEU 11 3.670 -8.639 -6.495 82 HG LEU 11 HG LEU 11 5.801 -9.759 -7.188 83 1HD1 LEU 11 1HD1 LEU 11 4.040 -11.916 -8.370 84 2HD1 LEU 11 2HD1 LEU 11 5.782 -11.727 -8.619 85 3HD1 LEU 11 3HD1 LEU 11 5.170 -12.135 -7.018 86 1HD2 LEU 11 1HD2 LEU 11 5.453 -9.599 -9.607 87 2HD2 LEU 11 2HD2 LEU 11 3.688 -9.643 -9.369 88 3HD2 LEU 11 3HD2 LEU 11 4.645 -8.283 -8.747 89 H TYR 12 H TYR 12 4.670 -8.151 -4.022 90 HA TYR 12 HA TYR 12 7.435 -8.349 -4.283 91 1HB TYR 12 HB2 TYR 12 6.517 -6.287 -3.535 92 2HB TYR 12 HB3 TYR 12 5.724 -7.041 -2.169 93 HD1 TYR 12 HD1 TYR 12 9.259 -6.857 -3.463 94 HD2 TYR 12 HD2 TYR 12 6.598 -6.560 -0.085 95 HE1 TYR 12 HE1 TYR 12 11.213 -6.429 -1.951 96 HE2 TYR 12 HE2 TYR 12 8.535 -6.119 1.408 97 HH TYR 12 HH TYR 12 10.792 -5.850 1.559 98 H LYS 13 H LYS 13 5.471 -9.663 -1.559 99 HA LYS 13 HA LYS 13 7.733 -10.921 -0.293 100 1HB LYS 13 HB2 LYS 13 5.505 -10.530 0.789 101 2HB LYS 13 HB3 LYS 13 4.787 -11.772 -0.249 102 1HG LYS 13 HG2 LYS 13 6.320 -13.472 0.723 103 2HG LYS 13 HG3 LYS 13 7.056 -12.237 1.750 104 1HD LYS 13 HD2 LYS 13 4.125 -13.088 1.842 105 2HD LYS 13 HD3 LYS 13 5.396 -13.678 2.922 106 1HE LYS 13 HE2 LYS 13 5.805 -11.339 3.703 107 2HE LYS 13 HE3 LYS 13 4.478 -10.777 2.678 108 1HZ LYS 13 HZ1 LYS 13 3.733 -11.152 4.956 109 2HZ LYS 13 HZ2 LYS 13 2.971 -12.200 3.966 110 3HZ LYS 13 HZ3 LYS 13 4.198 -12.714 4.915 111 H TYR 14 H TYR 14 5.272 -12.654 -2.424 112 HA TYR 14 HA TYR 14 6.771 -14.881 -2.740 113 1HB TYR 14 HB2 TYR 14 4.484 -14.358 -3.626 114 2HB TYR 14 HB3 TYR 14 5.230 -13.529 -4.982 115 HD1 TYR 14 HD1 TYR 14 6.054 -14.790 -6.883 116 HD2 TYR 14 HD2 TYR 14 4.880 -16.816 -3.257 117 HE1 TYR 14 HE1 TYR 14 6.220 -16.991 -8.051 118 HE2 TYR 14 HE2 TYR 14 5.038 -19.006 -4.424 119 HH TYR 14 HH TYR 14 5.458 -20.083 -6.404 120 H MET 15 H MET 15 7.426 -11.922 -4.709 121 HA MET 15 HA MET 15 9.356 -13.325 -6.328 122 1HB MET 15 HB2 MET 15 9.705 -11.408 -7.530 123 2HB MET 15 HB3 MET 15 7.979 -11.525 -7.204 124 1HG MET 15 HG2 MET 15 8.377 -9.877 -5.294 125 2HG MET 15 HG3 MET 15 9.974 -9.625 -5.946 126 1HE MET 15 HE1 MET 15 8.804 -8.373 -9.681 127 2HE MET 15 HE2 MET 15 10.241 -8.820 -8.751 128 3HE MET 15 HE3 MET 15 9.037 -10.055 -9.165 129 H LYS 16 H LYS 16 9.635 -11.209 -3.392 130 HA LYS 16 HA LYS 16 12.490 -11.340 -3.285 131 1HB LYS 16 HB2 LYS 16 11.040 -9.863 -1.927 132 2HB LYS 16 HB3 LYS 16 10.477 -11.250 -0.989 133 1HG LYS 16 HG2 LYS 16 12.612 -11.585 0.010 134 2HG LYS 16 HG3 LYS 16 13.443 -10.616 -1.221 135 1HD LYS 16 HD2 LYS 16 12.384 -8.568 -0.406 136 2HD LYS 16 HD3 LYS 16 11.475 -9.482 0.816 137 1HE LYS 16 HE2 LYS 16 13.491 -10.100 1.982 138 2HE LYS 16 HE3 LYS 16 14.514 -9.545 0.649 139 1HZ LYS 16 HZ1 LYS 16 14.419 -7.935 2.492 140 2HZ LYS 16 HZ2 LYS 16 13.893 -7.296 1.083 141 3HZ LYS 16 HZ3 LYS 16 12.812 -7.718 2.247 142 H GLU 17 H GLU 17 10.017 -13.701 -2.181 143 HA GLU 17 HA GLU 17 11.991 -15.653 -1.320 144 1HB GLU 17 HB2 GLU 17 9.511 -15.400 -0.670 145 2HB GLU 17 HB3 GLU 17 9.131 -16.214 -2.188 146 1HG GLU 17 HG2 GLU 17 10.372 -18.212 -1.438 147 2HG GLU 17 HG3 GLU 17 10.939 -17.349 -0.007 148 H ARG 18 H ARG 18 11.478 -14.485 -4.422 149 HA ARG 18 HA ARG 18 12.549 -17.022 -5.618 150 1HB ARG 18 HB2 ARG 18 10.392 -15.198 -6.648 151 2HB ARG 18 HB3 ARG 18 11.503 -15.902 -7.803 152 1HG ARG 18 HG2 ARG 18 9.772 -17.419 -7.789 153 2HG ARG 18 HG3 ARG 18 11.017 -18.181 -6.805 154 1HD ARG 18 HD2 ARG 18 9.705 -17.242 -4.760 155 2HD ARG 18 HD3 ARG 18 8.444 -16.839 -5.906 156 HE ARG 18 H3T ARG 18 7.966 -19.115 -6.225 157 1HH1 ARG 18 2HH2 ARG 18 10.725 -18.851 -4.022 158 2HH1 ARG 18 1HH2 ARG 18 10.606 -20.532 -3.581 159 1HH2 ARG 18 2HH1 ARG 18 7.918 -21.232 -5.596 160 2HH2 ARG 18 1HH1 ARG 18 9.060 -21.830 -4.428 161 H LYS 19 H LYS 19 13.799 -14.514 -4.388 162 HA LYS 19 HA LYS 19 15.806 -13.502 -4.539 163 1HB LYS 19 HB2 LYS 19 16.428 -15.387 -6.848 164 2HB LYS 19 HB3 LYS 19 17.585 -14.431 -5.923 165 1HG LYS 19 HG2 LYS 19 16.995 -15.674 -3.859 166 2HG LYS 19 HG3 LYS 19 15.846 -16.664 -4.780 167 1HD LYS 19 HD2 LYS 19 17.694 -17.473 -6.227 168 2HD LYS 19 HD3 LYS 19 18.851 -16.520 -5.268 169 1HE LYS 19 HE2 LYS 19 18.203 -17.785 -3.231 170 2HE LYS 19 HE3 LYS 19 17.034 -18.718 -4.173 171 1HZ LYS 19 HZ1 LYS 19 19.973 -18.731 -4.619 172 2HZ LYS 19 HZ2 LYS 19 19.121 -19.928 -3.909 173 3HZ LYS 19 HZ3 LYS 19 18.889 -19.595 -5.488 174 H THR 20 H THR 20 13.440 -12.582 -6.017 175 HA THR 20 HA THR 20 14.826 -10.697 -7.794 176 HB THR 20 H5T THR 20 12.253 -12.047 -8.684 177 HG1 THR 20 HG1 THR 20 13.856 -13.595 -8.711 178 1HG2 THR 20 1HG2 THR 20 12.856 -11.185 -10.903 179 2HG2 THR 20 2HG2 THR 20 12.767 -9.832 -9.773 180 3HG2 THR 20 3HG2 THR 20 14.350 -10.473 -10.262 181 HA PRO 21 HA PRO 21 11.590 -8.892 -4.839 182 1HB PRO 21 HB2 PRO 21 13.168 -7.225 -3.365 183 2HB PRO 21 HB3 PRO 21 12.982 -8.957 -2.995 184 1HG PRO 21 HG2 PRO 21 15.207 -7.651 -4.594 185 2HG PRO 21 HG3 PRO 21 15.359 -8.777 -3.204 186 1HD PRO 21 HD2 PRO 21 15.504 -9.668 -5.756 187 2HD PRO 21 HD3 PRO 21 14.648 -10.615 -4.503 188 H ILE 22 H ILE 22 10.742 -6.680 -4.860 189 HA ILE 22 HA ILE 22 11.317 -5.058 -7.174 190 HB ILE 22 H5T ILE 22 9.809 -4.508 -4.589 191 1HG1 ILE 22 2HG1 ILE 22 8.911 -5.162 -7.406 192 2HG1 ILE 22 3HG1 ILE 22 8.898 -6.253 -6.022 193 1HG2 ILE 22 1HG2 ILE 22 8.837 -2.519 -5.743 194 2HG2 ILE 22 2HG2 ILE 22 10.562 -2.322 -5.512 195 3HG2 ILE 22 3HG2 ILE 22 9.939 -2.778 -7.114 196 1HD1 ILE 22 1HD1 ILE 22 6.676 -5.574 -6.216 197 2HD1 ILE 22 2HD1 ILE 22 7.315 -4.621 -4.863 198 3HD1 ILE 22 3HD1 ILE 22 7.101 -3.868 -6.460 199 H GLU 23 H GLU 23 12.765 -5.244 -3.994 200 HA GLU 23 HA GLU 23 14.388 -2.965 -3.989 201 1HB GLU 23 HB2 GLU 23 15.132 -5.770 -3.088 202 2HB GLU 23 HB3 GLU 23 15.998 -4.292 -2.668 203 1HG GLU 23 HG2 GLU 23 13.908 -3.392 -1.616 204 2HG GLU 23 HG3 GLU 23 13.121 -4.944 -1.916 205 H ARG 24 H ARG 24 14.581 -5.418 -6.447 206 HA ARG 24 HA ARG 24 17.100 -4.134 -7.440 207 1HB ARG 24 HB2 ARG 24 17.867 -6.056 -8.385 208 2HB ARG 24 HB3 ARG 24 17.174 -6.632 -6.878 209 1HG ARG 24 HG2 ARG 24 15.081 -7.259 -8.265 210 2HG ARG 24 HG3 ARG 24 16.033 -6.934 -9.703 211 1HD ARG 24 HD2 ARG 24 16.743 -8.945 -7.520 212 2HD ARG 24 HD3 ARG 24 15.985 -9.329 -9.077 213 HE ARG 24 H3T ARG 24 18.344 -7.954 -9.691 214 1HH1 ARG 24 2HH2 ARG 24 17.584 -11.077 -8.169 215 2HH1 ARG 24 1HH2 ARG 24 19.082 -11.753 -8.718 216 1HH2 ARG 24 2HH1 ARG 24 20.220 -8.941 -10.306 217 2HH2 ARG 24 1HH1 ARG 24 20.519 -10.599 -9.877 218 H ILE 25 H ILE 25 14.097 -3.509 -7.775 219 HA ILE 25 HA ILE 25 14.142 -2.992 -10.716 220 HB ILE 25 H5T ILE 25 11.618 -3.682 -9.180 221 1HG1 ILE 25 2HG1 ILE 25 13.242 -5.577 -10.936 222 2HG1 ILE 25 3HG1 ILE 25 13.081 -5.697 -9.183 223 1HG2 ILE 25 1HG2 ILE 25 11.509 -2.284 -11.300 224 2HG2 ILE 25 2HG2 ILE 25 12.270 -3.629 -12.162 225 3HG2 ILE 25 3HG2 ILE 25 10.663 -3.819 -11.434 226 1HD1 ILE 25 1HD1 ILE 25 10.623 -5.981 -9.415 227 2HD1 ILE 25 2HD1 ILE 25 10.830 -6.054 -11.184 228 3HD1 ILE 25 3HD1 ILE 25 11.585 -7.277 -10.153 229 HA PRO 26 HA PRO 26 13.793 0.680 -7.946 230 1HB PRO 26 HB2 PRO 26 15.719 2.307 -8.985 231 2HB PRO 26 HB3 PRO 26 16.088 0.872 -7.985 232 1HG PRO 26 HG2 PRO 26 16.042 1.045 -11.022 233 2HG PRO 26 HG3 PRO 26 17.355 0.414 -9.972 234 1HD PRO 26 HD2 PRO 26 15.516 -1.238 -11.109 235 2HD PRO 26 HD3 PRO 26 16.122 -1.526 -9.450 236 H TYR 27 H TYR 27 13.072 0.707 -11.430 237 HA TYR 27 HA TYR 27 11.822 3.375 -11.153 238 1HB TYR 27 HB2 TYR 27 13.971 2.821 -13.233 239 2HB TYR 27 HB3 TYR 27 12.998 4.273 -13.127 240 HD1 TYR 27 HD1 TYR 27 13.114 5.473 -10.675 241 HD2 TYR 27 HD2 TYR 27 16.169 3.012 -12.467 242 HE1 TYR 27 HE1 TYR 27 14.830 6.571 -9.250 243 HE2 TYR 27 HE2 TYR 27 17.887 4.106 -11.032 244 HH TYR 27 HH TYR 27 17.049 6.678 -8.679 245 H LEU 28 H LEU 28 10.299 3.847 -12.657 246 HA LEU 28 HA LEU 28 9.018 1.827 -14.342 247 1HB LEU 28 HB2 LEU 28 7.785 3.592 -13.185 248 2HB LEU 28 HB3 LEU 28 8.753 4.839 -13.940 249 HG LEU 28 HG LEU 28 7.757 4.208 -16.169 250 1HD1 LEU 28 1HD1 LEU 28 5.725 2.852 -16.207 251 2HD1 LEU 28 2HD1 LEU 28 7.069 1.877 -15.603 252 3HD1 LEU 28 3HD1 LEU 28 5.863 2.530 -14.466 253 1HD2 LEU 28 1HD2 LEU 28 5.875 4.981 -13.895 254 2HD2 LEU 28 2HD2 LEU 28 6.879 6.081 -14.864 255 3HD2 LEU 28 3HD2 LEU 28 5.531 5.215 -15.615 256 H GLY 29 H GLY 29 10.152 5.036 -15.419 257 1HA GLY 29 HA2 GLY 29 12.511 3.916 -16.775 258 2HA GLY 29 HA3 GLY 29 11.228 4.503 -17.834 259 H PHE 30 H PHE 30 10.465 6.734 -16.054 260 HA PHE 30 HA PHE 30 12.885 8.491 -15.952 261 1HB PHE 30 HB2 PHE 30 11.409 10.335 -16.577 262 2HB PHE 30 HB3 PHE 30 11.380 9.073 -17.793 263 HD1 PHE 30 HD1 PHE 30 9.407 10.786 -15.164 264 HD2 PHE 30 HD2 PHE 30 9.365 7.724 -18.195 265 HE1 PHE 30 HE1 PHE 30 6.947 10.572 -14.920 266 HE2 PHE 30 HE2 PHE 30 6.908 7.495 -17.935 267 HZ PHE 30 HZ PHE 30 5.696 8.905 -16.279 268 H LYS 31 H LYS 31 10.960 6.780 -13.964 269 HA LYS 31 HA LYS 31 11.054 8.631 -11.664 270 1HB LYS 31 HB2 LYS 31 9.039 9.300 -13.020 271 2HB LYS 31 HB3 LYS 31 8.417 7.656 -12.902 272 1HG LYS 31 HG2 LYS 31 8.079 7.920 -10.494 273 2HG LYS 31 HG3 LYS 31 8.911 9.493 -10.516 274 1HD LYS 31 HD2 LYS 31 7.131 10.402 -11.982 275 2HD LYS 31 HD3 LYS 31 6.323 8.819 -11.994 276 1HE LYS 31 HE2 LYS 31 6.041 8.940 -9.532 277 2HE LYS 31 HE3 LYS 31 6.866 10.504 -9.505 278 1HZ LYS 31 HZ1 LYS 31 5.068 11.406 -10.881 279 2HZ LYS 31 HZ2 LYS 31 4.301 9.962 -10.910 280 3HZ LYS 31 HZ3 LYS 31 4.454 10.778 -9.507 281 H GLN 32 H GLN 32 10.070 7.385 -9.699 282 HA GLN 32 HA GLN 32 11.018 4.744 -9.331 283 1HB GLN 32 HB2 GLN 32 10.197 6.451 -7.599 284 2HB GLN 32 HB3 GLN 32 8.558 5.998 -8.056 285 1HG GLN 32 HG2 GLN 32 9.437 3.522 -7.420 286 2HG GLN 32 HG3 GLN 32 10.646 4.428 -6.534 287 1HE2 GLN 32 1HE2 GLN 32 7.152 3.716 -6.866 288 2HE2 GLN 32 2HE2 GLN 32 6.735 4.316 -5.263 289 H ILE 33 H ILE 33 9.922 2.662 -9.307 290 HA ILE 33 HA ILE 33 8.011 2.022 -11.305 291 HB ILE 33 H5T ILE 33 8.830 0.738 -8.690 292 1HG1 ILE 33 2HG1 ILE 33 10.407 0.643 -10.603 293 2HG1 ILE 33 3HG1 ILE 33 9.883 -0.928 -10.024 294 1HG2 ILE 33 1HG2 ILE 33 6.539 0.000 -8.859 295 2HG2 ILE 33 2HG2 ILE 33 6.749 -0.438 -10.577 296 3HG2 ILE 33 3HG2 ILE 33 7.615 -1.316 -9.296 297 1HD1 ILE 33 1HD1 ILE 33 8.777 0.390 -12.537 298 2HD1 ILE 33 2HD1 ILE 33 10.043 -0.845 -12.489 299 3HD1 ILE 33 3HD1 ILE 33 8.420 -1.247 -11.944 300 H ASN 34 H ASN 34 5.906 2.070 -11.461 301 HA ASN 34 HA ASN 34 4.113 2.869 -9.229 302 1HB ASN 34 HB2 ASN 34 4.969 4.903 -10.477 303 2HB ASN 34 HB3 ASN 34 4.262 4.245 -11.952 304 1HD2 ASN 34 1HD2 ASN 34 2.838 6.053 -12.180 305 2HD2 ASN 34 2HD2 ASN 34 1.434 6.187 -11.132 306 H LEU 35 H LEU 35 4.266 0.393 -9.850 307 HA LEU 35 HA LEU 35 3.502 -0.768 -12.150 308 1HB LEU 35 HB2 LEU 35 4.492 -1.818 -10.167 309 2HB LEU 35 HB3 LEU 35 2.930 -1.828 -9.372 310 HG LEU 35 HG LEU 35 3.654 -3.989 -10.321 311 1HD1 LEU 35 1HD1 LEU 35 1.157 -3.206 -11.832 312 2HD1 LEU 35 2HD1 LEU 35 1.619 -4.728 -11.097 313 3HD1 LEU 35 3HD1 LEU 35 1.183 -3.369 -10.059 314 1HD2 LEU 35 1HD2 LEU 35 4.757 -3.125 -12.394 315 2HD2 LEU 35 2HD2 LEU 35 3.665 -4.486 -12.662 316 3HD2 LEU 35 3HD2 LEU 35 3.145 -2.849 -13.092 317 H TRP 36 H TRP 36 0.999 -0.177 -9.601 318 HA TRP 36 HA TRP 36 -1.227 -1.251 -10.872 319 1HB TRP 36 HB2 TRP 36 -2.552 0.093 -9.508 320 2HB TRP 36 HB3 TRP 36 -1.115 -0.325 -8.592 321 HD1 TRP 36 HD1 TRP 36 0.834 1.809 -8.653 322 HE1 TRP 36 HE1 TRP 36 0.458 4.314 -8.443 323 HE3 TRP 36 HE3 TRP 36 -4.191 1.943 -9.637 324 HZ2 TRP 36 HZ2 TRP 36 -1.785 6.156 -8.494 325 HZ3 TRP 36 HZ3 TRP 36 -5.420 4.113 -9.584 326 HH2 TRP 36 HH2 TRP 36 -4.231 6.212 -9.007 327 H THR 37 H THR 37 0.343 1.883 -11.580 328 HA THR 37 HA THR 37 -1.727 2.881 -13.396 329 HB THR 37 H5T THR 37 1.085 3.896 -12.877 330 HG1 THR 37 HG1 THR 37 -0.384 4.000 -11.105 331 1HG2 THR 37 1HG2 THR 37 -1.275 5.182 -14.317 332 2HG2 THR 37 2HG2 THR 37 0.202 6.033 -13.813 333 3HG2 THR 37 3HG2 THR 37 0.297 4.759 -15.031 334 H MET 38 H MET 38 1.661 1.583 -13.900 335 HA MET 38 HA MET 38 1.355 1.660 -16.782 336 1HB MET 38 HB2 MET 38 3.259 0.169 -16.935 337 2HB MET 38 HB3 MET 38 3.586 1.558 -15.905 338 1HG MET 38 HG2 MET 38 3.637 0.284 -13.958 339 2HG MET 38 HG3 MET 38 2.714 -1.049 -14.662 340 1HE MET 38 HE1 MET 38 7.044 -1.252 -13.976 341 2HE MET 38 HE2 MET 38 6.223 0.317 -13.856 342 3HE MET 38 HE3 MET 38 5.633 -1.068 -12.915 343 H PHE 39 H PHE 39 0.412 -0.737 -14.344 344 HA PHE 39 HA PHE 39 -0.386 -2.780 -16.179 345 1HB PHE 39 HB2 PHE 39 -0.137 -3.219 -13.819 346 2HB PHE 39 HB3 PHE 39 -1.423 -2.089 -13.414 347 HD1 PHE 39 HD1 PHE 39 -3.609 -2.945 -13.108 348 HD2 PHE 39 HD2 PHE 39 -0.826 -5.117 -15.589 349 HE1 PHE 39 HE1 PHE 39 -5.295 -4.740 -13.440 350 HE2 PHE 39 HE2 PHE 39 -2.503 -6.918 -15.897 351 HZ PHE 39 HZ PHE 39 -4.748 -6.714 -14.850 352 H GLN 40 H GLN 40 -2.581 -0.312 -14.573 353 HA GLN 40 HA GLN 40 -4.720 -1.079 -16.321 354 1HB GLN 40 HB2 GLN 40 -5.950 0.773 -15.458 355 2HB GLN 40 HB3 GLN 40 -4.971 0.122 -14.142 356 1HG GLN 40 HG2 GLN 40 -3.258 1.971 -14.763 357 2HG GLN 40 HG3 GLN 40 -4.548 2.695 -15.721 358 1HE2 GLN 40 1HE2 GLN 40 -3.629 1.627 -12.434 359 2HE2 GLN 40 2HE2 GLN 40 -4.625 2.830 -11.611 360 H ALA 41 H ALA 41 -2.094 1.242 -16.893 361 HA ALA 41 HA ALA 41 -3.126 2.314 -19.339 362 1HB ALA 41 HB1 ALA 41 -0.247 1.822 -18.453 363 2HB ALA 41 HB2 ALA 41 -0.760 2.864 -19.789 364 3HB ALA 41 HB3 ALA 41 -1.201 3.282 -18.121 365 H ALA 42 H ALA 42 -0.905 -0.531 -18.821 366 HA ALA 42 HA ALA 42 -0.898 -1.374 -21.523 367 1HB ALA 42 HB1 ALA 42 0.656 -2.207 -19.762 368 2HB ALA 42 HB2 ALA 42 -0.691 -3.068 -18.990 369 3HB ALA 42 HB3 ALA 42 -0.152 -3.535 -20.616 370 H GLN 43 H GLN 43 -3.325 -2.020 -18.966 371 HA GLN 43 HA GLN 43 -4.754 -3.978 -20.528 372 1HB GLN 43 HB2 GLN 43 -5.591 -2.356 -18.108 373 2HB GLN 43 HB3 GLN 43 -6.568 -3.622 -18.847 374 1HG GLN 43 HG2 GLN 43 -3.840 -3.997 -17.545 375 2HG GLN 43 HG3 GLN 43 -5.389 -4.515 -16.911 376 1HE2 GLN 43 1HE2 GLN 43 -2.700 -5.854 -18.068 377 2HE2 GLN 43 2HE2 GLN 43 -3.396 -7.199 -18.951 378 H LYS 44 H LYS 44 -4.731 -0.471 -20.529 379 HA LYS 44 HA LYS 44 -7.229 -0.269 -22.100 380 1HB LYS 44 HB2 LYS 44 -6.434 1.484 -20.472 381 2HB LYS 44 HB3 LYS 44 -5.072 1.819 -21.548 382 1HG LYS 44 HG2 LYS 44 -6.741 2.347 -23.383 383 2HG LYS 44 HG3 LYS 44 -8.036 2.134 -22.198 384 1HD LYS 44 HD2 LYS 44 -5.808 4.216 -22.142 385 2HD LYS 44 HD3 LYS 44 -7.520 4.496 -22.490 386 1HE LYS 44 HE2 LYS 44 -8.055 3.669 -20.152 387 2HE LYS 44 HE3 LYS 44 -6.317 3.585 -19.837 388 1HZ LYS 44 HZ1 LYS 44 -6.201 5.989 -20.359 389 2HZ LYS 44 HZ2 LYS 44 -7.826 6.050 -20.549 390 3HZ LYS 44 HZ3 LYS 44 -7.189 5.710 -19.082 391 H LEU 45 H LEU 45 -3.709 0.179 -22.677 392 HA LEU 45 HA LEU 45 -4.034 0.076 -25.516 393 1HB LEU 45 HB2 LEU 45 -1.596 -0.155 -23.713 394 2HB LEU 45 HB3 LEU 45 -1.500 -0.193 -25.455 395 HG LEU 45 HG LEU 45 -0.873 1.951 -24.914 396 1HD1 LEU 45 1HD1 LEU 45 -3.817 2.255 -25.627 397 2HD1 LEU 45 2HD1 LEU 45 -2.530 3.424 -25.919 398 3HD1 LEU 45 3HD1 LEU 45 -2.511 1.870 -26.777 399 1HD2 LEU 45 1HD2 LEU 45 -2.079 3.565 -23.557 400 2HD2 LEU 45 2HD2 LEU 45 -3.318 2.364 -23.166 401 3HD2 LEU 45 3HD2 LEU 45 -1.639 2.144 -22.611 402 H GLY 46 H GLY 46 -5.025 -2.419 -23.841 403 1HA GLY 46 HA2 GLY 46 -5.740 -4.296 -25.041 404 2HA GLY 46 HA3 GLY 46 -4.397 -4.175 -26.147 405 H GLY 47 H GLY 47 -4.021 -4.305 -22.644 406 1HA GLY 47 HA2 GLY 47 -2.820 -5.682 -21.285 407 2HA GLY 47 HA3 GLY 47 -3.393 -7.036 -22.259 408 H TYR 48 H TYR 48 -0.920 -7.183 -21.116 409 HA TYR 48 HA TYR 48 1.281 -6.565 -22.661 410 1HB TYR 48 HB2 TYR 48 1.134 -7.826 -20.486 411 2HB TYR 48 HB3 TYR 48 0.783 -9.278 -21.409 412 HD1 TYR 48 HD1 TYR 48 3.316 -6.613 -20.778 413 HD2 TYR 48 HD2 TYR 48 2.578 -10.498 -22.500 414 HE1 TYR 48 HE1 TYR 48 5.772 -6.996 -20.960 415 HE2 TYR 48 HE2 TYR 48 5.036 -10.862 -22.719 416 HH TYR 48 HH TYR 48 7.425 -8.449 -21.592 417 H GLU 49 H GLU 49 -1.347 -8.688 -23.701 418 HA GLU 49 HA GLU 49 0.266 -10.162 -25.629 419 1HB GLU 49 HB2 GLU 49 -2.710 -9.898 -25.109 420 2HB GLU 49 HB3 GLU 49 -2.062 -10.845 -26.461 421 1HG GLU 49 HG2 GLU 49 -0.799 -12.281 -24.983 422 2HG GLU 49 HG3 GLU 49 -1.165 -11.274 -23.584 423 H THR 50 H THR 50 -2.127 -7.446 -26.040 424 HA THR 50 HA THR 50 -1.515 -7.117 -28.842 425 HB THR 50 H5T THR 50 -2.518 -5.019 -26.896 426 HG1 THR 50 HG1 THR 50 -3.991 -6.623 -26.951 427 1HG2 THR 50 1HG2 THR 50 -2.635 -5.170 -29.940 428 2HG2 THR 50 2HG2 THR 50 -3.514 -3.990 -28.939 429 3HG2 THR 50 3HG2 THR 50 -1.749 -3.970 -28.969 430 H ILE 51 H ILE 51 -0.112 -5.821 -25.807 431 HA ILE 51 HA ILE 51 1.753 -4.050 -26.997 432 HB ILE 51 H5T ILE 51 1.291 -5.345 -24.396 433 1HG1 ILE 51 2HG1 ILE 51 2.159 -3.122 -23.575 434 2HG1 ILE 51 3HG1 ILE 51 2.365 -2.648 -25.257 435 1HG2 ILE 51 1HG2 ILE 51 3.488 -4.962 -23.414 436 2HG2 ILE 51 2HG2 ILE 51 3.481 -6.293 -24.547 437 3HG2 ILE 51 3HG2 ILE 51 4.159 -4.719 -25.056 438 1HD1 ILE 51 1HD1 ILE 51 -0.224 -3.352 -23.797 439 2HD1 ILE 51 2HD1 ILE 51 0.239 -1.789 -24.485 440 3HD1 ILE 51 3HD1 ILE 51 -0.152 -3.138 -25.559 441 H THR 52 H THR 52 2.186 -7.575 -26.337 442 HA THR 52 HA THR 52 4.811 -7.611 -27.516 443 HB THR 52 H5T THR 52 2.838 -9.875 -27.000 444 HG1 THR 52 HG1 THR 52 3.362 -9.081 -25.099 445 1HG2 THR 52 1HG2 THR 52 4.554 -10.709 -28.521 446 2HG2 THR 52 2HG2 THR 52 5.837 -9.915 -27.583 447 3HG2 THR 52 3HG2 THR 52 4.921 -11.275 -26.888 448 H ALA 53 H ALA 53 1.563 -8.201 -28.905 449 HA ALA 53 HA ALA 53 2.558 -9.057 -31.471 450 1HB ALA 53 HB1 ALA 53 0.223 -8.703 -32.166 451 2HB ALA 53 HB2 ALA 53 0.296 -9.556 -30.613 452 3HB ALA 53 HB3 ALA 53 -0.110 -7.825 -30.659 453 H ARG 54 H ARG 54 2.233 -5.808 -30.048 454 HA ARG 54 HA ARG 54 2.674 -4.616 -32.797 455 1HB ARG 54 HB2 ARG 54 0.910 -3.619 -30.531 456 2HB ARG 54 HB3 ARG 54 1.162 -2.783 -32.046 457 1HG ARG 54 HG2 ARG 54 -0.204 -5.490 -31.749 458 2HG ARG 54 HG3 ARG 54 -1.006 -3.944 -31.945 459 1HD ARG 54 HD2 ARG 54 0.827 -5.259 -33.993 460 2HD ARG 54 HD3 ARG 54 -0.924 -5.213 -34.065 461 HE ARG 54 H3T ARG 54 0.947 -3.079 -34.756 462 1HH1 ARG 54 2HH2 ARG 54 -2.405 -3.635 -33.881 463 2HH1 ARG 54 1HH2 ARG 54 -2.927 -2.130 -34.588 464 1HH2 ARG 54 2HH1 ARG 54 0.209 -1.183 -35.626 465 2HH2 ARG 54 1HH1 ARG 54 -1.481 -0.787 -35.551 466 H ARG 55 H ARG 55 4.086 -4.722 -29.726 467 HA ARG 55 HA ARG 55 5.484 -3.362 -28.491 468 1HB ARG 55 HB2 ARG 55 6.423 -2.109 -31.091 469 2HB ARG 55 HB3 ARG 55 7.312 -2.303 -29.582 470 1HG ARG 55 HG2 ARG 55 6.497 -4.480 -31.548 471 2HG ARG 55 HG3 ARG 55 8.116 -3.875 -31.275 472 1HD ARG 55 HD2 ARG 55 8.468 -5.194 -29.443 473 2HD ARG 55 HD3 ARG 55 6.855 -4.950 -28.809 474 HE ARG 55 H3T ARG 55 6.056 -6.825 -29.903 475 1HH1 ARG 55 2HH2 ARG 55 9.281 -6.261 -31.174 476 2HH1 ARG 55 1HH2 ARG 55 9.298 -7.800 -31.992 477 1HH2 ARG 55 2HH1 ARG 55 6.131 -8.677 -30.924 478 2HH2 ARG 55 1HH1 ARG 55 7.538 -9.161 -31.854 479 H GLN 56 H GLN 56 3.284 -2.738 -27.937 480 HA GLN 56 HA GLN 56 2.472 -0.071 -28.902 481 1HB GLN 56 HB2 GLN 56 0.970 -2.296 -28.405 482 2HB GLN 56 HB3 GLN 56 0.858 -1.486 -26.850 483 1HG GLN 56 HG2 GLN 56 -0.980 -0.627 -27.939 484 2HG GLN 56 HG3 GLN 56 0.195 0.638 -28.259 485 1HE2 GLN 56 1HE2 GLN 56 0.605 1.119 -30.554 486 2HE2 GLN 56 2HE2 GLN 56 -0.037 0.080 -31.806 487 H TRP 57 H TRP 57 4.578 -1.069 -26.495 488 HA TRP 57 HA TRP 57 3.924 0.473 -24.234 489 1HB TRP 57 HB2 TRP 57 6.666 -0.170 -25.366 490 2HB TRP 57 HB3 TRP 57 6.377 0.651 -23.876 491 HD1 TRP 57 HD1 TRP 57 6.304 -2.794 -25.361 492 HE1 TRP 57 HE1 TRP 57 5.775 -4.510 -23.534 493 HE3 TRP 57 HE3 TRP 57 5.139 0.398 -21.532 494 HZ2 TRP 57 HZ2 TRP 57 4.960 -4.512 -20.752 495 HZ3 TRP 57 HZ3 TRP 57 4.504 -0.476 -19.312 496 HH2 TRP 57 HH2 TRP 57 4.401 -2.911 -18.918 497 H LYS 58 H LYS 58 5.232 1.623 -27.342 498 HA LYS 58 HA LYS 58 5.803 4.310 -26.465 499 1HB LYS 58 HB2 LYS 58 4.835 3.365 -29.197 500 2HB LYS 58 HB3 LYS 58 5.544 4.940 -28.850 501 1HG LYS 58 HG2 LYS 58 6.968 2.253 -28.611 502 2HG LYS 58 HG3 LYS 58 7.160 3.437 -29.900 503 1HD LYS 58 HD2 LYS 58 8.055 5.086 -28.239 504 2HD LYS 58 HD3 LYS 58 7.952 3.835 -26.975 505 1HE LYS 58 HE2 LYS 58 9.459 2.374 -28.266 506 2HE LYS 58 HE3 LYS 58 9.538 3.572 -29.566 507 1HZ LYS 58 HZ1 LYS 58 11.460 3.748 -28.123 508 2HZ LYS 58 HZ2 LYS 58 10.589 5.118 -27.951 509 3HZ LYS 58 HZ3 LYS 58 10.554 3.977 -26.793 510 H HIS 59 H HIS 59 2.658 2.805 -27.044 511 HA HIS 59 HA HIS 59 1.314 5.415 -26.618 512 1HB HIS 59 HB2 HIS 59 0.126 2.648 -26.967 513 2HB HIS 59 HB3 HIS 59 -0.708 4.197 -27.050 514 HD1 HIS 59 HD1 HIS 59 -1.087 5.037 -29.471 515 HD2 HIS 59 HD2 HIS 59 2.115 2.340 -29.057 516 HE1 HIS 59 HE1 HIS 59 -0.268 4.524 -31.829 517 H ILE 60 H ILE 60 2.417 2.706 -24.681 518 HA ILE 60 HA ILE 60 0.603 3.249 -22.420 519 HB ILE 60 H5T ILE 60 3.211 1.708 -22.621 520 1HG1 ILE 60 2HG1 ILE 60 0.356 0.872 -21.914 521 2HG1 ILE 60 3HG1 ILE 60 1.046 0.729 -23.531 522 1HG2 ILE 60 1HG2 ILE 60 3.244 2.782 -20.434 523 2HG2 ILE 60 2HG2 ILE 60 1.558 2.313 -20.135 524 3HG2 ILE 60 3HG2 ILE 60 2.841 1.096 -20.212 525 1HD1 ILE 60 1HD1 ILE 60 2.736 -0.847 -22.723 526 2HD1 ILE 60 2HD1 ILE 60 2.073 -0.742 -21.070 527 3HD1 ILE 60 3HD1 ILE 60 1.102 -1.411 -22.368 528 H TYR 61 H TYR 61 3.910 4.220 -23.490 529 HA TYR 61 HA TYR 61 4.426 6.185 -21.542 530 1HB TYR 61 HB2 TYR 61 6.095 5.499 -23.122 531 2HB TYR 61 HB3 TYR 61 5.108 5.974 -24.481 532 HD1 TYR 61 HD1 TYR 61 7.133 7.289 -21.626 533 HD2 TYR 61 HD2 TYR 61 5.180 8.171 -25.374 534 HE1 TYR 61 HE1 TYR 61 8.325 9.478 -21.734 535 HE2 TYR 61 HE2 TYR 61 6.373 10.358 -25.475 536 HH TYR 61 HH TYR 61 8.622 11.433 -22.913 537 H ASP 62 H ASP 62 2.191 6.284 -24.269 538 HA ASP 62 HA ASP 62 1.617 9.090 -24.084 539 1HB ASP 62 HB2 ASP 62 1.167 7.757 -26.125 540 2HB ASP 62 HB3 ASP 62 -0.214 7.034 -25.296 541 H GLU 63 H GLU 63 -0.268 6.224 -22.880 542 HA GLU 63 HA GLU 63 -1.973 7.740 -21.213 543 1HB GLU 63 HB2 GLU 63 -2.308 5.392 -21.846 544 2HB GLU 63 HB3 GLU 63 -0.927 4.913 -20.868 545 1HG GLU 63 HG2 GLU 63 -3.032 4.427 -19.743 546 2HG GLU 63 HG3 GLU 63 -2.073 5.567 -18.813 547 H LEU 64 H LEU 64 1.332 6.571 -20.429 548 HA LEU 64 HA LEU 64 1.350 7.373 -17.662 549 1HB LEU 64 HB2 LEU 64 3.662 7.233 -19.656 550 2HB LEU 64 HB3 LEU 64 3.839 7.431 -17.926 551 HG LEU 64 HG LEU 64 2.766 4.983 -19.328 552 1HD1 LEU 64 1HD1 LEU 64 4.824 3.918 -18.484 553 2HD1 LEU 64 2HD1 LEU 64 5.166 5.252 -19.591 554 3HD1 LEU 64 3HD1 LEU 64 5.361 5.488 -17.847 555 1HD2 LEU 64 1HD2 LEU 64 1.646 5.163 -17.169 556 2HD2 LEU 64 2HD2 LEU 64 2.873 3.896 -17.086 557 3HD2 LEU 64 3HD2 LEU 64 3.197 5.487 -16.357 558 H GLY 65 H GLY 65 1.570 9.257 -20.628 559 1HA GLY 65 HA2 GLY 65 2.062 11.457 -21.045 560 2HA GLY 65 HA3 GLY 65 1.559 11.823 -19.385 561 H GLY 66 H GLY 66 4.281 9.694 -20.421 562 1HA GLY 66 HA2 GLY 66 5.909 10.591 -18.330 563 2HA GLY 66 HA3 GLY 66 6.454 9.641 -19.704 564 H ASN 67 H ASN 67 8.200 11.127 -18.548 565 HA ASN 67 HA ASN 67 8.558 13.809 -18.992 566 1HB ASN 67 HB2 ASN 67 9.901 12.415 -17.524 567 2HB ASN 67 HB3 ASN 67 10.547 11.519 -18.896 568 1HD2 ASN 67 2HD2 ASN 67 12.552 12.156 -19.558 569 2HD2 ASN 67 1HD2 ASN 67 13.223 13.768 -19.287 570 HA PRO 68 HA PRO 68 9.287 14.133 -23.458 571 1HB PRO 68 HB2 PRO 68 9.855 16.787 -23.678 572 2HB PRO 68 HB3 PRO 68 8.234 16.170 -23.259 573 1HG PRO 68 HG2 PRO 68 10.387 17.121 -21.340 574 2HG PRO 68 HG3 PRO 68 8.670 17.635 -21.415 575 1HD PRO 68 HD2 PRO 68 9.502 15.710 -19.700 576 2HD PRO 68 HD3 PRO 68 7.920 15.587 -20.518 577 H GLY 69 H GLY 69 11.104 12.616 -22.876 578 1HA GLY 69 HA2 GLY 69 13.396 13.035 -24.274 579 2HA GLY 69 HA3 GLY 69 13.829 13.718 -22.688 580 H SER 70 H SER 70 11.626 10.970 -23.144 581 HA SER 70 HA SER 70 13.624 9.045 -22.014 582 1HB SER 70 HB2 SER 70 10.963 9.772 -20.727 583 2HB SER 70 HB3 SER 70 12.020 8.433 -20.238 584 HG SER 70 HG SER 70 13.640 9.934 -19.738 585 H THR 71 H THR 71 12.820 9.033 -24.619 586 HA THR 71 HA THR 71 10.587 7.340 -25.200 587 HB THR 71 H5T THR 71 11.878 8.736 -26.811 588 HG1 THR 71 HG1 THR 71 11.479 7.362 -28.469 589 1HG2 THR 71 1HG2 THR 71 13.820 7.827 -27.946 590 2HG2 THR 71 2HG2 THR 71 14.193 7.997 -26.226 591 3HG2 THR 71 3HG2 THR 71 13.831 6.393 -26.903 592 H SER 72 H SER 72 13.645 6.564 -23.754 593 HA SER 72 HA SER 72 13.641 3.697 -24.109 594 1HB SER 72 HB2 SER 72 15.170 3.820 -22.101 595 2HB SER 72 HB3 SER 72 15.671 4.809 -23.485 596 HG SER 72 HG SER 72 15.789 5.962 -21.487 597 H ALA 73 H ALA 73 12.012 5.911 -21.791 598 HA ALA 73 HA ALA 73 11.085 3.873 -20.030 599 1HB ALA 73 HB1 ALA 73 9.470 5.498 -19.261 600 2HB ALA 73 HB2 ALA 73 11.004 6.343 -19.560 601 3HB ALA 73 HB3 ALA 73 9.660 6.473 -20.723 602 H ALA 74 H ALA 74 8.844 3.043 -19.881 603 HA ALA 74 HA ALA 74 7.256 1.666 -20.664 604 1HB ALA 74 HB1 ALA 74 7.097 3.237 -23.217 605 2HB ALA 74 HB2 ALA 74 5.860 2.256 -22.412 606 3HB ALA 74 HB3 ALA 74 6.385 3.752 -21.664 607 H THR 75 H THR 75 9.777 2.230 -23.208 608 HA THR 75 HA THR 75 9.581 -0.478 -24.224 609 HB THR 75 H5T THR 75 11.815 1.602 -24.417 610 HG1 THR 75 HG1 THR 75 9.698 2.118 -25.281 611 1HG2 THR 75 1HG2 THR 75 12.452 0.393 -26.504 612 2HG2 THR 75 2HG2 THR 75 12.705 -0.600 -25.064 613 3HG2 THR 75 3HG2 THR 75 11.289 -0.890 -26.102 614 H CYS 76 H CYS 76 11.943 1.024 -21.918 615 HA CYS 76 HA CYS 76 13.133 -1.557 -21.229 616 1HB CYS 76 HB2 CYS 76 13.103 1.115 -19.738 617 2HB CYS 76 HB3 CYS 76 14.110 -0.288 -19.335 618 HG CYS 76 HG CYS 76 14.028 1.512 -22.113 619 H THR 77 H THR 77 10.440 0.406 -19.934 620 HA THR 77 HA THR 77 9.793 -1.052 -17.667 621 HB THR 77 H5T THR 77 7.768 -0.025 -19.649 622 HG1 THR 77 HG1 THR 77 9.315 1.362 -17.709 623 1HG2 THR 77 1HG2 THR 77 7.656 -0.231 -16.644 624 2HG2 THR 77 2HG2 THR 77 6.479 0.626 -17.686 625 3HG2 THR 77 3HG2 THR 77 6.677 -1.118 -17.843 626 H ARG 78 H ARG 78 9.198 -2.174 -21.055 627 HA ARG 78 HA ARG 78 7.518 -4.341 -20.502 628 1HB ARG 78 HB2 ARG 78 8.361 -3.614 -22.783 629 2HB ARG 78 HB3 ARG 78 9.937 -4.291 -22.386 630 1HG ARG 78 HG2 ARG 78 8.946 -6.549 -22.162 631 2HG ARG 78 HG3 ARG 78 7.344 -5.894 -22.530 632 1HD ARG 78 HD2 ARG 78 8.108 -5.286 -24.801 633 2HD ARG 78 HD3 ARG 78 9.750 -5.783 -24.397 634 HE ARG 78 H3T ARG 78 9.172 -8.040 -24.528 635 1HH1 ARG 78 2HH2 ARG 78 6.245 -6.193 -25.146 636 2HH1 ARG 78 1HH2 ARG 78 5.296 -7.675 -25.272 637 1HH2 ARG 78 2HH1 ARG 78 7.834 -9.824 -24.879 638 2HH2 ARG 78 1HH1 ARG 78 6.145 -9.537 -25.249 639 H ARG 79 H ARG 79 11.012 -4.037 -19.868 640 HA ARG 79 HA ARG 79 11.220 -6.828 -19.315 641 1HB ARG 79 HB2 ARG 79 13.211 -4.594 -18.704 642 2HB ARG 79 HB3 ARG 79 13.555 -6.324 -18.619 643 1HG ARG 79 HG2 ARG 79 13.021 -6.514 -21.081 644 2HG ARG 79 HG3 ARG 79 12.802 -4.759 -21.131 645 1HD ARG 79 HD2 ARG 79 14.997 -5.203 -21.926 646 2HD ARG 79 HD3 ARG 79 15.155 -4.475 -20.318 647 HE ARG 79 H3T ARG 79 15.114 -7.351 -20.122 648 1HH1 ARG 79 2HH2 ARG 79 17.304 -4.811 -21.136 649 2HH1 ARG 79 1HH2 ARG 79 18.718 -5.774 -20.805 650 1HH2 ARG 79 2HH1 ARG 79 16.959 -8.520 -19.711 651 2HH2 ARG 79 1HH1 ARG 79 18.519 -7.819 -20.022 652 H HIS 80 H HIS 80 10.478 -4.051 -17.400 653 HA HIS 80 HA HIS 80 10.725 -5.386 -14.786 654 1HB HIS 80 HB2 HIS 80 9.270 -2.836 -15.560 655 2HB HIS 80 HB3 HIS 80 9.648 -3.391 -13.931 656 HD1 HIS 80 HD1 HIS 80 10.801 -0.620 -15.388 657 HD2 HIS 80 HD2 HIS 80 12.790 -4.242 -14.569 658 HE1 HIS 80 HE1 HIS 80 13.271 -0.090 -15.388 659 H TYR 81 H TYR 81 7.972 -4.483 -16.983 660 HA TYR 81 HA TYR 81 5.901 -5.561 -15.424 661 1HB TYR 81 HB2 TYR 81 5.741 -4.090 -17.435 662 2HB TYR 81 HB3 TYR 81 6.079 -5.474 -18.457 663 HD1 TYR 81 HD1 TYR 81 4.397 -7.537 -18.233 664 HD2 TYR 81 HD2 TYR 81 3.510 -3.515 -16.941 665 HE1 TYR 81 HE1 TYR 81 1.970 -8.036 -18.337 666 HE2 TYR 81 HE2 TYR 81 1.087 -3.974 -17.227 667 HH TYR 81 HH TYR 81 -0.159 -7.246 -17.968 668 H GLU 82 H GLU 82 8.093 -7.331 -17.661 669 HA GLU 82 HA GLU 82 6.454 -9.682 -17.718 670 1HB GLU 82 HB2 GLU 82 8.086 -10.697 -19.037 671 2HB GLU 82 HB3 GLU 82 7.955 -9.022 -19.563 672 1HG GLU 82 HG2 GLU 82 10.017 -8.450 -18.469 673 2HG GLU 82 HG3 GLU 82 10.097 -10.010 -17.664 674 H ARG 83 H ARG 83 8.409 -8.427 -15.254 675 HA ARG 83 HA ARG 83 8.220 -11.079 -13.947 676 1HB ARG 83 HB2 ARG 83 10.387 -8.976 -13.520 677 2HB ARG 83 HB3 ARG 83 10.217 -10.428 -12.540 678 1HG ARG 83 HG2 ARG 83 10.844 -10.387 -15.514 679 2HG ARG 83 HG3 ARG 83 12.003 -10.630 -14.213 680 1HD ARG 83 HD2 ARG 83 10.888 -12.697 -13.520 681 2HD ARG 83 HD3 ARG 83 9.642 -12.492 -14.747 682 HE ARG 83 H3T ARG 83 12.418 -13.373 -15.156 683 1HH1 ARG 83 2HH2 ARG 83 9.499 -12.297 -16.814 684 2HH1 ARG 83 1HH2 ARG 83 10.292 -12.423 -18.376 685 1HH2 ARG 83 2HH1 ARG 83 13.185 -13.784 -17.227 686 2HH2 ARG 83 1HH1 ARG 83 12.151 -13.458 -18.595 687 H LEU 84 H LEU 84 7.023 -7.941 -13.885 688 HA LEU 84 HA LEU 84 6.675 -7.991 -10.921 689 1HB LEU 84 HB2 LEU 84 8.084 -6.244 -12.028 690 2HB LEU 84 HB3 LEU 84 6.657 -5.709 -12.926 691 HG LEU 84 HG LEU 84 5.581 -5.034 -10.819 692 1HD1 LEU 84 1HD1 LEU 84 6.926 -4.925 -8.746 693 2HD1 LEU 84 2HD1 LEU 84 6.601 -6.595 -9.213 694 3HD1 LEU 84 3HD1 LEU 84 8.200 -5.891 -9.527 695 1HD2 LEU 84 1HD2 LEU 84 8.394 -3.922 -11.026 696 2HD2 LEU 84 2HD2 LEU 84 7.067 -3.492 -12.124 697 3HD2 LEU 84 3HD2 LEU 84 6.939 -3.119 -10.399 698 H ILE 85 H ILE 85 4.851 -8.411 -13.808 699 HA ILE 85 HA ILE 85 2.572 -8.844 -12.145 700 HB ILE 85 H5T ILE 85 2.339 -6.418 -12.404 701 1HG1 ILE 85 2HG1 ILE 85 0.048 -7.754 -13.877 702 2HG1 ILE 85 3HG1 ILE 85 0.398 -8.181 -12.201 703 1HG2 ILE 85 1HG2 ILE 85 3.265 -6.158 -14.683 704 2HG2 ILE 85 2HG2 ILE 85 1.818 -6.953 -15.335 705 3HG2 ILE 85 3HG2 ILE 85 1.685 -5.390 -14.509 706 1HD1 ILE 85 1HD1 ILE 85 -0.091 -6.006 -11.409 707 2HD1 ILE 85 2HD1 ILE 85 -0.077 -5.317 -13.035 708 3HD1 ILE 85 3HD1 ILE 85 -1.381 -6.422 -12.543 709 H LEU 86 H LEU 86 4.010 -8.999 -15.390 710 HA LEU 86 HA LEU 86 2.110 -10.582 -16.662 711 1HB LEU 86 HB2 LEU 86 4.205 -9.850 -17.644 712 2HB LEU 86 HB3 LEU 86 5.114 -10.915 -16.559 713 HG LEU 86 HG LEU 86 4.225 -12.887 -17.655 714 1HD1 LEU 86 1HD1 LEU 86 1.980 -12.088 -18.367 715 2HD1 LEU 86 2HD1 LEU 86 2.739 -10.925 -19.477 716 3HD1 LEU 86 3HD1 LEU 86 2.883 -12.673 -19.765 717 1HD2 LEU 86 1HD2 LEU 86 6.239 -11.976 -18.562 718 2HD2 LEU 86 2HD2 LEU 86 5.251 -12.603 -19.882 719 3HD2 LEU 86 3HD2 LEU 86 5.327 -10.851 -19.605 720 HA PRO 87 HA PRO 87 3.177 -14.474 -14.100 721 1HB PRO 87 HB2 PRO 87 4.376 -14.284 -11.640 722 2HB PRO 87 HB3 PRO 87 5.272 -14.480 -13.175 723 1HG PRO 87 HG2 PRO 87 4.679 -11.899 -11.687 724 2HG PRO 87 HG3 PRO 87 6.260 -12.483 -12.308 725 1HD PRO 87 HD2 PRO 87 4.796 -10.744 -13.712 726 2HD PRO 87 HD3 PRO 87 5.632 -12.072 -14.554 727 H TYR 88 H TYR 88 1.855 -11.494 -12.733 728 HA TYR 88 HA TYR 88 0.152 -13.134 -10.897 729 1HB TYR 88 HB2 TYR 88 1.532 -10.583 -10.501 730 2HB TYR 88 HB3 TYR 88 -0.170 -10.526 -10.094 731 HD1 TYR 88 HD1 TYR 88 2.153 -13.495 -9.706 732 HD2 TYR 88 HD2 TYR 88 -0.118 -10.401 -7.732 733 HE1 TYR 88 HE1 TYR 88 2.579 -14.572 -7.513 734 HE2 TYR 88 HE2 TYR 88 0.296 -11.490 -5.550 735 HH TYR 88 HH TYR 88 1.276 -13.258 -4.448 736 H GLU 89 H GLU 89 -0.177 -10.735 -13.577 737 HA GLU 89 HA GLU 89 -3.012 -10.678 -13.468 738 1HB GLU 89 HB2 GLU 89 -3.027 -10.086 -15.777 739 2HB GLU 89 HB3 GLU 89 -1.682 -9.258 -15.002 740 1HG GLU 89 HG2 GLU 89 -0.078 -10.757 -16.035 741 2HG GLU 89 HG3 GLU 89 -1.346 -11.836 -16.600 742 H ARG 90 H ARG 90 -0.980 -13.350 -13.930 743 HA ARG 90 HA ARG 90 -2.574 -15.158 -15.441 744 1HB ARG 90 HB2 ARG 90 -0.212 -15.455 -14.627 745 2HB ARG 90 HB3 ARG 90 -0.843 -15.748 -13.001 746 1HG ARG 90 HG2 ARG 90 -2.038 -17.750 -13.798 747 2HG ARG 90 HG3 ARG 90 -1.562 -17.391 -15.474 748 1HD ARG 90 HD2 ARG 90 0.822 -17.624 -14.837 749 2HD ARG 90 HD3 ARG 90 0.340 -18.025 -13.176 750 HE ARG 90 H3T ARG 90 -1.037 -19.835 -14.799 751 1HH1 ARG 90 2HH1 ARG 90 2.356 -19.167 -14.232 752 2HH1 ARG 90 1HH1 ARG 90 2.837 -20.792 -14.640 753 1HH2 ARG 90 2HH2 ARG 90 -0.355 -21.890 -15.298 754 2HH2 ARG 90 1HH2 ARG 90 1.336 -22.289 -15.219 755 H PHE 91 H PHE 91 -3.052 -14.066 -12.027 756 HA PHE 91 HA PHE 91 -5.251 -15.999 -11.691 757 1HB PHE 91 HB2 PHE 91 -5.704 -15.050 -9.591 758 2HB PHE 91 HB3 PHE 91 -3.980 -15.282 -9.741 759 HD1 PHE 91 HD1 PHE 91 -6.655 -12.604 -9.988 760 HD2 PHE 91 HD2 PHE 91 -2.533 -13.526 -9.081 761 HE1 PHE 91 HE1 PHE 91 -6.263 -10.255 -9.335 762 HE2 PHE 91 HE2 PHE 91 -2.165 -11.174 -8.437 763 HZ PHE 91 HZ PHE 91 -3.991 -9.523 -8.648 764 H ILE 92 H ILE 92 -4.980 -12.740 -13.032 765 HA ILE 92 HA ILE 92 -7.858 -12.158 -12.788 766 HB ILE 92 H5T ILE 92 -5.742 -10.838 -14.545 767 1HG1 ILE 92 2HG1 ILE 92 -6.698 -10.018 -11.767 768 2HG1 ILE 92 3HG1 ILE 92 -5.127 -10.736 -12.128 769 1HG2 ILE 92 1HG2 ILE 92 -7.319 -8.942 -14.627 770 2HG2 ILE 92 2HG2 ILE 92 -8.086 -10.386 -15.254 771 3HG2 ILE 92 3HG2 ILE 92 -8.470 -9.836 -13.610 772 1HD1 ILE 92 1HD1 ILE 92 -6.069 -7.996 -13.004 773 2HD1 ILE 92 2HD1 ILE 92 -4.787 -8.407 -11.860 774 3HD1 ILE 92 3HD1 ILE 92 -4.577 -8.785 -13.580 775 H LYS 93 H LYS 93 -5.596 -13.408 -15.233 776 HA LYS 93 HA LYS 93 -7.732 -13.530 -17.275 777 1HB LYS 93 HB2 LYS 93 -5.342 -12.606 -17.470 778 2HB LYS 93 HB3 LYS 93 -4.792 -14.283 -17.488 779 1HG LYS 93 HG2 LYS 93 -5.907 -14.690 -19.597 780 2HG LYS 93 HG3 LYS 93 -6.893 -13.223 -19.431 781 1HD LYS 93 HD2 LYS 93 -5.141 -12.808 -21.044 782 2HD LYS 93 HD3 LYS 93 -4.878 -11.816 -19.603 783 1HE LYS 93 HE2 LYS 93 -3.210 -13.544 -18.793 784 2HE LYS 93 HE3 LYS 93 -3.436 -14.407 -20.325 785 1HZ LYS 93 HZ1 LYS 93 -2.738 -12.323 -21.443 786 2HZ LYS 93 HZ2 LYS 93 -2.354 -11.665 -19.958 787 3HZ LYS 93 HZ3 LYS 93 -1.542 -12.970 -20.518 788 H GLY 94 H GLY 94 -6.707 -15.583 -14.846 789 1HA GLY 94 HA2 GLY 94 -7.464 -18.049 -16.391 790 2HA GLY 94 HA3 GLY 94 -6.299 -18.005 -15.072 791 H GLU 95 H GLU 95 -8.212 -16.039 -13.564 792 HA GLU 95 HA GLU 95 -10.385 -17.922 -12.838 793 1HB GLU 95 HB2 GLU 95 -8.382 -16.756 -10.843 794 2HB GLU 95 HB3 GLU 95 -9.792 -17.737 -10.439 795 1HG GLU 95 HG2 GLU 95 -8.816 -19.642 -11.722 796 2HG GLU 95 HG3 GLU 95 -7.348 -18.687 -11.971 797 H GLU 96 H GLU 96 -10.369 -15.274 -14.138 798 HA GLU 96 HA GLU 96 -12.662 -14.284 -12.667 799 1HB GLU 96 HB2 GLU 96 -10.745 -13.092 -11.549 800 2HB GLU 96 HB3 GLU 96 -10.386 -12.301 -13.086 801 1HG GLU 96 HG2 GLU 96 -12.602 -11.232 -13.085 802 2HG GLU 96 HG3 GLU 96 -13.064 -12.130 -11.637 803 H ASP 97 H ASP 97 -10.470 -13.403 -15.436 804 HA ASP 97 HA ASP 97 -12.547 -12.037 -16.862 805 1HB ASP 97 HB2 ASP 97 -10.075 -11.749 -17.126 806 2HB ASP 97 HB3 ASP 97 -10.003 -13.327 -17.915 807 H LYS 98 H LYS 98 -12.026 -15.442 -16.512 808 HA LYS 98 HA LYS 98 -12.989 -16.376 -19.025 809 1HB LYS 98 HB2 LYS 98 -12.974 -17.624 -16.248 810 2HB LYS 98 HB3 LYS 98 -13.554 -18.477 -17.685 811 1HG LYS 98 HG2 LYS 98 -11.384 -18.252 -18.785 812 2HG LYS 98 HG3 LYS 98 -10.742 -17.343 -17.400 813 1HD LYS 98 HD2 LYS 98 -11.091 -19.262 -15.924 814 2HD LYS 98 HD3 LYS 98 -11.825 -20.198 -17.242 815 1HE LYS 98 HE2 LYS 98 -9.770 -20.288 -18.476 816 2HE LYS 98 HE3 LYS 98 -9.021 -19.050 -17.462 817 1HZ LYS 98 HZ1 LYS 98 -9.058 -20.573 -15.604 818 2HZ LYS 98 HZ2 LYS 98 -9.790 -21.750 -16.492 819 3HZ LYS 98 HZ3 LYS 98 -8.265 -21.285 -16.851 820 HA PRO 99 HA PRO 99 -17.409 -15.664 -18.555 821 1HB PRO 99 HB2 PRO 99 -18.419 -17.285 -20.508 822 2HB PRO 99 HB3 PRO 99 -17.458 -15.820 -20.868 823 1HG PRO 99 HG2 PRO 99 -16.494 -18.693 -20.757 824 2HG PRO 99 HG3 PRO 99 -16.208 -17.480 -22.041 825 1HD PRO 99 HD2 PRO 99 -14.393 -17.983 -20.052 826 2HD PRO 99 HD3 PRO 99 -14.607 -16.351 -20.753 827 H LEU 100 H LEU 100 -15.864 -18.369 -17.376 828 HA LEU 100 HA LEU 100 -18.141 -19.275 -15.902 829 1HB LEU 100 HB2 LEU 100 -18.052 -21.692 -16.745 830 2HB LEU 100 HB3 LEU 100 -18.886 -20.507 -17.718 831 HG LEU 100 HG LEU 100 -16.948 -20.420 -19.291 832 1HD1 LEU 100 1HD1 LEU 100 -15.067 -21.200 -17.964 833 2HD1 LEU 100 2HD1 LEU 100 -15.896 -22.741 -17.624 834 3HD1 LEU 100 3HD1 LEU 100 -15.348 -22.343 -19.265 835 1HD2 LEU 100 1HD2 LEU 100 -18.903 -21.828 -19.699 836 2HD2 LEU 100 2HD2 LEU 100 -17.436 -22.593 -20.318 837 3HD2 LEU 100 3HD2 LEU 100 -18.146 -23.165 -18.792 838 HA PRO 101 HA PRO 101 -14.663 -20.779 -13.443 839 1HB PRO 101 HB2 PRO 101 -15.825 -22.534 -11.719 840 2HB PRO 101 HB3 PRO 101 -16.150 -20.776 -11.642 841 1HG PRO 101 HG2 PRO 101 -17.823 -22.917 -12.996 842 2HG PRO 101 HG3 PRO 101 -18.369 -21.645 -11.856 843 1HD PRO 101 HD2 PRO 101 -18.555 -21.356 -14.573 844 2HD PRO 101 HD3 PRO 101 -18.210 -19.968 -13.501 845 HA PRO 102 HA PRO 102 -13.342 -24.452 -15.561 846 1HB PRO 102 HB2 PRO 102 -11.552 -25.636 -13.834 847 2HB PRO 102 HB3 PRO 102 -11.233 -24.119 -14.726 848 1HG PRO 102 HG2 PRO 102 -12.217 -24.430 -11.874 849 2HG PRO 102 HG3 PRO 102 -10.887 -23.391 -12.479 850 1HD PRO 102 HD2 PRO 102 -13.374 -22.398 -12.032 851 2HD PRO 102 HD3 PRO 102 -12.408 -21.847 -13.433 852 H ILE 103 H ILE 103 -14.834 -24.894 -12.379 853 HA ILE 103 HA ILE 103 -15.133 -27.736 -12.704 854 HB ILE 103 H5T ILE 103 -14.886 -26.382 -10.568 855 1HG1 ILE 103 2HG1 ILE 103 -17.152 -28.401 -10.465 856 2HG1 ILE 103 3HG1 ILE 103 -15.444 -28.813 -10.652 857 1HG2 ILE 103 1HG2 ILE 103 -16.796 -25.400 -9.492 858 2HG2 ILE 103 2HG2 ILE 103 -16.706 -24.716 -11.116 859 3HG2 ILE 103 3HG2 ILE 103 -17.898 -25.980 -10.753 860 1HD1 ILE 103 1HD1 ILE 103 -14.953 -27.674 -8.484 861 2HD1 ILE 103 2HD1 ILE 103 -16.698 -27.375 -8.276 862 3HD1 ILE 103 3HD1 ILE 103 -16.083 -29.035 -8.328 863 H LYS 104 H LYS 104 -16.358 -26.029 -14.837 864 HA LYS 104 HA LYS 104 -18.811 -27.649 -15.075 865 1HB LYS 104 HB2 LYS 104 -18.857 -24.598 -15.227 866 2HB LYS 104 HB3 LYS 104 -20.108 -25.644 -15.904 867 1HG LYS 104 HG2 LYS 104 -20.493 -26.618 -13.626 868 2HG LYS 104 HG3 LYS 104 -19.409 -25.387 -12.958 869 1HD LYS 104 HD2 LYS 104 -21.937 -24.797 -14.573 870 2HD LYS 104 HD3 LYS 104 -21.852 -24.827 -12.806 871 1HE LYS 104 HE2 LYS 104 -20.178 -23.022 -12.826 872 2HE LYS 104 HE3 LYS 104 -20.225 -22.972 -14.599 873 1HZ LYS 104 HZ1 LYS 104 -21.654 -21.273 -13.499 874 2HZ LYS 104 HZ2 LYS 104 -22.481 -22.217 -14.529 875 3HZ LYS 104 HZ3 LYS 104 -22.609 -22.457 -12.906 876 HA PRO 105 HA PRO 105 -17.301 -27.542 -19.316 877 1HB PRO 105 HB2 PRO 105 -19.322 -28.782 -20.639 878 2HB PRO 105 HB3 PRO 105 -18.300 -29.645 -19.450 879 1HG PRO 105 HG2 PRO 105 -21.036 -28.406 -18.992 880 2HG PRO 105 HG3 PRO 105 -20.485 -30.057 -18.563 881 1HD PRO 105 HD2 PRO 105 -20.474 -27.991 -16.763 882 2HD PRO 105 HD3 PRO 105 -19.227 -29.272 -16.743 883 H ARG 106 H ARG 106 -20.243 -25.961 -18.335 884 HA ARG 106 HA ARG 106 -20.179 -24.000 -20.567 885 1HB ARG 106 HB2 ARG 106 -22.626 -25.650 -19.766 886 2HB ARG 106 HB3 ARG 106 -22.666 -24.239 -20.825 887 1HG ARG 106 HG2 ARG 106 -21.095 -25.423 -22.397 888 2HG ARG 106 HG3 ARG 106 -21.284 -26.884 -21.416 889 1HD ARG 106 HD2 ARG 106 -23.534 -25.370 -22.806 890 2HD ARG 106 HD3 ARG 106 -22.777 -26.832 -23.419 891 HE ARG 106 H3T ARG 106 -24.734 -26.603 -21.239 892 1HH1 ARG 106 2HH2 ARG 106 -22.420 -28.788 -22.714 893 2HH1 ARG 106 1HH2 ARG 106 -23.172 -30.194 -22.014 894 1HH2 ARG 106 2HH1 ARG 106 -25.634 -28.434 -20.381 895 2HH2 ARG 106 1HH1 ARG 106 -24.942 -29.992 -20.729 896 H LYS 107 H LYS 107 -21.957 -22.269 -20.112 897 HA LYS 107 HA LYS 107 -21.403 -21.061 -17.559 898 1HB LYS 107 HB2 LYS 107 -23.512 -20.392 -19.652 899 2HB LYS 107 HB3 LYS 107 -23.126 -19.417 -18.230 900 1HG LYS 107 HG2 LYS 107 -20.751 -19.215 -19.072 901 2HG LYS 107 HG3 LYS 107 -21.227 -20.085 -20.528 902 1HD LYS 107 HD2 LYS 107 -21.246 -17.741 -21.061 903 2HD LYS 107 HD3 LYS 107 -22.906 -18.323 -21.037 904 1HE LYS 107 HE2 LYS 107 -22.969 -16.219 -19.960 905 2HE LYS 107 HE3 LYS 107 -23.113 -17.407 -18.669 906 1HZ LYS 107 HZ1 LYS 107 -20.674 -15.886 -19.410 907 2HZ LYS 107 HZ2 LYS 107 -21.525 -15.740 -18.029 908 3HZ LYS 107 HZ3 LYS 107 -20.648 -17.095 -18.313 Start of MODEL 2 1 1H ARG 1 H1 ARG 1 -7.431 1.951 -7.832 2 2H ARG 1 H2 ARG 1 -8.156 1.401 -6.472 3 3H ARG 1 H3 ARG 1 -7.379 0.358 -7.489 4 HA ARG 1 HA ARG 1 -5.278 1.377 -7.084 5 1HB ARG 1 HB2 ARG 1 -6.005 3.634 -6.497 6 2HB ARG 1 HB3 ARG 1 -6.796 3.043 -5.039 7 1HG ARG 1 HG2 ARG 1 -4.680 4.135 -4.498 8 2HG ARG 1 HG3 ARG 1 -4.618 2.436 -4.050 9 1HD ARG 1 HD2 ARG 1 -3.371 1.986 -6.222 10 2HD ARG 1 HD3 ARG 1 -3.365 3.727 -6.503 11 HE ARG 1 H3T ARG 1 -1.818 2.202 -4.476 12 1HH1 ARG 1 2HH2 ARG 1 -2.496 5.396 -5.762 13 2HH1 ARG 1 1HH2 ARG 1 -1.106 6.082 -4.963 14 1HH2 ARG 1 2HH1 ARG 1 -0.140 3.077 -3.564 15 2HH2 ARG 1 1HH1 ARG 1 0.230 4.786 -3.733 16 H ALA 2 H ALA 2 -7.571 0.521 -4.418 17 HA ALA 2 HA ALA 2 -5.340 -0.442 -2.837 18 1HB ALA 2 HB1 ALA 2 -7.359 0.585 -1.843 19 2HB ALA 2 HB2 ALA 2 -8.352 -0.760 -2.455 20 3HB ALA 2 HB3 ALA 2 -7.102 -1.058 -1.229 21 H ASP 3 H ASP 3 -7.604 -2.098 -5.051 22 HA ASP 3 HA ASP 3 -6.899 -4.764 -4.125 23 1HB ASP 3 HB2 ASP 3 -9.009 -4.188 -5.313 24 2HB ASP 3 HB3 ASP 3 -8.080 -3.815 -6.765 25 H GLU 4 H GLU 4 -5.623 -2.520 -6.598 26 HA GLU 4 HA GLU 4 -3.710 -4.390 -7.796 27 1HB GLU 4 HB2 GLU 4 -3.515 -1.369 -7.690 28 2HB GLU 4 HB3 GLU 4 -2.740 -2.493 -8.797 29 1HG GLU 4 HG2 GLU 4 -4.388 -1.815 -10.182 30 2HG GLU 4 HG3 GLU 4 -5.299 -3.103 -9.404 31 H GLN 5 H GLN 5 -3.639 -1.862 -5.236 32 HA GLN 5 HA GLN 5 -0.951 -2.173 -4.555 33 1HB GLN 5 HB2 GLN 5 -2.677 -0.384 -3.798 34 2HB GLN 5 HB3 GLN 5 -3.211 -1.551 -2.593 35 1HG GLN 5 HG2 GLN 5 -1.717 -0.080 -1.491 36 2HG GLN 5 HG3 GLN 5 -0.812 -1.577 -1.710 37 1HE2 GLN 5 2HE2 GLN 5 1.118 -1.463 -2.940 38 2HE2 GLN 5 1HE2 GLN 5 1.647 0.013 -3.741 39 H ALA 6 H ALA 6 -3.798 -3.932 -3.242 40 HA ALA 6 HA ALA 6 -2.291 -5.581 -1.449 41 1HB ALA 6 HB1 ALA 6 -4.735 -5.254 -1.285 42 2HB ALA 6 HB2 ALA 6 -4.968 -6.093 -2.835 43 3HB ALA 6 HB3 ALA 6 -4.338 -6.977 -1.429 44 H PHE 7 H PHE 7 -3.399 -6.283 -4.852 45 HA PHE 7 HA PHE 7 -2.043 -8.817 -4.790 46 1HB PHE 7 HB2 PHE 7 -2.925 -9.300 -6.768 47 2HB PHE 7 HB3 PHE 7 -4.078 -8.136 -6.173 48 HD1 PHE 7 HD1 PHE 7 -4.962 -6.706 -7.772 49 HD2 PHE 7 HD2 PHE 7 -1.002 -8.287 -8.413 50 HE1 PHE 7 HE1 PHE 7 -4.903 -5.667 -10.018 51 HE2 PHE 7 HE2 PHE 7 -0.958 -7.260 -10.652 52 HZ PHE 7 HZ PHE 7 -2.894 -5.930 -11.463 53 H LEU 8 H LEU 8 -0.619 -5.707 -5.086 54 HA LEU 8 HA LEU 8 1.630 -6.897 -6.683 55 1HB LEU 8 HB2 LEU 8 0.862 -4.002 -6.283 56 2HB LEU 8 HB3 LEU 8 2.377 -4.541 -7.004 57 HG LEU 8 HG LEU 8 -0.346 -5.378 -8.107 58 1HD1 LEU 8 1HD1 LEU 8 -0.208 -2.969 -8.206 59 2HD1 LEU 8 2HD1 LEU 8 1.399 -3.061 -8.939 60 3HD1 LEU 8 3HD1 LEU 8 -0.025 -3.657 -9.827 61 1HD2 LEU 8 1HD2 LEU 8 1.412 -6.868 -8.855 62 2HD2 LEU 8 2HD2 LEU 8 0.959 -5.797 -10.178 63 3HD2 LEU 8 3HD2 LEU 8 2.458 -5.503 -9.283 64 H VAL 9 H VAL 9 0.606 -5.718 -3.509 65 HA VAL 9 HA VAL 9 3.348 -5.840 -2.427 66 HB VAL 9 H5T VAL 9 0.597 -5.787 -1.151 67 1HG1 VAL 9 1HG1 VAL 9 1.766 -5.576 1.045 68 2HG1 VAL 9 2HG1 VAL 9 1.946 -7.182 0.341 69 3HG1 VAL 9 3HG1 VAL 9 3.295 -6.023 0.256 70 1HG2 VAL 9 1HG2 VAL 9 1.350 -3.613 -0.315 71 2HG2 VAL 9 2HG2 VAL 9 2.978 -3.872 -0.984 72 3HG2 VAL 9 3HG2 VAL 9 1.597 -3.650 -2.067 73 H ALA 10 H ALA 10 0.523 -8.027 -2.726 74 HA ALA 10 HA ALA 10 1.765 -10.363 -1.736 75 1HB ALA 10 HB1 ALA 10 -0.276 -10.086 -3.980 76 2HB ALA 10 HB2 ALA 10 0.083 -11.566 -3.070 77 3HB ALA 10 HB3 ALA 10 -0.640 -10.173 -2.243 78 H LEU 11 H LEU 11 1.761 -9.215 -5.216 79 HA LEU 11 HA LEU 11 3.678 -11.091 -6.113 80 1HB LEU 11 HB2 LEU 11 2.461 -9.604 -7.623 81 2HB LEU 11 HB3 LEU 11 3.373 -8.207 -7.050 82 HG LEU 11 HG LEU 11 5.004 -10.554 -8.031 83 1HD1 LEU 11 1HD1 LEU 11 3.305 -10.471 -9.741 84 2HD1 LEU 11 2HD1 LEU 11 3.408 -8.710 -9.835 85 3HD1 LEU 11 3HD1 LEU 11 4.769 -9.741 -10.371 86 1HD2 LEU 11 1HD2 LEU 11 6.386 -8.750 -9.007 87 2HD2 LEU 11 2HD2 LEU 11 5.221 -7.533 -8.450 88 3HD2 LEU 11 3HD2 LEU 11 6.168 -8.480 -7.286 89 H TYR 12 H TYR 12 4.382 -7.848 -4.697 90 HA TYR 12 HA TYR 12 7.157 -8.038 -4.897 91 1HB TYR 12 HB2 TYR 12 5.995 -5.980 -4.411 92 2HB TYR 12 HB3 TYR 12 5.383 -6.630 -2.896 93 HD1 TYR 12 HD1 TYR 12 8.969 -6.983 -3.961 94 HD2 TYR 12 HD2 TYR 12 6.106 -4.834 -1.543 95 HE1 TYR 12 HE1 TYR 12 10.819 -5.892 -2.734 96 HE2 TYR 12 HE2 TYR 12 7.968 -3.726 -0.333 97 HH TYR 12 HH TYR 12 11.412 -4.399 -1.102 98 H LYS 13 H LYS 13 5.075 -9.259 -2.238 99 HA LYS 13 HA LYS 13 7.211 -10.280 -0.616 100 1HB LYS 13 HB2 LYS 13 4.854 -9.917 0.133 101 2HB LYS 13 HB3 LYS 13 4.326 -11.270 -0.878 102 1HG LYS 13 HG2 LYS 13 5.816 -12.800 0.429 103 2HG LYS 13 HG3 LYS 13 6.291 -11.444 1.457 104 1HD LYS 13 HD2 LYS 13 3.455 -12.534 1.143 105 2HD LYS 13 HD3 LYS 13 4.562 -12.915 2.470 106 1HE LYS 13 HE2 LYS 13 4.641 -10.496 3.087 107 2HE LYS 13 HE3 LYS 13 3.475 -10.141 1.805 108 1HZ LYS 13 HZ1 LYS 13 1.882 -11.596 2.947 109 2HZ LYS 13 HZ2 LYS 13 2.960 -11.916 4.133 110 3HZ LYS 13 HZ3 LYS 13 2.372 -10.407 3.950 111 H TYR 14 H TYR 14 5.188 -12.095 -3.087 112 HA TYR 14 HA TYR 14 6.722 -14.467 -2.921 113 1HB TYR 14 HB2 TYR 14 4.560 -14.356 -3.983 114 2HB TYR 14 HB3 TYR 14 5.099 -13.139 -5.124 115 HD1 TYR 14 HD1 TYR 14 6.177 -13.709 -7.186 116 HD2 TYR 14 HD2 TYR 14 5.368 -16.745 -4.225 117 HE1 TYR 14 HE1 TYR 14 6.650 -15.484 -8.872 118 HE2 TYR 14 HE2 TYR 14 5.835 -18.514 -5.913 119 HH TYR 14 HH TYR 14 6.400 -18.973 -8.088 120 H MET 15 H MET 15 7.237 -11.587 -4.928 121 HA MET 15 HA MET 15 9.422 -12.477 -6.492 122 1HB MET 15 HB2 MET 15 8.208 -10.625 -7.203 123 2HB MET 15 HB3 MET 15 8.280 -9.823 -5.629 124 1HG MET 15 HG2 MET 15 10.434 -9.190 -5.815 125 2HG MET 15 HG3 MET 15 10.792 -10.293 -7.159 126 1HE MET 15 HE1 MET 15 10.602 -9.722 -9.619 127 2HE MET 15 HE2 MET 15 8.853 -9.967 -9.402 128 3HE MET 15 HE3 MET 15 9.451 -8.541 -10.283 129 H LYS 16 H LYS 16 9.479 -10.554 -3.367 130 HA LYS 16 HA LYS 16 12.277 -10.710 -2.998 131 1HB LYS 16 HB2 LYS 16 10.628 -9.281 -1.770 132 2HB LYS 16 HB3 LYS 16 10.130 -10.702 -0.839 133 1HG LYS 16 HG2 LYS 16 12.426 -10.920 0.063 134 2HG LYS 16 HG3 LYS 16 12.968 -9.571 -0.957 135 1HD LYS 16 HD2 LYS 16 11.397 -8.049 0.221 136 2HD LYS 16 HD3 LYS 16 10.866 -9.398 1.250 137 1HE LYS 16 HE2 LYS 16 13.191 -9.669 2.086 138 2HE LYS 16 HE3 LYS 16 13.724 -8.335 1.055 139 1HZ LYS 16 HZ1 LYS 16 12.239 -6.860 2.310 140 2HZ LYS 16 HZ2 LYS 16 11.750 -8.094 3.265 141 3HZ LYS 16 HZ3 LYS 16 13.297 -7.581 3.323 142 H GLU 17 H GLU 17 9.784 -13.063 -1.948 143 HA GLU 17 HA GLU 17 11.583 -14.906 -0.769 144 1HB GLU 17 HB2 GLU 17 9.005 -14.790 -0.765 145 2HB GLU 17 HB3 GLU 17 9.061 -15.739 -2.242 146 1HG GLU 17 HG2 GLU 17 10.307 -16.510 0.441 147 2HG GLU 17 HG3 GLU 17 8.712 -17.020 -0.102 148 H ARG 18 H ARG 18 10.589 -14.621 -4.221 149 HA ARG 18 HA ARG 18 12.357 -16.703 -5.185 150 1HB ARG 18 HB2 ARG 18 10.602 -14.564 -6.310 151 2HB ARG 18 HB3 ARG 18 11.978 -14.940 -7.304 152 1HG ARG 18 HG2 ARG 18 10.142 -16.231 -8.035 153 2HG ARG 18 HG3 ARG 18 11.359 -17.315 -7.381 154 1HD ARG 18 HD2 ARG 18 8.935 -16.396 -5.772 155 2HD ARG 18 HD3 ARG 18 8.854 -17.756 -6.881 156 HE ARG 18 H3T ARG 18 9.975 -17.789 -4.223 157 1HH1 ARG 18 2HH2 ARG 18 10.311 -19.434 -7.321 158 2HH1 ARG 18 1HH2 ARG 18 10.933 -20.867 -6.550 159 1HH2 ARG 18 2HH1 ARG 18 10.674 -19.522 -3.376 160 2HH2 ARG 18 1HH1 ARG 18 11.162 -20.937 -4.318 161 H LYS 19 H LYS 19 13.401 -13.992 -3.660 162 HA LYS 19 HA LYS 19 15.414 -13.144 -3.279 163 1HB LYS 19 HB2 LYS 19 16.621 -15.117 -5.258 164 2HB LYS 19 HB3 LYS 19 17.484 -14.049 -4.169 165 1HG LYS 19 HG2 LYS 19 17.553 -15.826 -2.833 166 2HG LYS 19 HG3 LYS 19 15.979 -15.240 -2.300 167 1HD LYS 19 HD2 LYS 19 14.914 -16.843 -3.952 168 2HD LYS 19 HD3 LYS 19 16.517 -17.458 -4.344 169 1HE LYS 19 HE2 LYS 19 15.230 -17.477 -1.571 170 2HE LYS 19 HE3 LYS 19 15.198 -18.834 -2.697 171 1HZ LYS 19 HZ1 LYS 19 17.637 -18.902 -2.597 172 2HZ LYS 19 HZ2 LYS 19 17.666 -17.670 -1.520 173 3HZ LYS 19 HZ3 LYS 19 16.995 -19.098 -1.112 174 H THR 20 H THR 20 13.581 -11.960 -5.037 175 HA THR 20 HA THR 20 15.529 -10.104 -6.302 176 HB THR 20 H5T THR 20 12.866 -11.046 -7.349 177 HG1 THR 20 HG1 THR 20 14.565 -12.034 -8.225 178 1HG2 THR 20 1HG2 THR 20 12.499 -8.707 -7.543 179 2HG2 THR 20 2HG2 THR 20 14.185 -8.367 -7.881 180 3HG2 THR 20 3HG2 THR 20 13.166 -9.185 -9.102 181 HA PRO 21 HA PRO 21 13.509 -7.771 -2.990 182 1HB PRO 21 HB2 PRO 21 15.319 -5.774 -2.633 183 2HB PRO 21 HB3 PRO 21 15.714 -7.474 -2.267 184 1HG PRO 21 HG2 PRO 21 16.316 -5.957 -4.836 185 2HG PRO 21 HG3 PRO 21 17.468 -6.861 -3.795 186 1HD PRO 21 HD2 PRO 21 16.293 -7.996 -5.982 187 2HD PRO 21 HD3 PRO 21 16.618 -8.942 -4.496 188 H ILE 22 H ILE 22 12.836 -7.290 -5.993 189 HA ILE 22 HA ILE 22 12.059 -5.804 -7.420 190 HB ILE 22 H5T ILE 22 10.403 -5.726 -5.378 191 1HG1 ILE 22 2HG1 ILE 22 9.846 -3.797 -7.637 192 2HG1 ILE 22 3HG1 ILE 22 10.029 -5.507 -7.966 193 1HG2 ILE 22 1HG2 ILE 22 11.332 -3.656 -4.307 194 2HG2 ILE 22 2HG2 ILE 22 10.970 -2.749 -5.785 195 3HG2 ILE 22 3HG2 ILE 22 9.669 -3.455 -4.813 196 1HD1 ILE 22 1HD1 ILE 22 7.666 -4.982 -7.656 197 2HD1 ILE 22 2HD1 ILE 22 8.210 -6.067 -6.372 198 3HD1 ILE 22 3HD1 ILE 22 7.975 -4.336 -6.039 199 H GLU 23 H GLU 23 13.991 -3.964 -5.038 200 HA GLU 23 HA GLU 23 14.403 -1.728 -6.652 201 1HB GLU 23 HB2 GLU 23 16.343 -3.108 -4.756 202 2HB GLU 23 HB3 GLU 23 16.529 -1.465 -5.383 203 1HG GLU 23 HG2 GLU 23 14.341 -0.838 -4.351 204 2HG GLU 23 HG3 GLU 23 14.240 -2.444 -3.626 205 H ARG 24 H ARG 24 15.633 -4.900 -7.425 206 HA ARG 24 HA ARG 24 17.767 -4.013 -9.179 207 1HB ARG 24 HB2 ARG 24 17.963 -6.180 -9.936 208 2HB ARG 24 HB3 ARG 24 17.444 -6.365 -8.266 209 1HG ARG 24 HG2 ARG 24 15.063 -6.668 -9.178 210 2HG ARG 24 HG3 ARG 24 15.773 -6.740 -10.793 211 1HD ARG 24 HD2 ARG 24 16.369 -8.647 -8.481 212 2HD ARG 24 HD3 ARG 24 15.376 -8.985 -9.900 213 HE ARG 24 H3T ARG 24 17.988 -8.214 -10.768 214 1HH1 ARG 24 2HH2 ARG 24 16.327 -10.940 -9.304 215 2HH1 ARG 24 1HH2 ARG 24 17.531 -12.078 -9.858 216 1HH2 ARG 24 2HH1 ARG 24 19.473 -9.730 -11.455 217 2HH2 ARG 24 1HH1 ARG 24 19.247 -11.408 -11.061 218 H ILE 25 H ILE 25 14.509 -3.518 -9.372 219 HA ILE 25 HA ILE 25 14.591 -2.630 -12.225 220 HB ILE 25 H5T ILE 25 12.202 -3.337 -10.464 221 1HG1 ILE 25 2HG1 ILE 25 13.066 -4.735 -13.029 222 2HG1 ILE 25 3HG1 ILE 25 13.582 -5.301 -11.446 223 1HG2 ILE 25 1HG2 ILE 25 12.377 -2.344 -13.335 224 2HG2 ILE 25 2HG2 ILE 25 10.879 -2.895 -12.544 225 3HG2 ILE 25 3HG2 ILE 25 11.701 -1.461 -11.964 226 1HD1 ILE 25 1HD1 ILE 25 10.686 -5.117 -12.335 227 2HD1 ILE 25 2HD1 ILE 25 11.664 -6.580 -12.165 228 3HD1 ILE 25 3HD1 ILE 25 11.255 -5.622 -10.731 229 HA PRO 26 HA PRO 26 15.217 0.611 -9.039 230 1HB PRO 26 HB2 PRO 26 16.928 2.303 -10.334 231 2HB PRO 26 HB3 PRO 26 17.416 0.726 -9.652 232 1HG PRO 26 HG2 PRO 26 16.651 1.339 -12.527 233 2HG PRO 26 HG3 PRO 26 18.102 0.471 -11.929 234 1HD PRO 26 HD2 PRO 26 15.897 -0.876 -12.772 235 2HD PRO 26 HD3 PRO 26 16.848 -1.438 -11.364 236 H TYR 27 H TYR 27 14.285 1.568 -12.410 237 HA TYR 27 HA TYR 27 12.575 3.717 -11.285 238 1HB TYR 27 HB2 TYR 27 14.820 4.238 -13.282 239 2HB TYR 27 HB3 TYR 27 13.576 5.392 -12.840 240 HD1 TYR 27 HD1 TYR 27 16.887 4.337 -12.144 241 HD2 TYR 27 HD2 TYR 27 13.365 5.995 -10.286 242 HE1 TYR 27 HE1 TYR 27 18.286 5.240 -10.289 243 HE2 TYR 27 HE2 TYR 27 14.762 6.902 -8.436 244 HH TYR 27 HH TYR 27 16.873 7.098 -7.565 245 H LEU 28 H LEU 28 11.076 4.556 -12.681 246 HA LEU 28 HA LEU 28 10.497 3.098 -15.206 247 1HB LEU 28 HB2 LEU 28 8.805 3.203 -13.383 248 2HB LEU 28 HB3 LEU 28 8.766 4.955 -13.520 249 HG LEU 28 HG LEU 28 7.769 4.795 -15.759 250 1HD1 LEU 28 1HD1 LEU 28 8.074 1.783 -15.420 251 2HD1 LEU 28 2HD1 LEU 28 7.065 2.566 -16.656 252 3HD1 LEU 28 3HD1 LEU 28 8.811 2.801 -16.676 253 1HD2 LEU 28 1HD2 LEU 28 6.414 2.893 -13.802 254 2HD2 LEU 28 2HD2 LEU 28 6.304 4.673 -13.768 255 3HD2 LEU 28 3HD2 LEU 28 5.638 3.769 -15.137 256 H GLY 29 H GLY 29 12.720 4.573 -15.441 257 1HA GLY 29 HA2 GLY 29 13.524 5.953 -17.163 258 2HA GLY 29 HA3 GLY 29 11.923 6.671 -17.361 259 H PHE 30 H PHE 30 11.298 7.647 -14.942 260 HA PHE 30 HA PHE 30 13.503 9.380 -13.999 261 1HB PHE 30 HB2 PHE 30 12.425 11.407 -14.599 262 2HB PHE 30 HB3 PHE 30 12.454 10.417 -16.036 263 HD1 PHE 30 HD1 PHE 30 10.473 12.596 -14.165 264 HD2 PHE 30 HD2 PHE 30 10.177 8.894 -16.365 265 HE1 PHE 30 HE1 PHE 30 8.053 12.994 -14.522 266 HE2 PHE 30 HE2 PHE 30 7.751 9.238 -16.621 267 HZ PHE 30 HZ PHE 30 6.681 11.321 -15.753 268 H LYS 31 H LYS 31 11.206 7.373 -12.933 269 HA LYS 31 HA LYS 31 11.064 8.667 -10.308 270 1HB LYS 31 HB2 LYS 31 8.599 8.582 -10.139 271 2HB LYS 31 HB3 LYS 31 9.140 9.755 -11.326 272 1HG LYS 31 HG2 LYS 31 8.379 8.481 -13.157 273 2HG LYS 31 HG3 LYS 31 8.383 6.971 -12.253 274 1HD LYS 31 HD2 LYS 31 6.086 7.769 -12.693 275 2HD LYS 31 HD3 LYS 31 6.451 7.568 -10.985 276 1HE LYS 31 HE2 LYS 31 5.159 9.568 -11.222 277 2HE LYS 31 HE3 LYS 31 6.794 10.023 -10.750 278 1HZ LYS 31 HZ1 LYS 31 7.231 10.569 -13.101 279 2HZ LYS 31 HZ2 LYS 31 5.701 10.147 -13.512 280 3HZ LYS 31 HZ3 LYS 31 5.961 11.429 -12.539 281 H GLN 32 H GLN 32 9.695 7.253 -8.788 282 HA GLN 32 HA GLN 32 10.585 4.546 -8.679 283 1HB GLN 32 HB2 GLN 32 9.791 5.994 -6.781 284 2HB GLN 32 HB3 GLN 32 8.140 5.842 -7.391 285 1HG GLN 32 HG2 GLN 32 8.264 3.363 -7.011 286 2HG GLN 32 HG3 GLN 32 9.910 3.558 -6.394 287 1HE2 GLN 32 1HE2 GLN 32 6.496 3.794 -5.652 288 2HE2 GLN 32 2HE2 GLN 32 6.711 4.326 -3.990 289 H ILE 33 H ILE 33 9.382 2.560 -8.965 290 HA ILE 33 HA ILE 33 7.905 2.400 -11.390 291 HB ILE 33 H5T ILE 33 7.981 0.318 -9.181 292 1HG1 ILE 33 2HG1 ILE 33 10.286 0.881 -9.491 293 2HG1 ILE 33 3HG1 ILE 33 9.977 -0.642 -10.290 294 1HG2 ILE 33 1HG2 ILE 33 7.849 -1.272 -11.072 295 2HG2 ILE 33 2HG2 ILE 33 6.432 -0.216 -11.012 296 3HG2 ILE 33 3HG2 ILE 33 7.707 0.077 -12.213 297 1HD1 ILE 33 1HD1 ILE 33 11.463 0.811 -11.612 298 2HD1 ILE 33 2HD1 ILE 33 9.964 0.493 -12.502 299 3HD1 ILE 33 3HD1 ILE 33 10.215 2.058 -11.691 300 H ASN 34 H ASN 34 6.064 3.592 -11.494 301 HA ASN 34 HA ASN 34 3.942 3.522 -9.520 302 1HB ASN 34 HB2 ASN 34 4.639 5.472 -11.004 303 2HB ASN 34 HB3 ASN 34 3.889 4.622 -12.360 304 1HD2 ASN 34 1HD2 ASN 34 2.558 6.652 -12.432 305 2HD2 ASN 34 2HD2 ASN 34 1.137 6.685 -11.395 306 H LEU 35 H LEU 35 4.221 1.043 -9.805 307 HA LEU 35 HA LEU 35 3.519 -0.445 -11.972 308 1HB LEU 35 HB2 LEU 35 4.501 -0.875 -9.503 309 2HB LEU 35 HB3 LEU 35 2.901 -1.517 -9.249 310 HG LEU 35 HG LEU 35 5.037 -2.402 -11.235 311 1HD1 LEU 35 1HD1 LEU 35 3.714 -3.666 -8.802 312 2HD1 LEU 35 2HD1 LEU 35 4.836 -4.523 -9.863 313 3HD1 LEU 35 3HD1 LEU 35 5.386 -3.109 -8.947 314 1HD2 LEU 35 1HD2 LEU 35 2.199 -3.457 -11.047 315 2HD2 LEU 35 2HD2 LEU 35 3.007 -2.764 -12.469 316 3HD2 LEU 35 3HD2 LEU 35 3.539 -4.314 -11.824 317 H TRP 36 H TRP 36 1.072 0.459 -9.440 318 HA TRP 36 HA TRP 36 -1.108 -1.030 -10.562 319 1HB TRP 36 HB2 TRP 36 -2.507 0.271 -9.193 320 2HB TRP 36 HB3 TRP 36 -1.033 -0.025 -8.289 321 HD1 TRP 36 HD1 TRP 36 0.781 2.223 -8.459 322 HE1 TRP 36 HE1 TRP 36 0.267 4.712 -8.415 323 HE3 TRP 36 HE3 TRP 36 -4.261 2.015 -9.343 324 HZ2 TRP 36 HZ2 TRP 36 -2.075 6.418 -8.518 325 HZ3 TRP 36 HZ3 TRP 36 -5.619 4.105 -9.340 326 HH2 TRP 36 HH2 TRP 36 -4.538 6.301 -8.930 327 H THR 37 H THR 37 0.112 2.246 -11.295 328 HA THR 37 HA THR 37 -1.956 2.949 -13.229 329 HB THR 37 H5T THR 37 0.812 4.124 -12.820 330 HG1 THR 37 HG1 THR 37 -0.567 4.410 -11.054 331 1HG2 THR 37 1HG2 THR 37 -1.588 5.159 -14.388 332 2HG2 THR 37 2HG2 THR 37 -0.151 6.119 -13.968 333 3HG2 THR 37 3HG2 THR 37 0.008 4.733 -15.050 334 H MET 38 H MET 38 1.374 1.621 -13.456 335 HA MET 38 HA MET 38 1.451 1.323 -16.294 336 1HB MET 38 HB2 MET 38 3.402 1.093 -14.742 337 2HB MET 38 HB3 MET 38 2.680 -0.368 -14.073 338 1HG MET 38 HG2 MET 38 2.808 -1.301 -16.504 339 2HG MET 38 HG3 MET 38 3.954 0.011 -16.771 340 1HE MET 38 HE1 MET 38 5.409 0.061 -13.730 341 2HE MET 38 HE2 MET 38 6.817 -0.908 -14.216 342 3HE MET 38 HE3 MET 38 6.159 0.312 -15.324 343 H PHE 39 H PHE 39 0.124 -0.920 -13.783 344 HA PHE 39 HA PHE 39 -0.670 -2.987 -15.604 345 1HB PHE 39 HB2 PHE 39 -0.570 -3.336 -13.212 346 2HB PHE 39 HB3 PHE 39 -1.718 -2.054 -12.911 347 HD1 PHE 39 HD1 PHE 39 -1.547 -5.203 -15.004 348 HD2 PHE 39 HD2 PHE 39 -3.917 -2.656 -12.447 349 HE1 PHE 39 HE1 PHE 39 -3.451 -6.786 -15.182 350 HE2 PHE 39 HE2 PHE 39 -5.823 -4.234 -12.655 351 HZ PHE 39 HZ PHE 39 -5.580 -6.288 -14.037 352 H GLN 40 H GLN 40 -2.770 -0.309 -14.254 353 HA GLN 40 HA GLN 40 -4.873 -1.117 -16.063 354 1HB GLN 40 HB2 GLN 40 -6.095 0.800 -15.299 355 2HB GLN 40 HB3 GLN 40 -5.214 0.125 -13.928 356 1HG GLN 40 HG2 GLN 40 -3.392 1.904 -14.512 357 2HG GLN 40 HG3 GLN 40 -4.642 2.679 -15.481 358 1HE2 GLN 40 1HE2 GLN 40 -3.753 1.605 -12.190 359 2HE2 GLN 40 2HE2 GLN 40 -4.768 2.790 -11.372 360 H ALA 41 H ALA 41 -2.138 1.107 -16.621 361 HA ALA 41 HA ALA 41 -3.152 2.113 -19.132 362 1HB ALA 41 HB1 ALA 41 -1.284 3.189 -17.950 363 2HB ALA 41 HB2 ALA 41 -0.307 1.713 -18.091 364 3HB ALA 41 HB3 ALA 41 -0.752 2.625 -19.547 365 H ALA 42 H ALA 42 -0.975 -0.717 -18.343 366 HA ALA 42 HA ALA 42 -0.798 -1.638 -21.018 367 1HB ALA 42 HB1 ALA 42 -0.111 -3.770 -19.996 368 2HB ALA 42 HB2 ALA 42 0.665 -2.400 -19.179 369 3HB ALA 42 HB3 ALA 42 -0.712 -3.222 -18.414 370 H GLN 43 H GLN 43 -3.368 -2.247 -18.573 371 HA GLN 43 HA GLN 43 -4.672 -4.235 -20.149 372 1HB GLN 43 HB2 GLN 43 -5.633 -2.576 -17.818 373 2HB GLN 43 HB3 GLN 43 -6.622 -3.800 -18.611 374 1HG GLN 43 HG2 GLN 43 -3.969 -4.299 -17.210 375 2HG GLN 43 HG3 GLN 43 -5.561 -4.725 -16.610 376 1HE2 GLN 43 1HE2 GLN 43 -2.968 -6.274 -17.572 377 2HE2 GLN 43 2HE2 GLN 43 -3.675 -7.571 -18.507 378 H LYS 44 H LYS 44 -5.203 -0.669 -19.960 379 HA LYS 44 HA LYS 44 -7.440 -0.897 -21.826 380 1HB LYS 44 HB2 LYS 44 -7.771 1.376 -21.649 381 2HB LYS 44 HB3 LYS 44 -7.292 0.852 -20.038 382 1HG LYS 44 HG2 LYS 44 -4.948 1.698 -20.564 383 2HG LYS 44 HG3 LYS 44 -5.583 2.297 -22.105 384 1HD LYS 44 HD2 LYS 44 -5.552 4.141 -20.648 385 2HD LYS 44 HD3 LYS 44 -7.248 3.686 -20.807 386 1HE LYS 44 HE2 LYS 44 -7.194 2.558 -18.621 387 2HE LYS 44 HE3 LYS 44 -5.447 2.805 -18.502 388 1HZ LYS 44 HZ1 LYS 44 -7.456 4.993 -18.555 389 2HZ LYS 44 HZ2 LYS 44 -6.641 4.492 -17.228 390 3HZ LYS 44 HZ3 LYS 44 -5.831 5.200 -18.468 391 H LEU 45 H LEU 45 -3.966 -0.128 -22.121 392 HA LEU 45 HA LEU 45 -4.197 -0.098 -24.986 393 1HB LEU 45 HB2 LEU 45 -1.768 -0.293 -23.161 394 2HB LEU 45 HB3 LEU 45 -1.660 -0.352 -24.898 395 HG LEU 45 HG LEU 45 -1.077 1.800 -24.501 396 1HD1 LEU 45 1HD1 LEU 45 -4.077 2.085 -24.941 397 2HD1 LEU 45 2HD1 LEU 45 -2.840 3.267 -25.346 398 3HD1 LEU 45 3HD1 LEU 45 -2.875 1.715 -26.206 399 1HD2 LEU 45 1HD2 LEU 45 -2.209 3.417 -23.047 400 2HD2 LEU 45 2HD2 LEU 45 -3.331 2.156 -22.513 401 3HD2 LEU 45 3HD2 LEU 45 -1.596 2.024 -22.152 402 H GLY 46 H GLY 46 -5.261 -2.561 -23.408 403 1HA GLY 46 HA2 GLY 46 -5.961 -4.434 -24.580 404 2HA GLY 46 HA3 GLY 46 -4.663 -4.252 -25.734 405 H GLY 47 H GLY 47 -4.286 -4.529 -22.235 406 1HA GLY 47 HA2 GLY 47 -2.897 -5.842 -20.966 407 2HA GLY 47 HA3 GLY 47 -3.545 -7.202 -21.882 408 H TYR 48 H TYR 48 -1.050 -7.570 -21.026 409 HA TYR 48 HA TYR 48 1.055 -6.969 -22.736 410 1HB TYR 48 HB2 TYR 48 1.009 -8.370 -20.630 411 2HB TYR 48 HB3 TYR 48 0.447 -9.713 -21.608 412 HD1 TYR 48 HD1 TYR 48 2.020 -11.064 -22.826 413 HD2 TYR 48 HD2 TYR 48 3.266 -7.301 -21.119 414 HE1 TYR 48 HE1 TYR 48 4.394 -11.653 -23.261 415 HE2 TYR 48 HE2 TYR 48 5.652 -7.910 -21.535 416 HH TYR 48 HH TYR 48 6.583 -11.006 -23.076 417 H GLU 49 H GLU 49 -1.810 -8.900 -23.530 418 HA GLU 49 HA GLU 49 -0.704 -10.386 -25.689 419 1HB GLU 49 HB2 GLU 49 -3.585 -9.382 -25.530 420 2HB GLU 49 HB3 GLU 49 -2.963 -10.762 -26.421 421 1HG GLU 49 HG2 GLU 49 -3.920 -11.824 -24.644 422 2HG GLU 49 HG3 GLU 49 -2.272 -11.672 -24.046 423 H THR 50 H THR 50 -2.608 -7.317 -25.911 424 HA THR 50 HA THR 50 -2.012 -7.011 -28.721 425 HB THR 50 H5T THR 50 -2.941 -4.834 -26.837 426 HG1 THR 50 HG1 THR 50 -4.383 -6.524 -26.697 427 1HG2 THR 50 1HG2 THR 50 -3.320 -5.261 -29.838 428 2HG2 THR 50 2HG2 THR 50 -4.034 -3.947 -28.879 429 3HG2 THR 50 3HG2 THR 50 -2.277 -4.041 -29.082 430 H ILE 51 H ILE 51 -0.485 -5.857 -25.693 431 HA ILE 51 HA ILE 51 1.437 -4.143 -26.887 432 HB ILE 51 H5T ILE 51 0.976 -5.442 -24.321 433 1HG1 ILE 51 2HG1 ILE 51 2.211 -3.390 -23.503 434 2HG1 ILE 51 3HG1 ILE 51 2.421 -2.924 -25.189 435 1HG2 ILE 51 1HG2 ILE 51 3.188 -5.502 -23.413 436 2HG2 ILE 51 2HG2 ILE 51 3.009 -6.719 -24.657 437 3HG2 ILE 51 3HG2 ILE 51 3.896 -5.221 -25.025 438 1HD1 ILE 51 1HD1 ILE 51 -0.145 -3.028 -25.403 439 2HD1 ILE 51 2HD1 ILE 51 -0.195 -3.273 -23.651 440 3HD1 ILE 51 3HD1 ILE 51 0.474 -1.770 -24.320 441 H THR 52 H THR 52 1.453 -7.732 -26.656 442 HA THR 52 HA THR 52 4.128 -7.965 -27.786 443 HB THR 52 H5T THR 52 1.876 -10.015 -27.622 444 HG1 THR 52 HG1 THR 52 2.488 -9.324 -25.600 445 1HG2 THR 52 1HG2 THR 52 4.878 -10.356 -28.057 446 2HG2 THR 52 2HG2 THR 52 3.738 -11.672 -27.695 447 3HG2 THR 52 3HG2 THR 52 3.587 -10.774 -29.209 448 H ALA 53 H ALA 53 0.796 -8.056 -29.147 449 HA ALA 53 HA ALA 53 1.617 -8.618 -31.828 450 1HB ALA 53 HB1 ALA 53 -0.675 -7.950 -32.381 451 2HB ALA 53 HB2 ALA 53 -0.667 -8.948 -30.914 452 3HB ALA 53 HB3 ALA 53 -0.866 -7.183 -30.792 453 H ARG 54 H ARG 54 1.627 -5.527 -30.044 454 HA ARG 54 HA ARG 54 2.141 -4.080 -32.655 455 1HB ARG 54 HB2 ARG 54 0.517 -3.292 -30.219 456 2HB ARG 54 HB3 ARG 54 0.930 -2.187 -31.526 457 1HG ARG 54 HG2 ARG 54 -0.325 -3.660 -33.127 458 2HG ARG 54 HG3 ARG 54 -0.865 -4.629 -31.726 459 1HD ARG 54 HD2 ARG 54 -1.725 -2.551 -30.659 460 2HD ARG 54 HD3 ARG 54 -1.232 -1.615 -32.077 461 HE ARG 54 H3T ARG 54 -2.971 -3.663 -32.970 462 1HH1 ARG 54 2HH2 ARG 54 -3.139 -0.765 -30.976 463 2HH1 ARG 54 1HH2 ARG 54 -4.814 -0.482 -31.385 464 1HH2 ARG 54 2HH1 ARG 54 -5.118 -3.232 -33.430 465 2HH2 ARG 54 1HH1 ARG 54 -5.900 -1.848 -32.726 466 H ARG 55 H ARG 55 3.637 -4.577 -29.594 467 HA ARG 55 HA ARG 55 5.080 -3.367 -28.299 468 1HB ARG 55 HB2 ARG 55 6.972 -2.201 -29.285 469 2HB ARG 55 HB3 ARG 55 6.828 -3.888 -29.653 470 1HG ARG 55 HG2 ARG 55 6.060 -1.694 -31.630 471 2HG ARG 55 HG3 ARG 55 7.687 -2.320 -31.457 472 1HD ARG 55 HD2 ARG 55 5.279 -3.834 -32.486 473 2HD ARG 55 HD3 ARG 55 6.740 -3.395 -33.341 474 HE ARG 55 H3T ARG 55 7.997 -4.964 -31.862 475 1HH1 ARG 55 2HH2 ARG 55 4.598 -5.650 -32.396 476 2HH1 ARG 55 1HH2 ARG 55 4.681 -7.150 -31.496 477 1HH2 ARG 55 2HH1 ARG 55 8.048 -7.002 -30.945 478 2HH2 ARG 55 1HH1 ARG 55 6.588 -7.950 -30.885 479 H GLN 56 H GLN 56 3.074 -2.596 -27.717 480 HA GLN 56 HA GLN 56 2.512 0.193 -28.537 481 1HB GLN 56 HB2 GLN 56 0.880 -1.684 -28.780 482 2HB GLN 56 HB3 GLN 56 0.732 -1.746 -27.031 483 1HG GLN 56 HG2 GLN 56 -0.356 0.374 -26.970 484 2HG GLN 56 HG3 GLN 56 0.229 0.817 -28.586 485 1HE2 GLN 56 1HE2 GLN 56 -1.756 -1.851 -27.073 486 2HE2 GLN 56 2HE2 GLN 56 -2.910 -1.848 -28.386 487 H TRP 57 H TRP 57 4.446 -1.035 -26.283 488 HA TRP 57 HA TRP 57 4.002 0.291 -23.833 489 1HB TRP 57 HB2 TRP 57 6.658 0.065 -25.273 490 2HB TRP 57 HB3 TRP 57 6.353 0.333 -23.583 491 HD1 TRP 57 HD1 TRP 57 6.566 -2.435 -26.102 492 HE1 TRP 57 HE1 TRP 57 6.201 -4.708 -24.966 493 HE3 TRP 57 HE3 TRP 57 5.228 -0.810 -21.423 494 HZ2 TRP 57 HZ2 TRP 57 5.358 -5.690 -22.393 495 HZ3 TRP 57 HZ3 TRP 57 4.623 -2.448 -19.644 496 HH2 TRP 57 HH2 TRP 57 4.664 -4.887 -20.151 497 H LYS 58 H LYS 58 5.017 1.645 -26.976 498 HA LYS 58 HA LYS 58 5.537 4.324 -26.029 499 1HB LYS 58 HB2 LYS 58 4.563 3.311 -28.733 500 2HB LYS 58 HB3 LYS 58 4.968 4.996 -28.421 501 1HG LYS 58 HG2 LYS 58 6.914 2.662 -28.158 502 2HG LYS 58 HG3 LYS 58 6.800 3.786 -29.514 503 1HD LYS 58 HD2 LYS 58 7.317 5.686 -27.896 504 2HD LYS 58 HD3 LYS 58 7.585 4.471 -26.645 505 1HE LYS 58 HE2 LYS 58 9.712 5.055 -27.444 506 2HE LYS 58 HE3 LYS 58 9.368 3.431 -28.051 507 1HZ LYS 58 HZ1 LYS 58 8.808 4.445 -30.208 508 2HZ LYS 58 HZ2 LYS 58 9.097 5.946 -29.623 509 3HZ LYS 58 HZ3 LYS 58 10.319 4.876 -29.775 510 H HIS 59 H HIS 59 2.389 2.766 -26.554 511 HA HIS 59 HA HIS 59 1.082 5.338 -25.883 512 1HB HIS 59 HB2 HIS 59 -0.069 2.646 -26.620 513 2HB HIS 59 HB3 HIS 59 -0.993 4.104 -26.256 514 HD1 HIS 59 HD1 HIS 59 -1.276 5.870 -28.180 515 HD2 HIS 59 HD2 HIS 59 1.504 2.808 -28.962 516 HE1 HIS 59 HE1 HIS 59 -0.605 6.119 -30.626 517 H ILE 60 H ILE 60 2.236 2.524 -24.171 518 HA ILE 60 HA ILE 60 0.563 2.968 -21.786 519 HB ILE 60 H5T ILE 60 3.192 1.501 -22.205 520 1HG1 ILE 60 2HG1 ILE 60 0.399 0.543 -21.413 521 2HG1 ILE 60 3HG1 ILE 60 1.019 0.501 -23.062 522 1HG2 ILE 60 1HG2 ILE 60 1.641 1.832 -19.602 523 2HG2 ILE 60 2HG2 ILE 60 3.036 0.761 -19.847 524 3HG2 ILE 60 3HG2 ILE 60 3.253 2.493 -19.946 525 1HD1 ILE 60 1HD1 ILE 60 2.200 -1.062 -20.728 526 2HD1 ILE 60 2HD1 ILE 60 1.190 -1.697 -22.020 527 3HD1 ILE 60 3HD1 ILE 60 2.789 -1.060 -22.411 528 H TYR 61 H TYR 61 3.785 3.995 -22.997 529 HA TYR 61 HA TYR 61 4.378 5.959 -21.065 530 1HB TYR 61 HB2 TYR 61 6.063 5.328 -22.577 531 2HB TYR 61 HB3 TYR 61 5.045 5.561 -23.975 532 HD1 TYR 61 HD1 TYR 61 7.027 7.344 -21.364 533 HD2 TYR 61 HD2 TYR 61 4.901 7.648 -25.109 534 HE1 TYR 61 HE1 TYR 61 8.028 9.603 -21.764 535 HE2 TYR 61 HE2 TYR 61 5.889 9.893 -25.494 536 HH TYR 61 HH TYR 61 7.260 11.517 -24.697 537 H ASP 62 H ASP 62 2.158 6.110 -23.846 538 HA ASP 62 HA ASP 62 1.579 8.882 -23.647 539 1HB ASP 62 HB2 ASP 62 0.969 7.542 -25.613 540 2HB ASP 62 HB3 ASP 62 -0.351 6.823 -24.680 541 H GLU 63 H GLU 63 -0.181 6.084 -22.140 542 HA GLU 63 HA GLU 63 -1.682 7.736 -20.361 543 1HB GLU 63 HB2 GLU 63 -0.796 4.843 -20.282 544 2HB GLU 63 HB3 GLU 63 -1.683 5.552 -18.935 545 1HG GLU 63 HG2 GLU 63 -2.670 5.526 -21.814 546 2HG GLU 63 HG3 GLU 63 -3.120 4.356 -20.574 547 H LEU 64 H LEU 64 1.676 6.540 -19.915 548 HA LEU 64 HA LEU 64 1.869 7.370 -17.166 549 1HB LEU 64 HB2 LEU 64 4.126 7.231 -19.218 550 2HB LEU 64 HB3 LEU 64 4.312 7.362 -17.483 551 HG LEU 64 HG LEU 64 3.321 4.975 -19.028 552 1HD1 LEU 64 1HD1 LEU 64 5.742 5.329 -18.982 553 2HD1 LEU 64 2HD1 LEU 64 5.705 5.382 -17.205 554 3HD1 LEU 64 3HD1 LEU 64 5.277 3.887 -18.067 555 1HD2 LEU 64 1HD2 LEU 64 3.189 3.785 -16.845 556 2HD2 LEU 64 2HD2 LEU 64 3.442 5.331 -16.003 557 3HD2 LEU 64 3HD2 LEU 64 1.974 5.060 -16.975 558 H GLY 65 H GLY 65 2.131 9.207 -20.180 559 1HA GLY 65 HA2 GLY 65 2.567 11.425 -20.598 560 2HA GLY 65 HA3 GLY 65 2.088 11.796 -18.933 561 H GLY 66 H GLY 66 4.786 9.686 -20.063 562 1HA GLY 66 HA2 GLY 66 6.450 10.608 -17.971 563 2HA GLY 66 HA3 GLY 66 6.943 9.556 -19.289 564 H ASN 67 H ASN 67 8.782 11.104 -18.281 565 HA ASN 67 HA ASN 67 9.319 13.655 -19.264 566 1HB ASN 67 HB2 ASN 67 10.618 12.498 -17.564 567 2HB ASN 67 HB3 ASN 67 11.129 11.276 -18.727 568 1HD2 ASN 67 1HD2 ASN 67 13.300 11.600 -19.151 569 2HD2 ASN 67 2HD2 ASN 67 14.007 13.190 -19.425 570 HA PRO 68 HA PRO 68 9.172 13.085 -23.671 571 1HB PRO 68 HB2 PRO 68 11.221 15.308 -23.664 572 2HB PRO 68 HB3 PRO 68 9.809 15.087 -24.748 573 1HG PRO 68 HG2 PRO 68 9.617 16.745 -22.625 574 2HG PRO 68 HG3 PRO 68 8.279 15.603 -22.982 575 1HD PRO 68 HD2 PRO 68 10.441 15.379 -20.895 576 2HD PRO 68 HD3 PRO 68 8.704 14.957 -20.796 577 H GLY 69 H GLY 69 12.504 13.274 -22.348 578 1HA GLY 69 HA2 GLY 69 13.701 11.955 -24.662 579 2HA GLY 69 HA3 GLY 69 14.465 12.303 -23.109 580 H SER 70 H SER 70 12.650 10.904 -21.391 581 HA SER 70 HA SER 70 13.777 8.273 -21.621 582 1HB SER 70 HB2 SER 70 11.610 9.233 -19.720 583 2HB SER 70 HB3 SER 70 12.720 7.875 -19.479 584 HG SER 70 HG SER 70 14.431 9.313 -19.310 585 H THR 71 H THR 71 11.683 8.956 -23.769 586 HA THR 71 HA THR 71 9.325 7.506 -23.311 587 HB THR 71 H5T THR 71 9.592 9.050 -25.174 588 HG1 THR 71 HG1 THR 71 7.978 7.573 -25.422 589 1HG2 THR 71 1HG2 THR 71 11.891 8.481 -25.922 590 2HG2 THR 71 2HG2 THR 71 11.299 6.918 -26.533 591 3HG2 THR 71 3HG2 THR 71 10.720 8.436 -27.245 592 H SER 72 H SER 72 12.501 6.275 -24.073 593 HA SER 72 HA SER 72 11.859 3.570 -24.795 594 1HB SER 72 HB2 SER 72 14.247 3.171 -24.159 595 2HB SER 72 HB3 SER 72 14.017 4.507 -25.301 596 HG SER 72 HG SER 72 15.447 5.061 -23.574 597 H ALA 73 H ALA 73 11.909 5.149 -21.601 598 HA ALA 73 HA ALA 73 12.308 2.950 -20.001 599 1HB ALA 73 HB1 ALA 73 10.312 5.202 -19.530 600 2HB ALA 73 HB2 ALA 73 11.042 4.158 -18.293 601 3HB ALA 73 HB3 ALA 73 12.065 5.270 -19.229 602 H ALA 74 H ALA 74 9.121 3.777 -21.509 603 HA ALA 74 HA ALA 74 7.664 1.508 -20.469 604 1HB ALA 74 HB1 ALA 74 6.096 2.014 -22.159 605 2HB ALA 74 HB2 ALA 74 6.683 3.515 -21.459 606 3HB ALA 74 HB3 ALA 74 7.278 3.003 -23.064 607 H THR 75 H THR 75 9.928 1.806 -23.230 608 HA THR 75 HA THR 75 9.389 -0.860 -24.249 609 HB THR 75 H5T THR 75 11.815 0.962 -24.604 610 HG1 THR 75 HG1 THR 75 10.758 1.432 -26.571 611 1HG2 THR 75 1HG2 THR 75 12.355 -1.355 -25.289 612 2HG2 THR 75 2HG2 THR 75 10.850 -1.440 -26.234 613 3HG2 THR 75 3HG2 THR 75 12.156 -0.331 -26.714 614 H CYS 76 H CYS 76 11.936 0.437 -22.031 615 HA CYS 76 HA CYS 76 13.142 -2.148 -21.510 616 1HB CYS 76 HB2 CYS 76 13.044 0.382 -19.781 617 2HB CYS 76 HB3 CYS 76 14.163 -0.977 -19.583 618 HG CYS 76 HG CYS 76 13.817 1.103 -22.157 619 H THR 77 H THR 77 10.512 -0.345 -19.881 620 HA THR 77 HA THR 77 9.933 -2.129 -17.838 621 HB THR 77 H5T THR 77 8.022 -0.475 -19.485 622 HG1 THR 77 HG1 THR 77 9.510 0.710 -18.388 623 1HG2 THR 77 1HG2 THR 77 6.671 -2.135 -18.287 624 2HG2 THR 77 2HG2 THR 77 7.567 -1.797 -16.787 625 3HG2 THR 77 3HG2 THR 77 6.540 -0.545 -17.532 626 H ARG 78 H ARG 78 9.426 -2.846 -21.295 627 HA ARG 78 HA ARG 78 7.604 -4.991 -20.869 628 1HB ARG 78 HB2 ARG 78 7.907 -5.507 -23.088 629 2HB ARG 78 HB3 ARG 78 8.459 -3.829 -23.092 630 1HG ARG 78 HG2 ARG 78 10.846 -4.801 -22.877 631 2HG ARG 78 HG3 ARG 78 10.124 -6.379 -23.194 632 1HD ARG 78 HD2 ARG 78 9.230 -5.552 -25.355 633 2HD ARG 78 HD3 ARG 78 9.885 -3.951 -25.015 634 HE ARG 78 H3T ARG 78 12.019 -4.653 -25.554 635 1HH1 ARG 78 2HH1 ARG 78 10.030 -7.542 -25.408 636 2HH1 ARG 78 1HH1 ARG 78 11.278 -8.537 -26.101 637 1HH2 ARG 78 1HH2 ARG 78 13.552 -5.985 -26.444 638 2HH2 ARG 78 2HH2 ARG 78 13.213 -7.675 -26.670 639 H ARG 79 H ARG 79 11.046 -4.756 -20.207 640 HA ARG 79 HA ARG 79 11.219 -7.675 -19.995 641 1HB ARG 79 HB2 ARG 79 13.316 -5.543 -19.357 642 2HB ARG 79 HB3 ARG 79 13.594 -7.284 -19.438 643 1HG ARG 79 HG2 ARG 79 12.997 -7.249 -21.875 644 2HG ARG 79 HG3 ARG 79 12.769 -5.497 -21.771 645 1HD ARG 79 HD2 ARG 79 14.924 -5.873 -22.696 646 2HD ARG 79 HD3 ARG 79 15.125 -5.213 -21.079 647 HE ARG 79 H3T ARG 79 15.412 -8.127 -21.808 648 1HH1 ARG 79 2HH2 ARG 79 16.577 -5.461 -19.843 649 2HH1 ARG 79 1HH2 ARG 79 17.793 -6.450 -19.084 650 1HH2 ARG 79 2HH1 ARG 79 16.977 -9.310 -20.803 651 2HH2 ARG 79 1HH1 ARG 79 18.010 -8.565 -19.619 652 H HIS 80 H HIS 80 11.056 -4.831 -17.898 653 HA HIS 80 HA HIS 80 11.309 -6.153 -15.362 654 1HB HIS 80 HB2 HIS 80 9.486 -3.802 -15.935 655 2HB HIS 80 HB3 HIS 80 10.240 -4.262 -14.415 656 HD1 HIS 80 HD1 HIS 80 10.607 -1.348 -15.755 657 HD2 HIS 80 HD2 HIS 80 13.284 -4.594 -15.923 658 HE1 HIS 80 HE1 HIS 80 12.905 -0.356 -16.199 659 H TYR 81 H TYR 81 8.452 -5.552 -17.454 660 HA TYR 81 HA TYR 81 6.404 -6.480 -15.872 661 1HB TYR 81 HB2 TYR 81 6.447 -5.354 -18.178 662 2HB TYR 81 HB3 TYR 81 6.573 -6.961 -18.857 663 HD1 TYR 81 HD1 TYR 81 4.424 -4.388 -17.512 664 HD2 TYR 81 HD2 TYR 81 4.612 -8.599 -18.445 665 HE1 TYR 81 HE1 TYR 81 1.952 -4.446 -17.739 666 HE2 TYR 81 HE2 TYR 81 2.126 -8.671 -18.585 667 HH TYR 81 HH TYR 81 0.122 -5.719 -18.217 668 H GLU 82 H GLU 82 8.756 -8.552 -17.538 669 HA GLU 82 HA GLU 82 7.223 -10.963 -17.677 670 1HB GLU 82 HB2 GLU 82 10.236 -10.520 -17.594 671 2HB GLU 82 HB3 GLU 82 9.439 -12.052 -17.961 672 1HG GLU 82 HG2 GLU 82 8.297 -10.973 -19.908 673 2HG GLU 82 HG3 GLU 82 9.214 -9.498 -19.590 674 H ARG 83 H ARG 83 8.803 -9.385 -14.980 675 HA ARG 83 HA ARG 83 7.751 -11.604 -13.381 676 1HB ARG 83 HB2 ARG 83 10.522 -10.374 -13.045 677 2HB ARG 83 HB3 ARG 83 9.737 -11.255 -11.739 678 1HG ARG 83 HG2 ARG 83 10.421 -12.443 -14.459 679 2HG ARG 83 HG3 ARG 83 11.326 -12.670 -12.960 680 1HD ARG 83 HD2 ARG 83 9.337 -13.679 -11.887 681 2HD ARG 83 HD3 ARG 83 8.418 -13.511 -13.373 682 HE ARG 83 H3T ARG 83 10.513 -15.483 -12.799 683 1HH1 ARG 83 2HH1 ARG 83 8.643 -14.034 -15.421 684 2HH1 ARG 83 1HH1 ARG 83 8.888 -15.425 -16.446 685 1HH2 ARG 83 2HH2 ARG 83 10.783 -17.183 -14.190 686 2HH2 ARG 83 1HH2 ARG 83 10.073 -17.138 -15.776 687 H LEU 84 H LEU 84 8.051 -8.214 -13.722 688 HA LEU 84 HA LEU 84 7.354 -7.515 -11.031 689 1HB LEU 84 HB2 LEU 84 8.493 -6.118 -12.766 690 2HB LEU 84 HB3 LEU 84 7.002 -6.123 -13.715 691 HG LEU 84 HG LEU 84 5.870 -4.902 -11.852 692 1HD1 LEU 84 1HD1 LEU 84 7.331 -5.494 -9.958 693 2HD1 LEU 84 2HD1 LEU 84 8.728 -4.742 -10.760 694 3HD1 LEU 84 3HD1 LEU 84 7.375 -3.742 -10.202 695 1HD2 LEU 84 1HD2 LEU 84 6.852 -3.808 -13.865 696 2HD2 LEU 84 2HD2 LEU 84 6.898 -2.772 -12.445 697 3HD2 LEU 84 3HD2 LEU 84 8.380 -3.587 -12.979 698 H ILE 85 H ILE 85 5.417 -8.751 -13.703 699 HA ILE 85 HA ILE 85 3.023 -8.813 -12.064 700 HB ILE 85 H5T ILE 85 3.271 -6.372 -12.901 701 1HG1 ILE 85 2HG1 ILE 85 0.680 -7.846 -13.550 702 2HG1 ILE 85 3HG1 ILE 85 1.218 -7.454 -11.916 703 1HG2 ILE 85 1HG2 ILE 85 3.910 -6.969 -15.232 704 2HG2 ILE 85 2HG2 ILE 85 2.231 -7.482 -15.512 705 3HG2 ILE 85 3HG2 ILE 85 2.601 -5.797 -15.098 706 1HD1 ILE 85 1HD1 ILE 85 -0.408 -5.826 -12.665 707 2HD1 ILE 85 2HD1 ILE 85 1.168 -5.036 -12.505 708 3HD1 ILE 85 3HD1 ILE 85 0.551 -5.459 -14.115 709 H LEU 86 H LEU 86 4.518 -9.611 -15.213 710 HA LEU 86 HA LEU 86 2.432 -11.084 -16.290 711 1HB LEU 86 HB2 LEU 86 4.646 -10.751 -17.309 712 2HB LEU 86 HB3 LEU 86 5.363 -11.845 -16.128 713 HG LEU 86 HG LEU 86 3.996 -13.719 -17.062 714 1HD1 LEU 86 1HD1 LEU 86 2.095 -12.477 -18.014 715 2HD1 LEU 86 2HD1 LEU 86 3.179 -11.647 -19.153 716 3HD1 LEU 86 3HD1 LEU 86 2.909 -13.399 -19.279 717 1HD2 LEU 86 1HD2 LEU 86 5.264 -13.939 -19.149 718 2HD2 LEU 86 2HD2 LEU 86 5.652 -12.206 -19.123 719 3HD2 LEU 86 3HD2 LEU 86 6.290 -13.290 -17.861 720 HA PRO 87 HA PRO 87 3.001 -14.750 -13.278 721 1HB PRO 87 HB2 PRO 87 4.112 -14.366 -10.788 722 2HB PRO 87 HB3 PRO 87 5.019 -14.900 -12.234 723 1HG PRO 87 HG2 PRO 87 4.751 -12.090 -11.139 724 2HG PRO 87 HG3 PRO 87 6.247 -12.950 -11.628 725 1HD PRO 87 HD2 PRO 87 5.039 -11.224 -13.281 726 2HD PRO 87 HD3 PRO 87 5.717 -12.742 -13.928 727 H TYR 88 H TYR 88 1.908 -11.530 -12.477 728 HA TYR 88 HA TYR 88 -0.248 -12.768 -10.832 729 1HB TYR 88 HB2 TYR 88 1.185 -10.183 -10.532 730 2HB TYR 88 HB3 TYR 88 -0.522 -10.231 -10.159 731 HD1 TYR 88 HD1 TYR 88 -1.091 -10.580 -7.957 732 HD2 TYR 88 HD2 TYR 88 2.479 -12.466 -9.457 733 HE1 TYR 88 HE1 TYR 88 -0.739 -11.673 -5.754 734 HE2 TYR 88 HE2 TYR 88 2.841 -13.545 -7.253 735 HH TYR 88 HH TYR 88 2.038 -13.843 -5.122 736 H GLU 89 H GLU 89 0.021 -10.186 -13.408 737 HA GLU 89 HA GLU 89 -2.832 -10.150 -13.708 738 1HB GLU 89 HB2 GLU 89 -2.549 -8.911 -15.692 739 2HB GLU 89 HB3 GLU 89 -1.416 -8.348 -14.485 740 1HG GLU 89 HG2 GLU 89 -0.146 -8.296 -16.400 741 2HG GLU 89 HG3 GLU 89 0.345 -9.827 -15.699 742 H ARG 90 H ARG 90 -0.678 -12.644 -14.435 743 HA ARG 90 HA ARG 90 -2.120 -13.981 -16.516 744 1HB ARG 90 HB2 ARG 90 -1.165 -16.071 -15.706 745 2HB ARG 90 HB3 ARG 90 0.013 -14.803 -15.938 746 1HG ARG 90 HG2 ARG 90 0.706 -15.874 -14.004 747 2HG ARG 90 HG3 ARG 90 -0.021 -14.378 -13.463 748 1HD ARG 90 HD2 ARG 90 -0.471 -16.356 -12.000 749 2HD ARG 90 HD3 ARG 90 -1.896 -15.488 -12.507 750 HE ARG 90 H3T ARG 90 -2.704 -17.458 -13.349 751 1HH1 ARG 90 2HH1 ARG 90 0.792 -17.833 -13.426 752 2HH1 ARG 90 1HH1 ARG 90 0.673 -19.467 -14.017 753 1HH2 ARG 90 2HH2 ARG 90 -2.773 -19.517 -14.041 754 2HH2 ARG 90 1HH2 ARG 90 -1.291 -20.386 -14.372 755 H PHE 91 H PHE 91 -3.041 -13.516 -13.087 756 HA PHE 91 HA PHE 91 -5.109 -15.513 -13.255 757 1HB PHE 91 HB2 PHE 91 -6.136 -14.445 -11.302 758 2HB PHE 91 HB3 PHE 91 -4.440 -14.804 -11.107 759 HD1 PHE 91 HD1 PHE 91 -3.599 -13.365 -9.498 760 HD2 PHE 91 HD2 PHE 91 -6.246 -11.697 -12.481 761 HE1 PHE 91 HE1 PHE 91 -3.195 -11.099 -8.618 762 HE2 PHE 91 HE2 PHE 91 -5.770 -9.443 -11.637 763 HZ PHE 91 HZ PHE 91 -4.228 -9.128 -9.720 764 H ILE 92 H ILE 92 -5.018 -12.461 -14.870 765 HA ILE 92 HA ILE 92 -7.916 -12.225 -14.951 766 HB ILE 92 H5T ILE 92 -5.946 -10.423 -15.141 767 1HG1 ILE 92 2HG1 ILE 92 -8.620 -10.133 -16.526 768 2HG1 ILE 92 3HG1 ILE 92 -8.377 -10.105 -14.783 769 1HG2 ILE 92 1HG2 ILE 92 -6.713 -10.726 -18.077 770 2HG2 ILE 92 2HG2 ILE 92 -5.572 -9.570 -17.356 771 3HG2 ILE 92 3HG2 ILE 92 -5.176 -11.283 -17.403 772 1HD1 ILE 92 1HD1 ILE 92 -8.548 -7.826 -15.607 773 2HD1 ILE 92 2HD1 ILE 92 -6.916 -8.121 -14.975 774 3HD1 ILE 92 3HD1 ILE 92 -7.200 -8.073 -16.728 775 H LYS 93 H LYS 93 -5.590 -14.001 -16.799 776 HA LYS 93 HA LYS 93 -7.658 -14.642 -18.874 777 1HB LYS 93 HB2 LYS 93 -6.101 -14.151 -20.643 778 2HB LYS 93 HB3 LYS 93 -6.259 -12.744 -19.599 779 1HG LYS 93 HG2 LYS 93 -4.092 -13.678 -18.405 780 2HG LYS 93 HG3 LYS 93 -3.924 -14.668 -19.864 781 1HD LYS 93 HD2 LYS 93 -4.034 -12.523 -21.219 782 2HD LYS 93 HD3 LYS 93 -4.066 -11.627 -19.684 783 1HE LYS 93 HE2 LYS 93 -1.900 -12.972 -19.108 784 2HE LYS 93 HE3 LYS 93 -1.846 -13.349 -20.839 785 1HZ LYS 93 HZ1 LYS 93 -2.000 -10.816 -21.135 786 2HZ LYS 93 HZ2 LYS 93 -1.711 -10.701 -19.523 787 3HZ LYS 93 HZ3 LYS 93 -0.583 -11.380 -20.465 788 H GLY 94 H GLY 94 -5.117 -15.837 -16.855 789 1HA GLY 94 HA2 GLY 94 -4.921 -18.418 -18.358 790 2HA GLY 94 HA3 GLY 94 -4.049 -17.954 -16.890 791 H GLU 95 H GLU 95 -6.332 -16.962 -15.470 792 HA GLU 95 HA GLU 95 -8.025 -19.365 -14.974 793 1HB GLU 95 HB2 GLU 95 -7.172 -17.081 -13.139 794 2HB GLU 95 HB3 GLU 95 -8.438 -18.235 -12.737 795 1HG GLU 95 HG2 GLU 95 -6.483 -18.972 -11.642 796 2HG GLU 95 HG3 GLU 95 -6.847 -20.111 -12.929 797 H GLU 96 H GLU 96 -8.228 -17.333 -17.016 798 HA GLU 96 HA GLU 96 -9.656 -15.811 -18.027 799 1HB GLU 96 HB2 GLU 96 -9.981 -18.178 -18.682 800 2HB GLU 96 HB3 GLU 96 -11.391 -18.262 -17.622 801 1HG GLU 96 HG2 GLU 96 -12.501 -16.499 -18.945 802 2HG GLU 96 HG3 GLU 96 -11.036 -16.255 -19.897 803 H ASP 97 H ASP 97 -9.918 -14.047 -16.627 804 HA ASP 97 HA ASP 97 -12.578 -13.954 -15.240 805 1HB ASP 97 HB2 ASP 97 -10.615 -14.265 -13.722 806 2HB ASP 97 HB3 ASP 97 -9.972 -12.726 -14.294 807 H LYS 98 H LYS 98 -12.541 -13.222 -17.826 808 HA LYS 98 HA LYS 98 -13.161 -10.352 -17.556 809 1HB LYS 98 HB2 LYS 98 -11.601 -11.531 -19.892 810 2HB LYS 98 HB3 LYS 98 -12.451 -9.985 -19.954 811 1HG LYS 98 HG2 LYS 98 -11.072 -9.170 -18.038 812 2HG LYS 98 HG3 LYS 98 -10.158 -10.693 -18.094 813 1HD LYS 98 HD2 LYS 98 -9.410 -10.213 -20.378 814 2HD LYS 98 HD3 LYS 98 -10.417 -8.749 -20.434 815 1HE LYS 98 HE2 LYS 98 -9.124 -7.773 -18.561 816 2HE LYS 98 HE3 LYS 98 -8.123 -9.226 -18.485 817 1HZ LYS 98 HZ1 LYS 98 -8.273 -7.391 -20.816 818 2HZ LYS 98 HZ2 LYS 98 -7.040 -7.458 -19.744 819 3HZ LYS 98 HZ3 LYS 98 -7.333 -8.730 -20.737 820 HA PRO 99 HA PRO 99 -16.244 -12.386 -20.721 821 1HB PRO 99 HB2 PRO 99 -16.044 -15.212 -19.686 822 2HB PRO 99 HB3 PRO 99 -16.472 -14.638 -21.328 823 1HG PRO 99 HG2 PRO 99 -14.003 -15.613 -20.844 824 2HG PRO 99 HG3 PRO 99 -14.186 -14.114 -21.815 825 1HD PRO 99 HD2 PRO 99 -13.537 -14.371 -18.867 826 2HD PRO 99 HD3 PRO 99 -12.725 -13.378 -20.115 827 H LEU 100 H LEU 100 -18.489 -13.148 -20.251 828 HA LEU 100 HA LEU 100 -19.122 -13.417 -17.337 829 1HB LEU 100 HB2 LEU 100 -20.589 -11.653 -19.357 830 2HB LEU 100 HB3 LEU 100 -21.196 -12.105 -17.780 831 HG LEU 100 HG LEU 100 -18.919 -11.030 -16.899 832 1HD1 LEU 100 1HD1 LEU 100 -19.448 -9.482 -19.485 833 2HD1 LEU 100 2HD1 LEU 100 -18.322 -9.010 -18.193 834 3HD1 LEU 100 3HD1 LEU 100 -18.001 -10.450 -19.155 835 1HD2 LEU 100 1HD2 LEU 100 -21.179 -10.283 -16.298 836 2HD2 LEU 100 2HD2 LEU 100 -20.128 -8.898 -16.615 837 3HD2 LEU 100 3HD2 LEU 100 -21.319 -9.405 -17.838 838 HA PRO 101 HA PRO 101 -21.251 -16.965 -18.745 839 1HB PRO 101 HB2 PRO 101 -23.189 -17.392 -16.837 840 2HB PRO 101 HB3 PRO 101 -21.437 -17.625 -16.564 841 1HG PRO 101 HG2 PRO 101 -23.119 -15.199 -15.872 842 2HG PRO 101 HG3 PRO 101 -21.940 -16.064 -14.836 843 1HD PRO 101 HD2 PRO 101 -21.272 -13.800 -16.188 844 2HD PRO 101 HD3 PRO 101 -20.104 -15.142 -15.999 845 HA PRO 102 HA PRO 102 -24.813 -15.369 -21.036 846 1HB PRO 102 HB2 PRO 102 -25.306 -17.457 -22.700 847 2HB PRO 102 HB3 PRO 102 -23.792 -16.509 -22.801 848 1HG PRO 102 HG2 PRO 102 -24.231 -19.149 -21.356 849 2HG PRO 102 HG3 PRO 102 -22.943 -18.735 -22.534 850 1HD PRO 102 HD2 PRO 102 -22.567 -18.568 -19.825 851 2HD PRO 102 HD3 PRO 102 -21.791 -17.426 -20.964 852 H ILE 103 H ILE 103 -25.039 -17.774 -18.632 853 HA ILE 103 HA ILE 103 -26.587 -19.201 -17.913 854 HB ILE 103 H5T ILE 103 -27.081 -17.055 -16.864 855 1HG1 ILE 103 2HG1 ILE 103 -29.100 -17.610 -15.724 856 2HG1 ILE 103 3HG1 ILE 103 -29.611 -18.727 -16.975 857 1HG2 ILE 103 1HG2 ILE 103 -29.205 -15.865 -17.330 858 2HG2 ILE 103 2HG2 ILE 103 -28.031 -15.724 -18.631 859 3HG2 ILE 103 3HG2 ILE 103 -29.410 -16.835 -18.801 860 1HD1 ILE 103 1HD1 ILE 103 -27.790 -20.269 -16.394 861 2HD1 ILE 103 2HD1 ILE 103 -27.113 -19.076 -15.255 862 3HD1 ILE 103 3HD1 ILE 103 -28.686 -19.831 -14.935 863 H LYS 104 H LYS 104 -26.297 -19.490 -20.699 864 HA LYS 104 HA LYS 104 -28.777 -21.004 -21.255 865 1HB LYS 104 HB2 LYS 104 -28.973 -18.565 -22.096 866 2HB LYS 104 HB3 LYS 104 -27.704 -18.955 -23.234 867 1HG LYS 104 HG2 LYS 104 -29.522 -19.335 -24.556 868 2HG LYS 104 HG3 LYS 104 -29.360 -20.955 -23.904 869 1HD LYS 104 HD2 LYS 104 -31.311 -18.775 -23.042 870 2HD LYS 104 HD3 LYS 104 -31.683 -20.268 -23.902 871 1HE LYS 104 HE2 LYS 104 -30.825 -21.520 -21.833 872 2HE LYS 104 HE3 LYS 104 -30.812 -19.956 -21.003 873 1HZ LYS 104 HZ1 LYS 104 -32.896 -21.102 -20.619 874 2HZ LYS 104 HZ2 LYS 104 -33.224 -19.802 -21.559 875 3HZ LYS 104 HZ3 LYS 104 -33.162 -21.311 -22.217 876 HA PRO 105 HA PRO 105 -24.986 -23.402 -22.640 877 1HB PRO 105 HB2 PRO 105 -26.579 -25.513 -21.205 878 2HB PRO 105 HB3 PRO 105 -24.809 -25.269 -21.252 879 1HG PRO 105 HG2 PRO 105 -26.254 -24.571 -19.060 880 2HG PRO 105 HG3 PRO 105 -24.932 -23.512 -19.653 881 1HD PRO 105 HD2 PRO 105 -27.912 -23.228 -20.118 882 2HD PRO 105 HD3 PRO 105 -26.711 -21.995 -19.636 883 H ARG 106 H ARG 106 -28.454 -24.065 -22.502 884 HA ARG 106 HA ARG 106 -28.649 -24.669 -25.387 885 1HB ARG 106 HB2 ARG 106 -29.780 -26.487 -23.199 886 2HB ARG 106 HB3 ARG 106 -30.208 -26.577 -24.909 887 1HG ARG 106 HG2 ARG 106 -27.807 -27.049 -25.461 888 2HG ARG 106 HG3 ARG 106 -27.452 -27.128 -23.727 889 1HD ARG 106 HD2 ARG 106 -29.439 -28.885 -25.215 890 2HD ARG 106 HD3 ARG 106 -27.804 -29.361 -24.757 891 HE ARG 106 H3T ARG 106 -28.540 -28.906 -22.346 892 1HH1 ARG 106 2HH2 ARG 106 -30.825 -30.141 -24.707 893 2HH1 ARG 106 1HH2 ARG 106 -31.821 -30.875 -23.480 894 1HH2 ARG 106 2HH1 ARG 106 -29.855 -29.865 -20.850 895 2HH2 ARG 106 1HH1 ARG 106 -31.276 -30.725 -21.361 896 H LYS 107 H LYS 107 -31.028 -24.586 -26.060 897 HA LYS 107 HA LYS 107 -32.159 -22.140 -25.189 898 1HB LYS 107 HB2 LYS 107 -32.380 -23.298 -27.414 899 2HB LYS 107 HB3 LYS 107 -33.569 -24.379 -26.701 900 1HG LYS 107 HG2 LYS 107 -33.863 -21.338 -26.698 901 2HG LYS 107 HG3 LYS 107 -34.354 -22.341 -28.061 902 1HD LYS 107 HD2 LYS 107 -35.926 -23.593 -26.588 903 2HD LYS 107 HD3 LYS 107 -35.521 -22.495 -25.253 904 1HE LYS 107 HE2 LYS 107 -36.245 -20.557 -26.621 905 2HE LYS 107 HE3 LYS 107 -36.675 -21.651 -27.943 906 1HZ LYS 107 HZ1 LYS 107 -38.614 -21.087 -26.596 907 2HZ LYS 107 HZ2 LYS 107 -38.316 -22.685 -26.464 908 3HZ LYS 107 HZ3 LYS 107 -37.918 -21.674 -25.242 Start of MODEL 3 1 1H ARG 1 H1 ARG 1 -7.694 0.979 -9.153 2 2H ARG 1 H2 ARG 1 -8.316 0.671 -7.673 3 3H ARG 1 H3 ARG 1 -7.530 -0.511 -8.510 4 HA ARG 1 HA ARG 1 -5.475 0.717 -8.445 5 1HB ARG 1 HB2 ARG 1 -6.583 2.939 -8.180 6 2HB ARG 1 HB3 ARG 1 -6.903 2.582 -6.488 7 1HG ARG 1 HG2 ARG 1 -4.080 2.448 -7.604 8 2HG ARG 1 HG3 ARG 1 -4.822 4.003 -7.238 9 1HD ARG 1 HD2 ARG 1 -5.099 3.331 -4.871 10 2HD ARG 1 HD3 ARG 1 -4.353 1.773 -5.225 11 HE ARG 1 H3T ARG 1 -2.255 2.760 -5.472 12 1HH1 ARG 1 2HH2 ARG 1 -4.583 5.331 -4.964 13 2HH1 ARG 1 1HH2 ARG 1 -3.336 6.517 -4.697 14 1HH2 ARG 1 2HH1 ARG 1 -0.734 4.311 -5.090 15 2HH2 ARG 1 1HH1 ARG 1 -1.222 5.948 -4.768 16 H ALA 2 H ALA 2 -7.556 0.275 -5.531 17 HA ALA 2 HA ALA 2 -5.286 -0.280 -3.871 18 1HB ALA 2 HB1 ALA 2 -7.395 0.637 -3.010 19 2HB ALA 2 HB2 ALA 2 -8.244 -0.867 -3.443 20 3HB ALA 2 HB3 ALA 2 -6.982 -0.881 -2.193 21 H ASP 3 H ASP 3 -7.736 -2.460 -5.288 22 HA ASP 3 HA ASP 3 -6.663 -4.881 -4.382 23 1HB ASP 3 HB2 ASP 3 -8.872 -4.545 -5.483 24 2HB ASP 3 HB3 ASP 3 -8.055 -4.378 -7.039 25 H GLU 4 H GLU 4 -5.683 -3.055 -7.322 26 HA GLU 4 HA GLU 4 -3.858 -5.075 -8.351 27 1HB GLU 4 HB2 GLU 4 -3.847 -2.089 -8.818 28 2HB GLU 4 HB3 GLU 4 -3.058 -3.341 -9.779 29 1HG GLU 4 HG2 GLU 4 -4.869 -3.109 -11.101 30 2HG GLU 4 HG3 GLU 4 -5.618 -4.233 -9.972 31 H GLN 5 H GLN 5 -3.433 -2.188 -6.242 32 HA GLN 5 HA GLN 5 -0.614 -2.718 -6.164 33 1HB GLN 5 HB2 GLN 5 -0.307 -0.865 -4.722 34 2HB GLN 5 HB3 GLN 5 -1.373 -0.446 -6.051 35 1HG GLN 5 HG2 GLN 5 -2.326 0.626 -4.219 36 2HG GLN 5 HG3 GLN 5 -3.320 -0.798 -4.447 37 1HE2 GLN 5 1HE2 GLN 5 -3.710 -2.023 -2.583 38 2HE2 GLN 5 2HE2 GLN 5 -2.771 -1.837 -1.101 39 H ALA 6 H ALA 6 -3.345 -3.746 -4.219 40 HA ALA 6 HA ALA 6 -1.829 -4.736 -1.978 41 1HB ALA 6 HB1 ALA 6 -4.242 -4.312 -1.828 42 2HB ALA 6 HB2 ALA 6 -4.562 -5.544 -3.071 43 3HB ALA 6 HB3 ALA 6 -3.894 -6.016 -1.495 44 H PHE 7 H PHE 7 -2.974 -6.303 -5.077 45 HA PHE 7 HA PHE 7 -1.655 -8.772 -4.315 46 1HB PHE 7 HB2 PHE 7 -2.320 -9.689 -6.295 47 2HB PHE 7 HB3 PHE 7 -3.610 -8.633 -5.760 48 HD1 PHE 7 HD1 PHE 7 -4.858 -7.860 -7.501 49 HD2 PHE 7 HD2 PHE 7 -0.598 -8.257 -8.072 50 HE1 PHE 7 HE1 PHE 7 -5.098 -7.116 -9.848 51 HE2 PHE 7 HE2 PHE 7 -0.839 -7.433 -10.368 52 HZ PHE 7 HZ PHE 7 -3.085 -6.875 -11.292 53 H LEU 8 H LEU 8 -0.578 -6.074 -6.523 54 HA LEU 8 HA LEU 8 1.997 -7.038 -6.827 55 1HB LEU 8 HB2 LEU 8 0.948 -4.220 -6.550 56 2HB LEU 8 HB3 LEU 8 2.627 -4.538 -6.954 57 HG LEU 8 HG LEU 8 0.379 -5.770 -8.601 58 1HD1 LEU 8 1HD1 LEU 8 1.686 -3.043 -8.877 59 2HD1 LEU 8 2HD1 LEU 8 0.745 -3.852 -10.170 60 3HD1 LEU 8 3HD1 LEU 8 -0.029 -3.400 -8.649 61 1HD2 LEU 8 1HD2 LEU 8 2.131 -5.798 -10.347 62 2HD2 LEU 8 2HD2 LEU 8 3.296 -5.107 -9.198 63 3HD2 LEU 8 3HD2 LEU 8 2.622 -6.726 -8.932 64 H VAL 9 H VAL 9 0.802 -5.633 -3.770 65 HA VAL 9 HA VAL 9 3.492 -5.542 -2.586 66 HB VAL 9 H5T VAL 9 0.701 -5.312 -1.456 67 1HG1 VAL 9 1HG1 VAL 9 1.897 -6.553 0.282 68 2HG1 VAL 9 2HG1 VAL 9 3.293 -5.456 0.148 69 3HG1 VAL 9 3HG1 VAL 9 1.735 -4.868 0.770 70 1HG2 VAL 9 1HG2 VAL 9 1.472 -3.080 -0.843 71 2HG2 VAL 9 2HG2 VAL 9 3.132 -3.463 -1.354 72 3HG2 VAL 9 3HG2 VAL 9 1.840 -3.335 -2.554 73 H ALA 10 H ALA 10 0.728 -7.845 -2.311 74 HA ALA 10 HA ALA 10 2.098 -9.866 -1.022 75 1HB ALA 10 HB1 ALA 10 0.488 -11.423 -2.033 76 2HB ALA 10 HB2 ALA 10 -0.314 -9.913 -1.558 77 3HB ALA 10 HB3 ALA 10 0.063 -10.224 -3.266 78 H LEU 11 H LEU 11 2.208 -9.320 -4.582 79 HA LEU 11 HA LEU 11 4.148 -11.338 -5.156 80 1HB LEU 11 HB2 LEU 11 2.896 -10.327 -6.917 81 2HB LEU 11 HB3 LEU 11 3.491 -8.719 -6.546 82 HG LEU 11 HG LEU 11 5.622 -10.751 -7.147 83 1HD1 LEU 11 1HD1 LEU 11 4.061 -11.472 -8.798 84 2HD1 LEU 11 2HD1 LEU 11 3.672 -9.804 -9.269 85 3HD1 LEU 11 3HD1 LEU 11 5.282 -10.492 -9.608 86 1HD2 LEU 11 1HD2 LEU 11 6.138 -8.317 -6.821 87 2HD2 LEU 11 2HD2 LEU 11 6.570 -8.884 -8.433 88 3HD2 LEU 11 3HD2 LEU 11 5.090 -7.930 -8.196 89 H TYR 12 H TYR 12 4.685 -7.830 -4.303 90 HA TYR 12 HA TYR 12 7.480 -7.889 -4.449 91 1HB TYR 12 HB2 TYR 12 6.213 -5.836 -4.150 92 2HB TYR 12 HB3 TYR 12 5.695 -6.331 -2.547 93 HD1 TYR 12 HD1 TYR 12 8.482 -4.982 -4.532 94 HD2 TYR 12 HD2 TYR 12 7.239 -6.325 -0.623 95 HE1 TYR 12 HE1 TYR 12 10.529 -3.978 -3.534 96 HE2 TYR 12 HE2 TYR 12 9.293 -5.325 0.369 97 HH TYR 12 HH TYR 12 11.767 -3.679 -1.635 98 H LYS 13 H LYS 13 5.432 -8.847 -1.657 99 HA LYS 13 HA LYS 13 7.615 -9.592 0.064 100 1HB LYS 13 HB2 LYS 13 5.157 -9.204 0.698 101 2HB LYS 13 HB3 LYS 13 4.825 -10.819 0.058 102 1HG LYS 13 HG2 LYS 13 6.604 -11.702 1.684 103 2HG LYS 13 HG3 LYS 13 6.732 -10.066 2.323 104 1HD LYS 13 HD2 LYS 13 5.287 -11.240 3.812 105 2HD LYS 13 HD3 LYS 13 4.270 -10.150 2.875 106 1HE LYS 13 HE2 LYS 13 3.078 -12.192 2.985 107 2HE LYS 13 HE3 LYS 13 3.718 -12.117 1.343 108 1HZ LYS 13 HZ1 LYS 13 5.522 -13.645 2.067 109 2HZ LYS 13 HZ2 LYS 13 4.906 -13.678 3.581 110 3HZ LYS 13 HZ3 LYS 13 4.056 -14.307 2.341 111 H TYR 14 H TYR 14 5.590 -11.699 -2.128 112 HA TYR 14 HA TYR 14 7.070 -14.066 -1.712 113 1HB TYR 14 HB2 TYR 14 4.897 -13.919 -2.815 114 2HB TYR 14 HB3 TYR 14 5.592 -13.013 -4.147 115 HD1 TYR 14 HD1 TYR 14 5.698 -16.337 -2.423 116 HD2 TYR 14 HD2 TYR 14 6.485 -14.127 -6.048 117 HE1 TYR 14 HE1 TYR 14 6.084 -18.473 -3.641 118 HE2 TYR 14 HE2 TYR 14 6.863 -16.269 -7.266 119 HH TYR 14 HH TYR 14 6.555 -19.459 -5.655 120 H MET 15 H MET 15 7.827 -11.328 -3.832 121 HA MET 15 HA MET 15 9.946 -12.628 -5.286 122 1HB MET 15 HB2 MET 15 9.058 -9.745 -5.010 123 2HB MET 15 HB3 MET 15 10.387 -10.248 -6.070 124 1HG MET 15 HG2 MET 15 7.765 -11.699 -6.128 125 2HG MET 15 HG3 MET 15 7.951 -10.177 -7.011 126 1HE MET 15 HE1 MET 15 10.443 -11.010 -9.834 127 2HE MET 15 HE2 MET 15 9.140 -9.926 -9.295 128 3HE MET 15 HE3 MET 15 10.637 -10.070 -8.345 129 H LYS 16 H LYS 16 9.965 -10.312 -2.482 130 HA LYS 16 HA LYS 16 12.800 -10.450 -2.020 131 1HB LYS 16 HB2 LYS 16 11.234 -8.866 -0.920 132 2HB LYS 16 HB3 LYS 16 10.480 -10.206 -0.044 133 1HG LYS 16 HG2 LYS 16 12.599 -10.668 1.129 134 2HG LYS 16 HG3 LYS 16 13.418 -9.409 0.187 135 1HD LYS 16 HD2 LYS 16 11.914 -7.695 1.168 136 2HD LYS 16 HD3 LYS 16 11.082 -8.959 2.102 137 1HE LYS 16 HE2 LYS 16 13.225 -9.523 3.234 138 2HE LYS 16 HE3 LYS 16 14.050 -8.263 2.308 139 1HZ LYS 16 HZ1 LYS 16 12.601 -6.618 3.382 140 2HZ LYS 16 HZ2 LYS 16 11.839 -7.785 4.240 141 3HZ LYS 16 HZ3 LYS 16 13.416 -7.468 4.512 142 H GLU 17 H GLU 17 10.100 -12.648 -1.187 143 HA GLU 17 HA GLU 17 11.849 -14.572 0.142 144 1HB GLU 17 HB2 GLU 17 8.987 -14.764 -0.846 145 2HB GLU 17 HB3 GLU 17 9.831 -16.089 -0.048 146 1HG GLU 17 HG2 GLU 17 10.215 -14.712 1.943 147 2HG GLU 17 HG3 GLU 17 9.411 -13.338 1.193 148 H ARG 18 H ARG 18 11.731 -13.819 -3.122 149 HA ARG 18 HA ARG 18 12.796 -16.544 -3.879 150 1HB ARG 18 HB2 ARG 18 11.046 -14.562 -5.247 151 2HB ARG 18 HB3 ARG 18 12.416 -15.016 -6.213 152 1HG ARG 18 HG2 ARG 18 10.699 -16.417 -6.873 153 2HG ARG 18 HG3 ARG 18 11.797 -17.435 -5.948 154 1HD ARG 18 HD2 ARG 18 9.246 -16.195 -4.818 155 2HD ARG 18 HD3 ARG 18 9.298 -17.776 -5.590 156 HE ARG 18 H3T ARG 18 10.717 -17.021 -3.066 157 1HH1 ARG 18 2HH2 ARG 18 9.432 -19.647 -5.011 158 2HH1 ARG 18 1HH2 ARG 18 9.883 -20.836 -3.818 159 1HH2 ARG 18 2HH1 ARG 18 11.287 -18.503 -1.685 160 2HH2 ARG 18 1HH1 ARG 18 10.899 -20.197 -1.930 161 H LYS 19 H LYS 19 13.966 -13.769 -2.716 162 HA LYS 19 HA LYS 19 15.961 -12.765 -2.598 163 1HB LYS 19 HB2 LYS 19 17.103 -14.890 -4.448 164 2HB LYS 19 HB3 LYS 19 18.009 -13.692 -3.528 165 1HG LYS 19 HG2 LYS 19 17.101 -14.613 -1.403 166 2HG LYS 19 HG3 LYS 19 16.258 -15.874 -2.325 167 1HD LYS 19 HD2 LYS 19 18.424 -16.723 -3.179 168 2HD LYS 19 HD3 LYS 19 19.272 -15.412 -2.352 169 1HE LYS 19 HE2 LYS 19 19.544 -17.362 -1.013 170 2HE LYS 19 HE3 LYS 19 18.457 -16.269 -0.154 171 1HZ LYS 19 HZ1 LYS 19 16.589 -17.643 -0.917 172 2HZ LYS 19 HZ2 LYS 19 17.595 -18.631 -1.749 173 3HZ LYS 19 HZ3 LYS 19 17.664 -18.574 -0.122 174 H THR 20 H THR 20 13.886 -12.109 -4.529 175 HA THR 20 HA THR 20 15.546 -10.131 -5.987 176 HB THR 20 H5T THR 20 14.843 -11.300 -7.785 177 HG1 THR 20 HG1 THR 20 12.653 -9.583 -7.313 178 1HG2 THR 20 1HG2 THR 20 13.383 -12.984 -6.838 179 2HG2 THR 20 2HG2 THR 20 12.099 -11.779 -6.586 180 3HG2 THR 20 3HG2 THR 20 12.610 -12.215 -8.227 181 HA PRO 21 HA PRO 21 12.779 -7.993 -2.952 182 1HB PRO 21 HB2 PRO 21 14.594 -6.283 -1.845 183 2HB PRO 21 HB3 PRO 21 14.531 -8.015 -1.426 184 1HG PRO 21 HG2 PRO 21 16.329 -6.685 -3.481 185 2HG PRO 21 HG3 PRO 21 16.812 -7.757 -2.124 186 1HD PRO 21 HD2 PRO 21 16.436 -8.710 -4.639 187 2HD PRO 21 HD3 PRO 21 15.956 -9.668 -3.205 188 H ILE 22 H ILE 22 13.260 -7.464 -5.917 189 HA ILE 22 HA ILE 22 12.977 -5.894 -7.454 190 HB ILE 22 H5T ILE 22 10.960 -5.469 -5.365 191 1HG1 ILE 22 2HG1 ILE 22 10.757 -5.891 -8.364 192 2HG1 ILE 22 3HG1 ILE 22 11.123 -7.207 -7.252 193 1HG2 ILE 22 1HG2 ILE 22 11.031 -3.533 -7.713 194 2HG2 ILE 22 2HG2 ILE 22 9.717 -3.734 -6.540 195 3HG2 ILE 22 3HG2 ILE 22 11.270 -3.096 -6.004 196 1HD1 ILE 22 1HD1 ILE 22 8.777 -7.301 -7.708 197 2HD1 ILE 22 2HD1 ILE 22 8.990 -6.797 -6.028 198 3HD1 ILE 22 3HD1 ILE 22 8.545 -5.596 -7.269 199 H GLU 23 H GLU 23 14.492 -4.209 -4.719 200 HA GLU 23 HA GLU 23 15.054 -1.866 -6.147 201 1HB GLU 23 HB2 GLU 23 16.877 -3.457 -4.297 202 2HB GLU 23 HB3 GLU 23 17.144 -1.784 -4.803 203 1HG GLU 23 HG2 GLU 23 14.939 -1.152 -3.790 204 2HG GLU 23 HG3 GLU 23 14.777 -2.799 -3.174 205 H ARG 24 H ARG 24 16.179 -5.049 -6.950 206 HA ARG 24 HA ARG 24 18.377 -4.384 -8.677 207 1HB ARG 24 HB2 ARG 24 18.185 -6.576 -9.524 208 2HB ARG 24 HB3 ARG 24 17.750 -6.681 -7.820 209 1HG ARG 24 HG2 ARG 24 15.295 -6.648 -8.535 210 2HG ARG 24 HG3 ARG 24 15.857 -6.683 -10.212 211 1HD ARG 24 HD2 ARG 24 17.184 -8.835 -9.490 212 2HD ARG 24 HD3 ARG 24 16.108 -8.840 -8.085 213 HE ARG 24 H3T ARG 24 14.323 -9.424 -9.396 214 1HH1 ARG 24 2HH2 ARG 24 16.919 -8.626 -11.627 215 2HH1 ARG 24 1HH2 ARG 24 16.048 -9.255 -12.998 216 1HH2 ARG 24 2HH1 ARG 24 13.294 -10.202 -11.163 217 2HH2 ARG 24 1HH1 ARG 24 14.038 -10.127 -12.738 218 H ILE 25 H ILE 25 15.090 -3.653 -8.995 219 HA ILE 25 HA ILE 25 15.397 -2.743 -11.821 220 HB ILE 25 H5T ILE 25 12.912 -3.574 -10.307 221 1HG1 ILE 25 2HG1 ILE 25 13.991 -4.540 -12.999 222 2HG1 ILE 25 3HG1 ILE 25 14.445 -5.312 -11.487 223 1HG2 ILE 25 1HG2 ILE 25 11.679 -2.886 -12.379 224 2HG2 ILE 25 2HG2 ILE 25 12.409 -1.512 -11.574 225 3HG2 ILE 25 3HG2 ILE 25 13.184 -2.186 -13.013 226 1HD1 ILE 25 1HD1 ILE 25 12.646 -6.556 -12.499 227 2HD1 ILE 25 2HD1 ILE 25 12.112 -5.823 -10.975 228 3HD1 ILE 25 3HD1 ILE 25 11.603 -5.125 -12.530 229 HA PRO 26 HA PRO 26 15.893 0.643 -8.831 230 1HB PRO 26 HB2 PRO 26 17.348 2.388 -10.387 231 2HB PRO 26 HB3 PRO 26 18.026 0.931 -9.602 232 1HG PRO 26 HG2 PRO 26 17.061 1.230 -12.459 233 2HG PRO 26 HG3 PRO 26 18.598 0.509 -11.876 234 1HD PRO 26 HD2 PRO 26 16.442 -1.033 -12.496 235 2HD PRO 26 HD3 PRO 26 17.485 -1.444 -11.102 236 H TYR 27 H TYR 27 14.420 1.090 -12.058 237 HA TYR 27 HA TYR 27 12.671 3.219 -11.050 238 1HB TYR 27 HB2 TYR 27 14.661 3.778 -13.306 239 2HB TYR 27 HB3 TYR 27 13.358 4.835 -12.826 240 HD1 TYR 27 HD1 TYR 27 13.398 5.707 -10.329 241 HD2 TYR 27 HD2 TYR 27 16.818 4.229 -12.500 242 HE1 TYR 27 HE1 TYR 27 14.901 7.027 -8.849 243 HE2 TYR 27 HE2 TYR 27 18.326 5.537 -11.006 244 HH TYR 27 HH TYR 27 17.065 7.592 -8.352 245 H LEU 28 H LEU 28 11.057 3.815 -12.651 246 HA LEU 28 HA LEU 28 10.349 1.881 -14.747 247 1HB LEU 28 HB2 LEU 28 8.815 3.373 -13.326 248 2HB LEU 28 HB3 LEU 28 9.293 4.713 -14.354 249 HG LEU 28 HG LEU 28 7.958 2.120 -15.264 250 1HD1 LEU 28 1HD1 LEU 28 6.493 3.570 -13.896 251 2HD1 LEU 28 2HD1 LEU 28 6.837 4.939 -14.970 252 3HD1 LEU 28 3HD1 LEU 28 5.964 3.516 -15.582 253 1HD2 LEU 28 1HD2 LEU 28 7.558 3.275 -17.397 254 2HD2 LEU 28 2HD2 LEU 28 8.512 4.678 -16.842 255 3HD2 LEU 28 3HD2 LEU 28 9.269 3.085 -17.110 256 H GLY 29 H GLY 29 11.093 5.391 -14.990 257 1HA GLY 29 HA2 GLY 29 13.390 4.744 -16.824 258 2HA GLY 29 HA3 GLY 29 12.254 6.061 -17.143 259 H PHE 30 H PHE 30 11.961 7.486 -14.981 260 HA PHE 30 HA PHE 30 14.512 7.856 -13.478 261 1HB PHE 30 HB2 PHE 30 12.878 10.053 -14.817 262 2HB PHE 30 HB3 PHE 30 14.232 10.321 -13.730 263 HD1 PHE 30 HD1 PHE 30 13.339 10.084 -17.139 264 HD2 PHE 30 HD2 PHE 30 16.515 9.144 -14.377 265 HE1 PHE 30 HE1 PHE 30 14.976 10.074 -19.016 266 HE2 PHE 30 HE2 PHE 30 18.142 9.126 -16.255 267 HZ PHE 30 HZ PHE 30 17.372 9.590 -18.576 268 H LYS 31 H LYS 31 11.857 6.592 -12.823 269 HA LYS 31 HA LYS 31 11.248 8.080 -10.329 270 1HB LYS 31 HB2 LYS 31 9.812 9.052 -12.155 271 2HB LYS 31 HB3 LYS 31 9.134 7.450 -12.454 272 1HG LYS 31 HG2 LYS 31 8.126 7.424 -10.212 273 2HG LYS 31 HG3 LYS 31 8.935 8.953 -9.804 274 1HD LYS 31 HD2 LYS 31 7.656 10.099 -11.596 275 2HD LYS 31 HD3 LYS 31 6.860 8.564 -12.011 276 1HE LYS 31 HE2 LYS 31 5.906 8.436 -9.725 277 2HE LYS 31 HE3 LYS 31 6.720 9.944 -9.291 278 1HZ LYS 31 HZ1 LYS 31 5.390 11.078 -10.990 279 2HZ LYS 31 HZ2 LYS 31 4.637 9.686 -11.398 280 3HZ LYS 31 HZ3 LYS 31 4.407 10.338 -9.920 281 H GLN 32 H GLN 32 10.016 6.759 -8.821 282 HA GLN 32 HA GLN 32 10.767 4.059 -8.597 283 1HB GLN 32 HB2 GLN 32 9.843 5.630 -6.801 284 2HB GLN 32 HB3 GLN 32 8.241 5.340 -7.478 285 1HG GLN 32 HG2 GLN 32 8.941 2.756 -7.055 286 2HG GLN 32 HG3 GLN 32 10.038 3.495 -5.905 287 1HE2 GLN 32 1HE2 GLN 32 6.711 2.636 -6.619 288 2HE2 GLN 32 2HE2 GLN 32 6.051 3.214 -5.089 289 H ILE 33 H ILE 33 9.876 2.076 -9.225 290 HA ILE 33 HA ILE 33 7.942 1.783 -11.254 291 HB ILE 33 H5T ILE 33 8.836 -0.031 -8.987 292 1HG1 ILE 33 2HG1 ILE 33 10.594 0.538 -10.623 293 2HG1 ILE 33 3HG1 ILE 33 10.190 -1.166 -10.616 294 1HG2 ILE 33 1HG2 ILE 33 6.694 -0.923 -9.573 295 2HG2 ILE 33 2HG2 ILE 33 7.040 -0.792 -11.316 296 3HG2 ILE 33 3HG2 ILE 33 7.927 -1.943 -10.301 297 1HD1 ILE 33 1HD1 ILE 33 8.932 -0.927 -12.724 298 2HD1 ILE 33 2HD1 ILE 33 9.241 0.826 -12.727 299 3HD1 ILE 33 3HD1 ILE 33 10.580 -0.312 -12.894 300 H ASN 34 H ASN 34 5.828 1.636 -11.362 301 HA ASN 34 HA ASN 34 4.044 1.923 -8.987 302 1HB ASN 34 HB2 ASN 34 4.849 4.144 -9.974 303 2HB ASN 34 HB3 ASN 34 4.068 3.684 -11.484 304 1HD2 ASN 34 1HD2 ASN 34 2.531 5.345 -11.485 305 2HD2 ASN 34 2HD2 ASN 34 1.259 5.437 -10.289 306 H LEU 35 H LEU 35 4.476 -0.401 -10.281 307 HA LEU 35 HA LEU 35 3.601 -1.074 -12.696 308 1HB LEU 35 HB2 LEU 35 4.686 -2.384 -10.634 309 2HB LEU 35 HB3 LEU 35 3.092 -3.069 -10.557 310 HG LEU 35 HG LEU 35 4.396 -4.576 -11.745 311 1HD1 LEU 35 1HD1 LEU 35 3.008 -3.108 -14.006 312 2HD1 LEU 35 2HD1 LEU 35 3.498 -4.798 -13.952 313 3HD1 LEU 35 3HD1 LEU 35 2.214 -4.222 -12.868 314 1HD2 LEU 35 1HD2 LEU 35 5.309 -2.466 -13.723 315 2HD2 LEU 35 2HD2 LEU 35 6.272 -3.011 -12.322 316 3HD2 LEU 35 3HD2 LEU 35 5.836 -4.146 -13.605 317 H TRP 36 H TRP 36 1.179 -0.851 -10.032 318 HA TRP 36 HA TRP 36 -1.052 -2.014 -11.341 319 1HB TRP 36 HB2 TRP 36 -2.411 -0.808 -9.919 320 2HB TRP 36 HB3 TRP 36 -0.974 -1.210 -8.991 321 HD1 TRP 36 HD1 TRP 36 0.743 0.920 -8.554 322 HE1 TRP 36 HE1 TRP 36 0.341 3.428 -8.434 323 HE3 TRP 36 HE3 TRP 36 -3.939 1.081 -10.637 324 HZ2 TRP 36 HZ2 TRP 36 -1.858 5.273 -8.916 325 HZ3 TRP 36 HZ3 TRP 36 -5.179 3.235 -10.760 326 HH2 TRP 36 HH2 TRP 36 -4.141 5.333 -9.928 327 H THR 37 H THR 37 0.440 1.203 -11.823 328 HA THR 37 HA THR 37 -1.645 2.318 -13.514 329 HB THR 37 H5T THR 37 1.231 3.194 -13.074 330 HG1 THR 37 HG1 THR 37 -0.172 3.340 -11.290 331 1HG2 THR 37 1HG2 THR 37 -1.079 4.616 -14.473 332 2HG2 THR 37 2HG2 THR 37 0.433 5.392 -13.955 333 3HG2 THR 37 3HG2 THR 37 0.474 4.145 -15.204 334 H MET 38 H MET 38 1.702 1.065 -14.306 335 HA MET 38 HA MET 38 1.098 1.140 -17.128 336 1HB MET 38 HB2 MET 38 3.080 -0.427 -17.368 337 2HB MET 38 HB3 MET 38 3.341 1.224 -16.846 338 1HG MET 38 HG2 MET 38 3.094 -0.923 -14.758 339 2HG MET 38 HG3 MET 38 4.565 -0.794 -15.706 340 1HE MET 38 HE1 MET 38 6.510 1.161 -13.245 341 2HE MET 38 HE2 MET 38 5.779 -0.452 -13.136 342 3HE MET 38 HE3 MET 38 6.490 0.104 -14.666 343 H PHE 39 H PHE 39 0.281 -1.262 -14.666 344 HA PHE 39 HA PHE 39 -0.483 -3.326 -16.539 345 1HB PHE 39 HB2 PHE 39 -0.210 -3.821 -14.206 346 2HB PHE 39 HB3 PHE 39 -1.429 -2.652 -13.744 347 HD1 PHE 39 HD1 PHE 39 -3.578 -3.444 -13.261 348 HD2 PHE 39 HD2 PHE 39 -1.127 -5.617 -16.069 349 HE1 PHE 39 HE1 PHE 39 -5.387 -5.120 -13.551 350 HE2 PHE 39 HE2 PHE 39 -2.944 -7.281 -16.366 351 HZ PHE 39 HZ PHE 39 -5.073 -7.025 -15.120 352 H GLN 40 H GLN 40 -2.578 -0.757 -14.928 353 HA GLN 40 HA GLN 40 -4.768 -1.421 -16.677 354 1HB GLN 40 HB2 GLN 40 -5.830 0.623 -16.037 355 2HB GLN 40 HB3 GLN 40 -5.162 -0.159 -14.611 356 1HG GLN 40 HG2 GLN 40 -3.442 1.454 -14.378 357 2HG GLN 40 HG3 GLN 40 -3.648 2.087 -16.011 358 1HE2 GLN 40 1HE2 GLN 40 -4.099 3.080 -12.931 359 2HE2 GLN 40 2HE2 GLN 40 -5.497 4.102 -13.221 360 H ALA 41 H ALA 41 -2.010 0.772 -17.214 361 HA ALA 41 HA ALA 41 -2.950 1.865 -19.674 362 1HB ALA 41 HB1 ALA 41 -0.951 2.612 -18.287 363 2HB ALA 41 HB2 ALA 41 -0.070 1.226 -18.965 364 3HB ALA 41 HB3 ALA 41 -0.680 2.507 -20.031 365 H ALA 42 H ALA 42 -0.877 -1.093 -19.127 366 HA ALA 42 HA ALA 42 -0.899 -1.972 -21.814 367 1HB ALA 42 HB1 ALA 42 -0.765 -3.623 -19.252 368 2HB ALA 42 HB2 ALA 42 -0.244 -4.151 -20.865 369 3HB ALA 42 HB3 ALA 42 0.618 -2.841 -20.041 370 H GLN 43 H GLN 43 -3.435 -2.319 -19.336 371 HA GLN 43 HA GLN 43 -4.928 -4.214 -20.943 372 1HB GLN 43 HB2 GLN 43 -5.586 -2.669 -18.422 373 2HB GLN 43 HB3 GLN 43 -6.737 -3.742 -19.210 374 1HG GLN 43 HG2 GLN 43 -4.016 -4.583 -18.125 375 2HG GLN 43 HG3 GLN 43 -5.569 -4.887 -17.361 376 1HE2 GLN 43 1HE2 GLN 43 -3.371 -6.730 -18.576 377 2HE2 GLN 43 2HE2 GLN 43 -4.311 -7.786 -19.610 378 H LYS 44 H LYS 44 -4.768 -0.717 -20.889 379 HA LYS 44 HA LYS 44 -7.328 -0.554 -22.438 380 1HB LYS 44 HB2 LYS 44 -5.573 1.568 -21.152 381 2HB LYS 44 HB3 LYS 44 -7.015 1.925 -22.114 382 1HG LYS 44 HG2 LYS 44 -8.438 0.681 -20.539 383 2HG LYS 44 HG3 LYS 44 -7.044 0.252 -19.558 384 1HD LYS 44 HD2 LYS 44 -8.192 3.034 -19.983 385 2HD LYS 44 HD3 LYS 44 -8.221 2.067 -18.500 386 1HE LYS 44 HE2 LYS 44 -5.674 2.155 -18.498 387 2HE LYS 44 HE3 LYS 44 -5.779 3.276 -19.862 388 1HZ LYS 44 HZ1 LYS 44 -7.235 4.663 -18.309 389 2HZ LYS 44 HZ2 LYS 44 -6.623 3.748 -17.076 390 3HZ LYS 44 HZ3 LYS 44 -5.630 4.644 -18.032 391 H LEU 45 H LEU 45 -3.899 0.441 -22.727 392 HA LEU 45 HA LEU 45 -4.192 1.025 -25.537 393 1HB LEU 45 HB2 LEU 45 -1.743 0.571 -23.764 394 2HB LEU 45 HB3 LEU 45 -1.660 1.043 -25.440 395 HG LEU 45 HG LEU 45 -1.274 2.971 -24.271 396 1HD1 LEU 45 1HD1 LEU 45 -2.999 4.504 -24.962 397 2HD1 LEU 45 2HD1 LEU 45 -2.880 3.215 -26.174 398 3HD1 LEU 45 3HD1 LEU 45 -4.215 3.217 -24.998 399 1HD2 LEU 45 1HD2 LEU 45 -2.647 4.027 -22.592 400 2HD2 LEU 45 2HD2 LEU 45 -3.773 2.658 -22.590 401 3HD2 LEU 45 3HD2 LEU 45 -2.083 2.447 -22.056 402 H GLY 46 H GLY 46 -4.603 -1.993 -24.293 403 1HA GLY 46 HA2 GLY 46 -4.715 -3.159 -26.698 404 2HA GLY 46 HA3 GLY 46 -3.014 -3.417 -26.352 405 H GLY 47 H GLY 47 -5.255 -3.735 -23.625 406 1HA GLY 47 HA2 GLY 47 -5.736 -5.601 -22.334 407 2HA GLY 47 HA3 GLY 47 -6.125 -6.335 -23.883 408 H TYR 48 H TYR 48 -2.881 -5.341 -22.778 409 HA TYR 48 HA TYR 48 -0.922 -6.403 -22.940 410 1HB TYR 48 HB2 TYR 48 -1.514 -7.563 -20.944 411 2HB TYR 48 HB3 TYR 48 -2.497 -8.732 -21.804 412 HD1 TYR 48 HD1 TYR 48 -1.491 -10.523 -23.187 413 HD2 TYR 48 HD2 TYR 48 0.923 -7.810 -20.858 414 HE1 TYR 48 HE1 TYR 48 0.458 -12.055 -23.427 415 HE2 TYR 48 HE2 TYR 48 2.868 -9.353 -21.087 416 HH TYR 48 HH TYR 48 2.658 -12.432 -22.912 417 H GLU 49 H GLU 49 -3.312 -8.450 -24.728 418 HA GLU 49 HA GLU 49 -1.117 -9.687 -26.157 419 1HB GLU 49 HB2 GLU 49 -4.115 -9.629 -26.730 420 2HB GLU 49 HB3 GLU 49 -2.933 -10.631 -27.583 421 1HG GLU 49 HG2 GLU 49 -2.299 -11.665 -25.366 422 2HG GLU 49 HG3 GLU 49 -3.647 -10.798 -24.627 423 H THR 50 H THR 50 -3.431 -7.100 -27.075 424 HA THR 50 HA THR 50 -2.298 -6.813 -29.717 425 HB THR 50 H5T THR 50 -4.101 -4.833 -28.299 426 HG1 THR 50 HG1 THR 50 -5.799 -6.029 -29.190 427 1HG2 THR 50 1HG2 THR 50 -3.760 -5.590 -31.238 428 2HG2 THR 50 2HG2 THR 50 -4.964 -4.446 -30.600 429 3HG2 THR 50 3HG2 THR 50 -3.244 -4.067 -30.486 430 H ILE 51 H ILE 51 -1.489 -5.503 -26.521 431 HA ILE 51 HA ILE 51 0.113 -3.335 -27.731 432 HB ILE 51 H5T ILE 51 -0.809 -2.724 -25.707 433 1HG1 ILE 51 2HG1 ILE 51 1.983 -3.448 -24.814 434 2HG1 ILE 51 3HG1 ILE 51 1.739 -2.291 -26.102 435 1HG2 ILE 51 1HG2 ILE 51 -1.361 -4.895 -24.728 436 2HG2 ILE 51 2HG2 ILE 51 0.371 -5.180 -24.372 437 3HG2 ILE 51 3HG2 ILE 51 -0.530 -3.893 -23.560 438 1HD1 ILE 51 1HD1 ILE 51 0.636 -2.052 -23.292 439 2HD1 ILE 51 2HD1 ILE 51 1.994 -1.158 -23.970 440 3HD1 ILE 51 3HD1 ILE 51 0.353 -0.884 -24.604 441 H THR 52 H THR 52 0.671 -6.639 -26.513 442 HA THR 52 HA THR 52 3.526 -6.572 -26.988 443 HB THR 52 H5T THR 52 1.610 -8.943 -26.944 444 HG1 THR 52 HG1 THR 52 1.502 -7.999 -25.009 445 1HG2 THR 52 1HG2 THR 52 3.626 -10.219 -26.258 446 2HG2 THR 52 2HG2 THR 52 3.790 -9.587 -27.899 447 3HG2 THR 52 3HG2 THR 52 4.635 -8.784 -26.555 448 H ALA 53 H ALA 53 0.745 -7.715 -29.011 449 HA ALA 53 HA ALA 53 2.392 -8.468 -31.210 450 1HB ALA 53 HB1 ALA 53 0.113 -9.315 -30.763 451 2HB ALA 53 HB2 ALA 53 -0.559 -7.709 -31.127 452 3HB ALA 53 HB3 ALA 53 0.247 -8.650 -32.399 453 H ARG 54 H ARG 54 1.611 -5.217 -30.243 454 HA ARG 54 HA ARG 54 2.336 -4.246 -32.998 455 1HB ARG 54 HB2 ARG 54 0.117 -3.120 -31.264 456 2HB ARG 54 HB3 ARG 54 0.665 -2.463 -32.803 457 1HG ARG 54 HG2 ARG 54 -0.005 -4.605 -33.923 458 2HG ARG 54 HG3 ARG 54 -0.696 -5.152 -32.376 459 1HD ARG 54 HD2 ARG 54 -2.158 -3.148 -32.335 460 2HD ARG 54 HD3 ARG 54 -1.485 -2.631 -33.893 461 HE ARG 54 H3T ARG 54 -2.469 -5.284 -34.185 462 1HH1 ARG 54 2HH2 ARG 54 -3.785 -2.066 -33.742 463 2HH1 ARG 54 1HH2 ARG 54 -5.276 -2.465 -34.548 464 1HH2 ARG 54 2HH1 ARG 54 -4.399 -5.724 -35.204 465 2HH2 ARG 54 1HH1 ARG 54 -5.608 -4.483 -35.352 466 H ARG 55 H ARG 55 3.414 -4.192 -29.901 467 HA ARG 55 HA ARG 55 4.934 -2.971 -28.748 468 1HB ARG 55 HB2 ARG 55 5.687 -1.737 -31.425 469 2HB ARG 55 HB3 ARG 55 6.623 -1.666 -29.929 470 1HG ARG 55 HG2 ARG 55 6.818 -4.162 -29.952 471 2HG ARG 55 HG3 ARG 55 5.964 -4.190 -31.507 472 1HD ARG 55 HD2 ARG 55 7.751 -2.700 -32.466 473 2HD ARG 55 HD3 ARG 55 8.601 -2.779 -30.927 474 HE ARG 55 H3T ARG 55 9.231 -4.999 -31.328 475 1HH1 ARG 55 2HH2 ARG 55 7.170 -3.960 -33.972 476 2HH1 ARG 55 1HH2 ARG 55 7.632 -5.309 -34.974 477 1HH2 ARG 55 2HH1 ARG 55 9.769 -6.684 -32.661 478 2HH2 ARG 55 1HH1 ARG 55 9.062 -6.806 -34.245 479 H GLN 56 H GLN 56 2.838 -2.191 -27.894 480 HA GLN 56 HA GLN 56 2.425 0.678 -28.553 481 1HB GLN 56 HB2 GLN 56 0.343 -1.202 -27.443 482 2HB GLN 56 HB3 GLN 56 0.152 0.529 -27.658 483 1HG GLN 56 HG2 GLN 56 0.631 0.296 -30.091 484 2HG GLN 56 HG3 GLN 56 0.761 -1.453 -29.883 485 1HE2 GLN 56 1HE2 GLN 56 -1.188 -2.693 -29.449 486 2HE2 GLN 56 2HE2 GLN 56 -2.767 -1.926 -29.608 487 H TRP 57 H TRP 57 4.148 -0.935 -26.418 488 HA TRP 57 HA TRP 57 3.824 0.286 -23.862 489 1HB TRP 57 HB2 TRP 57 6.543 -0.063 -25.069 490 2HB TRP 57 HB3 TRP 57 5.967 -0.311 -23.439 491 HD1 TRP 57 HD1 TRP 57 6.397 -2.138 -26.709 492 HE1 TRP 57 HE1 TRP 57 5.457 -4.529 -26.584 493 HE3 TRP 57 HE3 TRP 57 4.378 -1.971 -22.025 494 HZ2 TRP 57 HZ2 TRP 57 3.754 -6.055 -24.788 495 HZ3 TRP 57 HZ3 TRP 57 3.070 -3.881 -21.132 496 HH2 TRP 57 HH2 TRP 57 2.740 -5.929 -22.514 497 H LYS 58 H LYS 58 5.075 1.696 -26.905 498 HA LYS 58 HA LYS 58 5.818 4.269 -25.939 499 1HB LYS 58 HB2 LYS 58 4.478 3.632 -28.603 500 2HB LYS 58 HB3 LYS 58 5.466 5.038 -28.225 501 1HG LYS 58 HG2 LYS 58 6.396 2.158 -28.526 502 2HG LYS 58 HG3 LYS 58 6.772 3.545 -29.548 503 1HD LYS 58 HD2 LYS 58 7.956 4.586 -27.548 504 2HD LYS 58 HD3 LYS 58 7.734 3.040 -26.700 505 1HE LYS 58 HE2 LYS 58 8.911 1.919 -28.673 506 2HE LYS 58 HE3 LYS 58 9.279 3.544 -29.275 507 1HZ LYS 58 HZ1 LYS 58 10.195 2.324 -26.731 508 2HZ LYS 58 HZ2 LYS 58 11.136 2.836 -27.965 509 3HZ LYS 58 HZ3 LYS 58 10.347 3.927 -27.028 510 H HIS 59 H HIS 59 2.561 2.965 -26.228 511 HA HIS 59 HA HIS 59 1.439 5.663 -25.665 512 1HB HIS 59 HB2 HIS 59 0.035 3.052 -26.275 513 2HB HIS 59 HB3 HIS 59 -0.724 4.630 -26.025 514 HD1 HIS 59 HD1 HIS 59 -0.068 6.564 -27.948 515 HD2 HIS 59 HD2 HIS 59 0.893 2.544 -28.726 516 HE1 HIS 59 HE1 HIS 59 0.428 6.418 -30.443 517 H ILE 60 H ILE 60 2.547 2.909 -23.884 518 HA ILE 60 HA ILE 60 0.922 3.502 -21.484 519 HB ILE 60 H5T ILE 60 3.531 1.960 -21.800 520 1HG1 ILE 60 2HG1 ILE 60 0.631 1.132 -21.385 521 2HG1 ILE 60 3HG1 ILE 60 1.688 0.765 -22.737 522 1HG2 ILE 60 1HG2 ILE 60 1.907 2.485 -19.277 523 2HG2 ILE 60 2HG2 ILE 60 3.275 1.353 -19.406 524 3HG2 ILE 60 3HG2 ILE 60 3.549 3.059 -19.613 525 1HD1 ILE 60 1HD1 ILE 60 3.169 -0.497 -21.049 526 2HD1 ILE 60 2HD1 ILE 60 1.812 -0.352 -19.916 527 3HD1 ILE 60 3HD1 ILE 60 1.597 -1.228 -21.432 528 H TYR 61 H TYR 61 4.172 4.303 -22.828 529 HA TYR 61 HA TYR 61 4.946 6.268 -20.954 530 1HB TYR 61 HB2 TYR 61 6.556 5.656 -22.506 531 2HB TYR 61 HB3 TYR 61 5.463 5.762 -23.867 532 HD1 TYR 61 HD1 TYR 61 7.556 7.784 -21.536 533 HD2 TYR 61 HD2 TYR 61 5.128 7.785 -25.105 534 HE1 TYR 61 HE1 TYR 61 8.365 10.076 -22.110 535 HE2 TYR 61 HE2 TYR 61 5.946 10.052 -25.674 536 HH TYR 61 HH TYR 61 7.265 11.794 -25.065 537 H ASP 62 H ASP 62 2.715 6.632 -23.749 538 HA ASP 62 HA ASP 62 2.098 9.347 -23.327 539 1HB ASP 62 HB2 ASP 62 1.458 8.063 -25.335 540 2HB ASP 62 HB3 ASP 62 0.174 7.292 -24.403 541 H GLU 63 H GLU 63 0.301 6.495 -21.938 542 HA GLU 63 HA GLU 63 -1.270 8.028 -20.166 543 1HB GLU 63 HB2 GLU 63 -1.613 5.631 -20.719 544 2HB GLU 63 HB3 GLU 63 -0.178 5.219 -19.793 545 1HG GLU 63 HG2 GLU 63 -1.976 4.668 -18.429 546 2HG GLU 63 HG3 GLU 63 -1.321 6.121 -17.717 547 H LEU 64 H LEU 64 2.127 6.972 -19.643 548 HA LEU 64 HA LEU 64 2.283 7.677 -16.873 549 1HB LEU 64 HB2 LEU 64 4.526 7.861 -18.929 550 2HB LEU 64 HB3 LEU 64 4.711 7.859 -17.186 551 HG LEU 64 HG LEU 64 3.863 5.545 -18.919 552 1HD1 LEU 64 1HD1 LEU 64 5.913 4.540 -18.218 553 2HD1 LEU 64 2HD1 LEU 64 6.250 6.122 -18.934 554 3HD1 LEU 64 3HD1 LEU 64 6.290 5.931 -17.168 555 1HD2 LEU 64 1HD2 LEU 64 2.609 5.370 -16.809 556 2HD2 LEU 64 2HD2 LEU 64 3.896 4.161 -16.865 557 3HD2 LEU 64 3HD2 LEU 64 4.109 5.631 -15.886 558 H GLY 65 H GLY 65 2.319 9.750 -19.734 559 1HA GLY 65 HA2 GLY 65 2.551 12.024 -19.978 560 2HA GLY 65 HA3 GLY 65 2.194 12.212 -18.255 561 H GLY 66 H GLY 66 4.945 10.394 -19.702 562 1HA GLY 66 HA2 GLY 66 6.810 11.533 -17.833 563 2HA GLY 66 HA3 GLY 66 7.189 10.476 -19.187 564 H ASN 67 H ASN 67 9.018 12.225 -18.650 565 HA ASN 67 HA ASN 67 8.987 14.783 -19.868 566 1HB ASN 67 HB2 ASN 67 10.685 13.999 -18.290 567 2HB ASN 67 HB3 ASN 67 11.187 12.735 -19.406 568 1HD2 ASN 67 1HD2 ASN 67 11.644 16.057 -18.514 569 2HD2 ASN 67 2HD2 ASN 67 12.781 16.421 -19.802 570 HA PRO 68 HA PRO 68 8.732 14.011 -24.249 571 1HB PRO 68 HB2 PRO 68 10.975 16.033 -24.428 572 2HB PRO 68 HB3 PRO 68 9.505 15.895 -25.448 573 1HG PRO 68 HG2 PRO 68 9.566 17.681 -23.425 574 2HG PRO 68 HG3 PRO 68 8.109 16.662 -23.662 575 1HD PRO 68 HD2 PRO 68 10.337 16.326 -21.659 576 2HD PRO 68 HD3 PRO 68 8.573 16.117 -21.448 577 H GLY 69 H GLY 69 11.921 13.581 -22.752 578 1HA GLY 69 HA2 GLY 69 12.577 11.627 -24.954 579 2HA GLY 69 HA3 GLY 69 13.791 12.592 -24.099 580 H SER 70 H SER 70 10.921 10.774 -22.931 581 HA SER 70 HA SER 70 12.747 8.790 -21.592 582 1HB SER 70 HB2 SER 70 10.092 9.858 -20.548 583 2HB SER 70 HB3 SER 70 10.959 8.464 -19.880 584 HG SER 70 HG SER 70 12.744 9.859 -19.484 585 H THR 71 H THR 71 11.597 8.954 -24.256 586 HA THR 71 HA THR 71 9.194 7.594 -24.708 587 HB THR 71 H5T THR 71 10.167 7.518 -27.097 588 HG1 THR 71 HG1 THR 71 12.056 8.674 -27.380 589 1HG2 THR 71 1HG2 THR 71 10.165 10.175 -25.611 590 2HG2 THR 71 2HG2 THR 71 10.068 9.958 -27.372 591 3HG2 THR 71 3HG2 THR 71 8.760 9.369 -26.338 592 H SER 72 H SER 72 11.939 6.025 -23.622 593 HA SER 72 HA SER 72 10.878 3.421 -24.652 594 1HB SER 72 HB2 SER 72 13.790 4.193 -24.322 595 2HB SER 72 HB3 SER 72 13.212 2.534 -24.582 596 HG SER 72 HG SER 72 13.807 3.676 -26.538 597 H ALA 73 H ALA 73 11.424 5.225 -21.787 598 HA ALA 73 HA ALA 73 11.903 3.287 -19.915 599 1HB ALA 73 HB1 ALA 73 9.754 5.448 -19.773 600 2HB ALA 73 HB2 ALA 73 10.549 4.652 -18.398 601 3HB ALA 73 HB3 ALA 73 11.492 5.689 -19.480 602 H ALA 74 H ALA 74 8.718 3.727 -21.527 603 HA ALA 74 HA ALA 74 7.326 1.517 -20.297 604 1HB ALA 74 HB1 ALA 74 6.986 2.793 -23.004 605 2HB ALA 74 HB2 ALA 74 5.836 1.757 -22.113 606 3HB ALA 74 HB3 ALA 74 6.259 3.350 -21.471 607 H THR 75 H THR 75 9.569 1.640 -23.088 608 HA THR 75 HA THR 75 9.126 -1.100 -23.924 609 HB THR 75 H5T THR 75 11.528 0.742 -24.329 610 HG1 THR 75 HG1 THR 75 9.210 0.294 -25.890 611 1HG2 THR 75 1HG2 THR 75 12.077 -1.575 -24.967 612 2HG2 THR 75 2HG2 THR 75 10.572 -1.695 -25.908 613 3HG2 THR 75 3HG2 THR 75 11.862 -0.577 -26.412 614 H CYS 76 H CYS 76 11.622 0.443 -21.816 615 HA CYS 76 HA CYS 76 12.869 -2.011 -20.969 616 1HB CYS 76 HB2 CYS 76 12.620 0.735 -19.640 617 2HB CYS 76 HB3 CYS 76 13.704 -0.552 -19.093 618 HG CYS 76 HG CYS 76 15.039 -0.797 -21.350 619 H THR 77 H THR 77 10.027 -0.223 -19.714 620 HA THR 77 HA THR 77 9.587 -1.796 -17.396 621 HB THR 77 H5T THR 77 7.647 -0.301 -19.189 622 HG1 THR 77 HG1 THR 77 9.147 0.949 -18.131 623 1HG2 THR 77 1HG2 THR 77 7.134 -1.483 -16.440 624 2HG2 THR 77 2HG2 THR 77 6.149 -0.224 -17.232 625 3HG2 THR 77 3HG2 THR 77 6.251 -1.834 -17.951 626 H ARG 78 H ARG 78 8.973 -2.703 -20.793 627 HA ARG 78 HA ARG 78 7.159 -4.835 -20.226 628 1HB ARG 78 HB2 ARG 78 8.115 -3.683 -22.489 629 2HB ARG 78 HB3 ARG 78 9.161 -5.098 -22.472 630 1HG ARG 78 HG2 ARG 78 6.118 -5.119 -22.322 631 2HG ARG 78 HG3 ARG 78 7.047 -5.276 -23.817 632 1HD ARG 78 HD2 ARG 78 7.993 -7.401 -23.052 633 2HD ARG 78 HD3 ARG 78 7.107 -7.258 -21.519 634 HE ARG 78 H3T ARG 78 5.205 -7.032 -23.577 635 1HH1 ARG 78 2HH2 ARG 78 7.318 -9.552 -22.334 636 2HH1 ARG 78 1HH2 ARG 78 6.095 -10.784 -22.577 637 1HH2 ARG 78 2HH1 ARG 78 3.779 -8.733 -24.022 638 2HH2 ARG 78 1HH1 ARG 78 4.132 -10.292 -23.348 639 H ARG 79 H ARG 79 10.677 -4.535 -19.807 640 HA ARG 79 HA ARG 79 11.056 -7.384 -19.518 641 1HB ARG 79 HB2 ARG 79 12.815 -5.239 -18.286 642 2HB ARG 79 HB3 ARG 79 13.314 -6.837 -18.802 643 1HG ARG 79 HG2 ARG 79 13.229 -6.197 -21.146 644 2HG ARG 79 HG3 ARG 79 12.486 -4.639 -20.769 645 1HD ARG 79 HD2 ARG 79 15.278 -5.515 -19.974 646 2HD ARG 79 HD3 ARG 79 14.848 -4.331 -21.220 647 HE ARG 79 H3T ARG 79 13.678 -3.488 -18.762 648 1HH1 ARG 79 2HH2 ARG 79 16.868 -3.639 -20.198 649 2HH1 ARG 79 1HH2 ARG 79 17.540 -2.520 -19.044 650 1HH2 ARG 79 2HH1 ARG 79 14.655 -2.259 -17.182 651 2HH2 ARG 79 1HH1 ARG 79 16.289 -1.707 -17.424 652 H HIS 80 H HIS 80 10.564 -4.649 -17.338 653 HA HIS 80 HA HIS 80 10.823 -6.082 -14.863 654 1HB HIS 80 HB2 HIS 80 9.146 -3.594 -15.350 655 2HB HIS 80 HB3 HIS 80 9.903 -4.107 -13.850 656 HD1 HIS 80 HD1 HIS 80 10.427 -1.230 -15.222 657 HD2 HIS 80 HD2 HIS 80 12.888 -4.636 -15.428 658 HE1 HIS 80 HE1 HIS 80 12.760 -0.388 -15.784 659 H TYR 81 H TYR 81 7.975 -5.189 -16.834 660 HA TYR 81 HA TYR 81 5.874 -6.262 -15.375 661 1HB TYR 81 HB2 TYR 81 5.871 -4.839 -17.452 662 2HB TYR 81 HB3 TYR 81 6.253 -6.261 -18.399 663 HD1 TYR 81 HD1 TYR 81 4.507 -8.255 -18.294 664 HD2 TYR 81 HD2 TYR 81 3.673 -4.169 -17.169 665 HE1 TYR 81 HE1 TYR 81 2.074 -8.643 -18.655 666 HE2 TYR 81 HE2 TYR 81 1.258 -4.544 -17.604 667 HH TYR 81 HH TYR 81 -0.344 -6.032 -18.288 668 H GLU 82 H GLU 82 8.197 -8.088 -17.412 669 HA GLU 82 HA GLU 82 6.657 -10.510 -17.628 670 1HB GLU 82 HB2 GLU 82 9.539 -9.733 -18.119 671 2HB GLU 82 HB3 GLU 82 9.027 -11.422 -18.202 672 1HG GLU 82 HG2 GLU 82 7.480 -11.008 -19.959 673 2HG GLU 82 HG3 GLU 82 7.593 -9.265 -19.776 674 H ARG 83 H ARG 83 8.415 -9.130 -14.989 675 HA ARG 83 HA ARG 83 8.003 -11.701 -13.583 676 1HB ARG 83 HB2 ARG 83 10.358 -9.803 -13.286 677 2HB ARG 83 HB3 ARG 83 9.976 -11.016 -12.078 678 1HG ARG 83 HG2 ARG 83 10.696 -11.671 -14.965 679 2HG ARG 83 HG3 ARG 83 11.805 -11.660 -13.600 680 1HD ARG 83 HD2 ARG 83 11.279 -13.916 -13.814 681 2HD ARG 83 HD3 ARG 83 10.255 -13.376 -12.468 682 HE ARG 83 H3T ARG 83 8.881 -13.147 -14.999 683 1HH1 ARG 83 2HH1 ARG 83 9.737 -15.635 -12.681 684 2HH1 ARG 83 1HH1 ARG 83 8.360 -16.614 -13.110 685 1HH2 ARG 83 2HH2 ARG 83 7.219 -14.375 -15.488 686 2HH2 ARG 83 1HH2 ARG 83 6.957 -15.919 -14.704 687 H LEU 84 H LEU 84 7.492 -8.260 -13.487 688 HA LEU 84 HA LEU 84 6.729 -8.392 -10.642 689 1HB LEU 84 HB2 LEU 84 7.173 -6.183 -12.635 690 2HB LEU 84 HB3 LEU 84 6.141 -5.904 -11.242 691 HG LEU 84 HG LEU 84 7.841 -6.554 -9.687 692 1HD1 LEU 84 1HD1 LEU 84 9.700 -6.891 -12.076 693 2HD1 LEU 84 2HD1 LEU 84 10.203 -6.854 -10.370 694 3HD1 LEU 84 3HD1 LEU 84 9.192 -8.164 -10.943 695 1HD2 LEU 84 1HD2 LEU 84 9.347 -4.621 -10.012 696 2HD2 LEU 84 2HD2 LEU 84 8.820 -4.494 -11.704 697 3HD2 LEU 84 3HD2 LEU 84 7.663 -4.220 -10.380 698 H ILE 85 H ILE 85 4.984 -8.709 -13.686 699 HA ILE 85 HA ILE 85 2.645 -9.225 -11.966 700 HB ILE 85 H5T ILE 85 2.707 -6.760 -12.711 701 1HG1 ILE 85 2HG1 ILE 85 0.241 -8.412 -13.363 702 2HG1 ILE 85 3HG1 ILE 85 0.787 -8.023 -11.734 703 1HG2 ILE 85 1HG2 ILE 85 3.348 -7.219 -15.094 704 2HG2 ILE 85 2HG2 ILE 85 1.731 -7.907 -15.366 705 3HG2 ILE 85 3HG2 ILE 85 1.917 -6.205 -14.939 706 1HD1 ILE 85 1HD1 ILE 85 -0.001 -5.994 -13.843 707 2HD1 ILE 85 2HD1 ILE 85 -1.034 -6.532 -12.523 708 3HD1 ILE 85 3HD1 ILE 85 0.451 -5.628 -12.162 709 H LEU 86 H LEU 86 4.188 -9.770 -15.138 710 HA LEU 86 HA LEU 86 2.173 -11.357 -16.228 711 1HB LEU 86 HB2 LEU 86 4.302 -10.596 -17.287 712 2HB LEU 86 HB3 LEU 86 5.155 -11.856 -16.390 713 HG LEU 86 HG LEU 86 3.914 -13.596 -17.619 714 1HD1 LEU 86 1HD1 LEU 86 1.778 -12.500 -18.067 715 2HD1 LEU 86 2HD1 LEU 86 2.585 -11.261 -19.062 716 3HD1 LEU 86 3HD1 LEU 86 2.528 -12.955 -19.600 717 1HD2 LEU 86 1HD2 LEU 86 5.095 -11.487 -19.465 718 2HD2 LEU 86 2HD2 LEU 86 6.015 -12.710 -18.552 719 3HD2 LEU 86 3HD2 LEU 86 4.897 -13.214 -19.828 720 HA PRO 87 HA PRO 87 2.971 -15.090 -13.521 721 1HB PRO 87 HB2 PRO 87 4.062 -14.912 -11.038 722 2HB PRO 87 HB3 PRO 87 5.044 -15.120 -12.520 723 1HG PRO 87 HG2 PRO 87 4.408 -12.536 -11.064 724 2HG PRO 87 HG3 PRO 87 6.013 -13.144 -11.587 725 1HD PRO 87 HD2 PRO 87 4.624 -11.372 -13.049 726 2HD PRO 87 HD3 PRO 87 5.557 -12.659 -13.852 727 H TYR 88 H TYR 88 1.766 -11.989 -12.451 728 HA TYR 88 HA TYR 88 -0.140 -13.313 -10.556 729 1HB TYR 88 HB2 TYR 88 1.388 -10.774 -10.451 730 2HB TYR 88 HB3 TYR 88 -0.295 -10.650 -9.994 731 HD1 TYR 88 HD1 TYR 88 2.404 -13.241 -9.363 732 HD2 TYR 88 HD2 TYR 88 -0.601 -10.631 -7.708 733 HE1 TYR 88 HE1 TYR 88 2.928 -14.086 -7.086 734 HE2 TYR 88 HE2 TYR 88 -0.066 -11.469 -5.426 735 HH TYR 88 HH TYR 88 2.433 -13.970 -4.850 736 H GLU 89 H GLU 89 -0.257 -10.569 -13.015 737 HA GLU 89 HA GLU 89 -3.121 -10.704 -13.113 738 1HB GLU 89 HB2 GLU 89 -3.059 -9.474 -15.162 739 2HB GLU 89 HB3 GLU 89 -2.002 -8.784 -13.953 740 1HG GLU 89 HG2 GLU 89 -0.822 -8.534 -15.938 741 2HG GLU 89 HG3 GLU 89 -0.058 -9.915 -15.191 742 H ARG 90 H ARG 90 -0.838 -12.973 -14.116 743 HA ARG 90 HA ARG 90 -2.169 -14.468 -16.092 744 1HB ARG 90 HB2 ARG 90 0.090 -14.784 -14.966 745 2HB ARG 90 HB3 ARG 90 -0.744 -15.574 -13.630 746 1HG ARG 90 HG2 ARG 90 -1.598 -17.313 -15.168 747 2HG ARG 90 HG3 ARG 90 -0.878 -16.474 -16.553 748 1HD ARG 90 HD2 ARG 90 0.652 -17.681 -14.206 749 2HD ARG 90 HD3 ARG 90 0.486 -18.386 -15.824 750 HE ARG 90 H3T ARG 90 1.628 -15.654 -15.698 751 1HH1 ARG 90 2HH2 ARG 90 2.476 -19.055 -15.915 752 2HH1 ARG 90 1HH2 ARG 90 4.057 -18.693 -16.551 753 1HH2 ARG 90 2HH1 ARG 90 3.558 -15.276 -16.482 754 2HH2 ARG 90 1HH1 ARG 90 4.653 -16.576 -16.912 755 H PHE 91 H PHE 91 -3.030 -14.207 -12.571 756 HA PHE 91 HA PHE 91 -4.949 -16.351 -12.886 757 1HB PHE 91 HB2 PHE 91 -5.815 -15.650 -10.639 758 2HB PHE 91 HB3 PHE 91 -4.129 -16.084 -10.732 759 HD1 PHE 91 HD1 PHE 91 -3.067 -15.029 -8.966 760 HD2 PHE 91 HD2 PHE 91 -5.802 -12.721 -11.371 761 HE1 PHE 91 HE1 PHE 91 -2.444 -12.979 -7.724 762 HE2 PHE 91 HE2 PHE 91 -5.178 -10.682 -10.129 763 HZ PHE 91 HZ PHE 91 -3.494 -10.799 -8.307 764 H ILE 92 H ILE 92 -5.281 -13.161 -14.070 765 HA ILE 92 HA ILE 92 -8.173 -13.807 -14.486 766 HB ILE 92 H5T ILE 92 -8.447 -11.394 -14.944 767 1HG1 ILE 92 2HG1 ILE 92 -6.969 -9.823 -13.618 768 2HG1 ILE 92 3HG1 ILE 92 -5.736 -11.071 -13.630 769 1HG2 ILE 92 1HG2 ILE 92 -7.777 -12.279 -12.120 770 2HG2 ILE 92 2HG2 ILE 92 -8.751 -10.867 -12.533 771 3HG2 ILE 92 3HG2 ILE 92 -9.316 -12.485 -12.962 772 1HD1 ILE 92 1HD1 ILE 92 -5.767 -10.988 -16.157 773 2HD1 ILE 92 2HD1 ILE 92 -7.021 -9.733 -16.062 774 3HD1 ILE 92 3HD1 ILE 92 -5.400 -9.418 -15.430 775 H LYS 93 H LYS 93 -5.280 -14.068 -16.021 776 HA LYS 93 HA LYS 93 -6.621 -13.780 -18.698 777 1HB LYS 93 HB2 LYS 93 -4.640 -12.313 -18.030 778 2HB LYS 93 HB3 LYS 93 -3.650 -13.770 -18.077 779 1HG LYS 93 HG2 LYS 93 -4.150 -14.053 -20.489 780 2HG LYS 93 HG3 LYS 93 -5.327 -12.730 -20.414 781 1HD LYS 93 HD2 LYS 93 -3.341 -11.801 -21.367 782 2HD LYS 93 HD3 LYS 93 -3.474 -11.191 -19.711 783 1HE LYS 93 HE2 LYS 93 -1.928 -13.195 -19.069 784 2HE LYS 93 HE3 LYS 93 -1.598 -13.338 -20.802 785 1HZ LYS 93 HZ1 LYS 93 -0.788 -11.014 -20.714 786 2HZ LYS 93 HZ2 LYS 93 -1.187 -10.940 -19.108 787 3HZ LYS 93 HZ3 LYS 93 0.006 -11.925 -19.595 788 H GLY 94 H GLY 94 -4.991 -16.076 -16.562 789 1HA GLY 94 HA2 GLY 94 -5.341 -18.200 -18.686 790 2HA GLY 94 HA3 GLY 94 -4.046 -18.172 -17.488 791 H GLU 95 H GLU 95 -6.120 -17.210 -15.407 792 HA GLU 95 HA GLU 95 -7.812 -19.653 -15.162 793 1HB GLU 95 HB2 GLU 95 -6.524 -18.078 -12.890 794 2HB GLU 95 HB3 GLU 95 -7.608 -19.458 -12.701 795 1HG GLU 95 HG2 GLU 95 -5.968 -20.897 -13.917 796 2HG GLU 95 HG3 GLU 95 -4.848 -19.531 -13.985 797 H GLU 96 H GLU 96 -8.108 -16.839 -16.129 798 HA GLU 96 HA GLU 96 -9.567 -14.980 -15.936 799 1HB GLU 96 HB2 GLU 96 -11.556 -15.647 -17.148 800 2HB GLU 96 HB3 GLU 96 -10.073 -16.309 -17.808 801 1HG GLU 96 HG2 GLU 96 -10.560 -18.517 -16.839 802 2HG GLU 96 HG3 GLU 96 -12.028 -17.891 -16.086 803 H ASP 97 H ASP 97 -9.280 -15.267 -13.289 804 HA ASP 97 HA ASP 97 -11.740 -15.918 -11.969 805 1HB ASP 97 HB2 ASP 97 -9.379 -16.112 -11.099 806 2HB ASP 97 HB3 ASP 97 -9.362 -14.360 -10.894 807 H LYS 98 H LYS 98 -12.233 -13.794 -13.963 808 HA LYS 98 HA LYS 98 -13.754 -12.026 -12.216 809 1HB LYS 98 HB2 LYS 98 -12.931 -9.932 -13.141 810 2HB LYS 98 HB3 LYS 98 -11.586 -10.817 -12.441 811 1HG LYS 98 HG2 LYS 98 -10.890 -11.576 -14.706 812 2HG LYS 98 HG3 LYS 98 -12.243 -10.713 -15.421 813 1HD LYS 98 HD2 LYS 98 -9.902 -9.439 -13.950 814 2HD LYS 98 HD3 LYS 98 -10.182 -9.467 -15.693 815 1HE LYS 98 HE2 LYS 98 -12.432 -8.268 -15.145 816 2HE LYS 98 HE3 LYS 98 -11.735 -7.971 -13.547 817 1HZ LYS 98 HZ1 LYS 98 -9.859 -6.857 -14.714 818 2HZ LYS 98 HZ2 LYS 98 -10.615 -7.093 -16.156 819 3HZ LYS 98 HZ3 LYS 98 -11.283 -6.120 -15.028 820 HA PRO 99 HA PRO 99 -16.594 -12.390 -15.654 821 1HB PRO 99 HB2 PRO 99 -18.250 -10.233 -15.345 822 2HB PRO 99 HB3 PRO 99 -18.208 -11.600 -14.192 823 1HG PRO 99 HG2 PRO 99 -16.763 -8.937 -13.985 824 2HG PRO 99 HG3 PRO 99 -17.783 -9.738 -12.746 825 1HD PRO 99 HD2 PRO 99 -15.083 -9.957 -12.721 826 2HD PRO 99 HD3 PRO 99 -16.119 -11.343 -12.279 827 H LEU 100 H LEU 100 -14.183 -10.031 -15.692 828 HA LEU 100 HA LEU 100 -14.820 -9.280 -18.502 829 1HB LEU 100 HB2 LEU 100 -14.048 -7.329 -16.304 830 2HB LEU 100 HB3 LEU 100 -14.106 -6.939 -18.019 831 HG LEU 100 HG LEU 100 -16.532 -7.785 -16.374 832 1HD1 LEU 100 1HD1 LEU 100 -17.161 -5.414 -16.475 833 2HD1 LEU 100 2HD1 LEU 100 -15.621 -5.627 -15.626 834 3HD1 LEU 100 3HD1 LEU 100 -15.633 -5.028 -17.301 835 1HD2 LEU 100 1HD2 LEU 100 -17.818 -6.880 -18.284 836 2HD2 LEU 100 2HD2 LEU 100 -16.308 -6.577 -19.170 837 3HD2 LEU 100 3HD2 LEU 100 -16.818 -8.239 -18.791 838 HA PRO 101 HA PRO 101 -10.420 -10.862 -17.773 839 1HB PRO 101 HB2 PRO 101 -11.183 -12.331 -20.291 840 2HB PRO 101 HB3 PRO 101 -10.151 -12.880 -18.938 841 1HG PRO 101 HG2 PRO 101 -12.708 -13.745 -19.140 842 2HG PRO 101 HG3 PRO 101 -12.041 -13.264 -17.544 843 1HD PRO 101 HD2 PRO 101 -13.818 -11.658 -19.388 844 2HD PRO 101 HD3 PRO 101 -13.915 -11.901 -17.631 845 HA PRO 102 HA PRO 102 -8.348 -7.972 -20.409 846 1HB PRO 102 HB2 PRO 102 -6.725 -10.362 -21.348 847 2HB PRO 102 HB3 PRO 102 -6.161 -8.701 -20.988 848 1HG PRO 102 HG2 PRO 102 -5.925 -10.600 -19.099 849 2HG PRO 102 HG3 PRO 102 -6.604 -9.009 -18.631 850 1HD PRO 102 HD2 PRO 102 -8.075 -11.580 -19.233 851 2HD PRO 102 HD3 PRO 102 -8.344 -10.403 -17.913 852 H ILE 103 H ILE 103 -9.373 -7.043 -22.032 853 HA ILE 103 HA ILE 103 -10.929 -6.945 -23.730 854 HB ILE 103 H5T ILE 103 -9.817 -7.032 -25.929 855 1HG1 ILE 103 2HG1 ILE 103 -7.374 -8.078 -24.426 856 2HG1 ILE 103 3HG1 ILE 103 -8.360 -9.020 -25.538 857 1HG2 ILE 103 1HG2 ILE 103 -8.251 -5.680 -23.696 858 2HG2 ILE 103 2HG2 ILE 103 -8.272 -5.209 -25.408 859 3HG2 ILE 103 3HG2 ILE 103 -9.740 -5.084 -24.446 860 1HD1 ILE 103 1HD1 ILE 103 -6.377 -8.275 -26.686 861 2HD1 ILE 103 2HD1 ILE 103 -7.780 -7.438 -27.379 862 3HD1 ILE 103 3HD1 ILE 103 -6.684 -6.586 -26.264 863 H LYS 104 H LYS 104 -11.706 -9.247 -22.485 864 HA LYS 104 HA LYS 104 -12.896 -10.786 -24.674 865 1HB LYS 104 HB2 LYS 104 -10.565 -11.752 -24.424 866 2HB LYS 104 HB3 LYS 104 -10.987 -12.234 -22.783 867 1HG LYS 104 HG2 LYS 104 -12.852 -13.645 -23.736 868 2HG LYS 104 HG3 LYS 104 -12.375 -13.118 -25.359 869 1HD LYS 104 HD2 LYS 104 -10.135 -14.158 -25.039 870 2HD LYS 104 HD3 LYS 104 -10.583 -14.608 -23.390 871 1HE LYS 104 HE2 LYS 104 -10.816 -16.567 -24.726 872 2HE LYS 104 HE3 LYS 104 -12.436 -16.025 -24.286 873 1HZ LYS 104 HZ1 LYS 104 -11.122 -15.525 -26.910 874 2HZ LYS 104 HZ2 LYS 104 -12.280 -16.641 -26.639 875 3HZ LYS 104 HZ3 LYS 104 -12.641 -15.057 -26.519 876 HA PRO 105 HA PRO 105 -14.954 -10.060 -20.524 877 1HB PRO 105 HB2 PRO 105 -17.311 -8.911 -21.347 878 2HB PRO 105 HB3 PRO 105 -15.772 -8.015 -21.165 879 1HG PRO 105 HG2 PRO 105 -16.931 -9.207 -23.702 880 2HG PRO 105 HG3 PRO 105 -16.309 -7.544 -23.444 881 1HD PRO 105 HD2 PRO 105 -14.756 -9.469 -24.550 882 2HD PRO 105 HD3 PRO 105 -14.067 -8.292 -23.392 883 H ARG 106 H ARG 106 -16.769 -11.005 -19.466 884 HA ARG 106 HA ARG 106 -18.035 -13.337 -20.862 885 1HB ARG 106 HB2 ARG 106 -15.922 -13.680 -19.368 886 2HB ARG 106 HB3 ARG 106 -17.004 -13.374 -18.009 887 1HG ARG 106 HG2 ARG 106 -18.392 -15.348 -18.716 888 2HG ARG 106 HG3 ARG 106 -17.347 -15.553 -20.128 889 1HD ARG 106 HD2 ARG 106 -16.686 -17.146 -18.444 890 2HD ARG 106 HD3 ARG 106 -15.414 -15.934 -18.626 891 HE ARG 106 H3T ARG 106 -17.453 -15.613 -16.461 892 1HH1 ARG 106 2HH2 ARG 106 -14.113 -16.483 -17.182 893 2HH1 ARG 106 1HH2 ARG 106 -13.577 -15.987 -15.587 894 1HH2 ARG 106 2HH1 ARG 106 -16.690 -15.257 -14.385 895 2HH2 ARG 106 1HH1 ARG 106 -14.989 -15.464 -14.059 896 H LYS 107 H LYS 107 -18.862 -10.474 -19.533 897 HA LYS 107 HA LYS 107 -21.506 -11.486 -18.681 898 1HB LYS 107 HB2 LYS 107 -20.108 -11.178 -16.657 899 2HB LYS 107 HB3 LYS 107 -19.790 -9.502 -17.132 900 1HG LYS 107 HG2 LYS 107 -22.199 -8.971 -16.900 901 2HG LYS 107 HG3 LYS 107 -22.534 -10.665 -16.479 902 1HD LYS 107 HD2 LYS 107 -21.117 -10.448 -14.452 903 2HD LYS 107 HD3 LYS 107 -20.681 -8.802 -14.924 904 1HE LYS 107 HE2 LYS 107 -22.346 -8.627 -13.222 905 2HE LYS 107 HE3 LYS 107 -23.070 -8.113 -14.747 906 1HZ LYS 107 HZ1 LYS 107 -24.539 -9.590 -13.486 907 2HZ LYS 107 HZ2 LYS 107 -24.140 -10.303 -14.896 908 3HZ LYS 107 HZ3 LYS 107 -23.437 -10.792 -13.501 Start of MODEL 4 1 1H ARG 1 H1 ARG 1 -6.815 1.683 -8.638 2 2H ARG 1 H2 ARG 1 -7.535 1.081 -7.296 3 3H ARG 1 H3 ARG 1 -6.601 0.116 -8.249 4 HA ARG 1 HA ARG 1 -4.629 1.357 -7.753 5 1HB ARG 1 HB2 ARG 1 -5.813 3.532 -7.322 6 2HB ARG 1 HB3 ARG 1 -6.436 2.872 -5.818 7 1HG ARG 1 HG2 ARG 1 -3.884 2.528 -5.192 8 2HG ARG 1 HG3 ARG 1 -3.587 3.667 -6.506 9 1HD ARG 1 HD2 ARG 1 -5.408 4.110 -4.104 10 2HD ARG 1 HD3 ARG 1 -3.760 4.707 -4.228 11 HE ARG 1 H3T ARG 1 -6.141 5.669 -5.749 12 1HH1 ARG 1 1HH1 ARG 1 -2.753 6.195 -5.035 13 2HH1 ARG 1 2HH1 ARG 1 -2.784 7.814 -5.680 14 1HH2 ARG 1 2HH2 ARG 1 -6.095 7.707 -6.581 15 2HH2 ARG 1 1HH2 ARG 1 -4.625 8.634 -6.541 16 H ALA 2 H ALA 2 -6.932 0.682 -5.053 17 HA ALA 2 HA ALA 2 -4.724 -0.093 -3.363 18 1HB ALA 2 HB1 ALA 2 -6.787 0.961 -2.506 19 2HB ALA 2 HB2 ALA 2 -7.734 -0.457 -3.020 20 3HB ALA 2 HB3 ALA 2 -6.506 -0.616 -1.747 21 H ASP 3 H ASP 3 -7.000 -1.948 -5.389 22 HA ASP 3 HA ASP 3 -6.273 -4.532 -4.298 23 1HB ASP 3 HB2 ASP 3 -7.510 -3.726 -6.964 24 2HB ASP 3 HB3 ASP 3 -7.346 -5.382 -6.387 25 H GLU 4 H GLU 4 -4.983 -2.517 -6.974 26 HA GLU 4 HA GLU 4 -3.218 -4.533 -8.097 27 1HB GLU 4 HB2 GLU 4 -2.968 -1.527 -8.185 28 2HB GLU 4 HB3 GLU 4 -2.125 -2.708 -9.183 29 1HG GLU 4 HG2 GLU 4 -3.733 -2.171 -10.673 30 2HG GLU 4 HG3 GLU 4 -4.641 -3.425 -9.832 31 H GLN 5 H GLN 5 -2.834 -1.852 -5.734 32 HA GLN 5 HA GLN 5 -0.107 -2.469 -5.247 33 1HB GLN 5 HB2 GLN 5 -2.128 -0.899 -3.611 34 2HB GLN 5 HB3 GLN 5 -0.423 -1.046 -3.162 35 1HG GLN 5 HG2 GLN 5 -1.436 0.070 -5.804 36 2HG GLN 5 HG3 GLN 5 -0.912 1.036 -4.418 37 1HE2 GLN 5 1HE2 GLN 5 1.461 0.658 -3.702 38 2HE2 GLN 5 2HE2 GLN 5 2.600 0.336 -5.000 39 H ALA 6 H ALA 6 -3.093 -3.574 -3.567 40 HA ALA 6 HA ALA 6 -1.745 -5.083 -1.557 41 1HB ALA 6 HB1 ALA 6 -3.872 -6.344 -1.416 42 2HB ALA 6 HB2 ALA 6 -4.157 -4.596 -1.492 43 3HB ALA 6 HB3 ALA 6 -4.421 -5.604 -2.934 44 H PHE 7 H PHE 7 -2.738 -6.074 -4.921 45 HA PHE 7 HA PHE 7 -1.533 -8.675 -4.499 46 1HB PHE 7 HB2 PHE 7 -2.372 -9.343 -6.481 47 2HB PHE 7 HB3 PHE 7 -3.550 -8.224 -5.851 48 HD1 PHE 7 HD1 PHE 7 -0.539 -7.991 -8.186 49 HD2 PHE 7 HD2 PHE 7 -4.726 -7.183 -7.526 50 HE1 PHE 7 HE1 PHE 7 -0.715 -7.041 -10.439 51 HE2 PHE 7 HE2 PHE 7 -4.895 -6.226 -9.804 52 HZ PHE 7 HZ PHE 7 -2.883 -6.131 -11.269 53 H LEU 8 H LEU 8 -0.022 -5.680 -5.179 54 HA LEU 8 HA LEU 8 2.224 -7.116 -6.546 55 1HB LEU 8 HB2 LEU 8 1.232 -4.400 -6.851 56 2HB LEU 8 HB3 LEU 8 2.840 -4.345 -6.184 57 HG LEU 8 HG LEU 8 2.844 -4.231 -8.599 58 1HD1 LEU 8 1HD1 LEU 8 4.577 -5.850 -9.060 59 2HD1 LEU 8 2HD1 LEU 8 4.767 -5.242 -7.412 60 3HD1 LEU 8 3HD1 LEU 8 4.084 -6.855 -7.694 61 1HD2 LEU 8 1HD2 LEU 8 2.152 -6.002 -10.054 62 2HD2 LEU 8 2HD2 LEU 8 1.784 -7.081 -8.702 63 3HD2 LEU 8 3HD2 LEU 8 0.799 -5.625 -8.980 64 H VAL 9 H VAL 9 1.131 -5.713 -3.497 65 HA VAL 9 HA VAL 9 3.788 -5.895 -2.234 66 HB VAL 9 H5T VAL 9 0.973 -5.638 -1.148 67 1HG1 VAL 9 1HG1 VAL 9 2.000 -5.362 1.108 68 2HG1 VAL 9 2HG1 VAL 9 2.143 -7.013 0.508 69 3HG1 VAL 9 3HG1 VAL 9 3.553 -5.928 0.456 70 1HG2 VAL 9 1HG2 VAL 9 2.135 -3.607 -2.103 71 2HG2 VAL 9 2HG2 VAL 9 1.794 -3.465 -0.373 72 3HG2 VAL 9 3HG2 VAL 9 3.440 -3.844 -0.931 73 H ALA 10 H ALA 10 0.896 -7.998 -2.538 74 HA ALA 10 HA ALA 10 1.988 -10.254 -1.224 75 1HB ALA 10 HB1 ALA 10 0.268 -11.518 -2.451 76 2HB ALA 10 HB2 ALA 10 -0.397 -9.989 -1.843 77 3HB ALA 10 HB3 ALA 10 0.031 -10.158 -3.563 78 H LEU 11 H LEU 11 2.156 -9.495 -4.800 79 HA LEU 11 HA LEU 11 3.933 -11.664 -5.317 80 1HB LEU 11 HB2 LEU 11 2.750 -10.486 -7.101 81 2HB LEU 11 HB3 LEU 11 3.686 -9.026 -6.776 82 HG LEU 11 HG LEU 11 5.791 -10.223 -7.408 83 1HD1 LEU 11 1HD1 LEU 11 5.217 -12.549 -6.914 84 2HD1 LEU 11 2HD1 LEU 11 4.016 -12.543 -8.225 85 3HD1 LEU 11 3HD1 LEU 11 5.740 -12.346 -8.585 86 1HD2 LEU 11 1HD2 LEU 11 4.505 -8.949 -9.031 87 2HD2 LEU 11 2HD2 LEU 11 5.274 -10.341 -9.811 88 3HD2 LEU 11 3HD2 LEU 11 3.532 -10.378 -9.450 89 H TYR 12 H TYR 12 4.768 -8.251 -4.355 90 HA TYR 12 HA TYR 12 7.565 -8.473 -4.467 91 1HB TYR 12 HB2 TYR 12 6.836 -6.348 -3.934 92 2HB TYR 12 HB3 TYR 12 5.639 -6.916 -2.795 93 HD1 TYR 12 HD1 TYR 12 5.971 -6.666 -0.513 94 HD2 TYR 12 HD2 TYR 12 9.386 -6.806 -3.140 95 HE1 TYR 12 HE1 TYR 12 7.476 -6.192 1.412 96 HE2 TYR 12 HE2 TYR 12 10.890 -6.308 -1.221 97 HH TYR 12 HH TYR 12 11.022 -5.861 1.028 98 H LYS 13 H LYS 13 5.413 -9.530 -1.772 99 HA LYS 13 HA LYS 13 7.517 -10.674 -0.197 100 1HB LYS 13 HB2 LYS 13 5.185 -10.188 0.600 101 2HB LYS 13 HB3 LYS 13 4.593 -11.553 -0.355 102 1HG LYS 13 HG2 LYS 13 6.107 -13.079 0.943 103 2HG LYS 13 HG3 LYS 13 6.610 -11.704 1.934 104 1HD LYS 13 HD2 LYS 13 3.765 -12.790 1.693 105 2HD LYS 13 HD3 LYS 13 4.889 -13.131 3.015 106 1HE LYS 13 HE2 LYS 13 4.973 -10.696 3.562 107 2HE LYS 13 HE3 LYS 13 3.798 -10.377 2.278 108 1HZ LYS 13 HZ1 LYS 13 2.709 -10.576 4.438 109 2HZ LYS 13 HZ2 LYS 13 2.208 -11.792 3.472 110 3HZ LYS 13 HZ3 LYS 13 3.293 -12.082 4.660 111 H TYR 14 H TYR 14 5.277 -12.525 -2.455 112 HA TYR 14 HA TYR 14 6.775 -14.809 -2.480 113 1HB TYR 14 HB2 TYR 14 4.571 -14.344 -3.539 114 2HB TYR 14 HB3 TYR 14 5.402 -13.558 -4.866 115 HD1 TYR 14 HD1 TYR 14 5.704 -16.823 -2.970 116 HD2 TYR 14 HD2 TYR 14 5.436 -14.866 -6.810 117 HE1 TYR 14 HE1 TYR 14 5.762 -19.035 -4.104 118 HE2 TYR 14 HE2 TYR 14 5.448 -17.080 -7.937 119 HH TYR 14 HH TYR 14 5.678 -20.153 -6.106 120 H MET 15 H MET 15 7.722 -11.866 -4.227 121 HA MET 15 HA MET 15 9.761 -13.116 -5.826 122 1HB MET 15 HB2 MET 15 9.133 -10.228 -5.174 123 2HB MET 15 HB3 MET 15 10.518 -10.731 -6.158 124 1HG MET 15 HG2 MET 15 9.011 -12.065 -7.595 125 2HG MET 15 HG3 MET 15 7.645 -11.480 -6.676 126 1HE MET 15 HE1 MET 15 10.928 -9.662 -8.097 127 2HE MET 15 HE2 MET 15 10.352 -10.864 -9.272 128 3HE MET 15 HE3 MET 15 10.283 -9.129 -9.660 129 H LYS 16 H LYS 16 10.020 -11.089 -2.774 130 HA LYS 16 HA LYS 16 12.819 -11.782 -2.469 131 1HB LYS 16 HB2 LYS 16 12.726 -10.828 -0.305 132 2HB LYS 16 HB3 LYS 16 11.850 -9.796 -1.433 133 1HG LYS 16 HG2 LYS 16 9.705 -10.623 -0.554 134 2HG LYS 16 HG3 LYS 16 10.548 -11.720 0.556 135 1HD LYS 16 HD2 LYS 16 11.598 -9.812 1.690 136 2HD LYS 16 HD3 LYS 16 10.873 -8.686 0.527 137 1HE LYS 16 HE2 LYS 16 8.612 -9.327 1.281 138 2HE LYS 16 HE3 LYS 16 9.306 -10.492 2.423 139 1HZ LYS 16 HZ1 LYS 16 8.772 -8.380 3.514 140 2HZ LYS 16 HZ2 LYS 16 10.385 -8.623 3.561 141 3HZ LYS 16 HZ3 LYS 16 9.752 -7.548 2.500 142 H GLU 17 H GLU 17 9.914 -13.578 -1.862 143 HA GLU 17 HA GLU 17 11.308 -15.626 -0.262 144 1HB GLU 17 HB2 GLU 17 8.599 -15.506 -1.593 145 2HB GLU 17 HB3 GLU 17 9.189 -16.977 -0.848 146 1HG GLU 17 HG2 GLU 17 9.011 -14.350 0.678 147 2HG GLU 17 HG3 GLU 17 7.689 -15.507 0.581 148 H ARG 18 H ARG 18 11.567 -14.782 -3.519 149 HA ARG 18 HA ARG 18 12.399 -17.560 -4.284 150 1HB ARG 18 HB2 ARG 18 11.550 -15.143 -5.879 151 2HB ARG 18 HB3 ARG 18 12.473 -16.460 -6.612 152 1HG ARG 18 HG2 ARG 18 10.795 -18.057 -6.239 153 2HG ARG 18 HG3 ARG 18 9.939 -17.064 -5.051 154 1HD ARG 18 HD2 ARG 18 9.131 -15.557 -6.671 155 2HD ARG 18 HD3 ARG 18 10.246 -16.122 -7.917 156 HE ARG 18 H3T ARG 18 7.765 -17.462 -6.983 157 1HH1 ARG 18 2HH1 ARG 18 10.494 -17.650 -9.185 158 2HH1 ARG 18 1HH1 ARG 18 9.773 -18.941 -10.104 159 1HH2 ARG 18 2HH2 ARG 18 6.954 -19.172 -8.153 160 2HH2 ARG 18 1HH2 ARG 18 7.816 -19.750 -9.552 161 H LYS 19 H LYS 19 13.551 -14.420 -5.238 162 HA LYS 19 HA LYS 19 16.187 -14.362 -4.199 163 1HB LYS 19 HB2 LYS 19 17.514 -15.098 -6.182 164 2HB LYS 19 HB3 LYS 19 16.721 -16.414 -5.354 165 1HG LYS 19 HG2 LYS 19 14.992 -16.528 -7.124 166 2HG LYS 19 HG3 LYS 19 15.663 -15.085 -7.892 167 1HD LYS 19 HD2 LYS 19 16.368 -17.049 -9.109 168 2HD LYS 19 HD3 LYS 19 17.773 -16.285 -8.353 169 1HE LYS 19 HE2 LYS 19 17.690 -17.965 -6.514 170 2HE LYS 19 HE3 LYS 19 16.269 -18.710 -7.257 171 1HZ LYS 19 HZ1 LYS 19 18.309 -19.886 -7.857 172 2HZ LYS 19 HZ2 LYS 19 17.650 -19.236 -9.199 173 3HZ LYS 19 HZ3 LYS 19 18.960 -18.542 -8.513 174 H THR 20 H THR 20 13.805 -12.757 -5.427 175 HA THR 20 HA THR 20 15.420 -10.961 -7.216 176 HB THR 20 H5T THR 20 12.546 -11.862 -7.565 177 HG1 THR 20 HG1 THR 20 14.812 -12.792 -8.972 178 1HG2 THR 20 1HG2 THR 20 13.143 -9.777 -8.818 179 2HG2 THR 20 2HG2 THR 20 14.497 -10.655 -9.577 180 3HG2 THR 20 3HG2 THR 20 12.821 -11.141 -9.897 181 HA PRO 21 HA PRO 21 13.581 -8.364 -3.688 182 1HB PRO 21 HB2 PRO 21 16.219 -7.062 -4.409 183 2HB PRO 21 HB3 PRO 21 15.388 -7.124 -2.821 184 1HG PRO 21 HG2 PRO 21 17.435 -8.813 -3.348 185 2HG PRO 21 HG3 PRO 21 15.959 -9.427 -2.534 186 1HD PRO 21 HD2 PRO 21 16.751 -9.690 -5.439 187 2HD PRO 21 HD3 PRO 21 16.024 -10.893 -4.332 188 H ILE 22 H ILE 22 12.142 -6.804 -4.323 189 HA ILE 22 HA ILE 22 11.838 -6.410 -7.095 190 HB ILE 22 H5T ILE 22 10.068 -6.530 -5.331 191 1HG1 ILE 22 2HG1 ILE 22 9.689 -4.210 -7.249 192 2HG1 ILE 22 3HG1 ILE 22 9.719 -5.908 -7.742 193 1HG2 ILE 22 1HG2 ILE 22 11.001 -4.781 -3.793 194 2HG2 ILE 22 2HG2 ILE 22 10.569 -3.536 -4.985 195 3HG2 ILE 22 3HG2 ILE 22 9.310 -4.501 -4.201 196 1HD1 ILE 22 1HD1 ILE 22 7.801 -6.404 -6.252 197 2HD1 ILE 22 2HD1 ILE 22 7.712 -4.681 -5.804 198 3HD1 ILE 22 3HD1 ILE 22 7.410 -5.182 -7.470 199 H GLU 23 H GLU 23 13.341 -4.216 -4.717 200 HA GLU 23 HA GLU 23 13.455 -1.947 -6.357 201 1HB GLU 23 HB2 GLU 23 15.591 -2.783 -4.359 202 2HB GLU 23 HB3 GLU 23 15.175 -1.159 -4.886 203 1HG GLU 23 HG2 GLU 23 14.021 -1.058 -2.977 204 2HG GLU 23 HG3 GLU 23 12.756 -1.875 -3.881 205 H ARG 24 H ARG 24 15.061 -4.840 -7.162 206 HA ARG 24 HA ARG 24 17.430 -3.851 -8.457 207 1HB ARG 24 HB2 ARG 24 17.424 -5.889 -9.685 208 2HB ARG 24 HB3 ARG 24 16.887 -6.238 -8.036 209 1HG ARG 24 HG2 ARG 24 14.457 -6.068 -9.050 210 2HG ARG 24 HG3 ARG 24 15.256 -6.189 -10.613 211 1HD ARG 24 HD2 ARG 24 15.264 -8.277 -8.347 212 2HD ARG 24 HD3 ARG 24 14.486 -8.363 -9.908 213 HE ARG 24 H3T ARG 24 16.554 -8.718 -11.004 214 1HH1 ARG 24 2HH2 ARG 24 17.100 -8.454 -7.553 215 2HH1 ARG 24 1HH2 ARG 24 18.612 -9.319 -7.639 216 1HH2 ARG 24 2HH1 ARG 24 18.510 -9.762 -11.041 217 2HH2 ARG 24 1HH1 ARG 24 19.392 -10.012 -9.565 218 H ILE 25 H ILE 25 14.129 -3.437 -9.270 219 HA ILE 25 HA ILE 25 14.256 -3.057 -12.065 220 HB ILE 25 H5T ILE 25 12.293 -3.493 -10.565 221 1HG1 ILE 25 2HG1 ILE 25 11.832 -1.182 -12.475 222 2HG1 ILE 25 3HG1 ILE 25 12.164 -2.838 -12.971 223 1HG2 ILE 25 1HG2 ILE 25 12.784 -1.636 -8.899 224 2HG2 ILE 25 2HG2 ILE 25 12.175 -0.486 -10.102 225 3HG2 ILE 25 3HG2 ILE 25 11.111 -1.740 -9.436 226 1HD1 ILE 25 1HD1 ILE 25 9.766 -2.452 -12.980 227 2HD1 ILE 25 2HD1 ILE 25 10.220 -3.676 -11.777 228 3HD1 ILE 25 3HD1 ILE 25 9.803 -2.042 -11.248 229 HA PRO 26 HA PRO 26 15.948 1.185 -12.218 230 1HB PRO 26 HB2 PRO 26 15.629 1.760 -14.835 231 2HB PRO 26 HB3 PRO 26 16.733 0.461 -14.284 232 1HG PRO 26 HG2 PRO 26 13.864 0.140 -15.237 233 2HG PRO 26 HG3 PRO 26 15.328 -0.696 -15.854 234 1HD PRO 26 HD2 PRO 26 13.737 -1.788 -13.944 235 2HD PRO 26 HD3 PRO 26 15.508 -2.019 -13.911 236 H TYR 27 H TYR 27 14.861 3.318 -13.650 237 HA TYR 27 HA TYR 27 12.267 3.704 -12.198 238 1HB TYR 27 HB2 TYR 27 14.321 5.688 -13.229 239 2HB TYR 27 HB3 TYR 27 12.778 6.128 -12.514 240 HD1 TYR 27 HD1 TYR 27 16.171 4.878 -11.812 241 HD2 TYR 27 HD2 TYR 27 12.293 5.744 -10.131 242 HE1 TYR 27 HE1 TYR 27 17.134 4.748 -9.515 243 HE2 TYR 27 HE2 TYR 27 13.256 5.611 -7.836 244 HH TYR 27 HH TYR 27 15.138 5.250 -6.579 245 H LEU 28 H LEU 28 10.595 4.929 -13.191 246 HA LEU 28 HA LEU 28 10.107 4.214 -15.983 247 1HB LEU 28 HB2 LEU 28 8.500 4.046 -13.935 248 2HB LEU 28 HB3 LEU 28 8.317 5.777 -14.100 249 HG LEU 28 HG LEU 28 7.425 5.425 -16.427 250 1HD1 LEU 28 1HD1 LEU 28 8.434 3.242 -16.983 251 2HD1 LEU 28 2HD1 LEU 28 7.516 2.480 -15.662 252 3HD1 LEU 28 3HD1 LEU 28 6.673 3.156 -17.070 253 1HD2 LEU 28 1HD2 LEU 28 5.996 3.874 -14.227 254 2HD2 LEU 28 2HD2 LEU 28 5.906 5.633 -14.496 255 3HD2 LEU 28 3HD2 LEU 28 5.252 4.519 -15.703 256 H GLY 29 H GLY 29 12.245 6.098 -15.763 257 1HA GLY 29 HA2 GLY 29 12.943 7.969 -16.942 258 2HA GLY 29 HA3 GLY 29 11.282 8.262 -17.463 259 H PHE 30 H PHE 30 9.952 8.603 -15.088 260 HA PHE 30 HA PHE 30 11.426 10.584 -13.441 261 1HB PHE 30 HB2 PHE 30 10.204 11.701 -15.343 262 2HB PHE 30 HB3 PHE 30 8.696 11.058 -14.723 263 HD1 PHE 30 HD1 PHE 30 7.410 12.445 -13.295 264 HD2 PHE 30 HD2 PHE 30 11.649 13.158 -13.671 265 HE1 PHE 30 HE1 PHE 30 7.190 14.495 -11.910 266 HE2 PHE 30 HE2 PHE 30 11.424 15.206 -12.282 267 HZ PHE 30 HZ PHE 30 9.196 15.877 -11.401 268 H LYS 31 H LYS 31 9.563 7.808 -13.321 269 HA LYS 31 HA LYS 31 8.498 8.476 -10.591 270 1HB LYS 31 HB2 LYS 31 7.029 7.023 -12.829 271 2HB LYS 31 HB3 LYS 31 6.475 7.117 -11.159 272 1HG LYS 31 HG2 LYS 31 6.235 9.531 -11.298 273 2HG LYS 31 HG3 LYS 31 6.937 9.556 -12.928 274 1HD LYS 31 HD2 LYS 31 5.067 8.200 -13.793 275 2HD LYS 31 HD3 LYS 31 4.332 8.169 -12.174 276 1HE LYS 31 HE2 LYS 31 4.143 10.624 -12.186 277 2HE LYS 31 HE3 LYS 31 4.965 10.710 -13.749 278 1HZ LYS 31 HZ1 LYS 31 2.525 10.844 -13.942 279 2HZ LYS 31 HZ2 LYS 31 3.104 9.571 -14.773 280 3HZ LYS 31 HZ3 LYS 31 2.359 9.343 -13.325 281 H GLN 32 H GLN 32 8.116 6.710 -9.232 282 HA GLN 32 HA GLN 32 10.315 4.828 -9.253 283 1HB GLN 32 HB2 GLN 32 9.882 4.559 -6.983 284 2HB GLN 32 HB3 GLN 32 9.558 6.240 -7.330 285 1HG GLN 32 HG2 GLN 32 7.635 4.049 -6.556 286 2HG GLN 32 HG3 GLN 32 7.897 5.601 -5.805 287 1HE2 GLN 32 1HE2 GLN 32 5.582 3.956 -7.357 288 2HE2 GLN 32 2HE2 GLN 32 4.732 5.313 -8.088 289 H ILE 33 H ILE 33 8.721 4.085 -11.408 290 HA ILE 33 HA ILE 33 7.296 2.568 -12.317 291 HB ILE 33 H5T ILE 33 8.470 0.688 -10.285 292 1HG1 ILE 33 2HG1 ILE 33 10.214 1.970 -11.612 293 2HG1 ILE 33 3HG1 ILE 33 10.270 0.238 -11.687 294 1HG2 ILE 33 1HG2 ILE 33 7.125 0.229 -12.988 295 2HG2 ILE 33 2HG2 ILE 33 8.058 -1.020 -12.160 296 3HG2 ILE 33 3HG2 ILE 33 6.601 -0.393 -11.411 297 1HD1 ILE 33 1HD1 ILE 33 9.406 0.188 -13.945 298 2HD1 ILE 33 2HD1 ILE 33 9.010 1.915 -13.884 299 3HD1 ILE 33 3HD1 ILE 33 10.703 1.388 -13.877 300 H ASN 34 H ASN 34 5.614 3.940 -11.516 301 HA ASN 34 HA ASN 34 3.892 3.151 -9.322 302 1HB ASN 34 HB2 ASN 34 4.243 5.486 -10.384 303 2HB ASN 34 HB3 ASN 34 3.209 4.938 -11.699 304 1HD2 ASN 34 1HD2 ASN 34 1.022 5.305 -11.376 305 2HD2 ASN 34 2HD2 ASN 34 0.318 5.673 -9.809 306 H LEU 35 H LEU 35 4.069 0.827 -10.134 307 HA LEU 35 HA LEU 35 3.257 -0.120 -12.495 308 1HB LEU 35 HB2 LEU 35 4.387 -1.325 -10.691 309 2HB LEU 35 HB3 LEU 35 2.847 -1.608 -9.887 310 HG LEU 35 HG LEU 35 3.148 -2.421 -12.800 311 1HD1 LEU 35 1HD1 LEU 35 4.260 -3.998 -10.461 312 2HD1 LEU 35 2HD1 LEU 35 4.092 -4.590 -12.128 313 3HD1 LEU 35 3HD1 LEU 35 5.200 -3.260 -11.769 314 1HD2 LEU 35 1HD2 LEU 35 0.951 -2.819 -11.854 315 2HD2 LEU 35 2HD2 LEU 35 1.785 -4.353 -12.030 316 3HD2 LEU 35 3HD2 LEU 35 1.650 -3.596 -10.430 317 H TRP 36 H TRP 36 0.853 0.383 -9.872 318 HA TRP 36 HA TRP 36 -1.355 -0.857 -11.089 319 1HB TRP 36 HB2 TRP 36 -2.708 0.432 -9.632 320 2HB TRP 36 HB3 TRP 36 -1.263 -0.109 -8.797 321 HD1 TRP 36 HD1 TRP 36 0.627 1.824 -8.290 322 HE1 TRP 36 HE1 TRP 36 0.367 4.320 -7.813 323 HE3 TRP 36 HE3 TRP 36 -4.171 2.443 -9.925 324 HZ2 TRP 36 HZ2 TRP 36 -1.678 6.353 -8.098 325 HZ3 TRP 36 HZ3 TRP 36 -5.258 4.694 -9.832 326 HH2 TRP 36 HH2 TRP 36 -4.013 6.643 -8.941 327 H THR 37 H THR 37 -0.077 2.510 -11.806 328 HA THR 37 HA THR 37 -2.295 3.067 -13.609 329 HB THR 37 H5T THR 37 -0.996 5.023 -14.297 330 HG1 THR 37 HG1 THR 37 1.087 4.536 -13.861 331 1HG2 THR 37 1HG2 THR 37 -2.668 5.169 -12.536 332 2HG2 THR 37 2HG2 THR 37 -1.452 4.712 -11.325 333 3HG2 THR 37 3HG2 THR 37 -1.303 6.254 -12.203 334 H MET 38 H MET 38 1.146 2.018 -14.074 335 HA MET 38 HA MET 38 0.825 2.130 -16.956 336 1HB MET 38 HB2 MET 38 2.919 1.191 -17.205 337 2HB MET 38 HB3 MET 38 3.019 2.227 -15.786 338 1HG MET 38 HG2 MET 38 2.703 0.106 -14.403 339 2HG MET 38 HG3 MET 38 2.919 -0.809 -15.893 340 1HE MET 38 HE1 MET 38 5.002 -1.407 -13.432 341 2HE MET 38 HE2 MET 38 4.827 -2.169 -15.034 342 3HE MET 38 HE3 MET 38 6.407 -1.561 -14.494 343 H PHE 39 H PHE 39 0.078 -0.358 -14.537 344 HA PHE 39 HA PHE 39 -0.629 -2.439 -16.402 345 1HB PHE 39 HB2 PHE 39 -0.256 -2.887 -14.058 346 2HB PHE 39 HB3 PHE 39 -1.557 -1.799 -13.586 347 HD1 PHE 39 HD1 PHE 39 -1.024 -4.758 -15.872 348 HD2 PHE 39 HD2 PHE 39 -3.620 -2.785 -13.044 349 HE1 PHE 39 HE1 PHE 39 -2.618 -6.652 -16.013 350 HE2 PHE 39 HE2 PHE 39 -5.218 -4.682 -13.198 351 HZ PHE 39 HZ PHE 39 -4.701 -6.616 -14.680 352 H GLN 40 H GLN 40 -2.849 -0.027 -14.723 353 HA GLN 40 HA GLN 40 -5.047 -0.895 -16.363 354 1HB GLN 40 HB2 GLN 40 -6.336 0.812 -15.411 355 2HB GLN 40 HB3 GLN 40 -5.208 0.299 -14.159 356 1HG GLN 40 HG2 GLN 40 -3.744 2.293 -14.980 357 2HG GLN 40 HG3 GLN 40 -5.188 2.853 -15.816 358 1HE2 GLN 40 1HE2 GLN 40 -3.961 1.864 -12.567 359 2HE2 GLN 40 2HE2 GLN 40 -4.944 3.050 -11.710 360 H ALA 41 H ALA 41 -2.601 1.621 -16.978 361 HA ALA 41 HA ALA 41 -3.674 2.683 -19.397 362 1HB ALA 41 HB1 ALA 41 -0.807 2.206 -18.468 363 2HB ALA 41 HB2 ALA 41 -1.254 3.128 -19.897 364 3HB ALA 41 HB3 ALA 41 -1.758 3.697 -18.282 365 H ALA 42 H ALA 42 -1.411 -0.112 -18.899 366 HA ALA 42 HA ALA 42 -1.342 -1.000 -21.565 367 1HB ALA 42 HB1 ALA 42 -1.228 -2.703 -19.043 368 2HB ALA 42 HB2 ALA 42 -0.621 -3.136 -20.649 369 3HB ALA 42 HB3 ALA 42 0.135 -1.820 -19.739 370 H GLN 43 H GLN 43 -3.873 -1.651 -19.048 371 HA GLN 43 HA GLN 43 -5.249 -3.589 -20.629 372 1HB GLN 43 HB2 GLN 43 -6.432 -1.850 -18.449 373 2HB GLN 43 HB3 GLN 43 -7.138 -3.294 -19.151 374 1HG GLN 43 HG2 GLN 43 -4.968 -3.059 -17.126 375 2HG GLN 43 HG3 GLN 43 -6.313 -4.162 -17.207 376 1HE2 GLN 43 1HE2 GLN 43 -2.971 -3.733 -17.853 377 2HE2 GLN 43 2HE2 GLN 43 -2.695 -5.330 -18.558 378 H LYS 44 H LYS 44 -5.550 -0.029 -20.550 379 HA LYS 44 HA LYS 44 -7.847 0.017 -22.375 380 1HB LYS 44 HB2 LYS 44 -5.780 2.146 -21.674 381 2HB LYS 44 HB3 LYS 44 -7.221 2.405 -22.667 382 1HG LYS 44 HG2 LYS 44 -8.643 1.670 -20.715 383 2HG LYS 44 HG3 LYS 44 -7.184 1.630 -19.721 384 1HD LYS 44 HD2 LYS 44 -8.344 4.070 -21.126 385 2HD LYS 44 HD3 LYS 44 -8.424 3.719 -19.393 386 1HE LYS 44 HE2 LYS 44 -5.945 3.832 -19.245 387 2HE LYS 44 HE3 LYS 44 -5.856 4.156 -20.981 388 1HZ LYS 44 HZ1 LYS 44 -7.172 6.198 -20.562 389 2HZ LYS 44 HZ2 LYS 44 -7.054 5.946 -18.946 390 3HZ LYS 44 HZ3 LYS 44 -5.703 6.206 -19.857 391 H LEU 45 H LEU 45 -4.312 0.456 -22.703 392 HA LEU 45 HA LEU 45 -4.355 0.278 -25.536 393 1HB LEU 45 HB2 LEU 45 -2.136 -0.196 -23.528 394 2HB LEU 45 HB3 LEU 45 -1.869 0.018 -25.244 395 HG LEU 45 HG LEU 45 -3.138 2.188 -23.505 396 1HD1 LEU 45 1HD1 LEU 45 -0.978 3.220 -23.425 397 2HD1 LEU 45 2HD1 LEU 45 -0.922 1.627 -22.681 398 3HD1 LEU 45 3HD1 LEU 45 -0.242 1.843 -24.311 399 1HD2 LEU 45 1HD2 LEU 45 -2.449 3.664 -25.365 400 2HD2 LEU 45 2HD2 LEU 45 -1.923 2.231 -26.289 401 3HD2 LEU 45 3HD2 LEU 45 -3.631 2.451 -25.868 402 H GLY 46 H GLY 46 -5.617 -2.149 -23.913 403 1HA GLY 46 HA2 GLY 46 -6.223 -4.129 -24.942 404 2HA GLY 46 HA3 GLY 46 -4.881 -4.017 -26.052 405 H GLY 47 H GLY 47 -4.543 -3.936 -22.562 406 1HA GLY 47 HA2 GLY 47 -3.329 -5.176 -21.083 407 2HA GLY 47 HA3 GLY 47 -3.948 -6.602 -21.910 408 H TYR 48 H TYR 48 -1.621 -7.013 -20.842 409 HA TYR 48 HA TYR 48 0.739 -6.602 -22.262 410 1HB TYR 48 HB2 TYR 48 0.492 -7.857 -20.167 411 2HB TYR 48 HB3 TYR 48 -0.318 -9.159 -21.018 412 HD1 TYR 48 HD1 TYR 48 0.948 -10.987 -21.802 413 HD2 TYR 48 HD2 TYR 48 2.923 -7.226 -21.031 414 HE1 TYR 48 HE1 TYR 48 3.153 -12.061 -22.207 415 HE2 TYR 48 HE2 TYR 48 5.134 -8.317 -21.406 416 HH TYR 48 HH TYR 48 5.426 -11.784 -22.262 417 H GLU 49 H GLU 49 -2.089 -8.454 -23.362 418 HA GLU 49 HA GLU 49 -0.630 -10.057 -25.280 419 1HB GLU 49 HB2 GLU 49 -3.574 -9.443 -24.852 420 2HB GLU 49 HB3 GLU 49 -2.986 -10.509 -26.145 421 1HG GLU 49 HG2 GLU 49 -1.942 -12.012 -24.560 422 2HG GLU 49 HG3 GLU 49 -2.242 -10.913 -23.218 423 H THR 50 H THR 50 -2.666 -7.080 -25.730 424 HA THR 50 HA THR 50 -1.876 -6.845 -28.511 425 HB THR 50 H5T THR 50 -2.979 -4.679 -26.721 426 HG1 THR 50 HG1 THR 50 -4.412 -6.377 -26.806 427 1HG2 THR 50 1HG2 THR 50 -2.962 -4.996 -29.757 428 2HG2 THR 50 2HG2 THR 50 -3.864 -3.751 -28.860 429 3HG2 THR 50 3HG2 THR 50 -2.099 -3.756 -28.822 430 H ILE 51 H ILE 51 -0.524 -5.679 -25.402 431 HA ILE 51 HA ILE 51 1.480 -4.005 -26.560 432 HB ILE 51 H5T ILE 51 0.914 -5.278 -23.955 433 1HG1 ILE 51 2HG1 ILE 51 2.139 -3.179 -23.098 434 2HG1 ILE 51 3HG1 ILE 51 2.240 -2.680 -24.771 435 1HG2 ILE 51 1HG2 ILE 51 3.838 -4.915 -24.577 436 2HG2 ILE 51 2HG2 ILE 51 3.115 -5.199 -22.974 437 3HG2 ILE 51 3HG2 ILE 51 3.016 -6.450 -24.193 438 1HD1 ILE 51 1HD1 ILE 51 -0.258 -3.185 -23.080 439 2HD1 ILE 51 2HD1 ILE 51 0.281 -1.644 -23.768 440 3HD1 ILE 51 3HD1 ILE 51 -0.353 -2.923 -24.827 441 H THR 52 H THR 52 1.476 -7.542 -26.074 442 HA THR 52 HA THR 52 4.167 -7.859 -27.098 443 HB THR 52 H5T THR 52 1.904 -9.886 -26.827 444 HG1 THR 52 HG1 THR 52 2.420 -9.036 -24.858 445 1HG2 THR 52 1HG2 THR 52 4.918 -10.276 -27.114 446 2HG2 THR 52 2HG2 THR 52 3.760 -11.548 -26.664 447 3HG2 THR 52 3HG2 THR 52 3.666 -10.804 -28.264 448 H ALA 53 H ALA 53 0.895 -8.129 -28.577 449 HA ALA 53 HA ALA 53 1.914 -9.006 -31.139 450 1HB ALA 53 HB1 ALA 53 -0.354 -9.516 -30.281 451 2HB ALA 53 HB2 ALA 53 -0.770 -7.787 -30.355 452 3HB ALA 53 HB3 ALA 53 -0.414 -8.684 -31.845 453 H ARG 54 H ARG 54 1.407 -5.755 -29.726 454 HA ARG 54 HA ARG 54 2.132 -4.593 -32.398 455 1HB ARG 54 HB2 ARG 54 -0.434 -4.823 -31.602 456 2HB ARG 54 HB3 ARG 54 -0.057 -3.362 -30.725 457 1HG ARG 54 HG2 ARG 54 -1.033 -2.729 -32.798 458 2HG ARG 54 HG3 ARG 54 0.682 -2.333 -32.951 459 1HD ARG 54 HD2 ARG 54 1.051 -4.436 -34.226 460 2HD ARG 54 HD3 ARG 54 -0.657 -4.863 -34.010 461 HE ARG 54 H3T ARG 54 -0.547 -2.302 -35.226 462 1HH1 ARG 54 2HH2 ARG 54 0.242 -5.600 -36.110 463 2HH1 ARG 54 1HH2 ARG 54 -0.029 -5.308 -37.807 464 1HH2 ARG 54 2HH1 ARG 54 -0.878 -1.999 -37.408 465 2HH2 ARG 54 1HH1 ARG 54 -0.645 -3.319 -38.515 466 H ARG 55 H ARG 55 3.557 -4.739 -29.652 467 HA ARG 55 HA ARG 55 5.183 -3.496 -28.610 468 1HB ARG 55 HB2 ARG 55 5.255 -2.112 -31.320 469 2HB ARG 55 HB3 ARG 55 6.519 -2.013 -30.086 470 1HG ARG 55 HG2 ARG 55 6.919 -4.428 -30.226 471 2HG ARG 55 HG3 ARG 55 5.643 -4.610 -31.435 472 1HD ARG 55 HD2 ARG 55 8.139 -2.901 -31.807 473 2HD ARG 55 HD3 ARG 55 7.958 -4.554 -32.375 474 HE ARG 55 H3T ARG 55 6.306 -3.902 -33.958 475 1HH1 ARG 55 2HH1 ARG 55 7.735 -1.074 -32.445 476 2HH1 ARG 55 1HH1 ARG 55 7.171 -0.015 -33.708 477 1HH2 ARG 55 2HH2 ARG 55 5.631 -2.493 -35.519 478 2HH2 ARG 55 1HH2 ARG 55 6.015 -0.802 -35.397 479 H GLN 56 H GLN 56 2.975 -2.797 -27.503 480 HA GLN 56 HA GLN 56 2.362 0.014 -28.090 481 1HB GLN 56 HB2 GLN 56 0.847 -2.008 -26.456 482 2HB GLN 56 HB3 GLN 56 0.363 -0.330 -26.599 483 1HG GLN 56 HG2 GLN 56 0.659 -2.248 -28.935 484 2HG GLN 56 HG3 GLN 56 -0.852 -1.875 -28.117 485 1HE2 GLN 56 1HE2 GLN 56 1.307 -0.810 -30.636 486 2HE2 GLN 56 2HE2 GLN 56 0.475 0.717 -30.927 487 H TRP 57 H TRP 57 4.628 -1.321 -26.048 488 HA TRP 57 HA TRP 57 4.329 0.183 -23.660 489 1HB TRP 57 HB2 TRP 57 7.034 -0.131 -24.988 490 2HB TRP 57 HB3 TRP 57 6.610 0.007 -23.321 491 HD1 TRP 57 HD1 TRP 57 7.000 -2.602 -26.012 492 HE1 TRP 57 HE1 TRP 57 6.669 -4.944 -25.011 493 HE3 TRP 57 HE3 TRP 57 5.416 -1.257 -21.344 494 HZ2 TRP 57 HZ2 TRP 57 5.726 -6.087 -22.518 495 HZ3 TRP 57 HZ3 TRP 57 4.711 -2.974 -19.710 496 HH2 TRP 57 HH2 TRP 57 4.870 -5.397 -20.281 497 H LYS 58 H LYS 58 5.459 1.224 -26.898 498 HA LYS 58 HA LYS 58 6.188 3.908 -26.178 499 1HB LYS 58 HB2 LYS 58 5.084 2.875 -28.826 500 2HB LYS 58 HB3 LYS 58 5.916 4.407 -28.582 501 1HG LYS 58 HG2 LYS 58 7.086 1.607 -28.349 502 2HG LYS 58 HG3 LYS 58 7.463 2.832 -29.548 503 1HD LYS 58 HD2 LYS 58 8.187 2.927 -26.579 504 2HD LYS 58 HD3 LYS 58 9.273 2.613 -27.934 505 1HE LYS 58 HE2 LYS 58 8.762 4.899 -28.841 506 2HE LYS 58 HE3 LYS 58 7.768 5.218 -27.413 507 1HZ LYS 58 HZ1 LYS 58 9.770 4.889 -26.036 508 2HZ LYS 58 HZ2 LYS 58 10.679 4.626 -27.380 509 3HZ LYS 58 HZ3 LYS 58 9.994 6.089 -27.095 510 H HIS 59 H HIS 59 2.971 2.521 -26.535 511 HA HIS 59 HA HIS 59 1.814 5.220 -26.137 512 1HB HIS 59 HB2 HIS 59 0.510 2.524 -26.570 513 2HB HIS 59 HB3 HIS 59 -0.326 4.071 -26.371 514 HD1 HIS 59 HD1 HIS 59 -0.265 5.769 -28.457 515 HD2 HIS 59 HD2 HIS 59 1.835 2.156 -28.942 516 HE1 HIS 59 HE1 HIS 59 0.349 5.623 -30.926 517 H ILE 60 H ILE 60 2.815 2.511 -24.109 518 HA ILE 60 HA ILE 60 1.195 3.376 -21.802 519 HB ILE 60 H5T ILE 60 3.717 1.686 -21.993 520 1HG1 ILE 60 2HG1 ILE 60 0.807 1.064 -21.294 521 2HG1 ILE 60 3HG1 ILE 60 1.608 0.663 -22.819 522 1HG2 ILE 60 1HG2 ILE 60 2.104 2.380 -19.495 523 2HG2 ILE 60 2HG2 ILE 60 3.461 1.231 -19.584 524 3HG2 ILE 60 3HG2 ILE 60 3.758 2.930 -19.843 525 1HD1 ILE 60 1HD1 ILE 60 2.158 -0.528 -20.080 526 2HD1 ILE 60 2HD1 ILE 60 1.511 -1.324 -21.523 527 3HD1 ILE 60 3HD1 ILE 60 3.196 -0.789 -21.509 528 H TYR 61 H TYR 61 4.353 4.134 -23.252 529 HA TYR 61 HA TYR 61 5.088 6.269 -21.534 530 1HB TYR 61 HB2 TYR 61 6.683 5.334 -22.971 531 2HB TYR 61 HB3 TYR 61 5.695 5.583 -24.390 532 HD1 TYR 61 HD1 TYR 61 7.791 7.335 -21.845 533 HD2 TYR 61 HD2 TYR 61 5.738 7.623 -25.631 534 HE1 TYR 61 HE1 TYR 61 8.977 9.472 -22.327 535 HE2 TYR 61 HE2 TYR 61 6.922 9.764 -26.107 536 HH TYR 61 HH TYR 61 9.288 11.211 -23.848 537 H ASP 62 H ASP 62 2.526 6.078 -23.922 538 HA ASP 62 HA ASP 62 2.076 8.940 -24.036 539 1HB ASP 62 HB2 ASP 62 1.351 7.407 -25.859 540 2HB ASP 62 HB3 ASP 62 0.011 6.929 -24.805 541 H GLU 63 H GLU 63 0.363 6.234 -22.422 542 HA GLU 63 HA GLU 63 -1.323 7.933 -20.886 543 1HB GLU 63 HB2 GLU 63 -0.416 5.063 -20.563 544 2HB GLU 63 HB3 GLU 63 -1.661 5.787 -19.545 545 1HG GLU 63 HG2 GLU 63 -1.814 5.516 -22.582 546 2HG GLU 63 HG3 GLU 63 -2.597 4.452 -21.422 547 H LEU 64 H LEU 64 1.899 6.631 -19.963 548 HA LEU 64 HA LEU 64 1.583 7.151 -17.181 549 1HB LEU 64 HB2 LEU 64 3.815 6.492 -16.905 550 2HB LEU 64 HB3 LEU 64 3.180 5.550 -18.228 551 HG LEU 64 HG LEU 64 4.368 7.347 -19.755 552 1HD1 LEU 64 1HD1 LEU 64 5.132 8.927 -17.993 553 2HD1 LEU 64 2HD1 LEU 64 5.972 7.604 -17.165 554 3HD1 LEU 64 3HD1 LEU 64 6.504 8.154 -18.766 555 1HD2 LEU 64 1HD2 LEU 64 6.459 5.970 -19.621 556 2HD2 LEU 64 2HD2 LEU 64 5.877 5.279 -18.094 557 3HD2 LEU 64 3HD2 LEU 64 5.003 4.963 -19.594 558 H GLY 65 H GLY 65 2.092 9.451 -19.672 559 1HA GLY 65 HA2 GLY 65 1.934 11.799 -19.109 560 2HA GLY 65 HA3 GLY 65 2.877 11.528 -17.646 561 H GLY 66 H GLY 66 4.080 9.891 -20.504 562 1HA GLY 66 HA2 GLY 66 6.135 10.051 -21.499 563 2HA GLY 66 HA3 GLY 66 5.704 11.738 -21.706 564 H ASN 67 H ASN 67 8.095 11.622 -21.825 565 HA ASN 67 HA ASN 67 9.131 13.129 -19.631 566 1HB ASN 67 HB2 ASN 67 9.697 10.838 -18.779 567 2HB ASN 67 HB3 ASN 67 10.552 10.497 -20.284 568 1HD2 ASN 67 1HD2 ASN 67 10.663 12.275 -17.232 569 2HD2 ASN 67 2HD2 ASN 67 12.345 12.749 -17.405 570 HA PRO 68 HA PRO 68 10.710 15.090 -23.284 571 1HB PRO 68 HB2 PRO 68 13.140 15.756 -21.612 572 2HB PRO 68 HB3 PRO 68 12.225 16.809 -22.737 573 1HG PRO 68 HG2 PRO 68 11.763 16.957 -20.079 574 2HG PRO 68 HG3 PRO 68 10.380 16.947 -21.222 575 1HD PRO 68 HD2 PRO 68 11.460 14.680 -19.551 576 2HD PRO 68 HD3 PRO 68 9.763 15.136 -19.894 577 H GLY 69 H GLY 69 13.484 13.419 -21.670 578 1HA GLY 69 HA2 GLY 69 14.331 12.433 -24.375 579 2HA GLY 69 HA3 GLY 69 15.354 12.714 -22.980 580 H SER 70 H SER 70 13.417 11.180 -21.146 581 HA SER 70 HA SER 70 14.688 8.605 -21.592 582 1HB SER 70 HB2 SER 70 12.620 9.343 -19.493 583 2HB SER 70 HB3 SER 70 13.697 7.942 -19.493 584 HG SER 70 HG SER 70 14.375 10.684 -19.209 585 H THR 71 H THR 71 13.070 9.036 -23.795 586 HA THR 71 HA THR 71 10.455 7.987 -23.706 587 HB THR 71 H5T THR 71 11.410 9.323 -25.547 588 HG1 THR 71 HG1 THR 71 9.579 8.356 -26.081 589 1HG2 THR 71 1HG2 THR 71 12.746 6.737 -26.461 590 2HG2 THR 71 2HG2 THR 71 12.662 8.270 -27.351 591 3HG2 THR 71 3HG2 THR 71 13.591 8.178 -25.849 592 H SER 72 H SER 72 13.457 6.216 -23.653 593 HA SER 72 HA SER 72 12.436 3.617 -24.326 594 1HB SER 72 HB2 SER 72 14.821 4.347 -22.587 595 2HB SER 72 HB3 SER 72 14.527 2.795 -23.396 596 HG SER 72 HG SER 72 15.959 4.141 -24.594 597 H ALA 73 H ALA 73 11.933 5.479 -21.406 598 HA ALA 73 HA ALA 73 12.043 3.673 -19.419 599 1HB ALA 73 HB1 ALA 73 10.190 4.936 -18.328 600 2HB ALA 73 HB2 ALA 73 11.414 5.980 -19.076 601 3HB ALA 73 HB3 ALA 73 9.846 5.732 -19.877 602 H ALA 74 H ALA 74 8.869 3.964 -21.180 603 HA ALA 74 HA ALA 74 7.659 1.610 -20.160 604 1HB ALA 74 HB1 ALA 74 6.552 3.439 -21.367 605 2HB ALA 74 HB2 ALA 74 7.314 2.869 -22.876 606 3HB ALA 74 HB3 ALA 74 6.170 1.830 -21.981 607 H THR 75 H THR 75 10.108 1.870 -22.742 608 HA THR 75 HA THR 75 9.756 -0.886 -23.647 609 HB THR 75 H5T THR 75 12.104 1.047 -23.985 610 HG1 THR 75 HG1 THR 75 11.114 1.396 -26.020 611 1HG2 THR 75 1HG2 THR 75 12.578 -0.304 -26.032 612 2HG2 THR 75 2HG2 THR 75 12.744 -1.275 -24.567 613 3HG2 THR 75 3HG2 THR 75 11.286 -1.439 -25.573 614 H CYS 76 H CYS 76 11.972 0.717 -21.303 615 HA CYS 76 HA CYS 76 13.325 -1.773 -20.587 616 1HB CYS 76 HB2 CYS 76 13.043 0.878 -19.075 617 2HB CYS 76 HB3 CYS 76 14.190 -0.421 -18.697 618 HG CYS 76 HG CYS 76 13.922 1.380 -21.471 619 H THR 77 H THR 77 10.509 0.018 -19.189 620 HA THR 77 HA THR 77 9.857 -1.698 -17.138 621 HB THR 77 H5T THR 77 8.132 -0.215 -19.115 622 HG1 THR 77 HG1 THR 77 7.776 0.944 -17.198 623 1HG2 THR 77 1HG2 THR 77 7.109 -1.833 -16.752 624 2HG2 THR 77 2HG2 THR 77 6.187 -0.603 -17.658 625 3HG2 THR 77 3HG2 THR 77 6.687 -2.086 -18.461 626 H ARG 78 H ARG 78 9.608 -2.629 -20.615 627 HA ARG 78 HA ARG 78 7.853 -4.785 -20.239 628 1HB ARG 78 HB2 ARG 78 8.312 -5.393 -22.397 629 2HB ARG 78 HB3 ARG 78 8.817 -3.704 -22.432 630 1HG ARG 78 HG2 ARG 78 11.224 -4.633 -22.070 631 2HG ARG 78 HG3 ARG 78 10.526 -6.228 -22.348 632 1HD ARG 78 HD2 ARG 78 9.681 -5.461 -24.572 633 2HD ARG 78 HD3 ARG 78 10.412 -3.883 -24.283 634 HE ARG 78 H3T ARG 78 12.525 -4.734 -24.713 635 1HH1 ARG 78 2HH2 ARG 78 10.353 -7.486 -24.524 636 2HH1 ARG 78 1HH2 ARG 78 11.560 -8.586 -25.129 637 1HH2 ARG 78 2HH1 ARG 78 14.001 -6.197 -25.486 638 2HH2 ARG 78 1HH1 ARG 78 13.562 -7.870 -25.660 639 H ARG 79 H ARG 79 11.342 -4.615 -19.553 640 HA ARG 79 HA ARG 79 11.389 -7.504 -19.404 641 1HB ARG 79 HB2 ARG 79 13.764 -7.388 -19.355 642 2HB ARG 79 HB3 ARG 79 13.264 -6.071 -20.422 643 1HG ARG 79 HG2 ARG 79 13.405 -4.553 -18.351 644 2HG ARG 79 HG3 ARG 79 14.180 -5.905 -17.521 645 1HD ARG 79 HD2 ARG 79 15.967 -5.877 -19.274 646 2HD ARG 79 HD3 ARG 79 15.179 -4.446 -19.984 647 HE ARG 79 H3T ARG 79 15.773 -4.240 -17.110 648 1HH1 ARG 79 2HH2 ARG 79 17.102 -3.567 -20.288 649 2HH1 ARG 79 1HH2 ARG 79 18.190 -2.355 -19.671 650 1HH2 ARG 79 2HH1 ARG 79 17.208 -2.742 -16.394 651 2HH2 ARG 79 1HH1 ARG 79 18.252 -1.906 -17.511 652 H HIS 80 H HIS 80 10.554 -5.168 -17.238 653 HA HIS 80 HA HIS 80 11.002 -7.018 -14.918 654 1HB HIS 80 HB2 HIS 80 10.699 -4.019 -14.928 655 2HB HIS 80 HB3 HIS 80 10.754 -5.061 -13.499 656 HD1 HIS 80 HD1 HIS 80 13.154 -6.483 -13.168 657 HD2 HIS 80 HD2 HIS 80 13.055 -3.352 -15.959 658 HE1 HIS 80 HE1 HIS 80 15.584 -5.939 -13.723 659 H TYR 81 H TYR 81 8.531 -5.292 -16.808 660 HA TYR 81 HA TYR 81 6.241 -6.009 -15.296 661 1HB TYR 81 HB2 TYR 81 6.434 -4.497 -17.302 662 2HB TYR 81 HB3 TYR 81 6.611 -5.912 -18.319 663 HD1 TYR 81 HD1 TYR 81 4.592 -7.664 -18.227 664 HD2 TYR 81 HD2 TYR 81 4.354 -3.528 -17.003 665 HE1 TYR 81 HE1 TYR 81 2.140 -7.688 -18.592 666 HE2 TYR 81 HE2 TYR 81 1.909 -3.542 -17.440 667 HH TYR 81 HH TYR 81 0.120 -4.760 -18.170 668 H GLU 82 H GLU 82 8.375 -7.991 -17.392 669 HA GLU 82 HA GLU 82 6.596 -10.258 -17.472 670 1HB GLU 82 HB2 GLU 82 8.344 -11.454 -18.528 671 2HB GLU 82 HB3 GLU 82 8.148 -9.878 -19.283 672 1HG GLU 82 HG2 GLU 82 10.142 -9.031 -18.237 673 2HG GLU 82 HG3 GLU 82 10.306 -10.451 -17.211 674 H ARG 83 H ARG 83 8.395 -8.965 -14.892 675 HA ARG 83 HA ARG 83 7.987 -11.566 -13.538 676 1HB ARG 83 HB2 ARG 83 10.233 -9.578 -13.016 677 2HB ARG 83 HB3 ARG 83 9.909 -10.987 -12.011 678 1HG ARG 83 HG2 ARG 83 10.729 -11.080 -14.937 679 2HG ARG 83 HG3 ARG 83 11.791 -11.331 -13.558 680 1HD ARG 83 HD2 ARG 83 10.538 -13.327 -12.875 681 2HD ARG 83 HD3 ARG 83 9.391 -13.113 -14.194 682 HE ARG 83 H3T ARG 83 12.113 -14.173 -14.362 683 1HH1 ARG 83 2HH1 ARG 83 9.479 -12.860 -16.295 684 2HH1 ARG 83 1HH1 ARG 83 10.413 -13.040 -17.776 685 1HH2 ARG 83 2HH2 ARG 83 13.051 -14.649 -16.350 686 2HH2 ARG 83 1HH2 ARG 83 12.196 -14.228 -17.812 687 H LEU 84 H LEU 84 7.281 -8.158 -13.408 688 HA LEU 84 HA LEU 84 6.420 -8.388 -10.564 689 1HB LEU 84 HB2 LEU 84 6.994 -6.096 -12.458 690 2HB LEU 84 HB3 LEU 84 5.903 -5.866 -11.115 691 HG LEU 84 HG LEU 84 7.664 -6.680 -9.528 692 1HD1 LEU 84 1HD1 LEU 84 9.193 -7.788 -11.141 693 2HD1 LEU 84 2HD1 LEU 84 9.488 -6.227 -11.929 694 3HD1 LEU 84 3HD1 LEU 84 10.013 -6.495 -10.254 695 1HD2 LEU 84 1HD2 LEU 84 8.051 -4.185 -11.228 696 2HD2 LEU 84 2HD2 LEU 84 7.102 -4.338 -9.744 697 3HD2 LEU 84 3HD2 LEU 84 8.868 -4.452 -9.670 698 H ILE 85 H ILE 85 4.919 -8.901 -13.591 699 HA ILE 85 HA ILE 85 2.417 -9.057 -12.189 700 HB ILE 85 H5T ILE 85 2.473 -6.620 -12.756 701 1HG1 ILE 85 2HG1 ILE 85 0.187 -7.962 -14.234 702 2HG1 ILE 85 3HG1 ILE 85 0.375 -8.176 -12.490 703 1HG2 ILE 85 1HG2 ILE 85 2.146 -7.507 -15.639 704 2HG2 ILE 85 2HG2 ILE 85 2.092 -5.849 -15.019 705 3HG2 ILE 85 3HG2 ILE 85 3.602 -6.757 -14.948 706 1HD1 ILE 85 1HD1 ILE 85 -1.182 -6.345 -13.081 707 2HD1 ILE 85 2HD1 ILE 85 0.169 -5.818 -12.076 708 3HD1 ILE 85 3HD1 ILE 85 0.177 -5.451 -13.810 709 H LEU 86 H LEU 86 4.174 -9.596 -15.236 710 HA LEU 86 HA LEU 86 2.297 -11.222 -16.493 711 1HB LEU 86 HB2 LEU 86 4.470 -10.522 -17.319 712 2HB LEU 86 HB3 LEU 86 5.282 -11.650 -16.235 713 HG LEU 86 HG LEU 86 5.146 -12.240 -18.672 714 1HD1 LEU 86 1HD1 LEU 86 5.643 -13.934 -16.941 715 2HD1 LEU 86 2HD1 LEU 86 3.923 -14.370 -16.889 716 3HD1 LEU 86 3HD1 LEU 86 4.853 -14.589 -18.379 717 1HD2 LEU 86 1HD2 LEU 86 2.232 -12.885 -18.099 718 2HD2 LEU 86 2HD2 LEU 86 2.822 -11.531 -19.080 719 3HD2 LEU 86 3HD2 LEU 86 3.127 -13.196 -19.602 720 HA PRO 87 HA PRO 87 3.032 -14.922 -13.588 721 1HB PRO 87 HB2 PRO 87 3.959 -14.562 -11.032 722 2HB PRO 87 HB3 PRO 87 5.005 -14.923 -12.438 723 1HG PRO 87 HG2 PRO 87 4.379 -12.213 -11.234 724 2HG PRO 87 HG3 PRO 87 5.985 -12.900 -11.648 725 1HD PRO 87 HD2 PRO 87 4.720 -11.215 -13.310 726 2HD PRO 87 HD3 PRO 87 5.601 -12.615 -13.971 727 H TYR 88 H TYR 88 1.741 -11.783 -12.538 728 HA TYR 88 HA TYR 88 -0.257 -13.204 -10.822 729 1HB TYR 88 HB2 TYR 88 1.017 -10.539 -10.679 730 2HB TYR 88 HB3 TYR 88 -0.714 -10.567 -10.388 731 HD1 TYR 88 HD1 TYR 88 1.936 -13.129 -9.478 732 HD2 TYR 88 HD2 TYR 88 -1.029 -10.329 -8.098 733 HE1 TYR 88 HE1 TYR 88 2.213 -13.981 -7.164 734 HE2 TYR 88 HE2 TYR 88 -0.739 -11.174 -5.772 735 HH TYR 88 HH TYR 88 1.548 -13.811 -4.976 736 H GLU 89 H GLU 89 -0.227 -11.005 -13.689 737 HA GLU 89 HA GLU 89 -2.995 -11.009 -14.122 738 1HB GLU 89 HB2 GLU 89 -2.558 -10.620 -16.443 739 2HB GLU 89 HB3 GLU 89 -1.350 -9.788 -15.480 740 1HG GLU 89 HG2 GLU 89 -0.067 -10.639 -17.192 741 2HG GLU 89 HG3 GLU 89 0.172 -11.832 -15.932 742 H ARG 90 H ARG 90 -1.037 -13.770 -13.955 743 HA ARG 90 HA ARG 90 -2.494 -15.546 -15.657 744 1HB ARG 90 HB2 ARG 90 -0.178 -15.778 -14.368 745 2HB ARG 90 HB3 ARG 90 -1.166 -16.389 -13.054 746 1HG ARG 90 HG2 ARG 90 -0.159 -18.150 -14.495 747 2HG ARG 90 HG3 ARG 90 -1.917 -18.260 -14.423 748 1HD ARG 90 HD2 ARG 90 -0.836 -18.624 -16.714 749 2HD ARG 90 HD3 ARG 90 -2.188 -17.515 -16.635 750 HE ARG 90 H3T ARG 90 -0.730 -15.622 -16.926 751 1HH1 ARG 90 2HH2 ARG 90 1.149 -18.585 -17.230 752 2HH1 ARG 90 1HH2 ARG 90 2.441 -17.732 -18.030 753 1HH2 ARG 90 2HH1 ARG 90 0.802 -14.684 -17.827 754 2HH2 ARG 90 1HH1 ARG 90 2.262 -15.510 -18.385 755 H PHE 91 H PHE 91 -3.315 -14.272 -12.433 756 HA PHE 91 HA PHE 91 -5.438 -16.160 -11.992 757 1HB PHE 91 HB2 PHE 91 -6.438 -14.455 -10.480 758 2HB PHE 91 HB3 PHE 91 -4.819 -14.998 -10.129 759 HD1 PHE 91 HD1 PHE 91 -3.987 -13.335 -8.762 760 HD2 PHE 91 HD2 PHE 91 -5.863 -12.156 -12.469 761 HE1 PHE 91 HE1 PHE 91 -3.205 -11.016 -8.435 762 HE2 PHE 91 HE2 PHE 91 -5.007 -9.865 -12.168 763 HZ PHE 91 HZ PHE 91 -3.657 -9.288 -10.159 764 H ILE 92 H ILE 92 -5.371 -13.530 -14.335 765 HA ILE 92 HA ILE 92 -8.269 -13.519 -14.533 766 HB ILE 92 H5T ILE 92 -6.483 -11.652 -15.103 767 1HG1 ILE 92 2HG1 ILE 92 -9.078 -12.049 -16.639 768 2HG1 ILE 92 3HG1 ILE 92 -8.940 -11.481 -14.975 769 1HG2 ILE 92 1HG2 ILE 92 -5.938 -11.348 -17.393 770 2HG2 ILE 92 2HG2 ILE 92 -5.538 -13.037 -17.082 771 3HG2 ILE 92 3HG2 ILE 92 -7.035 -12.634 -17.933 772 1HD1 ILE 92 1HD1 ILE 92 -7.914 -10.029 -17.447 773 2HD1 ILE 92 2HD1 ILE 92 -9.289 -9.585 -16.425 774 3HD1 ILE 92 3HD1 ILE 92 -7.638 -9.502 -15.768 775 H LYS 93 H LYS 93 -6.010 -15.778 -15.640 776 HA LYS 93 HA LYS 93 -7.910 -16.767 -17.738 777 1HB LYS 93 HB2 LYS 93 -5.989 -17.091 -19.271 778 2HB LYS 93 HB3 LYS 93 -6.350 -15.407 -18.898 779 1HG LYS 93 HG2 LYS 93 -4.454 -15.399 -17.229 780 2HG LYS 93 HG3 LYS 93 -4.098 -17.069 -17.678 781 1HD LYS 93 HD2 LYS 93 -2.590 -15.413 -18.721 782 2HD LYS 93 HD3 LYS 93 -3.465 -16.369 -19.928 783 1HE LYS 93 HE2 LYS 93 -4.949 -14.568 -20.443 784 2HE LYS 93 HE3 LYS 93 -4.481 -13.654 -19.000 785 1HZ LYS 93 HZ1 LYS 93 -3.504 -12.931 -21.203 786 2HZ LYS 93 HZ2 LYS 93 -2.457 -13.081 -19.929 787 3HZ LYS 93 HZ3 LYS 93 -2.515 -14.230 -21.118 788 H GLY 94 H GLY 94 -5.643 -17.608 -15.196 789 1HA GLY 94 HA2 GLY 94 -5.689 -20.471 -15.856 790 2HA GLY 94 HA3 GLY 94 -5.079 -19.707 -14.387 791 H GLU 95 H GLU 95 -7.372 -18.330 -13.525 792 HA GLU 95 HA GLU 95 -9.578 -20.305 -13.292 793 1HB GLU 95 HB2 GLU 95 -8.260 -18.861 -10.941 794 2HB GLU 95 HB3 GLU 95 -9.716 -19.858 -10.841 795 1HG GLU 95 HG2 GLU 95 -8.395 -21.831 -11.624 796 2HG GLU 95 HG3 GLU 95 -6.929 -20.844 -11.549 797 H GLU 96 H GLU 96 -9.071 -17.732 -14.632 798 HA GLU 96 HA GLU 96 -9.740 -15.492 -14.687 799 1HB GLU 96 HB2 GLU 96 -11.861 -15.383 -15.836 800 2HB GLU 96 HB3 GLU 96 -10.804 -16.640 -16.456 801 1HG GLU 96 HG2 GLU 96 -12.125 -18.398 -15.553 802 2HG GLU 96 HG3 GLU 96 -13.031 -17.320 -14.498 803 H ASP 97 H ASP 97 -9.420 -14.891 -12.360 804 HA ASP 97 HA ASP 97 -11.829 -14.867 -10.676 805 1HB ASP 97 HB2 ASP 97 -9.454 -15.265 -9.895 806 2HB ASP 97 HB3 ASP 97 -9.100 -13.581 -10.266 807 H LYS 98 H LYS 98 -11.213 -13.036 -13.323 808 HA LYS 98 HA LYS 98 -11.301 -10.741 -13.862 809 1HB LYS 98 HB2 LYS 98 -13.962 -11.622 -12.714 810 2HB LYS 98 HB3 LYS 98 -13.764 -10.211 -13.760 811 1HG LYS 98 HG2 LYS 98 -12.962 -11.526 -15.597 812 2HG LYS 98 HG3 LYS 98 -12.879 -12.996 -14.640 813 1HD LYS 98 HD2 LYS 98 -15.444 -11.494 -15.267 814 2HD LYS 98 HD3 LYS 98 -14.848 -12.875 -16.181 815 1HE LYS 98 HE2 LYS 98 -15.618 -12.923 -13.226 816 2HE LYS 98 HE3 LYS 98 -16.644 -13.446 -14.561 817 1HZ LYS 98 HZ1 LYS 98 -14.069 -14.715 -13.775 818 2HZ LYS 98 HZ2 LYS 98 -15.561 -15.352 -13.620 819 3HZ LYS 98 HZ3 LYS 98 -14.916 -15.137 -15.109 820 HA PRO 99 HA PRO 99 -11.009 -8.597 -9.714 821 1HB PRO 99 HB2 PRO 99 -8.355 -8.211 -9.351 822 2HB PRO 99 HB3 PRO 99 -9.114 -9.805 -9.067 823 1HG PRO 99 HG2 PRO 99 -7.669 -8.860 -11.571 824 2HG PRO 99 HG3 PRO 99 -7.401 -10.364 -10.625 825 1HD PRO 99 HD2 PRO 99 -9.007 -10.282 -12.854 826 2HD PRO 99 HD3 PRO 99 -9.311 -11.364 -11.464 827 H LEU 100 H LEU 100 -10.297 -7.748 -12.947 828 HA LEU 100 HA LEU 100 -8.859 -5.400 -12.732 829 1HB LEU 100 HB2 LEU 100 -11.034 -6.180 -14.715 830 2HB LEU 100 HB3 LEU 100 -10.020 -4.766 -14.929 831 HG LEU 100 HG LEU 100 -9.062 -7.650 -14.880 832 1HD1 LEU 100 1HD1 LEU 100 -9.207 -5.550 -17.093 833 2HD1 LEU 100 2HD1 LEU 100 -10.218 -7.008 -16.952 834 3HD1 LEU 100 3HD1 LEU 100 -8.485 -7.164 -17.253 835 1HD2 LEU 100 1HD2 LEU 100 -7.274 -6.290 -13.948 836 2HD2 LEU 100 2HD2 LEU 100 -6.872 -6.681 -15.619 837 3HD2 LEU 100 3HD2 LEU 100 -7.485 -5.062 -15.223 838 HA PRO 101 HA PRO 101 -11.497 -2.106 -11.232 839 1HB PRO 101 HB2 PRO 101 -10.407 0.064 -12.578 840 2HB PRO 101 HB3 PRO 101 -9.645 -0.750 -11.183 841 1HG PRO 101 HG2 PRO 101 -9.106 -1.178 -14.131 842 2HG PRO 101 HG3 PRO 101 -7.920 -0.935 -12.809 843 1HD PRO 101 HD2 PRO 101 -8.557 -3.395 -13.749 844 2HD PRO 101 HD3 PRO 101 -8.236 -3.129 -12.011 845 HA PRO 102 HA PRO 102 -14.955 -1.325 -13.758 846 1HB PRO 102 HB2 PRO 102 -14.381 1.647 -13.753 847 2HB PRO 102 HB3 PRO 102 -15.945 0.804 -13.499 848 1HG PRO 102 HG2 PRO 102 -14.538 1.645 -11.362 849 2HG PRO 102 HG3 PRO 102 -15.238 -0.009 -11.354 850 1HD PRO 102 HD2 PRO 102 -12.399 0.836 -11.926 851 2HD PRO 102 HD3 PRO 102 -12.994 -0.534 -10.943 852 H ILE 103 H ILE 103 -12.006 -0.376 -15.302 853 HA ILE 103 HA ILE 103 -13.334 0.124 -17.872 854 HB ILE 103 H5T ILE 103 -11.022 0.224 -18.810 855 1HG1 ILE 103 2HG1 ILE 103 -10.039 -0.112 -15.945 856 2HG1 ILE 103 3HG1 ILE 103 -10.050 -1.428 -17.121 857 1HG2 ILE 103 1HG2 ILE 103 -11.342 1.984 -16.343 858 2HG2 ILE 103 2HG2 ILE 103 -10.400 2.341 -17.805 859 3HG2 ILE 103 3HG2 ILE 103 -12.160 2.243 -17.898 860 1HD1 ILE 103 1HD1 ILE 103 -8.542 -0.131 -18.599 861 2HD1 ILE 103 2HD1 ILE 103 -8.467 1.163 -17.373 862 3HD1 ILE 103 3HD1 ILE 103 -7.838 -0.450 -17.003 863 H LYS 104 H LYS 104 -13.152 -2.532 -16.199 864 HA LYS 104 HA LYS 104 -12.119 -4.536 -17.818 865 1HB LYS 104 HB2 LYS 104 -13.046 -4.764 -15.488 866 2HB LYS 104 HB3 LYS 104 -14.673 -4.734 -16.179 867 1HG LYS 104 HG2 LYS 104 -13.995 -6.782 -17.571 868 2HG LYS 104 HG3 LYS 104 -12.467 -6.775 -16.710 869 1HD LYS 104 HD2 LYS 104 -13.856 -8.425 -15.691 870 2HD LYS 104 HD3 LYS 104 -13.711 -7.083 -14.557 871 1HE LYS 104 HE2 LYS 104 -15.991 -7.882 -14.560 872 2HE LYS 104 HE3 LYS 104 -15.962 -6.260 -15.251 873 1HZ LYS 104 HZ1 LYS 104 -16.144 -7.250 -17.466 874 2HZ LYS 104 HZ2 LYS 104 -16.039 -8.771 -16.871 875 3HZ LYS 104 HZ3 LYS 104 -17.345 -7.842 -16.530 876 HA PRO 105 HA PRO 105 -14.816 -4.760 -21.491 877 1HB PRO 105 HB2 PRO 105 -13.963 -7.654 -21.297 878 2HB PRO 105 HB3 PRO 105 -14.052 -6.601 -22.745 879 1HG PRO 105 HG2 PRO 105 -11.667 -7.092 -21.572 880 2HG PRO 105 HG3 PRO 105 -12.074 -5.424 -22.094 881 1HD PRO 105 HD2 PRO 105 -12.228 -6.615 -19.317 882 2HD PRO 105 HD3 PRO 105 -11.588 -5.026 -19.841 883 H ARG 106 H ARG 106 -16.624 -6.168 -22.268 884 HA ARG 106 HA ARG 106 -18.724 -6.405 -20.409 885 1HB ARG 106 HB2 ARG 106 -20.031 -7.265 -22.233 886 2HB ARG 106 HB3 ARG 106 -18.980 -5.983 -22.820 887 1HG ARG 106 HG2 ARG 106 -17.397 -7.721 -23.718 888 2HG ARG 106 HG3 ARG 106 -18.515 -8.987 -23.196 889 1HD ARG 106 HD2 ARG 106 -19.164 -6.751 -25.158 890 2HD ARG 106 HD3 ARG 106 -18.707 -8.399 -25.615 891 HE ARG 106 H3T ARG 106 -20.821 -8.926 -24.026 892 1HH1 ARG 106 2HH2 ARG 106 -20.589 -6.637 -26.671 893 2HH1 ARG 106 1HH2 ARG 106 -22.295 -6.733 -27.020 894 1HH2 ARG 106 2HH1 ARG 106 -22.980 -8.999 -24.526 895 2HH2 ARG 106 1HH1 ARG 106 -23.604 -8.045 -25.839 896 H LYS 107 H LYS 107 -16.252 -8.719 -20.684 897 HA LYS 107 HA LYS 107 -17.798 -10.528 -18.979 898 1HB LYS 107 HB2 LYS 107 -18.082 -11.288 -21.380 899 2HB LYS 107 HB3 LYS 107 -16.360 -11.616 -21.444 900 1HG LYS 107 HG2 LYS 107 -18.287 -12.892 -19.439 901 2HG LYS 107 HG3 LYS 107 -17.926 -13.559 -21.030 902 1HD LYS 107 HD2 LYS 107 -15.482 -13.663 -20.368 903 2HD LYS 107 HD3 LYS 107 -15.982 -13.265 -18.706 904 1HE LYS 107 HE2 LYS 107 -17.447 -15.241 -18.640 905 2HE LYS 107 HE3 LYS 107 -17.096 -15.586 -20.337 906 1HZ LYS 107 HZ1 LYS 107 -14.733 -15.907 -19.664 907 2HZ LYS 107 HZ2 LYS 107 -15.156 -15.776 -18.083 908 3HZ LYS 107 HZ3 LYS 107 -15.732 -16.990 -18.976 Start of MODEL 5 1 1H ARG 1 H1 ARG 1 -7.531 1.270 -7.811 2 2H ARG 1 H2 ARG 1 -8.184 0.760 -6.401 3 3H ARG 1 H3 ARG 1 -7.452 -0.312 -7.426 4 HA ARG 1 HA ARG 1 -5.346 0.727 -7.168 5 1HB ARG 1 HB2 ARG 1 -6.265 2.977 -6.565 6 2HB ARG 1 HB3 ARG 1 -6.557 2.402 -4.926 7 1HG ARG 1 HG2 ARG 1 -3.805 2.054 -6.143 8 2HG ARG 1 HG3 ARG 1 -4.310 3.672 -5.669 9 1HD ARG 1 HD2 ARG 1 -4.547 3.016 -3.352 10 2HD ARG 1 HD3 ARG 1 -4.311 1.316 -3.747 11 HE ARG 1 H3T ARG 1 -2.026 1.605 -3.861 12 1HH1 ARG 1 2HH1 ARG 1 -3.375 4.850 -3.822 13 2HH1 ARG 1 1HH1 ARG 1 -1.797 5.565 -3.639 14 1HH2 ARG 1 2HH2 ARG 1 -0.160 2.528 -3.605 15 2HH2 ARG 1 1HH2 ARG 1 0.012 4.274 -3.521 16 H ALA 2 H ALA 2 -7.529 -0.142 -4.424 17 HA ALA 2 HA ALA 2 -5.241 -1.040 -2.877 18 1HB ALA 2 HB1 ALA 2 -8.238 -1.407 -2.430 19 2HB ALA 2 HB2 ALA 2 -6.957 -1.674 -1.230 20 3HB ALA 2 HB3 ALA 2 -7.256 -0.040 -1.849 21 H ASP 3 H ASP 3 -7.504 -2.734 -5.054 22 HA ASP 3 HA ASP 3 -6.761 -5.398 -4.133 23 1HB ASP 3 HB2 ASP 3 -8.027 -4.403 -6.719 24 2HB ASP 3 HB3 ASP 3 -7.810 -6.099 -6.294 25 H GLU 4 H GLU 4 -5.559 -3.156 -6.650 26 HA GLU 4 HA GLU 4 -3.603 -4.978 -7.835 27 1HB GLU 4 HB2 GLU 4 -3.451 -1.961 -7.699 28 2HB GLU 4 HB3 GLU 4 -2.667 -3.059 -8.825 29 1HG GLU 4 HG2 GLU 4 -4.325 -2.384 -10.197 30 2HG GLU 4 HG3 GLU 4 -5.230 -3.680 -9.424 31 H GLN 5 H GLN 5 -3.569 -2.439 -5.289 32 HA GLN 5 HA GLN 5 -0.875 -2.678 -4.635 33 1HB GLN 5 HB2 GLN 5 -2.583 -0.904 -3.887 34 2HB GLN 5 HB3 GLN 5 -3.126 -2.057 -2.669 35 1HG GLN 5 HG2 GLN 5 -1.620 -0.551 -1.600 36 2HG GLN 5 HG3 GLN 5 -0.752 -2.076 -1.755 37 1HE2 GLN 5 1HE2 GLN 5 1.192 -2.062 -2.984 38 2HE2 GLN 5 2HE2 GLN 5 1.772 -0.621 -3.811 39 H ALA 6 H ALA 6 -3.662 -4.498 -3.292 40 HA ALA 6 HA ALA 6 -2.131 -6.067 -1.446 41 1HB ALA 6 HB1 ALA 6 -4.583 -5.821 -1.326 42 2HB ALA 6 HB2 ALA 6 -4.765 -6.690 -2.866 43 3HB ALA 6 HB3 ALA 6 -4.129 -7.531 -1.436 44 H PHE 7 H PHE 7 -3.136 -6.821 -4.865 45 HA PHE 7 HA PHE 7 -1.701 -9.322 -4.762 46 1HB PHE 7 HB2 PHE 7 -2.530 -9.816 -6.792 47 2HB PHE 7 HB3 PHE 7 -3.753 -8.786 -6.100 48 HD1 PHE 7 HD1 PHE 7 -4.900 -7.589 -7.684 49 HD2 PHE 7 HD2 PHE 7 -0.700 -8.320 -8.355 50 HE1 PHE 7 HE1 PHE 7 -5.045 -6.458 -9.882 51 HE2 PHE 7 HE2 PHE 7 -0.846 -7.156 -10.515 52 HZ PHE 7 HZ PHE 7 -3.015 -6.219 -11.300 53 H LEU 8 H LEU 8 -0.426 -6.174 -5.050 54 HA LEU 8 HA LEU 8 1.894 -7.198 -6.665 55 1HB LEU 8 HB2 LEU 8 0.936 -4.387 -6.087 56 2HB LEU 8 HB3 LEU 8 2.546 -4.737 -6.713 57 HG LEU 8 HG LEU 8 0.088 -5.836 -8.129 58 1HD1 LEU 8 1HD1 LEU 8 -0.215 -3.399 -7.890 59 2HD1 LEU 8 2HD1 LEU 8 1.372 -3.139 -8.620 60 3HD1 LEU 8 3HD1 LEU 8 0.049 -3.891 -9.561 61 1HD2 LEU 8 1HD2 LEU 8 1.576 -5.801 -10.084 62 2HD2 LEU 8 2HD2 LEU 8 2.883 -5.105 -9.107 63 3HD2 LEU 8 3HD2 LEU 8 2.300 -6.751 -8.791 64 H VAL 9 H VAL 9 0.783 -6.137 -3.457 65 HA VAL 9 HA VAL 9 3.481 -6.196 -2.304 66 HB VAL 9 H5T VAL 9 0.698 -6.295 -1.114 67 1HG1 VAL 9 1HG1 VAL 9 2.041 -7.695 0.374 68 2HG1 VAL 9 2HG1 VAL 9 3.356 -6.493 0.373 69 3HG1 VAL 9 3HG1 VAL 9 1.789 -6.120 1.126 70 1HG2 VAL 9 1HG2 VAL 9 1.347 -4.129 -0.182 71 2HG2 VAL 9 2HG2 VAL 9 3.005 -4.310 -0.802 72 3HG2 VAL 9 3HG2 VAL 9 1.654 -4.097 -1.925 73 H ALA 10 H ALA 10 0.761 -8.506 -2.674 74 HA ALA 10 HA ALA 10 2.074 -10.776 -1.659 75 1HB ALA 10 HB1 ALA 10 0.476 -12.064 -3.034 76 2HB ALA 10 HB2 ALA 10 -0.325 -10.693 -2.239 77 3HB ALA 10 HB3 ALA 10 0.086 -10.607 -3.966 78 H LEU 11 H LEU 11 2.102 -9.715 -5.166 79 HA LEU 11 HA LEU 11 4.102 -11.578 -5.927 80 1HB LEU 11 HB2 LEU 11 2.847 -10.355 -7.568 81 2HB LEU 11 HB3 LEU 11 3.529 -8.813 -7.056 82 HG LEU 11 HG LEU 11 5.530 -10.940 -7.809 83 1HD1 LEU 11 1HD1 LEU 11 5.283 -10.433 -10.226 84 2HD1 LEU 11 2HD1 LEU 11 3.954 -11.359 -9.543 85 3HD1 LEU 11 3HD1 LEU 11 3.728 -9.630 -9.862 86 1HD2 LEU 11 1HD2 LEU 11 5.298 -8.013 -8.625 87 2HD2 LEU 11 2HD2 LEU 11 6.178 -8.565 -7.196 88 3HD2 LEU 11 3HD2 LEU 11 6.720 -9.082 -8.778 89 H TYR 12 H TYR 12 4.608 -8.239 -4.612 90 HA TYR 12 HA TYR 12 7.420 -8.212 -4.759 91 1HB TYR 12 HB2 TYR 12 6.430 -6.173 -4.263 92 2HB TYR 12 HB3 TYR 12 5.364 -6.872 -3.061 93 HD1 TYR 12 HD1 TYR 12 5.630 -5.886 -1.020 94 HD2 TYR 12 HD2 TYR 12 9.130 -6.847 -3.351 95 HE1 TYR 12 HE1 TYR 12 7.066 -5.152 0.848 96 HE2 TYR 12 HE2 TYR 12 10.580 -6.117 -1.466 97 HH TYR 12 HH TYR 12 9.222 -4.908 1.626 98 H LYS 13 H LYS 13 5.370 -9.512 -2.082 99 HA LYS 13 HA LYS 13 7.603 -10.372 -0.476 100 1HB LYS 13 HB2 LYS 13 4.685 -11.258 -0.630 101 2HB LYS 13 HB3 LYS 13 5.835 -11.947 0.524 102 1HG LYS 13 HG2 LYS 13 6.252 -9.764 1.528 103 2HG LYS 13 HG3 LYS 13 5.207 -8.966 0.345 104 1HD LYS 13 HD2 LYS 13 3.257 -10.244 1.176 105 2HD LYS 13 HD3 LYS 13 4.299 -11.077 2.353 106 1HE LYS 13 HE2 LYS 13 4.877 -8.879 3.376 107 2HE LYS 13 HE3 LYS 13 3.815 -8.063 2.222 108 1HZ LYS 13 HZ1 LYS 13 2.690 -8.453 4.340 109 2HZ LYS 13 HZ2 LYS 13 1.942 -9.319 3.176 110 3HZ LYS 13 HZ3 LYS 13 2.932 -10.062 4.243 111 H TYR 14 H TYR 14 5.697 -12.241 -2.973 112 HA TYR 14 HA TYR 14 7.273 -14.589 -2.714 113 1HB TYR 14 HB2 TYR 14 5.150 -14.607 -3.808 114 2HB TYR 14 HB3 TYR 14 5.606 -13.331 -4.915 115 HD1 TYR 14 HD1 TYR 14 6.627 -13.770 -7.011 116 HD2 TYR 14 HD2 TYR 14 6.176 -16.930 -4.105 117 HE1 TYR 14 HE1 TYR 14 7.198 -15.456 -8.754 118 HE2 TYR 14 HE2 TYR 14 6.776 -18.610 -5.842 119 HH TYR 14 HH TYR 14 7.340 -18.967 -8.035 120 H MET 15 H MET 15 7.768 -11.697 -4.701 121 HA MET 15 HA MET 15 10.026 -12.580 -6.198 122 1HB MET 15 HB2 MET 15 8.684 -10.804 -6.985 123 2HB MET 15 HB3 MET 15 8.844 -9.877 -5.487 124 1HG MET 15 HG2 MET 15 11.081 -9.403 -5.837 125 2HG MET 15 HG3 MET 15 11.239 -10.562 -7.164 126 1HE MET 15 HE1 MET 15 8.890 -10.073 -9.151 127 2HE MET 15 HE2 MET 15 9.553 -8.799 -10.189 128 3HE MET 15 HE3 MET 15 10.597 -10.129 -9.642 129 H LYS 16 H LYS 16 9.916 -10.472 -3.190 130 HA LYS 16 HA LYS 16 12.685 -10.522 -2.655 131 1HB LYS 16 HB2 LYS 16 10.931 -9.170 -1.530 132 2HB LYS 16 HB3 LYS 16 10.349 -10.610 -0.689 133 1HG LYS 16 HG2 LYS 16 12.452 -10.808 0.539 134 2HG LYS 16 HG3 LYS 16 13.185 -9.516 -0.431 135 1HD LYS 16 HD2 LYS 16 11.467 -7.916 0.430 136 2HD LYS 16 HD3 LYS 16 10.797 -9.208 1.447 137 1HE LYS 16 HE2 LYS 16 12.969 -9.411 2.625 138 2HE LYS 16 HE3 LYS 16 13.664 -8.165 1.578 139 1HZ LYS 16 HZ1 LYS 16 12.023 -6.593 2.481 140 2HZ LYS 16 HZ2 LYS 16 11.408 -7.741 3.467 141 3HZ LYS 16 HZ3 LYS 16 12.936 -7.214 3.684 142 H GLU 17 H GLU 17 10.230 -12.979 -1.749 143 HA GLU 17 HA GLU 17 12.223 -14.783 -0.709 144 1HB GLU 17 HB2 GLU 17 9.316 -15.107 -1.455 145 2HB GLU 17 HB3 GLU 17 10.279 -16.487 -0.935 146 1HG GLU 17 HG2 GLU 17 10.053 -13.946 0.728 147 2HG GLU 17 HG3 GLU 17 8.957 -15.314 0.881 148 H ARG 18 H ARG 18 11.956 -13.917 -3.888 149 HA ARG 18 HA ARG 18 13.037 -16.564 -4.836 150 1HB ARG 18 HB2 ARG 18 11.702 -14.274 -6.166 151 2HB ARG 18 HB3 ARG 18 13.224 -14.684 -6.920 152 1HG ARG 18 HG2 ARG 18 11.489 -15.819 -8.045 153 2HG ARG 18 HG3 ARG 18 12.474 -17.026 -7.226 154 1HD ARG 18 HD2 ARG 18 9.936 -15.944 -5.955 155 2HD ARG 18 HD3 ARG 18 9.850 -17.161 -7.219 156 HE ARG 18 H3T ARG 18 11.353 -18.596 -5.793 157 1HH1 ARG 18 2HH1 ARG 18 9.277 -16.283 -4.169 158 2HH1 ARG 18 1HH1 ARG 18 8.921 -17.405 -2.874 159 1HH2 ARG 18 2HH2 ARG 18 10.980 -19.884 -4.042 160 2HH2 ARG 18 1HH2 ARG 18 9.945 -19.338 -2.761 161 H LYS 19 H LYS 19 14.006 -13.899 -3.183 162 HA LYS 19 HA LYS 19 15.900 -13.044 -2.449 163 1HB LYS 19 HB2 LYS 19 17.463 -15.212 -3.868 164 2HB LYS 19 HB3 LYS 19 17.972 -14.219 -2.507 165 1HG LYS 19 HG2 LYS 19 15.857 -16.409 -2.500 166 2HG LYS 19 HG3 LYS 19 17.429 -16.422 -1.713 167 1HD LYS 19 HD2 LYS 19 16.665 -14.587 -0.186 168 2HD LYS 19 HD3 LYS 19 15.057 -14.658 -0.941 169 1HE LYS 19 HE2 LYS 19 14.878 -17.064 -0.314 170 2HE LYS 19 HE3 LYS 19 16.455 -16.958 0.475 171 1HZ LYS 19 HZ1 LYS 19 15.436 -15.208 1.938 172 2HZ LYS 19 HZ2 LYS 19 13.955 -15.559 1.313 173 3HZ LYS 19 HZ3 LYS 19 14.780 -16.687 2.130 174 H THR 20 H THR 20 14.625 -11.998 -4.658 175 HA THR 20 HA THR 20 16.785 -10.264 -5.517 176 HB THR 20 H5T THR 20 16.965 -11.896 -7.225 177 HG1 THR 20 HG1 THR 20 17.332 -9.898 -7.940 178 1HG2 THR 20 1HG2 THR 20 15.313 -12.488 -8.834 179 2HG2 THR 20 2HG2 THR 20 14.687 -12.874 -7.229 180 3HG2 THR 20 3HG2 THR 20 14.091 -11.441 -8.091 181 HA PRO 21 HA PRO 21 12.795 -8.538 -4.069 182 1HB PRO 21 HB2 PRO 21 13.736 -6.303 -2.748 183 2HB PRO 21 HB3 PRO 21 13.736 -7.957 -2.071 184 1HG PRO 21 HG2 PRO 21 16.009 -6.514 -3.462 185 2HG PRO 21 HG3 PRO 21 16.053 -7.415 -1.910 186 1HD PRO 21 HD2 PRO 21 16.859 -8.548 -4.229 187 2HD PRO 21 HD3 PRO 21 15.944 -9.505 -3.021 188 H ILE 22 H ILE 22 11.460 -6.728 -4.488 189 HA ILE 22 HA ILE 22 11.587 -6.051 -7.186 190 HB ILE 22 H5T ILE 22 9.619 -6.278 -5.616 191 1HG1 ILE 22 2HG1 ILE 22 9.414 -3.899 -7.487 192 2HG1 ILE 22 3HG1 ILE 22 9.508 -5.581 -8.028 193 1HG2 ILE 22 1HG2 ILE 22 10.398 -4.549 -3.942 194 2HG2 ILE 22 2HG2 ILE 22 9.997 -3.290 -5.129 195 3HG2 ILE 22 3HG2 ILE 22 8.731 -4.338 -4.474 196 1HD1 ILE 22 1HD1 ILE 22 7.316 -4.394 -6.275 197 2HD1 ILE 22 2HD1 ILE 22 7.180 -4.944 -7.948 198 3HD1 ILE 22 3HD1 ILE 22 7.475 -6.125 -6.669 199 H GLU 23 H GLU 23 12.794 -4.020 -4.524 200 HA GLU 23 HA GLU 23 13.081 -1.629 -5.990 201 1HB GLU 23 HB2 GLU 23 14.810 -2.738 -3.743 202 2HB GLU 23 HB3 GLU 23 14.808 -1.061 -4.304 203 1HG GLU 23 HG2 GLU 23 12.357 -0.920 -3.757 204 2HG GLU 23 HG3 GLU 23 12.459 -2.528 -3.035 205 H ARG 24 H ARG 24 14.719 -4.530 -6.705 206 HA ARG 24 HA ARG 24 17.171 -3.597 -7.848 207 1HB ARG 24 HB2 ARG 24 17.126 -5.633 -9.124 208 2HB ARG 24 HB3 ARG 24 16.493 -5.986 -7.514 209 1HG ARG 24 HG2 ARG 24 14.128 -5.699 -8.568 210 2HG ARG 24 HG3 ARG 24 14.960 -5.698 -10.128 211 1HD ARG 24 HD2 ARG 24 15.949 -7.930 -9.506 212 2HD ARG 24 HD3 ARG 24 14.890 -7.956 -8.083 213 HE ARG 24 H3T ARG 24 13.080 -7.478 -10.028 214 1HH1 ARG 24 2HH1 ARG 24 15.461 -10.003 -9.762 215 2HH1 ARG 24 1HH1 ARG 24 14.782 -10.931 -11.081 216 1HH2 ARG 24 2HH2 ARG 24 12.208 -8.721 -11.662 217 2HH2 ARG 24 1HH2 ARG 24 12.940 -10.249 -12.066 218 H ILE 25 H ILE 25 13.892 -3.151 -8.910 219 HA ILE 25 HA ILE 25 14.456 -2.605 -11.698 220 HB ILE 25 H5T ILE 25 11.995 -2.095 -9.982 221 1HG1 ILE 25 2HG1 ILE 25 12.561 -4.353 -11.977 222 2HG1 ILE 25 3HG1 ILE 25 12.724 -4.525 -10.232 223 1HG2 ILE 25 1HG2 ILE 25 12.234 -2.142 -13.022 224 2HG2 ILE 25 2HG2 ILE 25 10.745 -1.890 -12.097 225 3HG2 ILE 25 3HG2 ILE 25 12.009 -0.676 -12.052 226 1HD1 ILE 25 1HD1 ILE 25 10.136 -3.999 -11.707 227 2HD1 ILE 25 2HD1 ILE 25 10.627 -5.458 -10.838 228 3HD1 ILE 25 3HD1 ILE 25 10.327 -3.957 -9.938 229 HA PRO 26 HA PRO 26 15.471 1.784 -11.008 230 1HB PRO 26 HB2 PRO 26 15.889 2.583 -13.551 231 2HB PRO 26 HB3 PRO 26 16.894 1.321 -12.793 232 1HG PRO 26 HG2 PRO 26 14.455 0.875 -14.556 233 2HG PRO 26 HG3 PRO 26 16.117 0.234 -14.797 234 1HD PRO 26 HD2 PRO 26 14.202 -1.201 -13.497 235 2HD PRO 26 HD3 PRO 26 15.910 -1.255 -12.984 236 H TYR 27 H TYR 27 14.380 3.582 -13.320 237 HA TYR 27 HA TYR 27 11.641 3.938 -12.110 238 1HB TYR 27 HB2 TYR 27 13.692 6.008 -12.990 239 2HB TYR 27 HB3 TYR 27 12.074 6.363 -12.422 240 HD1 TYR 27 HD1 TYR 27 11.613 6.620 -10.107 241 HD2 TYR 27 HD2 TYR 27 15.378 4.938 -11.363 242 HE1 TYR 27 HE1 TYR 27 12.445 6.721 -7.758 243 HE2 TYR 27 HE2 TYR 27 16.207 5.038 -9.022 244 HH TYR 27 HH TYR 27 15.728 5.605 -6.853 245 H LEU 28 H LEU 28 10.013 4.857 -13.440 246 HA LEU 28 HA LEU 28 10.241 4.264 -16.313 247 1HB LEU 28 HB2 LEU 28 8.240 3.761 -14.690 248 2HB LEU 28 HB3 LEU 28 7.785 5.418 -14.972 249 HG LEU 28 HG LEU 28 6.529 3.882 -16.341 250 1HD1 LEU 28 1HD1 LEU 28 8.432 5.362 -18.192 251 2HD1 LEU 28 2HD1 LEU 28 6.809 4.765 -18.582 252 3HD1 LEU 28 3HD1 LEU 28 7.004 6.062 -17.391 253 1HD2 LEU 28 1HD2 LEU 28 8.225 2.078 -16.482 254 2HD2 LEU 28 2HD2 LEU 28 7.438 2.444 -18.024 255 3HD2 LEU 28 3HD2 LEU 28 9.089 3.013 -17.721 256 H GLY 29 H GLY 29 12.079 6.082 -15.979 257 1HA GLY 29 HA2 GLY 29 12.771 7.954 -17.162 258 2HA GLY 29 HA3 GLY 29 11.095 8.296 -17.591 259 H PHE 30 H PHE 30 9.905 8.634 -15.131 260 HA PHE 30 HA PHE 30 11.520 10.505 -13.499 261 1HB PHE 30 HB2 PHE 30 8.852 11.153 -14.831 262 2HB PHE 30 HB3 PHE 30 9.475 12.090 -13.493 263 HD1 PHE 30 HD1 PHE 30 12.284 12.567 -14.022 264 HD2 PHE 30 HD2 PHE 30 8.897 12.580 -16.695 265 HE1 PHE 30 HE1 PHE 30 13.432 14.217 -15.470 266 HE2 PHE 30 HE2 PHE 30 10.032 14.272 -18.112 267 HZ PHE 30 HZ PHE 30 12.309 15.074 -17.519 268 H LYS 31 H LYS 31 9.514 7.817 -13.348 269 HA LYS 31 HA LYS 31 8.654 8.521 -10.576 270 1HB LYS 31 HB2 LYS 31 6.418 7.634 -10.948 271 2HB LYS 31 HB3 LYS 31 6.762 9.042 -11.948 272 1HG LYS 31 HG2 LYS 31 7.128 7.567 -13.919 273 2HG LYS 31 HG3 LYS 31 6.839 6.149 -12.903 274 1HD LYS 31 HD2 LYS 31 4.855 6.689 -14.249 275 2HD LYS 31 HD3 LYS 31 4.538 6.793 -12.524 276 1HE LYS 31 HE2 LYS 31 3.405 8.622 -13.545 277 2HE LYS 31 HE3 LYS 31 4.759 9.284 -12.639 278 1HZ LYS 31 HZ1 LYS 31 4.586 8.945 -15.596 279 2HZ LYS 31 HZ2 LYS 31 4.665 10.335 -14.773 280 3HZ LYS 31 HZ3 LYS 31 5.979 9.369 -14.829 281 H GLN 32 H GLN 32 8.287 6.927 -9.167 282 HA GLN 32 HA GLN 32 10.246 4.825 -9.370 283 1HB GLN 32 HB2 GLN 32 10.158 4.754 -7.044 284 2HB GLN 32 HB3 GLN 32 9.936 6.433 -7.478 285 1HG GLN 32 HG2 GLN 32 7.942 4.506 -6.277 286 2HG GLN 32 HG3 GLN 32 8.478 6.054 -5.671 287 1HE2 GLN 32 1HE2 GLN 32 5.828 4.563 -6.946 288 2HE2 GLN 32 2HE2 GLN 32 5.053 5.981 -7.642 289 H ILE 33 H ILE 33 8.248 4.106 -11.167 290 HA ILE 33 HA ILE 33 6.905 2.395 -11.792 291 HB ILE 33 H5T ILE 33 8.295 0.819 -9.639 292 1HG1 ILE 33 2HG1 ILE 33 10.031 1.958 -10.873 293 2HG1 ILE 33 3HG1 ILE 33 10.035 0.249 -11.209 294 1HG2 ILE 33 1HG2 ILE 33 6.531 -0.492 -10.662 295 2HG2 ILE 33 2HG2 ILE 33 7.033 -0.004 -12.293 296 3HG2 ILE 33 3HG2 ILE 33 8.066 -1.063 -11.309 297 1HD1 ILE 33 1HD1 ILE 33 8.915 2.393 -13.058 298 2HD1 ILE 33 2HD1 ILE 33 10.473 1.574 -13.238 299 3HD1 ILE 33 3HD1 ILE 33 8.975 0.652 -13.423 300 H ASN 34 H ASN 34 5.289 3.906 -10.832 301 HA ASN 34 HA ASN 34 3.650 3.014 -8.602 302 1HB ASN 34 HB2 ASN 34 3.916 5.399 -9.555 303 2HB ASN 34 HB3 ASN 34 2.906 4.880 -10.899 304 1HD2 ASN 34 1HD2 ASN 34 0.983 5.997 -10.493 305 2HD2 ASN 34 2HD2 ASN 34 0.132 5.919 -8.969 306 H LEU 35 H LEU 35 3.920 0.757 -9.610 307 HA LEU 35 HA LEU 35 3.038 -0.073 -11.996 308 1HB LEU 35 HB2 LEU 35 4.359 -1.222 -10.116 309 2HB LEU 35 HB3 LEU 35 2.831 -1.841 -9.562 310 HG LEU 35 HG LEU 35 4.076 -3.466 -10.850 311 1HD1 LEU 35 1HD1 LEU 35 1.546 -3.432 -11.150 312 2HD1 LEU 35 2HD1 LEU 35 1.844 -2.721 -12.753 313 3HD1 LEU 35 3HD1 LEU 35 2.512 -4.285 -12.358 314 1HD2 LEU 35 1HD2 LEU 35 4.618 -3.255 -13.191 315 2HD2 LEU 35 2HD2 LEU 35 3.842 -1.676 -13.294 316 3HD2 LEU 35 3HD2 LEU 35 5.320 -1.871 -12.332 317 H TRP 36 H TRP 36 0.678 0.057 -9.237 318 HA TRP 36 HA TRP 36 -1.488 -1.231 -10.541 319 1HB TRP 36 HB2 TRP 36 -2.911 -0.045 -9.056 320 2HB TRP 36 HB3 TRP 36 -1.468 -0.561 -8.200 321 HD1 TRP 36 HD1 TRP 36 0.364 1.455 -7.658 322 HE1 TRP 36 HE1 TRP 36 0.028 3.939 -7.196 323 HE3 TRP 36 HE3 TRP 36 -4.450 1.920 -9.321 324 HZ2 TRP 36 HZ2 TRP 36 -2.122 5.878 -7.380 325 HZ3 TRP 36 HZ3 TRP 36 -5.630 4.117 -9.158 326 HH2 TRP 36 HH2 TRP 36 -4.473 6.090 -8.201 327 H THR 37 H THR 37 -0.259 2.090 -10.993 328 HA THR 37 HA THR 37 -2.368 2.946 -12.841 329 HB THR 37 H5T THR 37 0.334 4.184 -12.252 330 HG1 THR 37 HG1 THR 37 -1.225 4.138 -10.546 331 1HG2 THR 37 1HG2 THR 37 -0.689 6.239 -13.218 332 2HG2 THR 37 2HG2 THR 37 -0.460 4.980 -14.437 333 3HG2 THR 37 3HG2 THR 37 -2.080 5.275 -13.764 334 H MET 38 H MET 38 0.981 1.656 -13.187 335 HA MET 38 HA MET 38 1.004 1.764 -16.078 336 1HB MET 38 HB2 MET 38 3.035 1.591 -14.785 337 2HB MET 38 HB3 MET 38 2.538 0.030 -14.122 338 1HG MET 38 HG2 MET 38 3.069 -1.128 -16.015 339 2HG MET 38 HG3 MET 38 2.595 0.195 -17.090 340 1HE MET 38 HE1 MET 38 5.578 -1.317 -14.939 341 2HE MET 38 HE2 MET 38 6.715 0.044 -14.957 342 3HE MET 38 HE3 MET 38 5.184 0.194 -14.077 343 H PHE 39 H PHE 39 -0.170 -0.718 -13.792 344 HA PHE 39 HA PHE 39 -0.899 -2.656 -15.770 345 1HB PHE 39 HB2 PHE 39 -0.775 -3.143 -13.366 346 2HB PHE 39 HB3 PHE 39 -2.071 -2.015 -13.035 347 HD1 PHE 39 HD1 PHE 39 -1.498 -4.902 -15.424 348 HD2 PHE 39 HD2 PHE 39 -4.160 -2.978 -12.620 349 HE1 PHE 39 HE1 PHE 39 -3.161 -6.706 -15.759 350 HE2 PHE 39 HE2 PHE 39 -5.838 -4.769 -12.996 351 HZ PHE 39 HZ PHE 39 -5.337 -6.626 -14.575 352 H GLN 40 H GLN 40 -3.092 -0.196 -14.142 353 HA GLN 40 HA GLN 40 -5.166 -0.826 -16.012 354 1HB GLN 40 HB2 GLN 40 -6.400 1.009 -15.162 355 2HB GLN 40 HB3 GLN 40 -5.514 0.279 -13.823 356 1HG GLN 40 HG2 GLN 40 -3.732 2.114 -14.288 357 2HG GLN 40 HG3 GLN 40 -4.975 2.917 -15.244 358 1HE2 GLN 40 1HE2 GLN 40 -4.208 1.617 -11.989 359 2HE2 GLN 40 2HE2 GLN 40 -5.226 2.780 -11.138 360 H ALA 41 H ALA 41 -2.499 1.535 -16.363 361 HA ALA 41 HA ALA 41 -3.388 2.736 -18.782 362 1HB ALA 41 HB1 ALA 41 -1.502 3.606 -17.478 363 2HB ALA 41 HB2 ALA 41 -0.577 2.114 -17.758 364 3HB ALA 41 HB3 ALA 41 -0.943 3.186 -19.111 365 H ALA 42 H ALA 42 -1.310 -0.208 -18.314 366 HA ALA 42 HA ALA 42 -1.160 -0.859 -21.088 367 1HB ALA 42 HB1 ALA 42 -0.389 -3.041 -20.275 368 2HB ALA 42 HB2 ALA 42 0.379 -1.724 -19.371 369 3HB ALA 42 HB3 ALA 42 -0.947 -2.648 -18.633 370 H GLN 43 H GLN 43 -3.686 -1.618 -18.629 371 HA GLN 43 HA GLN 43 -5.088 -3.463 -20.328 372 1HB GLN 43 HB2 GLN 43 -5.998 -1.944 -17.879 373 2HB GLN 43 HB3 GLN 43 -6.975 -3.136 -18.725 374 1HG GLN 43 HG2 GLN 43 -4.326 -3.677 -17.333 375 2HG GLN 43 HG3 GLN 43 -5.914 -4.143 -16.767 376 1HE2 GLN 43 1HE2 GLN 43 -3.311 -5.628 -17.713 377 2HE2 GLN 43 2HE2 GLN 43 -3.967 -6.897 -18.716 378 H LYS 44 H LYS 44 -5.334 0.094 -19.980 379 HA LYS 44 HA LYS 44 -7.654 0.360 -21.737 380 1HB LYS 44 HB2 LYS 44 -5.341 2.260 -21.118 381 2HB LYS 44 HB3 LYS 44 -6.747 2.684 -22.090 382 1HG LYS 44 HG2 LYS 44 -8.236 2.414 -20.162 383 2HG LYS 44 HG3 LYS 44 -6.881 1.882 -19.157 384 1HD LYS 44 HD2 LYS 44 -5.727 4.096 -19.710 385 2HD LYS 44 HD3 LYS 44 -7.251 4.612 -20.460 386 1HE LYS 44 HE2 LYS 44 -8.394 4.189 -18.246 387 2HE LYS 44 HE3 LYS 44 -6.814 3.786 -17.557 388 1HZ LYS 44 HZ1 LYS 44 -7.267 6.097 -17.115 389 2HZ LYS 44 HZ2 LYS 44 -6.082 6.074 -18.256 390 3HZ LYS 44 HZ3 LYS 44 -7.616 6.417 -18.677 391 H LEU 45 H LEU 45 -4.125 0.558 -22.177 392 HA LEU 45 HA LEU 45 -4.280 0.473 -25.010 393 1HB LEU 45 HB2 LEU 45 -2.011 -0.102 -23.087 394 2HB LEU 45 HB3 LEU 45 -1.791 0.134 -24.812 395 HG LEU 45 HG LEU 45 -2.978 2.306 -23.016 396 1HD1 LEU 45 1HD1 LEU 45 -0.114 1.901 -23.876 397 2HD1 LEU 45 2HD1 LEU 45 -0.791 3.292 -22.961 398 3HD1 LEU 45 3HD1 LEU 45 -0.765 1.692 -22.230 399 1HD2 LEU 45 1HD2 LEU 45 -3.507 2.641 -25.348 400 2HD2 LEU 45 2HD2 LEU 45 -2.234 3.781 -24.883 401 3HD2 LEU 45 3HD2 LEU 45 -1.830 2.323 -25.828 402 H GLY 46 H GLY 46 -5.583 -1.944 -23.427 403 1HA GLY 46 HA2 GLY 46 -6.289 -3.857 -24.538 404 2HA GLY 46 HA3 GLY 46 -4.934 -3.773 -25.639 405 H GLY 47 H GLY 47 -4.590 -3.818 -22.146 406 1HA GLY 47 HA2 GLY 47 -3.388 -5.147 -20.738 407 2HA GLY 47 HA3 GLY 47 -4.047 -6.533 -21.610 408 H TYR 48 H TYR 48 -1.715 -7.101 -20.677 409 HA TYR 48 HA TYR 48 0.603 -6.512 -22.203 410 1HB TYR 48 HB2 TYR 48 0.601 -7.804 -20.133 411 2HB TYR 48 HB3 TYR 48 -0.337 -9.083 -20.883 412 HD1 TYR 48 HD1 TYR 48 3.005 -7.426 -20.819 413 HD2 TYR 48 HD2 TYR 48 0.687 -10.768 -22.261 414 HE1 TYR 48 HE1 TYR 48 5.108 -8.626 -21.445 415 HE2 TYR 48 HE2 TYR 48 2.776 -11.949 -22.898 416 HH TYR 48 HH TYR 48 5.049 -11.911 -22.891 417 H GLU 49 H GLU 49 -2.274 -8.378 -23.126 418 HA GLU 49 HA GLU 49 -0.934 -9.992 -25.089 419 1HB GLU 49 HB2 GLU 49 -3.875 -9.194 -24.795 420 2HB GLU 49 HB3 GLU 49 -3.292 -10.432 -25.906 421 1HG GLU 49 HG2 GLU 49 -2.980 -10.551 -22.870 422 2HG GLU 49 HG3 GLU 49 -4.271 -11.317 -23.780 423 H THR 50 H THR 50 -2.926 -6.980 -25.532 424 HA THR 50 HA THR 50 -2.231 -6.845 -28.342 425 HB THR 50 H5T THR 50 -3.156 -4.504 -26.668 426 HG1 THR 50 HG1 THR 50 -4.648 -6.127 -26.386 427 1HG2 THR 50 1HG2 THR 50 -3.554 -5.224 -29.613 428 2HG2 THR 50 2HG2 THR 50 -4.165 -3.769 -28.793 429 3HG2 THR 50 3HG2 THR 50 -2.424 -3.999 -29.010 430 H ILE 51 H ILE 51 -0.795 -5.576 -25.320 431 HA ILE 51 HA ILE 51 1.150 -3.905 -26.560 432 HB ILE 51 H5T ILE 51 0.648 -5.074 -23.895 433 1HG1 ILE 51 2HG1 ILE 51 1.752 -2.928 -23.143 434 2HG1 ILE 51 3HG1 ILE 51 1.977 -2.512 -24.832 435 1HG2 ILE 51 1HG2 ILE 51 2.778 -6.191 -24.076 436 2HG2 ILE 51 2HG2 ILE 51 3.546 -4.661 -24.585 437 3HG2 ILE 51 3HG2 ILE 51 2.872 -4.852 -22.952 438 1HD1 ILE 51 1HD1 ILE 51 -0.570 -2.683 -25.082 439 2HD1 ILE 51 2HD1 ILE 51 -0.647 -2.916 -23.322 440 3HD1 ILE 51 3HD1 ILE 51 -0.004 -1.403 -23.986 441 H THR 52 H THR 52 1.330 -7.436 -25.902 442 HA THR 52 HA THR 52 4.020 -7.502 -26.993 443 HB THR 52 H5T THR 52 3.053 -9.003 -25.159 444 HG1 THR 52 HG1 THR 52 4.372 -10.414 -27.208 445 1HG2 THR 52 1HG2 THR 52 1.117 -9.968 -26.287 446 2HG2 THR 52 2HG2 THR 52 2.167 -10.717 -27.511 447 3HG2 THR 52 3HG2 THR 52 2.283 -11.200 -25.806 448 H ALA 53 H ALA 53 0.774 -8.147 -28.293 449 HA ALA 53 HA ALA 53 1.693 -9.204 -30.807 450 1HB ALA 53 HB1 ALA 53 -0.888 -7.755 -30.066 451 2HB ALA 53 HB2 ALA 53 -0.620 -8.742 -31.518 452 3HB ALA 53 HB3 ALA 53 -0.593 -9.503 -29.918 453 H ARG 54 H ARG 54 1.235 -5.804 -29.644 454 HA ARG 54 HA ARG 54 2.117 -4.903 -32.393 455 1HB ARG 54 HB2 ARG 54 -0.078 -3.786 -30.608 456 2HB ARG 54 HB3 ARG 54 0.446 -3.053 -32.117 457 1HG ARG 54 HG2 ARG 54 -0.816 -5.815 -31.864 458 2HG ARG 54 HG3 ARG 54 -1.645 -4.337 -32.329 459 1HD ARG 54 HD2 ARG 54 -0.273 -4.103 -34.330 460 2HD ARG 54 HD3 ARG 54 0.699 -5.501 -33.898 461 HE ARG 54 H3T ARG 54 -2.101 -5.493 -34.877 462 1HH1 ARG 54 2HH2 ARG 54 0.576 -7.523 -33.798 463 2HH1 ARG 54 1HH2 ARG 54 -0.110 -8.936 -34.557 464 1HH2 ARG 54 1HH1 ARG 54 -2.907 -7.353 -35.753 465 2HH2 ARG 54 2HH1 ARG 54 -2.032 -8.847 -35.595 466 H ARG 55 H ARG 55 3.446 -4.913 -29.484 467 HA ARG 55 HA ARG 55 5.129 -3.720 -28.477 468 1HB ARG 55 HB2 ARG 55 5.599 -2.642 -31.283 469 2HB ARG 55 HB3 ARG 55 6.721 -2.519 -29.922 470 1HG ARG 55 HG2 ARG 55 6.830 -4.999 -29.778 471 2HG ARG 55 HG3 ARG 55 5.765 -5.133 -31.183 472 1HD ARG 55 HD2 ARG 55 8.490 -3.766 -31.157 473 2HD ARG 55 HD3 ARG 55 8.198 -5.402 -31.729 474 HE ARG 55 H3T ARG 55 7.577 -2.888 -33.104 475 1HH1 ARG 55 2HH2 ARG 55 6.864 -6.323 -33.114 476 2HH1 ARG 55 1HH2 ARG 55 6.316 -6.292 -34.766 477 1HH2 ARG 55 2HH1 ARG 55 6.862 -2.926 -35.200 478 2HH2 ARG 55 1HH1 ARG 55 6.320 -4.418 -35.910 479 H GLN 56 H GLN 56 3.095 -2.848 -27.501 480 HA GLN 56 HA GLN 56 2.665 -0.020 -28.256 481 1HB GLN 56 HB2 GLN 56 0.772 -1.707 -26.638 482 2HB GLN 56 HB3 GLN 56 0.522 -0.073 -27.247 483 1HG GLN 56 HG2 GLN 56 1.013 -1.148 -29.599 484 2HG GLN 56 HG3 GLN 56 0.649 -2.671 -28.772 485 1HE2 GLN 56 1HE2 GLN 56 -1.533 -1.799 -27.057 486 2HE2 GLN 56 2HE2 GLN 56 -2.825 -1.313 -28.125 487 H TRP 57 H TRP 57 4.696 -1.385 -26.176 488 HA TRP 57 HA TRP 57 4.466 0.076 -23.741 489 1HB TRP 57 HB2 TRP 57 7.119 -0.259 -25.147 490 2HB TRP 57 HB3 TRP 57 6.720 -0.180 -23.460 491 HD1 TRP 57 HD1 TRP 57 6.846 -2.666 -26.328 492 HE1 TRP 57 HE1 TRP 57 6.343 -5.028 -25.457 493 HE3 TRP 57 HE3 TRP 57 5.627 -1.500 -21.504 494 HZ2 TRP 57 HZ2 TRP 57 5.547 -6.265 -22.961 495 HZ3 TRP 57 HZ3 TRP 57 4.910 -3.258 -19.932 496 HH2 TRP 57 HH2 TRP 57 4.873 -5.653 -20.641 497 H LYS 58 H LYS 58 5.553 1.129 -26.998 498 HA LYS 58 HA LYS 58 6.248 3.825 -26.268 499 1HB LYS 58 HB2 LYS 58 5.441 2.474 -28.854 500 2HB LYS 58 HB3 LYS 58 5.609 4.227 -28.803 501 1HG LYS 58 HG2 LYS 58 7.824 2.374 -27.832 502 2HG LYS 58 HG3 LYS 58 7.678 2.895 -29.514 503 1HD LYS 58 HD2 LYS 58 7.847 5.244 -28.881 504 2HD LYS 58 HD3 LYS 58 7.927 4.850 -27.166 505 1HE LYS 58 HE2 LYS 58 9.949 3.823 -29.198 506 2HE LYS 58 HE3 LYS 58 10.118 5.377 -28.370 507 1HZ LYS 58 HZ1 LYS 58 11.309 3.622 -27.209 508 2HZ LYS 58 HZ2 LYS 58 10.133 4.236 -26.250 509 3HZ LYS 58 HZ3 LYS 58 9.952 2.763 -26.946 510 H HIS 59 H HIS 59 3.010 2.433 -26.614 511 HA HIS 59 HA HIS 59 1.890 5.137 -26.153 512 1HB HIS 59 HB2 HIS 59 0.498 2.460 -26.370 513 2HB HIS 59 HB3 HIS 59 -0.244 4.064 -26.390 514 HD1 HIS 59 HD1 HIS 59 1.725 5.425 -28.578 515 HD2 HIS 59 HD2 HIS 59 -0.163 1.669 -28.797 516 HE1 HIS 59 HE1 HIS 59 1.595 4.835 -31.052 517 H ILE 60 H ILE 60 2.930 2.420 -24.165 518 HA ILE 60 HA ILE 60 1.387 3.218 -21.788 519 HB ILE 60 H5T ILE 60 3.890 1.533 -22.165 520 1HG1 ILE 60 2HG1 ILE 60 1.090 0.888 -21.133 521 2HG1 ILE 60 3HG1 ILE 60 1.633 0.594 -22.789 522 1HG2 ILE 60 1HG2 ILE 60 2.518 2.214 -19.534 523 2HG2 ILE 60 2HG2 ILE 60 3.844 1.051 -19.746 524 3HG2 ILE 60 3HG2 ILE 60 4.144 2.748 -20.030 525 1HD1 ILE 60 1HD1 ILE 60 3.289 -1.028 -21.994 526 2HD1 ILE 60 2HD1 ILE 60 2.761 -0.769 -20.310 527 3HD1 ILE 60 3HD1 ILE 60 1.643 -1.450 -21.484 528 H TYR 61 H TYR 61 4.548 3.963 -23.241 529 HA TYR 61 HA TYR 61 5.367 6.059 -21.551 530 1HB TYR 61 HB2 TYR 61 6.873 5.211 -23.147 531 2HB TYR 61 HB3 TYR 61 5.732 5.363 -24.460 532 HD1 TYR 61 HD1 TYR 61 7.922 7.348 -22.175 533 HD2 TYR 61 HD2 TYR 61 5.683 7.272 -25.863 534 HE1 TYR 61 HE1 TYR 61 8.926 9.528 -22.852 535 HE2 TYR 61 HE2 TYR 61 6.711 9.428 -26.541 536 HH TYR 61 HH TYR 61 8.145 11.112 -25.966 537 H ASP 62 H ASP 62 2.540 5.979 -23.599 538 HA ASP 62 HA ASP 62 2.337 8.915 -23.707 539 1HB ASP 62 HB2 ASP 62 1.715 7.610 -25.708 540 2HB ASP 62 HB3 ASP 62 0.349 6.954 -24.803 541 H GLU 63 H GLU 63 0.314 6.194 -22.498 542 HA GLU 63 HA GLU 63 -1.356 7.873 -20.949 543 1HB GLU 63 HB2 GLU 63 -1.850 5.572 -21.758 544 2HB GLU 63 HB3 GLU 63 -0.691 4.933 -20.606 545 1HG GLU 63 HG2 GLU 63 -2.941 4.607 -19.822 546 2HG GLU 63 HG3 GLU 63 -2.086 5.683 -18.726 547 H LEU 64 H LEU 64 1.814 6.578 -20.089 548 HA LEU 64 HA LEU 64 1.547 7.446 -17.263 549 1HB LEU 64 HB2 LEU 64 3.943 6.219 -18.718 550 2HB LEU 64 HB3 LEU 64 3.789 6.485 -16.984 551 HG LEU 64 HG LEU 64 2.232 4.561 -18.697 552 1HD1 LEU 64 1HD1 LEU 64 4.506 3.880 -17.956 553 2HD1 LEU 64 2HD1 LEU 64 4.029 4.142 -16.265 554 3HD1 LEU 64 3HD1 LEU 64 3.249 2.870 -17.227 555 1HD2 LEU 64 1HD2 LEU 64 1.810 5.197 -15.737 556 2HD2 LEU 64 2HD2 LEU 64 0.624 5.427 -17.047 557 3HD2 LEU 64 3HD2 LEU 64 1.106 3.808 -16.590 558 H GLY 65 H GLY 65 2.082 9.248 -19.992 559 1HA GLY 65 HA2 GLY 65 3.376 11.070 -20.523 560 2HA GLY 65 HA3 GLY 65 3.168 11.484 -18.819 561 H GLY 66 H GLY 66 5.090 8.679 -19.999 562 1HA GLY 66 HA2 GLY 66 7.300 9.092 -18.431 563 2HA GLY 66 HA3 GLY 66 7.360 8.270 -19.980 564 H ASN 67 H ASN 67 9.469 9.566 -18.854 565 HA ASN 67 HA ASN 67 10.049 12.204 -19.317 566 1HB ASN 67 HB2 ASN 67 11.290 10.721 -17.962 567 2HB ASN 67 HB3 ASN 67 11.765 9.723 -19.337 568 1HD2 ASN 67 1HD2 ASN 67 13.326 11.249 -17.212 569 2HD2 ASN 67 2HD2 ASN 67 14.468 12.182 -18.176 570 HA PRO 68 HA PRO 68 9.758 12.653 -23.741 571 1HB PRO 68 HB2 PRO 68 11.570 15.010 -23.187 572 2HB PRO 68 HB3 PRO 68 10.150 14.920 -24.278 573 1HG PRO 68 HG2 PRO 68 9.886 15.986 -21.808 574 2HG PRO 68 HG3 PRO 68 8.641 14.852 -22.426 575 1HD PRO 68 HD2 PRO 68 10.885 14.306 -20.484 576 2HD PRO 68 HD3 PRO 68 9.187 13.734 -20.470 577 H GLY 69 H GLY 69 13.076 12.824 -22.349 578 1HA GLY 69 HA2 GLY 69 14.286 12.124 -24.961 579 2HA GLY 69 HA3 GLY 69 15.109 12.434 -23.432 580 H SER 70 H SER 70 13.735 10.598 -21.738 581 HA SER 70 HA SER 70 14.935 8.053 -22.630 582 1HB SER 70 HB2 SER 70 13.522 8.710 -20.032 583 2HB SER 70 HB3 SER 70 14.465 7.256 -20.397 584 HG SER 70 HG SER 70 15.716 8.802 -19.263 585 H THR 71 H THR 71 12.931 8.651 -24.376 586 HA THR 71 HA THR 71 10.393 7.475 -23.854 587 HB THR 71 H5T THR 71 10.787 8.885 -25.795 588 HG1 THR 71 HG1 THR 71 9.110 7.473 -26.036 589 1HG2 THR 71 1HG2 THR 71 11.940 8.072 -27.799 590 2HG2 THR 71 2HG2 THR 71 13.071 8.188 -26.447 591 3HG2 THR 71 3HG2 THR 71 12.449 6.599 -26.950 592 H SER 72 H SER 72 13.462 5.941 -24.278 593 HA SER 72 HA SER 72 12.674 3.262 -24.923 594 1HB SER 72 HB2 SER 72 14.889 2.725 -23.855 595 2HB SER 72 HB3 SER 72 14.961 3.951 -25.133 596 HG SER 72 HG SER 72 16.149 4.562 -23.245 597 H ALA 73 H ALA 73 12.376 5.094 -21.891 598 HA ALA 73 HA ALA 73 12.625 3.104 -20.078 599 1HB ALA 73 HB1 ALA 73 12.281 5.459 -19.508 600 2HB ALA 73 HB2 ALA 73 10.573 5.360 -19.991 601 3HB ALA 73 HB3 ALA 73 11.163 4.438 -18.589 602 H ALA 74 H ALA 74 9.270 3.790 -21.397 603 HA ALA 74 HA ALA 74 7.998 1.462 -20.395 604 1HB ALA 74 HB1 ALA 74 7.540 2.845 -23.033 605 2HB ALA 74 HB2 ALA 74 6.410 1.822 -22.108 606 3HB ALA 74 HB3 ALA 74 6.910 3.385 -21.453 607 H THR 75 H THR 75 10.174 1.722 -23.235 608 HA THR 75 HA THR 75 9.478 -0.910 -24.266 609 HB THR 75 H5T THR 75 11.840 0.945 -24.814 610 HG1 THR 75 HG1 THR 75 9.427 0.501 -26.235 611 1HG2 THR 75 1HG2 THR 75 12.390 -1.293 -25.657 612 2HG2 THR 75 2HG2 THR 75 10.786 -1.439 -26.412 613 3HG2 THR 75 3HG2 THR 75 11.960 -0.243 -27.013 614 H CYS 76 H CYS 76 12.196 0.294 -22.219 615 HA CYS 76 HA CYS 76 13.340 -2.402 -21.887 616 1HB CYS 76 HB2 CYS 76 13.714 0.190 -20.293 617 2HB CYS 76 HB3 CYS 76 14.712 -1.269 -20.157 618 HG CYS 76 HG CYS 76 14.215 0.696 -22.784 619 H THR 77 H THR 77 10.983 -0.370 -20.161 620 HA THR 77 HA THR 77 10.601 -2.039 -17.936 621 HB THR 77 H5T THR 77 8.657 -0.214 -19.334 622 HG1 THR 77 HG1 THR 77 10.366 0.785 -18.399 623 1HG2 THR 77 1HG2 THR 77 7.472 -0.171 -17.175 624 2HG2 THR 77 2HG2 THR 77 7.255 -1.699 -18.032 625 3HG2 THR 77 3HG2 THR 77 8.373 -1.605 -16.643 626 H ARG 78 H ARG 78 9.655 -2.813 -21.263 627 HA ARG 78 HA ARG 78 7.860 -4.879 -20.772 628 1HB ARG 78 HB2 ARG 78 8.637 -4.333 -23.063 629 2HB ARG 78 HB3 ARG 78 10.273 -4.885 -22.672 630 1HG ARG 78 HG2 ARG 78 9.547 -7.165 -22.361 631 2HG ARG 78 HG3 ARG 78 7.852 -6.702 -22.452 632 1HD ARG 78 HD2 ARG 78 8.206 -6.122 -24.864 633 2HD ARG 78 HD3 ARG 78 9.874 -6.716 -24.723 634 HE ARG 78 H3T ARG 78 8.696 -8.858 -23.763 635 1HH1 ARG 78 2HH2 ARG 78 7.312 -7.250 -26.589 636 2HH1 ARG 78 1HH2 ARG 78 6.071 -8.494 -26.661 637 1HH2 ARG 78 2HH1 ARG 78 7.201 -10.218 -23.965 638 2HH2 ARG 78 1HH1 ARG 78 5.988 -10.093 -25.251 639 H ARG 79 H ARG 79 11.383 -4.821 -20.060 640 HA ARG 79 HA ARG 79 11.390 -7.636 -19.599 641 1HB ARG 79 HB2 ARG 79 13.384 -5.492 -18.695 642 2HB ARG 79 HB3 ARG 79 13.720 -7.222 -18.724 643 1HG ARG 79 HG2 ARG 79 13.663 -7.285 -21.147 644 2HG ARG 79 HG3 ARG 79 13.056 -5.621 -21.243 645 1HD ARG 79 HD2 ARG 79 15.112 -4.800 -20.144 646 2HD ARG 79 HD3 ARG 79 15.779 -6.444 -20.175 647 HE ARG 79 H3T ARG 79 15.294 -6.214 -22.758 648 1HH1 ARG 79 2HH1 ARG 79 16.649 -3.683 -20.744 649 2HH1 ARG 79 1HH1 ARG 79 17.405 -2.891 -22.098 650 1HH2 ARG 79 2HH2 ARG 79 16.320 -5.173 -24.426 651 2HH2 ARG 79 1HH2 ARG 79 17.247 -3.736 -24.116 652 H HIS 80 H HIS 80 11.009 -4.806 -17.564 653 HA HIS 80 HA HIS 80 10.993 -6.179 -15.012 654 1HB HIS 80 HB2 HIS 80 9.584 -3.569 -15.660 655 2HB HIS 80 HB3 HIS 80 10.210 -4.115 -14.110 656 HD1 HIS 80 HD1 HIS 80 11.015 -1.360 -15.849 657 HD2 HIS 80 HD2 HIS 80 13.236 -4.882 -15.205 658 HE1 HIS 80 HE1 HIS 80 13.451 -0.756 -16.252 659 H TYR 81 H TYR 81 8.405 -5.063 -17.255 660 HA TYR 81 HA TYR 81 6.149 -5.838 -15.768 661 1HB TYR 81 HB2 TYR 81 6.402 -4.355 -17.843 662 2HB TYR 81 HB3 TYR 81 6.344 -5.834 -18.784 663 HD1 TYR 81 HD1 TYR 81 4.203 -7.357 -18.424 664 HD2 TYR 81 HD2 TYR 81 4.465 -3.222 -17.205 665 HE1 TYR 81 HE1 TYR 81 1.728 -7.226 -18.308 666 HE2 TYR 81 HE2 TYR 81 1.975 -3.087 -17.151 667 HH TYR 81 HH TYR 81 -0.075 -5.971 -17.715 668 H GLU 82 H GLU 82 8.204 -7.788 -17.924 669 HA GLU 82 HA GLU 82 6.527 -10.118 -18.051 670 1HB GLU 82 HB2 GLU 82 9.414 -9.494 -18.683 671 2HB GLU 82 HB3 GLU 82 8.818 -11.161 -18.708 672 1HG GLU 82 HG2 GLU 82 7.084 -10.608 -20.316 673 2HG GLU 82 HG3 GLU 82 7.548 -8.912 -20.318 674 H ARG 83 H ARG 83 8.292 -8.788 -15.389 675 HA ARG 83 HA ARG 83 7.746 -11.331 -14.065 676 1HB ARG 83 HB2 ARG 83 10.225 -10.959 -14.823 677 2HB ARG 83 HB3 ARG 83 10.327 -9.835 -13.483 678 1HG ARG 83 HG2 ARG 83 11.210 -12.152 -13.065 679 2HG ARG 83 HG3 ARG 83 10.033 -11.611 -11.879 680 1HD ARG 83 HD2 ARG 83 9.847 -14.027 -12.648 681 2HD ARG 83 HD3 ARG 83 8.367 -13.081 -12.669 682 HE ARG 83 H3T ARG 83 8.687 -12.758 -15.130 683 1HH1 ARG 83 2HH2 ARG 83 10.211 -15.616 -13.766 684 2HH1 ARG 83 1HH2 ARG 83 10.132 -16.454 -15.291 685 1HH2 ARG 83 2HH1 ARG 83 8.600 -13.829 -16.936 686 2HH2 ARG 83 1HH1 ARG 83 9.240 -15.451 -17.073 687 H LEU 84 H LEU 84 7.331 -7.914 -13.624 688 HA LEU 84 HA LEU 84 6.515 -8.606 -10.849 689 1HB LEU 84 HB2 LEU 84 6.859 -6.604 -10.046 690 2HB LEU 84 HB3 LEU 84 8.157 -6.676 -11.213 691 HG LEU 84 HG LEU 84 5.495 -5.243 -11.749 692 1HD1 LEU 84 1HD1 LEU 84 8.030 -4.223 -10.448 693 2HD1 LEU 84 2HD1 LEU 84 6.842 -3.160 -11.220 694 3HD1 LEU 84 3HD1 LEU 84 6.360 -4.153 -9.847 695 1HD2 LEU 84 1HD2 LEU 84 6.853 -3.994 -13.402 696 2HD2 LEU 84 2HD2 LEU 84 8.241 -5.035 -13.015 697 3HD2 LEU 84 3HD2 LEU 84 6.762 -5.726 -13.733 698 H ILE 85 H ILE 85 4.982 -8.676 -13.717 699 HA ILE 85 HA ILE 85 2.526 -8.832 -12.267 700 HB ILE 85 H5T ILE 85 2.616 -6.373 -12.597 701 1HG1 ILE 85 2HG1 ILE 85 0.286 -7.576 -14.129 702 2HG1 ILE 85 3HG1 ILE 85 0.498 -7.826 -12.392 703 1HG2 ILE 85 1HG2 ILE 85 2.252 -5.351 -14.760 704 2HG2 ILE 85 2HG2 ILE 85 3.722 -6.324 -14.818 705 3HG2 ILE 85 3HG2 ILE 85 2.219 -6.942 -15.538 706 1HD1 ILE 85 1HD1 ILE 85 -1.052 -6.005 -12.847 707 2HD1 ILE 85 2HD1 ILE 85 0.376 -5.411 -11.996 708 3HD1 ILE 85 3HD1 ILE 85 0.211 -5.129 -13.745 709 H LEU 86 H LEU 86 4.076 -9.128 -15.496 710 HA LEU 86 HA LEU 86 2.055 -10.508 -16.808 711 1HB LEU 86 HB2 LEU 86 4.204 -9.965 -17.739 712 2HB LEU 86 HB3 LEU 86 5.024 -11.095 -16.674 713 HG LEU 86 HG LEU 86 4.786 -11.729 -19.087 714 1HD1 LEU 86 1HD1 LEU 86 4.479 -14.058 -18.739 715 2HD1 LEU 86 2HD1 LEU 86 5.289 -13.402 -17.308 716 3HD1 LEU 86 3HD1 LEU 86 3.557 -13.814 -17.254 717 1HD2 LEU 86 1HD2 LEU 86 2.436 -10.988 -19.393 718 2HD2 LEU 86 2HD2 LEU 86 2.734 -12.647 -19.942 719 3HD2 LEU 86 3HD2 LEU 86 1.890 -12.363 -18.410 720 HA PRO 87 HA PRO 87 2.724 -14.533 -14.331 721 1HB PRO 87 HB2 PRO 87 3.896 -14.480 -11.833 722 2HB PRO 87 HB3 PRO 87 4.776 -14.787 -13.360 723 1HG PRO 87 HG2 PRO 87 4.467 -12.152 -11.892 724 2HG PRO 87 HG3 PRO 87 5.977 -12.907 -12.502 725 1HD PRO 87 HD2 PRO 87 4.736 -11.017 -13.918 726 2HD PRO 87 HD3 PRO 87 5.392 -12.447 -14.758 727 H TYR 88 H TYR 88 1.622 -11.479 -12.971 728 HA TYR 88 HA TYR 88 -0.329 -12.984 -11.277 729 1HB TYR 88 HB2 TYR 88 0.995 -10.348 -10.944 730 2HB TYR 88 HB3 TYR 88 -0.697 -10.458 -10.495 731 HD1 TYR 88 HD1 TYR 88 2.223 -12.867 -10.118 732 HD2 TYR 88 HD2 TYR 88 -0.972 -10.697 -8.214 733 HE1 TYR 88 HE1 TYR 88 2.803 -13.925 -7.952 734 HE2 TYR 88 HE2 TYR 88 -0.403 -11.772 -6.044 735 HH TYR 88 HH TYR 88 2.286 -14.116 -5.724 736 H GLU 89 H GLU 89 -0.342 -10.349 -13.827 737 HA GLU 89 HA GLU 89 -3.174 -10.569 -14.100 738 1HB GLU 89 HB2 GLU 89 -3.137 -9.341 -15.999 739 2HB GLU 89 HB3 GLU 89 -1.825 -8.695 -15.032 740 1HG GLU 89 HG2 GLU 89 -0.170 -9.698 -16.498 741 2HG GLU 89 HG3 GLU 89 -1.403 -10.638 -17.347 742 H ARG 90 H ARG 90 -0.906 -12.932 -14.595 743 HA ARG 90 HA ARG 90 -2.017 -14.622 -16.595 744 1HB ARG 90 HB2 ARG 90 0.063 -15.027 -15.224 745 2HB ARG 90 HB3 ARG 90 -0.968 -15.360 -13.824 746 1HG ARG 90 HG2 ARG 90 -2.028 -17.248 -15.164 747 2HG ARG 90 HG3 ARG 90 -0.822 -16.955 -16.422 748 1HD ARG 90 HD2 ARG 90 -0.274 -17.712 -13.513 749 2HD ARG 90 HD3 ARG 90 -0.236 -18.832 -14.866 750 HE ARG 90 H3T ARG 90 1.818 -16.923 -14.072 751 1HH1 ARG 90 2HH2 ARG 90 0.711 -18.811 -16.813 752 2HH1 ARG 90 1HH2 ARG 90 2.281 -18.804 -17.567 753 1HH2 ARG 90 2HH1 ARG 90 3.806 -16.988 -15.084 754 2HH2 ARG 90 1HH1 ARG 90 3.970 -17.786 -16.618 755 H PHE 91 H PHE 91 -3.200 -13.944 -13.228 756 HA PHE 91 HA PHE 91 -5.387 -15.840 -13.515 757 1HB PHE 91 HB2 PHE 91 -6.381 -14.817 -11.529 758 2HB PHE 91 HB3 PHE 91 -4.763 -15.438 -11.337 759 HD1 PHE 91 HD1 PHE 91 -6.331 -12.049 -12.172 760 HD2 PHE 91 HD2 PHE 91 -3.483 -14.283 -9.816 761 HE1 PHE 91 HE1 PHE 91 -5.629 -9.972 -11.039 762 HE2 PHE 91 HE2 PHE 91 -2.830 -12.207 -8.653 763 HZ PHE 91 HZ PHE 91 -3.873 -10.039 -9.287 764 H ILE 92 H ILE 92 -5.076 -12.521 -14.711 765 HA ILE 92 HA ILE 92 -7.964 -12.124 -15.023 766 HB ILE 92 H5T ILE 92 -5.632 -10.853 -16.512 767 1HG1 ILE 92 2HG1 ILE 92 -5.445 -10.384 -14.110 768 2HG1 ILE 92 3HG1 ILE 92 -5.821 -8.949 -15.035 769 1HG2 ILE 92 1HG2 ILE 92 -7.653 -10.529 -17.795 770 2HG2 ILE 92 2HG2 ILE 92 -8.536 -9.976 -16.360 771 3HG2 ILE 92 3HG2 ILE 92 -7.204 -9.011 -17.022 772 1HD1 ILE 92 1HD1 ILE 92 -8.175 -9.035 -14.275 773 2HD1 ILE 92 2HD1 ILE 92 -7.840 -10.537 -13.382 774 3HD1 ILE 92 3HD1 ILE 92 -7.054 -9.021 -12.908 775 H LYS 93 H LYS 93 -5.412 -13.782 -16.833 776 HA LYS 93 HA LYS 93 -6.935 -13.961 -19.291 777 1HB LYS 93 HB2 LYS 93 -4.361 -13.974 -18.940 778 2HB LYS 93 HB3 LYS 93 -4.548 -15.658 -18.468 779 1HG LYS 93 HG2 LYS 93 -3.875 -15.610 -20.756 780 2HG LYS 93 HG3 LYS 93 -5.552 -16.118 -20.742 781 1HD LYS 93 HD2 LYS 93 -6.134 -13.614 -21.243 782 2HD LYS 93 HD3 LYS 93 -4.401 -13.398 -21.485 783 1HE LYS 93 HE2 LYS 93 -5.302 -13.751 -23.640 784 2HE LYS 93 HE3 LYS 93 -4.510 -15.272 -23.215 785 1HZ LYS 93 HZ1 LYS 93 -6.730 -16.137 -22.601 786 2HZ LYS 93 HZ2 LYS 93 -7.431 -14.706 -22.985 787 3HZ LYS 93 HZ3 LYS 93 -6.741 -15.621 -24.154 788 H GLY 94 H GLY 94 -7.261 -15.655 -16.357 789 1HA GLY 94 HA2 GLY 94 -8.723 -17.889 -17.753 790 2HA GLY 94 HA3 GLY 94 -7.701 -18.144 -16.343 791 H GLU 95 H GLU 95 -8.767 -15.504 -15.137 792 HA GLU 95 HA GLU 95 -11.419 -16.554 -14.232 793 1HB GLU 95 HB2 GLU 95 -9.251 -15.162 -12.613 794 2HB GLU 95 HB3 GLU 95 -10.819 -15.616 -11.984 795 1HG GLU 95 HG2 GLU 95 -8.924 -17.712 -13.105 796 2HG GLU 95 HG3 GLU 95 -8.812 -17.119 -11.458 797 H GLU 96 H GLU 96 -10.756 -14.530 -16.268 798 HA GLU 96 HA GLU 96 -12.960 -12.758 -15.659 799 1HB GLU 96 HB2 GLU 96 -11.075 -11.522 -14.582 800 2HB GLU 96 HB3 GLU 96 -10.200 -11.549 -16.102 801 1HG GLU 96 HG2 GLU 96 -11.195 -9.369 -15.727 802 2HG GLU 96 HG3 GLU 96 -11.874 -10.119 -17.164 803 H ASP 97 H ASP 97 -10.205 -13.362 -17.928 804 HA ASP 97 HA ASP 97 -11.777 -12.544 -20.244 805 1HB ASP 97 HB2 ASP 97 -9.288 -12.296 -19.934 806 2HB ASP 97 HB3 ASP 97 -9.142 -14.048 -20.075 807 H LYS 98 H LYS 98 -12.943 -14.818 -18.610 808 HA LYS 98 HA LYS 98 -12.551 -17.317 -19.827 809 1HB LYS 98 HB2 LYS 98 -15.041 -16.155 -18.495 810 2HB LYS 98 HB3 LYS 98 -14.857 -17.853 -18.941 811 1HG LYS 98 HG2 LYS 98 -12.809 -17.979 -17.495 812 2HG LYS 98 HG3 LYS 98 -13.161 -16.334 -16.920 813 1HD LYS 98 HD2 LYS 98 -15.425 -17.124 -16.176 814 2HD LYS 98 HD3 LYS 98 -14.999 -18.769 -16.662 815 1HE LYS 98 HE2 LYS 98 -13.574 -17.098 -14.545 816 2HE LYS 98 HE3 LYS 98 -14.753 -18.368 -14.217 817 1HZ LYS 98 HZ1 LYS 98 -12.133 -18.800 -15.557 818 2HZ LYS 98 HZ2 LYS 98 -12.446 -19.148 -14.015 819 3HZ LYS 98 HZ3 LYS 98 -13.227 -19.983 -15.201 820 HA PRO 99 HA PRO 99 -14.743 -17.051 -23.730 821 1HB PRO 99 HB2 PRO 99 -15.119 -19.680 -24.330 822 2HB PRO 99 HB3 PRO 99 -13.493 -18.933 -24.286 823 1HG PRO 99 HG2 PRO 99 -14.871 -20.515 -22.086 824 2HG PRO 99 HG3 PRO 99 -13.221 -20.754 -22.750 825 1HD PRO 99 HD2 PRO 99 -13.672 -19.307 -20.484 826 2HD PRO 99 HD3 PRO 99 -12.397 -18.843 -21.651 827 H LEU 100 H LEU 100 -16.247 -18.204 -20.827 828 HA LEU 100 HA LEU 100 -18.727 -19.122 -21.763 829 1HB LEU 100 HB2 LEU 100 -18.057 -17.574 -19.235 830 2HB LEU 100 HB3 LEU 100 -19.570 -18.428 -19.502 831 HG LEU 100 HG LEU 100 -16.819 -19.734 -19.334 832 1HD1 LEU 100 1HD1 LEU 100 -17.629 -18.848 -17.180 833 2HD1 LEU 100 2HD1 LEU 100 -19.168 -19.713 -17.391 834 3HD1 LEU 100 3HD1 LEU 100 -17.649 -20.617 -17.193 835 1HD2 LEU 100 1HD2 LEU 100 -18.289 -21.071 -20.776 836 2HD2 LEU 100 2HD2 LEU 100 -18.109 -21.861 -19.210 837 3HD2 LEU 100 3HD2 LEU 100 -19.601 -20.967 -19.576 838 HA PRO 101 HA PRO 101 -20.976 -15.465 -23.194 839 1HB PRO 101 HB2 PRO 101 -23.309 -16.864 -21.883 840 2HB PRO 101 HB3 PRO 101 -23.213 -16.127 -23.511 841 1HG PRO 101 HG2 PRO 101 -23.061 -18.814 -23.217 842 2HG PRO 101 HG3 PRO 101 -21.967 -17.969 -24.359 843 1HD PRO 101 HD2 PRO 101 -21.360 -18.939 -21.556 844 2HD PRO 101 HD3 PRO 101 -20.384 -19.071 -23.051 845 HA PRO 102 HA PRO 102 -21.754 -12.721 -19.658 846 1HB PRO 102 HB2 PRO 102 -24.426 -12.164 -20.953 847 2HB PRO 102 HB3 PRO 102 -23.234 -11.004 -20.287 848 1HG PRO 102 HG2 PRO 102 -23.408 -11.387 -22.961 849 2HG PRO 102 HG3 PRO 102 -21.796 -11.288 -22.177 850 1HD PRO 102 HD2 PRO 102 -23.327 -13.759 -23.020 851 2HD PRO 102 HD3 PRO 102 -21.596 -13.365 -23.251 852 H ILE 103 H ILE 103 -23.233 -12.359 -17.817 853 HA ILE 103 HA ILE 103 -24.150 -13.349 -15.991 854 HB ILE 103 H5T ILE 103 -26.538 -13.658 -16.123 855 1HG1 ILE 103 2HG1 ILE 103 -26.357 -13.300 -19.145 856 2HG1 ILE 103 3HG1 ILE 103 -26.640 -14.853 -18.354 857 1HG2 ILE 103 1HG2 ILE 103 -27.048 -11.391 -16.774 858 2HG2 ILE 103 2HG2 ILE 103 -25.441 -11.415 -16.053 859 3HG2 ILE 103 3HG2 ILE 103 -25.617 -11.304 -17.819 860 1HD1 ILE 103 1HD1 ILE 103 -28.469 -12.426 -18.242 861 2HD1 ILE 103 2HD1 ILE 103 -28.751 -13.958 -19.081 862 3HD1 ILE 103 3HD1 ILE 103 -28.710 -13.922 -17.307 863 H LYS 104 H LYS 104 -22.394 -15.228 -16.975 864 HA LYS 104 HA LYS 104 -23.662 -17.654 -15.797 865 1HB LYS 104 HB2 LYS 104 -22.094 -17.643 -18.404 866 2HB LYS 104 HB3 LYS 104 -22.356 -19.086 -17.417 867 1HG LYS 104 HG2 LYS 104 -24.823 -18.733 -17.575 868 2HG LYS 104 HG3 LYS 104 -24.539 -17.366 -18.665 869 1HD LYS 104 HD2 LYS 104 -23.412 -18.877 -20.275 870 2HD LYS 104 HD3 LYS 104 -23.694 -20.250 -19.177 871 1HE LYS 104 HE2 LYS 104 -26.157 -19.786 -19.299 872 2HE LYS 104 HE3 LYS 104 -25.841 -18.497 -20.465 873 1HZ LYS 104 HZ1 LYS 104 -24.909 -20.187 -21.968 874 2HZ LYS 104 HZ2 LYS 104 -25.197 -21.373 -20.878 875 3HZ LYS 104 HZ3 LYS 104 -26.441 -20.577 -21.569 876 HA PRO 105 HA PRO 105 -18.925 -17.600 -14.675 877 1HB PRO 105 HB2 PRO 105 -18.619 -14.593 -14.828 878 2HB PRO 105 HB3 PRO 105 -17.362 -15.862 -14.969 879 1HG PRO 105 HG2 PRO 105 -18.336 -14.677 -17.193 880 2HG PRO 105 HG3 PRO 105 -18.112 -16.456 -17.159 881 1HD PRO 105 HD2 PRO 105 -20.650 -14.868 -16.765 882 2HD PRO 105 HD3 PRO 105 -20.381 -16.352 -17.733 883 H ARG 106 H ARG 106 -21.451 -15.372 -13.851 884 HA ARG 106 HA ARG 106 -22.279 -14.438 -11.976 885 1HB ARG 106 HB2 ARG 106 -23.219 -16.024 -10.537 886 2HB ARG 106 HB3 ARG 106 -23.067 -16.758 -12.118 887 1HG ARG 106 HG2 ARG 106 -20.806 -17.779 -11.073 888 2HG ARG 106 HG3 ARG 106 -21.597 -17.386 -9.549 889 1HD ARG 106 HD2 ARG 106 -22.117 -19.652 -10.065 890 2HD ARG 106 HD3 ARG 106 -23.600 -18.722 -10.361 891 HE ARG 106 H3T ARG 106 -22.135 -18.828 -12.799 892 1HH1 ARG 106 2HH2 ARG 106 -23.848 -21.154 -10.808 893 2HH1 ARG 106 1HH2 ARG 106 -24.147 -22.205 -12.168 894 1HH2 ARG 106 2HH1 ARG 106 -22.517 -20.139 -14.412 895 2HH2 ARG 106 1HH1 ARG 106 -23.401 -21.639 -14.201 896 H LYS 107 H LYS 107 -19.443 -13.867 -12.052 897 HA LYS 107 HA LYS 107 -18.349 -13.855 -9.421 898 1HB LYS 107 HB2 LYS 107 -17.944 -11.922 -11.742 899 2HB LYS 107 HB3 LYS 107 -16.984 -11.950 -10.259 900 1HG LYS 107 HG2 LYS 107 -16.300 -14.310 -10.758 901 2HG LYS 107 HG3 LYS 107 -17.218 -14.240 -12.266 902 1HD LYS 107 HD2 LYS 107 -14.894 -13.887 -12.761 903 2HD LYS 107 HD3 LYS 107 -15.770 -12.380 -13.065 904 1HE LYS 107 HE2 LYS 107 -14.996 -11.470 -10.902 905 2HE LYS 107 HE3 LYS 107 -14.203 -13.006 -10.520 906 1HZ LYS 107 HZ1 LYS 107 -12.626 -11.388 -11.417 907 2HZ LYS 107 HZ2 LYS 107 -12.758 -12.657 -12.451 908 3HZ LYS 107 HZ3 LYS 107 -13.483 -11.242 -12.809 Start of MODEL 6 1 1H ARG 1 H1 ARG 1 -6.944 -0.098 -7.713 2 2H ARG 1 H2 ARG 1 -6.923 1.289 -8.575 3 3H ARG 1 H3 ARG 1 -7.488 1.311 -7.043 4 HA ARG 1 HA ARG 1 -4.735 0.719 -7.899 5 1HB ARG 1 HB2 ARG 1 -5.266 3.091 -8.124 6 2HB ARG 1 HB3 ARG 1 -5.744 3.194 -6.433 7 1HG ARG 1 HG2 ARG 1 -2.971 2.148 -7.036 8 2HG ARG 1 HG3 ARG 1 -3.282 3.847 -7.372 9 1HD ARG 1 HD2 ARG 1 -3.935 4.278 -5.062 10 2HD ARG 1 HD3 ARG 1 -3.844 2.566 -4.667 11 HE ARG 1 H3T ARG 1 -1.579 2.725 -4.380 12 1HH1 ARG 1 2HH2 ARG 1 -2.469 5.636 -6.140 13 2HH1 ARG 1 1HH2 ARG 1 -0.879 6.316 -5.928 14 1HH2 ARG 1 2HH1 ARG 1 0.294 3.616 -4.130 15 2HH2 ARG 1 1HH1 ARG 1 0.685 5.186 -4.816 16 H ALA 2 H ALA 2 -6.784 0.966 -4.932 17 HA ALA 2 HA ALA 2 -4.509 0.461 -3.222 18 1HB ALA 2 HB1 ALA 2 -7.501 0.252 -2.677 19 2HB ALA 2 HB2 ALA 2 -6.214 0.292 -1.456 20 3HB ALA 2 HB3 ALA 2 -6.499 1.710 -2.481 21 H ASP 3 H ASP 3 -7.133 -1.652 -4.442 22 HA ASP 3 HA ASP 3 -6.285 -4.007 -3.081 23 1HB ASP 3 HB2 ASP 3 -8.517 -3.617 -4.133 24 2HB ASP 3 HB3 ASP 3 -7.771 -3.771 -5.725 25 H GLU 4 H GLU 4 -5.395 -2.752 -6.331 26 HA GLU 4 HA GLU 4 -3.698 -4.926 -7.168 27 1HB GLU 4 HB2 GLU 4 -3.616 -1.977 -7.850 28 2HB GLU 4 HB3 GLU 4 -2.740 -3.269 -8.662 29 1HG GLU 4 HG2 GLU 4 -4.579 -2.753 -10.033 30 2HG GLU 4 HG3 GLU 4 -4.907 -4.320 -9.309 31 H GLN 5 H GLN 5 -3.106 -1.917 -5.342 32 HA GLN 5 HA GLN 5 -0.312 -2.312 -5.256 33 1HB GLN 5 HB2 GLN 5 -1.564 -0.112 -4.862 34 2HB GLN 5 HB3 GLN 5 -1.890 -0.710 -3.222 35 1HG GLN 5 HG2 GLN 5 0.725 -1.107 -3.142 36 2HG GLN 5 HG3 GLN 5 0.767 -0.054 -4.550 37 1HE2 GLN 5 1HE2 GLN 5 0.619 -0.205 -1.147 38 2HE2 GLN 5 2HE2 GLN 5 0.362 1.516 -0.855 39 H ALA 6 H ALA 6 -2.965 -3.217 -3.031 40 HA ALA 6 HA ALA 6 -1.331 -4.329 -0.949 41 1HB ALA 6 HB1 ALA 6 -3.717 -3.786 -0.666 42 2HB ALA 6 HB2 ALA 6 -4.162 -5.062 -1.821 43 3HB ALA 6 HB3 ALA 6 -3.399 -5.487 -0.276 44 H PHE 7 H PHE 7 -2.825 -5.915 -3.863 45 HA PHE 7 HA PHE 7 -1.436 -8.390 -3.245 46 1HB PHE 7 HB2 PHE 7 -2.504 -9.368 -5.028 47 2HB PHE 7 HB3 PHE 7 -3.649 -8.292 -4.246 48 HD1 PHE 7 HD1 PHE 7 -1.157 -7.810 -7.101 49 HD2 PHE 7 HD2 PHE 7 -5.263 -7.696 -5.767 50 HE1 PHE 7 HE1 PHE 7 -1.834 -6.974 -9.269 51 HE2 PHE 7 HE2 PHE 7 -5.961 -6.970 -8.029 52 HZ PHE 7 HZ PHE 7 -4.247 -6.600 -9.804 53 H LEU 8 H LEU 8 -0.110 -5.546 -4.371 54 HA LEU 8 HA LEU 8 1.895 -7.029 -6.053 55 1HB LEU 8 HB2 LEU 8 1.011 -4.141 -5.987 56 2HB LEU 8 HB3 LEU 8 2.658 -4.528 -6.450 57 HG LEU 8 HG LEU 8 0.378 -6.056 -7.756 58 1HD1 LEU 8 1HD1 LEU 8 1.385 -3.321 -8.565 59 2HD1 LEU 8 2HD1 LEU 8 0.402 -4.388 -9.598 60 3HD1 LEU 8 3HD1 LEU 8 -0.262 -3.749 -8.093 61 1HD2 LEU 8 1HD2 LEU 8 3.179 -5.214 -8.608 62 2HD2 LEU 8 2HD2 LEU 8 2.685 -6.842 -8.115 63 3HD2 LEU 8 3HD2 LEU 8 2.059 -6.146 -9.608 64 H VAL 9 H VAL 9 1.221 -5.441 -2.989 65 HA VAL 9 HA VAL 9 4.038 -5.481 -2.130 66 HB VAL 9 H5T VAL 9 1.422 -5.199 -0.618 67 1HG1 VAL 9 1HG1 VAL 9 2.815 -4.703 1.390 68 2HG1 VAL 9 2HG1 VAL 9 2.944 -6.390 0.893 69 3HG1 VAL 9 3HG1 VAL 9 4.258 -5.253 0.509 70 1HG2 VAL 9 1HG2 VAL 9 2.261 -2.942 -0.160 71 2HG2 VAL 9 2HG2 VAL 9 3.784 -3.300 -1.006 72 3HG2 VAL 9 3HG2 VAL 9 2.263 -3.211 -1.907 73 H ALA 10 H ALA 10 1.142 -7.607 -1.915 74 HA ALA 10 HA ALA 10 2.436 -9.824 -0.729 75 1HB ALA 10 HB1 ALA 10 -0.020 -9.600 -1.091 76 2HB ALA 10 HB2 ALA 10 0.233 -9.884 -2.830 77 3HB ALA 10 HB3 ALA 10 0.630 -11.150 -1.659 78 H LEU 11 H LEU 11 2.148 -9.129 -4.319 79 HA LEU 11 HA LEU 11 3.879 -11.247 -5.060 80 1HB LEU 11 HB2 LEU 11 2.436 -9.876 -6.626 81 2HB LEU 11 HB3 LEU 11 3.650 -8.597 -6.509 82 HG LEU 11 HG LEU 11 5.385 -10.272 -7.395 83 1HD1 LEU 11 1HD1 LEU 11 4.508 -12.246 -8.608 84 2HD1 LEU 11 2HD1 LEU 11 4.269 -12.396 -6.871 85 3HD1 LEU 11 3HD1 LEU 11 2.896 -11.958 -7.916 86 1HD2 LEU 11 1HD2 LEU 11 2.949 -9.706 -9.127 87 2HD2 LEU 11 2HD2 LEU 11 4.318 -8.613 -8.847 88 3HD2 LEU 11 3HD2 LEU 11 4.572 -10.134 -9.716 89 H TYR 12 H TYR 12 4.812 -7.864 -4.244 90 HA TYR 12 HA TYR 12 7.584 -8.065 -4.632 91 1HB TYR 12 HB2 TYR 12 6.643 -5.959 -4.146 92 2HB TYR 12 HB3 TYR 12 5.811 -6.560 -2.740 93 HD1 TYR 12 HD1 TYR 12 6.400 -5.050 -1.107 94 HD2 TYR 12 HD2 TYR 12 9.494 -6.957 -3.438 95 HE1 TYR 12 HE1 TYR 12 8.121 -4.105 0.404 96 HE2 TYR 12 HE2 TYR 12 11.211 -6.019 -1.918 97 HH TYR 12 HH TYR 12 11.627 -4.736 -0.062 98 H LYS 13 H LYS 13 5.729 -9.048 -1.677 99 HA LYS 13 HA LYS 13 8.021 -10.170 -0.343 100 1HB LYS 13 HB2 LYS 13 5.054 -10.852 -0.102 101 2HB LYS 13 HB3 LYS 13 6.302 -11.514 0.944 102 1HG LYS 13 HG2 LYS 13 5.653 -8.544 0.694 103 2HG LYS 13 HG3 LYS 13 5.068 -9.624 1.959 104 1HD LYS 13 HD2 LYS 13 7.433 -10.047 2.662 105 2HD LYS 13 HD3 LYS 13 7.981 -8.872 1.441 106 1HE LYS 13 HE2 LYS 13 6.606 -7.110 2.505 107 2HE LYS 13 HE3 LYS 13 6.047 -8.268 3.719 108 1HZ LYS 13 HZ1 LYS 13 8.359 -8.500 4.466 109 2HZ LYS 13 HZ2 LYS 13 8.875 -7.425 3.346 110 3HZ LYS 13 HZ3 LYS 13 7.895 -6.939 4.557 111 H TYR 14 H TYR 14 5.532 -12.095 -2.294 112 HA TYR 14 HA TYR 14 7.085 -14.374 -2.318 113 1HB TYR 14 HB2 TYR 14 5.436 -13.348 -4.644 114 2HB TYR 14 HB3 TYR 14 5.849 -15.023 -4.324 115 HD1 TYR 14 HD1 TYR 14 5.256 -15.227 -1.354 116 HD2 TYR 14 HD2 TYR 14 3.083 -13.378 -4.600 117 HE1 TYR 14 HE1 TYR 14 3.133 -15.479 -0.089 118 HE2 TYR 14 HE2 TYR 14 0.966 -13.640 -3.330 119 HH TYR 14 HH TYR 14 -0.019 -14.386 -1.398 120 H MET 15 H MET 15 7.770 -11.532 -4.307 121 HA MET 15 HA MET 15 9.594 -12.955 -6.065 122 1HB MET 15 HB2 MET 15 8.991 -10.022 -5.663 123 2HB MET 15 HB3 MET 15 10.165 -10.624 -6.849 124 1HG MET 15 HG2 MET 15 7.346 -11.670 -6.635 125 2HG MET 15 HG3 MET 15 7.757 -10.305 -7.682 126 1HE MET 15 HE1 MET 15 8.988 -10.544 -9.990 127 2HE MET 15 HE2 MET 15 10.440 -11.087 -9.123 128 3HE MET 15 HE3 MET 15 9.843 -12.006 -10.518 129 H LYS 16 H LYS 16 10.014 -10.717 -3.243 130 HA LYS 16 HA LYS 16 12.864 -11.053 -3.053 131 1HB LYS 16 HB2 LYS 16 11.486 -9.292 -1.953 132 2HB LYS 16 HB3 LYS 16 10.794 -10.489 -0.867 133 1HG LYS 16 HG2 LYS 16 13.803 -10.249 -1.035 134 2HG LYS 16 HG3 LYS 16 12.920 -8.958 -0.230 135 1HD LYS 16 HD2 LYS 16 12.057 -10.345 1.455 136 2HD LYS 16 HD3 LYS 16 12.411 -11.838 0.603 137 1HE LYS 16 HE2 LYS 16 14.543 -9.926 1.650 138 2HE LYS 16 HE3 LYS 16 13.934 -11.323 2.541 139 1HZ LYS 16 HZ1 LYS 16 15.329 -11.458 -0.079 140 2HZ LYS 16 HZ2 LYS 16 15.941 -11.924 1.360 141 3HZ LYS 16 HZ3 LYS 16 14.695 -12.745 0.694 142 H GLU 17 H GLU 17 10.153 -13.092 -2.134 143 HA GLU 17 HA GLU 17 11.705 -14.972 -0.571 144 1HB GLU 17 HB2 GLU 17 9.241 -14.634 -0.470 145 2HB GLU 17 HB3 GLU 17 9.095 -15.401 -2.046 146 1HG GLU 17 HG2 GLU 17 9.897 -17.528 -1.106 147 2HG GLU 17 HG3 GLU 17 10.156 -16.742 0.459 148 H ARG 18 H ARG 18 12.054 -14.281 -3.854 149 HA ARG 18 HA ARG 18 12.968 -17.064 -4.480 150 1HB ARG 18 HB2 ARG 18 11.129 -15.270 -6.088 151 2HB ARG 18 HB3 ARG 18 12.033 -16.599 -6.833 152 1HG ARG 18 HG2 ARG 18 10.937 -18.258 -5.535 153 2HG ARG 18 HG3 ARG 18 10.300 -17.077 -4.394 154 1HD ARG 18 HD2 ARG 18 8.831 -16.132 -6.155 155 2HD ARG 18 HD3 ARG 18 9.442 -17.336 -7.294 156 HE ARG 18 H3T ARG 18 8.052 -18.923 -6.348 157 1HH1 ARG 18 2HH2 ARG 18 8.236 -16.298 -4.035 158 2HH1 ARG 18 1HH2 ARG 18 7.368 -17.207 -2.802 159 1HH2 ARG 18 2HH1 ARG 18 6.749 -19.916 -4.804 160 2HH2 ARG 18 1HH1 ARG 18 6.415 -19.077 -3.312 161 H LYS 19 H LYS 19 13.074 -13.937 -6.150 162 HA LYS 19 HA LYS 19 16.050 -14.147 -6.426 163 1HB LYS 19 HB2 LYS 19 14.065 -14.263 -8.750 164 2HB LYS 19 HB3 LYS 19 15.777 -13.943 -8.963 165 1HG LYS 19 HG2 LYS 19 14.630 -16.538 -7.874 166 2HG LYS 19 HG3 LYS 19 15.181 -16.243 -9.516 167 1HD LYS 19 HD2 LYS 19 17.477 -15.808 -8.726 168 2HD LYS 19 HD3 LYS 19 16.970 -16.083 -7.047 169 1HE LYS 19 HE2 LYS 19 16.256 -18.387 -7.638 170 2HE LYS 19 HE3 LYS 19 16.790 -18.124 -9.303 171 1HZ LYS 19 HZ1 LYS 19 18.558 -18.049 -6.914 172 2HZ LYS 19 HZ2 LYS 19 18.491 -19.265 -7.999 173 3HZ LYS 19 HZ3 LYS 19 19.056 -17.804 -8.452 174 H THR 20 H THR 20 13.437 -12.104 -5.924 175 HA THR 20 HA THR 20 14.896 -9.760 -7.082 176 HB THR 20 H5T THR 20 12.184 -10.734 -7.915 177 HG1 THR 20 HG1 THR 20 13.136 -10.622 -9.888 178 1HG2 THR 20 1HG2 THR 20 11.686 -8.407 -7.673 179 2HG2 THR 20 2HG2 THR 20 13.304 -7.921 -8.237 180 3HG2 THR 20 3HG2 THR 20 12.123 -8.621 -9.362 181 HA PRO 21 HA PRO 21 13.064 -8.162 -3.189 182 1HB PRO 21 HB2 PRO 21 15.031 -6.419 -2.506 183 2HB PRO 21 HB3 PRO 21 15.224 -8.184 -2.315 184 1HG PRO 21 HG2 PRO 21 16.169 -6.465 -4.634 185 2HG PRO 21 HG3 PRO 21 17.129 -7.627 -3.662 186 1HD PRO 21 HD2 PRO 21 15.985 -8.294 -6.045 187 2HD PRO 21 HD3 PRO 21 16.125 -9.477 -4.711 188 H ILE 22 H ILE 22 12.756 -7.287 -6.162 189 HA ILE 22 HA ILE 22 11.910 -5.678 -7.371 190 HB ILE 22 H5T ILE 22 10.332 -5.811 -5.199 191 1HG1 ILE 22 2HG1 ILE 22 9.717 -4.024 -7.566 192 2HG1 ILE 22 3HG1 ILE 22 9.806 -5.782 -7.673 193 1HG2 ILE 22 1HG2 ILE 22 11.259 -3.696 -4.196 194 2HG2 ILE 22 2HG2 ILE 22 10.680 -2.811 -5.624 195 3HG2 ILE 22 3HG2 ILE 22 9.541 -3.620 -4.531 196 1HD1 ILE 22 1HD1 ILE 22 8.015 -6.063 -6.038 197 2HD1 ILE 22 2HD1 ILE 22 7.867 -4.297 -5.850 198 3HD1 ILE 22 3HD1 ILE 22 7.472 -5.063 -7.388 199 H GLU 23 H GLU 23 13.584 -3.874 -4.733 200 HA GLU 23 HA GLU 23 14.018 -1.599 -6.293 201 1HB GLU 23 HB2 GLU 23 15.804 -2.808 -4.145 202 2HB GLU 23 HB3 GLU 23 15.877 -1.137 -4.717 203 1HG GLU 23 HG2 GLU 23 13.514 -0.796 -3.980 204 2HG GLU 23 HG3 GLU 23 13.505 -2.425 -3.302 205 H ARG 24 H ARG 24 15.439 -4.615 -7.035 206 HA ARG 24 HA ARG 24 17.895 -3.763 -8.273 207 1HB ARG 24 HB2 ARG 24 17.886 -5.838 -9.424 208 2HB ARG 24 HB3 ARG 24 17.262 -6.143 -7.803 209 1HG ARG 24 HG2 ARG 24 14.918 -6.082 -8.760 210 2HG ARG 24 HG3 ARG 24 15.613 -5.924 -10.375 211 1HD ARG 24 HD2 ARG 24 16.046 -8.269 -8.484 212 2HD ARG 24 HD3 ARG 24 14.940 -8.221 -9.870 213 HE ARG 24 H3T ARG 24 17.624 -7.601 -10.701 214 1HH1 ARG 24 2HH2 ARG 24 15.599 -10.369 -9.865 215 2HH1 ARG 24 1HH2 ARG 24 16.597 -11.457 -10.787 216 1HH2 ARG 24 2HH1 ARG 24 18.819 -9.069 -11.858 217 2HH2 ARG 24 1HH1 ARG 24 18.342 -10.739 -11.901 218 H ILE 25 H ILE 25 14.619 -3.241 -9.221 219 HA ILE 25 HA ILE 25 15.003 -2.987 -12.041 220 HB ILE 25 H5T ILE 25 12.846 -2.456 -10.048 221 1HG1 ILE 25 2HG1 ILE 25 12.951 -3.846 -12.761 222 2HG1 ILE 25 3HG1 ILE 25 13.296 -4.622 -11.217 223 1HG2 ILE 25 1HG2 ILE 25 12.666 -1.193 -12.798 224 2HG2 ILE 25 2HG2 ILE 25 11.321 -1.448 -11.686 225 3HG2 ILE 25 3HG2 ILE 25 12.609 -0.380 -11.199 226 1HD1 ILE 25 1HD1 ILE 25 10.972 -4.134 -10.463 227 2HD1 ILE 25 2HD1 ILE 25 10.610 -3.509 -12.092 228 3HD1 ILE 25 3HD1 ILE 25 11.073 -5.200 -11.884 229 HA PRO 26 HA PRO 26 16.876 1.034 -12.252 230 1HB PRO 26 HB2 PRO 26 16.622 1.599 -14.909 231 2HB PRO 26 HB3 PRO 26 17.633 0.254 -14.301 232 1HG PRO 26 HG2 PRO 26 14.759 0.102 -15.288 233 2HG PRO 26 HG3 PRO 26 16.164 -0.873 -15.838 234 1HD PRO 26 HD2 PRO 26 14.483 -1.823 -13.934 235 2HD PRO 26 HD3 PRO 26 16.241 -2.083 -13.802 236 H TYR 27 H TYR 27 13.506 0.710 -12.398 237 HA TYR 27 HA TYR 27 11.832 2.167 -12.014 238 1HB TYR 27 HB2 TYR 27 13.747 4.483 -11.787 239 2HB TYR 27 HB3 TYR 27 12.121 4.348 -11.174 240 HD1 TYR 27 HD1 TYR 27 15.529 4.045 -10.288 241 HD2 TYR 27 HD2 TYR 27 11.636 2.364 -9.487 242 HE1 TYR 27 HE1 TYR 27 16.332 3.222 -8.074 243 HE2 TYR 27 HE2 TYR 27 12.437 1.552 -7.275 244 HH TYR 27 HH TYR 27 14.188 1.469 -5.799 245 H LEU 28 H LEU 28 10.892 4.460 -12.903 246 HA LEU 28 HA LEU 28 10.546 3.781 -15.728 247 1HB LEU 28 HB2 LEU 28 8.761 4.041 -13.852 248 2HB LEU 28 HB3 LEU 28 8.966 5.773 -14.063 249 HG LEU 28 HG LEU 28 8.163 5.569 -16.418 250 1HD1 LEU 28 1HD1 LEU 28 7.793 2.625 -15.709 251 2HD1 LEU 28 2HD1 LEU 28 7.094 3.435 -17.131 252 3HD1 LEU 28 3HD1 LEU 28 8.847 3.290 -16.984 253 1HD2 LEU 28 1HD2 LEU 28 6.374 4.253 -14.329 254 2HD2 LEU 28 2HD2 LEU 28 6.576 6.000 -14.588 255 3HD2 LEU 28 3HD2 LEU 28 5.827 5.000 -15.844 256 H GLY 29 H GLY 29 13.029 5.221 -15.070 257 1HA GLY 29 HA2 GLY 29 14.277 6.679 -16.393 258 2HA GLY 29 HA3 GLY 29 12.806 7.299 -17.135 259 H PHE 30 H PHE 30 11.481 8.047 -14.694 260 HA PHE 30 HA PHE 30 13.283 9.949 -13.298 261 1HB PHE 30 HB2 PHE 30 12.025 11.852 -13.817 262 2HB PHE 30 HB3 PHE 30 12.163 11.025 -15.352 263 HD1 PHE 30 HD1 PHE 30 9.927 12.653 -13.137 264 HD2 PHE 30 HD2 PHE 30 10.102 9.359 -15.910 265 HE1 PHE 30 HE1 PHE 30 7.458 12.714 -13.373 266 HE2 PHE 30 HE2 PHE 30 7.632 9.409 -16.130 267 HZ PHE 30 HZ PHE 30 6.306 11.091 -14.867 268 H LYS 31 H LYS 31 10.856 7.638 -12.972 269 HA LYS 31 HA LYS 31 10.021 8.629 -10.291 270 1HB LYS 31 HB2 LYS 31 8.534 9.543 -12.188 271 2HB LYS 31 HB3 LYS 31 8.021 7.883 -12.482 272 1HG LYS 31 HG2 LYS 31 7.072 7.775 -10.190 273 2HG LYS 31 HG3 LYS 31 7.717 9.396 -9.846 274 1HD LYS 31 HD2 LYS 31 6.310 10.293 -11.735 275 2HD LYS 31 HD3 LYS 31 5.601 8.674 -11.926 276 1HE LYS 31 HE2 LYS 31 4.783 8.764 -9.577 277 2HE LYS 31 HE3 LYS 31 5.532 10.351 -9.371 278 1HZ LYS 31 HZ1 LYS 31 3.167 10.551 -9.886 279 2HZ LYS 31 HZ2 LYS 31 4.042 11.217 -11.089 280 3HZ LYS 31 HZ3 LYS 31 3.346 9.752 -11.298 281 H GLN 32 H GLN 32 8.952 6.981 -9.028 282 HA GLN 32 HA GLN 32 10.047 4.373 -9.164 283 1HB GLN 32 HB2 GLN 32 8.978 5.617 -7.176 284 2HB GLN 32 HB3 GLN 32 7.414 5.185 -7.865 285 1HG GLN 32 HG2 GLN 32 8.370 2.697 -7.724 286 2HG GLN 32 HG3 GLN 32 9.524 3.409 -6.607 287 1HE2 GLN 32 1HE2 GLN 32 6.140 2.539 -7.173 288 2HE2 GLN 32 2HE2 GLN 32 5.612 2.843 -5.516 289 H ILE 33 H ILE 33 9.198 2.353 -9.796 290 HA ILE 33 HA ILE 33 7.275 2.211 -11.944 291 HB ILE 33 H5T ILE 33 7.189 -0.253 -11.229 292 1HG1 ILE 33 2HG1 ILE 33 9.762 0.344 -9.733 293 2HG1 ILE 33 3HG1 ILE 33 8.213 0.246 -8.893 294 1HG2 ILE 33 1HG2 ILE 33 8.422 0.678 -13.170 295 2HG2 ILE 33 2HG2 ILE 33 9.845 0.923 -12.137 296 3HG2 ILE 33 3HG2 ILE 33 9.238 -0.716 -12.464 297 1HD1 ILE 33 1HD1 ILE 33 9.370 -2.014 -10.568 298 2HD1 ILE 33 2HD1 ILE 33 9.451 -1.879 -8.803 299 3HD1 ILE 33 3HD1 ILE 33 7.880 -2.046 -9.604 300 H ASN 34 H ASN 34 5.165 1.880 -11.949 301 HA ASN 34 HA ASN 34 3.614 1.714 -9.390 302 1HB ASN 34 HB2 ASN 34 3.152 3.532 -11.791 303 2HB ASN 34 HB3 ASN 34 2.007 3.305 -10.472 304 1HD2 ASN 34 1HD2 ASN 34 3.699 5.686 -11.496 305 2HD2 ASN 34 2HD2 ASN 34 4.425 6.278 -10.008 306 H LEU 35 H LEU 35 3.653 -0.568 -9.894 307 HA LEU 35 HA LEU 35 2.984 -1.654 -12.397 308 1HB LEU 35 HB2 LEU 35 3.141 -2.713 -9.604 309 2HB LEU 35 HB3 LEU 35 2.603 -3.779 -10.910 310 HG LEU 35 HG LEU 35 5.116 -2.156 -11.343 311 1HD1 LEU 35 1HD1 LEU 35 5.060 -4.687 -9.674 312 2HD1 LEU 35 2HD1 LEU 35 6.492 -3.807 -10.242 313 3HD1 LEU 35 3HD1 LEU 35 5.408 -3.051 -9.068 314 1HD2 LEU 35 1HD2 LEU 35 4.135 -3.682 -13.100 315 2HD2 LEU 35 2HD2 LEU 35 5.794 -4.101 -12.626 316 3HD2 LEU 35 3HD2 LEU 35 4.421 -5.045 -12.006 317 H TRP 36 H TRP 36 0.764 -0.846 -9.774 318 HA TRP 36 HA TRP 36 -1.711 -1.876 -10.780 319 1HB TRP 36 HB2 TRP 36 -2.626 0.090 -9.457 320 2HB TRP 36 HB3 TRP 36 -1.642 -1.094 -8.611 321 HD1 TRP 36 HD1 TRP 36 -1.616 2.583 -9.571 322 HE1 TRP 36 HE1 TRP 36 0.313 3.771 -8.375 323 HE3 TRP 36 HE3 TRP 36 0.705 -1.492 -7.532 324 HZ2 TRP 36 HZ2 TRP 36 2.639 3.037 -6.821 325 HZ3 TRP 36 HZ3 TRP 36 2.851 -1.238 -6.304 326 HH2 TRP 36 HH2 TRP 36 3.820 1.018 -5.937 327 H THR 37 H THR 37 0.030 1.230 -11.399 328 HA THR 37 HA THR 37 -1.921 2.343 -13.206 329 HB THR 37 H5T THR 37 0.966 3.161 -12.791 330 HG1 THR 37 HG1 THR 37 -0.094 4.741 -11.473 331 1HG2 THR 37 1HG2 THR 37 0.164 5.378 -13.592 332 2HG2 THR 37 2HG2 THR 37 0.058 4.154 -14.859 333 3HG2 THR 37 3HG2 THR 37 -1.411 4.655 -13.991 334 H MET 38 H MET 38 1.321 0.798 -13.824 335 HA MET 38 HA MET 38 1.034 1.033 -16.666 336 1HB MET 38 HB2 MET 38 2.926 -0.174 -16.966 337 2HB MET 38 HB3 MET 38 3.178 0.572 -15.392 338 1HG MET 38 HG2 MET 38 2.518 -1.608 -14.336 339 2HG MET 38 HG3 MET 38 2.323 -2.302 -15.932 340 1HE MET 38 HE1 MET 38 4.865 -0.897 -13.302 341 2HE MET 38 HE2 MET 38 6.432 -1.177 -14.083 342 3HE MET 38 HE3 MET 38 5.365 0.115 -14.676 343 H PHE 39 H PHE 39 -0.219 -1.375 -14.369 344 HA PHE 39 HA PHE 39 -1.249 -3.232 -16.306 345 1HB PHE 39 HB2 PHE 39 -1.197 -3.704 -13.866 346 2HB PHE 39 HB3 PHE 39 -2.367 -2.462 -13.587 347 HD1 PHE 39 HD1 PHE 39 -2.125 -5.348 -16.039 348 HD2 PHE 39 HD2 PHE 39 -4.494 -3.245 -13.103 349 HE1 PHE 39 HE1 PHE 39 -3.956 -6.984 -16.344 350 HE2 PHE 39 HE2 PHE 39 -6.345 -4.860 -13.458 351 HZ PHE 39 HZ PHE 39 -6.072 -6.723 -15.084 352 H GLN 40 H GLN 40 -3.121 -0.556 -14.626 353 HA GLN 40 HA GLN 40 -5.264 -0.954 -16.493 354 1HB GLN 40 HB2 GLN 40 -6.268 1.067 -15.662 355 2HB GLN 40 HB3 GLN 40 -5.623 0.120 -14.321 356 1HG GLN 40 HG2 GLN 40 -3.675 1.610 -14.180 357 2HG GLN 40 HG3 GLN 40 -4.260 2.577 -15.534 358 1HE2 GLN 40 1HE2 GLN 40 -3.765 3.300 -12.579 359 2HE2 GLN 40 2HE2 GLN 40 -5.299 4.007 -12.107 360 H ALA 41 H ALA 41 -2.359 1.018 -16.897 361 HA ALA 41 HA ALA 41 -3.232 2.326 -19.308 362 1HB ALA 41 HB1 ALA 41 -0.427 1.499 -18.415 363 2HB ALA 41 HB2 ALA 41 -0.819 2.673 -19.683 364 3HB ALA 41 HB3 ALA 41 -1.235 3.024 -17.994 365 H ALA 42 H ALA 42 -1.310 -0.751 -18.875 366 HA ALA 42 HA ALA 42 -1.271 -1.406 -21.640 367 1HB ALA 42 HB1 ALA 42 0.188 -2.453 -19.940 368 2HB ALA 42 HB2 ALA 42 -1.222 -3.237 -19.197 369 3HB ALA 42 HB3 ALA 42 -0.721 -3.677 -20.843 370 H GLN 43 H GLN 43 -3.762 -2.080 -19.144 371 HA GLN 43 HA GLN 43 -5.329 -3.818 -20.748 372 1HB GLN 43 HB2 GLN 43 -6.030 -2.064 -18.380 373 2HB GLN 43 HB3 GLN 43 -7.194 -3.136 -19.149 374 1HG GLN 43 HG2 GLN 43 -4.581 -4.033 -17.866 375 2HG GLN 43 HG3 GLN 43 -6.182 -4.184 -17.162 376 1HE2 GLN 43 1HE2 GLN 43 -3.843 -5.956 -18.706 377 2HE2 GLN 43 2HE2 GLN 43 -4.886 -7.165 -19.448 378 H LYS 44 H LYS 44 -5.098 -0.284 -20.777 379 HA LYS 44 HA LYS 44 -7.495 -0.047 -22.524 380 1HB LYS 44 HB2 LYS 44 -5.509 1.996 -21.461 381 2HB LYS 44 HB3 LYS 44 -6.756 2.367 -22.667 382 1HG LYS 44 HG2 LYS 44 -8.501 1.471 -21.093 383 2HG LYS 44 HG3 LYS 44 -7.263 1.304 -19.850 384 1HD LYS 44 HD2 LYS 44 -8.098 3.906 -21.205 385 2HD LYS 44 HD3 LYS 44 -8.628 3.354 -19.609 386 1HE LYS 44 HE2 LYS 44 -6.256 3.375 -18.825 387 2HE LYS 44 HE3 LYS 44 -5.754 3.993 -20.405 388 1HZ LYS 44 HZ1 LYS 44 -7.160 5.947 -20.011 389 2HZ LYS 44 HZ2 LYS 44 -7.583 5.394 -18.527 390 3HZ LYS 44 HZ3 LYS 44 -6.027 5.810 -18.851 391 H LEU 45 H LEU 45 -3.927 0.312 -22.842 392 HA LEU 45 HA LEU 45 -4.119 0.280 -25.702 393 1HB LEU 45 HB2 LEU 45 -1.753 -0.099 -23.828 394 2HB LEU 45 HB3 LEU 45 -1.624 -0.033 -25.569 395 HG LEU 45 HG LEU 45 -0.974 2.063 -24.937 396 1HD1 LEU 45 1HD1 LEU 45 -3.933 2.477 -25.534 397 2HD1 LEU 45 2HD1 LEU 45 -2.635 3.647 -25.767 398 3HD1 LEU 45 3HD1 LEU 45 -2.664 2.167 -26.747 399 1HD2 LEU 45 1HD2 LEU 45 -3.360 2.415 -23.093 400 2HD2 LEU 45 2HD2 LEU 45 -1.679 2.087 -22.598 401 3HD2 LEU 45 3HD2 LEU 45 -2.084 3.594 -23.421 402 H GLY 46 H GLY 46 -5.266 -2.213 -24.125 403 1HA GLY 46 HA2 GLY 46 -6.010 -4.020 -25.434 404 2HA GLY 46 HA3 GLY 46 -4.584 -3.951 -26.440 405 H GLY 47 H GLY 47 -4.378 -4.091 -22.939 406 1HA GLY 47 HA2 GLY 47 -3.316 -5.530 -21.530 407 2HA GLY 47 HA3 GLY 47 -3.904 -6.857 -22.534 408 H TYR 48 H TYR 48 -1.489 -7.077 -21.291 409 HA TYR 48 HA TYR 48 0.814 -6.615 -22.756 410 1HB TYR 48 HB2 TYR 48 0.653 -7.783 -20.617 411 2HB TYR 48 HB3 TYR 48 -0.101 -9.166 -21.388 412 HD1 TYR 48 HD1 TYR 48 1.211 -10.894 -22.382 413 HD2 TYR 48 HD2 TYR 48 3.073 -7.191 -21.179 414 HE1 TYR 48 HE1 TYR 48 3.452 -11.937 -22.652 415 HE2 TYR 48 HE2 TYR 48 5.323 -8.248 -21.438 416 HH TYR 48 HH TYR 48 5.706 -11.663 -22.462 417 H GLU 49 H GLU 49 -1.907 -8.672 -23.807 418 HA GLU 49 HA GLU 49 -0.254 -10.186 -25.664 419 1HB GLU 49 HB2 GLU 49 -3.259 -9.989 -25.242 420 2HB GLU 49 HB3 GLU 49 -2.507 -11.023 -26.473 421 1HG GLU 49 HG2 GLU 49 -1.188 -12.189 -24.743 422 2HG GLU 49 HG3 GLU 49 -1.876 -11.157 -23.489 423 H THR 50 H THR 50 -2.387 -7.312 -26.093 424 HA THR 50 HA THR 50 -1.754 -7.187 -28.941 425 HB THR 50 H5T THR 50 -2.778 -4.945 -27.177 426 HG1 THR 50 HG1 THR 50 -4.281 -6.518 -27.111 427 1HG2 THR 50 1HG2 THR 50 -1.934 -4.172 -29.378 428 2HG2 THR 50 2HG2 THR 50 -2.932 -5.401 -30.189 429 3HG2 THR 50 3HG2 THR 50 -3.697 -4.063 -29.299 430 H ILE 51 H ILE 51 -0.423 -5.852 -25.882 431 HA ILE 51 HA ILE 51 1.392 -4.057 -27.082 432 HB ILE 51 H5T ILE 51 0.776 -4.975 -24.454 433 1HG1 ILE 51 2HG1 ILE 51 2.335 -2.958 -23.831 434 2HG1 ILE 51 3HG1 ILE 51 2.412 -2.699 -25.563 435 1HG2 ILE 51 1HG2 ILE 51 3.757 -5.105 -24.815 436 2HG2 ILE 51 2HG2 ILE 51 2.840 -5.125 -23.284 437 3HG2 ILE 51 3HG2 ILE 51 2.709 -6.465 -24.397 438 1HD1 ILE 51 1HD1 ILE 51 -0.060 -2.754 -23.758 439 2HD1 ILE 51 2HD1 ILE 51 0.562 -1.379 -24.696 440 3HD1 ILE 51 3HD1 ILE 51 -0.201 -2.764 -25.513 441 H THR 52 H THR 52 1.943 -7.519 -26.324 442 HA THR 52 HA THR 52 4.656 -7.424 -27.266 443 HB THR 52 H5T THR 52 3.620 -9.043 -25.604 444 HG1 THR 52 HG1 THR 52 4.952 -10.807 -26.565 445 1HG2 THR 52 1HG2 THR 52 2.774 -11.156 -26.362 446 2HG2 THR 52 2HG2 THR 52 1.737 -9.878 -26.995 447 3HG2 THR 52 3HG2 THR 52 2.907 -10.678 -28.069 448 H ALA 53 H ALA 53 1.582 -8.170 -28.881 449 HA ALA 53 HA ALA 53 2.859 -9.104 -31.322 450 1HB ALA 53 HB1 ALA 53 0.537 -9.132 -32.148 451 2HB ALA 53 HB2 ALA 53 0.654 -9.897 -30.552 452 3HB ALA 53 HB3 ALA 53 -0.003 -8.252 -30.702 453 H ARG 54 H ARG 54 1.917 -5.869 -30.119 454 HA ARG 54 HA ARG 54 2.436 -4.776 -32.885 455 1HB ARG 54 HB2 ARG 54 0.087 -4.113 -31.070 456 2HB ARG 54 HB3 ARG 54 0.481 -3.283 -32.575 457 1HG ARG 54 HG2 ARG 54 0.222 -5.478 -33.796 458 2HG ARG 54 HG3 ARG 54 -0.319 -6.199 -32.274 459 1HD ARG 54 HD2 ARG 54 -2.272 -5.654 -33.506 460 2HD ARG 54 HD3 ARG 54 -2.158 -4.504 -32.164 461 HE ARG 54 H3T ARG 54 -0.909 -3.405 -34.508 462 1HH1 ARG 54 2HH2 ARG 54 -4.137 -4.089 -33.327 463 2HH1 ARG 54 1HH2 ARG 54 -4.856 -2.830 -34.293 464 1HH2 ARG 54 2HH1 ARG 54 -1.892 -1.810 -35.708 465 2HH2 ARG 54 1HH1 ARG 54 -3.613 -1.581 -35.606 466 H ARG 55 H ARG 55 3.874 -4.609 -30.059 467 HA ARG 55 HA ARG 55 5.325 -3.137 -29.062 468 1HB ARG 55 HB2 ARG 55 5.437 -1.894 -31.841 469 2HB ARG 55 HB3 ARG 55 6.599 -1.637 -30.536 470 1HG ARG 55 HG2 ARG 55 7.153 -4.068 -30.551 471 2HG ARG 55 HG3 ARG 55 6.047 -4.295 -31.924 472 1HD ARG 55 HD2 ARG 55 7.367 -2.674 -33.256 473 2HD ARG 55 HD3 ARG 55 8.478 -2.459 -31.885 474 HE ARG 55 H3T ARG 55 8.306 -5.241 -32.536 475 1HH1 ARG 55 2HH1 ARG 55 9.709 -2.321 -33.873 476 2HH1 ARG 55 1HH1 ARG 55 10.968 -3.195 -34.701 477 1HH2 ARG 55 2HH2 ARG 55 9.936 -6.294 -33.621 478 2HH2 ARG 55 1HH2 ARG 55 11.085 -5.387 -34.560 479 H GLN 56 H GLN 56 2.903 -2.647 -28.242 480 HA GLN 56 HA GLN 56 2.136 0.100 -28.924 481 1HB GLN 56 HB2 GLN 56 0.718 -2.036 -27.341 482 2HB GLN 56 HB3 GLN 56 0.074 -0.411 -27.547 483 1HG GLN 56 HG2 GLN 56 0.699 -2.358 -29.798 484 2HG GLN 56 HG3 GLN 56 -0.895 -2.064 -29.116 485 1HE2 GLN 56 1HE2 GLN 56 1.381 -0.966 -31.506 486 2HE2 GLN 56 2HE2 GLN 56 0.479 0.485 -31.941 487 H TRP 57 H TRP 57 4.298 -1.077 -26.708 488 HA TRP 57 HA TRP 57 3.834 0.303 -24.312 489 1HB TRP 57 HB2 TRP 57 6.488 -0.034 -25.769 490 2HB TRP 57 HB3 TRP 57 6.264 0.372 -24.071 491 HD1 TRP 57 HD1 TRP 57 6.483 -2.560 -26.353 492 HE1 TRP 57 HE1 TRP 57 6.142 -4.730 -25.052 493 HE3 TRP 57 HE3 TRP 57 5.056 -0.576 -21.847 494 HZ2 TRP 57 HZ2 TRP 57 5.147 -5.521 -22.431 495 HZ3 TRP 57 HZ3 TRP 57 4.354 -2.075 -19.977 496 HH2 TRP 57 HH2 TRP 57 4.331 -4.529 -20.314 497 H LYS 58 H LYS 58 4.991 1.625 -27.410 498 HA LYS 58 HA LYS 58 5.658 4.251 -26.450 499 1HB LYS 58 HB2 LYS 58 4.642 3.451 -29.206 500 2HB LYS 58 HB3 LYS 58 5.482 4.945 -28.792 501 1HG LYS 58 HG2 LYS 58 6.648 2.126 -28.754 502 2HG LYS 58 HG3 LYS 58 7.012 3.431 -29.880 503 1HD LYS 58 HD2 LYS 58 7.938 4.758 -27.906 504 2HD LYS 58 HD3 LYS 58 7.746 3.285 -26.924 505 1HE LYS 58 HE2 LYS 58 9.154 2.050 -28.623 506 2HE LYS 58 HE3 LYS 58 9.411 3.584 -29.462 507 1HZ LYS 58 HZ1 LYS 58 10.336 2.876 -26.726 508 2HZ LYS 58 HZ2 LYS 58 11.257 3.196 -28.018 509 3HZ LYS 58 HZ3 LYS 58 10.412 4.411 -27.326 510 H HIS 59 H HIS 59 2.461 2.843 -27.060 511 HA HIS 59 HA HIS 59 1.226 5.476 -26.506 512 1HB HIS 59 HB2 HIS 59 -0.046 2.787 -27.077 513 2HB HIS 59 HB3 HIS 59 -0.857 4.357 -26.976 514 HD1 HIS 59 HD1 HIS 59 -0.122 6.181 -28.980 515 HD2 HIS 59 HD2 HIS 59 0.997 2.150 -29.419 516 HE1 HIS 59 HE1 HIS 59 0.557 5.889 -31.420 517 H ILE 60 H ILE 60 2.307 2.750 -24.626 518 HA ILE 60 HA ILE 60 0.560 3.345 -22.318 519 HB ILE 60 H5T ILE 60 3.114 1.726 -22.613 520 1HG1 ILE 60 2HG1 ILE 60 0.288 0.997 -21.710 521 2HG1 ILE 60 3HG1 ILE 60 0.880 0.797 -23.360 522 1HG2 ILE 60 1HG2 ILE 60 3.284 2.874 -20.437 523 2HG2 ILE 60 2HG2 ILE 60 1.635 2.361 -20.022 524 3HG2 ILE 60 3HG2 ILE 60 2.947 1.177 -20.199 525 1HD1 ILE 60 1HD1 ILE 60 1.976 -0.651 -20.909 526 2HD1 ILE 60 2HD1 ILE 60 0.953 -1.322 -22.172 527 3HD1 ILE 60 3HD1 ILE 60 2.589 -0.794 -22.578 528 H TYR 61 H TYR 61 3.800 4.284 -23.554 529 HA TYR 61 HA TYR 61 4.391 6.295 -21.644 530 1HB TYR 61 HB2 TYR 61 6.145 5.793 -23.042 531 2HB TYR 61 HB3 TYR 61 5.157 5.739 -24.484 532 HD1 TYR 61 HD1 TYR 61 7.377 7.756 -22.460 533 HD2 TYR 61 HD2 TYR 61 4.396 7.906 -25.578 534 HE1 TYR 61 HE1 TYR 61 8.210 9.997 -23.178 535 HE2 TYR 61 HE2 TYR 61 5.208 10.152 -26.256 536 HH TYR 61 HH TYR 61 6.718 11.834 -25.857 537 H ASP 62 H ASP 62 2.129 6.406 -24.412 538 HA ASP 62 HA ASP 62 1.524 9.187 -24.148 539 1HB ASP 62 HB2 ASP 62 0.956 7.859 -26.155 540 2HB ASP 62 HB3 ASP 62 -0.342 7.090 -25.240 541 H GLU 63 H GLU 63 -0.233 6.298 -22.827 542 HA GLU 63 HA GLU 63 -1.876 7.757 -21.091 543 1HB GLU 63 HB2 GLU 63 -2.088 5.356 -21.694 544 2HB GLU 63 HB3 GLU 63 -0.707 4.984 -20.674 545 1HG GLU 63 HG2 GLU 63 -2.781 4.434 -19.561 546 2HG GLU 63 HG3 GLU 63 -1.924 5.677 -18.670 547 H LEU 64 H LEU 64 1.552 6.917 -20.470 548 HA LEU 64 HA LEU 64 1.602 7.746 -17.710 549 1HB LEU 64 HB2 LEU 64 3.842 7.981 -19.771 550 2HB LEU 64 HB3 LEU 64 4.015 8.134 -18.037 551 HG LEU 64 HG LEU 64 3.384 5.625 -19.581 552 1HD1 LEU 64 1HD1 LEU 64 5.733 6.413 -17.835 553 2HD1 LEU 64 2HD1 LEU 64 5.523 4.863 -18.683 554 3HD1 LEU 64 3HD1 LEU 64 5.722 6.360 -19.609 555 1HD2 LEU 64 1HD2 LEU 64 3.512 4.434 -17.396 556 2HD2 LEU 64 2HD2 LEU 64 3.534 6.005 -16.562 557 3HD2 LEU 64 3HD2 LEU 64 2.104 5.496 -17.494 558 H GLY 65 H GLY 65 1.219 9.651 -20.611 559 1HA GLY 65 HA2 GLY 65 0.920 11.969 -20.777 560 2HA GLY 65 HA3 GLY 65 1.402 12.193 -19.091 561 H GLY 66 H GLY 66 3.267 10.299 -21.495 562 1HA GLY 66 HA2 GLY 66 5.275 10.766 -22.537 563 2HA GLY 66 HA3 GLY 66 5.216 12.432 -21.980 564 H ASN 67 H ASN 67 7.567 11.984 -21.739 565 HA ASN 67 HA ASN 67 8.228 11.221 -18.978 566 1HB ASN 67 HB2 ASN 67 8.321 9.127 -20.424 567 2HB ASN 67 HB3 ASN 67 9.598 9.894 -21.363 568 1HD2 ASN 67 1HD2 ASN 67 8.775 8.296 -18.383 569 2HD2 ASN 67 2HD2 ASN 67 10.410 8.153 -17.791 570 HA PRO 68 HA PRO 68 11.036 14.708 -19.575 571 1HB PRO 68 HB2 PRO 68 12.765 13.240 -17.577 572 2HB PRO 68 HB3 PRO 68 12.310 14.974 -17.618 573 1HG PRO 68 HG2 PRO 68 11.027 13.312 -15.944 574 2HG PRO 68 HG3 PRO 68 10.070 14.469 -16.923 575 1HD PRO 68 HD2 PRO 68 10.589 11.534 -17.484 576 2HD PRO 68 HD3 PRO 68 9.045 12.442 -17.520 577 H GLY 69 H GLY 69 11.933 11.605 -20.664 578 1HA GLY 69 HA2 GLY 69 14.020 12.694 -22.355 579 2HA GLY 69 HA3 GLY 69 14.686 11.640 -21.095 580 H SER 70 H SER 70 12.178 9.906 -21.183 581 HA SER 70 HA SER 70 11.550 7.960 -22.147 582 1HB SER 70 HB2 SER 70 12.482 8.968 -24.841 583 2HB SER 70 HB3 SER 70 11.363 7.642 -24.485 584 HG SER 70 HG SER 70 10.297 9.628 -25.054 585 H THR 71 H THR 71 14.365 8.597 -21.278 586 HA THR 71 HA THR 71 16.173 7.033 -22.794 587 HB THR 71 H5T THR 71 17.598 7.318 -20.648 588 HG1 THR 71 HG1 THR 71 16.778 8.808 -19.193 589 1HG2 THR 71 1HG2 THR 71 16.445 9.820 -21.954 590 2HG2 THR 71 2HG2 THR 71 17.979 9.699 -21.065 591 3HG2 THR 71 3HG2 THR 71 17.776 8.835 -22.596 592 H SER 72 H SER 72 13.854 6.168 -20.436 593 HA SER 72 HA SER 72 14.280 3.357 -20.644 594 1HB SER 72 HB2 SER 72 14.916 2.908 -18.224 595 2HB SER 72 HB3 SER 72 16.194 3.571 -19.232 596 HG SER 72 HG SER 72 16.101 4.625 -17.216 597 H ALA 73 H ALA 73 12.078 4.709 -21.171 598 HA ALA 73 HA ALA 73 10.273 3.387 -19.231 599 1HB ALA 73 HB1 ALA 73 8.675 5.271 -19.289 600 2HB ALA 73 HB2 ALA 73 10.230 5.797 -18.621 601 3HB ALA 73 HB3 ALA 73 9.800 6.215 -20.295 602 H ALA 74 H ALA 74 8.164 2.965 -20.174 603 HA ALA 74 HA ALA 74 6.972 1.749 -21.592 604 1HB ALA 74 HB1 ALA 74 8.098 3.728 -23.599 605 2HB ALA 74 HB2 ALA 74 7.018 2.430 -24.080 606 3HB ALA 74 HB3 ALA 74 6.475 3.614 -22.882 607 H THR 75 H THR 75 10.150 2.058 -23.361 608 HA THR 75 HA THR 75 9.923 -0.729 -24.175 609 HB THR 75 H5T THR 75 12.298 1.186 -24.341 610 HG1 THR 75 HG1 THR 75 10.292 0.544 -26.239 611 1HG2 THR 75 1HG2 THR 75 11.652 -1.351 -25.913 612 2HG2 THR 75 2HG2 THR 75 12.925 -0.182 -26.336 613 3HG2 THR 75 3HG2 THR 75 13.036 -1.097 -24.827 614 H CYS 76 H CYS 76 11.579 0.949 -21.487 615 HA CYS 76 HA CYS 76 12.800 -1.585 -20.545 616 1HB CYS 76 HB2 CYS 76 12.576 1.173 -19.268 617 2HB CYS 76 HB3 CYS 76 13.405 -0.217 -18.550 618 HG CYS 76 HG CYS 76 15.079 -0.650 -20.518 619 H THR 77 H THR 77 9.799 0.256 -20.067 620 HA THR 77 HA THR 77 8.855 -1.013 -17.702 621 HB THR 77 H5T THR 77 7.137 -0.201 -20.070 622 HG1 THR 77 HG1 THR 77 8.035 1.419 -17.929 623 1HG2 THR 77 1HG2 THR 77 6.602 -0.146 -17.073 624 2HG2 THR 77 2HG2 THR 77 5.515 0.452 -18.351 625 3HG2 THR 77 3HG2 THR 77 5.885 -1.276 -18.244 626 H ARG 78 H ARG 78 8.834 -2.158 -21.106 627 HA ARG 78 HA ARG 78 7.299 -4.479 -20.830 628 1HB ARG 78 HB2 ARG 78 8.171 -3.758 -22.998 629 2HB ARG 78 HB3 ARG 78 9.818 -3.824 -22.419 630 1HG ARG 78 HG2 ARG 78 9.364 -5.654 -23.953 631 2HG ARG 78 HG3 ARG 78 9.851 -6.220 -22.366 632 1HD ARG 78 HD2 ARG 78 7.343 -6.583 -21.874 633 2HD ARG 78 HD3 ARG 78 7.077 -6.273 -23.591 634 HE ARG 78 H3T ARG 78 8.887 -8.449 -22.533 635 1HH1 ARG 78 2HH2 ARG 78 6.342 -7.629 -24.800 636 2HH1 ARG 78 1HH2 ARG 78 6.438 -9.178 -25.585 637 1HH2 ARG 78 1HH1 ARG 78 8.973 -10.258 -23.451 638 2HH2 ARG 78 2HH1 ARG 78 7.949 -10.698 -24.823 639 H ARG 79 H ARG 79 10.692 -3.950 -19.761 640 HA ARG 79 HA ARG 79 11.074 -6.770 -19.560 641 1HB ARG 79 HB2 ARG 79 12.767 -4.493 -18.399 642 2HB ARG 79 HB3 ARG 79 13.309 -6.159 -18.615 643 1HG ARG 79 HG2 ARG 79 13.163 -5.927 -21.065 644 2HG ARG 79 HG3 ARG 79 12.522 -4.281 -20.896 645 1HD ARG 79 HD2 ARG 79 14.599 -3.620 -19.685 646 2HD ARG 79 HD3 ARG 79 15.275 -5.228 -20.023 647 HE ARG 79 H3T ARG 79 14.461 -4.243 -22.504 648 1HH1 ARG 79 2HH2 ARG 79 16.769 -3.157 -20.100 649 2HH1 ARG 79 1HH2 ARG 79 17.735 -2.315 -21.279 650 1HH2 ARG 79 1HH1 ARG 79 15.758 -3.173 -23.956 651 2HH2 ARG 79 2HH1 ARG 79 17.176 -2.334 -23.403 652 H HIS 80 H HIS 80 10.314 -4.170 -17.326 653 HA HIS 80 HA HIS 80 10.283 -5.726 -14.893 654 1HB HIS 80 HB2 HIS 80 8.418 -3.407 -15.451 655 2HB HIS 80 HB3 HIS 80 9.123 -3.916 -13.924 656 HD1 HIS 80 HD1 HIS 80 9.278 -0.922 -15.218 657 HD2 HIS 80 HD2 HIS 80 12.271 -3.874 -15.223 658 HE1 HIS 80 HE1 HIS 80 11.489 0.297 -15.593 659 H TYR 81 H TYR 81 7.758 -4.899 -17.352 660 HA TYR 81 HA TYR 81 5.635 -6.036 -16.024 661 1HB TYR 81 HB2 TYR 81 5.672 -4.534 -18.079 662 2HB TYR 81 HB3 TYR 81 5.838 -5.993 -19.040 663 HD1 TYR 81 HD1 TYR 81 3.574 -3.660 -17.673 664 HD2 TYR 81 HD2 TYR 81 3.934 -7.871 -18.545 665 HE1 TYR 81 HE1 TYR 81 1.093 -3.880 -17.675 666 HE2 TYR 81 HE2 TYR 81 1.473 -8.103 -18.442 667 HH TYR 81 HH TYR 81 -0.535 -7.032 -18.170 668 H GLU 82 H GLU 82 7.848 -7.748 -18.303 669 HA GLU 82 HA GLU 82 6.099 -10.054 -18.443 670 1HB GLU 82 HB2 GLU 82 7.751 -11.061 -19.827 671 2HB GLU 82 HB3 GLU 82 7.429 -9.415 -20.356 672 1HG GLU 82 HG2 GLU 82 9.550 -8.631 -19.581 673 2HG GLU 82 HG3 GLU 82 9.831 -10.078 -18.622 674 H ARG 83 H ARG 83 8.194 -9.026 -15.981 675 HA ARG 83 HA ARG 83 8.117 -11.784 -14.938 676 1HB ARG 83 HB2 ARG 83 10.452 -10.641 -15.754 677 2HB ARG 83 HB3 ARG 83 10.404 -10.031 -14.110 678 1HG ARG 83 HG2 ARG 83 11.645 -12.042 -13.978 679 2HG ARG 83 HG3 ARG 83 10.059 -12.480 -13.357 680 1HD ARG 83 HD2 ARG 83 10.731 -14.249 -14.791 681 2HD ARG 83 HD3 ARG 83 9.491 -13.377 -15.680 682 HE ARG 83 H3T ARG 83 12.462 -13.191 -16.130 683 1HH1 ARG 83 2HH2 ARG 83 9.232 -12.786 -17.588 684 2HH1 ARG 83 1HH2 ARG 83 10.005 -12.454 -19.136 685 1HH2 ARG 83 2HH1 ARG 83 13.176 -12.660 -18.207 686 2HH2 ARG 83 1HH1 ARG 83 11.956 -12.307 -19.427 687 H LEU 84 H LEU 84 6.870 -8.779 -14.337 688 HA LEU 84 HA LEU 84 6.632 -9.363 -11.411 689 1HB LEU 84 HB2 LEU 84 8.495 -7.736 -12.096 690 2HB LEU 84 HB3 LEU 84 7.212 -6.643 -12.612 691 HG LEU 84 HG LEU 84 6.423 -6.413 -10.314 692 1HD1 LEU 84 1HD1 LEU 84 6.923 -8.636 -9.364 693 2HD1 LEU 84 2HD1 LEU 84 8.668 -8.327 -9.549 694 3HD1 LEU 84 3HD1 LEU 84 7.695 -7.366 -8.417 695 1HD2 LEU 84 1HD2 LEU 84 9.450 -6.187 -10.431 696 2HD2 LEU 84 2HD2 LEU 84 8.337 -5.060 -11.243 697 3HD2 LEU 84 3HD2 LEU 84 8.326 -5.190 -9.486 698 H ILE 85 H ILE 85 4.867 -9.215 -14.072 699 HA ILE 85 HA ILE 85 2.483 -8.825 -12.510 700 HB ILE 85 H5T ILE 85 2.580 -6.580 -12.822 701 1HG1 ILE 85 2HG1 ILE 85 1.140 -7.346 -15.416 702 2HG1 ILE 85 3HG1 ILE 85 0.441 -7.580 -13.822 703 1HG2 ILE 85 1HG2 ILE 85 3.591 -6.897 -15.642 704 2HG2 ILE 85 2HG2 ILE 85 3.255 -5.341 -14.864 705 3HG2 ILE 85 3HG2 ILE 85 4.529 -6.346 -14.225 706 1HD1 ILE 85 1HD1 ILE 85 0.709 -5.088 -13.421 707 2HD1 ILE 85 2HD1 ILE 85 1.122 -4.932 -15.143 708 3HD1 ILE 85 3HD1 ILE 85 -0.442 -5.593 -14.674 709 H LEU 86 H LEU 86 3.865 -9.436 -15.755 710 HA LEU 86 HA LEU 86 1.732 -10.907 -16.820 711 1HB LEU 86 HB2 LEU 86 3.820 -10.317 -17.942 712 2HB LEU 86 HB3 LEU 86 4.727 -11.446 -16.954 713 HG LEU 86 HG LEU 86 4.251 -12.093 -19.329 714 1HD1 LEU 86 1HD1 LEU 86 4.899 -13.764 -17.609 715 2HD1 LEU 86 2HD1 LEU 86 3.177 -14.142 -17.363 716 3HD1 LEU 86 3HD1 LEU 86 3.930 -14.420 -18.936 717 1HD2 LEU 86 1HD2 LEU 86 1.892 -11.321 -19.430 718 2HD2 LEU 86 2HD2 LEU 86 2.113 -12.989 -19.982 719 3HD2 LEU 86 3HD2 LEU 86 1.421 -12.679 -18.380 720 HA PRO 87 HA PRO 87 2.750 -14.655 -13.984 721 1HB PRO 87 HB2 PRO 87 3.961 -14.142 -11.535 722 2HB PRO 87 HB3 PRO 87 4.783 -14.744 -13.004 723 1HG PRO 87 HG2 PRO 87 4.554 -11.877 -12.038 724 2HG PRO 87 HG3 PRO 87 6.023 -12.755 -12.585 725 1HD PRO 87 HD2 PRO 87 4.756 -11.150 -14.281 726 2HD PRO 87 HD3 PRO 87 5.285 -12.744 -14.851 727 H TYR 88 H TYR 88 1.634 -11.464 -12.783 728 HA TYR 88 HA TYR 88 -0.106 -12.857 -10.823 729 1HB TYR 88 HB2 TYR 88 -0.390 -11.005 -9.669 730 2HB TYR 88 HB3 TYR 88 1.177 -10.669 -10.322 731 HD1 TYR 88 HD1 TYR 88 1.448 -8.380 -10.630 732 HD2 TYR 88 HD2 TYR 88 -2.461 -10.056 -11.362 733 HE1 TYR 88 HE1 TYR 88 0.570 -6.135 -11.259 734 HE2 TYR 88 HE2 TYR 88 -3.287 -7.847 -12.073 735 HH TYR 88 HH TYR 88 -2.802 -5.627 -12.303 736 H GLU 89 H GLU 89 -0.527 -10.925 -13.846 737 HA GLU 89 HA GLU 89 -3.309 -11.018 -13.783 738 1HB GLU 89 HB2 GLU 89 -3.318 -10.503 -16.118 739 2HB GLU 89 HB3 GLU 89 -1.972 -9.684 -15.348 740 1HG GLU 89 HG2 GLU 89 -0.795 -10.414 -17.121 741 2HG GLU 89 HG3 GLU 89 -0.669 -11.908 -16.210 742 H ARG 90 H ARG 90 -1.239 -13.714 -14.181 743 HA ARG 90 HA ARG 90 -2.927 -15.579 -15.533 744 1HB ARG 90 HB2 ARG 90 -1.132 -16.168 -13.144 745 2HB ARG 90 HB3 ARG 90 -1.707 -17.295 -14.365 746 1HG ARG 90 HG2 ARG 90 0.379 -15.128 -14.643 747 2HG ARG 90 HG3 ARG 90 0.582 -16.859 -14.847 748 1HD ARG 90 HD2 ARG 90 -0.868 -14.942 -16.699 749 2HD ARG 90 HD3 ARG 90 0.660 -15.752 -17.008 750 HE ARG 90 H3T ARG 90 -0.672 -17.931 -16.850 751 1HH1 ARG 90 2HH1 ARG 90 -2.295 -14.992 -18.046 752 2HH1 ARG 90 1HH1 ARG 90 -3.360 -15.956 -19.034 753 1HH2 ARG 90 2HH2 ARG 90 -2.113 -19.003 -18.111 754 2HH2 ARG 90 1HH2 ARG 90 -3.302 -18.134 -19.033 755 H PHE 91 H PHE 91 -3.129 -14.389 -12.119 756 HA PHE 91 HA PHE 91 -5.101 -16.427 -11.528 757 1HB PHE 91 HB2 PHE 91 -5.568 -15.243 -9.462 758 2HB PHE 91 HB3 PHE 91 -3.868 -15.546 -9.713 759 HD1 PHE 91 HD1 PHE 91 -6.360 -12.756 -10.377 760 HD2 PHE 91 HD2 PHE 91 -2.492 -13.884 -8.844 761 HE1 PHE 91 HE1 PHE 91 -5.862 -10.379 -9.879 762 HE2 PHE 91 HE2 PHE 91 -2.048 -11.518 -8.256 763 HZ PHE 91 HZ PHE 91 -3.685 -9.754 -8.876 764 H ILE 92 H ILE 92 -5.536 -13.317 -13.192 765 HA ILE 92 HA ILE 92 -8.477 -13.688 -12.941 766 HB ILE 92 H5T ILE 92 -8.594 -11.652 -14.364 767 1HG1 ILE 92 2HG1 ILE 92 -5.658 -11.265 -13.726 768 2HG1 ILE 92 3HG1 ILE 92 -6.299 -11.723 -15.313 769 1HG2 ILE 92 1HG2 ILE 92 -7.161 -11.162 -11.751 770 2HG2 ILE 92 2HG2 ILE 92 -8.392 -10.155 -12.524 771 3HG2 ILE 92 3HG2 ILE 92 -8.846 -11.723 -11.853 772 1HD1 ILE 92 1HD1 ILE 92 -6.810 -9.104 -13.859 773 2HD1 ILE 92 2HD1 ILE 92 -5.834 -9.365 -15.313 774 3HD1 ILE 92 3HD1 ILE 92 -7.594 -9.593 -15.384 775 H LYS 93 H LYS 93 -6.130 -15.041 -14.843 776 HA LYS 93 HA LYS 93 -8.146 -15.491 -17.005 777 1HB LYS 93 HB2 LYS 93 -5.263 -14.541 -17.157 778 2HB LYS 93 HB3 LYS 93 -6.128 -15.227 -18.528 779 1HG LYS 93 HG2 LYS 93 -7.752 -13.483 -18.588 780 2HG LYS 93 HG3 LYS 93 -7.229 -12.836 -17.038 781 1HD LYS 93 HD2 LYS 93 -6.419 -11.397 -18.756 782 2HD LYS 93 HD3 LYS 93 -5.053 -12.202 -17.974 783 1HE LYS 93 HE2 LYS 93 -4.928 -13.816 -19.865 784 2HE LYS 93 HE3 LYS 93 -6.314 -13.027 -20.635 785 1HZ LYS 93 HZ1 LYS 93 -3.700 -11.739 -20.048 786 2HZ LYS 93 HZ2 LYS 93 -4.226 -12.216 -21.550 787 3HZ LYS 93 HZ3 LYS 93 -4.973 -10.995 -20.764 788 H GLY 94 H GLY 94 -6.143 -17.250 -14.886 789 1HA GLY 94 HA2 GLY 94 -7.187 -19.649 -16.089 790 2HA GLY 94 HA3 GLY 94 -5.493 -19.441 -16.532 791 H GLU 95 H GLU 95 -5.468 -18.152 -13.521 792 HA GLU 95 HA GLU 95 -4.977 -20.820 -12.245 793 1HB GLU 95 HB2 GLU 95 -3.135 -18.395 -12.284 794 2HB GLU 95 HB3 GLU 95 -2.890 -19.833 -11.283 795 1HG GLU 95 HG2 GLU 95 -2.914 -21.241 -13.378 796 2HG GLU 95 HG3 GLU 95 -2.948 -19.750 -14.324 797 H GLU 96 H GLU 96 -7.104 -18.818 -11.919 798 HA GLU 96 HA GLU 96 -7.698 -19.553 -9.264 799 1HB GLU 96 HB2 GLU 96 -6.156 -17.500 -8.828 800 2HB GLU 96 HB3 GLU 96 -7.502 -16.526 -9.431 801 1HG GLU 96 HG2 GLU 96 -8.968 -17.440 -7.687 802 2HG GLU 96 HG3 GLU 96 -7.684 -18.528 -7.151 803 H ASP 97 H ASP 97 -8.467 -17.376 -11.993 804 HA ASP 97 HA ASP 97 -11.163 -16.864 -11.463 805 1HB ASP 97 HB2 ASP 97 -9.792 -15.820 -13.211 806 2HB ASP 97 HB3 ASP 97 -9.739 -17.335 -14.110 807 H LYS 98 H LYS 98 -9.836 -19.992 -12.450 808 HA LYS 98 HA LYS 98 -12.585 -21.055 -12.604 809 1HB LYS 98 HB2 LYS 98 -10.400 -21.590 -14.659 810 2HB LYS 98 HB3 LYS 98 -11.940 -22.457 -14.571 811 1HG LYS 98 HG2 LYS 98 -13.159 -20.320 -14.956 812 2HG LYS 98 HG3 LYS 98 -11.600 -19.480 -15.090 813 1HD LYS 98 HD2 LYS 98 -10.993 -20.851 -17.051 814 2HD LYS 98 HD3 LYS 98 -12.518 -21.737 -16.905 815 1HE LYS 98 HE2 LYS 98 -12.794 -20.096 -18.635 816 2HE LYS 98 HE3 LYS 98 -13.786 -19.621 -17.254 817 1HZ LYS 98 HZ1 LYS 98 -11.120 -18.466 -17.896 818 2HZ LYS 98 HZ2 LYS 98 -12.551 -17.742 -18.196 819 3HZ LYS 98 HZ3 LYS 98 -12.080 -17.979 -16.656 820 HA PRO 99 HA PRO 99 -10.615 -24.273 -10.135 821 1HB PRO 99 HB2 PRO 99 -12.720 -25.904 -9.673 822 2HB PRO 99 HB3 PRO 99 -12.698 -24.225 -9.071 823 1HG PRO 99 HG2 PRO 99 -14.009 -25.243 -11.619 824 2HG PRO 99 HG3 PRO 99 -14.747 -24.255 -10.318 825 1HD PRO 99 HD2 PRO 99 -13.678 -23.153 -12.594 826 2HD PRO 99 HD3 PRO 99 -13.621 -22.324 -11.010 827 H LEU 100 H LEU 100 -9.478 -24.486 -12.492 828 HA LEU 100 HA LEU 100 -10.356 -26.506 -14.261 829 1HB LEU 100 HB2 LEU 100 -7.536 -25.466 -13.786 830 2HB LEU 100 HB3 LEU 100 -8.056 -26.388 -15.191 831 HG LEU 100 HG LEU 100 -9.003 -23.594 -14.431 832 1HD1 LEU 100 1HD1 LEU 100 -7.810 -22.911 -16.457 833 2HD1 LEU 100 2HD1 LEU 100 -6.708 -23.718 -15.332 834 3HD1 LEU 100 3HD1 LEU 100 -7.311 -24.593 -16.757 835 1HD2 LEU 100 1HD2 LEU 100 -10.116 -23.593 -16.665 836 2HD2 LEU 100 2HD2 LEU 100 -9.756 -25.326 -16.826 837 3HD2 LEU 100 3HD2 LEU 100 -10.854 -24.746 -15.551 838 HA PRO 101 HA PRO 101 -9.169 -30.424 -12.494 839 1HB PRO 101 HB2 PRO 101 -8.102 -31.090 -15.236 840 2HB PRO 101 HB3 PRO 101 -9.189 -32.051 -14.190 841 1HG PRO 101 HG2 PRO 101 -10.180 -30.659 -16.291 842 2HG PRO 101 HG3 PRO 101 -11.050 -30.668 -14.722 843 1HD PRO 101 HD2 PRO 101 -9.222 -28.532 -15.844 844 2HD PRO 101 HD3 PRO 101 -10.808 -28.369 -15.029 845 HA PRO 102 HA PRO 102 -4.815 -30.523 -11.477 846 1HB PRO 102 HB2 PRO 102 -4.859 -33.482 -12.075 847 2HB PRO 102 HB3 PRO 102 -4.216 -32.634 -10.636 848 1HG PRO 102 HG2 PRO 102 -6.615 -33.878 -10.526 849 2HG PRO 102 HG3 PRO 102 -6.424 -32.248 -9.799 850 1HD PRO 102 HD2 PRO 102 -7.604 -32.980 -12.489 851 2HD PRO 102 HD3 PRO 102 -8.216 -31.843 -11.250 852 H ILE 103 H ILE 103 -5.718 -31.757 -14.651 853 HA ILE 103 HA ILE 103 -4.554 -32.448 -16.466 854 HB ILE 103 H5T ILE 103 -2.531 -30.277 -15.931 855 1HG1 ILE 103 2HG1 ILE 103 -4.610 -29.173 -15.415 856 2HG1 ILE 103 3HG1 ILE 103 -3.997 -28.617 -16.946 857 1HG2 ILE 103 1HG2 ILE 103 -2.164 -31.596 -17.970 858 2HG2 ILE 103 2HG2 ILE 103 -3.842 -31.354 -18.475 859 3HG2 ILE 103 3HG2 ILE 103 -2.716 -29.983 -18.408 860 1HD1 ILE 103 1HD1 ILE 103 -6.458 -28.915 -16.950 861 2HD1 ILE 103 2HD1 ILE 103 -5.671 -29.919 -18.177 862 3HD1 ILE 103 3HD1 ILE 103 -6.255 -30.652 -16.668 863 H LYS 104 H LYS 104 -4.107 -34.244 -14.622 864 HA LYS 104 HA LYS 104 -1.294 -35.123 -14.971 865 1HB LYS 104 HB2 LYS 104 -2.577 -34.419 -12.293 866 2HB LYS 104 HB3 LYS 104 -1.334 -35.655 -12.390 867 1HG LYS 104 HG2 LYS 104 0.260 -34.051 -13.368 868 2HG LYS 104 HG3 LYS 104 -0.960 -32.770 -13.272 869 1HD LYS 104 HD2 LYS 104 -1.074 -33.050 -10.810 870 2HD LYS 104 HD3 LYS 104 0.181 -34.308 -10.903 871 1HE LYS 104 HE2 LYS 104 1.742 -32.662 -11.925 872 2HE LYS 104 HE3 LYS 104 0.492 -31.415 -11.832 873 1HZ LYS 104 HZ1 LYS 104 2.023 -31.275 -9.952 874 2HZ LYS 104 HZ2 LYS 104 0.532 -31.648 -9.404 875 3HZ LYS 104 HZ3 LYS 104 1.687 -32.803 -9.490 876 HA PRO 105 HA PRO 105 -3.317 -39.144 -14.909 877 1HB PRO 105 HB2 PRO 105 -1.371 -40.804 -13.915 878 2HB PRO 105 HB3 PRO 105 -1.312 -40.085 -15.553 879 1HG PRO 105 HG2 PRO 105 0.041 -39.080 -13.030 880 2HG PRO 105 HG3 PRO 105 0.768 -39.330 -14.650 881 1HD PRO 105 HD2 PRO 105 -0.077 -36.886 -13.830 882 2HD PRO 105 HD3 PRO 105 -0.299 -37.410 -15.524 883 H ARG 106 H ARG 106 -4.026 -40.864 -13.421 884 HA ARG 106 HA ARG 106 -4.065 -40.232 -10.517 885 1HB ARG 106 HB2 ARG 106 -5.972 -39.042 -11.965 886 2HB ARG 106 HB3 ARG 106 -6.672 -40.652 -12.001 887 1HG ARG 106 HG2 ARG 106 -6.316 -40.452 -9.315 888 2HG ARG 106 HG3 ARG 106 -6.255 -38.736 -9.697 889 1HD ARG 106 HD2 ARG 106 -8.522 -39.275 -9.134 890 2HD ARG 106 HD3 ARG 106 -8.481 -39.013 -10.889 891 HE ARG 106 H3T ARG 106 -8.051 -41.815 -10.240 892 1HH1 ARG 106 2HH2 ARG 106 -10.739 -39.556 -10.448 893 2HH1 ARG 106 1HH2 ARG 106 -11.868 -40.853 -10.747 894 1HH2 ARG 106 2HH1 ARG 106 -9.398 -43.287 -10.590 895 2HH2 ARG 106 1HH1 ARG 106 -11.126 -42.992 -10.828 896 H LYS 107 H LYS 107 -5.060 -41.953 -9.216 897 HA LYS 107 HA LYS 107 -4.535 -44.644 -10.111 898 1HB LYS 107 HB2 LYS 107 -6.094 -43.573 -7.722 899 2HB LYS 107 HB3 LYS 107 -5.720 -45.277 -8.004 900 1HG LYS 107 HG2 LYS 107 -3.282 -44.764 -7.954 901 2HG LYS 107 HG3 LYS 107 -3.647 -43.059 -7.667 902 1HD LYS 107 HD2 LYS 107 -3.053 -44.059 -5.575 903 2HD LYS 107 HD3 LYS 107 -4.778 -43.664 -5.530 904 1HE LYS 107 HE2 LYS 107 -5.337 -46.034 -6.015 905 2HE LYS 107 HE3 LYS 107 -3.617 -46.425 -6.133 906 1HZ LYS 107 HZ1 LYS 107 -4.506 -46.979 -3.943 907 2HZ LYS 107 HZ2 LYS 107 -3.384 -45.806 -3.787 908 3HZ LYS 107 HZ3 LYS 107 -4.974 -45.439 -3.678 Start of MODEL 7 1 1H ARG 1 H1 ARG 1 -7.749 0.534 -7.771 2 2H ARG 1 H2 ARG 1 -8.323 -0.039 -6.348 3 3H ARG 1 H3 ARG 1 -7.364 -0.978 -7.310 4 HA ARG 1 HA ARG 1 -5.514 0.499 -7.052 5 1HB ARG 1 HB2 ARG 1 -7.222 2.434 -6.423 6 2HB ARG 1 HB3 ARG 1 -6.967 1.893 -4.779 7 1HG ARG 1 HG2 ARG 1 -4.949 3.044 -6.728 8 2HG ARG 1 HG3 ARG 1 -5.561 3.773 -5.251 9 1HD ARG 1 HD2 ARG 1 -4.376 1.984 -3.939 10 2HD ARG 1 HD3 ARG 1 -3.687 1.391 -5.473 11 HE ARG 1 H3T ARG 1 -3.199 4.216 -5.107 12 1HH1 ARG 1 2HH2 ARG 1 -2.013 1.090 -4.194 13 2HH1 ARG 1 1HH2 ARG 1 -0.417 1.651 -3.783 14 1HH2 ARG 1 2HH1 ARG 1 -1.138 4.941 -4.598 15 2HH2 ARG 1 1HH1 ARG 1 0.061 3.803 -4.054 16 H ALA 2 H ALA 2 -7.496 -0.367 -4.156 17 HA ALA 2 HA ALA 2 -5.110 -1.087 -2.694 18 1HB ALA 2 HB1 ALA 2 -7.150 -0.172 -1.634 19 2HB ALA 2 HB2 ALA 2 -8.058 -1.627 -2.112 20 3HB ALA 2 HB3 ALA 2 -6.719 -1.750 -0.950 21 H ASP 3 H ASP 3 -7.369 -2.992 -4.671 22 HA ASP 3 HA ASP 3 -6.482 -5.571 -3.749 23 1HB ASP 3 HB2 ASP 3 -8.598 -5.114 -4.987 24 2HB ASP 3 HB3 ASP 3 -7.656 -4.758 -6.437 25 H GLU 4 H GLU 4 -5.447 -3.504 -6.522 26 HA GLU 4 HA GLU 4 -3.352 -5.149 -7.524 27 1HB GLU 4 HB2 GLU 4 -3.412 -2.127 -7.491 28 2HB GLU 4 HB3 GLU 4 -2.468 -3.189 -8.527 29 1HG GLU 4 HG2 GLU 4 -4.122 -2.742 -10.002 30 2HG GLU 4 HG3 GLU 4 -4.899 -4.112 -9.220 31 H GLN 5 H GLN 5 -3.372 -2.560 -5.066 32 HA GLN 5 HA GLN 5 -0.659 -2.701 -4.522 33 1HB GLN 5 HB2 GLN 5 -2.135 -0.838 -3.829 34 2HB GLN 5 HB3 GLN 5 -2.923 -1.886 -2.649 35 1HG GLN 5 HG2 GLN 5 -1.331 -0.411 -1.543 36 2HG GLN 5 HG3 GLN 5 -0.823 -2.084 -1.367 37 1HE2 GLN 5 2HE2 GLN 5 1.033 -2.831 -2.694 38 2HE2 GLN 5 1HE2 GLN 5 2.180 -1.622 -3.280 39 H ALA 6 H ALA 6 -3.362 -4.508 -3.064 40 HA ALA 6 HA ALA 6 -1.788 -5.892 -1.073 41 1HB ALA 6 HB1 ALA 6 -3.756 -7.379 -0.929 42 2HB ALA 6 HB2 ALA 6 -4.233 -5.670 -0.930 43 3HB ALA 6 HB3 ALA 6 -4.432 -6.648 -2.401 44 H PHE 7 H PHE 7 -2.794 -6.803 -4.436 45 HA PHE 7 HA PHE 7 -1.308 -9.276 -4.261 46 1HB PHE 7 HB2 PHE 7 -2.144 -9.862 -6.299 47 2HB PHE 7 HB3 PHE 7 -3.412 -9.000 -5.465 48 HD1 PHE 7 HD1 PHE 7 -4.859 -8.039 -6.948 49 HD2 PHE 7 HD2 PHE 7 -0.662 -8.015 -7.920 50 HE1 PHE 7 HE1 PHE 7 -5.360 -6.924 -9.098 51 HE2 PHE 7 HE2 PHE 7 -1.164 -6.858 -10.040 52 HZ PHE 7 HZ PHE 7 -3.512 -6.320 -10.655 53 H LEU 8 H LEU 8 -0.070 -6.178 -4.552 54 HA LEU 8 HA LEU 8 2.237 -7.264 -6.121 55 1HB LEU 8 HB2 LEU 8 1.006 -4.629 -6.322 56 2HB LEU 8 HB3 LEU 8 2.661 -4.501 -5.786 57 HG LEU 8 HG LEU 8 2.379 -4.392 -8.232 58 1HD1 LEU 8 1HD1 LEU 8 4.518 -5.065 -7.253 59 2HD1 LEU 8 2HD1 LEU 8 4.037 -6.772 -7.333 60 3HD1 LEU 8 3HD1 LEU 8 4.228 -5.836 -8.821 61 1HD2 LEU 8 1HD2 LEU 8 1.941 -6.374 -9.573 62 2HD2 LEU 8 2HD2 LEU 8 1.658 -7.357 -8.149 63 3HD2 LEU 8 3HD2 LEU 8 0.552 -6.007 -8.532 64 H VAL 9 H VAL 9 1.101 -6.116 -2.981 65 HA VAL 9 HA VAL 9 3.781 -6.238 -1.794 66 HB VAL 9 H5T VAL 9 0.983 -6.390 -0.630 67 1HG1 VAL 9 1HG1 VAL 9 2.056 -6.230 1.618 68 2HG1 VAL 9 2HG1 VAL 9 2.348 -7.789 0.841 69 3HG1 VAL 9 3HG1 VAL 9 3.636 -6.560 0.866 70 1HG2 VAL 9 1HG2 VAL 9 3.242 -4.362 -0.280 71 2HG2 VAL 9 2HG2 VAL 9 1.886 -4.161 -1.393 72 3HG2 VAL 9 3HG2 VAL 9 1.584 -4.228 0.346 73 H ALA 10 H ALA 10 1.057 -8.524 -2.238 74 HA ALA 10 HA ALA 10 2.338 -10.822 -1.236 75 1HB ALA 10 HB1 ALA 10 -0.064 -10.645 -1.818 76 2HB ALA 10 HB2 ALA 10 0.363 -10.634 -3.545 77 3HB ALA 10 HB3 ALA 10 0.703 -12.068 -2.546 78 H LEU 11 H LEU 11 2.342 -9.739 -4.752 79 HA LEU 11 HA LEU 11 4.301 -11.676 -5.455 80 1HB LEU 11 HB2 LEU 11 2.941 -10.503 -7.120 81 2HB LEU 11 HB3 LEU 11 3.794 -9.000 -6.764 82 HG LEU 11 HG LEU 11 5.932 -9.992 -7.571 83 1HD1 LEU 11 1HD1 LEU 11 5.599 -12.388 -7.110 84 2HD1 LEU 11 2HD1 LEU 11 4.279 -12.442 -8.299 85 3HD1 LEU 11 3HD1 LEU 11 5.942 -12.109 -8.819 86 1HD2 LEU 11 1HD2 LEU 11 4.412 -8.813 -9.097 87 2HD2 LEU 11 2HD2 LEU 11 5.325 -10.075 -9.941 88 3HD2 LEU 11 3HD2 LEU 11 3.616 -10.346 -9.520 89 H TYR 12 H TYR 12 4.858 -8.336 -4.169 90 HA TYR 12 HA TYR 12 7.684 -8.323 -4.363 91 1HB TYR 12 HB2 TYR 12 6.713 -6.308 -3.707 92 2HB TYR 12 HB3 TYR 12 5.679 -7.070 -2.522 93 HD1 TYR 12 HD1 TYR 12 6.099 -6.651 -0.293 94 HD2 TYR 12 HD2 TYR 12 9.390 -6.722 -3.071 95 HE1 TYR 12 HE1 TYR 12 7.659 -5.979 1.530 96 HE2 TYR 12 HE2 TYR 12 10.943 -6.011 -1.260 97 HH TYR 12 HH TYR 12 11.135 -5.342 0.925 98 H LYS 13 H LYS 13 5.640 -9.735 -1.749 99 HA LYS 13 HA LYS 13 7.857 -10.739 -0.217 100 1HB LYS 13 HB2 LYS 13 4.931 -11.580 -0.397 101 2HB LYS 13 HB3 LYS 13 6.083 -12.337 0.707 102 1HG LYS 13 HG2 LYS 13 6.524 -10.223 1.831 103 2HG LYS 13 HG3 LYS 13 5.508 -9.342 0.684 104 1HD LYS 13 HD2 LYS 13 3.520 -10.618 1.432 105 2HD LYS 13 HD3 LYS 13 4.535 -11.518 2.583 106 1HE LYS 13 HE2 LYS 13 5.144 -9.381 3.703 107 2HE LYS 13 HE3 LYS 13 4.117 -8.491 2.570 108 1HZ LYS 13 HZ1 LYS 13 2.203 -9.743 3.443 109 2HZ LYS 13 HZ2 LYS 13 3.160 -10.546 4.499 110 3HZ LYS 13 HZ3 LYS 13 2.950 -8.936 4.651 111 H TYR 14 H TYR 14 5.916 -12.501 -2.794 112 HA TYR 14 HA TYR 14 7.635 -14.789 -2.601 113 1HB TYR 14 HB2 TYR 14 5.897 -13.780 -4.881 114 2HB TYR 14 HB3 TYR 14 6.655 -15.367 -4.823 115 HD1 TYR 14 HD1 TYR 14 3.852 -15.145 -5.350 116 HD2 TYR 14 HD2 TYR 14 5.853 -15.361 -1.526 117 HE1 TYR 14 HE1 TYR 14 1.823 -16.167 -4.331 118 HE2 TYR 14 HE2 TYR 14 3.830 -16.358 -0.524 119 HH TYR 14 HH TYR 14 1.681 -17.088 -0.869 120 H MET 15 H MET 15 7.924 -11.829 -4.503 121 HA MET 15 HA MET 15 10.086 -12.600 -6.182 122 1HB MET 15 HB2 MET 15 8.721 -10.739 -6.689 123 2HB MET 15 HB3 MET 15 9.079 -9.936 -5.151 124 1HG MET 15 HG2 MET 15 11.255 -9.499 -5.695 125 2HG MET 15 HG3 MET 15 11.285 -10.659 -7.030 126 1HE MET 15 HE1 MET 15 10.549 -10.265 -9.413 127 2HE MET 15 HE2 MET 15 8.858 -10.109 -8.889 128 3HE MET 15 HE3 MET 15 9.556 -8.899 -9.981 129 H LYS 16 H LYS 16 10.118 -10.863 -2.961 130 HA LYS 16 HA LYS 16 12.919 -11.019 -2.512 131 1HB LYS 16 HB2 LYS 16 11.235 -9.735 -1.193 132 2HB LYS 16 HB3 LYS 16 10.618 -11.244 -0.521 133 1HG LYS 16 HG2 LYS 16 12.930 -11.675 0.447 134 2HG LYS 16 HG3 LYS 16 13.399 -10.063 -0.104 135 1HD LYS 16 HD2 LYS 16 11.175 -10.732 1.879 136 2HD LYS 16 HD3 LYS 16 12.779 -10.108 2.283 137 1HE LYS 16 HE2 LYS 16 12.290 -8.037 0.967 138 2HE LYS 16 HE3 LYS 16 10.665 -8.650 0.631 139 1HZ LYS 16 HZ1 LYS 16 11.735 -8.048 3.337 140 2HZ LYS 16 HZ2 LYS 16 10.643 -7.148 2.517 141 3HZ LYS 16 HZ3 LYS 16 10.242 -8.649 3.035 142 H GLU 17 H GLU 17 10.367 -13.454 -1.859 143 HA GLU 17 HA GLU 17 12.075 -15.341 -0.589 144 1HB GLU 17 HB2 GLU 17 9.574 -15.341 -0.553 145 2HB GLU 17 HB3 GLU 17 9.583 -15.971 -2.206 146 1HG GLU 17 HG2 GLU 17 10.806 -17.979 -1.454 147 2HG GLU 17 HG3 GLU 17 10.894 -17.329 0.182 148 H ARG 18 H ARG 18 11.248 -15.016 -4.079 149 HA ARG 18 HA ARG 18 12.997 -17.086 -5.022 150 1HB ARG 18 HB2 ARG 18 11.921 -14.531 -6.271 151 2HB ARG 18 HB3 ARG 18 12.809 -15.742 -7.192 152 1HG ARG 18 HG2 ARG 18 11.140 -17.354 -7.041 153 2HG ARG 18 HG3 ARG 18 10.403 -16.650 -5.597 154 1HD ARG 18 HD2 ARG 18 9.625 -14.718 -6.878 155 2HD ARG 18 HD3 ARG 18 10.358 -15.383 -8.359 156 HE ARG 18 H3T ARG 18 8.610 -17.339 -7.244 157 1HH1 ARG 18 2HH2 ARG 18 8.328 -14.258 -8.878 158 2HH1 ARG 18 1HH2 ARG 18 6.730 -14.616 -9.477 159 1HH2 ARG 18 2HH1 ARG 18 6.576 -17.737 -8.045 160 2HH2 ARG 18 1HH1 ARG 18 5.771 -16.544 -9.019 161 H LYS 19 H LYS 19 14.029 -14.371 -3.376 162 HA LYS 19 HA LYS 19 16.045 -13.570 -2.854 163 1HB LYS 19 HB2 LYS 19 17.346 -15.739 -4.531 164 2HB LYS 19 HB3 LYS 19 18.069 -14.809 -3.230 165 1HG LYS 19 HG2 LYS 19 15.871 -16.896 -2.951 166 2HG LYS 19 HG3 LYS 19 17.565 -17.060 -2.499 167 1HD LYS 19 HD2 LYS 19 17.305 -15.306 -0.773 168 2HD LYS 19 HD3 LYS 19 15.589 -15.119 -1.211 169 1HE LYS 19 HE2 LYS 19 15.155 -17.470 -0.645 170 2HE LYS 19 HE3 LYS 19 16.860 -17.716 -0.244 171 1HZ LYS 19 HZ1 LYS 19 15.529 -17.295 1.745 172 2HZ LYS 19 HZ2 LYS 19 16.607 -16.087 1.549 173 3HZ LYS 19 HZ3 LYS 19 15.036 -15.845 1.175 174 H THR 20 H THR 20 14.578 -12.433 -4.973 175 HA THR 20 HA THR 20 16.756 -10.748 -5.820 176 HB THR 20 H5T THR 20 16.756 -12.325 -7.652 177 HG1 THR 20 HG1 THR 20 17.404 -10.319 -8.139 178 1HG2 THR 20 1HG2 THR 20 14.315 -12.916 -7.737 179 2HG2 THR 20 2HG2 THR 20 14.028 -11.362 -8.558 180 3HG2 THR 20 3HG2 THR 20 15.085 -12.573 -9.294 181 HA PRO 21 HA PRO 21 12.973 -8.893 -4.004 182 1HB PRO 21 HB2 PRO 21 15.026 -6.824 -3.239 183 2HB PRO 21 HB3 PRO 21 13.678 -7.486 -2.265 184 1HG PRO 21 HG2 PRO 21 16.209 -8.357 -1.864 185 2HG PRO 21 HG3 PRO 21 14.861 -9.538 -1.913 186 1HD PRO 21 HD2 PRO 21 16.811 -8.833 -4.112 187 2HD PRO 21 HD3 PRO 21 16.245 -10.439 -3.559 188 H ILE 22 H ILE 22 11.755 -6.907 -4.291 189 HA ILE 22 HA ILE 22 11.620 -6.200 -7.015 190 HB ILE 22 H5T ILE 22 9.856 -6.284 -5.209 191 1HG1 ILE 22 2HG1 ILE 22 9.592 -3.826 -6.944 192 2HG1 ILE 22 3HG1 ILE 22 9.532 -5.475 -7.585 193 1HG2 ILE 22 1HG2 ILE 22 9.342 -4.273 -3.926 194 2HG2 ILE 22 2HG2 ILE 22 11.027 -4.685 -3.622 195 3HG2 ILE 22 3HG2 ILE 22 10.621 -3.364 -4.733 196 1HD1 ILE 22 1HD1 ILE 22 7.261 -4.605 -7.109 197 2HD1 ILE 22 2HD1 ILE 22 7.624 -6.039 -6.139 198 3HD1 ILE 22 3HD1 ILE 22 7.663 -4.419 -5.406 199 H GLU 23 H GLU 23 13.442 -4.424 -4.532 200 HA GLU 23 HA GLU 23 13.929 -2.090 -6.003 201 1HB GLU 23 HB2 GLU 23 15.906 -1.809 -4.670 202 2HB GLU 23 HB3 GLU 23 14.602 -2.444 -3.672 203 1HG GLU 23 HG2 GLU 23 15.596 -4.721 -3.832 204 2HG GLU 23 HG3 GLU 23 16.904 -4.090 -4.829 205 H ARG 24 H ARG 24 14.833 -5.221 -7.038 206 HA ARG 24 HA ARG 24 17.060 -4.724 -8.736 207 1HB ARG 24 HB2 ARG 24 16.325 -6.653 -9.953 208 2HB ARG 24 HB3 ARG 24 15.968 -6.936 -8.252 209 1HG ARG 24 HG2 ARG 24 13.557 -6.037 -8.859 210 2HG ARG 24 HG3 ARG 24 14.057 -6.304 -10.529 211 1HD ARG 24 HD2 ARG 24 13.853 -8.356 -8.302 212 2HD ARG 24 HD3 ARG 24 12.787 -8.230 -9.686 213 HE ARG 24 H3T ARG 24 15.392 -9.492 -9.502 214 1HH1 ARG 24 2HH2 ARG 24 13.208 -8.156 -11.901 215 2HH1 ARG 24 1HH2 ARG 24 13.944 -9.066 -13.191 216 1HH2 ARG 24 2HH1 ARG 24 16.269 -10.576 -11.138 217 2HH2 ARG 24 1HH1 ARG 24 15.653 -10.427 -12.764 218 H ILE 25 H ILE 25 13.838 -3.517 -8.940 219 HA ILE 25 HA ILE 25 14.182 -2.355 -11.657 220 HB ILE 25 H5T ILE 25 11.824 -2.368 -9.737 221 1HG1 ILE 25 2HG1 ILE 25 11.876 -3.798 -12.406 222 2HG1 ILE 25 3HG1 ILE 25 12.517 -4.604 -10.981 223 1HG2 ILE 25 1HG2 ILE 25 10.592 -1.527 -11.813 224 2HG2 ILE 25 2HG2 ILE 25 11.714 -0.368 -11.094 225 3HG2 ILE 25 3HG2 ILE 25 12.179 -1.262 -12.553 226 1HD1 ILE 25 1HD1 ILE 25 10.145 -5.166 -11.365 227 2HD1 ILE 25 2HD1 ILE 25 10.428 -4.398 -9.788 228 3HD1 ILE 25 3HD1 ILE 25 9.714 -3.463 -11.110 229 HA PRO 26 HA PRO 26 15.591 1.153 -9.091 230 1HB PRO 26 HB2 PRO 26 16.616 2.775 -11.035 231 2HB PRO 26 HB3 PRO 26 17.429 1.286 -10.464 232 1HG PRO 26 HG2 PRO 26 15.712 1.635 -12.937 233 2HG PRO 26 HG3 PRO 26 17.298 0.824 -12.796 234 1HD PRO 26 HD2 PRO 26 14.914 -0.540 -12.750 235 2HD PRO 26 HD3 PRO 26 16.339 -1.084 -11.812 236 H TYR 27 H TYR 27 13.686 1.711 -12.106 237 HA TYR 27 HA TYR 27 11.884 3.625 -10.744 238 1HB TYR 27 HB2 TYR 27 13.733 4.362 -13.073 239 2HB TYR 27 HB3 TYR 27 12.342 5.312 -12.617 240 HD1 TYR 27 HD1 TYR 27 12.526 5.567 -9.682 241 HD2 TYR 27 HD2 TYR 27 15.571 5.752 -12.734 242 HE1 TYR 27 HE1 TYR 27 13.844 7.137 -8.274 243 HE2 TYR 27 HE2 TYR 27 16.891 7.307 -11.318 244 HH TYR 27 HH TYR 27 17.003 8.456 -9.338 245 H LEU 28 H LEU 28 10.146 4.327 -12.240 246 HA LEU 28 HA LEU 28 9.176 2.401 -14.197 247 1HB LEU 28 HB2 LEU 28 7.705 3.941 -12.930 248 2HB LEU 28 HB3 LEU 28 8.521 5.328 -13.635 249 HG LEU 28 HG LEU 28 7.689 4.606 -15.916 250 1HD1 LEU 28 1HD1 LEU 28 5.802 3.010 -15.986 251 2HD1 LEU 28 2HD1 LEU 28 7.285 2.213 -15.459 252 3HD1 LEU 28 3HD1 LEU 28 6.039 2.649 -14.260 253 1HD2 LEU 28 1HD2 LEU 28 6.531 6.335 -14.652 254 2HD2 LEU 28 2HD2 LEU 28 5.351 5.313 -15.479 255 3HD2 LEU 28 3HD2 LEU 28 5.625 5.110 -13.731 256 H GLY 29 H GLY 29 10.082 5.812 -14.834 257 1HA GLY 29 HA2 GLY 29 12.256 4.856 -16.686 258 2HA GLY 29 HA3 GLY 29 11.135 6.174 -17.079 259 H PHE 30 H PHE 30 10.978 7.673 -14.838 260 HA PHE 30 HA PHE 30 13.684 8.199 -13.736 261 1HB PHE 30 HB2 PHE 30 13.054 9.592 -15.850 262 2HB PHE 30 HB3 PHE 30 11.927 10.434 -14.808 263 HD1 PHE 30 HD1 PHE 30 12.739 12.344 -13.604 264 HD2 PHE 30 HD2 PHE 30 15.537 9.418 -15.094 265 HE1 PHE 30 HE1 PHE 30 14.626 13.812 -12.939 266 HE2 PHE 30 HE2 PHE 30 17.427 10.888 -14.427 267 HZ PHE 30 HZ PHE 30 16.973 13.090 -13.350 268 H LYS 31 H LYS 31 11.035 7.056 -12.696 269 HA LYS 31 HA LYS 31 10.896 8.629 -10.208 270 1HB LYS 31 HB2 LYS 31 8.514 9.023 -10.302 271 2HB LYS 31 HB3 LYS 31 9.261 9.800 -11.684 272 1HG LYS 31 HG2 LYS 31 8.468 8.128 -13.217 273 2HG LYS 31 HG3 LYS 31 7.991 7.032 -11.924 274 1HD LYS 31 HD2 LYS 31 6.653 9.695 -12.509 275 2HD LYS 31 HD3 LYS 31 6.063 8.090 -12.973 276 1HE LYS 31 HE2 LYS 31 6.177 7.492 -10.461 277 2HE LYS 31 HE3 LYS 31 6.356 9.229 -10.168 278 1HZ LYS 31 HZ1 LYS 31 4.049 8.669 -10.039 279 2HZ LYS 31 HZ2 LYS 31 4.214 9.479 -11.452 280 3HZ LYS 31 HZ3 LYS 31 4.076 7.831 -11.438 281 H GLN 32 H GLN 32 9.355 7.608 -8.643 282 HA GLN 32 HA GLN 32 9.754 4.872 -8.141 283 1HB GLN 32 HB2 GLN 32 9.077 6.428 -6.437 284 2HB GLN 32 HB3 GLN 32 7.608 6.854 -7.308 285 1HG GLN 32 HG2 GLN 32 7.138 5.458 -5.350 286 2HG GLN 32 HG3 GLN 32 6.595 4.722 -6.843 287 1HE2 GLN 32 1HE2 GLN 32 6.812 2.521 -6.627 288 2HE2 GLN 32 2HE2 GLN 32 8.210 1.727 -5.893 289 H ILE 33 H ILE 33 8.784 2.982 -8.708 290 HA ILE 33 HA ILE 33 7.010 2.746 -10.941 291 HB ILE 33 H5T ILE 33 7.835 0.898 -8.679 292 1HG1 ILE 33 2HG1 ILE 33 9.537 1.570 -10.430 293 2HG1 ILE 33 3HG1 ILE 33 9.283 -0.151 -10.205 294 1HG2 ILE 33 1HG2 ILE 33 5.701 -0.005 -9.275 295 2HG2 ILE 33 2HG2 ILE 33 6.042 0.133 -11.019 296 3HG2 ILE 33 3HG2 ILE 33 6.945 -1.016 -10.007 297 1HD1 ILE 33 1HD1 ILE 33 8.051 -0.348 -12.269 298 2HD1 ILE 33 2HD1 ILE 33 7.971 1.419 -12.465 299 3HD1 ILE 33 3HD1 ILE 33 9.520 0.565 -12.603 300 H ASN 34 H ASN 34 4.914 2.691 -11.162 301 HA ASN 34 HA ASN 34 3.043 2.698 -8.835 302 1HB ASN 34 HB2 ASN 34 1.642 4.313 -10.197 303 2HB ASN 34 HB3 ASN 34 3.092 4.947 -9.433 304 1HD2 ASN 34 1HD2 ASN 34 2.531 3.313 -12.618 305 2HD2 ASN 34 2HD2 ASN 34 3.303 4.617 -13.532 306 H LEU 35 H LEU 35 3.315 0.342 -9.433 307 HA LEU 35 HA LEU 35 2.726 -0.696 -11.915 308 1HB LEU 35 HB2 LEU 35 3.826 -1.856 -10.067 309 2HB LEU 35 HB3 LEU 35 2.293 -2.042 -9.228 310 HG LEU 35 HG LEU 35 3.194 -4.040 -10.429 311 1HD1 LEU 35 1HD1 LEU 35 0.468 -3.397 -11.565 312 2HD1 LEU 35 2HD1 LEU 35 1.157 -4.939 -11.085 313 3HD1 LEU 35 3HD1 LEU 35 0.737 -3.750 -9.846 314 1HD2 LEU 35 1HD2 LEU 35 2.253 -2.781 -13.023 315 2HD2 LEU 35 2HD2 LEU 35 3.947 -2.794 -12.501 316 3HD2 LEU 35 3HD2 LEU 35 3.095 -4.314 -12.784 317 H TRP 36 H TRP 36 0.217 -0.204 -9.350 318 HA TRP 36 HA TRP 36 -1.964 -1.382 -10.685 319 1HB TRP 36 HB2 TRP 36 -3.342 -0.124 -9.282 320 2HB TRP 36 HB3 TRP 36 -1.900 -0.510 -8.364 321 HD1 TRP 36 HD1 TRP 36 -0.098 1.633 -8.089 322 HE1 TRP 36 HE1 TRP 36 -0.574 4.130 -7.793 323 HE3 TRP 36 HE3 TRP 36 -4.969 1.701 -9.657 324 HZ2 TRP 36 HZ2 TRP 36 -2.806 5.937 -8.159 325 HZ3 TRP 36 HZ3 TRP 36 -6.257 3.843 -9.677 326 HH2 TRP 36 HH2 TRP 36 -5.188 5.949 -8.932 327 H THR 37 H THR 37 -0.496 1.832 -11.176 328 HA THR 37 HA THR 37 -2.413 2.815 -13.161 329 HB THR 37 H5T THR 37 0.353 3.847 -12.473 330 HG1 THR 37 HG1 THR 37 -1.199 3.902 -10.764 331 1HG2 THR 37 1HG2 THR 37 -0.354 4.729 -14.644 332 2HG2 THR 37 2HG2 THR 37 -1.957 5.135 -13.988 333 3HG2 THR 37 3HG2 THR 37 -0.503 5.984 -13.417 334 H MET 38 H MET 38 0.857 1.317 -13.273 335 HA MET 38 HA MET 38 1.182 1.419 -16.134 336 1HB MET 38 HB2 MET 38 2.999 0.954 -14.477 337 2HB MET 38 HB3 MET 38 2.206 -0.556 -14.036 338 1HG MET 38 HG2 MET 38 2.527 -1.311 -16.442 339 2HG MET 38 HG3 MET 38 3.590 0.085 -16.640 340 1HE MET 38 HE1 MET 38 5.751 0.401 -14.839 341 2HE MET 38 HE2 MET 38 4.853 -0.133 -13.398 342 3HE MET 38 HE3 MET 38 6.369 -0.938 -13.847 343 H PHE 39 H PHE 39 -0.292 -1.033 -13.984 344 HA PHE 39 HA PHE 39 -1.079 -2.884 -16.007 345 1HB PHE 39 HB2 PHE 39 -1.079 -3.464 -13.667 346 2HB PHE 39 HB3 PHE 39 -2.202 -2.172 -13.277 347 HD1 PHE 39 HD1 PHE 39 -4.454 -2.753 -12.965 348 HD2 PHE 39 HD2 PHE 39 -2.022 -5.114 -15.636 349 HE1 PHE 39 HE1 PHE 39 -6.380 -4.255 -13.406 350 HE2 PHE 39 HE2 PHE 39 -3.938 -6.630 -16.043 351 HZ PHE 39 HZ PHE 39 -6.121 -6.182 -14.955 352 H GLN 40 H GLN 40 -3.177 -0.271 -14.517 353 HA GLN 40 HA GLN 40 -5.195 -0.821 -16.496 354 1HB GLN 40 HB2 GLN 40 -6.414 1.008 -15.643 355 2HB GLN 40 HB3 GLN 40 -5.578 0.261 -14.283 356 1HG GLN 40 HG2 GLN 40 -3.751 2.070 -14.692 357 2HG GLN 40 HG3 GLN 40 -4.956 2.893 -15.681 358 1HE2 GLN 40 1HE2 GLN 40 -4.317 1.557 -12.412 359 2HE2 GLN 40 2HE2 GLN 40 -5.295 2.768 -11.583 360 H ALA 41 H ALA 41 -2.370 1.375 -16.711 361 HA ALA 41 HA ALA 41 -3.192 2.663 -19.146 362 1HB ALA 41 HB1 ALA 41 -0.797 3.172 -19.374 363 2HB ALA 41 HB2 ALA 41 -1.352 3.478 -17.721 364 3HB ALA 41 HB3 ALA 41 -0.404 2.017 -18.082 365 H ALA 42 H ALA 42 -1.244 -0.358 -18.548 366 HA ALA 42 HA ALA 42 -0.965 -1.052 -21.295 367 1HB ALA 42 HB1 ALA 42 -0.524 -3.330 -20.373 368 2HB ALA 42 HB2 ALA 42 0.385 -2.059 -19.529 369 3HB ALA 42 HB3 ALA 42 -1.059 -2.777 -18.781 370 H GLN 43 H GLN 43 -3.676 -1.694 -19.009 371 HA GLN 43 HA GLN 43 -5.023 -3.486 -20.799 372 1HB GLN 43 HB2 GLN 43 -6.219 -1.868 -18.522 373 2HB GLN 43 HB3 GLN 43 -6.990 -3.179 -19.391 374 1HG GLN 43 HG2 GLN 43 -5.019 -3.307 -17.202 375 2HG GLN 43 HG3 GLN 43 -6.329 -4.375 -17.597 376 1HE2 GLN 43 1HE2 GLN 43 -2.931 -3.850 -17.840 377 2HE2 GLN 43 2HE2 GLN 43 -2.556 -5.382 -18.630 378 H LYS 44 H LYS 44 -5.095 0.041 -20.432 379 HA LYS 44 HA LYS 44 -7.355 0.451 -22.214 380 1HB LYS 44 HB2 LYS 44 -6.517 2.042 -20.448 381 2HB LYS 44 HB3 LYS 44 -5.104 2.363 -21.462 382 1HG LYS 44 HG2 LYS 44 -6.677 3.107 -23.303 383 2HG LYS 44 HG3 LYS 44 -8.028 2.872 -22.182 384 1HD LYS 44 HD2 LYS 44 -5.708 4.817 -21.877 385 2HD LYS 44 HD3 LYS 44 -7.377 5.227 -22.295 386 1HE LYS 44 HE2 LYS 44 -8.134 4.367 -20.078 387 2HE LYS 44 HE3 LYS 44 -6.456 3.988 -19.660 388 1HZ LYS 44 HZ1 LYS 44 -7.053 6.151 -18.767 389 2HZ LYS 44 HZ2 LYS 44 -5.918 6.347 -19.941 390 3HZ LYS 44 HZ3 LYS 44 -7.486 6.712 -20.245 391 H LEU 45 H LEU 45 -3.786 0.636 -22.587 392 HA LEU 45 HA LEU 45 -4.027 0.621 -25.450 393 1HB LEU 45 HB2 LEU 45 -1.650 0.360 -23.583 394 2HB LEU 45 HB3 LEU 45 -1.495 0.263 -25.318 395 HG LEU 45 HG LEU 45 -0.849 2.418 -24.828 396 1HD1 LEU 45 1HD1 LEU 45 -3.757 2.767 -25.640 397 2HD1 LEU 45 2HD1 LEU 45 -2.424 3.878 -25.946 398 3HD1 LEU 45 3HD1 LEU 45 -2.436 2.289 -26.737 399 1HD2 LEU 45 1HD2 LEU 45 -2.072 4.093 -23.560 400 2HD2 LEU 45 2HD2 LEU 45 -3.352 2.928 -23.187 401 3HD2 LEU 45 3HD2 LEU 45 -1.708 2.696 -22.550 402 H GLY 46 H GLY 46 -5.248 -1.782 -23.907 403 1HA GLY 46 HA2 GLY 46 -5.991 -3.628 -25.111 404 2HA GLY 46 HA3 GLY 46 -4.630 -3.521 -26.200 405 H GLY 47 H GLY 47 -4.164 -3.694 -22.739 406 1HA GLY 47 HA2 GLY 47 -3.192 -5.217 -21.352 407 2HA GLY 47 HA3 GLY 47 -3.952 -6.480 -22.323 408 H TYR 48 H TYR 48 -1.803 -7.337 -21.327 409 HA TYR 48 HA TYR 48 0.661 -6.962 -22.688 410 1HB TYR 48 HB2 TYR 48 0.260 -8.274 -20.609 411 2HB TYR 48 HB3 TYR 48 -0.511 -9.526 -21.570 412 HD1 TYR 48 HD1 TYR 48 2.691 -7.599 -21.174 413 HD2 TYR 48 HD2 TYR 48 0.832 -11.252 -22.536 414 HE1 TYR 48 HE1 TYR 48 4.935 -8.592 -21.580 415 HE2 TYR 48 HE2 TYR 48 3.076 -12.242 -22.944 416 HH TYR 48 HH TYR 48 5.337 -11.932 -22.835 417 H GLU 49 H GLU 49 -2.335 -8.484 -23.835 418 HA GLU 49 HA GLU 49 -1.106 -10.073 -25.889 419 1HB GLU 49 HB2 GLU 49 -3.937 -8.972 -25.639 420 2HB GLU 49 HB3 GLU 49 -3.404 -10.132 -26.863 421 1HG GLU 49 HG2 GLU 49 -2.703 -11.695 -25.025 422 2HG GLU 49 HG3 GLU 49 -3.402 -10.578 -23.850 423 H THR 50 H THR 50 -2.721 -6.845 -26.152 424 HA THR 50 HA THR 50 -1.954 -6.477 -28.904 425 HB THR 50 H5T THR 50 -2.665 -4.386 -26.828 426 HG1 THR 50 HG1 THR 50 -4.345 -5.807 -27.142 427 1HG2 THR 50 1HG2 THR 50 -2.742 -4.234 -29.874 428 2HG2 THR 50 2HG2 THR 50 -3.344 -2.998 -28.750 429 3HG2 THR 50 3HG2 THR 50 -1.615 -3.344 -28.825 430 H ILE 51 H ILE 51 -0.393 -5.566 -25.777 431 HA ILE 51 HA ILE 51 1.838 -4.210 -26.846 432 HB ILE 51 H5T ILE 51 1.335 -5.975 -24.451 433 1HG1 ILE 51 2HG1 ILE 51 2.167 -3.054 -24.528 434 2HG1 ILE 51 3HG1 ILE 51 0.486 -3.582 -24.642 435 1HG2 ILE 51 1HG2 ILE 51 3.632 -6.523 -24.841 436 2HG2 ILE 51 2HG2 ILE 51 4.045 -4.810 -25.097 437 3HG2 ILE 51 3HG2 ILE 51 3.552 -5.431 -23.490 438 1HD1 ILE 51 1HD1 ILE 51 0.853 -3.052 -22.349 439 2HD1 ILE 51 2HD1 ILE 51 0.779 -4.798 -22.428 440 3HD1 ILE 51 3HD1 ILE 51 2.352 -3.988 -22.278 441 H THR 52 H THR 52 1.504 -7.761 -26.402 442 HA THR 52 HA THR 52 4.140 -8.262 -27.446 443 HB THR 52 H5T THR 52 1.781 -10.156 -27.071 444 HG1 THR 52 HG1 THR 52 2.355 -9.352 -25.149 445 1HG2 THR 52 1HG2 THR 52 4.765 -10.723 -27.414 446 2HG2 THR 52 2HG2 THR 52 3.552 -11.904 -26.882 447 3HG2 THR 52 3HG2 THR 52 3.462 -11.232 -28.513 448 H ALA 53 H ALA 53 0.906 -8.253 -28.981 449 HA ALA 53 HA ALA 53 1.872 -9.131 -31.549 450 1HB ALA 53 HB1 ALA 53 -0.472 -9.306 -30.803 451 2HB ALA 53 HB2 ALA 53 -0.600 -7.532 -30.754 452 3HB ALA 53 HB3 ALA 53 -0.348 -8.369 -32.303 453 H ARG 54 H ARG 54 1.668 -5.836 -30.058 454 HA ARG 54 HA ARG 54 2.601 -4.701 -32.713 455 1HB ARG 54 HB2 ARG 54 0.345 -3.861 -30.864 456 2HB ARG 54 HB3 ARG 54 0.983 -2.793 -32.103 457 1HG ARG 54 HG2 ARG 54 0.275 -4.143 -33.885 458 2HG ARG 54 HG3 ARG 54 0.021 -5.562 -32.871 459 1HD ARG 54 HD2 ARG 54 -2.095 -4.493 -33.604 460 2HD ARG 54 HD3 ARG 54 -1.919 -4.696 -31.870 461 HE ARG 54 H3T ARG 54 -1.486 -2.335 -31.597 462 1HH1 ARG 54 2HH2 ARG 54 -2.648 -3.027 -34.845 463 2HH1 ARG 54 1HH2 ARG 54 -3.162 -1.378 -35.074 464 1HH2 ARG 54 2HH1 ARG 54 -2.136 -0.382 -31.925 465 2HH2 ARG 54 1HH1 ARG 54 -2.875 0.124 -33.434 466 H ARG 55 H ARG 55 3.809 -4.917 -29.677 467 HA ARG 55 HA ARG 55 5.257 -3.656 -28.367 468 1HB ARG 55 HB2 ARG 55 6.023 -2.218 -30.939 469 2HB ARG 55 HB3 ARG 55 6.975 -2.361 -29.471 470 1HG ARG 55 HG2 ARG 55 6.251 -4.606 -31.402 471 2HG ARG 55 HG3 ARG 55 7.818 -3.826 -31.242 472 1HD ARG 55 HD2 ARG 55 6.479 -5.479 -29.058 473 2HD ARG 55 HD3 ARG 55 7.698 -6.069 -30.198 474 HE ARG 55 H3T ARG 55 8.706 -3.744 -28.867 475 1HH1 ARG 55 2HH1 ARG 55 8.145 -7.142 -28.234 476 2HH1 ARG 55 1HH1 ARG 55 9.437 -7.233 -27.067 477 1HH2 ARG 55 2HH2 ARG 55 10.343 -3.930 -27.380 478 2HH2 ARG 55 1HH2 ARG 55 10.633 -5.449 -26.587 479 H GLN 56 H GLN 56 2.939 -2.995 -27.794 480 HA GLN 56 HA GLN 56 2.194 -0.339 -28.692 481 1HB GLN 56 HB2 GLN 56 0.659 -2.454 -28.239 482 2HB GLN 56 HB3 GLN 56 0.619 -1.819 -26.595 483 1HG GLN 56 HG2 GLN 56 -1.292 -0.967 -27.784 484 2HG GLN 56 HG3 GLN 56 -0.207 0.396 -27.568 485 1HE2 GLN 56 2HE2 GLN 56 0.929 1.224 -29.551 486 2HE2 GLN 56 1HE2 GLN 56 0.350 0.730 -31.129 487 H TRP 57 H TRP 57 4.249 -1.251 -26.209 488 HA TRP 57 HA TRP 57 3.764 0.615 -24.174 489 1HB TRP 57 HB2 TRP 57 6.453 -0.237 -25.283 490 2HB TRP 57 HB3 TRP 57 6.174 0.645 -23.816 491 HD1 TRP 57 HD1 TRP 57 6.053 -2.828 -25.211 492 HE1 TRP 57 HE1 TRP 57 5.414 -4.494 -23.381 493 HE3 TRP 57 HE3 TRP 57 4.878 0.470 -21.463 494 HZ2 TRP 57 HZ2 TRP 57 4.499 -4.431 -20.634 495 HZ3 TRP 57 HZ3 TRP 57 4.121 -0.372 -19.244 496 HH2 TRP 57 HH2 TRP 57 3.931 -2.787 -18.834 497 H LYS 58 H LYS 58 4.900 1.304 -27.472 498 HA LYS 58 HA LYS 58 5.766 3.997 -26.940 499 1HB LYS 58 HB2 LYS 58 4.526 2.885 -29.500 500 2HB LYS 58 HB3 LYS 58 5.455 4.379 -29.357 501 1HG LYS 58 HG2 LYS 58 6.503 1.544 -29.035 502 2HG LYS 58 HG3 LYS 58 6.848 2.695 -30.325 503 1HD LYS 58 HD2 LYS 58 7.937 4.201 -28.583 504 2HD LYS 58 HD3 LYS 58 7.729 2.874 -27.411 505 1HE LYS 58 HE2 LYS 58 9.007 1.376 -28.992 506 2HE LYS 58 HE3 LYS 58 9.323 2.788 -30.010 507 1HZ LYS 58 HZ1 LYS 58 10.430 3.806 -28.044 508 2HZ LYS 58 HZ2 LYS 58 10.205 2.413 -27.198 509 3HZ LYS 58 HZ3 LYS 58 11.170 2.426 -28.512 510 H HIS 59 H HIS 59 2.410 2.807 -27.218 511 HA HIS 59 HA HIS 59 1.540 5.624 -26.781 512 1HB HIS 59 HB2 HIS 59 -0.059 3.103 -27.264 513 2HB HIS 59 HB3 HIS 59 -0.698 4.749 -27.133 514 HD1 HIS 59 HD1 HIS 59 1.940 5.778 -29.122 515 HD2 HIS 59 HD2 HIS 59 -1.250 3.101 -29.754 516 HE1 HIS 59 HE1 HIS 59 1.618 5.632 -31.641 517 H ILE 60 H ILE 60 2.378 2.917 -24.833 518 HA ILE 60 HA ILE 60 0.718 3.759 -22.540 519 HB ILE 60 H5T ILE 60 3.161 1.958 -22.665 520 1HG1 ILE 60 2HG1 ILE 60 0.186 1.361 -22.254 521 2HG1 ILE 60 3HG1 ILE 60 1.016 1.166 -23.795 522 1HG2 ILE 60 1HG2 ILE 60 2.544 1.321 -20.333 523 2HG2 ILE 60 2HG2 ILE 60 3.020 3.008 -20.441 524 3HG2 ILE 60 3HG2 ILE 60 1.299 2.584 -20.331 525 1HD1 ILE 60 1HD1 ILE 60 2.466 -0.577 -22.813 526 2HD1 ILE 60 2HD1 ILE 60 1.527 -0.461 -21.301 527 3HD1 ILE 60 3HD1 ILE 60 0.744 -0.945 -22.817 528 H TYR 61 H TYR 61 3.991 4.341 -23.864 529 HA TYR 61 HA TYR 61 4.889 6.334 -22.066 530 1HB TYR 61 HB2 TYR 61 6.319 5.339 -23.735 531 2HB TYR 61 HB3 TYR 61 5.254 5.817 -25.033 532 HD1 TYR 61 HD1 TYR 61 7.919 6.950 -22.743 533 HD2 TYR 61 HD2 TYR 61 5.269 8.046 -25.971 534 HE1 TYR 61 HE1 TYR 61 9.354 8.925 -23.260 535 HE2 TYR 61 HE2 TYR 61 6.696 10.019 -26.475 536 HH TYR 61 HH TYR 61 8.600 11.162 -25.965 537 H ASP 62 H ASP 62 2.436 6.482 -24.646 538 HA ASP 62 HA ASP 62 2.144 9.346 -24.548 539 1HB ASP 62 HB2 ASP 62 1.440 7.996 -26.503 540 2HB ASP 62 HB3 ASP 62 0.074 7.409 -25.552 541 H GLU 63 H GLU 63 0.156 6.673 -23.074 542 HA GLU 63 HA GLU 63 -1.296 8.326 -21.348 543 1HB GLU 63 HB2 GLU 63 -1.671 5.899 -21.754 544 2HB GLU 63 HB3 GLU 63 -0.267 5.525 -20.755 545 1HG GLU 63 HG2 GLU 63 -2.268 5.194 -19.472 546 2HG GLU 63 HG3 GLU 63 -1.378 6.538 -18.785 547 H LEU 64 H LEU 64 2.077 7.192 -20.774 548 HA LEU 64 HA LEU 64 2.301 8.325 -18.126 549 1HB LEU 64 HB2 LEU 64 4.528 8.010 -20.185 550 2HB LEU 64 HB3 LEU 64 4.714 8.295 -18.467 551 HG LEU 64 HG LEU 64 3.812 5.766 -19.829 552 1HD1 LEU 64 1HD1 LEU 64 5.719 4.794 -18.684 553 2HD1 LEU 64 2HD1 LEU 64 6.220 6.176 -19.673 554 3HD1 LEU 64 3HD1 LEU 64 6.080 6.353 -17.905 555 1HD2 LEU 64 1HD2 LEU 64 3.716 6.401 -16.849 556 2HD2 LEU 64 2HD2 LEU 64 2.336 5.963 -17.888 557 3HD2 LEU 64 3HD2 LEU 64 3.589 4.764 -17.545 558 H GLY 65 H GLY 65 2.232 9.880 -21.267 559 1HA GLY 65 HA2 GLY 65 2.414 12.120 -21.840 560 2HA GLY 65 HA3 GLY 65 2.559 12.560 -20.133 561 H GLY 66 H GLY 66 4.592 10.251 -22.018 562 1HA GLY 66 HA2 GLY 66 7.016 11.117 -20.851 563 2HA GLY 66 HA3 GLY 66 6.864 10.146 -22.302 564 H ASN 67 H ASN 67 8.953 11.789 -21.987 565 HA ASN 67 HA ASN 67 8.651 14.007 -23.958 566 1HB ASN 67 HB2 ASN 67 8.326 14.824 -21.593 567 2HB ASN 67 HB3 ASN 67 9.907 14.184 -21.167 568 1HD2 ASN 67 2HD2 ASN 67 11.818 15.354 -21.900 569 2HD2 ASN 67 1HD2 ASN 67 11.632 16.977 -22.540 570 HA PRO 68 HA PRO 68 12.602 12.540 -25.602 571 1HB PRO 68 HB2 PRO 68 13.315 15.479 -25.438 572 2HB PRO 68 HB3 PRO 68 13.731 14.293 -26.719 573 1HG PRO 68 HG2 PRO 68 11.614 15.929 -27.066 574 2HG PRO 68 HG3 PRO 68 11.443 14.183 -27.446 575 1HD PRO 68 HD2 PRO 68 10.511 15.678 -25.004 576 2HD PRO 68 HD3 PRO 68 9.676 14.393 -25.929 577 H GLY 69 H GLY 69 13.985 11.417 -24.464 578 1HA GLY 69 HA2 GLY 69 15.936 11.177 -23.144 579 2HA GLY 69 HA3 GLY 69 15.581 12.672 -22.250 580 H SER 70 H SER 70 12.656 11.231 -22.360 581 HA SER 70 HA SER 70 13.165 9.203 -20.180 582 1HB SER 70 HB2 SER 70 10.937 9.548 -19.338 583 2HB SER 70 HB3 SER 70 11.831 11.075 -19.283 584 HG SER 70 HG SER 70 10.795 11.515 -21.388 585 H THR 71 H THR 71 13.009 9.515 -23.262 586 HA THR 71 HA THR 71 11.202 7.679 -24.436 587 HB THR 71 H5T THR 71 13.329 7.645 -26.074 588 HG1 THR 71 HG1 THR 71 14.680 9.296 -25.787 589 1HG2 THR 71 1HG2 THR 71 11.708 10.171 -25.513 590 2HG2 THR 71 2HG2 THR 71 12.579 9.804 -27.020 591 3HG2 THR 71 3HG2 THR 71 11.190 8.820 -26.541 592 H SER 72 H SER 72 13.905 7.152 -22.348 593 HA SER 72 HA SER 72 14.123 4.255 -23.002 594 1HB SER 72 HB2 SER 72 15.545 5.946 -20.896 595 2HB SER 72 HB3 SER 72 15.848 4.228 -21.229 596 HG SER 72 HG SER 72 16.182 6.379 -23.083 597 H ALA 73 H ALA 73 11.572 5.266 -22.216 598 HA ALA 73 HA ALA 73 11.143 3.492 -19.862 599 1HB ALA 73 HB1 ALA 73 11.017 5.957 -19.219 600 2HB ALA 73 HB2 ALA 73 9.599 6.073 -20.281 601 3HB ALA 73 HB3 ALA 73 9.564 4.985 -18.879 602 H ALA 74 H ALA 74 8.728 2.907 -19.812 603 HA ALA 74 HA ALA 74 7.060 1.721 -20.680 604 1HB ALA 74 HB1 ALA 74 5.817 2.440 -22.495 605 2HB ALA 74 HB2 ALA 74 6.491 3.896 -21.770 606 3HB ALA 74 HB3 ALA 74 7.208 3.239 -23.267 607 H THR 75 H THR 75 9.620 1.970 -23.301 608 HA THR 75 HA THR 75 9.096 -0.813 -24.095 609 HB THR 75 H5T THR 75 11.526 0.920 -24.714 610 HG1 THR 75 HG1 THR 75 9.013 0.631 -25.993 611 1HG2 THR 75 1HG2 THR 75 10.289 -1.466 -26.177 612 2HG2 THR 75 2HG2 THR 75 11.638 -0.467 -26.768 613 3HG2 THR 75 3HG2 THR 75 11.851 -1.456 -25.320 614 H CYS 76 H CYS 76 11.583 0.853 -22.094 615 HA CYS 76 HA CYS 76 12.817 -1.620 -21.179 616 1HB CYS 76 HB2 CYS 76 12.812 1.184 -19.960 617 2HB CYS 76 HB3 CYS 76 13.917 -0.136 -19.544 618 HG CYS 76 HG CYS 76 14.959 -0.420 -21.950 619 H THR 77 H THR 77 10.040 0.312 -20.122 620 HA THR 77 HA THR 77 9.635 -0.861 -17.541 621 HB THR 77 H5T THR 77 7.557 0.120 -19.521 622 HG1 THR 77 HG1 THR 77 9.035 1.492 -17.521 623 1HG2 THR 77 1HG2 THR 77 6.251 0.765 -17.556 624 2HG2 THR 77 2HG2 THR 77 6.407 -0.977 -17.775 625 3HG2 THR 77 3HG2 THR 77 7.389 -0.160 -16.530 626 H ARG 78 H ARG 78 8.847 -2.075 -20.815 627 HA ARG 78 HA ARG 78 7.171 -4.185 -20.199 628 1HB ARG 78 HB2 ARG 78 8.055 -3.533 -22.514 629 2HB ARG 78 HB3 ARG 78 9.543 -4.395 -22.114 630 1HG ARG 78 HG2 ARG 78 8.125 -6.478 -21.684 631 2HG ARG 78 HG3 ARG 78 6.739 -5.582 -22.282 632 1HD ARG 78 HD2 ARG 78 8.255 -5.192 -24.400 633 2HD ARG 78 HD3 ARG 78 9.216 -6.528 -23.760 634 HE ARG 78 H3T ARG 78 6.779 -6.712 -25.209 635 1HH1 ARG 78 2HH2 ARG 78 8.250 -8.472 -22.440 636 2HH1 ARG 78 1HH2 ARG 78 7.077 -9.748 -22.667 637 1HH2 ARG 78 2HH1 ARG 78 5.408 -8.467 -25.292 638 2HH2 ARG 78 1HH1 ARG 78 5.624 -9.753 -24.159 639 H ARG 79 H ARG 79 10.739 -4.019 -19.623 640 HA ARG 79 HA ARG 79 10.803 -6.821 -19.168 641 1HB ARG 79 HB2 ARG 79 12.882 -4.683 -18.501 642 2HB ARG 79 HB3 ARG 79 13.170 -6.427 -18.428 643 1HG ARG 79 HG2 ARG 79 12.661 -6.587 -20.885 644 2HG ARG 79 HG3 ARG 79 12.457 -4.832 -20.933 645 1HD ARG 79 HD2 ARG 79 14.643 -5.290 -21.727 646 2HD ARG 79 HD3 ARG 79 14.814 -4.566 -20.121 647 HE ARG 79 H3T ARG 79 14.761 -7.413 -19.844 648 1HH1 ARG 79 2HH2 ARG 79 16.940 -4.982 -21.122 649 2HH1 ARG 79 1HH2 ARG 79 18.348 -5.973 -20.848 650 1HH2 ARG 79 2HH1 ARG 79 16.595 -8.627 -19.538 651 2HH2 ARG 79 1HH1 ARG 79 18.148 -7.982 -19.981 652 H HIS 80 H HIS 80 10.153 -4.064 -17.177 653 HA HIS 80 HA HIS 80 10.353 -5.484 -14.612 654 1HB HIS 80 HB2 HIS 80 8.678 -3.017 -15.067 655 2HB HIS 80 HB3 HIS 80 9.458 -3.595 -13.597 656 HD1 HIS 80 HD1 HIS 80 9.824 -0.631 -14.957 657 HD2 HIS 80 HD2 HIS 80 12.479 -3.891 -15.053 658 HE1 HIS 80 HE1 HIS 80 12.124 0.336 -15.456 659 H TYR 81 H TYR 81 7.616 -4.361 -16.724 660 HA TYR 81 HA TYR 81 5.486 -5.502 -15.377 661 1HB TYR 81 HB2 TYR 81 5.417 -3.943 -17.308 662 2HB TYR 81 HB3 TYR 81 5.822 -5.270 -18.383 663 HD1 TYR 81 HD1 TYR 81 4.158 -7.269 -18.563 664 HD2 TYR 81 HD2 TYR 81 3.159 -3.512 -16.707 665 HE1 TYR 81 HE1 TYR 81 1.735 -7.790 -18.780 666 HE2 TYR 81 HE2 TYR 81 0.748 -3.969 -17.062 667 HH TYR 81 HH TYR 81 -0.380 -7.143 -18.226 668 H GLU 82 H GLU 82 7.593 -7.252 -17.715 669 HA GLU 82 HA GLU 82 5.855 -9.536 -17.832 670 1HB GLU 82 HB2 GLU 82 7.410 -10.530 -19.287 671 2HB GLU 82 HB3 GLU 82 7.270 -8.823 -19.699 672 1HG GLU 82 HG2 GLU 82 9.409 -8.445 -18.371 673 2HG GLU 82 HG3 GLU 82 9.512 -10.198 -18.179 674 H ARG 83 H ARG 83 8.016 -8.486 -15.399 675 HA ARG 83 HA ARG 83 7.552 -11.123 -14.151 676 1HB ARG 83 HB2 ARG 83 10.014 -9.334 -13.907 677 2HB ARG 83 HB3 ARG 83 9.705 -10.674 -12.807 678 1HG ARG 83 HG2 ARG 83 10.091 -10.957 -15.817 679 2HG ARG 83 HG3 ARG 83 11.301 -11.285 -14.576 680 1HD ARG 83 HD2 ARG 83 9.859 -13.018 -13.581 681 2HD ARG 83 HD3 ARG 83 8.626 -12.741 -14.799 682 HE ARG 83 H3T ARG 83 11.189 -14.143 -15.155 683 1HH1 ARG 83 2HH2 ARG 83 8.453 -12.741 -16.893 684 2HH1 ARG 83 1HH2 ARG 83 8.791 -13.698 -18.313 685 1HH2 ARG 83 2HH1 ARG 83 11.527 -15.302 -17.003 686 2HH2 ARG 83 1HH1 ARG 83 10.475 -15.092 -18.373 687 H LEU 84 H LEU 84 6.930 -7.798 -13.884 688 HA LEU 84 HA LEU 84 6.519 -7.903 -10.959 689 1HB LEU 84 HB2 LEU 84 7.711 -6.096 -12.201 690 2HB LEU 84 HB3 LEU 84 6.256 -5.813 -13.156 691 HG LEU 84 HG LEU 84 5.097 -5.045 -11.086 692 1HD1 LEU 84 1HD1 LEU 84 6.462 -4.397 -9.169 693 2HD1 LEU 84 2HD1 LEU 84 6.523 -6.154 -9.382 694 3HD1 LEU 84 3HD1 LEU 84 7.900 -5.154 -9.894 695 1HD2 LEU 84 1HD2 LEU 84 7.634 -3.556 -11.815 696 2HD2 LEU 84 2HD2 LEU 84 6.129 -3.521 -12.739 697 3HD2 LEU 84 3HD2 LEU 84 6.159 -2.879 -11.090 698 H ILE 85 H ILE 85 4.600 -8.558 -13.758 699 HA ILE 85 HA ILE 85 2.308 -8.912 -12.060 700 HB ILE 85 H5T ILE 85 2.191 -6.403 -12.696 701 1HG1 ILE 85 2HG1 ILE 85 -0.103 -8.359 -13.140 702 2HG1 ILE 85 3HG1 ILE 85 0.373 -7.563 -11.645 703 1HG2 ILE 85 1HG2 ILE 85 1.354 -5.743 -14.807 704 2HG2 ILE 85 2HG2 ILE 85 2.806 -6.697 -15.090 705 3HG2 ILE 85 3HG2 ILE 85 1.204 -7.418 -15.373 706 1HD1 ILE 85 1HD1 ILE 85 -0.874 -6.321 -14.115 707 2HD1 ILE 85 2HD1 ILE 85 -1.629 -6.540 -12.530 708 3HD1 ILE 85 3HD1 ILE 85 -0.305 -5.375 -12.727 709 H LEU 86 H LEU 86 3.671 -9.144 -15.385 710 HA LEU 86 HA LEU 86 1.706 -10.786 -16.464 711 1HB LEU 86 HB2 LEU 86 3.639 -10.009 -17.675 712 2HB LEU 86 HB3 LEU 86 4.708 -10.999 -16.682 713 HG LEU 86 HG LEU 86 3.739 -13.054 -17.623 714 1HD1 LEU 86 1HD1 LEU 86 1.467 -12.267 -18.221 715 2HD1 LEU 86 2HD1 LEU 86 2.159 -11.138 -19.405 716 3HD1 LEU 86 3HD1 LEU 86 2.293 -12.890 -19.654 717 1HD2 LEU 86 1HD2 LEU 86 4.747 -11.027 -19.638 718 2HD2 LEU 86 2HD2 LEU 86 5.717 -12.128 -18.638 719 3HD2 LEU 86 3HD2 LEU 86 4.673 -12.784 -19.906 720 HA PRO 87 HA PRO 87 3.183 -14.640 -13.972 721 1HB PRO 87 HB2 PRO 87 4.169 -13.293 -11.458 722 2HB PRO 87 HB3 PRO 87 4.720 -14.827 -12.200 723 1HG PRO 87 HG2 PRO 87 6.198 -12.578 -12.448 724 2HG PRO 87 HG3 PRO 87 5.963 -13.645 -13.872 725 1HD PRO 87 HD2 PRO 87 4.449 -11.119 -13.156 726 2HD PRO 87 HD3 PRO 87 5.197 -11.578 -14.712 727 H TYR 88 H TYR 88 1.749 -11.708 -12.532 728 HA TYR 88 HA TYR 88 -0.102 -13.381 -10.902 729 1HB TYR 88 HB2 TYR 88 0.903 -10.583 -10.744 730 2HB TYR 88 HB3 TYR 88 -0.772 -10.851 -10.308 731 HD1 TYR 88 HD1 TYR 88 2.029 -13.328 -9.718 732 HD2 TYR 88 HD2 TYR 88 -0.682 -10.457 -7.990 733 HE1 TYR 88 HE1 TYR 88 2.505 -14.233 -7.461 734 HE2 TYR 88 HE2 TYR 88 -0.247 -11.408 -5.741 735 HH TYR 88 HH TYR 88 0.837 -13.013 -4.539 736 H GLU 89 H GLU 89 -0.182 -11.336 -13.828 737 HA GLU 89 HA GLU 89 -2.972 -11.319 -14.166 738 1HB GLU 89 HB2 GLU 89 -0.848 -11.757 -16.321 739 2HB GLU 89 HB3 GLU 89 -2.540 -11.360 -16.609 740 1HG GLU 89 HG2 GLU 89 -2.030 -9.261 -15.081 741 2HG GLU 89 HG3 GLU 89 -0.353 -9.616 -15.507 742 H ARG 90 H ARG 90 -0.913 -14.122 -14.079 743 HA ARG 90 HA ARG 90 -2.462 -15.990 -15.575 744 1HB ARG 90 HB2 ARG 90 -0.920 -16.394 -12.973 745 2HB ARG 90 HB3 ARG 90 -1.461 -17.675 -14.049 746 1HG ARG 90 HG2 ARG 90 0.596 -15.523 -14.708 747 2HG ARG 90 HG3 ARG 90 0.929 -17.210 -14.342 748 1HD ARG 90 HD2 ARG 90 -0.589 -16.162 -16.771 749 2HD ARG 90 HD3 ARG 90 1.074 -16.713 -16.766 750 HE ARG 90 H3T ARG 90 -1.345 -18.371 -16.743 751 1HH1 ARG 90 2HH1 ARG 90 2.109 -18.465 -16.148 752 2HH1 ARG 90 1HH1 ARG 90 2.181 -20.195 -16.338 753 1HH2 ARG 90 2HH2 ARG 90 -1.175 -20.569 -16.978 754 2HH2 ARG 90 1HH2 ARG 90 0.370 -21.345 -16.797 755 H PHE 91 H PHE 91 -3.180 -14.622 -12.303 756 HA PHE 91 HA PHE 91 -5.507 -16.441 -12.109 757 1HB PHE 91 HB2 PHE 91 -6.203 -15.252 -10.166 758 2HB PHE 91 HB3 PHE 91 -4.523 -15.723 -10.051 759 HD1 PHE 91 HD1 PHE 91 -6.670 -12.707 -10.934 760 HD2 PHE 91 HD2 PHE 91 -3.005 -14.174 -9.181 761 HE1 PHE 91 HE1 PHE 91 -5.992 -10.390 -10.397 762 HE2 PHE 91 HE2 PHE 91 -2.377 -11.865 -8.602 763 HZ PHE 91 HZ PHE 91 -3.793 -9.955 -9.331 764 H ILE 92 H ILE 92 -4.932 -13.309 -13.640 765 HA ILE 92 HA ILE 92 -7.780 -12.629 -13.752 766 HB ILE 92 H5T ILE 92 -5.481 -11.492 -15.399 767 1HG1 ILE 92 2HG1 ILE 92 -6.622 -10.500 -12.749 768 2HG1 ILE 92 3HG1 ILE 92 -5.023 -11.212 -12.986 769 1HG2 ILE 92 1HG2 ILE 92 -7.751 -11.035 -16.322 770 2HG2 ILE 92 2HG2 ILE 92 -8.241 -10.350 -14.756 771 3HG2 ILE 92 3HG2 ILE 92 -6.988 -9.570 -15.743 772 1HD1 ILE 92 1HD1 ILE 92 -4.701 -8.875 -12.823 773 2HD1 ILE 92 2HD1 ILE 92 -4.446 -9.304 -14.527 774 3HD1 ILE 92 3HD1 ILE 92 -5.966 -8.526 -14.008 775 H LYS 93 H LYS 93 -5.400 -14.175 -15.901 776 HA LYS 93 HA LYS 93 -7.417 -14.308 -18.059 777 1HB LYS 93 HB2 LYS 93 -4.762 -13.723 -18.059 778 2HB LYS 93 HB3 LYS 93 -4.662 -15.453 -18.246 779 1HG LYS 93 HG2 LYS 93 -4.649 -14.514 -20.452 780 2HG LYS 93 HG3 LYS 93 -6.291 -15.153 -20.266 781 1HD LYS 93 HD2 LYS 93 -7.092 -12.838 -19.670 782 2HD LYS 93 HD3 LYS 93 -5.433 -12.254 -19.792 783 1HE LYS 93 HE2 LYS 93 -6.457 -11.613 -21.800 784 2HE LYS 93 HE3 LYS 93 -5.416 -12.976 -22.215 785 1HZ LYS 93 HZ1 LYS 93 -7.414 -14.388 -22.209 786 2HZ LYS 93 HZ2 LYS 93 -8.363 -13.116 -21.777 787 3HZ LYS 93 HZ3 LYS 93 -7.614 -13.124 -23.231 788 H GLY 94 H GLY 94 -6.681 -16.234 -15.429 789 1HA GLY 94 HA2 GLY 94 -7.684 -18.702 -16.835 790 2HA GLY 94 HA3 GLY 94 -6.468 -18.720 -15.557 791 H GLU 95 H GLU 95 -8.247 -16.474 -14.150 792 HA GLU 95 HA GLU 95 -10.514 -18.180 -13.314 793 1HB GLU 95 HB2 GLU 95 -8.262 -18.446 -11.938 794 2HB GLU 95 HB3 GLU 95 -8.758 -16.927 -11.189 795 1HG GLU 95 HG2 GLU 95 -10.888 -18.015 -10.461 796 2HG GLU 95 HG3 GLU 95 -10.441 -19.478 -11.335 797 H GLU 96 H GLU 96 -10.227 -15.633 -14.749 798 HA GLU 96 HA GLU 96 -12.563 -14.392 -13.527 799 1HB GLU 96 HB2 GLU 96 -10.113 -12.710 -14.190 800 2HB GLU 96 HB3 GLU 96 -11.704 -12.047 -13.915 801 1HG GLU 96 HG2 GLU 96 -10.027 -13.545 -11.861 802 2HG GLU 96 HG3 GLU 96 -10.198 -11.807 -11.990 803 H ASP 97 H ASP 97 -10.244 -14.320 -16.288 804 HA ASP 97 HA ASP 97 -12.487 -13.552 -18.075 805 1HB ASP 97 HB2 ASP 97 -10.346 -12.293 -18.104 806 2HB ASP 97 HB3 ASP 97 -9.519 -13.756 -18.645 807 H LYS 98 H LYS 98 -12.771 -16.131 -17.012 808 HA LYS 98 HA LYS 98 -11.968 -18.300 -18.495 809 1HB LYS 98 HB2 LYS 98 -14.785 -17.625 -17.525 810 2HB LYS 98 HB3 LYS 98 -14.296 -19.228 -18.043 811 1HG LYS 98 HG2 LYS 98 -13.146 -17.757 -15.639 812 2HG LYS 98 HG3 LYS 98 -14.377 -19.022 -15.622 813 1HD LYS 98 HD2 LYS 98 -12.656 -20.541 -16.788 814 2HD LYS 98 HD3 LYS 98 -11.448 -19.295 -16.398 815 1HE LYS 98 HE2 LYS 98 -12.159 -19.487 -13.973 816 2HE LYS 98 HE3 LYS 98 -13.240 -20.807 -14.434 817 1HZ LYS 98 HZ1 LYS 98 -11.257 -22.028 -15.230 818 2HZ LYS 98 HZ2 LYS 98 -10.285 -20.804 -14.728 819 3HZ LYS 98 HZ3 LYS 98 -11.132 -21.680 -13.640 820 HA PRO 99 HA PRO 99 -13.499 -17.911 -22.677 821 1HB PRO 99 HB2 PRO 99 -13.752 -20.522 -23.469 822 2HB PRO 99 HB3 PRO 99 -12.172 -19.730 -23.187 823 1HG PRO 99 HG2 PRO 99 -13.739 -21.479 -21.265 824 2HG PRO 99 HG3 PRO 99 -12.010 -21.612 -21.722 825 1HD PRO 99 HD2 PRO 99 -12.793 -20.337 -19.457 826 2HD PRO 99 HD3 PRO 99 -11.432 -19.715 -20.439 827 H LEU 100 H LEU 100 -15.401 -19.344 -20.163 828 HA LEU 100 HA LEU 100 -17.817 -18.380 -21.416 829 1HB LEU 100 HB2 LEU 100 -19.027 -20.650 -21.093 830 2HB LEU 100 HB3 LEU 100 -18.083 -20.368 -22.537 831 HG LEU 100 HG LEU 100 -16.262 -21.785 -21.707 832 1HD1 LEU 100 1HD1 LEU 100 -16.413 -21.575 -19.283 833 2HD1 LEU 100 2HD1 LEU 100 -18.052 -22.272 -19.291 834 3HD1 LEU 100 3HD1 LEU 100 -16.642 -23.259 -19.734 835 1HD2 LEU 100 1HD2 LEU 100 -18.108 -22.738 -23.027 836 2HD2 LEU 100 2HD2 LEU 100 -17.453 -23.914 -21.877 837 3HD2 LEU 100 3HD2 LEU 100 -18.998 -23.103 -21.528 838 HA PRO 101 HA PRO 101 -18.945 -17.744 -17.163 839 1HB PRO 101 HB2 PRO 101 -21.630 -18.974 -17.748 840 2HB PRO 101 HB3 PRO 101 -21.259 -17.404 -16.966 841 1HG PRO 101 HG2 PRO 101 -22.115 -17.512 -19.542 842 2HG PRO 101 HG3 PRO 101 -20.801 -16.389 -19.071 843 1HD PRO 101 HD2 PRO 101 -20.566 -19.081 -20.408 844 2HD PRO 101 HD3 PRO 101 -19.707 -17.552 -20.769 845 HA PRO 102 HA PRO 102 -18.364 -21.812 -15.311 846 1HB PRO 102 HB2 PRO 102 -18.742 -21.273 -12.634 847 2HB PRO 102 HB3 PRO 102 -17.290 -20.808 -13.564 848 1HG PRO 102 HG2 PRO 102 -19.674 -19.088 -12.855 849 2HG PRO 102 HG3 PRO 102 -17.935 -18.677 -12.767 850 1HD PRO 102 HD2 PRO 102 -19.524 -17.921 -14.866 851 2HD PRO 102 HD3 PRO 102 -17.799 -18.330 -15.085 852 H ILE 103 H ILE 103 -21.146 -20.173 -13.611 853 HA ILE 103 HA ILE 103 -22.917 -22.092 -14.924 854 HB ILE 103 H5T ILE 103 -22.165 -23.021 -12.680 855 1HG1 ILE 103 2HG1 ILE 103 -24.243 -23.829 -11.831 856 2HG1 ILE 103 3HG1 ILE 103 -25.170 -22.597 -12.665 857 1HG2 ILE 103 1HG2 ILE 103 -22.047 -20.889 -11.441 858 2HG2 ILE 103 2HG2 ILE 103 -23.820 -20.757 -11.491 859 3HG2 ILE 103 3HG2 ILE 103 -23.045 -22.082 -10.605 860 1HD1 ILE 103 1HD1 ILE 103 -23.492 -24.746 -14.044 861 2HD1 ILE 103 2HD1 ILE 103 -25.245 -24.831 -13.773 862 3HD1 ILE 103 3HD1 ILE 103 -24.584 -23.585 -14.845 863 H LYS 104 H LYS 104 -22.338 -19.064 -14.602 864 HA LYS 104 HA LYS 104 -25.055 -18.022 -14.110 865 1HB LYS 104 HB2 LYS 104 -22.421 -16.728 -14.947 866 2HB LYS 104 HB3 LYS 104 -23.889 -15.830 -14.570 867 1HG LYS 104 HG2 LYS 104 -23.850 -16.891 -12.258 868 2HG LYS 104 HG3 LYS 104 -22.242 -17.516 -12.644 869 1HD LYS 104 HD2 LYS 104 -23.087 -14.591 -12.577 870 2HD LYS 104 HD3 LYS 104 -22.113 -15.420 -11.354 871 1HE LYS 104 HE2 LYS 104 -20.296 -15.776 -12.982 872 2HE LYS 104 HE3 LYS 104 -21.285 -15.082 -14.268 873 1HZ LYS 104 HZ1 LYS 104 -19.853 -13.391 -13.561 874 2HZ LYS 104 HZ2 LYS 104 -21.303 -12.984 -12.955 875 3HZ LYS 104 HZ3 LYS 104 -20.166 -13.619 -11.956 876 HA PRO 105 HA PRO 105 -26.123 -17.589 -18.484 877 1HB PRO 105 HB2 PRO 105 -27.535 -15.247 -18.593 878 2HB PRO 105 HB3 PRO 105 -28.167 -16.741 -17.840 879 1HG PRO 105 HG2 PRO 105 -26.823 -14.391 -16.462 880 2HG PRO 105 HG3 PRO 105 -28.366 -15.200 -16.025 881 1HD PRO 105 HD2 PRO 105 -26.042 -15.830 -14.781 882 2HD PRO 105 HD3 PRO 105 -27.240 -17.094 -15.172 883 H ARG 106 H ARG 106 -24.237 -15.117 -16.875 884 HA ARG 106 HA ARG 106 -22.815 -14.367 -19.383 885 1HB ARG 106 HB2 ARG 106 -23.998 -12.412 -17.348 886 2HB ARG 106 HB3 ARG 106 -22.888 -11.958 -18.631 887 1HG ARG 106 HG2 ARG 106 -25.689 -13.090 -19.052 888 2HG ARG 106 HG3 ARG 106 -25.262 -11.390 -19.111 889 1HD ARG 106 HD2 ARG 106 -24.108 -13.495 -20.992 890 2HD ARG 106 HD3 ARG 106 -25.507 -12.475 -21.343 891 HE ARG 106 H3T ARG 106 -23.359 -10.775 -20.581 892 1HH1 ARG 106 2HH2 ARG 106 -24.241 -12.798 -23.300 893 2HH1 ARG 106 1HH2 ARG 106 -23.361 -11.814 -24.438 894 1HH2 ARG 106 2HH1 ARG 106 -22.247 -9.568 -22.079 895 2HH2 ARG 106 1HH1 ARG 106 -22.261 -10.032 -23.754 896 H LYS 107 H LYS 107 -20.666 -13.617 -19.043 897 HA LYS 107 HA LYS 107 -19.268 -14.633 -16.754 898 1HB LYS 107 HB2 LYS 107 -18.502 -12.717 -18.985 899 2HB LYS 107 HB3 LYS 107 -17.386 -13.146 -17.683 900 1HG LYS 107 HG2 LYS 107 -17.450 -15.493 -18.261 901 2HG LYS 107 HG3 LYS 107 -18.743 -15.233 -19.433 902 1HD LYS 107 HD2 LYS 107 -16.581 -15.554 -20.528 903 2HD LYS 107 HD3 LYS 107 -17.288 -13.980 -20.901 904 1HE LYS 107 HE2 LYS 107 -15.766 -12.854 -19.361 905 2HE LYS 107 HE3 LYS 107 -15.145 -14.407 -18.772 906 1HZ LYS 107 HZ1 LYS 107 -14.872 -13.493 -21.587 907 2HZ LYS 107 HZ2 LYS 107 -13.677 -13.364 -20.478 908 3HZ LYS 107 HZ3 LYS 107 -14.218 -14.847 -20.914 Start of MODEL 8 1 1H ARG 1 H1 ARG 1 -8.198 0.325 -6.065 2 2H ARG 1 H2 ARG 1 -7.383 -0.715 -7.055 3 3H ARG 1 H3 ARG 1 -7.640 0.826 -7.517 4 HA ARG 1 HA ARG 1 -5.389 0.545 -6.911 5 1HB ARG 1 HB2 ARG 1 -6.581 2.707 -6.435 6 2HB ARG 1 HB3 ARG 1 -6.721 2.230 -4.750 7 1HG ARG 1 HG2 ARG 1 -4.035 2.355 -6.208 8 2HG ARG 1 HG3 ARG 1 -4.791 3.785 -5.506 9 1HD ARG 1 HD2 ARG 1 -4.775 2.764 -3.270 10 2HD ARG 1 HD3 ARG 1 -3.994 1.317 -3.897 11 HE ARG 1 H3T ARG 1 -2.773 3.909 -3.373 12 1HH1 ARG 1 2HH1 ARG 1 -2.285 0.941 -5.195 13 2HH1 ARG 1 1HH1 ARG 1 -0.550 1.145 -5.174 14 1HH2 ARG 1 1HH2 ARG 1 -0.553 4.041 -3.388 15 2HH2 ARG 1 2HH2 ARG 1 0.372 2.770 -4.144 16 H ALA 2 H ALA 2 -7.386 -0.270 -4.005 17 HA ALA 2 HA ALA 2 -4.996 -0.944 -2.523 18 1HB ALA 2 HB1 ALA 2 -7.934 -1.525 -1.937 19 2HB ALA 2 HB2 ALA 2 -6.592 -1.603 -0.776 20 3HB ALA 2 HB3 ALA 2 -7.054 -0.046 -1.484 21 H ASP 3 H ASP 3 -7.277 -2.999 -4.393 22 HA ASP 3 HA ASP 3 -6.131 -5.487 -3.434 23 1HB ASP 3 HB2 ASP 3 -7.716 -4.809 -5.946 24 2HB ASP 3 HB3 ASP 3 -7.281 -6.441 -5.443 25 H GLU 4 H GLU 4 -5.101 -3.125 -5.820 26 HA GLU 4 HA GLU 4 -3.213 -4.964 -7.228 27 1HB GLU 4 HB2 GLU 4 -3.281 -1.939 -7.237 28 2HB GLU 4 HB3 GLU 4 -2.369 -3.034 -8.275 29 1HG GLU 4 HG2 GLU 4 -4.037 -2.635 -9.731 30 2HG GLU 4 HG3 GLU 4 -4.850 -3.935 -8.870 31 H GLN 5 H GLN 5 -3.229 -2.345 -4.718 32 HA GLN 5 HA GLN 5 -0.457 -2.463 -4.170 33 1HB GLN 5 HB2 GLN 5 -2.055 -0.660 -3.458 34 2HB GLN 5 HB3 GLN 5 -2.744 -1.759 -2.272 35 1HG GLN 5 HG2 GLN 5 -1.174 -0.190 -1.237 36 2HG GLN 5 HG3 GLN 5 -0.619 -1.850 -1.053 37 1HE2 GLN 5 1HE2 GLN 5 1.211 -2.569 -2.382 38 2HE2 GLN 5 2HE2 GLN 5 2.314 -1.356 -3.035 39 H ALA 6 H ALA 6 -3.157 -4.214 -2.565 40 HA ALA 6 HA ALA 6 -1.595 -5.709 -0.737 41 1HB ALA 6 HB1 ALA 6 -3.595 -7.162 -0.621 42 2HB ALA 6 HB2 ALA 6 -4.041 -5.450 -0.595 43 3HB ALA 6 HB3 ALA 6 -4.250 -6.397 -2.084 44 H PHE 7 H PHE 7 -2.685 -6.673 -4.115 45 HA PHE 7 HA PHE 7 -1.138 -9.128 -3.856 46 1HB PHE 7 HB2 PHE 7 -3.251 -8.563 -5.364 47 2HB PHE 7 HB3 PHE 7 -2.006 -8.193 -6.550 48 HD1 PHE 7 HD1 PHE 7 -0.250 -10.062 -7.059 49 HD2 PHE 7 HD2 PHE 7 -3.883 -10.781 -4.857 50 HE1 PHE 7 HE1 PHE 7 0.016 -12.486 -7.437 51 HE2 PHE 7 HE2 PHE 7 -3.680 -13.202 -5.338 52 HZ PHE 7 HZ PHE 7 -1.695 -14.077 -6.557 53 H LEU 8 H LEU 8 -0.011 -5.952 -4.300 54 HA LEU 8 HA LEU 8 2.250 -6.901 -6.039 55 1HB LEU 8 HB2 LEU 8 1.215 -4.158 -5.309 56 2HB LEU 8 HB3 LEU 8 2.884 -4.385 -5.806 57 HG LEU 8 HG LEU 8 0.638 -5.513 -7.534 58 1HD1 LEU 8 1HD1 LEU 8 0.775 -3.410 -8.849 59 2HD1 LEU 8 2HD1 LEU 8 0.121 -3.150 -7.227 60 3HD1 LEU 8 3HD1 LEU 8 1.802 -2.707 -7.556 61 1HD2 LEU 8 1HD2 LEU 8 2.371 -5.147 -9.297 62 2HD2 LEU 8 2HD2 LEU 8 3.500 -4.567 -8.058 63 3HD2 LEU 8 3HD2 LEU 8 2.938 -6.252 -8.044 64 H VAL 9 H VAL 9 1.278 -6.007 -2.725 65 HA VAL 9 HA VAL 9 4.033 -6.152 -1.702 66 HB VAL 9 H5T VAL 9 1.320 -6.309 -0.345 67 1HG1 VAL 9 1HG1 VAL 9 2.841 -7.659 1.026 68 2HG1 VAL 9 2HG1 VAL 9 4.092 -6.395 0.934 69 3HG1 VAL 9 3HG1 VAL 9 2.573 -6.096 1.809 70 1HG2 VAL 9 1HG2 VAL 9 1.956 -4.128 0.567 71 2HG2 VAL 9 2HG2 VAL 9 3.551 -4.225 -0.219 72 3HG2 VAL 9 3HG2 VAL 9 2.083 -4.072 -1.196 73 H ALA 10 H ALA 10 1.265 -8.434 -2.018 74 HA ALA 10 HA ALA 10 2.654 -10.703 -0.985 75 1HB ALA 10 HB1 ALA 10 0.191 -10.554 -1.296 76 2HB ALA 10 HB2 ALA 10 0.424 -10.581 -3.064 77 3HB ALA 10 HB3 ALA 10 0.879 -11.987 -2.082 78 H LEU 11 H LEU 11 2.304 -9.590 -4.428 79 HA LEU 11 HA LEU 11 4.050 -11.624 -5.389 80 1HB LEU 11 HB2 LEU 11 2.367 -10.428 -6.787 81 2HB LEU 11 HB3 LEU 11 3.402 -8.993 -6.740 82 HG LEU 11 HG LEU 11 5.224 -10.318 -7.859 83 1HD1 LEU 11 1HD1 LEU 11 3.124 -12.510 -8.139 84 2HD1 LEU 11 2HD1 LEU 11 4.742 -12.465 -8.893 85 3HD1 LEU 11 3HD1 LEU 11 4.600 -12.611 -7.157 86 1HD2 LEU 11 1HD2 LEU 11 4.218 -10.357 -10.059 87 2HD2 LEU 11 2HD2 LEU 11 2.585 -10.462 -9.369 88 3HD2 LEU 11 3HD2 LEU 11 3.548 -8.989 -9.145 89 H TYR 12 H TYR 12 4.823 -8.289 -4.241 90 HA TYR 12 HA TYR 12 7.598 -8.351 -4.832 91 1HB TYR 12 HB2 TYR 12 6.775 -6.319 -3.946 92 2HB TYR 12 HB3 TYR 12 5.932 -7.121 -2.650 93 HD1 TYR 12 HD1 TYR 12 6.608 -5.977 -0.771 94 HD2 TYR 12 HD2 TYR 12 9.600 -7.528 -3.470 95 HE1 TYR 12 HE1 TYR 12 8.378 -5.435 0.880 96 HE2 TYR 12 HE2 TYR 12 11.371 -6.994 -1.798 97 HH TYR 12 HH TYR 12 10.626 -5.498 1.363 98 H LYS 13 H LYS 13 5.897 -9.696 -1.921 99 HA LYS 13 HA LYS 13 8.298 -10.811 -0.831 100 1HB LYS 13 HB2 LYS 13 5.368 -11.627 -0.505 101 2HB LYS 13 HB3 LYS 13 6.690 -12.383 0.394 102 1HG LYS 13 HG2 LYS 13 7.315 -10.251 1.404 103 2HG LYS 13 HG3 LYS 13 6.095 -9.389 0.458 104 1HD LYS 13 HD2 LYS 13 4.301 -10.714 1.563 105 2HD LYS 13 HD3 LYS 13 5.531 -11.564 2.523 106 1HE LYS 13 HE2 LYS 13 6.266 -9.378 3.479 107 2HE LYS 13 HE3 LYS 13 5.009 -8.556 2.545 108 1HZ LYS 13 HZ1 LYS 13 3.348 -9.857 3.785 109 2HZ LYS 13 HZ2 LYS 13 4.521 -10.602 4.647 110 3HZ LYS 13 HZ3 LYS 13 4.274 -9.000 4.818 111 H TYR 14 H TYR 14 5.881 -12.603 -2.953 112 HA TYR 14 HA TYR 14 7.449 -14.882 -3.185 113 1HB TYR 14 HB2 TYR 14 5.228 -14.842 -4.032 114 2HB TYR 14 HB3 TYR 14 5.526 -13.434 -5.022 115 HD1 TYR 14 HD1 TYR 14 5.572 -17.075 -4.948 116 HD2 TYR 14 HD2 TYR 14 6.816 -13.580 -7.153 117 HE1 TYR 14 HE1 TYR 14 5.905 -18.467 -6.995 118 HE2 TYR 14 HE2 TYR 14 7.193 -14.978 -9.167 119 HH TYR 14 HH TYR 14 6.618 -18.508 -9.176 120 H MET 15 H MET 15 7.688 -11.900 -5.102 121 HA MET 15 HA MET 15 9.557 -12.846 -6.991 122 1HB MET 15 HB2 MET 15 8.064 -10.978 -7.343 123 2HB MET 15 HB3 MET 15 8.801 -10.077 -5.999 124 1HG MET 15 HG2 MET 15 9.629 -9.256 -8.041 125 2HG MET 15 HG3 MET 15 10.886 -10.096 -7.115 126 1HE MET 15 HE1 MET 15 12.067 -10.715 -10.815 127 2HE MET 15 HE2 MET 15 11.338 -9.259 -10.100 128 3HE MET 15 HE3 MET 15 12.546 -10.194 -9.183 129 H LYS 16 H LYS 16 10.107 -10.858 -3.981 130 HA LYS 16 HA LYS 16 12.942 -10.949 -3.966 131 1HB LYS 16 HB2 LYS 16 11.598 -9.541 -2.516 132 2HB LYS 16 HB3 LYS 16 10.895 -10.923 -1.700 133 1HG LYS 16 HG2 LYS 16 13.905 -10.639 -1.661 134 2HG LYS 16 HG3 LYS 16 12.955 -9.510 -0.694 135 1HD LYS 16 HD2 LYS 16 11.921 -11.260 0.581 136 2HD LYS 16 HD3 LYS 16 12.563 -12.517 -0.483 137 1HE LYS 16 HE2 LYS 16 14.869 -11.927 0.172 138 2HE LYS 16 HE3 LYS 16 14.246 -10.692 1.279 139 1HZ LYS 16 HZ1 LYS 16 13.157 -12.432 2.542 140 2HZ LYS 16 HZ2 LYS 16 13.545 -13.585 1.451 141 3HZ LYS 16 HZ3 LYS 16 14.719 -12.878 2.361 142 H GLU 17 H GLU 17 10.604 -13.368 -2.867 143 HA GLU 17 HA GLU 17 12.701 -15.210 -1.979 144 1HB GLU 17 HB2 GLU 17 9.695 -15.484 -2.320 145 2HB GLU 17 HB3 GLU 17 10.711 -16.797 -1.753 146 1HG GLU 17 HG2 GLU 17 10.545 -14.096 -0.357 147 2HG GLU 17 HG3 GLU 17 9.587 -15.508 0.066 148 H ARG 18 H ARG 18 12.148 -14.366 -5.128 149 HA ARG 18 HA ARG 18 12.882 -17.107 -6.027 150 1HB ARG 18 HB2 ARG 18 10.672 -15.380 -7.166 151 2HB ARG 18 HB3 ARG 18 11.637 -16.368 -8.246 152 1HG ARG 18 HG2 ARG 18 9.859 -17.763 -7.812 153 2HG ARG 18 HG3 ARG 18 11.116 -18.377 -6.733 154 1HD ARG 18 HD2 ARG 18 10.039 -16.912 -4.913 155 2HD ARG 18 HD3 ARG 18 8.760 -16.588 -6.060 156 HE ARG 18 H3T ARG 18 7.935 -18.759 -5.789 157 1HH1 ARG 18 2HH2 ARG 18 10.975 -18.550 -3.997 158 2HH1 ARG 18 1HH2 ARG 18 10.681 -20.075 -3.207 159 1HH2 ARG 18 2HH1 ARG 18 7.662 -20.682 -4.711 160 2HH2 ARG 18 1HH1 ARG 18 8.870 -21.228 -3.588 161 H LYS 19 H LYS 19 13.007 -13.728 -7.099 162 HA LYS 19 HA LYS 19 15.675 -14.432 -8.319 163 1HB LYS 19 HB2 LYS 19 13.452 -12.880 -9.708 164 2HB LYS 19 HB3 LYS 19 15.101 -13.093 -10.300 165 1HG LYS 19 HG2 LYS 19 14.646 -15.636 -10.186 166 2HG LYS 19 HG3 LYS 19 12.938 -15.203 -10.038 167 1HD LYS 19 HD2 LYS 19 14.832 -14.487 -12.320 168 2HD LYS 19 HD3 LYS 19 13.556 -15.709 -12.360 169 1HE LYS 19 HE2 LYS 19 11.841 -13.946 -12.056 170 2HE LYS 19 HE3 LYS 19 13.108 -12.713 -11.995 171 1HZ LYS 19 HZ1 LYS 19 12.541 -14.455 -14.340 172 2HZ LYS 19 HZ2 LYS 19 12.189 -12.864 -14.238 173 3HZ LYS 19 HZ3 LYS 19 13.744 -13.356 -14.270 174 H THR 20 H THR 20 13.775 -11.942 -6.629 175 HA THR 20 HA THR 20 16.016 -10.228 -6.373 176 HB THR 20 H5T THR 20 14.131 -8.798 -8.237 177 HG1 THR 20 HG1 THR 20 16.158 -10.491 -9.207 178 1HG2 THR 20 1HG2 THR 20 15.900 -7.550 -7.213 179 2HG2 THR 20 2HG2 THR 20 17.118 -8.747 -7.731 180 3HG2 THR 20 3HG2 THR 20 16.278 -7.736 -8.930 181 HA PRO 21 HA PRO 21 12.910 -8.147 -3.691 182 1HB PRO 21 HB2 PRO 21 14.995 -5.968 -3.823 183 2HB PRO 21 HB3 PRO 21 14.087 -6.574 -2.400 184 1HG PRO 21 HG2 PRO 21 16.658 -7.317 -2.791 185 2HG PRO 21 HG3 PRO 21 15.446 -8.538 -2.284 186 1HD PRO 21 HD2 PRO 21 16.533 -8.004 -5.055 187 2HD PRO 21 HD3 PRO 21 16.265 -9.571 -4.228 188 H ILE 22 H ILE 22 11.478 -6.180 -3.983 189 HA ILE 22 HA ILE 22 10.962 -5.784 -6.764 190 HB ILE 22 H5T ILE 22 9.247 -5.886 -5.013 191 1HG1 ILE 22 2HG1 ILE 22 8.851 -3.326 -6.548 192 2HG1 ILE 22 3HG1 ILE 22 9.022 -4.862 -7.394 193 1HG2 ILE 22 1HG2 ILE 22 8.636 -3.918 -3.697 194 2HG2 ILE 22 2HG2 ILE 22 10.308 -4.359 -3.335 195 3HG2 ILE 22 3HG2 ILE 22 9.968 -2.982 -4.402 196 1HD1 ILE 22 1HD1 ILE 22 7.104 -5.806 -6.162 197 2HD1 ILE 22 2HD1 ILE 22 6.898 -4.263 -5.297 198 3HD1 ILE 22 3HD1 ILE 22 6.664 -4.340 -7.053 199 H GLU 23 H GLU 23 12.957 -3.797 -4.594 200 HA GLU 23 HA GLU 23 13.319 -1.577 -6.134 201 1HB GLU 23 HB2 GLU 23 15.582 -3.253 -4.975 202 2HB GLU 23 HB3 GLU 23 15.651 -1.553 -5.418 203 1HG GLU 23 HG2 GLU 23 15.313 -1.256 -3.218 204 2HG GLU 23 HG3 GLU 23 13.628 -1.313 -3.707 205 H ARG 24 H ARG 24 13.805 -4.683 -7.478 206 HA ARG 24 HA ARG 24 15.556 -4.332 -9.662 207 1HB ARG 24 HB2 ARG 24 14.251 -6.373 -8.945 208 2HB ARG 24 HB3 ARG 24 12.791 -5.625 -9.578 209 1HG ARG 24 HG2 ARG 24 13.864 -5.644 -11.876 210 2HG ARG 24 HG3 ARG 24 15.240 -6.513 -11.167 211 1HD ARG 24 HD2 ARG 24 13.714 -8.314 -10.435 212 2HD ARG 24 HD3 ARG 24 12.331 -7.423 -11.063 213 HE ARG 24 H3T ARG 24 14.560 -8.548 -12.740 214 1HH1 ARG 24 2HH2 ARG 24 11.099 -7.857 -12.504 215 2HH1 ARG 24 1HH2 ARG 24 10.819 -8.568 -14.090 216 1HH2 ARG 24 2HH1 ARG 24 14.007 -9.488 -14.691 217 2HH2 ARG 24 1HH1 ARG 24 12.316 -9.586 -15.143 218 H ILE 25 H ILE 25 12.454 -2.843 -9.073 219 HA ILE 25 HA ILE 25 11.506 -1.966 -11.471 220 HB ILE 25 H5T ILE 25 11.470 -1.000 -8.659 221 1HG1 ILE 25 2HG1 ILE 25 9.293 -1.521 -10.739 222 2HG1 ILE 25 3HG1 ILE 25 9.963 -2.730 -9.643 223 1HG2 ILE 25 1HG2 ILE 25 10.112 0.996 -9.105 224 2HG2 ILE 25 2HG2 ILE 25 11.760 1.185 -9.646 225 3HG2 ILE 25 3HG2 ILE 25 10.469 0.850 -10.837 226 1HD1 ILE 25 1HD1 ILE 25 9.159 -1.316 -7.699 227 2HD1 ILE 25 2HD1 ILE 25 8.284 -0.314 -8.877 228 3HD1 ILE 25 3HD1 ILE 25 7.883 -2.025 -8.712 229 HA PRO 26 HA PRO 26 14.646 0.697 -13.176 230 1HB PRO 26 HB2 PRO 26 13.412 1.524 -15.451 231 2HB PRO 26 HB3 PRO 26 13.799 -0.193 -15.162 232 1HG PRO 26 HG2 PRO 26 11.155 1.219 -14.624 233 2HG PRO 26 HG3 PRO 26 11.424 -0.262 -15.597 234 1HD PRO 26 HD2 PRO 26 10.707 -0.425 -12.979 235 2HD PRO 26 HD3 PRO 26 11.899 -1.547 -13.663 236 H TYR 27 H TYR 27 11.926 2.041 -11.632 237 HA TYR 27 HA TYR 27 11.052 4.119 -11.362 238 1HB TYR 27 HB2 TYR 27 13.252 4.124 -10.189 239 2HB TYR 27 HB3 TYR 27 13.889 5.143 -11.467 240 HD1 TYR 27 HD1 TYR 27 11.552 4.881 -8.602 241 HD2 TYR 27 HD2 TYR 27 13.198 7.526 -11.593 242 HE1 TYR 27 HE1 TYR 27 10.644 6.856 -7.371 243 HE2 TYR 27 HE2 TYR 27 12.262 9.483 -10.377 244 HH TYR 27 HH TYR 27 11.065 10.203 -8.564 245 H LEU 28 H LEU 28 10.583 3.422 -13.688 246 HA LEU 28 HA LEU 28 10.500 3.667 -15.981 247 1HB LEU 28 HB2 LEU 28 8.622 4.451 -14.375 248 2HB LEU 28 HB3 LEU 28 9.056 6.066 -14.828 249 HG LEU 28 HG LEU 28 7.075 4.600 -15.872 250 1HD1 LEU 28 1HD1 LEU 28 8.552 6.643 -17.548 251 2HD1 LEU 28 2HD1 LEU 28 6.881 6.121 -17.735 252 3HD1 LEU 28 3HD1 LEU 28 7.367 6.995 -16.284 253 1HD2 LEU 28 1HD2 LEU 28 9.275 4.211 -17.917 254 2HD2 LEU 28 2HD2 LEU 28 8.516 2.937 -16.933 255 3HD2 LEU 28 3HD2 LEU 28 7.551 3.827 -18.118 256 H GLY 29 H GLY 29 13.105 4.831 -15.451 257 1HA GLY 29 HA2 GLY 29 14.627 6.136 -16.667 258 2HA GLY 29 HA3 GLY 29 13.315 6.757 -17.671 259 H PHE 30 H PHE 30 11.630 7.755 -15.582 260 HA PHE 30 HA PHE 30 13.223 9.669 -13.991 261 1HB PHE 30 HB2 PHE 30 12.194 11.599 -14.916 262 2HB PHE 30 HB3 PHE 30 12.724 10.653 -16.289 263 HD1 PHE 30 HD1 PHE 30 10.914 9.136 -17.475 264 HD2 PHE 30 HD2 PHE 30 9.930 12.279 -14.684 265 HE1 PHE 30 HE1 PHE 30 8.573 9.107 -18.269 266 HE2 PHE 30 HE2 PHE 30 7.582 12.246 -15.480 267 HZ PHE 30 HZ PHE 30 6.893 10.657 -17.268 268 H LYS 31 H LYS 31 10.475 7.595 -13.976 269 HA LYS 31 HA LYS 31 9.127 9.253 -11.830 270 1HB LYS 31 HB2 LYS 31 8.090 9.506 -14.061 271 2HB LYS 31 HB3 LYS 31 8.008 7.775 -14.233 272 1HG LYS 31 HG2 LYS 31 6.438 7.916 -12.092 273 2HG LYS 31 HG3 LYS 31 6.259 9.594 -12.624 274 1HD LYS 31 HD2 LYS 31 5.692 8.602 -14.967 275 2HD LYS 31 HD3 LYS 31 5.691 7.024 -14.170 276 1HE LYS 31 HE2 LYS 31 3.457 7.476 -14.049 277 2HE LYS 31 HE3 LYS 31 3.979 8.156 -12.507 278 1HZ LYS 31 HZ1 LYS 31 4.076 10.358 -13.696 279 2HZ LYS 31 HZ2 LYS 31 3.421 9.647 -15.029 280 3HZ LYS 31 HZ3 LYS 31 2.571 9.731 -13.646 281 H GLN 32 H GLN 32 8.250 8.161 -10.115 282 HA GLN 32 HA GLN 32 9.020 5.550 -9.372 283 1HB GLN 32 HB2 GLN 32 7.903 7.563 -8.047 284 2HB GLN 32 HB3 GLN 32 6.385 6.805 -8.504 285 1HG GLN 32 HG2 GLN 32 8.624 5.689 -6.773 286 2HG GLN 32 HG3 GLN 32 6.993 6.126 -6.274 287 1HE2 GLN 32 1HE2 GLN 32 5.152 4.721 -7.498 288 2HE2 GLN 32 2HE2 GLN 32 5.611 3.039 -7.714 289 H ILE 33 H ILE 33 8.366 3.514 -10.026 290 HA ILE 33 HA ILE 33 6.303 3.236 -12.059 291 HB ILE 33 H5T ILE 33 8.114 1.351 -10.564 292 1HG1 ILE 33 2HG1 ILE 33 8.984 2.764 -12.467 293 2HG1 ILE 33 3HG1 ILE 33 9.190 1.033 -12.642 294 1HG2 ILE 33 1HG2 ILE 33 5.849 0.550 -12.405 295 2HG2 ILE 33 2HG2 ILE 33 7.287 -0.471 -12.152 296 3HG2 ILE 33 3HG2 ILE 33 6.242 -0.074 -10.795 297 1HD1 ILE 33 1HD1 ILE 33 7.036 2.620 -14.081 298 2HD1 ILE 33 2HD1 ILE 33 8.582 2.065 -14.763 299 3HD1 ILE 33 3HD1 ILE 33 7.380 0.885 -14.268 300 H ASN 34 H ASN 34 4.485 4.042 -11.206 301 HA ASN 34 HA ASN 34 3.032 2.834 -8.953 302 1HB ASN 34 HB2 ASN 34 2.292 4.710 -11.239 303 2HB ASN 34 HB3 ASN 34 1.133 4.129 -10.054 304 1HD2 ASN 34 1HD2 ASN 34 1.205 6.729 -10.085 305 2HD2 ASN 34 2HD2 ASN 34 2.159 7.375 -8.760 306 H LEU 35 H LEU 35 3.520 0.631 -9.567 307 HA LEU 35 HA LEU 35 3.163 -0.569 -12.005 308 1HB LEU 35 HB2 LEU 35 4.150 -1.344 -9.669 309 2HB LEU 35 HB3 LEU 35 2.598 -2.115 -9.519 310 HG LEU 35 HG LEU 35 4.086 -3.747 -10.268 311 1HD1 LEU 35 1HD1 LEU 35 2.750 -2.882 -12.854 312 2HD1 LEU 35 2HD1 LEU 35 3.323 -4.495 -12.410 313 3HD1 LEU 35 3HD1 LEU 35 1.950 -3.788 -11.543 314 1HD2 LEU 35 1HD2 LEU 35 5.064 -1.886 -12.428 315 2HD2 LEU 35 2HD2 LEU 35 5.946 -2.415 -10.980 316 3HD2 LEU 35 3HD2 LEU 35 5.540 -3.579 -12.241 317 H TRP 36 H TRP 36 0.626 -0.248 -9.526 318 HA TRP 36 HA TRP 36 -1.608 -1.549 -10.693 319 1HB TRP 36 HB2 TRP 36 -2.876 0.202 -9.395 320 2HB TRP 36 HB3 TRP 36 -1.721 -0.790 -8.516 321 HD1 TRP 36 HD1 TRP 36 -2.294 2.827 -9.531 322 HE1 TRP 36 HE1 TRP 36 -0.669 4.345 -8.261 323 HE3 TRP 36 HE3 TRP 36 0.537 -0.756 -7.223 324 HZ2 TRP 36 HZ2 TRP 36 1.596 4.056 -6.495 325 HZ3 TRP 36 HZ3 TRP 36 2.429 -0.108 -5.751 326 HH2 TRP 36 HH2 TRP 36 2.974 2.289 -5.392 327 H THR 37 H THR 37 -0.348 1.796 -11.240 328 HA THR 37 HA THR 37 -2.408 2.626 -13.083 329 HB THR 37 H5T THR 37 0.306 3.883 -12.582 330 HG1 THR 37 HG1 THR 37 -1.090 5.291 -11.317 331 1HG2 THR 37 1HG2 THR 37 -0.704 4.752 -14.653 332 2HG2 THR 37 2HG2 THR 37 -2.254 4.994 -13.820 333 3HG2 THR 37 3HG2 THR 37 -0.826 5.955 -13.372 334 H MET 38 H MET 38 1.041 1.566 -13.580 335 HA MET 38 HA MET 38 0.753 1.779 -16.464 336 1HB MET 38 HB2 MET 38 2.820 0.441 -16.634 337 2HB MET 38 HB3 MET 38 2.961 1.927 -15.699 338 1HG MET 38 HG2 MET 38 3.074 0.818 -13.656 339 2HG MET 38 HG3 MET 38 2.447 -0.702 -14.315 340 1HE MET 38 HE1 MET 38 5.291 -2.573 -15.743 341 2HE MET 38 HE2 MET 38 3.683 -2.584 -14.995 342 3HE MET 38 HE3 MET 38 3.925 -1.783 -16.569 343 H PHE 39 H PHE 39 0.007 -0.862 -14.201 344 HA PHE 39 HA PHE 39 -0.650 -2.846 -16.193 345 1HB PHE 39 HB2 PHE 39 -0.501 -3.520 -13.928 346 2HB PHE 39 HB3 PHE 39 -1.620 -2.278 -13.390 347 HD1 PHE 39 HD1 PHE 39 -1.704 -4.919 -16.086 348 HD2 PHE 39 HD2 PHE 39 -3.679 -3.127 -12.692 349 HE1 PHE 39 HE1 PHE 39 -3.627 -6.464 -16.385 350 HE2 PHE 39 HE2 PHE 39 -5.629 -4.631 -13.039 351 HZ PHE 39 HZ PHE 39 -5.591 -6.280 -14.907 352 H GLN 40 H GLN 40 -2.953 -0.507 -14.562 353 HA GLN 40 HA GLN 40 -4.967 -1.194 -16.490 354 1HB GLN 40 HB2 GLN 40 -6.313 0.559 -15.604 355 2HB GLN 40 HB3 GLN 40 -5.490 -0.294 -14.301 356 1HG GLN 40 HG2 GLN 40 -3.743 1.626 -14.442 357 2HG GLN 40 HG3 GLN 40 -4.963 2.500 -15.364 358 1HE2 GLN 40 2HE2 GLN 40 -4.233 0.914 -12.241 359 2HE2 GLN 40 1HE2 GLN 40 -5.439 1.802 -11.314 360 H ALA 41 H ALA 41 -2.401 1.265 -16.752 361 HA ALA 41 HA ALA 41 -3.352 2.471 -19.167 362 1HB ALA 41 HB1 ALA 41 -0.491 1.988 -18.235 363 2HB ALA 41 HB2 ALA 41 -0.999 3.124 -19.486 364 3HB ALA 41 HB3 ALA 41 -1.501 3.391 -17.802 365 H ALA 42 H ALA 42 -1.179 -0.421 -18.698 366 HA ALA 42 HA ALA 42 -0.943 -1.055 -21.455 367 1HB ALA 42 HB1 ALA 42 -0.917 -2.936 -19.057 368 2HB ALA 42 HB2 ALA 42 -0.253 -3.267 -20.670 369 3HB ALA 42 HB3 ALA 42 0.473 -2.006 -19.658 370 H GLN 43 H GLN 43 -3.594 -1.836 -19.155 371 HA GLN 43 HA GLN 43 -5.006 -3.589 -20.919 372 1HB GLN 43 HB2 GLN 43 -6.068 -1.786 -18.719 373 2HB GLN 43 HB3 GLN 43 -7.013 -2.991 -19.576 374 1HG GLN 43 HG2 GLN 43 -4.566 -3.574 -17.851 375 2HG GLN 43 HG3 GLN 43 -6.239 -3.830 -17.389 376 1HE2 GLN 43 1HE2 GLN 43 -3.530 -5.423 -18.577 377 2HE2 GLN 43 2HE2 GLN 43 -4.378 -6.792 -19.285 378 H LYS 44 H LYS 44 -5.124 -0.017 -20.603 379 HA LYS 44 HA LYS 44 -7.156 0.352 -22.619 380 1HB LYS 44 HB2 LYS 44 -4.964 2.242 -21.638 381 2HB LYS 44 HB3 LYS 44 -6.293 2.702 -22.703 382 1HG LYS 44 HG2 LYS 44 -7.933 2.214 -20.928 383 2HG LYS 44 HG3 LYS 44 -6.631 1.679 -19.853 384 1HD LYS 44 HD2 LYS 44 -5.573 3.973 -20.103 385 2HD LYS 44 HD3 LYS 44 -7.013 4.475 -21.013 386 1HE LYS 44 HE2 LYS 44 -8.410 3.839 -19.003 387 2HE LYS 44 HE3 LYS 44 -6.914 3.468 -18.135 388 1HZ LYS 44 HZ1 LYS 44 -7.706 6.129 -19.190 389 2HZ LYS 44 HZ2 LYS 44 -7.578 5.717 -17.616 390 3HZ LYS 44 HZ3 LYS 44 -6.237 5.829 -18.560 391 H LEU 45 H LEU 45 -3.587 0.587 -22.739 392 HA LEU 45 HA LEU 45 -3.649 0.676 -25.565 393 1HB LEU 45 HB2 LEU 45 -1.377 0.264 -23.597 394 2HB LEU 45 HB3 LEU 45 -1.125 0.321 -25.326 395 HG LEU 45 HG LEU 45 -0.522 2.412 -24.637 396 1HD1 LEU 45 1HD1 LEU 45 -3.400 2.842 -25.526 397 2HD1 LEU 45 2HD1 LEU 45 -2.067 3.988 -25.651 398 3HD1 LEU 45 3HD1 LEU 45 -2.020 2.496 -26.603 399 1HD2 LEU 45 1HD2 LEU 45 -1.768 3.967 -23.257 400 2HD2 LEU 45 2HD2 LEU 45 -3.076 2.796 -23.041 401 3HD2 LEU 45 3HD2 LEU 45 -1.454 2.473 -22.374 402 H GLY 46 H GLY 46 -4.845 -1.870 -24.174 403 1HA GLY 46 HA2 GLY 46 -5.488 -3.563 -25.712 404 2HA GLY 46 HA3 GLY 46 -3.910 -3.564 -26.460 405 H GLY 47 H GLY 47 -4.425 -3.859 -22.955 406 1HA GLY 47 HA2 GLY 47 -3.733 -5.452 -21.464 407 2HA GLY 47 HA3 GLY 47 -4.162 -6.674 -22.665 408 H TYR 48 H TYR 48 -2.207 -7.638 -21.449 409 HA TYR 48 HA TYR 48 0.439 -6.775 -22.367 410 1HB TYR 48 HB2 TYR 48 -0.023 -8.134 -20.283 411 2HB TYR 48 HB3 TYR 48 -0.506 -9.471 -21.308 412 HD1 TYR 48 HD1 TYR 48 1.120 -11.144 -21.529 413 HD2 TYR 48 HD2 TYR 48 2.402 -7.057 -21.046 414 HE1 TYR 48 HE1 TYR 48 3.493 -11.891 -21.514 415 HE2 TYR 48 HE2 TYR 48 4.776 -7.803 -21.041 416 HH TYR 48 HH TYR 48 5.690 -11.256 -21.354 417 H GLU 49 H GLU 49 -2.266 -8.542 -23.738 418 HA GLU 49 HA GLU 49 -0.746 -10.280 -25.405 419 1HB GLU 49 HB2 GLU 49 -3.608 -9.233 -25.685 420 2HB GLU 49 HB3 GLU 49 -2.908 -10.535 -26.634 421 1HG GLU 49 HG2 GLU 49 -4.144 -11.618 -24.994 422 2HG GLU 49 HG3 GLU 49 -2.464 -11.817 -24.523 423 H THR 50 H THR 50 -2.456 -7.229 -26.419 424 HA THR 50 HA THR 50 -1.209 -7.172 -28.999 425 HB THR 50 H5T THR 50 -2.358 -4.856 -27.405 426 HG1 THR 50 HG1 THR 50 -4.236 -5.357 -28.567 427 1HG2 THR 50 1HG2 THR 50 -1.946 -5.236 -30.408 428 2HG2 THR 50 2HG2 THR 50 -2.822 -3.882 -29.651 429 3HG2 THR 50 3HG2 THR 50 -1.087 -4.071 -29.376 430 H ILE 51 H ILE 51 -0.184 -5.997 -25.790 431 HA ILE 51 HA ILE 51 2.048 -4.441 -26.709 432 HB ILE 51 H5T ILE 51 0.939 -5.441 -24.182 433 1HG1 ILE 51 2HG1 ILE 51 2.040 -3.348 -23.315 434 2HG1 ILE 51 3HG1 ILE 51 2.671 -3.064 -24.936 435 1HG2 ILE 51 1HG2 ILE 51 2.926 -5.394 -22.803 436 2HG2 ILE 51 2HG2 ILE 51 2.907 -6.783 -23.871 437 3HG2 ILE 51 3HG2 ILE 51 3.946 -5.397 -24.265 438 1HD1 ILE 51 1HD1 ILE 51 0.185 -3.135 -25.719 439 2HD1 ILE 51 2HD1 ILE 51 -0.228 -3.098 -23.995 440 3HD1 ILE 51 3HD1 ILE 51 0.666 -1.754 -24.718 441 H THR 52 H THR 52 1.840 -7.921 -25.815 442 HA THR 52 HA THR 52 4.577 -8.445 -26.390 443 HB THR 52 H5T THR 52 2.240 -10.392 -26.499 444 HG1 THR 52 HG1 THR 52 2.367 -9.448 -24.503 445 1HG2 THR 52 1HG2 THR 52 5.251 -10.797 -26.144 446 2HG2 THR 52 2HG2 THR 52 4.014 -12.055 -25.893 447 3HG2 THR 52 3HG2 THR 52 4.268 -11.371 -27.505 448 H ALA 53 H ALA 53 1.644 -8.720 -28.458 449 HA ALA 53 HA ALA 53 2.997 -9.749 -30.753 450 1HB ALA 53 HB1 ALA 53 0.558 -9.880 -30.353 451 2HB ALA 53 HB2 ALA 53 0.431 -8.113 -30.516 452 3HB ALA 53 HB3 ALA 53 0.917 -9.104 -31.906 453 H ARG 54 H ARG 54 3.029 -6.474 -29.455 454 HA ARG 54 HA ARG 54 4.279 -5.471 -32.005 455 1HB ARG 54 HB2 ARG 54 2.080 -4.077 -30.419 456 2HB ARG 54 HB3 ARG 54 2.881 -3.457 -31.868 457 1HG ARG 54 HG2 ARG 54 1.937 -5.343 -33.188 458 2HG ARG 54 HG3 ARG 54 1.032 -5.860 -31.747 459 1HD ARG 54 HD2 ARG 54 -0.087 -3.664 -31.647 460 2HD ARG 54 HD3 ARG 54 0.795 -3.121 -33.076 461 HE ARG 54 H3T ARG 54 -1.479 -4.992 -32.955 462 1HH1 ARG 54 2HH2 ARG 54 1.052 -3.771 -35.053 463 2HH1 ARG 54 1HH2 ARG 54 0.222 -4.288 -36.496 464 1HH2 ARG 54 2HH1 ARG 54 -2.473 -5.625 -34.831 465 2HH2 ARG 54 1HH1 ARG 54 -1.716 -5.315 -36.364 466 H ARG 55 H ARG 55 4.236 -2.827 -30.896 467 HA ARG 55 HA ARG 55 6.098 -2.812 -28.573 468 1HB ARG 55 HB2 ARG 55 6.681 -1.387 -31.206 469 2HB ARG 55 HB3 ARG 55 7.598 -1.222 -29.696 470 1HG ARG 55 HG2 ARG 55 8.085 -3.702 -29.789 471 2HG ARG 55 HG3 ARG 55 7.336 -3.734 -31.397 472 1HD ARG 55 HD2 ARG 55 8.998 -1.994 -32.142 473 2HD ARG 55 HD3 ARG 55 9.753 -2.101 -30.550 474 HE ARG 55 H3T ARG 55 10.654 -4.195 -31.068 475 1HH1 ARG 55 2HH2 ARG 55 8.588 -3.237 -33.741 476 2HH1 ARG 55 1HH2 ARG 55 9.226 -4.475 -34.786 477 1HH2 ARG 55 2HH1 ARG 55 11.417 -5.739 -32.459 478 2HH2 ARG 55 1HH1 ARG 55 10.792 -5.844 -34.077 479 H GLN 56 H GLN 56 3.616 -2.413 -28.120 480 HA GLN 56 HA GLN 56 2.700 0.320 -28.680 481 1HB GLN 56 HB2 GLN 56 1.584 -2.031 -27.138 482 2HB GLN 56 HB3 GLN 56 0.793 -0.454 -27.100 483 1HG GLN 56 HG2 GLN 56 1.303 -2.117 -29.601 484 2HG GLN 56 HG3 GLN 56 -0.232 -1.952 -28.746 485 1HE2 GLN 56 1HE2 GLN 56 -1.130 0.363 -28.581 486 2HE2 GLN 56 2HE2 GLN 56 -0.822 1.411 -29.961 487 H TRP 57 H TRP 57 4.830 -0.906 -26.343 488 HA TRP 57 HA TRP 57 4.246 0.450 -23.985 489 1HB TRP 57 HB2 TRP 57 7.008 0.070 -25.171 490 2HB TRP 57 HB3 TRP 57 6.590 0.427 -23.528 491 HD1 TRP 57 HD1 TRP 57 6.663 -2.461 -25.951 492 HE1 TRP 57 HE1 TRP 57 6.068 -4.649 -24.727 493 HE3 TRP 57 HE3 TRP 57 5.266 -0.508 -21.421 494 HZ2 TRP 57 HZ2 TRP 57 5.256 -5.446 -22.069 495 HZ3 TRP 57 HZ3 TRP 57 4.514 -2.000 -19.596 496 HH2 TRP 57 HH2 TRP 57 4.516 -4.465 -19.918 497 H LYS 58 H LYS 58 5.666 1.944 -26.945 498 HA LYS 58 HA LYS 58 6.150 4.461 -25.606 499 1HB LYS 58 HB2 LYS 58 5.737 3.970 -28.573 500 2HB LYS 58 HB3 LYS 58 6.369 5.444 -27.846 501 1HG LYS 58 HG2 LYS 58 7.674 2.716 -27.987 502 2HG LYS 58 HG3 LYS 58 8.248 4.243 -28.646 503 1HD LYS 58 HD2 LYS 58 8.239 3.375 -25.728 504 2HD LYS 58 HD3 LYS 58 9.624 3.626 -26.774 505 1HE LYS 58 HE2 LYS 58 9.137 6.053 -26.896 506 2HE LYS 58 HE3 LYS 58 7.717 5.827 -25.871 507 1HZ LYS 58 HZ1 LYS 58 9.281 4.943 -24.132 508 2HZ LYS 58 HZ2 LYS 58 10.538 5.366 -25.071 509 3HZ LYS 58 HZ3 LYS 58 9.530 6.524 -24.496 510 H HIS 59 H HIS 59 3.112 3.132 -26.733 511 HA HIS 59 HA HIS 59 1.797 5.737 -26.231 512 1HB HIS 59 HB2 HIS 59 0.624 3.027 -26.937 513 2HB HIS 59 HB3 HIS 59 -0.231 4.574 -26.874 514 HD1 HIS 59 HD1 HIS 59 0.492 6.422 -28.816 515 HD2 HIS 59 HD2 HIS 59 1.909 2.478 -29.198 516 HE1 HIS 59 HE1 HIS 59 1.329 6.190 -31.211 517 H ILE 60 H ILE 60 2.639 2.850 -24.416 518 HA ILE 60 HA ILE 60 0.722 3.319 -22.227 519 HB ILE 60 H5T ILE 60 3.312 1.722 -22.359 520 1HG1 ILE 60 2HG1 ILE 60 0.405 0.889 -21.958 521 2HG1 ILE 60 3HG1 ILE 60 1.238 0.834 -23.513 522 1HG2 ILE 60 1HG2 ILE 60 2.780 0.957 -20.045 523 2HG2 ILE 60 2HG2 ILE 60 3.107 2.667 -20.085 524 3HG2 ILE 60 3HG2 ILE 60 1.428 2.105 -19.987 525 1HD1 ILE 60 1HD1 ILE 60 2.797 -0.841 -22.688 526 2HD1 ILE 60 2HD1 ILE 60 2.061 -0.796 -21.071 527 3HD1 ILE 60 3HD1 ILE 60 1.123 -1.367 -22.440 528 H TYR 61 H TYR 61 4.137 4.097 -22.938 529 HA TYR 61 HA TYR 61 4.757 5.924 -20.928 530 1HB TYR 61 HB2 TYR 61 6.408 5.214 -22.457 531 2HB TYR 61 HB3 TYR 61 5.442 5.616 -23.844 532 HD1 TYR 61 HD1 TYR 61 5.252 7.970 -24.654 533 HD2 TYR 61 HD2 TYR 61 7.967 6.774 -21.527 534 HE1 TYR 61 HE1 TYR 61 6.656 9.963 -25.119 535 HE2 TYR 61 HE2 TYR 61 9.411 8.761 -22.031 536 HH TYR 61 HH TYR 61 8.560 11.101 -24.614 537 H ASP 62 H ASP 62 2.935 6.534 -23.954 538 HA ASP 62 HA ASP 62 2.432 9.255 -23.516 539 1HB ASP 62 HB2 ASP 62 2.044 8.079 -25.657 540 2HB ASP 62 HB3 ASP 62 0.561 7.402 -24.978 541 H GLU 63 H GLU 63 0.250 6.506 -22.573 542 HA GLU 63 HA GLU 63 -1.462 8.132 -20.987 543 1HB GLU 63 HB2 GLU 63 -1.997 5.875 -21.803 544 2HB GLU 63 HB3 GLU 63 -0.755 5.184 -20.778 545 1HG GLU 63 HG2 GLU 63 -2.869 4.753 -19.801 546 2HG GLU 63 HG3 GLU 63 -2.015 5.875 -18.756 547 H LEU 64 H LEU 64 1.680 6.686 -20.049 548 HA LEU 64 HA LEU 64 1.411 7.272 -17.221 549 1HB LEU 64 HB2 LEU 64 3.995 6.941 -18.807 550 2HB LEU 64 HB3 LEU 64 3.814 6.878 -17.063 551 HG LEU 64 HG LEU 64 2.926 4.858 -19.101 552 1HD1 LEU 64 1HD1 LEU 64 4.727 4.659 -16.686 553 2HD1 LEU 64 2HD1 LEU 64 4.291 3.324 -17.779 554 3HD1 LEU 64 3HD1 LEU 64 5.212 4.697 -18.401 555 1HD2 LEU 64 1HD2 LEU 64 2.211 4.838 -16.141 556 2HD2 LEU 64 2HD2 LEU 64 1.056 4.995 -17.488 557 3HD2 LEU 64 3HD2 LEU 64 1.962 3.502 -17.291 558 H GLY 65 H GLY 65 2.221 9.326 -19.939 559 1HA GLY 65 HA2 GLY 65 2.287 11.688 -19.793 560 2HA GLY 65 HA3 GLY 65 2.630 11.608 -18.065 561 H GLY 66 H GLY 66 4.460 9.527 -20.264 562 1HA GLY 66 HA2 GLY 66 6.965 10.164 -19.560 563 2HA GLY 66 HA3 GLY 66 6.555 9.690 -21.191 564 H ASN 67 H ASN 67 8.788 11.167 -20.483 565 HA ASN 67 HA ASN 67 8.367 13.870 -21.676 566 1HB ASN 67 HB2 ASN 67 9.610 13.063 -19.015 567 2HB ASN 67 HB3 ASN 67 10.017 14.593 -19.781 568 1HD2 ASN 67 1HD2 ASN 67 7.962 13.233 -17.541 569 2HD2 ASN 67 2HD2 ASN 67 6.682 14.431 -17.625 570 HA PRO 68 HA PRO 68 12.020 13.033 -23.991 571 1HB PRO 68 HB2 PRO 68 13.217 15.502 -24.259 572 2HB PRO 68 HB3 PRO 68 11.711 15.022 -25.097 573 1HG PRO 68 HG2 PRO 68 11.985 16.589 -22.515 574 2HG PRO 68 HG3 PRO 68 10.971 16.974 -23.940 575 1HD PRO 68 HD2 PRO 68 9.934 15.741 -21.771 576 2HD PRO 68 HD3 PRO 68 9.423 15.258 -23.416 577 H GLY 69 H GLY 69 14.258 12.665 -23.903 578 1HA GLY 69 HA2 GLY 69 16.357 12.463 -22.840 579 2HA GLY 69 HA3 GLY 69 15.760 13.313 -21.420 580 H SER 70 H SER 70 13.607 10.837 -22.485 581 HA SER 70 HA SER 70 14.748 8.739 -20.670 582 1HB SER 70 HB2 SER 70 11.933 9.881 -20.461 583 2HB SER 70 HB3 SER 70 12.580 8.512 -19.540 584 HG SER 70 HG SER 70 12.588 10.706 -18.529 585 H THR 71 H THR 71 14.729 8.796 -23.512 586 HA THR 71 HA THR 71 12.439 7.788 -24.765 587 HB THR 71 H5T THR 71 14.396 8.754 -25.894 588 HG1 THR 71 HG1 THR 71 14.207 7.439 -27.692 589 1HG2 THR 71 1HG2 THR 71 16.224 7.454 -24.785 590 2HG2 THR 71 2HG2 THR 71 15.684 5.995 -25.650 591 3HG2 THR 71 3HG2 THR 71 16.300 7.396 -26.548 592 H SER 72 H SER 72 14.779 5.919 -22.909 593 HA SER 72 HA SER 72 13.913 3.283 -23.724 594 1HB SER 72 HB2 SER 72 15.174 2.581 -21.687 595 2HB SER 72 HB3 SER 72 16.107 3.625 -22.773 596 HG SER 72 HG SER 72 16.296 4.277 -20.570 597 H ALA 73 H ALA 73 12.350 5.632 -21.679 598 HA ALA 73 HA ALA 73 11.180 3.905 -19.783 599 1HB ALA 73 HB1 ALA 73 10.168 6.507 -21.025 600 2HB ALA 73 HB2 ALA 73 9.494 5.776 -19.562 601 3HB ALA 73 HB3 ALA 73 11.176 6.348 -19.576 602 H ALA 74 H ALA 74 9.117 2.940 -19.642 603 HA ALA 74 HA ALA 74 7.599 1.408 -20.294 604 1HB ALA 74 HB1 ALA 74 6.046 1.867 -21.929 605 2HB ALA 74 HB2 ALA 74 6.487 3.386 -21.164 606 3HB ALA 74 HB3 ALA 74 7.140 2.987 -22.781 607 H THR 75 H THR 75 10.055 1.983 -22.863 608 HA THR 75 HA THR 75 9.814 -0.702 -23.929 609 HB THR 75 H5T THR 75 12.253 1.141 -23.947 610 HG1 THR 75 HG1 THR 75 11.412 1.845 -25.928 611 1HG2 THR 75 1HG2 THR 75 12.750 -0.004 -26.100 612 2HG2 THR 75 2HG2 THR 75 12.758 -1.141 -24.751 613 3HG2 THR 75 3HG2 THR 75 11.359 -1.084 -25.842 614 H CYS 76 H CYS 76 11.898 0.739 -21.347 615 HA CYS 76 HA CYS 76 13.128 -1.822 -20.675 616 1HB CYS 76 HB2 CYS 76 14.046 0.496 -20.168 617 2HB CYS 76 HB3 CYS 76 12.787 0.668 -18.931 618 HG CYS 76 HG CYS 76 15.096 0.052 -17.803 619 H THR 77 H THR 77 10.284 -0.024 -19.327 620 HA THR 77 HA THR 77 9.424 -1.764 -17.434 621 HB THR 77 H5T THR 77 7.556 -0.615 -19.516 622 HG1 THR 77 HG1 THR 77 7.606 1.122 -17.865 623 1HG2 THR 77 1HG2 THR 77 6.037 -0.316 -17.632 624 2HG2 THR 77 2HG2 THR 77 6.400 -2.019 -17.903 625 3HG2 THR 77 3HG2 THR 77 7.193 -1.152 -16.560 626 H ARG 78 H ARG 78 9.304 -2.595 -20.931 627 HA ARG 78 HA ARG 78 7.612 -4.848 -20.723 628 1HB ARG 78 HB2 ARG 78 8.493 -3.692 -22.828 629 2HB ARG 78 HB3 ARG 78 10.056 -4.454 -22.534 630 1HG ARG 78 HG2 ARG 78 9.045 -6.700 -22.827 631 2HG ARG 78 HG3 ARG 78 7.458 -5.950 -23.071 632 1HD ARG 78 HD2 ARG 78 8.482 -4.685 -25.034 633 2HD ARG 78 HD3 ARG 78 9.934 -5.662 -24.825 634 HE ARG 78 H3T ARG 78 8.442 -7.686 -25.164 635 1HH1 ARG 78 2HH2 ARG 78 7.670 -4.694 -26.825 636 2HH1 ARG 78 1HH2 ARG 78 6.591 -5.508 -27.943 637 1HH2 ARG 78 2HH1 ARG 78 7.260 -8.646 -26.776 638 2HH2 ARG 78 1HH1 ARG 78 6.427 -7.658 -27.947 639 H ARG 79 H ARG 79 10.967 -4.485 -19.685 640 HA ARG 79 HA ARG 79 10.907 -7.351 -19.053 641 1HB ARG 79 HB2 ARG 79 13.387 -7.241 -18.799 642 2HB ARG 79 HB3 ARG 79 12.821 -6.826 -20.409 643 1HG ARG 79 HG2 ARG 79 13.162 -4.487 -20.064 644 2HG ARG 79 HG3 ARG 79 13.461 -4.697 -18.328 645 1HD ARG 79 HD2 ARG 79 15.214 -5.820 -20.552 646 2HD ARG 79 HD3 ARG 79 15.490 -4.263 -19.783 647 HE ARG 79 H3T ARG 79 16.068 -6.899 -18.676 648 1HH1 ARG 79 2HH2 ARG 79 15.441 -3.588 -17.704 649 2HH1 ARG 79 1HH2 ARG 79 16.394 -3.732 -16.265 650 1HH2 ARG 79 2HH1 ARG 79 17.237 -7.025 -16.793 651 2HH2 ARG 79 1HH1 ARG 79 17.388 -5.630 -15.763 652 H HIS 80 H HIS 80 9.584 -5.197 -17.549 653 HA HIS 80 HA HIS 80 10.314 -6.324 -14.880 654 1HB HIS 80 HB2 HIS 80 9.483 -3.457 -15.401 655 2HB HIS 80 HB3 HIS 80 9.700 -4.210 -13.815 656 HD1 HIS 80 HD1 HIS 80 12.311 -5.039 -13.270 657 HD2 HIS 80 HD2 HIS 80 11.687 -2.545 -16.584 658 HE1 HIS 80 HE1 HIS 80 14.597 -4.132 -13.918 659 H TYR 81 H TYR 81 7.741 -5.266 -17.122 660 HA TYR 81 HA TYR 81 5.504 -5.929 -15.495 661 1HB TYR 81 HB2 TYR 81 5.667 -4.744 -17.762 662 2HB TYR 81 HB3 TYR 81 5.836 -6.320 -18.503 663 HD1 TYR 81 HD1 TYR 81 3.578 -3.765 -17.532 664 HD2 TYR 81 HD2 TYR 81 3.838 -8.030 -18.089 665 HE1 TYR 81 HE1 TYR 81 1.121 -3.865 -17.879 666 HE2 TYR 81 HE2 TYR 81 1.378 -8.141 -18.373 667 HH TYR 81 HH TYR 81 -0.587 -6.941 -18.526 668 H GLU 82 H GLU 82 7.846 -7.995 -17.154 669 HA GLU 82 HA GLU 82 6.243 -10.354 -17.417 670 1HB GLU 82 HB2 GLU 82 8.530 -11.419 -17.831 671 2HB GLU 82 HB3 GLU 82 7.941 -10.205 -18.946 672 1HG GLU 82 HG2 GLU 82 10.314 -9.919 -18.567 673 2HG GLU 82 HG3 GLU 82 9.408 -8.516 -18.031 674 H ARG 83 H ARG 83 7.759 -8.982 -14.616 675 HA ARG 83 HA ARG 83 6.918 -11.400 -13.270 676 1HB ARG 83 HB2 ARG 83 9.580 -11.202 -13.764 677 2HB ARG 83 HB3 ARG 83 9.511 -10.365 -12.221 678 1HG ARG 83 HG2 ARG 83 9.963 -12.679 -11.761 679 2HG ARG 83 HG3 ARG 83 8.283 -12.414 -11.283 680 1HD ARG 83 HD2 ARG 83 7.623 -13.325 -13.586 681 2HD ARG 83 HD3 ARG 83 9.321 -13.752 -13.812 682 HE ARG 83 H3T ARG 83 8.461 -14.875 -11.349 683 1HH1 ARG 83 2HH1 ARG 83 7.826 -15.316 -14.762 684 2HH1 ARG 83 1HH1 ARG 83 7.283 -16.957 -14.549 685 1HH2 ARG 83 2HH2 ARG 83 7.609 -16.974 -11.131 686 2HH2 ARG 83 1HH2 ARG 83 7.219 -17.864 -12.566 687 H LEU 84 H LEU 84 6.517 -8.141 -13.222 688 HA LEU 84 HA LEU 84 5.697 -8.310 -10.337 689 1HB LEU 84 HB2 LEU 84 6.575 -5.930 -12.005 690 2HB LEU 84 HB3 LEU 84 5.684 -5.770 -10.512 691 HG LEU 84 HG LEU 84 7.874 -5.364 -9.966 692 1HD1 LEU 84 1HD1 LEU 84 6.649 -6.837 -8.356 693 2HD1 LEU 84 2HD1 LEU 84 7.475 -8.243 -9.063 694 3HD1 LEU 84 3HD1 LEU 84 8.415 -6.982 -8.261 695 1HD2 LEU 84 1HD2 LEU 84 8.837 -8.007 -11.089 696 2HD2 LEU 84 2HD2 LEU 84 9.022 -6.422 -11.885 697 3HD2 LEU 84 3HD2 LEU 84 9.798 -6.731 -10.318 698 H ILE 85 H ILE 85 4.317 -8.538 -13.400 699 HA ILE 85 HA ILE 85 1.751 -8.505 -12.016 700 HB ILE 85 H5T ILE 85 1.831 -6.215 -12.582 701 1HG1 ILE 85 2HG1 ILE 85 -0.303 -7.626 -13.017 702 2HG1 ILE 85 3HG1 ILE 85 -0.244 -5.927 -13.447 703 1HG2 ILE 85 1HG2 ILE 85 2.481 -6.941 -15.440 704 2HG2 ILE 85 2HG2 ILE 85 2.019 -5.319 -14.889 705 3HG2 ILE 85 3HG2 ILE 85 3.500 -6.062 -14.288 706 1HD1 ILE 85 1HD1 ILE 85 -1.358 -7.383 -15.137 707 2HD1 ILE 85 2HD1 ILE 85 -0.024 -6.410 -15.768 708 3HD1 ILE 85 3HD1 ILE 85 0.197 -8.147 -15.493 709 H LEU 86 H LEU 86 3.496 -9.246 -15.070 710 HA LEU 86 HA LEU 86 1.526 -10.888 -16.184 711 1HB LEU 86 HB2 LEU 86 3.611 -10.299 -17.236 712 2HB LEU 86 HB3 LEU 86 4.532 -11.275 -16.122 713 HG LEU 86 HG LEU 86 4.239 -12.159 -18.430 714 1HD1 LEU 86 1HD1 LEU 86 4.024 -14.453 -17.852 715 2HD1 LEU 86 2HD1 LEU 86 4.847 -13.637 -16.515 716 3HD1 LEU 86 3HD1 LEU 86 3.131 -14.097 -16.370 717 1HD2 LEU 86 1HD2 LEU 86 1.861 -11.536 -18.751 718 2HD2 LEU 86 2HD2 LEU 86 2.202 -13.234 -19.128 719 3HD2 LEU 86 3HD2 LEU 86 1.386 -12.811 -17.615 720 HA PRO 87 HA PRO 87 2.547 -14.445 -13.076 721 1HB PRO 87 HB2 PRO 87 3.397 -12.827 -10.700 722 2HB PRO 87 HB3 PRO 87 3.895 -14.482 -11.168 723 1HG PRO 87 HG2 PRO 87 5.560 -12.413 -11.590 724 2HG PRO 87 HG3 PRO 87 5.328 -13.638 -12.884 725 1HD PRO 87 HD2 PRO 87 3.986 -10.932 -12.622 726 2HD PRO 87 HD3 PRO 87 4.801 -11.643 -14.046 727 H TYR 88 H TYR 88 1.165 -11.247 -12.064 728 HA TYR 88 HA TYR 88 -0.729 -12.712 -10.344 729 1HB TYR 88 HB2 TYR 88 -1.356 -10.909 -9.280 730 2HB TYR 88 HB3 TYR 88 0.353 -10.708 -9.432 731 HD1 TYR 88 HD1 TYR 88 -2.871 -9.630 -11.130 732 HD2 TYR 88 HD2 TYR 88 1.022 -8.487 -9.645 733 HE1 TYR 88 HE1 TYR 88 -3.420 -7.232 -11.501 734 HE2 TYR 88 HE2 TYR 88 0.455 -6.109 -10.009 735 HH TYR 88 HH TYR 88 -1.134 -4.603 -10.664 736 H GLU 89 H GLU 89 -0.802 -10.926 -13.451 737 HA GLU 89 HA GLU 89 -3.629 -11.080 -13.670 738 1HB GLU 89 HB2 GLU 89 -3.434 -10.393 -15.868 739 2HB GLU 89 HB3 GLU 89 -2.114 -9.655 -15.005 740 1HG GLU 89 HG2 GLU 89 -1.043 -10.271 -16.931 741 2HG GLU 89 HG3 GLU 89 -0.666 -11.630 -15.885 742 H ARG 90 H ARG 90 -1.349 -13.713 -13.823 743 HA ARG 90 HA ARG 90 -2.939 -15.581 -15.245 744 1HB ARG 90 HB2 ARG 90 -1.272 -16.238 -12.805 745 2HB ARG 90 HB3 ARG 90 -1.737 -17.295 -14.137 746 1HG ARG 90 HG2 ARG 90 0.353 -15.149 -14.058 747 2HG ARG 90 HG3 ARG 90 0.538 -16.841 -14.479 748 1HD ARG 90 HD2 ARG 90 -0.824 -14.707 -16.166 749 2HD ARG 90 HD3 ARG 90 0.787 -15.369 -16.434 750 HE ARG 90 H3T ARG 90 -0.922 -17.592 -16.445 751 1HH1 ARG 90 2HH1 ARG 90 -0.939 -14.669 -18.421 752 2HH1 ARG 90 1HH1 ARG 90 -1.143 -15.609 -19.884 753 1HH2 ARG 90 2HH2 ARG 90 -1.452 -18.591 -18.145 754 2HH2 ARG 90 1HH2 ARG 90 -1.568 -17.825 -19.735 755 H PHE 91 H PHE 91 -3.522 -14.326 -11.915 756 HA PHE 91 HA PHE 91 -5.520 -16.419 -11.435 757 1HB PHE 91 HB2 PHE 91 -6.325 -15.110 -9.563 758 2HB PHE 91 HB3 PHE 91 -4.596 -15.325 -9.507 759 HD1 PHE 91 HD1 PHE 91 -3.481 -13.577 -8.550 760 HD2 PHE 91 HD2 PHE 91 -6.992 -12.676 -10.890 761 HE1 PHE 91 HE1 PHE 91 -3.168 -11.165 -8.138 762 HE2 PHE 91 HE2 PHE 91 -6.603 -10.257 -10.534 763 HZ PHE 91 HZ PHE 91 -4.630 -9.499 -9.169 764 H ILE 92 H ILE 92 -5.607 -13.631 -13.478 765 HA ILE 92 HA ILE 92 -8.546 -14.077 -13.692 766 HB ILE 92 H5T ILE 92 -7.709 -11.793 -13.010 767 1HG1 ILE 92 2HG1 ILE 92 -9.505 -11.830 -15.471 768 2HG1 ILE 92 3HG1 ILE 92 -10.005 -12.403 -13.874 769 1HG2 ILE 92 1HG2 ILE 92 -7.077 -10.224 -14.840 770 2HG2 ILE 92 2HG2 ILE 92 -5.871 -11.445 -14.521 771 3HG2 ILE 92 3HG2 ILE 92 -6.921 -11.603 -15.949 772 1HD1 ILE 92 1HD1 ILE 92 -9.514 -10.141 -12.928 773 2HD1 ILE 92 2HD1 ILE 92 -9.193 -9.557 -14.580 774 3HD1 ILE 92 3HD1 ILE 92 -10.798 -10.158 -14.155 775 H LYS 93 H LYS 93 -6.057 -15.481 -14.842 776 HA LYS 93 HA LYS 93 -7.383 -15.916 -17.489 777 1HB LYS 93 HB2 LYS 93 -4.637 -16.626 -16.390 778 2HB LYS 93 HB3 LYS 93 -5.289 -17.310 -17.857 779 1HG LYS 93 HG2 LYS 93 -4.864 -14.323 -17.433 780 2HG LYS 93 HG3 LYS 93 -3.748 -15.414 -18.259 781 1HD LYS 93 HD2 LYS 93 -5.726 -16.017 -19.803 782 2HD LYS 93 HD3 LYS 93 -6.541 -14.592 -19.157 783 1HE LYS 93 HE2 LYS 93 -3.784 -14.578 -20.480 784 2HE LYS 93 HE3 LYS 93 -5.292 -14.294 -21.347 785 1HZ LYS 93 HZ1 LYS 93 -4.323 -12.209 -20.787 786 2HZ LYS 93 HZ2 LYS 93 -5.666 -12.362 -19.865 787 3HZ LYS 93 HZ3 LYS 93 -4.176 -12.570 -19.197 788 H GLY 94 H GLY 94 -7.538 -17.193 -14.356 789 1HA GLY 94 HA2 GLY 94 -9.511 -18.996 -15.217 790 2HA GLY 94 HA3 GLY 94 -8.046 -19.953 -15.013 791 H GLU 95 H GLU 95 -7.933 -17.507 -12.711 792 HA GLU 95 HA GLU 95 -7.866 -17.576 -10.469 793 1HB GLU 95 HB2 GLU 95 -10.340 -17.371 -10.851 794 2HB GLU 95 HB3 GLU 95 -10.491 -19.104 -10.609 795 1HG GLU 95 HG2 GLU 95 -11.136 -17.818 -8.630 796 2HG GLU 95 HG3 GLU 95 -9.797 -18.882 -8.271 797 H GLU 96 H GLU 96 -6.532 -19.513 -11.996 798 HA GLU 96 HA GLU 96 -5.957 -21.684 -10.119 799 1HB GLU 96 HB2 GLU 96 -7.948 -22.418 -11.404 800 2HB GLU 96 HB3 GLU 96 -7.098 -22.097 -12.924 801 1HG GLU 96 HG2 GLU 96 -5.465 -23.812 -12.426 802 2HG GLU 96 HG3 GLU 96 -6.169 -24.077 -10.820 803 H ASP 97 H ASP 97 -5.301 -20.397 -13.501 804 HA ASP 97 HA ASP 97 -2.751 -21.516 -13.622 805 1HB ASP 97 HB2 ASP 97 -4.198 -20.421 -15.436 806 2HB ASP 97 HB3 ASP 97 -3.489 -18.887 -14.938 807 H LYS 98 H LYS 98 -3.563 -19.194 -11.370 808 HA LYS 98 HA LYS 98 -1.217 -17.621 -11.116 809 1HB LYS 98 HB2 LYS 98 -1.915 -17.368 -8.765 810 2HB LYS 98 HB3 LYS 98 -3.213 -17.103 -9.924 811 1HG LYS 98 HG2 LYS 98 -3.998 -19.501 -9.454 812 2HG LYS 98 HG3 LYS 98 -2.815 -19.539 -8.136 813 1HD LYS 98 HD2 LYS 98 -3.945 -17.611 -7.071 814 2HD LYS 98 HD3 LYS 98 -5.085 -17.522 -8.432 815 1HE LYS 98 HE2 LYS 98 -5.826 -19.855 -7.934 816 2HE LYS 98 HE3 LYS 98 -4.759 -19.877 -6.519 817 1HZ LYS 98 HZ1 LYS 98 -6.058 -18.007 -5.621 818 2HZ LYS 98 HZ2 LYS 98 -7.017 -17.978 -6.949 819 3HZ LYS 98 HZ3 LYS 98 -7.057 -19.264 -5.939 820 HA PRO 99 HA PRO 99 1.990 -20.526 -10.369 821 1HB PRO 99 HB2 PRO 99 2.968 -18.556 -8.287 822 2HB PRO 99 HB3 PRO 99 3.904 -19.432 -9.540 823 1HG PRO 99 HG2 PRO 99 3.168 -16.859 -9.946 824 2HG PRO 99 HG3 PRO 99 3.011 -18.054 -11.272 825 1HD PRO 99 HD2 PRO 99 0.859 -16.971 -9.456 826 2HD PRO 99 HD3 PRO 99 0.820 -17.306 -11.215 827 H LEU 100 H LEU 100 1.705 -22.449 -9.360 828 HA LEU 100 HA LEU 100 1.574 -24.015 -7.735 829 1HB LEU 100 HB2 LEU 100 2.655 -21.936 -5.825 830 2HB LEU 100 HB3 LEU 100 2.553 -23.667 -5.539 831 HG LEU 100 HG LEU 100 4.265 -22.328 -7.684 832 1HD1 LEU 100 1HD1 LEU 100 6.148 -23.012 -6.270 833 2HD1 LEU 100 2HD1 LEU 100 5.055 -21.938 -5.381 834 3HD1 LEU 100 3HD1 LEU 100 5.026 -23.691 -5.069 835 1HD2 LEU 100 1HD2 LEU 100 3.623 -24.588 -8.420 836 2HD2 LEU 100 2HD2 LEU 100 5.314 -24.569 -7.921 837 3HD2 LEU 100 3HD2 LEU 100 4.086 -25.253 -6.834 838 HA PRO 101 HA PRO 101 -2.508 -22.254 -6.449 839 1HB PRO 101 HB2 PRO 101 -4.196 -23.790 -7.966 840 2HB PRO 101 HB3 PRO 101 -3.312 -22.380 -8.619 841 1HG PRO 101 HG2 PRO 101 -2.497 -25.309 -8.760 842 2HG PRO 101 HG3 PRO 101 -2.607 -24.135 -10.111 843 1HD PRO 101 HD2 PRO 101 -0.269 -24.688 -8.829 844 2HD PRO 101 HD3 PRO 101 -0.644 -23.049 -9.428 845 HA PRO 102 HA PRO 102 -3.768 -25.301 -3.387 846 1HB PRO 102 HB2 PRO 102 -6.602 -24.851 -4.329 847 2HB PRO 102 HB3 PRO 102 -5.950 -24.829 -2.661 848 1HG PRO 102 HG2 PRO 102 -6.453 -22.517 -3.943 849 2HG PRO 102 HG3 PRO 102 -4.919 -22.702 -3.026 850 1HD PRO 102 HD2 PRO 102 -5.378 -23.013 -6.005 851 2HD PRO 102 HD3 PRO 102 -4.104 -22.103 -5.140 852 H ILE 103 H ILE 103 -3.286 -26.579 -6.141 853 HA ILE 103 HA ILE 103 -4.935 -29.013 -5.757 854 HB ILE 103 H5T ILE 103 -5.440 -29.162 -8.182 855 1HG1 ILE 103 2HG1 ILE 103 -4.617 -26.232 -8.345 856 2HG1 ILE 103 3HG1 ILE 103 -3.612 -27.564 -8.926 857 1HG2 ILE 103 1HG2 ILE 103 -6.632 -26.653 -6.944 858 2HG2 ILE 103 2HG2 ILE 103 -7.371 -27.728 -8.146 859 3HG2 ILE 103 3HG2 ILE 103 -7.090 -28.313 -6.507 860 1HD1 ILE 103 1HD1 ILE 103 -5.430 -28.221 -10.508 861 2HD1 ILE 103 2HD1 ILE 103 -6.353 -26.788 -9.996 862 3HD1 ILE 103 3HD1 ILE 103 -4.788 -26.594 -10.797 863 H LYS 104 H LYS 104 -2.159 -28.327 -5.228 864 HA LYS 104 HA LYS 104 -1.033 -30.750 -6.449 865 1HB LYS 104 HB2 LYS 104 -0.504 -28.785 -8.011 866 2HB LYS 104 HB3 LYS 104 0.432 -28.087 -6.702 867 1HG LYS 104 HG2 LYS 104 1.977 -29.152 -8.140 868 2HG LYS 104 HG3 LYS 104 1.871 -30.205 -6.733 869 1HD LYS 104 HD2 LYS 104 0.196 -31.626 -8.050 870 2HD LYS 104 HD3 LYS 104 0.504 -30.596 -9.443 871 1HE LYS 104 HE2 LYS 104 2.554 -32.331 -7.981 872 2HE LYS 104 HE3 LYS 104 1.761 -32.723 -9.508 873 1HZ LYS 104 HZ1 LYS 104 2.820 -30.634 -10.407 874 2HZ LYS 104 HZ2 LYS 104 3.721 -30.547 -9.027 875 3HZ LYS 104 HZ3 LYS 104 3.877 -31.818 -10.024 876 HA PRO 105 HA PRO 105 0.953 -30.868 -2.329 877 1HB PRO 105 HB2 PRO 105 2.838 -32.726 -3.796 878 2HB PRO 105 HB3 PRO 105 2.060 -32.939 -2.199 879 1HG PRO 105 HG2 PRO 105 1.097 -34.231 -4.359 880 2HG PRO 105 HG3 PRO 105 -0.048 -33.426 -3.233 881 1HD PRO 105 HD2 PRO 105 1.048 -32.375 -5.860 882 2HD PRO 105 HD3 PRO 105 -0.646 -32.429 -5.274 883 H ARG 106 H ARG 106 1.771 -28.671 -4.072 884 HA ARG 106 HA ARG 106 3.342 -27.314 -4.876 885 1HB ARG 106 HB2 ARG 106 4.789 -26.303 -3.242 886 2HB ARG 106 HB3 ARG 106 3.174 -26.587 -2.640 887 1HG ARG 106 HG2 ARG 106 4.778 -26.960 -0.900 888 2HG ARG 106 HG3 ARG 106 3.958 -28.464 -1.262 889 1HD ARG 106 HD2 ARG 106 5.969 -29.226 -2.553 890 2HD ARG 106 HD3 ARG 106 6.736 -27.669 -2.249 891 HE ARG 106 H3T ARG 106 7.218 -28.304 -0.068 892 1HH1 ARG 106 2HH2 ARG 106 5.031 -30.739 -1.369 893 2HH1 ARG 106 1HH2 ARG 106 5.380 -31.849 -0.065 894 1HH2 ARG 106 2HH1 ARG 106 7.571 -29.765 1.560 895 2HH2 ARG 106 1HH1 ARG 106 6.759 -31.301 1.545 896 H LYS 107 H LYS 107 4.471 -30.439 -4.758 897 HA LYS 107 HA LYS 107 7.165 -30.073 -5.608 898 1HB LYS 107 HB2 LYS 107 6.124 -32.208 -4.883 899 2HB LYS 107 HB3 LYS 107 5.162 -32.242 -6.367 900 1HG LYS 107 HG2 LYS 107 7.231 -32.345 -7.720 901 2HG LYS 107 HG3 LYS 107 8.218 -32.263 -6.259 902 1HD LYS 107 HD2 LYS 107 6.239 -34.476 -6.972 903 2HD LYS 107 HD3 LYS 107 7.979 -34.575 -7.203 904 1HE LYS 107 HE2 LYS 107 6.589 -34.265 -4.498 905 2HE LYS 107 HE3 LYS 107 7.138 -35.789 -5.186 906 1HZ LYS 107 HZ1 LYS 107 8.779 -34.901 -3.656 907 2HZ LYS 107 HZ2 LYS 107 9.414 -34.933 -5.157 908 3HZ LYS 107 HZ3 LYS 107 8.924 -33.515 -4.503 Start of MODEL 9 1 1H ARG 1 H1 ARG 1 -6.101 2.166 -7.672 2 2H ARG 1 H2 ARG 1 -7.074 1.474 -6.548 3 3H ARG 1 H3 ARG 1 -6.238 0.538 -7.613 4 HA ARG 1 HA ARG 1 -4.156 1.133 -6.716 5 1HB ARG 1 HB2 ARG 1 -4.572 3.426 -6.077 6 2HB ARG 1 HB3 ARG 1 -5.755 2.942 -4.874 7 1HG ARG 1 HG2 ARG 1 -3.746 3.590 -3.735 8 2HG ARG 1 HG3 ARG 1 -3.963 1.878 -3.511 9 1HD ARG 1 HD2 ARG 1 -1.737 1.953 -3.906 10 2HD ARG 1 HD3 ARG 1 -2.284 1.642 -5.557 11 HE ARG 1 H3T ARG 1 -2.212 4.302 -5.642 12 1HH1 ARG 1 2HH2 ARG 1 0.255 2.191 -4.247 13 2HH1 ARG 1 1HH2 ARG 1 1.465 3.440 -4.362 14 1HH2 ARG 1 2HH1 ARG 1 -0.623 5.832 -5.651 15 2HH2 ARG 1 1HH1 ARG 1 0.986 5.421 -5.145 16 H ALA 2 H ALA 2 -6.179 1.050 -3.770 17 HA ALA 2 HA ALA 2 -4.807 -0.839 -2.633 18 1HB ALA 2 HB1 ALA 2 -6.737 -1.354 -1.194 19 2HB ALA 2 HB2 ALA 2 -6.666 0.370 -1.602 20 3HB ALA 2 HB3 ALA 2 -7.832 -0.694 -2.425 21 H ASP 3 H ASP 3 -7.151 -2.095 -5.071 22 HA ASP 3 HA ASP 3 -6.792 -4.846 -4.146 23 1HB ASP 3 HB2 ASP 3 -8.819 -4.043 -5.344 24 2HB ASP 3 HB3 ASP 3 -7.841 -3.746 -6.781 25 H GLU 4 H GLU 4 -5.331 -2.760 -6.651 26 HA GLU 4 HA GLU 4 -3.567 -4.775 -7.810 27 1HB GLU 4 HB2 GLU 4 -3.106 -1.790 -7.722 28 2HB GLU 4 HB3 GLU 4 -2.456 -2.981 -8.837 29 1HG GLU 4 HG2 GLU 4 -4.066 -2.167 -10.204 30 2HG GLU 4 HG3 GLU 4 -5.074 -3.360 -9.396 31 H GLN 5 H GLN 5 -3.292 -2.268 -5.264 32 HA GLN 5 HA GLN 5 -0.630 -2.731 -4.623 33 1HB GLN 5 HB2 GLN 5 -2.202 -0.827 -3.892 34 2HB GLN 5 HB3 GLN 5 -2.809 -1.921 -2.650 35 1HG GLN 5 HG2 GLN 5 -1.157 -0.482 -1.659 36 2HG GLN 5 HG3 GLN 5 -0.467 -2.097 -1.735 37 1HE2 GLN 5 1HE2 GLN 5 1.499 -2.339 -2.848 38 2HE2 GLN 5 2HE2 GLN 5 2.234 -1.045 -3.787 39 H ALA 6 H ALA 6 -3.576 -4.285 -3.280 40 HA ALA 6 HA ALA 6 -2.238 -5.997 -1.412 41 1HB ALA 6 HB1 ALA 6 -4.884 -6.367 -2.888 42 2HB ALA 6 HB2 ALA 6 -4.348 -7.280 -1.461 43 3HB ALA 6 HB3 ALA 6 -4.648 -5.538 -1.334 44 H PHE 7 H PHE 7 -3.256 -6.653 -4.849 45 HA PHE 7 HA PHE 7 -1.992 -9.240 -4.750 46 1HB PHE 7 HB2 PHE 7 -2.785 -9.668 -6.807 47 2HB PHE 7 HB3 PHE 7 -3.979 -8.594 -6.109 48 HD1 PHE 7 HD1 PHE 7 -5.037 -7.299 -7.684 49 HD2 PHE 7 HD2 PHE 7 -0.878 -8.270 -8.320 50 HE1 PHE 7 HE1 PHE 7 -5.102 -6.178 -9.892 51 HE2 PHE 7 HE2 PHE 7 -0.937 -7.087 -10.470 52 HZ PHE 7 HZ PHE 7 -3.042 -6.035 -11.282 53 H LEU 8 H LEU 8 -0.493 -6.196 -5.001 54 HA LEU 8 HA LEU 8 1.799 -7.359 -6.549 55 1HB LEU 8 HB2 LEU 8 1.063 -4.503 -5.821 56 2HB LEU 8 HB3 LEU 8 2.646 -4.967 -6.446 57 HG LEU 8 HG LEU 8 0.051 -5.502 -7.961 58 1HD1 LEU 8 1HD1 LEU 8 0.371 -3.103 -7.692 59 2HD1 LEU 8 2HD1 LEU 8 2.052 -3.240 -8.236 60 3HD1 LEU 8 3HD1 LEU 8 0.711 -3.584 -9.360 61 1HD2 LEU 8 1HD2 LEU 8 1.632 -5.722 -9.896 62 2HD2 LEU 8 2HD2 LEU 8 2.975 -5.711 -8.737 63 3HD2 LEU 8 3HD2 LEU 8 1.770 -7.010 -8.703 64 H VAL 9 H VAL 9 0.678 -6.402 -3.322 65 HA VAL 9 HA VAL 9 3.340 -6.703 -2.112 66 HB VAL 9 H5T VAL 9 0.529 -6.611 -0.985 67 1HG1 VAL 9 1HG1 VAL 9 3.130 -7.047 0.547 68 2HG1 VAL 9 2HG1 VAL 9 1.578 -6.571 1.278 69 3HG1 VAL 9 3HG1 VAL 9 1.729 -8.146 0.494 70 1HG2 VAL 9 1HG2 VAL 9 1.651 -4.470 -1.715 71 2HG2 VAL 9 2HG2 VAL 9 1.324 -4.530 0.022 72 3HG2 VAL 9 3HG2 VAL 9 2.970 -4.812 -0.581 73 H ALA 10 H ALA 10 0.467 -8.761 -2.672 74 HA ALA 10 HA ALA 10 1.572 -11.195 -1.753 75 1HB ALA 10 HB1 ALA 10 -0.089 -12.257 -3.217 76 2HB ALA 10 HB2 ALA 10 -0.796 -10.863 -2.370 77 3HB ALA 10 HB3 ALA 10 -0.339 -10.725 -4.079 78 H LEU 11 H LEU 11 1.779 -9.864 -5.159 79 HA LEU 11 HA LEU 11 3.679 -11.753 -6.055 80 1HB LEU 11 HB2 LEU 11 2.565 -10.181 -7.552 81 2HB LEU 11 HB3 LEU 11 3.479 -8.829 -6.881 82 HG LEU 11 HG LEU 11 5.086 -11.181 -7.906 83 1HD1 LEU 11 1HD1 LEU 11 3.505 -10.970 -9.710 84 2HD1 LEU 11 2HD1 LEU 11 3.622 -9.211 -9.679 85 3HD1 LEU 11 3HD1 LEU 11 5.005 -10.208 -10.222 86 1HD2 LEU 11 1HD2 LEU 11 6.240 -9.147 -6.988 87 2HD2 LEU 11 2HD2 LEU 11 6.607 -9.442 -8.676 88 3HD2 LEU 11 3HD2 LEU 11 5.453 -8.166 -8.229 89 H TYR 12 H TYR 12 4.394 -8.614 -4.396 90 HA TYR 12 HA TYR 12 7.185 -8.800 -4.456 91 1HB TYR 12 HB2 TYR 12 6.084 -6.784 -3.815 92 2HB TYR 12 HB3 TYR 12 5.264 -7.585 -2.487 93 HD1 TYR 12 HD1 TYR 12 5.817 -5.929 -0.900 94 HD2 TYR 12 HD2 TYR 12 8.949 -8.028 -3.005 95 HE1 TYR 12 HE1 TYR 12 7.488 -5.082 0.729 96 HE2 TYR 12 HE2 TYR 12 10.605 -7.201 -1.369 97 HH TYR 12 HH TYR 12 10.971 -5.925 0.502 98 H LYS 13 H LYS 13 4.956 -10.222 -1.993 99 HA LYS 13 HA LYS 13 7.047 -11.419 -0.431 100 1HB LYS 13 HB2 LYS 13 4.669 -11.092 0.292 101 2HB LYS 13 HB3 LYS 13 4.166 -12.374 -0.818 102 1HG LYS 13 HG2 LYS 13 5.608 -13.993 0.391 103 2HG LYS 13 HG3 LYS 13 6.135 -12.719 1.497 104 1HD LYS 13 HD2 LYS 13 3.260 -13.698 1.172 105 2HD LYS 13 HD3 LYS 13 4.382 -14.224 2.437 106 1HE LYS 13 HE2 LYS 13 4.580 -11.860 3.227 107 2HE LYS 13 HE3 LYS 13 3.391 -11.367 2.010 108 1HZ LYS 13 HZ1 LYS 13 1.771 -12.838 3.102 109 2HZ LYS 13 HZ2 LYS 13 2.875 -13.292 4.215 110 3HZ LYS 13 HZ3 LYS 13 2.345 -11.749 4.171 111 H TYR 14 H TYR 14 5.049 -12.973 -3.077 112 HA TYR 14 HA TYR 14 6.519 -15.368 -3.156 113 1HB TYR 14 HB2 TYR 14 4.413 -15.087 -4.246 114 2HB TYR 14 HB3 TYR 14 4.969 -13.714 -5.171 115 HD1 TYR 14 HD1 TYR 14 6.014 -13.927 -7.297 116 HD2 TYR 14 HD2 TYR 14 5.140 -17.418 -4.916 117 HE1 TYR 14 HE1 TYR 14 6.311 -15.363 -9.306 118 HE2 TYR 14 HE2 TYR 14 5.441 -18.859 -6.932 119 HH TYR 14 HH TYR 14 6.264 -17.494 -10.142 120 H MET 15 H MET 15 7.237 -12.309 -4.768 121 HA MET 15 HA MET 15 9.471 -13.130 -6.337 122 1HB MET 15 HB2 MET 15 8.315 -11.221 -6.978 123 2HB MET 15 HB3 MET 15 8.290 -10.532 -5.354 124 1HG MET 15 HG2 MET 15 10.349 -9.757 -5.398 125 2HG MET 15 HG3 MET 15 10.941 -10.915 -6.605 126 1HE MET 15 HE1 MET 15 10.782 -10.719 -9.102 127 2HE MET 15 HE2 MET 15 9.009 -10.659 -9.087 128 3HE MET 15 HE3 MET 15 9.930 -9.443 -9.990 129 H LYS 16 H LYS 16 9.441 -11.423 -3.076 130 HA LYS 16 HA LYS 16 12.181 -11.724 -2.554 131 1HB LYS 16 HB2 LYS 16 10.503 -10.425 -1.237 132 2HB LYS 16 HB3 LYS 16 9.878 -11.943 -0.569 133 1HG LYS 16 HG2 LYS 16 12.097 -12.396 0.463 134 2HG LYS 16 HG3 LYS 16 12.729 -10.896 -0.250 135 1HD LYS 16 HD2 LYS 16 11.068 -9.579 1.046 136 2HD LYS 16 HD3 LYS 16 10.426 -11.082 1.746 137 1HE LYS 16 HE2 LYS 16 12.665 -11.570 2.725 138 2HE LYS 16 HE3 LYS 16 13.292 -10.064 2.042 139 1HZ LYS 16 HZ1 LYS 16 11.677 -8.854 3.424 140 2HZ LYS 16 HZ2 LYS 16 11.110 -10.249 4.060 141 3HZ LYS 16 HZ3 LYS 16 12.642 -9.772 4.364 142 H GLU 17 H GLU 17 9.590 -14.123 -1.971 143 HA GLU 17 HA GLU 17 11.335 -16.188 -1.005 144 1HB GLU 17 HB2 GLU 17 8.589 -16.307 -2.288 145 2HB GLU 17 HB3 GLU 17 9.441 -17.729 -1.687 146 1HG GLU 17 HG2 GLU 17 9.615 -16.682 0.561 147 2HG GLU 17 HG3 GLU 17 8.666 -15.315 -0.005 148 H ARG 18 H ARG 18 11.482 -14.836 -4.056 149 HA ARG 18 HA ARG 18 12.787 -17.320 -5.165 150 1HB ARG 18 HB2 ARG 18 11.337 -15.038 -6.562 151 2HB ARG 18 HB3 ARG 18 12.276 -16.269 -7.412 152 1HG ARG 18 HG2 ARG 18 10.781 -18.006 -6.880 153 2HG ARG 18 HG3 ARG 18 10.037 -17.124 -5.552 154 1HD ARG 18 HD2 ARG 18 8.487 -17.142 -7.376 155 2HD ARG 18 HD3 ARG 18 9.049 -15.503 -7.097 156 HE ARG 18 H3T ARG 18 10.152 -15.488 -9.164 157 1HH1 ARG 18 2HH2 ARG 18 8.894 -18.713 -8.652 158 2HH1 ARG 18 1HH2 ARG 18 9.275 -19.219 -10.274 159 1HH2 ARG 18 2HH1 ARG 18 10.594 -16.190 -11.217 160 2HH2 ARG 18 1HH1 ARG 18 10.195 -17.816 -11.685 161 H LYS 19 H LYS 19 13.714 -14.826 -3.481 162 HA LYS 19 HA LYS 19 15.708 -13.932 -3.014 163 1HB LYS 19 HB2 LYS 19 16.933 -15.485 -5.321 164 2HB LYS 19 HB3 LYS 19 17.775 -14.734 -3.973 165 1HG LYS 19 HG2 LYS 19 15.890 -17.120 -3.796 166 2HG LYS 19 HG3 LYS 19 17.647 -17.141 -3.685 167 1HD LYS 19 HD2 LYS 19 17.530 -15.741 -1.617 168 2HD LYS 19 HD3 LYS 19 15.754 -15.811 -1.690 169 1HE LYS 19 HE2 LYS 19 15.837 -18.283 -1.568 170 2HE LYS 19 HE3 LYS 19 17.605 -18.231 -1.507 171 1HZ LYS 19 HZ1 LYS 19 16.643 -18.437 0.714 172 2HZ LYS 19 HZ2 LYS 19 17.431 -17.014 0.594 173 3HZ LYS 19 HZ3 LYS 19 15.798 -17.053 0.543 174 H THR 20 H THR 20 13.801 -12.648 -4.652 175 HA THR 20 HA THR 20 15.572 -10.635 -5.928 176 HB THR 20 H5T THR 20 12.872 -11.662 -6.883 177 HG1 THR 20 HG1 THR 20 14.558 -12.991 -7.465 178 1HG2 THR 20 1HG2 THR 20 13.149 -9.186 -7.345 179 2HG2 THR 20 2HG2 THR 20 14.634 -9.596 -8.248 180 3HG2 THR 20 3HG2 THR 20 13.067 -10.198 -8.790 181 HA PRO 21 HA PRO 21 13.201 -8.882 -2.439 182 1HB PRO 21 HB2 PRO 21 14.838 -6.817 -1.694 183 2HB PRO 21 HB3 PRO 21 15.265 -8.530 -1.470 184 1HG PRO 21 HG2 PRO 21 16.044 -6.741 -3.800 185 2HG PRO 21 HG3 PRO 21 17.131 -7.697 -2.733 186 1HD PRO 21 HD2 PRO 21 16.295 -8.683 -5.104 187 2HD PRO 21 HD3 PRO 21 16.398 -9.745 -3.672 188 H ILE 22 H ILE 22 12.440 -8.147 -5.247 189 HA ILE 22 HA ILE 22 11.642 -6.568 -6.564 190 HB ILE 22 H5T ILE 22 9.839 -6.938 -4.784 191 1HG1 ILE 22 2HG1 ILE 22 9.462 -4.551 -6.625 192 2HG1 ILE 22 3HG1 ILE 22 9.643 -6.185 -7.237 193 1HG2 ILE 22 1HG2 ILE 22 10.570 -5.153 -3.165 194 2HG2 ILE 22 2HG2 ILE 22 10.261 -3.928 -4.407 195 3HG2 ILE 22 3HG2 ILE 22 8.935 -4.896 -3.746 196 1HD1 ILE 22 1HD1 ILE 22 7.298 -5.643 -7.113 197 2HD1 ILE 22 2HD1 ILE 22 7.665 -6.923 -5.942 198 3HD1 ILE 22 3HD1 ILE 22 7.418 -5.243 -5.393 199 H GLU 23 H GLU 23 13.631 -4.904 -4.144 200 HA GLU 23 HA GLU 23 13.808 -2.481 -5.382 201 1HB GLU 23 HB2 GLU 23 16.061 -4.223 -4.319 202 2HB GLU 23 HB3 GLU 23 16.227 -2.502 -4.688 203 1HG GLU 23 HG2 GLU 23 14.416 -1.970 -3.071 204 2HG GLU 23 HG3 GLU 23 14.298 -3.676 -2.647 205 H ARG 24 H ARG 24 14.153 -5.161 -7.249 206 HA ARG 24 HA ARG 24 16.025 -4.244 -9.328 207 1HB ARG 24 HB2 ARG 24 13.912 -6.462 -9.155 208 2HB ARG 24 HB3 ARG 24 14.863 -6.126 -10.594 209 1HG ARG 24 HG2 ARG 24 15.890 -7.916 -9.621 210 2HG ARG 24 HG3 ARG 24 16.948 -6.539 -9.355 211 1HD ARG 24 HD2 ARG 24 15.050 -7.344 -7.129 212 2HD ARG 24 HD3 ARG 24 16.373 -8.421 -7.457 213 HE ARG 24 H3T ARG 24 16.599 -5.612 -6.497 214 1HH1 ARG 24 2HH2 ARG 24 18.384 -8.479 -7.437 215 2HH1 ARG 24 1HH2 ARG 24 19.832 -7.934 -6.636 216 1HH2 ARG 24 2HH1 ARG 24 18.501 -4.982 -5.515 217 2HH2 ARG 24 1HH1 ARG 24 19.885 -6.023 -5.589 218 H ILE 25 H ILE 25 14.476 -2.171 -8.655 219 HA ILE 25 HA ILE 25 12.591 -1.714 -10.872 220 HB ILE 25 H5T ILE 25 11.524 -2.773 -8.828 221 1HG1 ILE 25 2HG1 ILE 25 10.313 -0.128 -9.620 222 2HG1 ILE 25 3HG1 ILE 25 10.151 -1.678 -10.463 223 1HG2 ILE 25 1HG2 ILE 25 11.679 -0.081 -7.433 224 2HG2 ILE 25 2HG2 ILE 25 11.182 -1.648 -6.786 225 3HG2 ILE 25 3HG2 ILE 25 12.882 -1.356 -7.155 226 1HD1 ILE 25 1HD1 ILE 25 8.163 -1.397 -9.164 227 2HD1 ILE 25 2HD1 ILE 25 9.137 -2.587 -8.286 228 3HD1 ILE 25 3HD1 ILE 25 9.072 -0.903 -7.727 229 HA PRO 26 HA PRO 26 15.317 1.771 -8.812 230 1HB PRO 26 HB2 PRO 26 17.127 2.422 -10.788 231 2HB PRO 26 HB3 PRO 26 17.374 1.151 -9.553 232 1HG PRO 26 HG2 PRO 26 16.343 0.811 -12.386 233 2HG PRO 26 HG3 PRO 26 17.636 -0.118 -11.560 234 1HD PRO 26 HD2 PRO 26 15.115 -1.082 -11.697 235 2HD PRO 26 HD3 PRO 26 16.075 -1.248 -10.193 236 H TYR 27 H TYR 27 14.212 1.818 -12.239 237 HA TYR 27 HA TYR 27 12.758 4.328 -11.714 238 1HB TYR 27 HB2 TYR 27 15.011 4.122 -13.770 239 2HB TYR 27 HB3 TYR 27 13.731 5.310 -13.888 240 HD1 TYR 27 HD1 TYR 27 13.390 7.020 -12.054 241 HD2 TYR 27 HD2 TYR 27 16.939 4.594 -12.408 242 HE1 TYR 27 HE1 TYR 27 14.644 8.660 -10.666 243 HE2 TYR 27 HE2 TYR 27 18.197 6.242 -11.018 244 HH TYR 27 HH TYR 27 16.652 9.202 -9.711 245 H LEU 28 H LEU 28 11.172 4.747 -13.263 246 HA LEU 28 HA LEU 28 10.157 2.601 -14.970 247 1HB LEU 28 HB2 LEU 28 8.839 4.383 -13.716 248 2HB LEU 28 HB3 LEU 28 9.522 5.590 -14.780 249 HG LEU 28 HG LEU 28 8.381 4.322 -16.719 250 1HD1 LEU 28 1HD1 LEU 28 6.465 2.929 -16.113 251 2HD1 LEU 28 2HD1 LEU 28 7.919 2.202 -15.428 252 3HD1 LEU 28 3HD1 LEU 28 6.814 3.122 -14.381 253 1HD2 LEU 28 1HD2 LEU 28 6.817 5.614 -14.432 254 2HD2 LEU 28 2HD2 LEU 28 7.531 6.430 -15.846 255 3HD2 LEU 28 3HD2 LEU 28 6.162 5.321 -16.046 256 H GLY 29 H GLY 29 11.032 5.940 -15.965 257 1HA GLY 29 HA2 GLY 29 13.557 4.976 -17.171 258 2HA GLY 29 HA3 GLY 29 12.359 5.672 -18.260 259 H PHE 30 H PHE 30 11.393 7.727 -16.434 260 HA PHE 30 HA PHE 30 13.795 9.355 -15.717 261 1HB PHE 30 HB2 PHE 30 12.622 10.008 -17.871 262 2HB PHE 30 HB3 PHE 30 11.192 10.378 -16.918 263 HD1 PHE 30 HD1 PHE 30 10.991 12.536 -15.849 264 HD2 PHE 30 HD2 PHE 30 14.796 11.262 -17.423 265 HE1 PHE 30 HE1 PHE 30 11.905 14.817 -15.487 266 HE2 PHE 30 HE2 PHE 30 15.713 13.538 -17.042 267 HZ PHE 30 HZ PHE 30 14.275 15.319 -16.068 268 H LYS 31 H LYS 31 11.284 7.695 -14.330 269 HA LYS 31 HA LYS 31 11.268 9.366 -11.926 270 1HB LYS 31 HB2 LYS 31 8.862 9.723 -11.828 271 2HB LYS 31 HB3 LYS 31 9.545 10.497 -13.247 272 1HG LYS 31 HG2 LYS 31 8.705 8.639 -14.678 273 2HG LYS 31 HG3 LYS 31 7.998 7.862 -13.240 274 1HD LYS 31 HD2 LYS 31 6.540 9.799 -12.861 275 2HD LYS 31 HD3 LYS 31 7.334 10.693 -14.172 276 1HE LYS 31 HE2 LYS 31 6.531 8.974 -15.798 277 2HE LYS 31 HE3 LYS 31 5.665 8.160 -14.484 278 1HZ LYS 31 HZ1 LYS 31 4.242 9.758 -15.775 279 2HZ LYS 31 HZ2 LYS 31 4.327 10.169 -14.195 280 3HZ LYS 31 HZ3 LYS 31 5.193 10.989 -15.308 281 H GLN 32 H GLN 32 9.745 8.386 -10.250 282 HA GLN 32 HA GLN 32 10.554 5.684 -9.752 283 1HB GLN 32 HB2 GLN 32 10.001 7.720 -8.181 284 2HB GLN 32 HB3 GLN 32 8.339 7.166 -8.280 285 1HG GLN 32 HG2 GLN 32 10.749 5.564 -7.293 286 2HG GLN 32 HG3 GLN 32 9.569 6.383 -6.264 287 1HE2 GLN 32 1HE2 GLN 32 7.136 5.672 -6.829 288 2HE2 GLN 32 2HE2 GLN 32 6.944 3.974 -7.246 289 H ILE 33 H ILE 33 9.409 3.719 -9.899 290 HA ILE 33 HA ILE 33 7.337 3.571 -11.883 291 HB ILE 33 H5T ILE 33 8.838 1.647 -10.116 292 1HG1 ILE 33 2HG1 ILE 33 8.319 1.795 -13.110 293 2HG1 ILE 33 3HG1 ILE 33 9.639 2.628 -12.296 294 1HG2 ILE 33 1HG2 ILE 33 7.569 -0.282 -11.192 295 2HG2 ILE 33 2HG2 ILE 33 6.686 0.598 -9.949 296 3HG2 ILE 33 3HG2 ILE 33 6.336 0.902 -11.660 297 1HD1 ILE 33 1HD1 ILE 33 10.378 0.620 -13.465 298 2HD1 ILE 33 2HD1 ILE 33 10.714 0.538 -11.737 299 3HD1 ILE 33 3HD1 ILE 33 9.362 -0.394 -12.442 300 H ASN 34 H ASN 34 5.241 3.482 -11.837 301 HA ASN 34 HA ASN 34 3.743 3.027 -9.280 302 1HB ASN 34 HB2 ASN 34 3.021 4.728 -11.697 303 2HB ASN 34 HB3 ASN 34 1.876 4.261 -10.441 304 1HD2 ASN 34 1HD2 ASN 34 3.319 6.926 -11.334 305 2HD2 ASN 34 2HD2 ASN 34 3.721 7.604 -9.764 306 H LEU 35 H LEU 35 3.968 0.804 -9.557 307 HA LEU 35 HA LEU 35 3.602 -0.594 -11.954 308 1HB LEU 35 HB2 LEU 35 4.899 -1.209 -9.955 309 2HB LEU 35 HB3 LEU 35 3.408 -1.552 -9.091 310 HG LEU 35 HG LEU 35 2.957 -3.462 -10.567 311 1HD1 LEU 35 1HD1 LEU 35 3.849 -2.784 -12.703 312 2HD1 LEU 35 2HD1 LEU 35 5.501 -2.658 -12.035 313 3HD1 LEU 35 3HD1 LEU 35 4.698 -4.240 -12.182 314 1HD2 LEU 35 1HD2 LEU 35 5.863 -3.381 -9.620 315 2HD2 LEU 35 2HD2 LEU 35 4.457 -3.646 -8.567 316 3HD2 LEU 35 3HD2 LEU 35 4.849 -4.819 -9.820 317 H TRP 36 H TRP 36 1.148 0.119 -9.487 318 HA TRP 36 HA TRP 36 -1.045 -1.387 -10.611 319 1HB TRP 36 HB2 TRP 36 -2.416 0.019 -9.255 320 2HB TRP 36 HB3 TRP 36 -1.005 -0.457 -8.340 321 HD1 TRP 36 HD1 TRP 36 0.954 1.575 -8.130 322 HE1 TRP 36 HE1 TRP 36 0.654 4.105 -7.865 323 HE3 TRP 36 HE3 TRP 36 -3.934 1.980 -9.622 324 HZ2 TRP 36 HZ2 TRP 36 -1.462 6.039 -8.127 325 HZ3 TRP 36 HZ3 TRP 36 -5.095 4.177 -9.507 326 HH2 TRP 36 HH2 TRP 36 -3.868 6.208 -8.768 327 H THR 37 H THR 37 0.129 1.981 -11.156 328 HA THR 37 HA THR 37 -1.831 2.758 -13.064 329 HB THR 37 H5T THR 37 0.995 3.824 -12.778 330 HG1 THR 37 HG1 THR 37 -0.176 5.409 -11.550 331 1HG2 THR 37 1HG2 THR 37 -0.030 4.593 -14.882 332 2HG2 THR 37 2HG2 THR 37 -1.511 5.054 -14.006 333 3HG2 THR 37 3HG2 THR 37 0.021 5.910 -13.705 334 H MET 38 H MET 38 1.519 1.436 -13.627 335 HA MET 38 HA MET 38 1.159 1.424 -16.468 336 1HB MET 38 HB2 MET 38 3.116 0.243 -16.711 337 2HB MET 38 HB3 MET 38 3.376 1.203 -15.256 338 1HG MET 38 HG2 MET 38 2.918 -0.796 -13.882 339 2HG MET 38 HG3 MET 38 2.569 -1.742 -15.318 340 1HE MET 38 HE1 MET 38 6.763 -0.379 -13.989 341 2HE MET 38 HE2 MET 38 5.622 0.807 -14.671 342 3HE MET 38 HE3 MET 38 5.227 -0.043 -13.163 343 H PHE 39 H PHE 39 0.071 -0.927 -14.006 344 HA PHE 39 HA PHE 39 -0.665 -2.969 -15.895 345 1HB PHE 39 HB2 PHE 39 -0.494 -3.397 -13.483 346 2HB PHE 39 HB3 PHE 39 -1.826 -2.317 -13.168 347 HD1 PHE 39 HD1 PHE 39 -3.887 -3.335 -12.740 348 HD2 PHE 39 HD2 PHE 39 -1.179 -5.208 -15.532 349 HE1 PHE 39 HE1 PHE 39 -5.538 -5.146 -13.135 350 HE2 PHE 39 HE2 PHE 39 -2.838 -6.995 -15.940 351 HZ PHE 39 HZ PHE 39 -5.015 -6.977 -14.737 352 H GLN 40 H GLN 40 -2.756 -0.385 -14.344 353 HA GLN 40 HA GLN 40 -4.938 -1.075 -16.086 354 1HB GLN 40 HB2 GLN 40 -6.001 0.999 -15.435 355 2HB GLN 40 HB3 GLN 40 -5.357 0.148 -14.036 356 1HG GLN 40 HG2 GLN 40 -3.476 1.675 -13.898 357 2HG GLN 40 HG3 GLN 40 -3.966 2.523 -15.364 358 1HE2 GLN 40 1HE2 GLN 40 -3.770 3.256 -12.268 359 2HE2 GLN 40 2HE2 GLN 40 -5.280 4.120 -12.067 360 H ALA 41 H ALA 41 -2.231 1.180 -16.638 361 HA ALA 41 HA ALA 41 -3.197 2.221 -19.118 362 1HB ALA 41 HB1 ALA 41 -1.301 3.162 -17.803 363 2HB ALA 41 HB2 ALA 41 -0.318 1.745 -18.235 364 3HB ALA 41 HB3 ALA 41 -0.879 2.866 -19.494 365 H ALA 42 H ALA 42 -1.062 -0.664 -18.515 366 HA ALA 42 HA ALA 42 -1.030 -1.528 -21.256 367 1HB ALA 42 HB1 ALA 42 -0.563 -3.051 -18.660 368 2HB ALA 42 HB2 ALA 42 -0.099 -3.600 -20.286 369 3HB ALA 42 HB3 ALA 42 0.670 -2.165 -19.586 370 H GLN 43 H GLN 43 -3.480 -1.981 -18.750 371 HA GLN 43 HA GLN 43 -4.827 -4.087 -20.185 372 1HB GLN 43 HB2 GLN 43 -5.664 -2.281 -17.913 373 2HB GLN 43 HB3 GLN 43 -6.780 -3.417 -18.662 374 1HG GLN 43 HG2 GLN 43 -4.137 -4.217 -17.373 375 2HG GLN 43 HG3 GLN 43 -5.716 -4.341 -16.617 376 1HE2 GLN 43 1HE2 GLN 43 -3.417 -6.096 -18.372 377 2HE2 GLN 43 2HE2 GLN 43 -4.489 -7.380 -18.900 378 H LYS 44 H LYS 44 -5.021 -0.535 -20.294 379 HA LYS 44 HA LYS 44 -7.354 -0.658 -22.129 380 1HB LYS 44 HB2 LYS 44 -5.676 1.639 -21.029 381 2HB LYS 44 HB3 LYS 44 -7.066 1.853 -22.097 382 1HG LYS 44 HG2 LYS 44 -8.587 0.890 -20.463 383 2HG LYS 44 HG3 LYS 44 -7.266 0.488 -19.372 384 1HD LYS 44 HD2 LYS 44 -8.063 3.313 -20.193 385 2HD LYS 44 HD3 LYS 44 -8.494 2.516 -18.667 386 1HE LYS 44 HE2 LYS 44 -6.075 2.272 -18.116 387 2HE LYS 44 HE3 LYS 44 -5.653 3.084 -19.622 388 1HZ LYS 44 HZ1 LYS 44 -7.054 4.309 -17.324 389 2HZ LYS 44 HZ2 LYS 44 -5.554 4.661 -17.931 390 3HZ LYS 44 HZ3 LYS 44 -6.890 5.043 -18.790 391 H LEU 45 H LEU 45 -3.940 0.398 -22.269 392 HA LEU 45 HA LEU 45 -4.041 0.631 -25.143 393 1HB LEU 45 HB2 LEU 45 -1.714 0.626 -23.184 394 2HB LEU 45 HB3 LEU 45 -1.572 1.044 -24.868 395 HG LEU 45 HG LEU 45 -3.442 2.603 -23.034 396 1HD1 LEU 45 1HD1 LEU 45 -0.508 2.918 -23.535 397 2HD1 LEU 45 2HD1 LEU 45 -1.541 4.303 -23.070 398 3HD1 LEU 45 3HD1 LEU 45 -1.404 2.906 -22.001 399 1HD2 LEU 45 1HD2 LEU 45 -2.207 3.192 -25.743 400 2HD2 LEU 45 2HD2 LEU 45 -3.915 2.884 -25.393 401 3HD2 LEU 45 3HD2 LEU 45 -3.147 4.349 -24.774 402 H GLY 46 H GLY 46 -4.538 -2.173 -23.764 403 1HA GLY 46 HA2 GLY 46 -4.198 -3.613 -25.944 404 2HA GLY 46 HA3 GLY 46 -2.554 -3.735 -25.347 405 H GLY 47 H GLY 47 -4.918 -3.931 -22.784 406 1HA GLY 47 HA2 GLY 47 -5.335 -5.707 -21.343 407 2HA GLY 47 HA3 GLY 47 -5.752 -6.554 -22.821 408 H TYR 48 H TYR 48 -2.481 -5.476 -21.675 409 HA TYR 48 HA TYR 48 -0.520 -6.511 -21.935 410 1HB TYR 48 HB2 TYR 48 -0.862 -7.580 -19.909 411 2HB TYR 48 HB3 TYR 48 -2.111 -8.641 -20.528 412 HD1 TYR 48 HD1 TYR 48 -1.627 -10.727 -21.626 413 HD2 TYR 48 HD2 TYR 48 1.570 -8.053 -20.519 414 HE1 TYR 48 HE1 TYR 48 0.050 -12.502 -22.161 415 HE2 TYR 48 HE2 TYR 48 3.236 -9.825 -21.033 416 HH TYR 48 HH TYR 48 3.565 -11.959 -21.811 417 H GLU 49 H GLU 49 -2.913 -8.657 -23.540 418 HA GLU 49 HA GLU 49 -0.732 -10.057 -24.825 419 1HB GLU 49 HB2 GLU 49 -3.056 -10.961 -24.192 420 2HB GLU 49 HB3 GLU 49 -3.660 -10.151 -25.647 421 1HG GLU 49 HG2 GLU 49 -1.978 -11.445 -27.002 422 2HG GLU 49 HG3 GLU 49 -1.419 -12.229 -25.522 423 H THR 50 H THR 50 -3.020 -7.530 -25.962 424 HA THR 50 HA THR 50 -1.910 -7.491 -28.628 425 HB THR 50 H5T THR 50 -3.540 -5.298 -27.319 426 HG1 THR 50 HG1 THR 50 -5.316 -6.417 -28.250 427 1HG2 THR 50 1HG2 THR 50 -4.329 -4.908 -29.630 428 2HG2 THR 50 2HG2 THR 50 -2.572 -4.729 -29.533 429 3HG2 THR 50 3HG2 THR 50 -3.269 -6.212 -30.218 430 H ILE 51 H ILE 51 -1.136 -5.783 -25.540 431 HA ILE 51 HA ILE 51 0.563 -3.857 -26.928 432 HB ILE 51 H5T ILE 51 -0.351 -3.080 -24.947 433 1HG1 ILE 51 2HG1 ILE 51 2.535 -3.679 -24.197 434 2HG1 ILE 51 3HG1 ILE 51 2.057 -2.485 -25.396 435 1HG2 ILE 51 1HG2 ILE 51 0.864 -5.375 -23.386 436 2HG2 ILE 51 2HG2 ILE 51 -0.108 -4.041 -22.731 437 3HG2 ILE 51 3HG2 ILE 51 -0.867 -5.184 -23.807 438 1HD1 ILE 51 1HD1 ILE 51 0.683 -1.321 -23.655 439 2HD1 ILE 51 2HD1 ILE 51 1.374 -2.432 -22.441 440 3HD1 ILE 51 3HD1 ILE 51 2.439 -1.355 -23.357 441 H THR 52 H THR 52 1.071 -7.080 -25.532 442 HA THR 52 HA THR 52 3.951 -7.023 -25.999 443 HB THR 52 H5T THR 52 2.063 -9.394 -25.682 444 HG1 THR 52 HG1 THR 52 1.962 -8.244 -23.853 445 1HG2 THR 52 1HG2 THR 52 4.115 -10.557 -24.872 446 2HG2 THR 52 2HG2 THR 52 4.239 -10.118 -26.581 447 3HG2 THR 52 3HG2 THR 52 5.092 -9.153 -25.356 448 H ALA 53 H ALA 53 1.123 -8.346 -27.845 449 HA ALA 53 HA ALA 53 2.749 -9.391 -29.958 450 1HB ALA 53 HB1 ALA 53 -0.208 -8.653 -29.922 451 2HB ALA 53 HB2 ALA 53 0.589 -9.724 -31.089 452 3HB ALA 53 HB3 ALA 53 0.486 -10.201 -29.384 453 H ARG 54 H ARG 54 1.641 -6.086 -29.421 454 HA ARG 54 HA ARG 54 2.540 -5.383 -32.212 455 1HB ARG 54 HB2 ARG 54 0.185 -4.165 -30.746 456 2HB ARG 54 HB3 ARG 54 0.752 -3.759 -32.363 457 1HG ARG 54 HG2 ARG 54 0.197 -6.141 -33.059 458 2HG ARG 54 HG3 ARG 54 -0.510 -6.370 -31.450 459 1HD ARG 54 HD2 ARG 54 -2.334 -5.827 -32.821 460 2HD ARG 54 HD3 ARG 54 -2.008 -4.356 -31.917 461 HE ARG 54 H3T ARG 54 -1.378 -4.897 -34.794 462 1HH1 ARG 54 2HH2 ARG 54 -1.655 -2.392 -32.297 463 2HH1 ARG 54 1HH2 ARG 54 -1.641 -1.137 -33.503 464 1HH2 ARG 54 2HH1 ARG 54 -1.349 -3.219 -36.206 465 2HH2 ARG 54 1HH1 ARG 54 -1.451 -1.583 -35.624 466 H ARG 55 H ARG 55 3.665 -5.099 -29.288 467 HA ARG 55 HA ARG 55 5.055 -3.723 -28.147 468 1HB ARG 55 HB2 ARG 55 6.839 -2.633 -29.386 469 2HB ARG 55 HB3 ARG 55 6.561 -4.300 -29.877 470 1HG ARG 55 HG2 ARG 55 5.434 -3.557 -31.935 471 2HG ARG 55 HG3 ARG 55 5.623 -1.859 -31.450 472 1HD ARG 55 HD2 ARG 55 8.069 -2.108 -31.525 473 2HD ARG 55 HD3 ARG 55 7.889 -3.829 -31.924 474 HE ARG 55 H3T ARG 55 6.473 -2.119 -33.797 475 1HH1 ARG 55 2HH2 ARG 55 9.692 -3.348 -33.149 476 2HH1 ARG 55 1HH2 ARG 55 10.178 -3.194 -34.814 477 1HH2 ARG 55 2HH1 ARG 55 7.164 -1.952 -35.897 478 2HH2 ARG 55 1HH1 ARG 55 8.785 -2.420 -36.319 479 H GLN 56 H GLN 56 2.845 -2.869 -27.591 480 HA GLN 56 HA GLN 56 2.444 -0.152 -28.624 481 1HB GLN 56 HB2 GLN 56 0.495 -1.677 -26.888 482 2HB GLN 56 HB3 GLN 56 0.215 -0.189 -27.782 483 1HG GLN 56 HG2 GLN 56 0.827 -1.445 -29.913 484 2HG GLN 56 HG3 GLN 56 0.801 -2.929 -28.959 485 1HE2 GLN 56 1HE2 GLN 56 -1.687 -2.001 -27.361 486 2HE2 GLN 56 2HE2 GLN 56 -2.947 -2.235 -28.565 487 H TRP 57 H TRP 57 4.317 -1.250 -26.224 488 HA TRP 57 HA TRP 57 3.970 0.433 -23.974 489 1HB TRP 57 HB2 TRP 57 6.627 -0.300 -25.213 490 2HB TRP 57 HB3 TRP 57 6.268 0.146 -23.571 491 HD1 TRP 57 HD1 TRP 57 6.056 -2.850 -25.887 492 HE1 TRP 57 HE1 TRP 57 5.256 -4.915 -24.591 493 HE3 TRP 57 HE3 TRP 57 5.074 -0.636 -21.374 494 HZ2 TRP 57 HZ2 TRP 57 4.260 -5.522 -21.944 495 HZ3 TRP 57 HZ3 TRP 57 4.165 -1.973 -19.489 496 HH2 TRP 57 HH2 TRP 57 3.743 -4.410 -19.771 497 H LYS 58 H LYS 58 5.142 1.264 -27.254 498 HA LYS 58 HA LYS 58 5.944 3.956 -26.621 499 1HB LYS 58 HB2 LYS 58 4.830 2.864 -29.236 500 2HB LYS 58 HB3 LYS 58 5.657 4.406 -29.031 501 1HG LYS 58 HG2 LYS 58 6.870 1.632 -28.724 502 2HG LYS 58 HG3 LYS 58 7.233 2.855 -29.943 503 1HD LYS 58 HD2 LYS 58 8.077 4.348 -28.059 504 2HD LYS 58 HD3 LYS 58 7.900 2.954 -26.967 505 1HE LYS 58 HE2 LYS 58 9.445 1.649 -28.439 506 2HE LYS 58 HE3 LYS 58 9.661 3.089 -29.445 507 1HZ LYS 58 HZ1 LYS 58 11.434 2.998 -27.850 508 2HZ LYS 58 HZ2 LYS 58 10.457 4.241 -27.398 509 3HZ LYS 58 HZ3 LYS 58 10.420 2.805 -26.586 510 H HIS 59 H HIS 59 2.665 2.701 -26.748 511 HA HIS 59 HA HIS 59 1.688 5.484 -26.385 512 1HB HIS 59 HB2 HIS 59 0.151 2.880 -26.494 513 2HB HIS 59 HB3 HIS 59 -0.505 4.525 -26.526 514 HD1 HIS 59 HD1 HIS 59 0.196 5.995 -28.829 515 HD2 HIS 59 HD2 HIS 59 0.803 1.830 -28.819 516 HE1 HIS 59 HE1 HIS 59 0.517 5.313 -31.265 517 H ILE 60 H ILE 60 2.742 2.856 -24.350 518 HA ILE 60 HA ILE 60 1.258 3.672 -21.941 519 HB ILE 60 H5T ILE 60 3.918 2.226 -22.267 520 1HG1 ILE 60 2HG1 ILE 60 1.895 0.974 -23.052 521 2HG1 ILE 60 3HG1 ILE 60 2.826 0.208 -21.767 522 1HG2 ILE 60 1HG2 ILE 60 2.365 2.835 -19.732 523 2HG2 ILE 60 2HG2 ILE 60 3.637 1.592 -19.851 524 3HG2 ILE 60 3HG2 ILE 60 4.035 3.284 -20.147 525 1HD1 ILE 60 1HD1 ILE 60 0.323 0.071 -21.561 526 2HD1 ILE 60 2HD1 ILE 60 1.170 0.670 -20.122 527 3HD1 ILE 60 3HD1 ILE 60 0.312 1.797 -21.197 528 H TYR 61 H TYR 61 4.358 4.414 -23.525 529 HA TYR 61 HA TYR 61 5.237 6.576 -21.962 530 1HB TYR 61 HB2 TYR 61 6.534 5.494 -23.699 531 2HB TYR 61 HB3 TYR 61 5.381 5.964 -24.923 532 HD1 TYR 61 HD1 TYR 61 7.650 7.548 -22.357 533 HD2 TYR 61 HD2 TYR 61 5.938 7.724 -26.315 534 HE1 TYR 61 HE1 TYR 61 9.145 9.460 -22.928 535 HE2 TYR 61 HE2 TYR 61 7.440 9.625 -26.880 536 HH TYR 61 HH TYR 61 9.140 10.972 -26.181 537 H ASP 62 H ASP 62 2.352 6.434 -23.954 538 HA ASP 62 HA ASP 62 2.069 9.359 -24.054 539 1HB ASP 62 HB2 ASP 62 1.316 7.967 -25.966 540 2HB ASP 62 HB3 ASP 62 0.023 7.346 -24.937 541 H GLU 63 H GLU 63 0.239 6.604 -22.543 542 HA GLU 63 HA GLU 63 -1.326 8.337 -20.931 543 1HB GLU 63 HB2 GLU 63 -1.878 6.002 -21.470 544 2HB GLU 63 HB3 GLU 63 -0.627 5.434 -20.340 545 1HG GLU 63 HG2 GLU 63 -1.770 6.456 -18.460 546 2HG GLU 63 HG3 GLU 63 -2.889 7.315 -19.526 547 H LEU 64 H LEU 64 1.908 7.065 -20.265 548 HA LEU 64 HA LEU 64 2.066 7.783 -17.487 549 1HB LEU 64 HB2 LEU 64 4.173 7.564 -19.685 550 2HB LEU 64 HB3 LEU 64 4.580 7.858 -17.999 551 HG LEU 64 HG LEU 64 3.180 5.387 -19.035 552 1HD1 LEU 64 1HD1 LEU 64 5.382 4.309 -18.423 553 2HD1 LEU 64 2HD1 LEU 64 5.456 5.432 -19.789 554 3HD1 LEU 64 3HD1 LEU 64 6.051 5.943 -18.204 555 1HD2 LEU 64 1HD2 LEU 64 3.722 4.481 -16.739 556 2HD2 LEU 64 2HD2 LEU 64 4.078 6.156 -16.244 557 3HD2 LEU 64 3HD2 LEU 64 2.452 5.701 -16.784 558 H GLY 65 H GLY 65 2.339 9.806 -20.372 559 1HA GLY 65 HA2 GLY 65 2.799 12.050 -20.615 560 2HA GLY 65 HA3 GLY 65 2.509 12.279 -18.883 561 H GLY 66 H GLY 66 4.953 10.031 -20.253 562 1HA GLY 66 HA2 GLY 66 6.995 10.930 -18.498 563 2HA GLY 66 HA3 GLY 66 7.220 9.892 -19.900 564 H ASN 67 H ASN 67 9.174 11.525 -19.161 565 HA ASN 67 HA ASN 67 9.427 14.102 -20.195 566 1HB ASN 67 HB2 ASN 67 10.959 13.102 -18.650 567 2HB ASN 67 HB3 ASN 67 11.388 11.819 -19.769 568 1HD2 ASN 67 1HD2 ASN 67 12.610 14.573 -18.439 569 2HD2 ASN 67 2HD2 ASN 67 13.665 15.058 -19.757 570 HA PRO 68 HA PRO 68 8.976 13.493 -24.505 571 1HB PRO 68 HB2 PRO 68 10.019 15.804 -25.577 572 2HB PRO 68 HB3 PRO 68 8.504 15.731 -24.625 573 1HG PRO 68 HG2 PRO 68 11.297 16.417 -23.633 574 2HG PRO 68 HG3 PRO 68 9.777 17.336 -23.379 575 1HD PRO 68 HD2 PRO 68 10.700 15.632 -21.499 576 2HD PRO 68 HD3 PRO 68 8.950 15.711 -21.854 577 H GLY 69 H GLY 69 12.264 13.602 -23.306 578 1HA GLY 69 HA2 GLY 69 13.200 12.378 -25.899 579 2HA GLY 69 HA3 GLY 69 14.223 13.277 -24.772 580 H SER 70 H SER 70 11.726 10.854 -23.918 581 HA SER 70 HA SER 70 13.841 8.955 -22.956 582 1HB SER 70 HB2 SER 70 11.577 10.067 -21.261 583 2HB SER 70 HB3 SER 70 12.670 8.750 -20.800 584 HG SER 70 HG SER 70 13.438 11.431 -21.383 585 H THR 71 H THR 71 12.132 8.767 -25.273 586 HA THR 71 HA THR 71 9.853 7.160 -24.993 587 HB THR 71 H5T THR 71 10.546 8.124 -27.112 588 HG1 THR 71 HG1 THR 71 9.197 6.508 -27.453 589 1HG2 THR 71 1HG2 THR 71 13.000 7.728 -27.052 590 2HG2 THR 71 2HG2 THR 71 12.717 5.983 -27.236 591 3HG2 THR 71 3HG2 THR 71 12.257 7.107 -28.528 592 H SER 72 H SER 72 13.206 6.084 -24.615 593 HA SER 72 HA SER 72 12.801 3.281 -24.639 594 1HB SER 72 HB2 SER 72 14.712 4.860 -22.876 595 2HB SER 72 HB3 SER 72 14.849 3.150 -23.339 596 HG SER 72 HG SER 72 16.157 4.500 -24.661 597 H ALA 73 H ALA 73 12.076 5.633 -22.023 598 HA ALA 73 HA ALA 73 11.882 4.108 -19.870 599 1HB ALA 73 HB1 ALA 73 10.010 5.545 -19.098 600 2HB ALA 73 HB2 ALA 73 11.212 6.496 -19.996 601 3HB ALA 73 HB3 ALA 73 9.691 6.041 -20.773 602 H ALA 74 H ALA 74 9.043 4.135 -22.114 603 HA ALA 74 HA ALA 74 7.579 2.047 -20.741 604 1HB ALA 74 HB1 ALA 74 6.184 2.098 -22.602 605 2HB ALA 74 HB2 ALA 74 6.622 3.756 -22.195 606 3HB ALA 74 HB3 ALA 74 7.387 2.964 -23.600 607 H THR 75 H THR 75 10.228 1.928 -23.064 608 HA THR 75 HA THR 75 9.784 -0.884 -23.773 609 HB THR 75 H5T THR 75 12.210 0.960 -24.142 610 HG1 THR 75 HG1 THR 75 10.095 0.340 -25.923 611 1HG2 THR 75 1HG2 THR 75 11.418 -1.616 -25.585 612 2HG2 THR 75 2HG2 THR 75 12.724 -0.522 -26.082 613 3HG2 THR 75 3HG2 THR 75 12.840 -1.383 -24.539 614 H CYS 76 H CYS 76 11.889 0.913 -21.440 615 HA CYS 76 HA CYS 76 13.115 -1.506 -20.343 616 1HB CYS 76 HB2 CYS 76 12.803 1.324 -19.232 617 2HB CYS 76 HB3 CYS 76 13.793 0.038 -18.511 618 HG CYS 76 HG CYS 76 15.360 1.750 -19.750 619 H THR 77 H THR 77 10.250 0.484 -19.554 620 HA THR 77 HA THR 77 9.466 -0.741 -17.137 621 HB THR 77 H5T THR 77 7.737 0.334 -19.398 622 HG1 THR 77 HG1 THR 77 9.159 1.849 -18.535 623 1HG2 THR 77 1HG2 THR 77 6.090 0.802 -17.576 624 2HG2 THR 77 2HG2 THR 77 6.290 -0.923 -17.902 625 3HG2 THR 77 3HG2 THR 77 7.087 -0.193 -16.488 626 H ARG 78 H ARG 78 9.085 -1.972 -20.473 627 HA ARG 78 HA ARG 78 7.294 -4.128 -19.882 628 1HB ARG 78 HB2 ARG 78 7.844 -3.337 -22.182 629 2HB ARG 78 HB3 ARG 78 9.518 -3.841 -21.953 630 1HG ARG 78 HG2 ARG 78 8.758 -6.209 -21.701 631 2HG ARG 78 HG3 ARG 78 7.098 -5.690 -22.002 632 1HD ARG 78 HD2 ARG 78 8.050 -6.622 -24.030 633 2HD ARG 78 HD3 ARG 78 7.805 -4.892 -24.251 634 HE ARG 78 H3T ARG 78 10.069 -4.580 -24.494 635 1HH1 ARG 78 2HH2 ARG 78 9.730 -7.811 -23.051 636 2HH1 ARG 78 1HH2 ARG 78 11.392 -8.185 -23.410 637 1HH2 ARG 78 2HH1 ARG 78 12.144 -5.196 -24.902 638 2HH2 ARG 78 1HH1 ARG 78 12.707 -6.763 -24.408 639 H ARG 79 H ARG 79 10.806 -3.742 -19.161 640 HA ARG 79 HA ARG 79 11.143 -6.642 -19.177 641 1HB ARG 79 HB2 ARG 79 13.042 -4.426 -18.261 642 2HB ARG 79 HB3 ARG 79 13.449 -6.140 -18.384 643 1HG ARG 79 HG2 ARG 79 13.028 -6.062 -20.846 644 2HG ARG 79 HG3 ARG 79 12.705 -4.319 -20.721 645 1HD ARG 79 HD2 ARG 79 14.980 -3.969 -19.788 646 2HD ARG 79 HD3 ARG 79 15.291 -5.710 -19.910 647 HE ARG 79 H3T ARG 79 14.505 -4.607 -22.465 648 1HH1 ARG 79 2HH2 ARG 79 17.308 -4.807 -20.361 649 2HH1 ARG 79 1HH2 ARG 79 18.423 -4.662 -21.688 650 1HH2 ARG 79 2HH1 ARG 79 16.001 -4.411 -24.111 651 2HH2 ARG 79 1HH1 ARG 79 17.699 -4.433 -23.742 652 H HIS 80 H HIS 80 10.838 -3.971 -16.821 653 HA HIS 80 HA HIS 80 10.937 -5.623 -14.455 654 1HB HIS 80 HB2 HIS 80 9.334 -3.075 -14.697 655 2HB HIS 80 HB3 HIS 80 10.049 -3.809 -13.258 656 HD1 HIS 80 HD1 HIS 80 10.680 -0.928 -15.267 657 HD2 HIS 80 HD2 HIS 80 13.042 -4.077 -13.794 658 HE1 HIS 80 HE1 HIS 80 13.079 -0.091 -15.298 659 H TYR 81 H TYR 81 8.138 -4.480 -16.471 660 HA TYR 81 HA TYR 81 6.080 -5.645 -15.006 661 1HB TYR 81 HB2 TYR 81 5.961 -4.055 -16.947 662 2HB TYR 81 HB3 TYR 81 6.317 -5.372 -18.042 663 HD1 TYR 81 HD1 TYR 81 4.585 -7.434 -17.982 664 HD2 TYR 81 HD2 TYR 81 3.764 -3.407 -16.679 665 HE1 TYR 81 HE1 TYR 81 2.148 -7.819 -18.291 666 HE2 TYR 81 HE2 TYR 81 1.344 -3.768 -17.066 667 HH TYR 81 HH TYR 81 -0.273 -5.236 -17.757 668 H GLU 82 H GLU 82 8.207 -7.316 -17.344 669 HA GLU 82 HA GLU 82 6.628 -9.718 -17.580 670 1HB GLU 82 HB2 GLU 82 9.435 -8.899 -18.359 671 2HB GLU 82 HB3 GLU 82 8.907 -10.584 -18.478 672 1HG GLU 82 HG2 GLU 82 7.055 -9.980 -19.947 673 2HG GLU 82 HG3 GLU 82 7.444 -8.269 -19.801 674 H ARG 83 H ARG 83 8.629 -8.544 -14.995 675 HA ARG 83 HA ARG 83 8.262 -11.227 -13.799 676 1HB ARG 83 HB2 ARG 83 10.631 -9.353 -13.412 677 2HB ARG 83 HB3 ARG 83 10.371 -10.811 -12.459 678 1HG ARG 83 HG2 ARG 83 10.815 -10.761 -15.475 679 2HG ARG 83 HG3 ARG 83 12.040 -11.109 -14.258 680 1HD ARG 83 HD2 ARG 83 10.805 -13.080 -13.494 681 2HD ARG 83 HD3 ARG 83 9.511 -12.775 -14.647 682 HE ARG 83 H3T ARG 83 12.211 -13.821 -15.211 683 1HH1 ARG 83 2HH1 ARG 83 9.229 -12.649 -16.697 684 2HH1 ARG 83 1HH1 ARG 83 9.625 -13.404 -18.221 685 1HH2 ARG 83 2HH2 ARG 83 12.619 -14.722 -17.189 686 2HH2 ARG 83 1HH2 ARG 83 11.482 -14.523 -18.488 687 H LEU 84 H LEU 84 7.596 -7.877 -13.427 688 HA LEU 84 HA LEU 84 7.035 -8.254 -10.520 689 1HB LEU 84 HB2 LEU 84 7.598 -5.820 -12.240 690 2HB LEU 84 HB3 LEU 84 6.722 -5.685 -10.736 691 HG LEU 84 HG LEU 84 8.560 -6.961 -9.593 692 1HD1 LEU 84 1HD1 LEU 84 9.846 -7.780 -11.561 693 2HD1 LEU 84 2HD1 LEU 84 10.157 -6.104 -12.055 694 3HD1 LEU 84 3HD1 LEU 84 10.841 -6.735 -10.545 695 1HD2 LEU 84 1HD2 LEU 84 9.132 -4.198 -10.776 696 2HD2 LEU 84 2HD2 LEU 84 8.198 -4.552 -9.303 697 3HD2 LEU 84 3HD2 LEU 84 9.935 -4.886 -9.346 698 H ILE 85 H ILE 85 5.302 -8.623 -13.324 699 HA ILE 85 HA ILE 85 2.903 -8.798 -11.735 700 HB ILE 85 H5T ILE 85 2.943 -6.319 -12.260 701 1HG1 ILE 85 2HG1 ILE 85 0.594 -7.831 -13.459 702 2HG1 ILE 85 3HG1 ILE 85 0.893 -7.641 -11.728 703 1HG2 ILE 85 1HG2 ILE 85 2.507 -5.495 -14.470 704 2HG2 ILE 85 2HG2 ILE 85 3.938 -6.506 -14.542 705 3HG2 ILE 85 3HG2 ILE 85 2.383 -7.141 -15.127 706 1HD1 ILE 85 1HD1 ILE 85 0.402 -5.417 -13.732 707 2HD1 ILE 85 2HD1 ILE 85 -0.732 -5.992 -12.503 708 3HD1 ILE 85 3HD1 ILE 85 0.759 -5.160 -12.009 709 H LEU 86 H LEU 86 4.362 -9.241 -15.000 710 HA LEU 86 HA LEU 86 2.315 -10.824 -16.040 711 1HB LEU 86 HB2 LEU 86 4.380 -10.151 -17.134 712 2HB LEU 86 HB3 LEU 86 5.297 -11.350 -16.241 713 HG LEU 86 HG LEU 86 2.988 -12.092 -18.094 714 1HD1 LEU 86 1HD1 LEU 86 5.968 -11.904 -18.718 715 2HD1 LEU 86 2HD1 LEU 86 4.712 -12.518 -19.808 716 3HD1 LEU 86 3HD1 LEU 86 4.705 -10.814 -19.338 717 1HD2 LEU 86 1HD2 LEU 86 4.268 -14.250 -18.276 718 2HD2 LEU 86 2HD2 LEU 86 5.387 -13.669 -17.023 719 3HD2 LEU 86 3HD2 LEU 86 3.676 -13.978 -16.651 720 HA PRO 87 HA PRO 87 3.573 -14.629 -13.260 721 1HB PRO 87 HB2 PRO 87 4.497 -13.142 -10.813 722 2HB PRO 87 HB3 PRO 87 5.040 -14.724 -11.454 723 1HG PRO 87 HG2 PRO 87 6.544 -12.503 -11.769 724 2HG PRO 87 HG3 PRO 87 6.358 -13.672 -13.131 725 1HD PRO 87 HD2 PRO 87 4.899 -11.077 -12.665 726 2HD PRO 87 HD3 PRO 87 5.689 -11.675 -14.154 727 H TYR 88 H TYR 88 2.077 -11.598 -12.249 728 HA TYR 88 HA TYR 88 0.024 -13.178 -10.789 729 1HB TYR 88 HB2 TYR 88 1.252 -10.538 -10.247 730 2HB TYR 88 HB3 TYR 88 -0.466 -10.684 -9.962 731 HD1 TYR 88 HD1 TYR 88 2.595 -12.863 -9.284 732 HD2 TYR 88 HD2 TYR 88 -1.085 -11.179 -7.801 733 HE1 TYR 88 HE1 TYR 88 2.874 -14.121 -7.170 734 HE2 TYR 88 HE2 TYR 88 -0.809 -12.450 -5.685 735 HH TYR 88 HH TYR 88 1.982 -14.618 -5.114 736 H GLU 89 H GLU 89 0.162 -10.515 -13.226 737 HA GLU 89 HA GLU 89 -2.687 -10.657 -13.569 738 1HB GLU 89 HB2 GLU 89 -2.509 -9.263 -15.442 739 2HB GLU 89 HB3 GLU 89 -1.482 -8.687 -14.157 740 1HG GLU 89 HG2 GLU 89 -0.286 -8.301 -16.142 741 2HG GLU 89 HG3 GLU 89 0.504 -9.677 -15.388 742 H ARG 90 H ARG 90 -0.451 -13.024 -14.318 743 HA ARG 90 HA ARG 90 -1.866 -14.299 -16.500 744 1HB ARG 90 HB2 ARG 90 -0.837 -16.374 -15.836 745 2HB ARG 90 HB3 ARG 90 0.349 -15.072 -15.915 746 1HG ARG 90 HG2 ARG 90 0.353 -14.879 -13.480 747 2HG ARG 90 HG3 ARG 90 -0.893 -16.133 -13.330 748 1HD ARG 90 HD2 ARG 90 0.580 -17.818 -14.263 749 2HD ARG 90 HD3 ARG 90 1.808 -16.598 -14.667 750 HE ARG 90 H3T ARG 90 1.485 -16.274 -11.963 751 1HH1 ARG 90 2HH2 ARG 90 2.469 -19.047 -13.877 752 2HH1 ARG 90 1HH2 ARG 90 3.505 -19.644 -12.609 753 1HH2 ARG 90 2HH1 ARG 90 2.764 -17.080 -10.426 754 2HH2 ARG 90 1HH1 ARG 90 3.687 -18.532 -10.689 755 H PHE 91 H PHE 91 -2.765 -13.944 -13.071 756 HA PHE 91 HA PHE 91 -4.866 -15.882 -13.222 757 1HB PHE 91 HB2 PHE 91 -5.950 -14.748 -11.379 758 2HB PHE 91 HB3 PHE 91 -4.265 -15.113 -11.117 759 HD1 PHE 91 HD1 PHE 91 -3.555 -13.662 -9.455 760 HD2 PHE 91 HD2 PHE 91 -5.909 -12.034 -12.684 761 HE1 PHE 91 HE1 PHE 91 -3.156 -11.372 -8.618 762 HE2 PHE 91 HE2 PHE 91 -5.428 -9.757 -11.889 763 HZ PHE 91 HZ PHE 91 -4.024 -9.415 -9.872 764 H ILE 92 H ILE 92 -4.791 -12.820 -14.986 765 HA ILE 92 HA ILE 92 -7.684 -12.763 -15.255 766 HB ILE 92 H5T ILE 92 -7.474 -10.949 -16.588 767 1HG1 ILE 92 2HG1 ILE 92 -4.737 -11.843 -17.458 768 2HG1 ILE 92 3HG1 ILE 92 -6.174 -11.585 -18.414 769 1HG2 ILE 92 1HG2 ILE 92 -6.748 -10.567 -14.281 770 2HG2 ILE 92 2HG2 ILE 92 -5.053 -10.640 -14.820 771 3HG2 ILE 92 3HG2 ILE 92 -6.131 -9.372 -15.414 772 1HD1 ILE 92 1HD1 ILE 92 -4.639 -9.801 -18.868 773 2HD1 ILE 92 2HD1 ILE 92 -6.018 -9.129 -17.978 774 3HD1 ILE 92 3HD1 ILE 92 -4.465 -9.410 -17.151 775 H LYS 93 H LYS 93 -5.387 -14.868 -16.625 776 HA LYS 93 HA LYS 93 -7.280 -15.587 -18.840 777 1HB LYS 93 HB2 LYS 93 -5.336 -15.710 -20.401 778 2HB LYS 93 HB3 LYS 93 -5.747 -14.078 -19.872 779 1HG LYS 93 HG2 LYS 93 -3.886 -14.118 -18.235 780 2HG LYS 93 HG3 LYS 93 -3.453 -15.754 -18.748 781 1HD LYS 93 HD2 LYS 93 -2.847 -14.991 -20.952 782 2HD LYS 93 HD3 LYS 93 -3.517 -13.377 -20.666 783 1HE LYS 93 HE2 LYS 93 -1.217 -14.565 -19.054 784 2HE LYS 93 HE3 LYS 93 -0.982 -13.573 -20.495 785 1HZ LYS 93 HZ1 LYS 93 -0.887 -12.228 -18.437 786 2HZ LYS 93 HZ2 LYS 93 -2.090 -11.728 -19.376 787 3HZ LYS 93 HZ3 LYS 93 -2.412 -12.624 -18.055 788 H GLY 94 H GLY 94 -4.810 -16.669 -16.567 789 1HA GLY 94 HA2 GLY 94 -4.878 -19.444 -17.543 790 2HA GLY 94 HA3 GLY 94 -4.088 -18.824 -16.095 791 H GLU 95 H GLU 95 -6.552 -17.515 -15.085 792 HA GLU 95 HA GLU 95 -8.495 -19.702 -14.708 793 1HB GLU 95 HB2 GLU 95 -6.589 -19.602 -12.875 794 2HB GLU 95 HB3 GLU 95 -7.477 -18.207 -12.267 795 1HG GLU 95 HG2 GLU 95 -9.497 -19.665 -11.979 796 2HG GLU 95 HG3 GLU 95 -8.617 -21.012 -12.692 797 H GLU 96 H GLU 96 -8.344 -17.104 -16.030 798 HA GLU 96 HA GLU 96 -9.263 -14.927 -16.021 799 1HB GLU 96 HB2 GLU 96 -11.472 -15.149 -17.040 800 2HB GLU 96 HB3 GLU 96 -10.236 -16.165 -17.755 801 1HG GLU 96 HG2 GLU 96 -11.174 -18.162 -16.951 802 2HG GLU 96 HG3 GLU 96 -12.071 -17.366 -15.662 803 H ASP 97 H ASP 97 -8.917 -14.365 -13.670 804 HA ASP 97 HA ASP 97 -11.165 -14.692 -11.891 805 1HB ASP 97 HB2 ASP 97 -8.686 -14.660 -11.345 806 2HB ASP 97 HB3 ASP 97 -8.718 -12.916 -11.580 807 H LYS 98 H LYS 98 -11.561 -12.863 -14.426 808 HA LYS 98 HA LYS 98 -13.177 -10.943 -12.960 809 1HB LYS 98 HB2 LYS 98 -12.410 -8.952 -14.091 810 2HB LYS 98 HB3 LYS 98 -11.051 -9.723 -13.285 811 1HG LYS 98 HG2 LYS 98 -10.387 -10.727 -15.535 812 2HG LYS 98 HG3 LYS 98 -11.678 -9.758 -16.265 813 1HD LYS 98 HD2 LYS 98 -10.572 -7.689 -15.265 814 2HD LYS 98 HD3 LYS 98 -9.266 -8.731 -14.706 815 1HE LYS 98 HE2 LYS 98 -8.454 -7.767 -16.691 816 2HE LYS 98 HE3 LYS 98 -8.887 -9.423 -17.127 817 1HZ LYS 98 HZ1 LYS 98 -9.675 -7.753 -18.750 818 2HZ LYS 98 HZ2 LYS 98 -10.938 -8.577 -18.119 819 3HZ LYS 98 HZ3 LYS 98 -10.610 -7.048 -17.619 820 HA PRO 99 HA PRO 99 -16.287 -12.056 -15.641 821 1HB PRO 99 HB2 PRO 99 -16.970 -9.155 -16.170 822 2HB PRO 99 HB3 PRO 99 -18.050 -10.505 -15.705 823 1HG PRO 99 HG2 PRO 99 -17.211 -8.729 -13.846 824 2HG PRO 99 HG3 PRO 99 -17.235 -10.483 -13.462 825 1HD PRO 99 HD2 PRO 99 -14.878 -8.764 -14.248 826 2HD PRO 99 HD3 PRO 99 -15.009 -10.021 -12.982 827 H LEU 100 H LEU 100 -14.756 -9.183 -17.251 828 HA LEU 100 HA LEU 100 -15.244 -10.476 -19.870 829 1HB LEU 100 HB2 LEU 100 -14.326 -7.685 -19.120 830 2HB LEU 100 HB3 LEU 100 -14.607 -8.252 -20.763 831 HG LEU 100 HG LEU 100 -16.736 -8.024 -18.585 832 1HD1 LEU 100 1HD1 LEU 100 -17.594 -6.184 -19.969 833 2HD1 LEU 100 2HD1 LEU 100 -15.932 -5.856 -19.453 834 3HD1 LEU 100 3HD1 LEU 100 -16.252 -6.395 -21.117 835 1HD2 LEU 100 1HD2 LEU 100 -17.361 -9.828 -20.091 836 2HD2 LEU 100 2HD2 LEU 100 -18.325 -8.406 -20.491 837 3HD2 LEU 100 3HD2 LEU 100 -16.930 -8.839 -21.513 838 HA PRO 101 HA PRO 101 -10.879 -11.566 -20.060 839 1HB PRO 101 HB2 PRO 101 -10.784 -12.582 -22.624 840 2HB PRO 101 HB3 PRO 101 -11.470 -13.453 -21.218 841 1HG PRO 101 HG2 PRO 101 -12.944 -11.862 -23.327 842 2HG PRO 101 HG3 PRO 101 -13.348 -13.474 -22.672 843 1HD PRO 101 HD2 PRO 101 -14.524 -11.153 -21.808 844 2HD PRO 101 HD3 PRO 101 -14.236 -12.540 -20.712 845 HA PRO 102 HA PRO 102 -8.768 -8.102 -21.739 846 1HB PRO 102 HB2 PRO 102 -6.935 -10.013 -23.200 847 2HB PRO 102 HB3 PRO 102 -6.537 -8.582 -22.199 848 1HG PRO 102 HG2 PRO 102 -6.322 -11.064 -21.154 849 2HG PRO 102 HG3 PRO 102 -7.056 -9.740 -20.190 850 1HD PRO 102 HD2 PRO 102 -8.452 -11.930 -21.735 851 2HD PRO 102 HD3 PRO 102 -8.798 -11.294 -20.099 852 H ILE 103 H ILE 103 -9.506 -6.733 -23.235 853 HA ILE 103 HA ILE 103 -10.395 -5.926 -25.153 854 HB ILE 103 H5T ILE 103 -8.132 -7.321 -26.590 855 1HG1 ILE 103 2HG1 ILE 103 -7.112 -6.419 -24.582 856 2HG1 ILE 103 3HG1 ILE 103 -6.640 -5.492 -25.984 857 1HG2 ILE 103 1HG2 ILE 103 -9.532 -4.630 -26.985 858 2HG2 ILE 103 2HG2 ILE 103 -8.040 -5.112 -27.822 859 3HG2 ILE 103 3HG2 ILE 103 -9.528 -6.002 -28.099 860 1HD1 ILE 103 1HD1 ILE 103 -7.063 -4.019 -24.076 861 2HD1 ILE 103 2HD1 ILE 103 -8.219 -3.675 -25.358 862 3HD1 ILE 103 3HD1 ILE 103 -8.725 -4.610 -23.931 863 H LYS 104 H LYS 104 -11.967 -8.032 -24.437 864 HA LYS 104 HA LYS 104 -13.079 -8.803 -27.049 865 1HB LYS 104 HB2 LYS 104 -11.490 -10.613 -26.709 866 2HB LYS 104 HB3 LYS 104 -12.018 -10.838 -25.056 867 1HG LYS 104 HG2 LYS 104 -12.926 -12.620 -26.341 868 2HG LYS 104 HG3 LYS 104 -14.276 -11.579 -25.925 869 1HD LYS 104 HD2 LYS 104 -14.085 -10.550 -28.266 870 2HD LYS 104 HD3 LYS 104 -12.801 -11.715 -28.593 871 1HE LYS 104 HE2 LYS 104 -14.674 -12.756 -29.510 872 2HE LYS 104 HE3 LYS 104 -14.498 -13.546 -27.942 873 1HZ LYS 104 HZ1 LYS 104 -16.792 -12.945 -28.274 874 2HZ LYS 104 HZ2 LYS 104 -16.241 -11.937 -27.110 875 3HZ LYS 104 HZ3 LYS 104 -16.437 -11.399 -28.638 876 HA PRO 105 HA PRO 105 -16.501 -8.059 -24.099 877 1HB PRO 105 HB2 PRO 105 -18.576 -7.955 -25.888 878 2HB PRO 105 HB3 PRO 105 -17.446 -6.597 -25.606 879 1HG PRO 105 HG2 PRO 105 -17.343 -8.677 -27.808 880 2HG PRO 105 HG3 PRO 105 -17.185 -6.896 -27.958 881 1HD PRO 105 HD2 PRO 105 -15.021 -8.532 -27.879 882 2HD PRO 105 HD3 PRO 105 -14.991 -6.927 -27.089 883 H ARG 106 H ARG 106 -18.057 -9.376 -23.200 884 HA ARG 106 HA ARG 106 -18.726 -12.019 -24.382 885 1HB ARG 106 HB2 ARG 106 -16.526 -12.194 -23.156 886 2HB ARG 106 HB3 ARG 106 -17.369 -11.795 -21.655 887 1HG ARG 106 HG2 ARG 106 -18.669 -13.851 -21.771 888 2HG ARG 106 HG3 ARG 106 -18.157 -14.135 -23.442 889 1HD ARG 106 HD2 ARG 106 -16.962 -15.638 -22.047 890 2HD ARG 106 HD3 ARG 106 -15.813 -14.437 -22.656 891 HE ARG 106 H3T ARG 106 -16.635 -13.440 -20.176 892 1HH1 ARG 106 2HH2 ARG 106 -15.124 -16.465 -21.165 893 2HH1 ARG 106 1HH2 ARG 106 -14.306 -16.638 -19.621 894 1HH2 ARG 106 2HH1 ARG 106 -15.556 -13.762 -18.272 895 2HH2 ARG 106 1HH1 ARG 106 -14.746 -15.312 -18.001 896 H LYS 107 H LYS 107 -19.645 -9.397 -22.338 897 HA LYS 107 HA LYS 107 -22.251 -10.675 -21.856 898 1HB LYS 107 HB2 LYS 107 -20.504 -9.459 -19.663 899 2HB LYS 107 HB3 LYS 107 -22.223 -9.761 -19.475 900 1HG LYS 107 HG2 LYS 107 -20.139 -11.930 -19.975 901 2HG LYS 107 HG3 LYS 107 -20.800 -11.475 -18.406 902 1HD LYS 107 HD2 LYS 107 -23.076 -12.107 -19.134 903 2HD LYS 107 HD3 LYS 107 -22.451 -12.585 -20.727 904 1HE LYS 107 HE2 LYS 107 -20.970 -14.259 -19.652 905 2HE LYS 107 HE3 LYS 107 -21.601 -13.799 -18.064 906 1HZ LYS 107 HZ1 LYS 107 -23.223 -14.956 -20.272 907 2HZ LYS 107 HZ2 LYS 107 -22.742 -15.758 -18.936 908 3HZ LYS 107 HZ3 LYS 107 -23.809 -14.532 -18.807 Start of MODEL 10 1 1H ARG 1 H1 ARG 1 -8.494 0.069 -6.120 2 2H ARG 1 H2 ARG 1 -7.525 -0.736 -7.170 3 3H ARG 1 H3 ARG 1 -8.118 0.733 -7.572 4 HA ARG 1 HA ARG 1 -5.784 0.801 -7.017 5 1HB ARG 1 HB2 ARG 1 -7.070 2.854 -6.701 6 2HB ARG 1 HB3 ARG 1 -7.649 2.308 -5.130 7 1HG ARG 1 HG2 ARG 1 -5.929 3.992 -4.853 8 2HG ARG 1 HG3 ARG 1 -5.358 2.457 -4.208 9 1HD ARG 1 HD2 ARG 1 -4.111 2.095 -6.400 10 2HD ARG 1 HD3 ARG 1 -4.589 3.730 -6.863 11 HE ARG 1 H3T ARG 1 -2.642 2.908 -4.780 12 1HH1 ARG 1 1HH1 ARG 1 -4.238 5.683 -6.205 13 2HH1 ARG 1 2HH1 ARG 1 -3.135 6.789 -5.425 14 1HH2 ARG 1 2HH2 ARG 1 -1.348 4.269 -3.881 15 2HH2 ARG 1 1HH2 ARG 1 -1.491 6.001 -4.135 16 H ALA 2 H ALA 2 -7.553 0.201 -3.934 17 HA ALA 2 HA ALA 2 -5.100 -0.508 -2.576 18 1HB ALA 2 HB1 ALA 2 -6.623 -1.160 -0.752 19 2HB ALA 2 HB2 ALA 2 -7.063 0.426 -1.410 20 3HB ALA 2 HB3 ALA 2 -8.019 -1.015 -1.839 21 H ASP 3 H ASP 3 -7.540 -2.331 -4.383 22 HA ASP 3 HA ASP 3 -6.676 -4.952 -3.599 23 1HB ASP 3 HB2 ASP 3 -7.907 -5.673 -5.624 24 2HB ASP 3 HB3 ASP 3 -8.832 -4.679 -4.506 25 H GLU 4 H GLU 4 -5.571 -2.876 -6.396 26 HA GLU 4 HA GLU 4 -3.718 -4.872 -7.424 27 1HB GLU 4 HB2 GLU 4 -3.615 -1.864 -7.706 28 2HB GLU 4 HB3 GLU 4 -2.627 -3.049 -8.546 29 1HG GLU 4 HG2 GLU 4 -4.123 -2.736 -10.180 30 2HG GLU 4 HG3 GLU 4 -4.954 -4.041 -9.344 31 H GLN 5 H GLN 5 -3.439 -2.078 -5.148 32 HA GLN 5 HA GLN 5 -0.661 -2.471 -4.815 33 1HB GLN 5 HB2 GLN 5 -2.675 -0.993 -3.084 34 2HB GLN 5 HB3 GLN 5 -0.957 -1.102 -2.701 35 1HG GLN 5 HG2 GLN 5 -0.696 -0.318 -5.277 36 2HG GLN 5 HG3 GLN 5 -2.293 0.360 -4.974 37 1HE2 GLN 5 1HE2 GLN 5 1.013 0.181 -3.493 38 2HE2 GLN 5 2HE2 GLN 5 0.988 1.844 -2.922 39 H ALA 6 H ALA 6 -3.404 -3.913 -3.056 40 HA ALA 6 HA ALA 6 -1.760 -5.290 -1.117 41 1HB ALA 6 HB1 ALA 6 -3.772 -6.712 -0.815 42 2HB ALA 6 HB2 ALA 6 -4.189 -4.987 -0.826 43 3HB ALA 6 HB3 ALA 6 -4.506 -5.990 -2.261 44 H PHE 7 H PHE 7 -3.083 -6.382 -4.328 45 HA PHE 7 HA PHE 7 -1.616 -8.853 -4.119 46 1HB PHE 7 HB2 PHE 7 -2.598 -9.555 -6.031 47 2HB PHE 7 HB3 PHE 7 -3.783 -8.537 -5.241 48 HD1 PHE 7 HD1 PHE 7 -1.093 -8.006 -7.894 49 HD2 PHE 7 HD2 PHE 7 -5.227 -7.598 -6.741 50 HE1 PHE 7 HE1 PHE 7 -1.610 -7.030 -10.095 51 HE2 PHE 7 HE2 PHE 7 -5.747 -6.650 -8.968 52 HZ PHE 7 HZ PHE 7 -3.936 -6.350 -10.653 53 H LEU 8 H LEU 8 -0.301 -5.818 -4.706 54 HA LEU 8 HA LEU 8 1.813 -7.027 -6.464 55 1HB LEU 8 HB2 LEU 8 0.946 -4.133 -6.258 56 2HB LEU 8 HB3 LEU 8 2.431 -4.674 -7.044 57 HG LEU 8 HG LEU 8 -0.331 -5.691 -7.844 58 1HD1 LEU 8 1HD1 LEU 8 1.284 -3.535 -9.184 59 2HD1 LEU 8 2HD1 LEU 8 -0.266 -4.195 -9.732 60 3HD1 LEU 8 3HD1 LEU 8 -0.184 -3.275 -8.223 61 1HD2 LEU 8 1HD2 LEU 8 1.411 -7.232 -8.554 62 2HD2 LEU 8 2HD2 LEU 8 0.831 -6.339 -9.947 63 3HD2 LEU 8 3HD2 LEU 8 2.379 -5.899 -9.215 64 H VAL 9 H VAL 9 0.989 -5.619 -3.334 65 HA VAL 9 HA VAL 9 3.793 -5.594 -2.440 66 HB VAL 9 H5T VAL 9 1.142 -5.561 -0.980 67 1HG1 VAL 9 1HG1 VAL 9 2.457 -5.250 1.128 68 2HG1 VAL 9 2HG1 VAL 9 2.600 -6.879 0.467 69 3HG1 VAL 9 3HG1 VAL 9 3.930 -5.717 0.247 70 1HG2 VAL 9 1HG2 VAL 9 3.484 -3.595 -1.031 71 2HG2 VAL 9 2HG2 VAL 9 2.035 -3.441 -2.035 72 3HG2 VAL 9 3HG2 VAL 9 1.894 -3.351 -0.274 73 H ALA 10 H ALA 10 1.021 -7.888 -2.318 74 HA ALA 10 HA ALA 10 2.407 -10.122 -1.382 75 1HB ALA 10 HB1 ALA 10 0.695 -11.460 -2.508 76 2HB ALA 10 HB2 ALA 10 -0.036 -10.028 -1.764 77 3HB ALA 10 HB3 ALA 10 0.236 -10.079 -3.521 78 H LEU 11 H LEU 11 2.119 -9.232 -4.932 79 HA LEU 11 HA LEU 11 4.039 -11.130 -5.768 80 1HB LEU 11 HB2 LEU 11 2.638 -9.928 -7.330 81 2HB LEU 11 HB3 LEU 11 3.474 -8.409 -6.998 82 HG LEU 11 HG LEU 11 5.211 -10.737 -7.801 83 1HD1 LEU 11 1HD1 LEU 11 3.506 -11.144 -9.360 84 2HD1 LEU 11 2HD1 LEU 11 3.256 -9.422 -9.696 85 3HD1 LEU 11 3HD1 LEU 11 4.743 -10.250 -10.229 86 1HD2 LEU 11 1HD2 LEU 11 5.166 -7.849 -8.775 87 2HD2 LEU 11 2HD2 LEU 11 6.140 -8.411 -7.411 88 3HD2 LEU 11 3HD2 LEU 11 6.449 -9.068 -9.006 89 H TYR 12 H TYR 12 4.710 -7.752 -4.648 90 HA TYR 12 HA TYR 12 7.494 -7.781 -5.044 91 1HB TYR 12 HB2 TYR 12 6.402 -5.746 -4.610 92 2HB TYR 12 HB3 TYR 12 5.641 -6.370 -3.164 93 HD1 TYR 12 HD1 TYR 12 6.117 -4.638 -1.711 94 HD2 TYR 12 HD2 TYR 12 9.341 -6.588 -3.818 95 HE1 TYR 12 HE1 TYR 12 7.762 -3.485 -0.264 96 HE2 TYR 12 HE2 TYR 12 10.983 -5.463 -2.345 97 HH TYR 12 HH TYR 12 11.299 -4.007 -0.594 98 H LYS 13 H LYS 13 5.654 -8.971 -2.179 99 HA LYS 13 HA LYS 13 7.994 -9.843 -0.724 100 1HB LYS 13 HB2 LYS 13 5.063 -10.703 -0.643 101 2HB LYS 13 HB3 LYS 13 6.298 -11.384 0.427 102 1HG LYS 13 HG2 LYS 13 6.813 -9.172 1.344 103 2HG LYS 13 HG3 LYS 13 5.650 -8.406 0.252 104 1HD LYS 13 HD2 LYS 13 3.806 -9.699 1.300 105 2HD LYS 13 HD3 LYS 13 4.975 -10.479 2.387 106 1HE LYS 13 HE2 LYS 13 5.618 -8.238 3.279 107 2HE LYS 13 HE3 LYS 13 4.411 -7.482 2.232 108 1HZ LYS 13 HZ1 LYS 13 2.689 -8.747 3.418 109 2HZ LYS 13 HZ2 LYS 13 3.809 -9.448 4.381 110 3HZ LYS 13 HZ3 LYS 13 3.545 -7.845 4.478 111 H TYR 14 H TYR 14 5.898 -11.708 -3.072 112 HA TYR 14 HA TYR 14 7.477 -14.081 -2.868 113 1HB TYR 14 HB2 TYR 14 5.220 -14.025 -3.752 114 2HB TYR 14 HB3 TYR 14 5.683 -12.906 -5.017 115 HD1 TYR 14 HD1 TYR 14 6.806 -16.298 -3.776 116 HD2 TYR 14 HD2 TYR 14 5.783 -13.806 -7.152 117 HE1 TYR 14 HE1 TYR 14 7.170 -18.227 -5.311 118 HE2 TYR 14 HE2 TYR 14 6.128 -15.746 -8.681 119 HH TYR 14 HH TYR 14 7.146 -18.967 -7.482 120 H MET 15 H MET 15 7.795 -11.247 -4.952 121 HA MET 15 HA MET 15 9.911 -12.070 -6.654 122 1HB MET 15 HB2 MET 15 8.438 -10.155 -7.055 123 2HB MET 15 HB3 MET 15 9.019 -9.364 -5.597 124 1HG MET 15 HG2 MET 15 10.098 -8.332 -7.379 125 2HG MET 15 HG3 MET 15 11.270 -9.291 -6.478 126 1HE MET 15 HE1 MET 15 9.568 -10.442 -10.670 127 2HE MET 15 HE2 MET 15 8.707 -10.916 -9.196 128 3HE MET 15 HE3 MET 15 8.904 -9.193 -9.596 129 H LYS 16 H LYS 16 10.104 -10.082 -3.588 130 HA LYS 16 HA LYS 16 12.924 -10.197 -3.307 131 1HB LYS 16 HB2 LYS 16 11.468 -8.728 -1.983 132 2HB LYS 16 HB3 LYS 16 10.647 -10.112 -1.266 133 1HG LYS 16 HG2 LYS 16 12.163 -9.111 0.328 134 2HG LYS 16 HG3 LYS 16 12.667 -10.756 -0.051 135 1HD LYS 16 HD2 LYS 16 14.439 -9.835 -1.584 136 2HD LYS 16 HD3 LYS 16 13.871 -8.201 -1.213 137 1HE LYS 16 HE2 LYS 16 15.798 -8.586 0.129 138 2HE LYS 16 HE3 LYS 16 14.395 -8.608 1.204 139 1HZ LYS 16 HZ1 LYS 16 15.778 -11.029 0.156 140 2HZ LYS 16 HZ2 LYS 16 15.951 -10.430 1.666 141 3HZ LYS 16 HZ3 LYS 16 14.514 -11.045 1.198 142 H GLU 17 H GLU 17 10.449 -12.535 -2.238 143 HA GLU 17 HA GLU 17 12.245 -14.288 -0.918 144 1HB GLU 17 HB2 GLU 17 9.776 -14.295 -0.668 145 2HB GLU 17 HB3 GLU 17 9.615 -14.980 -2.275 146 1HG GLU 17 HG2 GLU 17 9.346 -16.698 -0.589 147 2HG GLU 17 HG3 GLU 17 10.756 -17.023 -1.588 148 H ARG 18 H ARG 18 11.375 -14.177 -4.395 149 HA ARG 18 HA ARG 18 13.008 -16.465 -5.135 150 1HB ARG 18 HB2 ARG 18 11.937 -14.071 -6.677 151 2HB ARG 18 HB3 ARG 18 12.764 -15.423 -7.445 152 1HG ARG 18 HG2 ARG 18 11.042 -16.943 -7.028 153 2HG ARG 18 HG3 ARG 18 10.380 -16.028 -5.676 154 1HD ARG 18 HD2 ARG 18 8.875 -15.776 -7.507 155 2HD ARG 18 HD3 ARG 18 9.651 -14.234 -7.212 156 HE ARG 18 H3T ARG 18 10.904 -14.449 -9.231 157 1HH1 ARG 18 2HH1 ARG 18 8.693 -17.178 -8.920 158 2HH1 ARG 18 1HH1 ARG 18 8.980 -17.679 -10.558 159 1HH2 ARG 18 2HH2 ARG 18 11.215 -15.184 -11.290 160 2HH2 ARG 18 1HH2 ARG 18 10.346 -16.578 -11.857 161 H LYS 19 H LYS 19 14.017 -13.478 -3.967 162 HA LYS 19 HA LYS 19 16.037 -12.715 -3.442 163 1HB LYS 19 HB2 LYS 19 17.311 -15.021 -4.954 164 2HB LYS 19 HB3 LYS 19 18.093 -13.931 -3.808 165 1HG LYS 19 HG2 LYS 19 16.541 -14.710 -2.007 166 2HG LYS 19 HG3 LYS 19 15.873 -15.903 -3.140 167 1HD LYS 19 HD2 LYS 19 18.111 -16.928 -3.396 168 2HD LYS 19 HD3 LYS 19 18.785 -15.739 -2.255 169 1HE LYS 19 HE2 LYS 19 17.214 -16.547 -0.501 170 2HE LYS 19 HE3 LYS 19 16.558 -17.735 -1.637 171 1HZ LYS 19 HZ1 LYS 19 18.770 -18.755 -1.734 172 2HZ LYS 19 HZ2 LYS 19 19.374 -17.661 -0.682 173 3HZ LYS 19 HZ3 LYS 19 18.242 -18.726 -0.189 174 H THR 20 H THR 20 14.575 -11.766 -5.748 175 HA THR 20 HA THR 20 16.831 -10.144 -6.710 176 HB THR 20 H5T THR 20 14.700 -11.065 -8.666 177 HG1 THR 20 HG1 THR 20 16.338 -12.280 -9.594 178 1HG2 THR 20 1HG2 THR 20 15.807 -8.819 -9.063 179 2HG2 THR 20 2HG2 THR 20 17.379 -9.636 -9.073 180 3HG2 THR 20 3HG2 THR 20 16.175 -10.015 -10.324 181 HA PRO 21 HA PRO 21 13.498 -7.870 -4.496 182 1HB PRO 21 HB2 PRO 21 15.652 -5.757 -4.737 183 2HB PRO 21 HB3 PRO 21 14.574 -6.105 -3.348 184 1HG PRO 21 HG2 PRO 21 17.125 -7.012 -3.350 185 2HG PRO 21 HG3 PRO 21 15.798 -8.084 -2.806 186 1HD PRO 21 HD2 PRO 21 17.219 -8.060 -5.467 187 2HD PRO 21 HD3 PRO 21 16.697 -9.449 -4.468 188 H ILE 22 H ILE 22 12.042 -6.127 -5.014 189 HA ILE 22 HA ILE 22 11.680 -5.804 -7.811 190 HB ILE 22 H5T ILE 22 9.924 -5.838 -6.003 191 1HG1 ILE 22 2HG1 ILE 22 9.571 -3.597 -8.031 192 2HG1 ILE 22 3HG1 ILE 22 9.639 -5.303 -8.477 193 1HG2 ILE 22 1HG2 ILE 22 10.915 -4.000 -4.586 194 2HG2 ILE 22 2HG2 ILE 22 10.448 -2.832 -5.840 195 3HG2 ILE 22 3HG2 ILE 22 9.209 -3.757 -4.975 196 1HD1 ILE 22 1HD1 ILE 22 7.573 -4.054 -6.622 197 2HD1 ILE 22 2HD1 ILE 22 7.325 -4.653 -8.270 198 3HD1 ILE 22 3HD1 ILE 22 7.715 -5.796 -6.974 199 H GLU 23 H GLU 23 13.593 -3.834 -5.635 200 HA GLU 23 HA GLU 23 13.802 -1.499 -7.249 201 1HB GLU 23 HB2 GLU 23 15.874 -2.869 -5.482 202 2HB GLU 23 HB3 GLU 23 15.999 -1.223 -6.113 203 1HG GLU 23 HG2 GLU 23 13.886 -0.620 -4.921 204 2HG GLU 23 HG3 GLU 23 13.849 -2.233 -4.205 205 H ARG 24 H ARG 24 14.402 -4.543 -8.400 206 HA ARG 24 HA ARG 24 16.729 -4.161 -10.073 207 1HB ARG 24 HB2 ARG 24 16.008 -6.126 -11.219 208 2HB ARG 24 HB3 ARG 24 15.781 -6.371 -9.490 209 1HG ARG 24 HG2 ARG 24 13.296 -5.832 -9.828 210 2HG ARG 24 HG3 ARG 24 13.626 -5.756 -11.559 211 1HD ARG 24 HD2 ARG 24 14.699 -8.201 -11.040 212 2HD ARG 24 HD3 ARG 24 13.558 -8.152 -9.709 213 HE ARG 24 H3T ARG 24 11.782 -8.294 -11.240 214 1HH1 ARG 24 2HH2 ARG 24 14.749 -7.879 -13.074 215 2HH1 ARG 24 1HH2 ARG 24 13.959 -8.188 -14.594 216 1HH2 ARG 24 2HH1 ARG 24 10.835 -8.564 -13.274 217 2HH2 ARG 24 1HH1 ARG 24 11.832 -8.558 -14.703 218 H ILE 25 H ILE 25 13.599 -2.837 -10.151 219 HA ILE 25 HA ILE 25 14.153 -1.581 -12.789 220 HB ILE 25 H5T ILE 25 12.128 -2.724 -12.979 221 1HG1 ILE 25 2HG1 ILE 25 11.697 0.263 -12.638 222 2HG1 ILE 25 3HG1 ILE 25 12.278 -0.584 -14.060 223 1HG2 ILE 25 1HG2 ILE 25 11.452 -3.173 -10.747 224 2HG2 ILE 25 2HG2 ILE 25 11.097 -1.459 -10.443 225 3HG2 ILE 25 3HG2 ILE 25 10.130 -2.411 -11.582 226 1HD1 ILE 25 1HD1 ILE 25 10.061 -1.760 -14.205 227 2HD1 ILE 25 2HD1 ILE 25 9.486 -0.751 -12.867 228 3HD1 ILE 25 3HD1 ILE 25 9.963 0.012 -14.389 229 HA PRO 26 HA PRO 26 15.094 1.665 -9.844 230 1HB PRO 26 HB2 PRO 26 16.247 3.496 -11.485 231 2HB PRO 26 HB3 PRO 26 16.997 1.914 -11.110 232 1HG PRO 26 HG2 PRO 26 15.383 2.657 -13.570 233 2HG PRO 26 HG3 PRO 26 16.965 1.818 -13.488 234 1HD PRO 26 HD2 PRO 26 14.580 0.464 -13.710 235 2HD PRO 26 HD3 PRO 26 15.973 -0.198 -12.804 236 H TYR 27 H TYR 27 13.332 2.618 -12.856 237 HA TYR 27 HA TYR 27 11.448 4.242 -11.254 238 1HB TYR 27 HB2 TYR 27 13.175 5.402 -13.487 239 2HB TYR 27 HB3 TYR 27 11.725 6.167 -12.871 240 HD1 TYR 27 HD1 TYR 27 15.279 5.789 -12.402 241 HD2 TYR 27 HD2 TYR 27 11.597 6.861 -10.417 242 HE1 TYR 27 HE1 TYR 27 16.574 6.985 -10.635 243 HE2 TYR 27 HE2 TYR 27 12.890 8.055 -8.659 244 HH TYR 27 HH TYR 27 14.966 8.651 -7.895 245 H LEU 28 H LEU 28 9.522 4.675 -12.335 246 HA LEU 28 HA LEU 28 8.999 3.269 -14.917 247 1HB LEU 28 HB2 LEU 28 7.572 2.652 -13.039 248 2HB LEU 28 HB3 LEU 28 7.124 4.335 -12.774 249 HG LEU 28 HG LEU 28 5.905 4.384 -14.928 250 1HD1 LEU 28 1HD1 LEU 28 5.559 2.238 -16.179 251 2HD1 LEU 28 2HD1 LEU 28 7.203 2.863 -16.313 252 3HD1 LEU 28 3HD1 LEU 28 6.865 1.511 -15.220 253 1HD2 LEU 28 1HD2 LEU 28 4.128 2.814 -14.350 254 2HD2 LEU 28 2HD2 LEU 28 5.216 1.956 -13.233 255 3HD2 LEU 28 3HD2 LEU 28 4.732 3.640 -12.915 256 H GLY 29 H GLY 29 10.503 5.070 -15.721 257 1HA GLY 29 HA2 GLY 29 10.528 6.814 -17.286 258 2HA GLY 29 HA3 GLY 29 8.837 7.176 -16.932 259 H PHE 30 H PHE 30 8.644 7.888 -14.420 260 HA PHE 30 HA PHE 30 10.893 9.623 -13.587 261 1HB PHE 30 HB2 PHE 30 9.067 10.709 -15.261 262 2HB PHE 30 HB3 PHE 30 8.192 10.951 -13.769 263 HD1 PHE 30 HD1 PHE 30 11.338 11.661 -15.622 264 HD2 PHE 30 HD2 PHE 30 8.910 12.736 -12.226 265 HE1 PHE 30 HE1 PHE 30 12.722 13.695 -15.280 266 HE2 PHE 30 HE2 PHE 30 10.299 14.770 -11.881 267 HZ PHE 30 HZ PHE 30 12.206 15.250 -13.407 268 H LYS 31 H LYS 31 8.948 7.299 -12.514 269 HA LYS 31 HA LYS 31 8.608 8.458 -9.785 270 1HB LYS 31 HB2 LYS 31 6.246 7.809 -9.725 271 2HB LYS 31 HB3 LYS 31 6.584 8.990 -10.978 272 1HG LYS 31 HG2 LYS 31 6.720 6.909 -12.592 273 2HG LYS 31 HG3 LYS 31 5.960 6.029 -11.272 274 1HD LYS 31 HD2 LYS 31 4.282 6.732 -12.869 275 2HD LYS 31 HD3 LYS 31 4.035 7.645 -11.369 276 1HE LYS 31 HE2 LYS 31 5.145 9.609 -12.337 277 2HE LYS 31 HE3 LYS 31 5.600 8.696 -13.784 278 1HZ LYS 31 HZ1 LYS 31 3.597 10.143 -14.030 279 2HZ LYS 31 HZ2 LYS 31 3.338 8.605 -14.464 280 3HZ LYS 31 HZ3 LYS 31 2.769 9.165 -13.018 281 H GLN 32 H GLN 32 7.879 6.914 -8.201 282 HA GLN 32 HA GLN 32 9.811 4.806 -8.117 283 1HB GLN 32 HB2 GLN 32 9.479 4.798 -5.811 284 2HB GLN 32 HB3 GLN 32 9.314 6.461 -6.329 285 1HG GLN 32 HG2 GLN 32 7.224 4.588 -5.229 286 2HG GLN 32 HG3 GLN 32 7.656 6.197 -4.699 287 1HE2 GLN 32 1HE2 GLN 32 5.349 4.415 -6.402 288 2HE2 GLN 32 2HE2 GLN 32 4.599 5.740 -7.293 289 H ILE 33 H ILE 33 8.268 3.873 -10.075 290 HA ILE 33 HA ILE 33 7.253 2.033 -10.834 291 HB ILE 33 H5T ILE 33 7.837 0.625 -8.277 292 1HG1 ILE 33 2HG1 ILE 33 9.908 1.681 -8.546 293 2HG1 ILE 33 3HG1 ILE 33 10.093 0.049 -9.123 294 1HG2 ILE 33 1HG2 ILE 33 6.652 -0.694 -10.011 295 2HG2 ILE 33 2HG2 ILE 33 7.882 -0.279 -11.213 296 3HG2 ILE 33 3HG2 ILE 33 8.299 -1.310 -9.842 297 1HD1 ILE 33 1HD1 ILE 33 9.900 2.588 -10.792 298 2HD1 ILE 33 2HD1 ILE 33 11.268 1.487 -10.629 299 3HD1 ILE 33 3HD1 ILE 33 9.808 0.972 -11.502 300 H ASN 34 H ASN 34 5.445 3.600 -10.510 301 HA ASN 34 HA ASN 34 3.181 2.928 -8.849 302 1HB ASN 34 HB2 ASN 34 3.887 4.849 -10.986 303 2HB ASN 34 HB3 ASN 34 2.276 4.241 -11.202 304 1HD2 ASN 34 1HD2 ASN 34 0.638 5.086 -10.016 305 2HD2 ASN 34 2HD2 ASN 34 0.924 6.226 -8.696 306 H LEU 35 H LEU 35 3.710 0.540 -9.264 307 HA LEU 35 HA LEU 35 3.327 -0.706 -11.727 308 1HB LEU 35 HB2 LEU 35 4.405 -1.334 -9.379 309 2HB LEU 35 HB3 LEU 35 2.892 -2.143 -9.126 310 HG LEU 35 HG LEU 35 5.033 -2.638 -11.242 311 1HD1 LEU 35 1HD1 LEU 35 5.106 -4.847 -10.025 312 2HD1 LEU 35 2HD1 LEU 35 5.463 -3.453 -8.995 313 3HD1 LEU 35 3HD1 LEU 35 3.878 -4.241 -8.921 314 1HD2 LEU 35 1HD2 LEU 35 2.961 -3.100 -12.440 315 2HD2 LEU 35 2HD2 LEU 35 3.765 -4.605 -12.020 316 3HD2 LEU 35 3HD2 LEU 35 2.354 -4.081 -11.086 317 H TRP 36 H TRP 36 0.832 -0.093 -9.230 318 HA TRP 36 HA TRP 36 -1.308 -1.591 -10.454 319 1HB TRP 36 HB2 TRP 36 -2.767 -0.297 -9.151 320 2HB TRP 36 HB3 TRP 36 -1.359 -0.647 -8.161 321 HD1 TRP 36 HD1 TRP 36 0.340 1.515 -7.751 322 HE1 TRP 36 HE1 TRP 36 -0.141 4.031 -7.663 323 HE3 TRP 36 HE3 TRP 36 -4.347 1.530 -9.835 324 HZ2 TRP 36 HZ2 TRP 36 -2.253 5.829 -8.425 325 HZ3 TRP 36 HZ3 TRP 36 -5.601 3.670 -10.068 326 HH2 TRP 36 HH2 TRP 36 -4.553 5.819 -9.406 327 H THR 37 H THR 37 -0.145 1.794 -10.927 328 HA THR 37 HA THR 37 -1.940 2.529 -13.025 329 HB THR 37 H5T THR 37 0.849 3.636 -12.797 330 HG1 THR 37 HG1 THR 37 -1.390 4.303 -11.191 331 1HG2 THR 37 1HG2 THR 37 -0.284 5.748 -13.359 332 2HG2 THR 37 2HG2 THR 37 -0.543 4.522 -14.610 333 3HG2 THR 37 3HG2 THR 37 -1.843 4.894 -13.456 334 H MET 38 H MET 38 1.353 1.110 -13.106 335 HA MET 38 HA MET 38 1.704 0.973 -15.919 336 1HB MET 38 HB2 MET 38 3.395 0.507 -14.057 337 2HB MET 38 HB3 MET 38 2.589 -1.033 -13.800 338 1HG MET 38 HG2 MET 38 3.113 -1.461 -16.319 339 2HG MET 38 HG3 MET 38 4.306 -0.182 -16.104 340 1HE MET 38 HE1 MET 38 6.616 -1.820 -13.263 341 2HE MET 38 HE2 MET 38 6.471 -0.463 -14.389 342 3HE MET 38 HE3 MET 38 5.300 -0.645 -13.059 343 H PHE 39 H PHE 39 0.177 -1.414 -13.704 344 HA PHE 39 HA PHE 39 -0.652 -3.241 -15.719 345 1HB PHE 39 HB2 PHE 39 -0.695 -3.823 -13.362 346 2HB PHE 39 HB3 PHE 39 -1.830 -2.547 -13.003 347 HD1 PHE 39 HD1 PHE 39 -1.568 -5.506 -15.339 348 HD2 PHE 39 HD2 PHE 39 -4.090 -3.103 -12.791 349 HE1 PHE 39 HE1 PHE 39 -3.478 -7.020 -15.803 350 HE2 PHE 39 HE2 PHE 39 -6.007 -4.598 -13.297 351 HZ PHE 39 HZ PHE 39 -5.697 -6.532 -14.821 352 H GLN 40 H GLN 40 -2.753 -0.598 -14.288 353 HA GLN 40 HA GLN 40 -4.720 -1.131 -16.324 354 1HB GLN 40 HB2 GLN 40 -5.775 0.993 -15.718 355 2HB GLN 40 HB3 GLN 40 -5.401 0.018 -14.298 356 1HG GLN 40 HG2 GLN 40 -3.673 1.435 -13.605 357 2HG GLN 40 HG3 GLN 40 -3.471 2.184 -15.188 358 1HE2 GLN 40 1HE2 GLN 40 -4.535 2.939 -12.135 359 2HE2 GLN 40 2HE2 GLN 40 -5.680 4.178 -12.618 360 H ALA 41 H ALA 41 -1.826 0.946 -16.536 361 HA ALA 41 HA ALA 41 -2.622 2.251 -18.970 362 1HB ALA 41 HB1 ALA 41 -0.203 2.705 -19.204 363 2HB ALA 41 HB2 ALA 41 -0.770 3.067 -17.564 364 3HB ALA 41 HB3 ALA 41 0.150 1.579 -17.877 365 H ALA 42 H ALA 42 -0.699 -0.792 -18.384 366 HA ALA 42 HA ALA 42 -0.443 -1.393 -21.172 367 1HB ALA 42 HB1 ALA 42 0.957 -2.412 -19.433 368 2HB ALA 42 HB2 ALA 42 -0.476 -3.197 -18.728 369 3HB ALA 42 HB3 ALA 42 0.098 -3.672 -20.343 370 H GLN 43 H GLN 43 -2.996 -2.291 -18.783 371 HA GLN 43 HA GLN 43 -4.433 -3.943 -20.602 372 1HB GLN 43 HB2 GLN 43 -5.391 -2.532 -18.116 373 2HB GLN 43 HB3 GLN 43 -6.334 -3.700 -19.039 374 1HG GLN 43 HG2 GLN 43 -3.726 -4.246 -17.576 375 2HG GLN 43 HG3 GLN 43 -5.327 -4.792 -17.124 376 1HE2 GLN 43 1HE2 GLN 43 -2.585 -6.129 -18.054 377 2HE2 GLN 43 2HE2 GLN 43 -3.214 -7.406 -19.059 378 H LYS 44 H LYS 44 -4.549 -0.414 -20.151 379 HA LYS 44 HA LYS 44 -6.872 -0.065 -21.912 380 1HB LYS 44 HB2 LYS 44 -4.824 1.774 -20.631 381 2HB LYS 44 HB3 LYS 44 -5.813 2.352 -21.975 382 1HG LYS 44 HG2 LYS 44 -7.873 1.814 -20.840 383 2HG LYS 44 HG3 LYS 44 -7.016 1.076 -19.485 384 1HD LYS 44 HD2 LYS 44 -6.547 3.993 -20.226 385 2HD LYS 44 HD3 LYS 44 -7.937 3.497 -19.250 386 1HE LYS 44 HE2 LYS 44 -6.453 2.403 -17.619 387 2HE LYS 44 HE3 LYS 44 -5.033 2.887 -18.551 388 1HZ LYS 44 HZ1 LYS 44 -5.710 4.360 -16.617 389 2HZ LYS 44 HZ2 LYS 44 -5.431 5.154 -18.037 390 3HZ LYS 44 HZ3 LYS 44 -6.967 4.877 -17.508 391 H LEU 45 H LEU 45 -3.312 0.219 -22.327 392 HA LEU 45 HA LEU 45 -3.640 0.265 -25.178 393 1HB LEU 45 HB2 LEU 45 -1.188 -0.052 -23.412 394 2HB LEU 45 HB3 LEU 45 -1.112 -0.061 -25.157 395 HG LEU 45 HG LEU 45 -0.454 2.061 -24.606 396 1HD1 LEU 45 1HD1 LEU 45 -3.409 2.434 -25.229 397 2HD1 LEU 45 2HD1 LEU 45 -2.113 3.574 -25.553 398 3HD1 LEU 45 3HD1 LEU 45 -2.150 2.031 -26.426 399 1HD2 LEU 45 1HD2 LEU 45 -2.841 2.455 -22.765 400 2HD2 LEU 45 2HD2 LEU 45 -1.131 2.275 -22.291 401 3HD2 LEU 45 3HD2 LEU 45 -1.651 3.683 -23.216 402 H GLY 46 H GLY 46 -4.747 -2.197 -23.615 403 1HA GLY 46 HA2 GLY 46 -5.533 -4.022 -24.851 404 2HA GLY 46 HA3 GLY 46 -4.173 -3.928 -25.950 405 H GLY 47 H GLY 47 -3.675 -4.030 -22.494 406 1HA GLY 47 HA2 GLY 47 -2.482 -5.446 -21.157 407 2HA GLY 47 HA3 GLY 47 -3.220 -6.790 -22.031 408 H TYR 48 H TYR 48 -0.810 -7.360 -21.207 409 HA TYR 48 HA TYR 48 1.381 -6.834 -22.908 410 1HB TYR 48 HB2 TYR 48 1.205 -8.176 -20.724 411 2HB TYR 48 HB3 TYR 48 0.650 -9.525 -21.688 412 HD1 TYR 48 HD1 TYR 48 2.240 -10.823 -23.038 413 HD2 TYR 48 HD2 TYR 48 3.497 -7.270 -20.932 414 HE1 TYR 48 HE1 TYR 48 4.628 -11.458 -23.370 415 HE2 TYR 48 HE2 TYR 48 5.879 -7.920 -21.247 416 HH TYR 48 HH TYR 48 7.329 -9.460 -22.137 417 H GLU 49 H GLU 49 -1.557 -8.674 -23.563 418 HA GLU 49 HA GLU 49 -0.531 -10.309 -25.647 419 1HB GLU 49 HB2 GLU 49 -3.359 -9.310 -25.072 420 2HB GLU 49 HB3 GLU 49 -2.960 -10.571 -26.253 421 1HG GLU 49 HG2 GLU 49 -2.035 -11.999 -24.491 422 2HG GLU 49 HG3 GLU 49 -2.257 -10.735 -23.283 423 H THR 50 H THR 50 -2.510 -7.256 -26.095 424 HA THR 50 HA THR 50 -1.866 -7.138 -28.896 425 HB THR 50 H5T THR 50 -2.720 -4.876 -27.081 426 HG1 THR 50 HG1 THR 50 -4.792 -5.407 -27.920 427 1HG2 THR 50 1HG2 THR 50 -1.906 -4.012 -29.239 428 2HG2 THR 50 2HG2 THR 50 -2.894 -5.208 -30.109 429 3HG2 THR 50 3HG2 THR 50 -3.668 -3.902 -29.185 430 H ILE 51 H ILE 51 -0.206 -5.914 -25.956 431 HA ILE 51 HA ILE 51 1.679 -4.255 -27.281 432 HB ILE 51 H5T ILE 51 1.352 -5.518 -24.656 433 1HG1 ILE 51 2HG1 ILE 51 2.555 -3.416 -23.924 434 2HG1 ILE 51 3HG1 ILE 51 2.674 -2.970 -25.624 435 1HG2 ILE 51 1HG2 ILE 51 4.209 -5.219 -25.560 436 2HG2 ILE 51 2HG2 ILE 51 3.633 -5.458 -23.885 437 3HG2 ILE 51 3HG2 ILE 51 3.398 -6.729 -25.061 438 1HD1 ILE 51 1HD1 ILE 51 0.092 -3.181 -25.695 439 2HD1 ILE 51 2HD1 ILE 51 0.160 -3.316 -23.929 440 3HD1 ILE 51 3HD1 ILE 51 0.745 -1.846 -24.732 441 H THR 52 H THR 52 1.692 -7.815 -26.870 442 HA THR 52 HA THR 52 4.357 -8.164 -27.910 443 HB THR 52 H5T THR 52 2.027 -10.122 -27.782 444 HG1 THR 52 HG1 THR 52 2.613 -9.369 -25.766 445 1HG2 THR 52 1HG2 THR 52 3.820 -11.858 -27.733 446 2HG2 THR 52 2HG2 THR 52 3.752 -11.013 -29.282 447 3HG2 THR 52 3HG2 THR 52 5.024 -10.607 -28.105 448 H ALA 53 H ALA 53 1.110 -8.266 -29.479 449 HA ALA 53 HA ALA 53 2.231 -8.945 -32.067 450 1HB ALA 53 HB1 ALA 53 -0.107 -8.675 -32.792 451 2HB ALA 53 HB2 ALA 53 -0.027 -9.629 -31.299 452 3HB ALA 53 HB3 ALA 53 -0.525 -7.922 -31.240 453 H ARG 54 H ARG 54 1.635 -5.850 -30.425 454 HA ARG 54 HA ARG 54 2.047 -4.442 -33.056 455 1HB ARG 54 HB2 ARG 54 -0.295 -4.831 -32.250 456 2HB ARG 54 HB3 ARG 54 0.032 -3.788 -30.881 457 1HG ARG 54 HG2 ARG 54 0.280 -1.856 -32.343 458 2HG ARG 54 HG3 ARG 54 0.242 -2.900 -33.787 459 1HD ARG 54 HD2 ARG 54 -2.047 -3.598 -33.251 460 2HD ARG 54 HD3 ARG 54 -2.011 -2.651 -31.749 461 HE ARG 54 H3T ARG 54 -1.412 -0.880 -33.878 462 1HH1 ARG 54 2HH2 ARG 54 -4.197 -2.700 -32.788 463 2HH1 ARG 54 1HH2 ARG 54 -5.325 -1.553 -33.458 464 1HH2 ARG 54 2HH1 ARG 54 -2.904 0.545 -34.711 465 2HH2 ARG 54 1HH1 ARG 54 -4.604 0.233 -34.513 466 H ARG 55 H ARG 55 3.547 -4.611 -30.066 467 HA ARG 55 HA ARG 55 5.240 -3.348 -29.130 468 1HB ARG 55 HB2 ARG 55 5.463 -2.154 -31.919 469 2HB ARG 55 HB3 ARG 55 6.675 -2.065 -30.639 470 1HG ARG 55 HG2 ARG 55 6.949 -4.520 -30.681 471 2HG ARG 55 HG3 ARG 55 5.690 -4.657 -31.917 472 1HD ARG 55 HD2 ARG 55 7.806 -4.801 -33.037 473 2HD ARG 55 HD3 ARG 55 7.035 -3.283 -33.472 474 HE ARG 55 H3T ARG 55 8.706 -2.079 -32.394 475 1HH1 ARG 55 2HH1 ARG 55 9.202 -5.462 -31.607 476 2HH1 ARG 55 1HH1 ARG 55 10.789 -5.164 -30.953 477 1HH2 ARG 55 2HH2 ARG 55 10.714 -1.775 -31.521 478 2HH2 ARG 55 1HH2 ARG 55 11.613 -3.126 -30.901 479 H GLN 56 H GLN 56 3.163 -2.603 -28.052 480 HA GLN 56 HA GLN 56 2.672 0.252 -28.640 481 1HB GLN 56 HB2 GLN 56 0.865 -1.645 -27.157 482 2HB GLN 56 HB3 GLN 56 0.547 0.056 -27.513 483 1HG GLN 56 HG2 GLN 56 1.016 -0.693 -30.011 484 2HG GLN 56 HG3 GLN 56 0.635 -2.302 -29.373 485 1HE2 GLN 56 1HE2 GLN 56 -1.502 -1.730 -27.561 486 2HE2 GLN 56 2HE2 GLN 56 -2.800 -1.035 -28.512 487 H TRP 57 H TRP 57 4.733 -1.211 -26.571 488 HA TRP 57 HA TRP 57 4.331 0.202 -24.120 489 1HB TRP 57 HB2 TRP 57 7.060 -0.302 -25.340 490 2HB TRP 57 HB3 TRP 57 6.661 0.138 -23.732 491 HD1 TRP 57 HD1 TRP 57 6.754 -2.882 -25.954 492 HE1 TRP 57 HE1 TRP 57 6.188 -4.988 -24.585 493 HE3 TRP 57 HE3 TRP 57 5.431 -0.667 -21.515 494 HZ2 TRP 57 HZ2 TRP 57 5.112 -5.612 -22.002 495 HZ3 TRP 57 HZ3 TRP 57 4.565 -2.055 -19.627 496 HH2 TRP 57 HH2 TRP 57 4.323 -4.505 -19.925 497 H LYS 58 H LYS 58 5.550 1.431 -27.281 498 HA LYS 58 HA LYS 58 6.146 4.054 -26.229 499 1HB LYS 58 HB2 LYS 58 5.498 3.064 -29.022 500 2HB LYS 58 HB3 LYS 58 5.671 4.780 -28.697 501 1HG LYS 58 HG2 LYS 58 7.799 2.639 -28.333 502 2HG LYS 58 HG3 LYS 58 7.766 3.949 -29.509 503 1HD LYS 58 HD2 LYS 58 8.330 4.109 -26.537 504 2HD LYS 58 HD3 LYS 58 9.366 4.572 -27.880 505 1HE LYS 58 HE2 LYS 58 7.851 6.476 -28.411 506 2HE LYS 58 HE3 LYS 58 6.776 5.992 -27.094 507 1HZ LYS 58 HZ1 LYS 58 8.777 6.316 -25.584 508 2HZ LYS 58 HZ2 LYS 58 9.544 7.022 -26.821 509 3HZ LYS 58 HZ3 LYS 58 8.175 7.690 -26.246 510 H HIS 59 H HIS 59 2.951 2.697 -26.853 511 HA HIS 59 HA HIS 59 1.807 5.354 -26.202 512 1HB HIS 59 HB2 HIS 59 0.424 2.712 -26.722 513 2HB HIS 59 HB3 HIS 59 -0.303 4.326 -26.669 514 HD1 HIS 59 HD1 HIS 59 1.474 5.959 -28.636 515 HD2 HIS 59 HD2 HIS 59 0.312 1.951 -29.196 516 HE1 HIS 59 HE1 HIS 59 1.672 5.501 -31.136 517 H ILE 60 H ILE 60 2.790 2.492 -24.441 518 HA ILE 60 HA ILE 60 1.186 3.119 -22.045 519 HB ILE 60 H5T ILE 60 3.639 1.363 -22.438 520 1HG1 ILE 60 2HG1 ILE 60 0.727 0.667 -21.826 521 2HG1 ILE 60 3HG1 ILE 60 1.420 0.620 -23.446 522 1HG2 ILE 60 1HG2 ILE 60 1.961 1.743 -19.920 523 2HG2 ILE 60 2HG2 ILE 60 3.259 0.553 -20.129 524 3HG2 ILE 60 3HG2 ILE 60 3.647 2.257 -20.132 525 1HD1 ILE 60 1HD1 ILE 60 2.991 -1.137 -22.785 526 2HD1 ILE 60 2HD1 ILE 60 2.322 -1.142 -21.133 527 3HD1 ILE 60 3HD1 ILE 60 1.317 -1.617 -22.491 528 H TYR 61 H TYR 61 4.372 3.924 -23.408 529 HA TYR 61 HA TYR 61 5.338 5.689 -21.431 530 1HB TYR 61 HB2 TYR 61 6.702 4.983 -23.272 531 2HB TYR 61 HB3 TYR 61 5.575 5.613 -24.439 532 HD1 TYR 61 HD1 TYR 61 8.367 6.417 -22.210 533 HD2 TYR 61 HD2 TYR 61 5.423 8.029 -24.925 534 HE1 TYR 61 HE1 TYR 61 9.698 8.508 -22.405 535 HE2 TYR 61 HE2 TYR 61 6.756 10.125 -25.111 536 HH TYR 61 HH TYR 61 9.831 10.640 -23.362 537 H ASP 62 H ASP 62 3.063 6.313 -24.163 538 HA ASP 62 HA ASP 62 2.505 8.982 -23.531 539 1HB ASP 62 HB2 ASP 62 1.854 7.860 -25.633 540 2HB ASP 62 HB3 ASP 62 0.533 7.075 -24.770 541 H GLU 63 H GLU 63 0.601 6.108 -22.433 542 HA GLU 63 HA GLU 63 -1.028 7.644 -20.713 543 1HB GLU 63 HB2 GLU 63 -1.503 5.397 -21.657 544 2HB GLU 63 HB3 GLU 63 -0.301 4.698 -20.584 545 1HG GLU 63 HG2 GLU 63 -2.494 4.273 -19.736 546 2HG GLU 63 HG3 GLU 63 -1.656 5.341 -18.620 547 H LEU 64 H LEU 64 2.095 6.073 -19.882 548 HA LEU 64 HA LEU 64 1.756 6.419 -17.048 549 1HB LEU 64 HB2 LEU 64 3.853 5.453 -16.781 550 2HB LEU 64 HB3 LEU 64 3.200 4.710 -18.218 551 HG LEU 64 HG LEU 64 4.658 6.497 -19.496 552 1HD1 LEU 64 1HD1 LEU 64 6.804 6.964 -18.348 553 2HD1 LEU 64 2HD1 LEU 64 5.489 7.794 -17.532 554 3HD1 LEU 64 3HD1 LEU 64 6.140 6.299 -16.843 555 1HD2 LEU 64 1HD2 LEU 64 5.027 4.056 -19.556 556 2HD2 LEU 64 2HD2 LEU 64 6.571 4.908 -19.449 557 3HD2 LEU 64 3HD2 LEU 64 5.880 4.138 -18.003 558 H GLY 65 H GLY 65 2.692 8.715 -19.467 559 1HA GLY 65 HA2 GLY 65 2.842 11.045 -18.874 560 2HA GLY 65 HA3 GLY 65 3.586 10.632 -17.331 561 H GLY 66 H GLY 66 4.874 8.810 -19.985 562 1HA GLY 66 HA2 GLY 66 7.000 8.736 -20.825 563 2HA GLY 66 HA3 GLY 66 6.689 10.416 -21.202 564 H ASN 67 H ASN 67 8.957 10.478 -21.224 565 HA ASN 67 HA ASN 67 10.013 11.786 -18.875 566 1HB ASN 67 HB2 ASN 67 10.771 9.483 -18.426 567 2HB ASN 67 HB3 ASN 67 11.455 9.355 -20.040 568 1HD2 ASN 67 1HD2 ASN 67 12.356 9.795 -16.888 569 2HD2 ASN 67 2HD2 ASN 67 13.832 10.715 -17.182 570 HA PRO 68 HA PRO 68 11.047 14.423 -22.318 571 1HB PRO 68 HB2 PRO 68 13.477 15.133 -20.661 572 2HB PRO 68 HB3 PRO 68 12.393 16.215 -21.591 573 1HG PRO 68 HG2 PRO 68 12.060 15.935 -18.921 574 2HG PRO 68 HG3 PRO 68 10.630 15.929 -20.003 575 1HD PRO 68 HD2 PRO 68 12.023 13.587 -18.711 576 2HD PRO 68 HD3 PRO 68 10.274 13.894 -18.941 577 H GLY 69 H GLY 69 14.115 12.929 -21.098 578 1HA GLY 69 HA2 GLY 69 14.960 12.522 -23.928 579 2HA GLY 69 HA3 GLY 69 15.964 12.502 -22.491 580 H SER 70 H SER 70 14.234 10.556 -20.996 581 HA SER 70 HA SER 70 15.332 8.122 -22.214 582 1HB SER 70 HB2 SER 70 13.683 8.407 -19.686 583 2HB SER 70 HB3 SER 70 14.579 6.981 -20.218 584 HG SER 70 HG SER 70 15.780 8.217 -18.714 585 H THR 71 H THR 71 13.841 8.804 -24.126 586 HA THR 71 HA THR 71 11.110 8.296 -24.256 587 HB THR 71 H5T THR 71 12.443 9.307 -26.022 588 HG1 THR 71 HG1 THR 71 11.345 8.402 -27.715 589 1HG2 THR 71 1HG2 THR 71 14.392 7.743 -26.082 590 2HG2 THR 71 2HG2 THR 71 13.347 6.493 -26.788 591 3HG2 THR 71 3HG2 THR 71 13.662 7.996 -27.671 592 H SER 72 H SER 72 13.678 5.915 -24.152 593 HA SER 72 HA SER 72 12.131 3.594 -24.816 594 1HB SER 72 HB2 SER 72 14.746 3.792 -23.270 595 2HB SER 72 HB3 SER 72 14.111 2.365 -24.107 596 HG SER 72 HG SER 72 15.667 3.489 -25.371 597 H ALA 73 H ALA 73 11.925 5.411 -21.887 598 HA ALA 73 HA ALA 73 12.035 3.662 -19.881 599 1HB ALA 73 HB1 ALA 73 11.400 5.984 -19.601 600 2HB ALA 73 HB2 ALA 73 9.793 5.677 -20.298 601 3HB ALA 73 HB3 ALA 73 10.244 4.941 -18.747 602 H ALA 74 H ALA 74 8.822 3.839 -21.602 603 HA ALA 74 HA ALA 74 7.712 1.448 -20.513 604 1HB ALA 74 HB1 ALA 74 7.228 2.697 -23.191 605 2HB ALA 74 HB2 ALA 74 6.132 1.658 -22.230 606 3HB ALA 74 HB3 ALA 74 6.538 3.268 -21.649 607 H THR 75 H THR 75 10.096 1.785 -23.131 608 HA THR 75 HA THR 75 9.765 -1.005 -24.030 609 HB THR 75 H5T THR 75 11.903 1.103 -24.603 610 HG1 THR 75 HG1 THR 75 9.767 1.531 -25.361 611 1HG2 THR 75 1HG2 THR 75 12.864 -1.076 -25.141 612 2HG2 THR 75 2HG2 THR 75 11.363 -1.578 -25.961 613 3HG2 THR 75 3HG2 THR 75 12.376 -0.282 -26.642 614 H CYS 76 H CYS 76 11.619 0.624 -21.534 615 HA CYS 76 HA CYS 76 13.106 -1.877 -20.885 616 1HB CYS 76 HB2 CYS 76 12.963 0.836 -19.467 617 2HB CYS 76 HB3 CYS 76 14.083 -0.486 -19.094 618 HG CYS 76 HG CYS 76 13.749 1.229 -21.913 619 H THR 77 H THR 77 10.185 -0.119 -19.868 620 HA THR 77 HA THR 77 9.669 -1.588 -17.471 621 HB THR 77 H5T THR 77 7.726 -0.463 -19.514 622 HG1 THR 77 HG1 THR 77 9.186 1.025 -18.492 623 1HG2 THR 77 1HG2 THR 77 7.245 -1.282 -16.639 624 2HG2 THR 77 2HG2 THR 77 6.136 -0.317 -17.644 625 3HG2 THR 77 3HG2 THR 77 6.497 -1.988 -18.097 626 H ARG 78 H ARG 78 9.313 -2.583 -20.896 627 HA ARG 78 HA ARG 78 7.547 -4.692 -20.502 628 1HB ARG 78 HB2 ARG 78 8.107 -5.414 -22.662 629 2HB ARG 78 HB3 ARG 78 8.448 -3.680 -22.687 630 1HG ARG 78 HG2 ARG 78 10.901 -4.323 -22.215 631 2HG ARG 78 HG3 ARG 78 10.440 -5.979 -22.580 632 1HD ARG 78 HD2 ARG 78 10.015 -3.634 -24.481 633 2HD ARG 78 HD3 ARG 78 11.429 -4.675 -24.512 634 HE ARG 78 H3T ARG 78 8.739 -5.296 -25.471 635 1HH1 ARG 78 2HH2 ARG 78 11.788 -6.771 -24.559 636 2HH1 ARG 78 1HH2 ARG 78 11.452 -8.226 -25.451 637 1HH2 ARG 78 2HH1 ARG 78 8.374 -7.196 -26.575 638 2HH2 ARG 78 1HH1 ARG 78 9.572 -8.453 -26.560 639 H ARG 79 H ARG 79 11.050 -4.679 -19.850 640 HA ARG 79 HA ARG 79 10.990 -7.541 -19.588 641 1HB ARG 79 HB2 ARG 79 13.406 -7.417 -19.290 642 2HB ARG 79 HB3 ARG 79 12.975 -6.185 -20.481 643 1HG ARG 79 HG2 ARG 79 12.756 -4.640 -18.345 644 2HG ARG 79 HG3 ARG 79 13.766 -5.847 -17.574 645 1HD ARG 79 HD2 ARG 79 15.566 -5.395 -19.144 646 2HD ARG 79 HD3 ARG 79 14.504 -4.327 -20.105 647 HE ARG 79 H3T ARG 79 14.434 -3.397 -17.440 648 1HH1 ARG 79 2HH2 ARG 79 16.837 -3.443 -19.989 649 2HH1 ARG 79 1HH2 ARG 79 17.644 -2.035 -19.353 650 1HH2 ARG 79 2HH1 ARG 79 15.475 -1.716 -16.678 651 2HH2 ARG 79 1HH1 ARG 79 16.879 -1.062 -17.493 652 H HIS 80 H HIS 80 10.207 -5.051 -17.570 653 HA HIS 80 HA HIS 80 10.645 -6.486 -14.996 654 1HB HIS 80 HB2 HIS 80 9.659 -3.701 -15.589 655 2HB HIS 80 HB3 HIS 80 10.006 -4.393 -14.002 656 HD1 HIS 80 HD1 HIS 80 12.801 -5.554 -14.148 657 HD2 HIS 80 HD2 HIS 80 11.642 -2.133 -16.293 658 HE1 HIS 80 HE1 HIS 80 14.944 -4.289 -14.684 659 H TYR 81 H TYR 81 7.986 -5.115 -17.021 660 HA TYR 81 HA TYR 81 5.784 -6.010 -15.588 661 1HB TYR 81 HB2 TYR 81 5.934 -4.522 -17.637 662 2HB TYR 81 HB3 TYR 81 6.021 -5.976 -18.618 663 HD1 TYR 81 HD1 TYR 81 3.989 -7.660 -18.436 664 HD2 TYR 81 HD2 TYR 81 3.894 -3.576 -17.070 665 HE1 TYR 81 HE1 TYR 81 1.493 -7.706 -18.451 666 HE2 TYR 81 HE2 TYR 81 1.418 -3.603 -17.113 667 HH TYR 81 HH TYR 81 -0.450 -4.844 -17.510 668 H GLU 82 H GLU 82 7.850 -7.992 -17.764 669 HA GLU 82 HA GLU 82 6.019 -10.186 -18.028 670 1HB GLU 82 HB2 GLU 82 7.944 -11.429 -18.869 671 2HB GLU 82 HB3 GLU 82 7.745 -9.876 -19.673 672 1HG GLU 82 HG2 GLU 82 9.600 -8.920 -18.580 673 2HG GLU 82 HG3 GLU 82 9.648 -10.148 -17.337 674 H ARG 83 H ARG 83 7.872 -9.125 -15.329 675 HA ARG 83 HA ARG 83 7.164 -11.679 -14.044 676 1HB ARG 83 HB2 ARG 83 9.648 -10.157 -13.232 677 2HB ARG 83 HB3 ARG 83 9.141 -11.737 -12.656 678 1HG ARG 83 HG2 ARG 83 10.114 -11.103 -15.460 679 2HG ARG 83 HG3 ARG 83 11.073 -11.843 -14.200 680 1HD ARG 83 HD2 ARG 83 10.031 -13.889 -14.348 681 2HD ARG 83 HD3 ARG 83 8.506 -13.219 -14.932 682 HE ARG 83 H3T ARG 83 10.406 -12.697 -16.958 683 1HH1 ARG 83 2HH1 ARG 83 8.881 -15.564 -15.621 684 2HH1 ARG 83 1HH1 ARG 83 8.985 -16.400 -17.148 685 1HH2 ARG 83 2HH2 ARG 83 10.454 -13.700 -18.749 686 2HH2 ARG 83 1HH2 ARG 83 9.900 -15.367 -18.932 687 H LEU 84 H LEU 84 6.916 -8.230 -13.864 688 HA LEU 84 HA LEU 84 6.378 -8.262 -10.975 689 1HB LEU 84 HB2 LEU 84 6.844 -6.218 -13.125 690 2HB LEU 84 HB3 LEU 84 5.780 -5.746 -11.856 691 HG LEU 84 HG LEU 84 7.486 -6.342 -10.144 692 1HD1 LEU 84 1HD1 LEU 84 8.867 -7.924 -11.508 693 2HD1 LEU 84 2HD1 LEU 84 9.401 -6.557 -12.507 694 3HD1 LEU 84 3HD1 LEU 84 9.821 -6.618 -10.784 695 1HD2 LEU 84 1HD2 LEU 84 7.233 -4.016 -10.930 696 2HD2 LEU 84 2HD2 LEU 84 8.940 -4.366 -10.624 697 3HD2 LEU 84 3HD2 LEU 84 8.322 -4.331 -12.291 698 H ILE 85 H ILE 85 4.452 -8.811 -13.760 699 HA ILE 85 HA ILE 85 1.966 -8.684 -12.228 700 HB ILE 85 H5T ILE 85 2.273 -6.324 -12.583 701 1HG1 ILE 85 2HG1 ILE 85 0.391 -5.660 -14.085 702 2HG1 ILE 85 3HG1 ILE 85 0.270 -7.307 -14.673 703 1HG2 ILE 85 1HG2 ILE 85 3.921 -6.249 -14.331 704 2HG2 ILE 85 2HG2 ILE 85 2.741 -6.857 -15.508 705 3HG2 ILE 85 3HG2 ILE 85 2.545 -5.254 -14.767 706 1HD1 ILE 85 1HD1 ILE 85 -1.433 -6.969 -12.998 707 2HD1 ILE 85 2HD1 ILE 85 -0.213 -8.004 -12.242 708 3HD1 ILE 85 3HD1 ILE 85 -0.266 -6.259 -11.872 709 H LEU 86 H LEU 86 3.510 -9.131 -15.451 710 HA LEU 86 HA LEU 86 1.417 -10.434 -16.733 711 1HB LEU 86 HB2 LEU 86 3.589 -9.851 -17.674 712 2HB LEU 86 HB3 LEU 86 4.371 -11.109 -16.746 713 HG LEU 86 HG LEU 86 4.044 -11.528 -19.180 714 1HD1 LEU 86 1HD1 LEU 86 4.421 -13.388 -17.568 715 2HD1 LEU 86 2HD1 LEU 86 2.662 -13.661 -17.520 716 3HD1 LEU 86 3HD1 LEU 86 3.549 -13.849 -19.037 717 1HD2 LEU 86 1HD2 LEU 86 1.909 -12.212 -20.074 718 2HD2 LEU 86 2HD2 LEU 86 1.111 -11.976 -18.507 719 3HD2 LEU 86 3HD2 LEU 86 1.755 -10.581 -19.402 720 HA PRO 87 HA PRO 87 2.150 -14.531 -14.388 721 1HB PRO 87 HB2 PRO 87 3.472 -14.598 -11.977 722 2HB PRO 87 HB3 PRO 87 4.268 -14.816 -13.567 723 1HG PRO 87 HG2 PRO 87 4.028 -12.263 -11.944 724 2HG PRO 87 HG3 PRO 87 5.505 -12.980 -12.665 725 1HD PRO 87 HD2 PRO 87 4.184 -11.029 -13.933 726 2HD PRO 87 HD3 PRO 87 4.815 -12.409 -14.863 727 H TYR 88 H TYR 88 1.170 -11.510 -12.920 728 HA TYR 88 HA TYR 88 -0.644 -12.988 -11.059 729 1HB TYR 88 HB2 TYR 88 0.616 -10.302 -10.958 730 2HB TYR 88 HB3 TYR 88 -1.027 -10.455 -10.348 731 HD1 TYR 88 HD1 TYR 88 1.833 -12.945 -10.124 732 HD2 TYR 88 HD2 TYR 88 -0.861 -10.313 -8.020 733 HE1 TYR 88 HE1 TYR 88 2.615 -13.873 -7.969 734 HE2 TYR 88 HE2 TYR 88 -0.081 -11.261 -5.857 735 HH TYR 88 HH TYR 88 2.396 -13.836 -5.677 736 H GLU 89 H GLU 89 -0.867 -10.587 -13.775 737 HA GLU 89 HA GLU 89 -3.661 -10.682 -13.881 738 1HB GLU 89 HB2 GLU 89 -3.644 -9.905 -16.035 739 2HB GLU 89 HB3 GLU 89 -2.207 -9.212 -15.305 740 1HG GLU 89 HG2 GLU 89 -0.760 -10.639 -16.560 741 2HG GLU 89 HG3 GLU 89 -2.069 -11.726 -17.028 742 H ARG 90 H ARG 90 -1.631 -13.380 -14.224 743 HA ARG 90 HA ARG 90 -3.222 -15.114 -15.871 744 1HB ARG 90 HB2 ARG 90 -1.561 -15.740 -13.394 745 2HB ARG 90 HB3 ARG 90 -2.297 -16.946 -14.456 746 1HG ARG 90 HG2 ARG 90 -0.988 -16.023 -16.388 747 2HG ARG 90 HG3 ARG 90 -0.133 -14.964 -15.262 748 1HD ARG 90 HD2 ARG 90 -0.192 -18.013 -15.169 749 2HD ARG 90 HD3 ARG 90 1.158 -17.012 -15.741 750 HE ARG 90 H3T ARG 90 0.607 -16.120 -13.144 751 1HH1 ARG 90 1HH2 ARG 90 1.739 -19.152 -14.489 752 2HH1 ARG 90 2HH2 ARG 90 2.556 -19.594 -13.012 753 1HH2 ARG 90 2HH1 ARG 90 1.640 -16.710 -11.353 754 2HH2 ARG 90 1HH1 ARG 90 2.512 -18.218 -11.267 755 H PHE 91 H PHE 91 -3.791 -14.068 -12.436 756 HA PHE 91 HA PHE 91 -5.980 -15.995 -12.260 757 1HB PHE 91 HB2 PHE 91 -6.687 -14.810 -10.217 758 2HB PHE 91 HB3 PHE 91 -5.058 -15.432 -10.216 759 HD1 PHE 91 HD1 PHE 91 -3.532 -14.146 -9.051 760 HD2 PHE 91 HD2 PHE 91 -6.748 -12.152 -11.119 761 HE1 PHE 91 HE1 PHE 91 -2.696 -11.960 -8.253 762 HE2 PHE 91 HE2 PHE 91 -5.865 -9.960 -10.366 763 HZ PHE 91 HZ PHE 91 -3.834 -9.859 -8.941 764 H ILE 92 H ILE 92 -5.801 -12.950 -13.876 765 HA ILE 92 HA ILE 92 -8.764 -12.870 -14.135 766 HB ILE 92 H5T ILE 92 -6.937 -11.010 -15.633 767 1HG1 ILE 92 2HG1 ILE 92 -7.544 -10.594 -12.676 768 2HG1 ILE 92 3HG1 ILE 92 -5.953 -10.984 -13.343 769 1HG2 ILE 92 1HG2 ILE 92 -8.770 -9.415 -15.290 770 2HG2 ILE 92 2HG2 ILE 92 -9.449 -10.907 -15.888 771 3HG2 ILE 92 3HG2 ILE 92 -9.578 -10.531 -14.163 772 1HD1 ILE 92 1HD1 ILE 92 -7.473 -8.406 -13.751 773 2HD1 ILE 92 2HD1 ILE 92 -5.944 -8.671 -12.907 774 3HD1 ILE 92 3HD1 ILE 92 -6.016 -8.876 -14.668 775 H LYS 93 H LYS 93 -6.299 -14.546 -15.599 776 HA LYS 93 HA LYS 93 -7.797 -14.642 -18.215 777 1HB LYS 93 HB2 LYS 93 -4.804 -14.575 -17.662 778 2HB LYS 93 HB3 LYS 93 -5.574 -14.770 -19.223 779 1HG LYS 93 HG2 LYS 93 -5.889 -12.265 -17.549 780 2HG LYS 93 HG3 LYS 93 -4.668 -12.501 -18.794 781 1HD LYS 93 HD2 LYS 93 -6.444 -12.818 -20.504 782 2HD LYS 93 HD3 LYS 93 -7.676 -12.619 -19.260 783 1HE LYS 93 HE2 LYS 93 -7.491 -10.546 -20.414 784 2HE LYS 93 HE3 LYS 93 -6.829 -10.317 -18.791 785 1HZ LYS 93 HZ1 LYS 93 -5.175 -10.780 -21.235 786 2HZ LYS 93 HZ2 LYS 93 -5.454 -9.321 -20.552 787 3HZ LYS 93 HZ3 LYS 93 -4.598 -10.425 -19.722 788 H GLY 94 H GLY 94 -6.285 -16.642 -15.758 789 1HA GLY 94 HA2 GLY 94 -6.919 -19.047 -17.464 790 2HA GLY 94 HA3 GLY 94 -5.406 -18.875 -16.579 791 H GLU 95 H GLU 95 -7.025 -17.589 -14.261 792 HA GLU 95 HA GLU 95 -8.415 -20.036 -13.260 793 1HB GLU 95 HB2 GLU 95 -6.944 -17.928 -11.631 794 2HB GLU 95 HB3 GLU 95 -7.731 -19.349 -10.973 795 1HG GLU 95 HG2 GLU 95 -5.278 -19.325 -12.773 796 2HG GLU 95 HG3 GLU 95 -5.301 -19.596 -11.038 797 H GLU 96 H GLU 96 -9.215 -17.456 -14.591 798 HA GLU 96 HA GLU 96 -10.671 -15.619 -14.303 799 1HB GLU 96 HB2 GLU 96 -12.923 -16.444 -14.747 800 2HB GLU 96 HB3 GLU 96 -11.690 -17.212 -15.734 801 1HG GLU 96 HG2 GLU 96 -11.833 -19.281 -14.531 802 2HG GLU 96 HG3 GLU 96 -12.773 -18.560 -13.229 803 H ASP 97 H ASP 97 -9.705 -15.284 -11.926 804 HA ASP 97 HA ASP 97 -11.476 -16.112 -9.770 805 1HB ASP 97 HB2 ASP 97 -8.951 -15.948 -9.736 806 2HB ASP 97 HB3 ASP 97 -9.117 -14.195 -9.729 807 H LYS 98 H LYS 98 -12.047 -13.675 -11.930 808 HA LYS 98 HA LYS 98 -12.997 -11.570 -11.855 809 1HB LYS 98 HB2 LYS 98 -14.747 -13.193 -9.985 810 2HB LYS 98 HB3 LYS 98 -15.263 -11.737 -10.849 811 1HG LYS 98 HG2 LYS 98 -15.054 -12.780 -12.996 812 2HG LYS 98 HG3 LYS 98 -14.190 -14.158 -12.332 813 1HD LYS 98 HD2 LYS 98 -16.354 -14.619 -10.938 814 2HD LYS 98 HD3 LYS 98 -17.122 -13.505 -12.081 815 1HE LYS 98 HE2 LYS 98 -17.449 -15.682 -12.993 816 2HE LYS 98 HE3 LYS 98 -16.165 -14.953 -13.961 817 1HZ LYS 98 HZ1 LYS 98 -15.830 -16.950 -11.785 818 2HZ LYS 98 HZ2 LYS 98 -15.522 -17.189 -13.378 819 3HZ LYS 98 HZ3 LYS 98 -14.559 -16.207 -12.498 820 HA PRO 99 HA PRO 99 -11.477 -9.872 -7.739 821 1HB PRO 99 HB2 PRO 99 -9.082 -8.784 -8.379 822 2HB PRO 99 HB3 PRO 99 -9.247 -10.545 -8.089 823 1HG PRO 99 HG2 PRO 99 -9.283 -9.104 -10.768 824 2HG PRO 99 HG3 PRO 99 -8.261 -10.494 -10.272 825 1HD PRO 99 HD2 PRO 99 -10.605 -10.843 -11.626 826 2HD PRO 99 HD3 PRO 99 -10.047 -11.986 -10.369 827 H LEU 100 H LEU 100 -12.377 -8.774 -10.836 828 HA LEU 100 HA LEU 100 -11.570 -6.026 -10.686 829 1HB LEU 100 HB2 LEU 100 -13.745 -7.371 -12.345 830 2HB LEU 100 HB3 LEU 100 -13.048 -5.792 -12.664 831 HG LEU 100 HG LEU 100 -11.552 -8.449 -12.815 832 1HD1 LEU 100 1HD1 LEU 100 -12.430 -6.534 -15.006 833 2HD1 LEU 100 2HD1 LEU 100 -13.198 -8.093 -14.623 834 3HD1 LEU 100 3HD1 LEU 100 -11.532 -8.053 -15.219 835 1HD2 LEU 100 1HD2 LEU 100 -10.619 -5.623 -13.480 836 2HD2 LEU 100 2HD2 LEU 100 -9.987 -6.669 -12.184 837 3HD2 LEU 100 3HD2 LEU 100 -9.742 -7.116 -13.872 838 HA PRO 101 HA PRO 101 -14.718 -4.002 -8.321 839 1HB PRO 101 HB2 PRO 101 -15.118 -2.155 -10.679 840 2HB PRO 101 HB3 PRO 101 -14.896 -1.737 -8.953 841 1HG PRO 101 HG2 PRO 101 -12.835 -1.513 -10.685 842 2HG PRO 101 HG3 PRO 101 -12.564 -2.229 -9.061 843 1HD PRO 101 HD2 PRO 101 -12.936 -3.650 -11.704 844 2HD PRO 101 HD3 PRO 101 -11.749 -3.960 -10.401 845 HA PRO 102 HA PRO 102 -18.834 -5.397 -9.308 846 1HB PRO 102 HB2 PRO 102 -19.803 -2.664 -8.466 847 2HB PRO 102 HB3 PRO 102 -20.421 -4.279 -7.992 848 1HG PRO 102 HG2 PRO 102 -18.805 -2.903 -6.323 849 2HG PRO 102 HG3 PRO 102 -18.534 -4.660 -6.577 850 1HD PRO 102 HD2 PRO 102 -17.063 -2.331 -7.826 851 2HD PRO 102 HD3 PRO 102 -16.420 -3.848 -7.130 852 H ILE 103 H ILE 103 -17.542 -3.016 -11.345 853 HA ILE 103 HA ILE 103 -20.105 -2.535 -12.752 854 HB ILE 103 H5T ILE 103 -18.925 -0.877 -14.101 855 1HG1 ILE 103 2HG1 ILE 103 -16.430 -1.557 -12.484 856 2HG1 ILE 103 3HG1 ILE 103 -16.703 -1.990 -14.172 857 1HG2 ILE 103 1HG2 ILE 103 -18.312 -0.401 -11.151 858 2HG2 ILE 103 2HG2 ILE 103 -18.635 0.813 -12.403 859 3HG2 ILE 103 3HG2 ILE 103 -19.927 -0.270 -11.884 860 1HD1 ILE 103 1HD1 ILE 103 -16.406 0.827 -13.070 861 2HD1 ILE 103 2HD1 ILE 103 -15.277 -0.059 -14.105 862 3HD1 ILE 103 3HD1 ILE 103 -16.854 0.438 -14.751 863 H LYS 104 H LYS 104 -18.251 -4.982 -12.613 864 HA LYS 104 HA LYS 104 -17.452 -6.627 -14.031 865 1HB LYS 104 HB2 LYS 104 -20.223 -6.008 -15.080 866 2HB LYS 104 HB3 LYS 104 -19.332 -7.485 -15.465 867 1HG LYS 104 HG2 LYS 104 -19.321 -8.243 -13.226 868 2HG LYS 104 HG3 LYS 104 -19.828 -6.696 -12.564 869 1HD LYS 104 HD2 LYS 104 -21.565 -8.411 -14.372 870 2HD LYS 104 HD3 LYS 104 -21.623 -8.465 -12.615 871 1HE LYS 104 HE2 LYS 104 -22.178 -5.962 -14.281 872 2HE LYS 104 HE3 LYS 104 -23.415 -7.070 -13.695 873 1HZ LYS 104 HZ1 LYS 104 -23.204 -5.223 -12.184 874 2HZ LYS 104 HZ2 LYS 104 -22.695 -6.562 -11.411 875 3HZ LYS 104 HZ3 LYS 104 -21.612 -5.458 -11.946 876 HA PRO 105 HA PRO 105 -15.927 -3.610 -17.261 877 1HB PRO 105 HB2 PRO 105 -13.371 -5.064 -16.614 878 2HB PRO 105 HB3 PRO 105 -13.626 -3.330 -16.969 879 1HG PRO 105 HG2 PRO 105 -13.304 -4.154 -14.415 880 2HG PRO 105 HG3 PRO 105 -14.562 -2.942 -14.814 881 1HD PRO 105 HD2 PRO 105 -14.899 -5.915 -14.361 882 2HD PRO 105 HD3 PRO 105 -15.877 -4.555 -13.747 883 H ARG 106 H ARG 106 -15.731 -7.100 -17.130 884 HA ARG 106 HA ARG 106 -15.113 -7.286 -20.051 885 1HB ARG 106 HB2 ARG 106 -14.300 -9.492 -19.649 886 2HB ARG 106 HB3 ARG 106 -13.486 -8.372 -18.581 887 1HG ARG 106 HG2 ARG 106 -14.500 -9.198 -16.648 888 2HG ARG 106 HG3 ARG 106 -15.919 -9.820 -17.493 889 1HD ARG 106 HD2 ARG 106 -13.130 -11.005 -17.769 890 2HD ARG 106 HD3 ARG 106 -14.371 -11.594 -16.645 891 HE ARG 106 H3T ARG 106 -15.560 -11.497 -19.209 892 1HH1 ARG 106 2HH2 ARG 106 -13.015 -13.367 -17.692 893 2HH1 ARG 106 1HH2 ARG 106 -13.279 -14.738 -18.736 894 1HH2 ARG 106 2HH1 ARG 106 -15.850 -13.272 -20.493 895 2HH2 ARG 106 1HH1 ARG 106 -14.854 -14.682 -20.273 896 H LYS 107 H LYS 107 -17.883 -6.956 -18.555 897 HA LYS 107 HA LYS 107 -19.442 -9.224 -19.257 898 1HB LYS 107 HB2 LYS 107 -21.361 -7.763 -19.045 899 2HB LYS 107 HB3 LYS 107 -20.203 -7.474 -17.751 900 1HG LYS 107 HG2 LYS 107 -19.341 -5.485 -19.132 901 2HG LYS 107 HG3 LYS 107 -20.727 -5.722 -20.195 902 1HD LYS 107 HD2 LYS 107 -22.290 -5.310 -18.398 903 2HD LYS 107 HD3 LYS 107 -21.008 -5.314 -17.183 904 1HE LYS 107 HE2 LYS 107 -21.191 -3.296 -19.456 905 2HE LYS 107 HE3 LYS 107 -21.860 -3.027 -17.844 906 1HZ LYS 107 HZ1 LYS 107 -18.989 -3.548 -18.388 907 2HZ LYS 107 HZ2 LYS 107 -19.629 -2.078 -18.058 908 3HZ LYS 107 HZ3 LYS 107 -19.628 -3.248 -16.916 Start of MODEL 11 1 1H ARG 1 H1 ARG 1 -7.467 1.089 -6.760 2 2H ARG 1 H2 ARG 1 -6.823 -0.123 -7.688 3 3H ARG 1 H3 ARG 1 -6.742 1.428 -8.183 4 HA ARG 1 HA ARG 1 -4.636 0.684 -7.433 5 1HB ARG 1 HB2 ARG 1 -5.326 3.080 -7.055 6 2HB ARG 1 HB3 ARG 1 -5.671 2.683 -5.373 7 1HG ARG 1 HG2 ARG 1 -2.971 1.942 -6.542 8 2HG ARG 1 HG3 ARG 1 -3.305 3.637 -6.207 9 1HD ARG 1 HD2 ARG 1 -3.581 3.230 -3.852 10 2HD ARG 1 HD3 ARG 1 -3.574 1.486 -4.082 11 HE ARG 1 H3T ARG 1 -1.275 1.469 -4.151 12 1HH1 ARG 1 2HH1 ARG 1 -2.179 4.831 -4.623 13 2HH1 ARG 1 1HH1 ARG 1 -0.523 5.355 -4.500 14 1HH2 ARG 1 2HH2 ARG 1 0.706 2.181 -3.939 15 2HH2 ARG 1 1HH2 ARG 1 1.097 3.880 -4.130 16 H ALA 2 H ALA 2 -7.015 0.215 -4.757 17 HA ALA 2 HA ALA 2 -4.879 -0.704 -3.002 18 1HB ALA 2 HB1 ALA 2 -7.913 -0.831 -2.712 19 2HB ALA 2 HB2 ALA 2 -6.724 -1.087 -1.421 20 3HB ALA 2 HB3 ALA 2 -6.871 0.508 -2.175 21 H ASP 3 H ASP 3 -7.227 -2.386 -5.103 22 HA ASP 3 HA ASP 3 -6.653 -5.023 -4.036 23 1HB ASP 3 HB2 ASP 3 -8.713 -4.421 -5.293 24 2HB ASP 3 HB3 ASP 3 -7.744 -4.183 -6.751 25 H GLU 4 H GLU 4 -5.268 -3.019 -6.650 26 HA GLU 4 HA GLU 4 -3.386 -5.005 -7.701 27 1HB GLU 4 HB2 GLU 4 -3.283 -1.968 -7.740 28 2HB GLU 4 HB3 GLU 4 -2.275 -3.088 -8.643 29 1HG GLU 4 HG2 GLU 4 -3.869 -2.314 -10.179 30 2HG GLU 4 HG3 GLU 4 -4.314 -3.970 -9.804 31 H GLN 5 H GLN 5 -3.248 -2.337 -5.277 32 HA GLN 5 HA GLN 5 -0.591 -2.723 -4.572 33 1HB GLN 5 HB2 GLN 5 -2.099 -0.784 -3.955 34 2HB GLN 5 HB3 GLN 5 -2.843 -1.807 -2.727 35 1HG GLN 5 HG2 GLN 5 -1.215 -0.370 -1.682 36 2HG GLN 5 HG3 GLN 5 -0.607 -2.022 -1.605 37 1HE2 GLN 5 1HE2 GLN 5 1.336 -2.508 -2.738 38 2HE2 GLN 5 2HE2 GLN 5 2.248 -1.268 -3.599 39 H ALA 6 H ALA 6 -3.503 -4.298 -3.191 40 HA ALA 6 HA ALA 6 -2.130 -5.842 -1.206 41 1HB ALA 6 HB1 ALA 6 -4.742 -6.391 -2.684 42 2HB ALA 6 HB2 ALA 6 -4.204 -7.181 -1.186 43 3HB ALA 6 HB3 ALA 6 -4.558 -5.443 -1.192 44 H PHE 7 H PHE 7 -3.087 -6.723 -4.604 45 HA PHE 7 HA PHE 7 -1.791 -9.292 -4.343 46 1HB PHE 7 HB2 PHE 7 -2.623 -9.841 -6.355 47 2HB PHE 7 HB3 PHE 7 -3.800 -8.706 -5.736 48 HD1 PHE 7 HD1 PHE 7 -4.847 -7.515 -7.394 49 HD2 PHE 7 HD2 PHE 7 -0.692 -8.535 -7.958 50 HE1 PHE 7 HE1 PHE 7 -4.900 -6.529 -9.662 51 HE2 PHE 7 HE2 PHE 7 -0.748 -7.544 -10.188 52 HZ PHE 7 HZ PHE 7 -2.853 -6.530 -11.076 53 H LEU 8 H LEU 8 -0.392 -6.228 -4.758 54 HA LEU 8 HA LEU 8 1.924 -7.392 -6.274 55 1HB LEU 8 HB2 LEU 8 1.071 -4.524 -5.746 56 2HB LEU 8 HB3 LEU 8 2.669 -4.960 -6.334 57 HG LEU 8 HG LEU 8 0.085 -5.704 -7.796 58 1HD1 LEU 8 1HD1 LEU 8 2.059 -3.449 -8.259 59 2HD1 LEU 8 2HD1 LEU 8 0.741 -3.913 -9.366 60 3HD1 LEU 8 3HD1 LEU 8 0.368 -3.290 -7.748 61 1HD2 LEU 8 1HD2 LEU 8 3.022 -6.038 -8.427 62 2HD2 LEU 8 2HD2 LEU 8 1.740 -7.263 -8.447 63 3HD2 LEU 8 3HD2 LEU 8 1.788 -6.016 -9.691 64 H VAL 9 H VAL 9 0.784 -6.287 -3.103 65 HA VAL 9 HA VAL 9 3.461 -6.393 -1.902 66 HB VAL 9 H5T VAL 9 0.653 -6.427 -0.760 67 1HG1 VAL 9 1HG1 VAL 9 3.271 -6.709 0.790 68 2HG1 VAL 9 2HG1 VAL 9 1.695 -6.308 1.505 69 3HG1 VAL 9 3HG1 VAL 9 1.931 -7.879 0.745 70 1HG2 VAL 9 1HG2 VAL 9 3.006 -4.511 -0.392 71 2HG2 VAL 9 2HG2 VAL 9 1.684 -4.256 -1.537 72 3HG2 VAL 9 3HG2 VAL 9 1.342 -4.287 0.198 73 H ALA 10 H ALA 10 0.692 -8.642 -2.321 74 HA ALA 10 HA ALA 10 1.943 -10.946 -1.298 75 1HB ALA 10 HB1 ALA 10 -0.452 -10.778 -1.895 76 2HB ALA 10 HB2 ALA 10 -0.021 -10.739 -3.619 77 3HB ALA 10 HB3 ALA 10 0.315 -12.190 -2.649 78 H LEU 11 H LEU 11 2.029 -9.868 -4.800 79 HA LEU 11 HA LEU 11 4.000 -11.837 -5.435 80 1HB LEU 11 HB2 LEU 11 2.581 -10.769 -7.107 81 2HB LEU 11 HB3 LEU 11 3.427 -9.235 -6.867 82 HG LEU 11 HG LEU 11 5.515 -10.177 -7.759 83 1HD1 LEU 11 1HD1 LEU 11 5.472 -12.487 -7.027 84 2HD1 LEU 11 2HD1 LEU 11 4.070 -12.829 -8.061 85 3HD1 LEU 11 3HD1 LEU 11 5.639 -12.406 -8.775 86 1HD2 LEU 11 1HD2 LEU 11 4.738 -10.627 -10.057 87 2HD2 LEU 11 2HD2 LEU 11 3.113 -10.980 -9.468 88 3HD2 LEU 11 3HD2 LEU 11 3.752 -9.346 -9.304 89 H TYR 12 H TYR 12 4.491 -8.507 -4.160 90 HA TYR 12 HA TYR 12 7.325 -8.445 -4.391 91 1HB TYR 12 HB2 TYR 12 6.289 -6.449 -3.761 92 2HB TYR 12 HB3 TYR 12 5.295 -7.231 -2.554 93 HD1 TYR 12 HD1 TYR 12 9.029 -7.184 -2.968 94 HD2 TYR 12 HD2 TYR 12 5.616 -6.272 -0.504 95 HE1 TYR 12 HE1 TYR 12 10.548 -6.331 -1.191 96 HE2 TYR 12 HE2 TYR 12 7.128 -5.445 1.286 97 HH TYR 12 HH TYR 12 10.680 -5.236 0.835 98 H LYS 13 H LYS 13 5.289 -9.886 -1.782 99 HA LYS 13 HA LYS 13 7.534 -10.924 -0.292 100 1HB LYS 13 HB2 LYS 13 4.607 -11.791 -0.488 101 2HB LYS 13 HB3 LYS 13 5.743 -12.564 0.597 102 1HG LYS 13 HG2 LYS 13 5.168 -9.567 0.661 103 2HG LYS 13 HG3 LYS 13 4.238 -10.744 1.579 104 1HD LYS 13 HD2 LYS 13 7.246 -10.303 1.888 105 2HD LYS 13 HD3 LYS 13 5.993 -9.589 2.905 106 1HE LYS 13 HE2 LYS 13 5.191 -11.892 3.499 107 2HE LYS 13 HE3 LYS 13 6.537 -12.574 2.577 108 1HZ LYS 13 HZ1 LYS 13 7.062 -12.400 4.940 109 2HZ LYS 13 HZ2 LYS 13 8.067 -11.433 4.095 110 3HZ LYS 13 HZ3 LYS 13 6.818 -10.783 4.934 111 H TYR 14 H TYR 14 5.514 -12.613 -2.835 112 HA TYR 14 HA TYR 14 7.107 -14.925 -2.814 113 1HB TYR 14 HB2 TYR 14 4.879 -14.666 -3.812 114 2HB TYR 14 HB3 TYR 14 5.517 -13.587 -5.031 115 HD1 TYR 14 HD1 TYR 14 6.748 -14.431 -6.977 116 HD2 TYR 14 HD2 TYR 14 5.259 -17.102 -3.928 117 HE1 TYR 14 HE1 TYR 14 7.003 -16.345 -8.534 118 HE2 TYR 14 HE2 TYR 14 5.556 -19.027 -5.487 119 HH TYR 14 HH TYR 14 6.794 -18.614 -8.828 120 H MET 15 H MET 15 7.586 -11.938 -4.675 121 HA MET 15 HA MET 15 9.766 -12.658 -6.303 122 1HB MET 15 HB2 MET 15 8.526 -10.653 -6.727 123 2HB MET 15 HB3 MET 15 8.772 -10.084 -5.082 124 1HG MET 15 HG2 MET 15 10.198 -8.754 -6.050 125 2HG MET 15 HG3 MET 15 11.294 -10.056 -5.687 126 1HE MET 15 HE1 MET 15 9.924 -11.911 -8.466 127 2HE MET 15 HE2 MET 15 11.344 -11.669 -9.493 128 3HE MET 15 HE3 MET 15 11.558 -12.088 -7.774 129 H LYS 16 H LYS 16 9.817 -10.946 -3.064 130 HA LYS 16 HA LYS 16 12.590 -11.151 -2.610 131 1HB LYS 16 HB2 LYS 16 10.862 -9.828 -1.326 132 2HB LYS 16 HB3 LYS 16 10.360 -11.328 -0.531 133 1HG LYS 16 HG2 LYS 16 12.749 -11.580 0.312 134 2HG LYS 16 HG3 LYS 16 13.100 -9.987 -0.375 135 1HD LYS 16 HD2 LYS 16 11.053 -10.614 1.804 136 2HD LYS 16 HD3 LYS 16 12.646 -9.890 2.046 137 1HE LYS 16 HE2 LYS 16 11.947 -7.948 0.619 138 2HE LYS 16 HE3 LYS 16 10.334 -8.656 0.480 139 1HZ LYS 16 HZ1 LYS 16 10.387 -7.023 2.260 140 2HZ LYS 16 HZ2 LYS 16 10.151 -8.493 2.929 141 3HZ LYS 16 HZ3 LYS 16 11.621 -7.784 3.018 142 H GLU 17 H GLU 17 10.054 -13.540 -1.815 143 HA GLU 17 HA GLU 17 11.796 -15.408 -0.544 144 1HB GLU 17 HB2 GLU 17 9.339 -15.367 -0.338 145 2HB GLU 17 HB3 GLU 17 9.189 -15.921 -1.999 146 1HG GLU 17 HG2 GLU 17 10.506 -18.003 -1.302 147 2HG GLU 17 HG3 GLU 17 10.433 -17.408 0.356 148 H ARG 18 H ARG 18 11.014 -15.041 -4.052 149 HA ARG 18 HA ARG 18 12.596 -17.253 -4.945 150 1HB ARG 18 HB2 ARG 18 11.321 -14.846 -6.117 151 2HB ARG 18 HB3 ARG 18 12.826 -15.243 -6.908 152 1HG ARG 18 HG2 ARG 18 11.124 -16.283 -8.116 153 2HG ARG 18 HG3 ARG 18 12.000 -17.573 -7.303 154 1HD ARG 18 HD2 ARG 18 9.467 -16.356 -6.138 155 2HD ARG 18 HD3 ARG 18 9.385 -17.587 -7.393 156 HE ARG 18 H3T ARG 18 10.737 -19.073 -5.846 157 1HH1 ARG 18 2HH1 ARG 18 8.639 -16.624 -4.439 158 2HH1 ARG 18 1HH1 ARG 18 8.211 -17.719 -3.112 159 1HH2 ARG 18 2HH2 ARG 18 10.137 -20.283 -4.003 160 2HH2 ARG 18 1HH2 ARG 18 9.027 -19.527 -2.860 161 H LYS 19 H LYS 19 13.811 -14.682 -3.209 162 HA LYS 19 HA LYS 19 15.864 -14.151 -2.509 163 1HB LYS 19 HB2 LYS 19 17.042 -16.287 -4.327 164 2HB LYS 19 HB3 LYS 19 17.854 -15.431 -3.018 165 1HG LYS 19 HG2 LYS 19 16.232 -16.386 -1.383 166 2HG LYS 19 HG3 LYS 19 15.487 -17.323 -2.694 167 1HD LYS 19 HD2 LYS 19 17.673 -18.407 -3.159 168 2HD LYS 19 HD3 LYS 19 18.397 -17.548 -1.794 169 1HE LYS 19 HE2 LYS 19 16.032 -19.475 -1.615 170 2HE LYS 19 HE3 LYS 19 17.713 -19.926 -1.319 171 1HZ LYS 19 HZ1 LYS 19 16.601 -19.442 0.756 172 2HZ LYS 19 HZ2 LYS 19 17.759 -18.318 0.516 173 3HZ LYS 19 HZ3 LYS 19 16.185 -17.941 0.275 174 H THR 20 H THR 20 14.511 -12.851 -4.709 175 HA THR 20 HA THR 20 16.812 -11.210 -5.486 176 HB THR 20 H5T THR 20 16.655 -12.736 -7.305 177 HG1 THR 20 HG1 THR 20 17.292 -10.715 -7.833 178 1HG2 THR 20 1HG2 THR 20 14.863 -12.995 -8.810 179 2HG2 THR 20 2HG2 THR 20 14.189 -13.267 -7.201 180 3HG2 THR 20 3HG2 THR 20 13.899 -11.726 -8.041 181 HA PRO 21 HA PRO 21 13.347 -9.049 -3.384 182 1HB PRO 21 HB2 PRO 21 15.636 -7.107 -3.019 183 2HB PRO 21 HB3 PRO 21 14.340 -7.553 -1.861 184 1HG PRO 21 HG2 PRO 21 16.787 -8.664 -1.630 185 2HG PRO 21 HG3 PRO 21 15.327 -9.696 -1.472 186 1HD PRO 21 HD2 PRO 21 17.139 -9.355 -3.868 187 2HD PRO 21 HD3 PRO 21 16.437 -10.846 -3.178 188 H ILE 22 H ILE 22 12.083 -7.174 -3.762 189 HA ILE 22 HA ILE 22 11.936 -6.620 -6.523 190 HB ILE 22 H5T ILE 22 10.070 -6.724 -4.833 191 1HG1 ILE 22 2HG1 ILE 22 9.877 -4.356 -6.724 192 2HG1 ILE 22 3HG1 ILE 22 9.879 -6.040 -7.253 193 1HG2 ILE 22 1HG2 ILE 22 9.355 -4.668 -3.708 194 2HG2 ILE 22 2HG2 ILE 22 11.021 -5.017 -3.234 195 3HG2 ILE 22 3HG2 ILE 22 10.676 -3.753 -4.435 196 1HD1 ILE 22 1HD1 ILE 22 7.593 -5.216 -7.095 197 2HD1 ILE 22 2HD1 ILE 22 7.854 -6.499 -5.896 198 3HD1 ILE 22 3HD1 ILE 22 7.811 -4.796 -5.388 199 H GLU 23 H GLU 23 13.587 -4.669 -4.050 200 HA GLU 23 HA GLU 23 13.860 -2.285 -5.377 201 1HB GLU 23 HB2 GLU 23 14.730 -3.013 -3.132 202 2HB GLU 23 HB3 GLU 23 16.100 -3.771 -3.947 203 1HG GLU 23 HG2 GLU 23 16.866 -1.587 -4.756 204 2HG GLU 23 HG3 GLU 23 15.393 -0.810 -4.162 205 H ARG 24 H ARG 24 15.088 -5.260 -6.654 206 HA ARG 24 HA ARG 24 17.074 -4.308 -8.477 207 1HB ARG 24 HB2 ARG 24 16.780 -6.389 -9.586 208 2HB ARG 24 HB3 ARG 24 16.529 -6.700 -7.871 209 1HG ARG 24 HG2 ARG 24 13.981 -6.503 -8.367 210 2HG ARG 24 HG3 ARG 24 14.435 -6.510 -10.075 211 1HD ARG 24 HD2 ARG 24 15.805 -8.655 -9.435 212 2HD ARG 24 HD3 ARG 24 14.750 -8.720 -8.019 213 HE ARG 24 H3T ARG 24 12.867 -8.537 -9.867 214 1HH1 ARG 24 2HH1 ARG 24 15.609 -10.660 -9.837 215 2HH1 ARG 24 1HH1 ARG 24 15.068 -11.580 -11.222 216 1HH2 ARG 24 2HH2 ARG 24 12.134 -9.810 -11.554 217 2HH2 ARG 24 1HH2 ARG 24 13.086 -11.171 -12.081 218 H ILE 25 H ILE 25 13.706 -3.686 -8.469 219 HA ILE 25 HA ILE 25 13.091 -3.367 -11.198 220 HB ILE 25 H5T ILE 25 11.641 -3.509 -9.125 221 1HG1 ILE 25 2HG1 ILE 25 10.720 -1.464 -11.119 222 2HG1 ILE 25 3HG1 ILE 25 10.749 -3.216 -11.371 223 1HG2 ILE 25 1HG2 ILE 25 10.942 -1.525 -7.961 224 2HG2 ILE 25 2HG2 ILE 25 12.701 -1.559 -7.921 225 3HG2 ILE 25 3HG2 ILE 25 11.865 -0.475 -9.051 226 1HD1 ILE 25 1HD1 ILE 25 9.302 -3.408 -9.253 227 2HD1 ILE 25 2HD1 ILE 25 9.065 -1.654 -9.388 228 3HD1 ILE 25 3HD1 ILE 25 8.527 -2.736 -10.694 229 HA PRO 26 HA PRO 26 15.340 0.341 -12.258 230 1HB PRO 26 HB2 PRO 26 14.283 0.966 -14.686 231 2HB PRO 26 HB3 PRO 26 15.127 -0.566 -14.384 232 1HG PRO 26 HG2 PRO 26 12.127 -0.081 -14.257 233 2HG PRO 26 HG3 PRO 26 13.007 -1.298 -15.249 234 1HD PRO 26 HD2 PRO 26 12.010 -1.976 -12.846 235 2HD PRO 26 HD3 PRO 26 13.623 -2.549 -13.342 236 H TYR 27 H TYR 27 14.278 2.558 -13.737 237 HA TYR 27 HA TYR 27 12.311 3.797 -11.841 238 1HB TYR 27 HB2 TYR 27 14.899 4.551 -11.837 239 2HB TYR 27 HB3 TYR 27 14.374 5.501 -13.208 240 HD1 TYR 27 HD1 TYR 27 13.376 4.669 -9.672 241 HD2 TYR 27 HD2 TYR 27 13.773 7.719 -12.701 242 HE1 TYR 27 HE1 TYR 27 12.812 6.419 -7.987 243 HE2 TYR 27 HE2 TYR 27 13.231 9.465 -11.007 244 HH TYR 27 HH TYR 27 12.707 9.906 -8.818 245 H LEU 28 H LEU 28 11.093 5.577 -12.964 246 HA LEU 28 HA LEU 28 10.403 4.606 -15.679 247 1HB LEU 28 HB2 LEU 28 8.925 4.133 -13.713 248 2HB LEU 28 HB3 LEU 28 8.612 5.857 -13.573 249 HG LEU 28 HG LEU 28 7.511 5.882 -15.746 250 1HD1 LEU 28 1HD1 LEU 28 8.322 2.952 -15.916 251 2HD1 LEU 28 2HD1 LEU 28 7.054 3.666 -16.913 252 3HD1 LEU 28 3HD1 LEU 28 8.712 4.248 -17.068 253 1HD2 LEU 28 1HD2 LEU 28 5.589 4.497 -15.206 254 2HD2 LEU 28 2HD2 LEU 28 6.563 3.500 -14.105 255 3HD2 LEU 28 3HD2 LEU 28 6.236 5.206 -13.717 256 H GLY 29 H GLY 29 12.387 6.322 -15.886 257 1HA GLY 29 HA2 GLY 29 12.808 7.903 -17.538 258 2HA GLY 29 HA3 GLY 29 11.092 8.316 -17.582 259 H PHE 30 H PHE 30 10.553 9.175 -15.084 260 HA PHE 30 HA PHE 30 12.579 11.139 -14.205 261 1HB PHE 30 HB2 PHE 30 11.117 13.030 -14.461 262 2HB PHE 30 HB3 PHE 30 11.178 12.213 -16.006 263 HD1 PHE 30 HD1 PHE 30 9.041 13.510 -13.428 264 HD2 PHE 30 HD2 PHE 30 9.193 10.575 -16.588 265 HE1 PHE 30 HE1 PHE 30 6.560 13.412 -13.465 266 HE2 PHE 30 HE2 PHE 30 6.716 10.443 -16.582 267 HZ PHE 30 HZ PHE 30 5.393 11.873 -15.041 268 H LYS 31 H LYS 31 10.638 8.739 -13.223 269 HA LYS 31 HA LYS 31 10.406 9.684 -10.460 270 1HB LYS 31 HB2 LYS 31 7.973 9.380 -10.305 271 2HB LYS 31 HB3 LYS 31 8.371 10.686 -11.411 272 1HG LYS 31 HG2 LYS 31 8.010 9.151 -13.353 273 2HG LYS 31 HG3 LYS 31 7.537 7.864 -12.242 274 1HD LYS 31 HD2 LYS 31 6.144 10.559 -12.520 275 2HD LYS 31 HD3 LYS 31 5.622 9.056 -13.300 276 1HE LYS 31 HE2 LYS 31 5.277 8.002 -11.096 277 2HE LYS 31 HE3 LYS 31 5.841 9.468 -10.284 278 1HZ LYS 31 HZ1 LYS 31 3.412 9.403 -10.387 279 2HZ LYS 31 HZ2 LYS 31 3.963 10.671 -11.250 280 3HZ LYS 31 HZ3 LYS 31 3.434 9.334 -12.021 281 H GLN 32 H GLN 32 9.544 7.888 -9.050 282 HA GLN 32 HA GLN 32 10.657 5.369 -9.580 283 1HB GLN 32 HB2 GLN 32 9.384 4.521 -7.733 284 2HB GLN 32 HB3 GLN 32 10.008 6.112 -7.325 285 1HG GLN 32 HG2 GLN 32 7.858 7.119 -7.431 286 2HG GLN 32 HG3 GLN 32 7.165 5.800 -8.371 287 1HE2 GLN 32 1HE2 GLN 32 6.726 3.715 -7.328 288 2HE2 GLN 32 2HE2 GLN 32 6.506 3.690 -5.579 289 H ILE 33 H ILE 33 9.766 3.279 -9.956 290 HA ILE 33 HA ILE 33 7.810 3.082 -12.063 291 HB ILE 33 H5T ILE 33 9.175 1.120 -10.205 292 1HG1 ILE 33 2HG1 ILE 33 10.367 2.273 -12.178 293 2HG1 ILE 33 3HG1 ILE 33 10.485 0.534 -12.060 294 1HG2 ILE 33 1HG2 ILE 33 7.113 -0.011 -10.517 295 2HG2 ILE 33 2HG2 ILE 33 7.008 0.506 -12.213 296 3HG2 ILE 33 3HG2 ILE 33 8.205 -0.704 -11.728 297 1HD1 ILE 33 1HD1 ILE 33 10.107 1.463 -14.388 298 2HD1 ILE 33 2HD1 ILE 33 9.001 0.173 -13.891 299 3HD1 ILE 33 3HD1 ILE 33 8.454 1.862 -13.885 300 H ASN 34 H ASN 34 5.705 2.550 -12.049 301 HA ASN 34 HA ASN 34 4.168 2.711 -9.498 302 1HB ASN 34 HB2 ASN 34 4.520 4.898 -10.892 303 2HB ASN 34 HB3 ASN 34 3.390 4.190 -12.038 304 1HD2 ASN 34 1HD2 ASN 34 2.116 6.167 -11.472 305 2HD2 ASN 34 2HD2 ASN 34 1.204 6.174 -9.968 306 H LEU 35 H LEU 35 4.298 0.439 -9.805 307 HA LEU 35 HA LEU 35 3.721 -1.034 -12.033 308 1HB LEU 35 HB2 LEU 35 4.992 -1.580 -9.987 309 2HB LEU 35 HB3 LEU 35 3.480 -1.823 -9.122 310 HG LEU 35 HG LEU 35 2.973 -3.777 -10.521 311 1HD1 LEU 35 1HD1 LEU 35 4.693 -4.695 -12.070 312 2HD1 LEU 35 2HD1 LEU 35 3.957 -3.211 -12.672 313 3HD1 LEU 35 3HD1 LEU 35 5.591 -3.164 -11.955 314 1HD2 LEU 35 1HD2 LEU 35 4.445 -3.919 -8.480 315 2HD2 LEU 35 2HD2 LEU 35 4.741 -5.185 -9.663 316 3HD2 LEU 35 3HD2 LEU 35 5.866 -3.816 -9.544 317 H TRP 36 H TRP 36 1.210 -0.211 -9.599 318 HA TRP 36 HA TRP 36 -0.924 -1.768 -10.798 319 1HB TRP 36 HB2 TRP 36 -2.385 -0.418 -9.509 320 2HB TRP 36 HB3 TRP 36 -1.010 -0.892 -8.533 321 HD1 TRP 36 HD1 TRP 36 0.880 1.126 -8.116 322 HE1 TRP 36 HE1 TRP 36 0.594 3.650 -7.918 323 HE3 TRP 36 HE3 TRP 36 -3.869 1.562 -10.007 324 HZ2 TRP 36 HZ2 TRP 36 -1.553 5.580 -8.174 325 HZ3 TRP 36 HZ3 TRP 36 -5.039 3.761 -9.936 326 HH2 TRP 36 HH2 TRP 36 -3.893 5.768 -9.038 327 H THR 37 H THR 37 0.258 1.598 -11.278 328 HA THR 37 HA THR 37 -1.701 2.446 -13.150 329 HB THR 37 H5T THR 37 1.080 3.545 -12.689 330 HG1 THR 37 HG1 THR 37 0.017 4.872 -11.304 331 1HG2 THR 37 1HG2 THR 37 0.212 4.435 -14.805 332 2HG2 THR 37 2HG2 THR 37 -1.357 4.785 -14.041 333 3HG2 THR 37 3HG2 THR 37 0.105 5.669 -13.554 334 H MET 38 H MET 38 1.660 1.207 -13.753 335 HA MET 38 HA MET 38 1.439 1.422 -16.594 336 1HB MET 38 HB2 MET 38 3.320 0.050 -16.814 337 2HB MET 38 HB3 MET 38 3.586 0.972 -15.335 338 1HG MET 38 HG2 MET 38 2.989 -0.984 -13.990 339 2HG MET 38 HG3 MET 38 2.520 -1.889 -15.421 340 1HE MET 38 HE1 MET 38 6.843 -1.113 -14.095 341 2HE MET 38 HE2 MET 38 5.806 0.255 -14.570 342 3HE MET 38 HE3 MET 38 5.400 -0.738 -13.153 343 H PHE 39 H PHE 39 0.221 -1.077 -14.389 344 HA PHE 39 HA PHE 39 -0.568 -2.893 -16.490 345 1HB PHE 39 HB2 PHE 39 -0.209 -3.660 -14.266 346 2HB PHE 39 HB3 PHE 39 -1.495 -2.645 -13.616 347 HD1 PHE 39 HD1 PHE 39 -0.811 -5.452 -16.012 348 HD2 PHE 39 HD2 PHE 39 -3.753 -3.443 -13.575 349 HE1 PHE 39 HE1 PHE 39 -2.441 -7.249 -16.503 350 HE2 PHE 39 HE2 PHE 39 -5.387 -5.251 -14.071 351 HZ PHE 39 HZ PHE 39 -4.732 -7.148 -15.536 352 H GLN 40 H GLN 40 -2.609 -0.479 -14.607 353 HA GLN 40 HA GLN 40 -4.822 -1.021 -16.385 354 1HB GLN 40 HB2 GLN 40 -5.890 0.978 -15.554 355 2HB GLN 40 HB3 GLN 40 -5.244 0.008 -14.231 356 1HG GLN 40 HG2 GLN 40 -3.399 1.517 -13.920 357 2HG GLN 40 HG3 GLN 40 -3.815 2.470 -15.348 358 1HE2 GLN 40 1HE2 GLN 40 -3.492 3.683 -12.775 359 2HE2 GLN 40 2HE2 GLN 40 -5.077 4.269 -12.315 360 H ALA 41 H ALA 41 -2.063 1.174 -16.849 361 HA ALA 41 HA ALA 41 -3.117 2.406 -19.247 362 1HB ALA 41 HB1 ALA 41 -1.229 3.349 -17.975 363 2HB ALA 41 HB2 ALA 41 -0.249 1.916 -18.339 364 3HB ALA 41 HB3 ALA 41 -0.763 3.004 -19.650 365 H ALA 42 H ALA 42 -0.889 -0.451 -18.810 366 HA ALA 42 HA ALA 42 -0.820 -1.223 -21.519 367 1HB ALA 42 HB1 ALA 42 -0.721 -2.991 -19.034 368 2HB ALA 42 HB2 ALA 42 -0.140 -3.422 -20.653 369 3HB ALA 42 HB3 ALA 42 0.660 -2.130 -19.738 370 H GLN 43 H GLN 43 -3.355 -1.911 -19.083 371 HA GLN 43 HA GLN 43 -4.774 -3.795 -20.651 372 1HB GLN 43 HB2 GLN 43 -5.583 -2.001 -18.364 373 2HB GLN 43 HB3 GLN 43 -6.748 -3.043 -19.170 374 1HG GLN 43 HG2 GLN 43 -4.192 -4.012 -17.829 375 2HG GLN 43 HG3 GLN 43 -5.802 -4.106 -17.133 376 1HE2 GLN 43 1HE2 GLN 43 -3.751 -6.225 -17.988 377 2HE2 GLN 43 2HE2 GLN 43 -4.704 -7.320 -18.973 378 H LYS 44 H LYS 44 -5.039 -0.203 -20.612 379 HA LYS 44 HA LYS 44 -7.214 -0.360 -22.589 380 1HB LYS 44 HB2 LYS 44 -7.461 1.935 -22.484 381 2HB LYS 44 HB3 LYS 44 -7.194 1.401 -20.828 382 1HG LYS 44 HG2 LYS 44 -4.789 2.151 -21.055 383 2HG LYS 44 HG3 LYS 44 -5.189 2.756 -22.674 384 1HD LYS 44 HD2 LYS 44 -5.251 4.609 -21.246 385 2HD LYS 44 HD3 LYS 44 -6.938 4.239 -21.597 386 1HE LYS 44 HE2 LYS 44 -7.209 3.160 -19.408 387 2HE LYS 44 HE3 LYS 44 -5.472 3.274 -19.093 388 1HZ LYS 44 HZ1 LYS 44 -6.661 5.058 -17.963 389 2HZ LYS 44 HZ2 LYS 44 -5.673 5.696 -19.111 390 3HZ LYS 44 HZ3 LYS 44 -7.290 5.605 -19.369 391 H LEU 45 H LEU 45 -3.708 0.438 -22.644 392 HA LEU 45 HA LEU 45 -3.678 0.373 -25.494 393 1HB LEU 45 HB2 LEU 45 -1.459 0.062 -23.432 394 2HB LEU 45 HB3 LEU 45 -1.176 0.012 -25.144 395 HG LEU 45 HG LEU 45 -0.544 2.130 -24.690 396 1HD1 LEU 45 1HD1 LEU 45 -2.153 3.706 -25.621 397 2HD1 LEU 45 2HD1 LEU 45 -2.217 2.176 -26.519 398 3HD1 LEU 45 3HD1 LEU 45 -3.485 2.584 -25.340 399 1HD2 LEU 45 1HD2 LEU 45 -1.258 2.300 -22.366 400 2HD2 LEU 45 2HD2 LEU 45 -1.638 3.763 -23.270 401 3HD2 LEU 45 3HD2 LEU 45 -2.928 2.612 -22.888 402 H GLY 46 H GLY 46 -4.949 -2.090 -24.025 403 1HA GLY 46 HA2 GLY 46 -5.571 -3.923 -25.309 404 2HA GLY 46 HA3 GLY 46 -4.122 -3.815 -26.270 405 H GLY 47 H GLY 47 -4.361 -4.132 -22.726 406 1HA GLY 47 HA2 GLY 47 -3.426 -5.620 -21.253 407 2HA GLY 47 HA3 GLY 47 -3.862 -6.880 -22.407 408 H TYR 48 H TYR 48 -1.903 -7.844 -21.417 409 HA TYR 48 HA TYR 48 0.740 -6.933 -22.235 410 1HB TYR 48 HB2 TYR 48 1.493 -9.035 -21.476 411 2HB TYR 48 HB3 TYR 48 0.191 -8.627 -20.374 412 HD1 TYR 48 HD1 TYR 48 1.421 -10.998 -22.842 413 HD2 TYR 48 HD2 TYR 48 -2.103 -9.754 -20.683 414 HE1 TYR 48 HE1 TYR 48 0.274 -13.119 -23.473 415 HE2 TYR 48 HE2 TYR 48 -3.259 -11.839 -21.357 416 HH TYR 48 HH TYR 48 -3.122 -13.798 -22.557 417 H GLU 49 H GLU 49 -1.928 -8.582 -23.860 418 HA GLU 49 HA GLU 49 -0.260 -10.054 -25.659 419 1HB GLU 49 HB2 GLU 49 -2.646 -10.559 -24.883 420 2HB GLU 49 HB3 GLU 49 -3.186 -9.384 -26.091 421 1HG GLU 49 HG2 GLU 49 -1.947 -10.722 -27.841 422 2HG GLU 49 HG3 GLU 49 -1.495 -11.878 -26.582 423 H THR 50 H THR 50 -2.184 -7.036 -26.184 424 HA THR 50 HA THR 50 -1.141 -6.599 -28.842 425 HB THR 50 H5T THR 50 -2.224 -4.550 -26.898 426 HG1 THR 50 HG1 THR 50 -3.759 -6.112 -27.305 427 1HG2 THR 50 1HG2 THR 50 -1.953 -4.496 -29.935 428 2HG2 THR 50 2HG2 THR 50 -2.848 -3.302 -28.963 429 3HG2 THR 50 3HG2 THR 50 -1.100 -3.450 -28.774 430 H ILE 51 H ILE 51 0.039 -5.795 -25.549 431 HA ILE 51 HA ILE 51 2.152 -4.082 -26.428 432 HB ILE 51 H5T ILE 51 1.299 -5.438 -23.953 433 1HG1 ILE 51 2HG1 ILE 51 2.313 -3.385 -22.922 434 2HG1 ILE 51 3HG1 ILE 51 2.839 -2.888 -24.533 435 1HG2 ILE 51 1HG2 ILE 51 3.349 -6.677 -23.983 436 2HG2 ILE 51 2HG2 ILE 51 4.290 -5.208 -24.320 437 3HG2 ILE 51 3HG2 ILE 51 3.436 -5.424 -22.759 438 1HD1 ILE 51 1HD1 ILE 51 0.810 -1.712 -24.132 439 2HD1 ILE 51 2HD1 ILE 51 0.297 -3.044 -25.170 440 3HD1 ILE 51 3HD1 ILE 51 0.016 -3.127 -23.424 441 H THR 52 H THR 52 2.044 -7.635 -26.091 442 HA THR 52 HA THR 52 4.792 -7.979 -26.929 443 HB THR 52 H5T THR 52 2.439 -9.911 -26.806 444 HG1 THR 52 HG1 THR 52 3.006 -9.205 -24.815 445 1HG2 THR 52 1HG2 THR 52 4.183 -11.690 -26.717 446 2HG2 THR 52 2HG2 THR 52 4.111 -10.894 -28.296 447 3HG2 THR 52 3HG2 THR 52 5.416 -10.490 -27.160 448 H ALA 53 H ALA 53 1.651 -8.131 -28.664 449 HA ALA 53 HA ALA 53 2.849 -8.876 -31.178 450 1HB ALA 53 HB1 ALA 53 0.142 -7.625 -30.523 451 2HB ALA 53 HB2 ALA 53 0.586 -8.438 -32.041 452 3HB ALA 53 HB3 ALA 53 0.513 -9.364 -30.532 453 H ARG 54 H ARG 54 2.390 -5.669 -29.652 454 HA ARG 54 HA ARG 54 3.236 -4.396 -32.267 455 1HB ARG 54 HB2 ARG 54 1.018 -3.480 -30.398 456 2HB ARG 54 HB3 ARG 54 1.541 -2.644 -31.845 457 1HG ARG 54 HG2 ARG 54 0.276 -5.412 -31.839 458 2HG ARG 54 HG3 ARG 54 -0.561 -3.900 -32.152 459 1HD ARG 54 HD2 ARG 54 0.798 -3.458 -34.125 460 2HD ARG 54 HD3 ARG 54 1.789 -4.875 -33.833 461 HE ARG 54 H3T ARG 54 -1.042 -4.827 -34.757 462 1HH1 ARG 54 2HH2 ARG 54 1.742 -6.870 -34.039 463 2HH1 ARG 54 1HH2 ARG 54 1.111 -8.176 -35.009 464 1HH2 ARG 54 2HH1 ARG 54 -1.790 -6.569 -35.886 465 2HH2 ARG 54 1HH1 ARG 54 -0.849 -8.027 -35.971 466 H ARG 55 H ARG 55 4.403 -4.709 -29.224 467 HA ARG 55 HA ARG 55 5.599 -3.420 -27.757 468 1HB ARG 55 HB2 ARG 55 7.510 -2.184 -28.678 469 2HB ARG 55 HB3 ARG 55 7.418 -3.872 -29.070 470 1HG ARG 55 HG2 ARG 55 6.571 -1.707 -31.043 471 2HG ARG 55 HG3 ARG 55 8.238 -2.203 -30.842 472 1HD ARG 55 HD2 ARG 55 5.976 -3.942 -31.875 473 2HD ARG 55 HD3 ARG 55 7.348 -3.315 -32.759 474 HE ARG 55 H3T ARG 55 8.838 -4.756 -31.434 475 1HH1 ARG 55 2HH2 ARG 55 5.487 -5.783 -31.541 476 2HH1 ARG 55 1HH2 ARG 55 5.817 -7.262 -30.671 477 1HH2 ARG 55 2HH1 ARG 55 9.222 -6.790 -30.647 478 2HH2 ARG 55 1HH1 ARG 55 7.901 -7.904 -30.432 479 H GLN 56 H GLN 56 3.534 -2.607 -27.245 480 HA GLN 56 HA GLN 56 3.022 0.099 -28.266 481 1HB GLN 56 HB2 GLN 56 1.314 -1.768 -28.395 482 2HB GLN 56 HB3 GLN 56 1.046 -1.539 -26.667 483 1HG GLN 56 HG2 GLN 56 0.135 0.610 -26.960 484 2HG GLN 56 HG3 GLN 56 0.971 0.873 -28.486 485 1HE2 GLN 56 1HE2 GLN 56 0.308 -0.845 -30.273 486 2HE2 GLN 56 2HE2 GLN 56 -1.438 -0.992 -30.442 487 H TRP 57 H TRP 57 4.809 -0.982 -25.844 488 HA TRP 57 HA TRP 57 4.239 0.612 -23.547 489 1HB TRP 57 HB2 TRP 57 6.889 -0.286 -24.695 490 2HB TRP 57 HB3 TRP 57 6.673 0.593 -23.225 491 HD1 TRP 57 HD1 TRP 57 6.003 -2.848 -24.672 492 HE1 TRP 57 HE1 TRP 57 5.177 -4.415 -22.822 493 HE3 TRP 57 HE3 TRP 57 5.620 0.524 -20.828 494 HZ2 TRP 57 HZ2 TRP 57 4.347 -4.220 -20.069 495 HZ3 TRP 57 HZ3 TRP 57 4.794 -0.185 -18.617 496 HH2 TRP 57 HH2 TRP 57 4.145 -2.539 -18.215 497 H LYS 58 H LYS 58 5.612 1.578 -26.693 498 HA LYS 58 HA LYS 58 6.254 4.271 -25.908 499 1HB LYS 58 HB2 LYS 58 5.422 3.113 -28.597 500 2HB LYS 58 HB3 LYS 58 5.995 4.766 -28.393 501 1HG LYS 58 HG2 LYS 58 7.648 2.349 -27.522 502 2HG LYS 58 HG3 LYS 58 7.712 3.018 -29.150 503 1HD LYS 58 HD2 LYS 58 8.559 5.124 -28.388 504 2HD LYS 58 HD3 LYS 58 8.301 4.710 -26.681 505 1HE LYS 58 HE2 LYS 58 10.022 3.110 -26.648 506 2HE LYS 58 HE3 LYS 58 10.072 2.953 -28.401 507 1HZ LYS 58 HZ1 LYS 58 11.928 4.298 -27.335 508 2HZ LYS 58 HZ2 LYS 58 11.176 5.020 -28.599 509 3HZ LYS 58 HZ3 LYS 58 10.849 5.492 -27.079 510 H HIS 59 H HIS 59 3.051 2.872 -26.561 511 HA HIS 59 HA HIS 59 1.843 5.563 -26.178 512 1HB HIS 59 HB2 HIS 59 0.589 2.879 -26.794 513 2HB HIS 59 HB3 HIS 59 -0.261 4.412 -26.629 514 HD1 HIS 59 HD1 HIS 59 -0.374 5.946 -28.745 515 HD2 HIS 59 HD2 HIS 59 2.373 2.768 -29.005 516 HE1 HIS 59 HE1 HIS 59 0.460 5.915 -31.155 517 H ILE 60 H ILE 60 2.646 2.762 -24.207 518 HA ILE 60 HA ILE 60 0.831 3.469 -22.002 519 HB ILE 60 H5T ILE 60 3.431 1.890 -22.068 520 1HG1 ILE 60 2HG1 ILE 60 0.557 1.029 -21.490 521 2HG1 ILE 60 3HG1 ILE 60 1.293 0.909 -23.088 522 1HG2 ILE 60 1HG2 ILE 60 1.642 2.508 -19.690 523 2HG2 ILE 60 2HG2 ILE 60 2.924 1.285 -19.687 524 3HG2 ILE 60 3HG2 ILE 60 3.337 2.972 -19.898 525 1HD1 ILE 60 1HD1 ILE 60 2.972 -0.661 -22.250 526 2HD1 ILE 60 2HD1 ILE 60 2.270 -0.578 -20.616 527 3HD1 ILE 60 3HD1 ILE 60 1.340 -1.242 -21.952 528 H TYR 61 H TYR 61 4.139 4.335 -23.081 529 HA TYR 61 HA TYR 61 4.655 6.314 -21.150 530 1HB TYR 61 HB2 TYR 61 6.189 5.267 -22.930 531 2HB TYR 61 HB3 TYR 61 5.547 6.467 -24.033 532 HD1 TYR 61 HD1 TYR 61 7.536 5.887 -20.963 533 HD2 TYR 61 HD2 TYR 61 6.154 8.848 -23.783 534 HE1 TYR 61 HE1 TYR 61 9.224 7.499 -20.101 535 HE2 TYR 61 HE2 TYR 61 7.861 10.441 -22.929 536 HH TYR 61 HH TYR 61 9.693 10.687 -21.606 537 H ASP 62 H ASP 62 2.609 6.443 -24.055 538 HA ASP 62 HA ASP 62 2.131 9.254 -23.988 539 1HB ASP 62 HB2 ASP 62 1.576 7.831 -25.936 540 2HB ASP 62 HB3 ASP 62 0.179 7.226 -25.041 541 H GLU 63 H GLU 63 0.228 6.528 -22.501 542 HA GLU 63 HA GLU 63 -1.334 8.225 -20.849 543 1HB GLU 63 HB2 GLU 63 -0.431 5.348 -20.567 544 2HB GLU 63 HB3 GLU 63 -1.366 6.121 -19.299 545 1HG GLU 63 HG2 GLU 63 -2.257 5.958 -22.204 546 2HG GLU 63 HG3 GLU 63 -2.716 4.813 -20.943 547 H LEU 64 H LEU 64 2.047 7.219 -20.242 548 HA LEU 64 HA LEU 64 2.084 8.122 -17.508 549 1HB LEU 64 HB2 LEU 64 4.424 7.972 -19.472 550 2HB LEU 64 HB3 LEU 64 4.554 8.200 -17.737 551 HG LEU 64 HG LEU 64 3.571 5.744 -19.175 552 1HD1 LEU 64 1HD1 LEU 64 5.546 4.693 -18.283 553 2HD1 LEU 64 2HD1 LEU 64 5.995 6.136 -19.196 554 3HD1 LEU 64 3HD1 LEU 64 5.995 6.194 -17.427 555 1HD2 LEU 64 1HD2 LEU 64 3.786 6.214 -16.171 556 2HD2 LEU 64 2HD2 LEU 64 2.290 5.900 -17.085 557 3HD2 LEU 64 3HD2 LEU 64 3.514 4.636 -16.945 558 H GLY 65 H GLY 65 2.244 9.970 -20.503 559 1HA GLY 65 HA2 GLY 65 2.658 12.191 -20.921 560 2HA GLY 65 HA3 GLY 65 2.254 12.539 -19.236 561 H GLY 66 H GLY 66 4.931 10.481 -20.496 562 1HA GLY 66 HA2 GLY 66 6.788 11.663 -18.602 563 2HA GLY 66 HA3 GLY 66 7.139 10.415 -19.782 564 H ASN 67 H ASN 67 9.082 12.064 -19.370 565 HA ASN 67 HA ASN 67 9.426 14.503 -20.670 566 1HB ASN 67 HB2 ASN 67 11.023 13.456 -19.136 567 2HB ASN 67 HB3 ASN 67 11.333 12.162 -20.293 568 1HD2 ASN 67 1HD2 ASN 67 13.414 12.481 -21.109 569 2HD2 ASN 67 2HD2 ASN 67 13.994 14.055 -21.638 570 HA PRO 68 HA PRO 68 8.505 13.595 -24.903 571 1HB PRO 68 HB2 PRO 68 10.591 15.705 -25.497 572 2HB PRO 68 HB3 PRO 68 8.985 15.468 -26.261 573 1HG PRO 68 HG2 PRO 68 9.269 17.296 -24.300 574 2HG PRO 68 HG3 PRO 68 7.855 16.188 -24.276 575 1HD PRO 68 HD2 PRO 68 10.403 16.036 -22.676 576 2HD PRO 68 HD3 PRO 68 8.713 15.726 -22.171 577 H GLY 69 H GLY 69 11.744 12.780 -23.938 578 1HA GLY 69 HA2 GLY 69 11.987 11.183 -26.450 579 2HA GLY 69 HA3 GLY 69 13.356 12.176 -25.921 580 H SER 70 H SER 70 12.603 11.262 -22.938 581 HA SER 70 HA SER 70 13.967 8.721 -22.881 582 1HB SER 70 HB2 SER 70 12.118 9.789 -20.738 583 2HB SER 70 HB3 SER 70 13.484 8.678 -20.574 584 HG SER 70 HG SER 70 14.331 10.587 -19.994 585 H THR 71 H THR 71 11.546 8.787 -24.652 586 HA THR 71 HA THR 71 9.295 7.502 -23.590 587 HB THR 71 H5T THR 71 8.665 7.119 -25.915 588 HG1 THR 71 HG1 THR 71 10.328 7.833 -27.483 589 1HG2 THR 71 1HG2 THR 71 10.163 9.757 -25.787 590 2HG2 THR 71 2HG2 THR 71 8.819 9.327 -26.859 591 3HG2 THR 71 3HG2 THR 71 8.544 9.474 -25.121 592 H SER 72 H SER 72 12.321 6.095 -24.584 593 HA SER 72 HA SER 72 11.432 3.341 -24.780 594 1HB SER 72 HB2 SER 72 14.197 4.499 -24.294 595 2HB SER 72 HB3 SER 72 13.840 2.806 -24.685 596 HG SER 72 HG SER 72 14.395 4.064 -26.542 597 H ALA 73 H ALA 73 12.117 5.362 -21.929 598 HA ALA 73 HA ALA 73 12.612 3.483 -20.056 599 1HB ALA 73 HB1 ALA 73 12.298 5.863 -19.570 600 2HB ALA 73 HB2 ALA 73 10.545 5.691 -19.806 601 3HB ALA 73 HB3 ALA 73 11.342 4.856 -18.460 602 H ALA 74 H ALA 74 9.286 4.066 -21.361 603 HA ALA 74 HA ALA 74 7.861 1.896 -20.145 604 1HB ALA 74 HB1 ALA 74 6.327 2.271 -21.913 605 2HB ALA 74 HB2 ALA 74 6.912 3.798 -21.315 606 3HB ALA 74 HB3 ALA 74 7.543 3.165 -22.862 607 H THR 75 H THR 75 10.084 1.865 -22.971 608 HA THR 75 HA THR 75 9.399 -0.860 -23.731 609 HB THR 75 H5T THR 75 11.855 0.838 -24.369 610 HG1 THR 75 HG1 THR 75 9.486 0.456 -25.870 611 1HG2 THR 75 1HG2 THR 75 12.260 -1.498 -25.002 612 2HG2 THR 75 2HG2 THR 75 10.672 -1.594 -25.795 613 3HG2 THR 75 3HG2 THR 75 11.943 -0.541 -26.453 614 H CYS 76 H CYS 76 11.963 0.550 -21.648 615 HA CYS 76 HA CYS 76 13.064 -2.082 -20.960 616 1HB CYS 76 HB2 CYS 76 14.302 0.138 -20.861 617 2HB CYS 76 HB3 CYS 76 13.303 0.574 -19.467 618 HG CYS 76 HG CYS 76 13.934 -1.638 -18.072 619 H THR 77 H THR 77 10.518 0.021 -19.611 620 HA THR 77 HA THR 77 10.084 -1.335 -17.158 621 HB THR 77 H5T THR 77 8.103 0.101 -18.967 622 HG1 THR 77 HG1 THR 77 9.824 1.357 -18.204 623 1HG2 THR 77 1HG2 THR 77 6.830 0.469 -16.879 624 2HG2 THR 77 2HG2 THR 77 6.845 -1.231 -17.375 625 3HG2 THR 77 3HG2 THR 77 7.907 -0.692 -16.052 626 H ARG 78 H ARG 78 9.096 -2.291 -20.460 627 HA ARG 78 HA ARG 78 7.294 -4.350 -19.905 628 1HB ARG 78 HB2 ARG 78 8.054 -3.509 -22.161 629 2HB ARG 78 HB3 ARG 78 9.569 -4.379 -21.937 630 1HG ARG 78 HG2 ARG 78 8.381 -6.535 -21.849 631 2HG ARG 78 HG3 ARG 78 6.822 -5.707 -21.969 632 1HD ARG 78 HD2 ARG 78 7.482 -4.840 -24.211 633 2HD ARG 78 HD3 ARG 78 9.048 -5.653 -24.046 634 HE ARG 78 H3T ARG 78 6.780 -7.461 -23.716 635 1HH1 ARG 78 2HH2 ARG 78 8.823 -6.022 -26.171 636 2HH1 ARG 78 1HH2 ARG 78 8.583 -7.348 -27.275 637 1HH2 ARG 78 2HH1 ARG 78 6.499 -9.103 -25.170 638 2HH2 ARG 78 1HH1 ARG 78 7.354 -9.075 -26.685 639 H ARG 79 H ARG 79 10.803 -4.275 -19.293 640 HA ARG 79 HA ARG 79 10.933 -7.143 -19.238 641 1HB ARG 79 HB2 ARG 79 13.011 -5.072 -18.352 642 2HB ARG 79 HB3 ARG 79 13.347 -6.775 -18.663 643 1HG ARG 79 HG2 ARG 79 12.896 -6.501 -21.046 644 2HG ARG 79 HG3 ARG 79 12.368 -4.826 -20.800 645 1HD ARG 79 HD2 ARG 79 14.602 -4.234 -19.935 646 2HD ARG 79 HD3 ARG 79 15.166 -5.882 -20.269 647 HE ARG 79 H3T ARG 79 14.262 -5.224 -22.704 648 1HH1 ARG 79 2HH1 ARG 79 16.271 -3.256 -20.602 649 2HH1 ARG 79 1HH1 ARG 79 17.029 -2.449 -21.946 650 1HH2 ARG 79 2HH2 ARG 79 15.261 -4.141 -24.354 651 2HH2 ARG 79 1HH2 ARG 79 16.465 -2.934 -24.008 652 H HIS 80 H HIS 80 10.093 -4.841 -16.922 653 HA HIS 80 HA HIS 80 10.363 -6.844 -14.707 654 1HB HIS 80 HB2 HIS 80 10.175 -3.831 -14.639 655 2HB HIS 80 HB3 HIS 80 9.832 -4.853 -13.238 656 HD1 HIS 80 HD1 HIS 80 11.915 -5.862 -11.957 657 HD2 HIS 80 HD2 HIS 80 12.784 -4.236 -15.730 658 HE1 HIS 80 HE1 HIS 80 14.461 -5.965 -12.229 659 H TYR 81 H TYR 81 7.992 -4.900 -16.572 660 HA TYR 81 HA TYR 81 5.649 -5.733 -15.258 661 1HB TYR 81 HB2 TYR 81 5.725 -4.121 -17.108 662 2HB TYR 81 HB3 TYR 81 6.211 -5.381 -18.226 663 HD1 TYR 81 HD1 TYR 81 4.605 -7.075 -19.048 664 HD2 TYR 81 HD2 TYR 81 3.397 -3.945 -16.338 665 HE1 TYR 81 HE1 TYR 81 2.228 -7.489 -19.626 666 HE2 TYR 81 HE2 TYR 81 1.027 -4.322 -16.958 667 HH TYR 81 HH TYR 81 0.032 -6.837 -19.297 668 H GLU 82 H GLU 82 7.725 -7.652 -17.526 669 HA GLU 82 HA GLU 82 5.820 -9.771 -17.820 670 1HB GLU 82 HB2 GLU 82 7.606 -11.012 -18.860 671 2HB GLU 82 HB3 GLU 82 7.605 -9.353 -19.466 672 1HG GLU 82 HG2 GLU 82 9.508 -8.774 -18.132 673 2HG GLU 82 HG3 GLU 82 9.389 -10.243 -17.173 674 H ARG 83 H ARG 83 7.664 -8.845 -15.135 675 HA ARG 83 HA ARG 83 7.653 -11.607 -14.063 676 1HB ARG 83 HB2 ARG 83 9.925 -9.892 -14.612 677 2HB ARG 83 HB3 ARG 83 9.787 -10.072 -12.876 678 1HG ARG 83 HG2 ARG 83 11.200 -11.821 -13.574 679 2HG ARG 83 HG3 ARG 83 9.653 -12.586 -13.212 680 1HD ARG 83 HD2 ARG 83 9.144 -12.569 -15.691 681 2HD ARG 83 HD3 ARG 83 10.754 -11.874 -15.970 682 HE ARG 83 H3T ARG 83 10.752 -14.352 -14.407 683 1HH1 ARG 83 2HH2 ARG 83 10.937 -13.165 -17.765 684 2HH1 ARG 83 1HH2 ARG 83 11.626 -14.675 -18.282 685 1HH2 ARG 83 2HH1 ARG 83 11.654 -16.189 -15.213 686 2HH2 ARG 83 1HH1 ARG 83 12.020 -16.314 -16.904 687 H LEU 84 H LEU 84 6.696 -8.372 -13.479 688 HA LEU 84 HA LEU 84 6.061 -9.055 -10.634 689 1HB LEU 84 HB2 LEU 84 7.194 -6.560 -11.893 690 2HB LEU 84 HB3 LEU 84 6.339 -6.476 -10.374 691 HG LEU 84 HG LEU 84 8.670 -8.368 -10.772 692 1HD1 LEU 84 1HD1 LEU 84 8.645 -5.586 -9.540 693 2HD1 LEU 84 2HD1 LEU 84 10.039 -6.694 -9.613 694 3HD1 LEU 84 3HD1 LEU 84 9.372 -6.006 -11.105 695 1HD2 LEU 84 1HD2 LEU 84 7.122 -7.342 -8.353 696 2HD2 LEU 84 2HD2 LEU 84 7.336 -9.028 -8.876 697 3HD2 LEU 84 3HD2 LEU 84 8.700 -8.128 -8.221 698 H ILE 85 H ILE 85 4.438 -8.949 -13.386 699 HA ILE 85 HA ILE 85 2.027 -8.759 -11.919 700 HB ILE 85 H5T ILE 85 2.330 -6.311 -12.136 701 1HG1 ILE 85 2HG1 ILE 85 -0.028 -6.815 -13.891 702 2HG1 ILE 85 3HG1 ILE 85 0.007 -7.647 -12.344 703 1HG2 ILE 85 1HG2 ILE 85 2.081 -6.693 -15.137 704 2HG2 ILE 85 2HG2 ILE 85 2.114 -5.151 -14.259 705 3HG2 ILE 85 3HG2 ILE 85 3.543 -6.187 -14.261 706 1HD1 ILE 85 1HD1 ILE 85 -1.119 -5.365 -12.333 707 2HD1 ILE 85 2HD1 ILE 85 0.114 -5.622 -11.095 708 3HD1 ILE 85 3HD1 ILE 85 0.508 -4.658 -12.514 709 H LEU 86 H LEU 86 3.451 -8.946 -15.212 710 HA LEU 86 HA LEU 86 1.329 -10.271 -16.457 711 1HB LEU 86 HB2 LEU 86 3.379 -9.553 -17.552 712 2HB LEU 86 HB3 LEU 86 4.296 -10.775 -16.663 713 HG LEU 86 HG LEU 86 3.278 -12.569 -17.877 714 1HD1 LEU 86 1HD1 LEU 86 1.676 -12.125 -19.775 715 2HD1 LEU 86 2HD1 LEU 86 0.967 -11.717 -18.214 716 3HD1 LEU 86 3HD1 LEU 86 1.588 -10.426 -19.258 717 1HD2 LEU 86 1HD2 LEU 86 5.165 -11.576 -18.971 718 2HD2 LEU 86 2HD2 LEU 86 3.984 -12.035 -20.198 719 3HD2 LEU 86 3HD2 LEU 86 4.138 -10.326 -19.731 720 HA PRO 87 HA PRO 87 2.331 -14.438 -14.359 721 1HB PRO 87 HB2 PRO 87 3.657 -14.542 -11.960 722 2HB PRO 87 HB3 PRO 87 4.464 -14.645 -13.555 723 1HG PRO 87 HG2 PRO 87 4.092 -12.184 -11.814 724 2HG PRO 87 HG3 PRO 87 5.605 -12.791 -12.562 725 1HD PRO 87 HD2 PRO 87 4.198 -10.853 -13.747 726 2HD PRO 87 HD3 PRO 87 4.891 -12.166 -14.734 727 H TYR 88 H TYR 88 1.269 -11.522 -12.700 728 HA TYR 88 HA TYR 88 -0.476 -13.174 -10.937 729 1HB TYR 88 HB2 TYR 88 0.845 -10.575 -10.583 730 2HB TYR 88 HB3 TYR 88 -0.852 -10.594 -10.131 731 HD1 TYR 88 HD1 TYR 88 1.900 -13.205 -9.819 732 HD2 TYR 88 HD2 TYR 88 -1.066 -10.791 -7.827 733 HE1 TYR 88 HE1 TYR 88 2.314 -14.431 -7.694 734 HE2 TYR 88 HE2 TYR 88 -0.617 -11.986 -5.701 735 HH TYR 88 HH TYR 88 0.565 -13.660 -4.667 736 H GLU 89 H GLU 89 -0.835 -10.491 -13.356 737 HA GLU 89 HA GLU 89 -3.639 -10.687 -13.515 738 1HB GLU 89 HB2 GLU 89 -3.511 -9.575 -15.573 739 2HB GLU 89 HB3 GLU 89 -2.173 -9.002 -14.597 740 1HG GLU 89 HG2 GLU 89 -1.063 -9.258 -16.568 741 2HG GLU 89 HG3 GLU 89 -0.803 -10.866 -15.904 742 H ARG 90 H ARG 90 -1.460 -13.143 -14.102 743 HA ARG 90 HA ARG 90 -2.771 -14.834 -15.993 744 1HB ARG 90 HB2 ARG 90 -0.503 -15.182 -14.987 745 2HB ARG 90 HB3 ARG 90 -1.275 -15.553 -13.438 746 1HG ARG 90 HG2 ARG 90 -2.419 -17.504 -14.484 747 2HG ARG 90 HG3 ARG 90 -1.629 -17.140 -16.025 748 1HD ARG 90 HD2 ARG 90 -0.195 -17.770 -13.402 749 2HD ARG 90 HD3 ARG 90 -0.543 -18.959 -14.653 750 HE ARG 90 H3T ARG 90 0.853 -17.552 -16.219 751 1HH1 ARG 90 2HH2 ARG 90 1.585 -17.402 -12.788 752 2HH1 ARG 90 1HH2 ARG 90 3.292 -17.223 -13.076 753 1HH2 ARG 90 2HH1 ARG 90 3.011 -17.219 -16.507 754 2HH2 ARG 90 1HH1 ARG 90 4.064 -17.063 -15.135 755 H PHE 91 H PHE 91 -3.556 -14.185 -12.518 756 HA PHE 91 HA PHE 91 -5.558 -16.258 -12.429 757 1HB PHE 91 HB2 PHE 91 -6.491 -15.105 -10.464 758 2HB PHE 91 HB3 PHE 91 -4.810 -15.565 -10.375 759 HD1 PHE 91 HD1 PHE 91 -6.671 -12.406 -11.487 760 HD2 PHE 91 HD2 PHE 91 -3.617 -14.165 -8.987 761 HE1 PHE 91 HE1 PHE 91 -6.034 -10.166 -10.676 762 HE2 PHE 91 HE2 PHE 91 -3.056 -11.931 -8.121 763 HZ PHE 91 HZ PHE 91 -4.216 -9.920 -9.001 764 H ILE 92 H ILE 92 -5.734 -13.062 -13.934 765 HA ILE 92 HA ILE 92 -8.620 -12.915 -13.902 766 HB ILE 92 H5T ILE 92 -6.695 -11.625 -15.877 767 1HG1 ILE 92 2HG1 ILE 92 -7.710 -10.569 -13.193 768 2HG1 ILE 92 3HG1 ILE 92 -6.059 -11.079 -13.535 769 1HG2 ILE 92 1HG2 ILE 92 -9.082 -11.573 -16.581 770 2HG2 ILE 92 2HG2 ILE 92 -9.515 -10.835 -15.026 771 3HG2 ILE 92 3HG2 ILE 92 -8.490 -9.968 -16.192 772 1HD1 ILE 92 1HD1 ILE 92 -7.453 -8.643 -14.671 773 2HD1 ILE 92 2HD1 ILE 92 -6.041 -8.721 -13.613 774 3HD1 ILE 92 3HD1 ILE 92 -5.913 -9.279 -15.296 775 H LYS 93 H LYS 93 -6.244 -14.334 -16.185 776 HA LYS 93 HA LYS 93 -8.437 -15.005 -18.082 777 1HB LYS 93 HB2 LYS 93 -6.702 -15.322 -19.703 778 2HB LYS 93 HB3 LYS 93 -6.431 -13.801 -18.856 779 1HG LYS 93 HG2 LYS 93 -4.757 -15.097 -17.370 780 2HG LYS 93 HG3 LYS 93 -4.895 -16.413 -18.552 781 1HD LYS 93 HD2 LYS 93 -4.186 -14.774 -20.346 782 2HD LYS 93 HD3 LYS 93 -4.005 -13.544 -19.073 783 1HE LYS 93 HE2 LYS 93 -2.441 -15.296 -17.923 784 2HE LYS 93 HE3 LYS 93 -2.395 -16.094 -19.501 785 1HZ LYS 93 HZ1 LYS 93 -1.641 -13.266 -18.943 786 2HZ LYS 93 HZ2 LYS 93 -0.574 -14.483 -19.210 787 3HZ LYS 93 HZ3 LYS 93 -1.555 -13.980 -20.426 788 H GLY 94 H GLY 94 -6.863 -16.587 -15.523 789 1HA GLY 94 HA2 GLY 94 -7.600 -19.269 -16.681 790 2HA GLY 94 HA3 GLY 94 -6.146 -18.974 -15.735 791 H GLU 95 H GLU 95 -8.077 -17.129 -13.950 792 HA GLU 95 HA GLU 95 -9.476 -19.300 -12.491 793 1HB GLU 95 HB2 GLU 95 -7.473 -17.350 -11.259 794 2HB GLU 95 HB3 GLU 95 -8.476 -18.487 -10.364 795 1HG GLU 95 HG2 GLU 95 -7.370 -20.376 -11.609 796 2HG GLU 95 HG3 GLU 95 -6.252 -19.193 -12.306 797 H GLU 96 H GLU 96 -10.359 -16.993 -14.105 798 HA GLU 96 HA GLU 96 -12.511 -16.168 -12.332 799 1HB GLU 96 HB2 GLU 96 -10.714 -14.477 -11.871 800 2HB GLU 96 HB3 GLU 96 -10.770 -13.995 -13.573 801 1HG GLU 96 HG2 GLU 96 -13.123 -13.298 -13.318 802 2HG GLU 96 HG3 GLU 96 -13.143 -13.906 -11.659 803 H ASP 97 H ASP 97 -11.071 -15.607 -15.629 804 HA ASP 97 HA ASP 97 -13.686 -15.079 -16.760 805 1HB ASP 97 HB2 ASP 97 -11.596 -14.071 -17.582 806 2HB ASP 97 HB3 ASP 97 -11.036 -15.656 -18.121 807 H LYS 98 H LYS 98 -14.447 -17.243 -15.614 808 HA LYS 98 HA LYS 98 -14.772 -19.178 -17.808 809 1HB LYS 98 HB2 LYS 98 -14.310 -21.097 -16.291 810 2HB LYS 98 HB3 LYS 98 -12.915 -20.062 -16.580 811 1HG LYS 98 HG2 LYS 98 -13.250 -18.990 -14.339 812 2HG LYS 98 HG3 LYS 98 -14.665 -20.010 -14.080 813 1HD LYS 98 HD2 LYS 98 -12.802 -20.970 -12.892 814 2HD LYS 98 HD3 LYS 98 -13.188 -22.042 -14.253 815 1HE LYS 98 HE2 LYS 98 -11.328 -20.986 -15.570 816 2HE LYS 98 HE3 LYS 98 -10.981 -19.925 -14.207 817 1HZ LYS 98 HZ1 LYS 98 -10.661 -22.876 -14.265 818 2HZ LYS 98 HZ2 LYS 98 -9.482 -21.738 -14.145 819 3HZ LYS 98 HZ3 LYS 98 -10.509 -21.989 -12.897 820 HA PRO 99 HA PRO 99 -18.928 -18.996 -16.697 821 1HB PRO 99 HB2 PRO 99 -20.040 -21.113 -17.996 822 2HB PRO 99 HB3 PRO 99 -19.099 -19.864 -18.849 823 1HG PRO 99 HG2 PRO 99 -18.069 -22.529 -17.803 824 2HG PRO 99 HG3 PRO 99 -17.974 -21.893 -19.483 825 1HD PRO 99 HD2 PRO 99 -15.925 -21.566 -17.736 826 2HD PRO 99 HD3 PRO 99 -16.378 -20.270 -18.882 827 H LEU 100 H LEU 100 -17.480 -20.139 -14.371 828 HA LEU 100 HA LEU 100 -18.905 -22.345 -13.258 829 1HB LEU 100 HB2 LEU 100 -17.448 -20.016 -11.984 830 2HB LEU 100 HB3 LEU 100 -18.148 -21.336 -11.050 831 HG LEU 100 HG LEU 100 -16.006 -21.716 -13.189 832 1HD1 LEU 100 1HD1 LEU 100 -15.807 -21.687 -10.154 833 2HD1 LEU 100 2HD1 LEU 100 -14.484 -22.079 -11.274 834 3HD1 LEU 100 3HD1 LEU 100 -15.164 -20.442 -11.248 835 1HD2 LEU 100 1HD2 LEU 100 -15.721 -23.943 -12.131 836 2HD2 LEU 100 2HD2 LEU 100 -17.133 -23.630 -11.096 837 3HD2 LEU 100 3HD2 LEU 100 -17.317 -23.771 -12.860 838 HA PRO 101 HA PRO 101 -22.922 -20.500 -12.942 839 1HB PRO 101 HB2 PRO 101 -23.302 -22.473 -10.680 840 2HB PRO 101 HB3 PRO 101 -24.412 -22.091 -12.034 841 1HG PRO 101 HG2 PRO 101 -22.862 -24.308 -12.136 842 2HG PRO 101 HG3 PRO 101 -23.038 -23.272 -13.588 843 1HD PRO 101 HD2 PRO 101 -20.750 -23.371 -11.615 844 2HD PRO 101 HD3 PRO 101 -20.722 -23.276 -13.402 845 HA PRO 102 HA PRO 102 -22.958 -17.797 -9.260 846 1HB PRO 102 HB2 PRO 102 -25.444 -16.707 -9.459 847 2HB PRO 102 HB3 PRO 102 -24.133 -16.309 -10.610 848 1HG PRO 102 HG2 PRO 102 -26.368 -18.329 -10.976 849 2HG PRO 102 HG3 PRO 102 -25.833 -17.054 -12.113 850 1HD PRO 102 HD2 PRO 102 -24.989 -19.656 -12.287 851 2HD PRO 102 HD3 PRO 102 -23.937 -18.281 -12.743 852 H ILE 103 H ILE 103 -24.232 -17.559 -7.207 853 HA ILE 103 HA ILE 103 -24.742 -18.650 -5.310 854 HB ILE 103 H5T ILE 103 -26.972 -19.450 -5.011 855 1HG1 ILE 103 2HG1 ILE 103 -27.264 -20.486 -7.378 856 2HG1 ILE 103 3HG1 ILE 103 -28.618 -19.805 -6.508 857 1HG2 ILE 103 1HG2 ILE 103 -26.447 -17.104 -4.830 858 2HG2 ILE 103 2HG2 ILE 103 -26.761 -16.848 -6.556 859 3HG2 ILE 103 3HG2 ILE 103 -28.082 -17.319 -5.464 860 1HD1 ILE 103 1HD1 ILE 103 -27.161 -18.280 -8.694 861 2HD1 ILE 103 2HD1 ILE 103 -28.614 -19.263 -8.932 862 3HD1 ILE 103 3HD1 ILE 103 -28.677 -17.835 -7.888 863 H LYS 104 H LYS 104 -22.803 -20.012 -6.315 864 HA LYS 104 HA LYS 104 -23.220 -22.694 -5.251 865 1HB LYS 104 HB2 LYS 104 -24.031 -22.909 -7.621 866 2HB LYS 104 HB3 LYS 104 -22.453 -22.369 -8.198 867 1HG LYS 104 HG2 LYS 104 -21.379 -24.340 -7.178 868 2HG LYS 104 HG3 LYS 104 -22.925 -24.862 -6.496 869 1HD LYS 104 HD2 LYS 104 -22.339 -24.625 -9.479 870 2HD LYS 104 HD3 LYS 104 -22.242 -26.115 -8.526 871 1HE LYS 104 HE2 LYS 104 -24.664 -25.797 -7.877 872 2HE LYS 104 HE3 LYS 104 -24.745 -24.434 -8.999 873 1HZ LYS 104 HZ1 LYS 104 -24.098 -27.242 -9.747 874 2HZ LYS 104 HZ2 LYS 104 -25.516 -26.493 -10.035 875 3HZ LYS 104 HZ3 LYS 104 -24.165 -25.993 -10.802 876 HA PRO 105 HA PRO 105 -19.086 -21.408 -4.178 877 1HB PRO 105 HB2 PRO 105 -17.957 -23.737 -3.225 878 2HB PRO 105 HB3 PRO 105 -19.165 -22.757 -2.341 879 1HG PRO 105 HG2 PRO 105 -19.650 -25.221 -4.037 880 2HG PRO 105 HG3 PRO 105 -20.283 -24.859 -2.399 881 1HD PRO 105 HD2 PRO 105 -21.784 -24.433 -4.610 882 2HD PRO 105 HD3 PRO 105 -21.832 -23.281 -3.247 883 H ARG 106 H ARG 106 -17.337 -21.000 -5.373 884 HA ARG 106 HA ARG 106 -16.747 -22.370 -7.848 885 1HB ARG 106 HB2 ARG 106 -14.970 -20.776 -8.123 886 2HB ARG 106 HB3 ARG 106 -16.393 -19.967 -7.510 887 1HG ARG 106 HG2 ARG 106 -14.876 -18.951 -6.154 888 2HG ARG 106 HG3 ARG 106 -15.174 -20.351 -5.138 889 1HD ARG 106 HD2 ARG 106 -12.819 -20.078 -5.224 890 2HD ARG 106 HD3 ARG 106 -13.177 -21.463 -6.252 891 HE ARG 106 H3T ARG 106 -12.959 -18.809 -7.562 892 1HH1 ARG 106 2HH2 ARG 106 -11.340 -21.923 -7.050 893 2HH1 ARG 106 1HH2 ARG 106 -9.992 -21.435 -8.037 894 1HH2 ARG 106 2HH1 ARG 106 -11.263 -18.400 -8.967 895 2HH2 ARG 106 1HH1 ARG 106 -9.974 -19.551 -9.089 896 H LYS 107 H LYS 107 -14.881 -23.527 -8.480 897 HA LYS 107 HA LYS 107 -14.269 -25.707 -6.843 898 1HB LYS 107 HB2 LYS 107 -12.710 -24.583 -9.204 899 2HB LYS 107 HB3 LYS 107 -12.449 -26.177 -8.485 900 1HG LYS 107 HG2 LYS 107 -14.800 -26.809 -8.999 901 2HG LYS 107 HG3 LYS 107 -15.052 -25.233 -9.774 902 1HD LYS 107 HD2 LYS 107 -13.273 -25.745 -11.424 903 2HD LYS 107 HD3 LYS 107 -13.004 -27.319 -10.643 904 1HE LYS 107 HE2 LYS 107 -15.365 -27.950 -11.115 905 2HE LYS 107 HE3 LYS 107 -15.623 -26.393 -11.912 906 1HZ LYS 107 HZ1 LYS 107 -13.921 -27.035 -13.547 907 2HZ LYS 107 HZ2 LYS 107 -13.692 -28.473 -12.802 908 3HZ LYS 107 HZ3 LYS 107 -15.118 -28.143 -13.519
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