NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
5712 | 1hue | 4047 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Orig H atom name Start of MODEL 1 Raw file had 1432 H/Q atoms Start of MODEL 1 1 1H MET 1 1H MET 1 -12.634 5.050 -1.201 2 2H MET 1 2H MET 1 -11.413 5.406 -2.228 3 HA MET 1 HA MET 1 -12.768 7.293 -0.435 4 1HB MET 1 1HB MET 1 -9.960 6.089 -0.142 5 2HB MET 1 2HB MET 1 -10.625 7.330 0.873 6 1HG MET 1 1HG MET 1 -12.388 5.732 1.723 7 2HG MET 1 2HG MET 1 -11.696 4.457 0.689 8 1HE MET 1 2HE MET 1 -10.518 2.706 2.093 9 2HE MET 1 1HE MET 1 -9.808 3.038 3.696 10 3HE MET 1 3HE MET 1 -11.556 3.318 3.414 11 H ASN 2 H ASN 2 -9.624 8.176 -0.796 12 HA ASN 2 HA ASN 2 -9.052 9.444 -3.015 13 1HB ASN 2 1HB ASN 2 -9.747 11.692 -3.365 14 2HB ASN 2 2HB ASN 2 -11.125 10.637 -3.401 15 1HD2 ASN 2 1HD2 ASN 2 -12.852 12.428 -0.808 16 2HD2 ASN 2 2HD2 ASN 2 -12.830 10.972 -1.925 17 H LYS 3 H LYS 3 -9.435 10.243 0.263 18 HA LYS 3 HA LYS 3 -7.159 10.264 1.550 19 1HB LYS 3 1HB LYS 3 -5.907 11.555 -0.267 20 2HB LYS 3 2HB LYS 3 -6.795 13.000 0.164 21 1HG LYS 3 1HG LYS 3 -5.680 12.910 2.458 22 2HG LYS 3 2HG LYS 3 -4.970 11.345 2.055 23 1HD LYS 3 1HD LYS 3 -3.693 12.460 0.142 24 2HD LYS 3 2HD LYS 3 -4.353 14.020 0.647 25 1HE LYS 3 1HE LYS 3 -3.226 13.754 2.913 26 2HE LYS 3 2HE LYS 3 -2.578 12.186 2.401 27 1HZ LYS 3 1HZ LYS 3 -0.967 13.910 2.100 28 2HZ LYS 3 2HZ LYS 3 -1.370 13.289 0.643 29 H THR 4 H THR 4 -10.045 12.197 0.927 30 HA THR 4 HA THR 4 -10.069 13.410 3.581 31 HB THR 4 HB THR 4 -11.718 13.590 0.961 32 HG1 THR 4 HG1 THR 4 -9.622 14.553 0.925 33 1HG2 THR 4 3HG2 THR 4 -11.869 15.090 3.585 34 2HG2 THR 4 1HG2 THR 4 -12.671 15.599 2.024 35 3HG2 THR 4 2HG2 THR 4 -13.117 14.038 2.818 36 H GLU 5 H GLU 5 -11.551 10.832 1.663 37 HA GLU 5 HA GLU 5 -13.688 10.152 3.681 38 1HB GLU 5 1HB GLU 5 -12.546 8.203 1.644 39 2HB GLU 5 2HB GLU 5 -14.030 8.041 2.548 40 1HG GLU 5 1HG GLU 5 -13.448 9.962 0.227 41 2HG GLU 5 2HG GLU 5 -14.458 8.543 0.179 42 HE2 GLU 5 HE2 GLU 5 -15.907 12.060 1.449 43 H LEU 6 H LEU 6 -10.334 9.907 3.327 44 HA LEU 6 HA LEU 6 -9.648 7.701 5.179 45 1HB LEU 6 2HB LEU 6 -8.229 9.331 3.307 46 2HB LEU 6 1HB LEU 6 -7.708 10.025 4.816 47 HG LEU 6 HG LEU 6 -7.418 7.118 4.068 48 1HD1 LEU 6 3HD1 LEU 6 -5.391 9.382 4.331 49 2HD1 LEU 6 1HD1 LEU 6 -4.981 7.671 4.077 50 3HD1 LEU 6 2HD1 LEU 6 -5.891 8.585 2.843 51 1HD2 LEU 6 3HD2 LEU 6 -7.044 8.450 6.758 52 2HD2 LEU 6 1HD2 LEU 6 -7.671 6.845 6.363 53 3HD2 LEU 6 2HD2 LEU 6 -5.929 7.177 6.255 54 H ILE 7 H ILE 7 -9.786 11.307 5.349 55 HA ILE 7 HA ILE 7 -9.061 11.637 8.121 56 HB ILE 7 HB ILE 7 -10.901 13.486 6.473 57 1HG1 ILE 7 1HG1 ILE 7 -7.855 13.742 6.756 58 2HG1 ILE 7 2HG1 ILE 7 -8.567 12.917 5.423 59 1HG2 ILE 7 2HG2 ILE 7 -10.893 14.071 8.946 60 2HG2 ILE 7 3HG2 ILE 7 -9.133 14.208 8.880 61 3HG2 ILE 7 1HG2 ILE 7 -10.144 15.341 7.971 62 1HD1 ILE 7 1HD1 ILE 7 -9.905 15.046 4.838 63 2HD1 ILE 7 2HD1 ILE 7 -8.800 15.892 5.916 64 3HD1 ILE 7 3HD1 ILE 7 -8.154 14.994 4.515 65 H ASN 8 H ASN 8 -12.286 11.422 6.632 66 HA ASN 8 HA ASN 8 -13.722 11.382 9.224 67 1HB ASN 8 1HB ASN 8 -14.734 10.268 6.497 68 2HB ASN 8 2HB ASN 8 -15.743 10.545 7.896 69 1HD2 ASN 8 2HD2 ASN 8 -15.216 13.659 5.393 70 2HD2 ASN 8 1HD2 ASN 8 -14.596 11.965 5.056 71 H ALA 9 H ALA 9 -12.005 8.825 7.660 72 HA ALA 9 HA ALA 9 -13.356 6.552 9.086 73 1HB ALA 9 2HB ALA 9 -11.702 6.236 6.976 74 2HB ALA 9 3HB ALA 9 -10.387 6.718 8.046 75 3HB ALA 9 1HB ALA 9 -11.246 5.257 8.423 76 H VAL 10 H VAL 10 -10.491 8.633 9.579 77 HA VAL 10 HA VAL 10 -9.552 7.186 11.843 78 HB VAL 10 HB VAL 10 -8.495 9.941 11.420 79 1HG1 VAL 10 3HG2 VAL 10 -7.671 8.034 13.045 80 2HG1 VAL 10 1HG2 VAL 10 -6.906 7.394 11.563 81 3HG1 VAL 10 2HG2 VAL 10 -6.498 9.036 12.116 82 1HG2 VAL 10 1HG1 VAL 10 -8.277 7.684 9.392 83 2HG2 VAL 10 2HG1 VAL 10 -8.742 9.406 9.214 84 3HG2 VAL 10 3HG1 VAL 10 -7.022 8.989 9.517 85 H ALA 11 H ALA 11 -10.921 10.212 11.392 86 HA ALA 11 HA ALA 11 -11.232 10.647 14.173 87 1HB ALA 11 2HB ALA 11 -11.199 12.560 12.527 88 2HB ALA 11 3HB ALA 11 -12.768 12.037 11.861 89 3HB ALA 11 1HB ALA 11 -12.665 12.693 13.528 90 H GLU 12 H GLU 12 -13.299 8.818 12.042 91 HA GLU 12 HA GLU 12 -15.543 8.746 14.038 92 1HB GLU 12 1HB GLU 12 -16.057 8.567 11.573 93 2HB GLU 12 2HB GLU 12 -15.172 7.053 11.498 94 1HG GLU 12 1HG GLU 12 -17.538 6.560 11.554 95 2HG GLU 12 2HG GLU 12 -16.856 5.995 13.066 96 HE1 GLU 12 HE2 GLU 12 -19.538 9.037 12.920 97 H THR 13 H THR 13 -12.950 6.444 12.935 98 HA THR 13 HA THR 13 -13.633 4.564 15.088 99 HB THR 13 HB THR 13 -11.423 3.393 14.552 100 HG1 THR 13 HG1 THR 13 -10.349 5.344 14.288 101 1HG2 THR 13 3HG2 THR 13 -12.783 4.164 11.915 102 2HG2 THR 13 1HG2 THR 13 -11.567 2.897 12.161 103 3HG2 THR 13 2HG2 THR 13 -13.166 2.748 12.935 104 H SER 14 H SER 14 -12.046 7.232 15.414 105 HA SER 14 HA SER 14 -10.544 6.338 17.983 106 1HB SER 14 1HB SER 14 -9.444 8.519 16.121 107 2HB SER 14 2HB SER 14 -8.663 7.846 17.549 108 HG SER 14 HG SER 14 -9.353 6.441 15.183 109 H GLY 15 H GLY 15 -12.372 9.068 16.558 110 1HA GLY 15 1HA GLY 15 -13.250 11.022 17.572 111 2HA GLY 15 2HA GLY 15 -13.067 10.248 19.146 112 H LEU 16 H LEU 16 -10.791 11.313 16.671 113 HA LEU 16 HA LEU 16 -9.273 13.166 18.511 114 1HB LEU 16 1HB LEU 16 -7.479 13.129 16.931 115 2HB LEU 16 2HB LEU 16 -7.792 11.642 17.800 116 HG LEU 16 HG LEU 16 -8.759 10.595 16.029 117 1HD1 LEU 16 2HD1 LEU 16 -10.075 12.490 14.990 118 2HD1 LEU 16 3HD1 LEU 16 -8.516 13.039 14.293 119 3HD1 LEU 16 1HD1 LEU 16 -9.268 11.446 13.822 120 1HD2 LEU 16 3HD2 LEU 16 -6.693 9.976 15.858 121 2HD2 LEU 16 1HD2 LEU 16 -7.664 9.892 14.368 122 3HD2 LEU 16 2HD2 LEU 16 -6.470 11.161 14.526 123 H SER 17 H SER 17 -8.944 14.234 15.766 124 HA SER 17 HA SER 17 -11.336 16.132 15.567 125 1HB SER 17 1HB SER 17 -8.513 17.262 15.311 126 2HB SER 17 2HB SER 17 -10.030 18.113 15.141 127 HG SER 17 HG SER 17 -9.100 18.368 17.196 128 H LYS 18 H LYS 18 -11.557 17.109 13.479 129 HA LYS 18 HA LYS 18 -10.920 15.296 11.156 130 1HB LYS 18 1HB LYS 18 -12.151 18.113 11.057 131 2HB LYS 18 2HB LYS 18 -11.949 17.045 9.682 132 1HG LYS 18 1HG LYS 18 -13.744 16.482 12.119 133 2HG LYS 18 2HG LYS 18 -14.285 17.094 10.567 134 1HD LYS 18 1HD LYS 18 -13.582 14.988 9.419 135 2HD LYS 18 2HD LYS 18 -12.943 14.326 10.912 136 1HE LYS 18 1HE LYS 18 -15.918 15.041 10.455 137 2HE LYS 18 2HE LYS 18 -15.218 13.433 10.266 138 1HZ LYS 18 1HZ LYS 18 -14.641 13.396 12.577 139 2HZ LYS 18 2HZ LYS 18 -16.243 13.667 12.397 140 H LYS 19 H LYS 19 -9.793 18.472 12.253 141 HA LYS 19 HA LYS 19 -7.531 18.718 10.367 142 1HB LYS 19 2HB LYS 19 -7.887 19.945 13.165 143 2HB LYS 19 1HB LYS 19 -6.527 20.319 12.097 144 1HG LYS 19 1HG LYS 19 -8.102 21.196 10.347 145 2HG LYS 19 2HG LYS 19 -9.483 20.823 11.379 146 1HD LYS 19 1HD LYS 19 -8.592 22.398 13.150 147 2HD LYS 19 2HD LYS 19 -7.224 22.796 12.103 148 1HE LYS 19 1HE LYS 19 -8.823 23.690 10.342 149 2HE LYS 19 2HE LYS 19 -10.200 23.271 11.371 150 1HZ LYS 19 1HZ LYS 19 -8.040 25.166 12.114 151 2HZ LYS 19 2HZ LYS 19 -9.316 24.778 13.060 152 H ASP 20 H ASP 20 -7.797 16.991 13.570 153 HA ASP 20 HA ASP 20 -4.859 16.309 13.556 154 1HB ASP 20 1HB ASP 20 -7.197 15.324 15.295 155 2HB ASP 20 2HB ASP 20 -5.662 14.500 15.341 156 HD1 ASP 20 HD2 ASP 20 -3.892 16.892 17.056 157 H ALA 21 H ALA 21 -7.747 14.765 12.287 158 HA ALA 21 HA ALA 21 -6.432 12.175 11.613 159 1HB ALA 21 2HB ALA 21 -9.172 13.406 10.925 160 2HB ALA 21 3HB ALA 21 -8.607 11.838 10.274 161 3HB ALA 21 1HB ALA 21 -8.777 12.079 11.986 162 H THR 22 H THR 22 -7.142 15.192 9.744 163 HA THR 22 HA THR 22 -5.976 14.382 7.238 164 HB THR 22 HB THR 22 -5.817 17.251 8.385 165 HG1 THR 22 HG1 THR 22 -7.877 16.410 8.790 166 1HG2 THR 22 3HG2 THR 22 -6.391 16.075 5.599 167 2HG2 THR 22 1HG2 THR 22 -6.456 17.814 6.006 168 3HG2 THR 22 2HG2 THR 22 -4.900 16.915 6.101 169 H LYS 23 H LYS 23 -4.469 16.016 9.944 170 HA LYS 23 HA LYS 23 -1.692 16.053 9.026 171 1HB LYS 23 2HB LYS 23 -3.020 15.733 11.838 172 2HB LYS 23 1HB LYS 23 -1.304 15.891 11.712 173 1HG LYS 23 1HG LYS 23 -1.460 18.172 10.680 174 2HG LYS 23 2HG LYS 23 -3.215 18.075 10.650 175 1HD LYS 23 1HD LYS 23 -3.219 17.852 13.194 176 2HD LYS 23 2HD LYS 23 -1.478 18.064 13.209 177 1HE LYS 23 1HE LYS 23 -3.505 20.147 12.129 178 2HE LYS 23 2HE LYS 23 -2.838 20.144 13.760 179 1HZ LYS 23 1HZ LYS 23 -1.265 20.456 11.268 180 2HZ LYS 23 2HZ LYS 23 -1.651 21.645 12.322 181 H ALA 24 H ALA 24 -3.277 13.772 11.123 182 HA ALA 24 HA ALA 24 -1.210 11.851 11.504 183 1HB ALA 24 3HB ALA 24 -4.244 11.541 11.536 184 2HB ALA 24 1HB ALA 24 -3.096 10.351 12.223 185 3HB ALA 24 2HB ALA 24 -3.161 12.005 12.895 186 H VAL 25 H VAL 25 -3.518 11.936 8.860 187 HA VAL 25 HA VAL 25 -2.505 9.513 7.422 188 HB VAL 25 HB VAL 25 -4.174 12.174 6.944 189 1HG1 VAL 25 1HG2 VAL 25 -3.290 10.398 4.593 190 2HG1 VAL 25 2HG2 VAL 25 -4.561 11.669 4.542 191 3HG1 VAL 25 3HG2 VAL 25 -2.885 12.099 4.849 192 1HG2 VAL 25 2HG1 VAL 25 -4.872 9.245 6.609 193 2HG2 VAL 25 3HG1 VAL 25 -5.312 10.293 7.972 194 3HG2 VAL 25 1HG1 VAL 25 -5.983 10.647 6.373 195 H ASP 26 H ASP 26 -1.815 13.017 6.887 196 HA ASP 26 HA ASP 26 0.777 12.318 5.486 197 1HB ASP 26 1HB ASP 26 -0.823 14.347 5.036 198 2HB ASP 26 2HB ASP 26 -0.126 15.078 6.482 199 HD1 ASP 26 HD2 ASP 26 1.957 14.691 2.986 200 H ALA 27 H ALA 27 0.325 11.690 8.181 201 HA ALA 27 HA ALA 27 2.975 12.295 9.544 202 1HB ALA 27 2HB ALA 27 0.887 12.657 10.856 203 2HB ALA 27 3HB ALA 27 0.529 10.930 10.641 204 3HB ALA 27 1HB ALA 27 1.998 11.418 11.460 205 H VAL 28 H VAL 28 0.861 9.559 8.864 206 HA VAL 28 HA VAL 28 2.815 7.333 9.111 207 HB VAL 28 HB VAL 28 0.124 7.546 7.534 208 1HG1 VAL 28 2HG2 VAL 28 1.577 5.032 8.550 209 2HG1 VAL 28 3HG2 VAL 28 -0.053 5.120 7.808 210 3HG1 VAL 28 1HG2 VAL 28 1.361 5.535 6.830 211 1HG2 VAL 28 3HG1 VAL 28 -0.131 7.947 9.969 212 2HG2 VAL 28 1HG1 VAL 28 -1.015 6.552 9.282 213 3HG2 VAL 28 2HG1 VAL 28 0.506 6.296 10.257 214 H PHE 29 H PHE 29 1.163 8.819 6.492 215 HA PHE 29 HA PHE 29 2.897 7.810 4.260 216 1HB PHE 29 2HB PHE 29 0.780 9.987 4.001 217 2HB PHE 29 1HB PHE 29 1.467 9.061 2.682 218 HD1 PHE 29 HD1 PHE 29 1.427 6.247 3.388 219 HD2 PHE 29 HD2 PHE 29 -1.431 9.270 4.449 220 HE1 PHE 29 HE1 PHE 29 -0.127 4.513 4.128 221 HE2 PHE 29 HE2 PHE 29 -2.959 7.529 5.255 222 HZ PHE 29 HZ PHE 29 -2.245 5.152 5.186 223 H ASP 30 H ASP 30 3.307 10.647 6.270 224 HA ASP 30 HA ASP 30 5.327 11.848 4.424 225 1HB ASP 30 1HB ASP 30 4.043 13.008 6.388 226 2HB ASP 30 2HB ASP 30 5.197 12.285 7.476 227 HD2 ASP 30 HD2 ASP 30 6.156 15.452 5.187 228 H SER 31 H SER 31 5.307 9.705 7.167 229 HA SER 31 HA SER 31 8.264 9.252 7.322 230 1HB SER 31 1HB SER 31 6.087 7.538 8.556 231 2HB SER 31 2HB SER 31 7.806 7.451 8.926 232 HG SER 31 HG SER 31 7.730 9.632 9.590 233 H ILE 32 H ILE 32 5.601 7.395 5.538 234 HA ILE 32 HA ILE 32 7.363 5.251 4.578 235 HB ILE 32 HB ILE 32 4.967 6.584 3.217 236 1HG1 ILE 32 1HG1 ILE 32 3.701 4.660 3.177 237 2HG1 ILE 32 2HG1 ILE 32 4.854 3.704 4.116 238 1HG2 ILE 32 1HG2 ILE 32 6.872 4.216 2.616 239 2HG2 ILE 32 2HG2 ILE 32 5.371 4.280 1.709 240 3HG2 ILE 32 3HG2 ILE 32 6.582 5.566 1.566 241 1HD1 ILE 32 3HD1 ILE 32 2.844 5.802 5.126 242 2HD1 ILE 32 1HD1 ILE 32 2.732 4.073 5.284 243 3HD1 ILE 32 2HD1 ILE 32 3.974 4.928 6.208 244 H THR 33 H THR 33 6.396 8.568 3.330 245 HA THR 33 HA THR 33 8.122 8.293 1.011 246 HB THR 33 HB THR 33 7.881 10.785 0.631 247 HG1 THR 33 HG1 THR 33 6.626 11.946 2.094 248 1HG2 THR 33 1HG2 THR 33 5.365 9.203 1.384 249 2HG2 THR 33 2HG2 THR 33 5.263 10.820 0.673 250 3HG2 THR 33 3HG2 THR 33 6.044 9.480 -0.210 251 H GLU 34 H GLU 34 8.924 9.427 4.203 252 HA GLU 34 HA GLU 34 11.694 10.216 3.409 253 1HB GLU 34 1HB GLU 34 10.509 11.194 5.481 254 2HB GLU 34 2HB GLU 34 10.627 9.617 6.257 255 1HG GLU 34 1HG GLU 34 13.169 9.765 6.115 256 2HG GLU 34 2HG GLU 34 13.038 11.315 5.292 257 HE1 GLU 34 HE2 GLU 34 12.194 13.147 8.122 258 H ALA 35 H ALA 35 10.131 7.137 4.651 259 HA ALA 35 HA ALA 35 12.674 5.684 4.544 260 1HB ALA 35 3HB ALA 35 10.471 4.624 5.612 261 2HB ALA 35 1HB ALA 35 9.739 4.686 4.022 262 3HB ALA 35 2HB ALA 35 11.029 3.569 4.299 263 H LEU 36 H LEU 36 10.176 5.979 2.036 264 HA LEU 36 HA LEU 36 11.553 4.359 0.085 265 1HB LEU 36 2HB LEU 36 9.455 6.410 -0.402 266 2HB LEU 36 1HB LEU 36 9.869 5.110 -1.471 267 HG LEU 36 HG LEU 36 9.493 3.647 -0.125 268 1HD1 LEU 36 3HD2 LEU 36 7.864 3.468 -1.431 269 2HD1 LEU 36 1HD2 LEU 36 7.015 3.132 0.095 270 3HD1 LEU 36 2HD2 LEU 36 6.916 4.763 -0.593 271 1HD2 LEU 36 2HD1 LEU 36 10.282 3.116 1.576 272 2HD2 LEU 36 3HD1 LEU 36 8.837 3.659 2.339 273 3HD2 LEU 36 1HD1 LEU 36 8.731 2.279 1.246 274 NH1 ARG 37 NH2 ARG 37 9.949 13.212 2.672 275 NH2 ARG 37 NH1 ARG 37 11.687 13.834 3.995 276 H ARG 37 H ARG 37 11.335 7.988 0.440 277 HA ARG 37 HA ARG 37 12.940 8.310 -1.908 278 1HB ARG 37 1HB ARG 37 12.947 10.661 -1.614 279 2HB ARG 37 2HB ARG 37 11.402 10.131 -1.006 280 1HG ARG 37 1HG ARG 37 12.697 10.166 1.396 281 2HG ARG 37 2HG ARG 37 13.858 11.170 0.543 282 1HD ARG 37 1HD ARG 37 12.045 12.761 -0.076 283 2HD ARG 37 2HD ARG 37 10.850 11.701 0.714 284 1HH1 ARG 37 2HH2 ARG 37 9.640 12.757 1.806 285 2HH1 ARG 37 1HH2 ARG 37 9.353 13.638 3.390 286 1HH2 ARG 37 1HH1 ARG 37 12.703 13.857 4.141 287 2HH2 ARG 37 2HH1 ARG 37 10.968 14.216 4.618 288 H LYS 38 H LYS 38 13.836 7.511 1.419 289 HA LYS 38 HA LYS 38 16.547 8.818 1.084 290 1HB LYS 38 1HB LYS 38 15.133 9.341 3.118 291 2HB LYS 38 2HB LYS 38 15.387 7.681 3.667 292 1HG LYS 38 1HG LYS 38 17.842 8.126 3.893 293 2HG LYS 38 2HG LYS 38 17.648 9.696 3.123 294 1HD LYS 38 1HD LYS 38 17.837 10.098 5.476 295 2HD LYS 38 2HD LYS 38 16.179 10.472 5.024 296 1HE LYS 38 1HE LYS 38 15.450 8.180 5.949 297 2HE LYS 38 2HE LYS 38 17.128 7.869 6.419 298 1HZ LYS 38 1HZ LYS 38 15.424 10.090 7.403 299 2HZ LYS 38 2HZ LYS 38 15.809 8.733 8.230 300 H GLY 39 H GLY 39 15.168 5.822 0.431 301 1HA GLY 39 1HA GLY 39 16.356 3.718 -0.051 302 2HA GLY 39 2HA GLY 39 17.700 4.189 0.950 303 H ASP 40 H ASP 40 15.321 4.795 3.036 304 HA ASP 40 HA ASP 40 15.627 2.245 4.542 305 1HB ASP 40 1HB ASP 40 14.414 4.923 5.303 306 2HB ASP 40 2HB ASP 40 14.249 3.516 6.324 307 HD1 ASP 40 HD2 ASP 40 16.350 5.720 4.907 308 H LYS 41 H LYS 41 14.121 1.147 5.635 309 HA LYS 41 HA LYS 41 11.720 0.407 3.892 310 1HB LYS 41 2HB LYS 41 12.908 -1.270 6.174 311 2HB LYS 41 1HB LYS 41 11.638 -1.750 5.045 312 1HG LYS 41 1HG LYS 41 13.449 -1.441 3.165 313 2HG LYS 41 2HG LYS 41 14.632 -1.373 4.458 314 1HD LYS 41 1HD LYS 41 12.686 -3.710 3.911 315 2HD LYS 41 2HD LYS 41 14.372 -3.645 3.413 316 1HE LYS 41 1HE LYS 41 15.111 -3.568 5.844 317 2HE LYS 41 2HE LYS 41 13.420 -3.646 6.360 318 1HZ LYS 41 1HZ LYS 41 14.789 -5.710 4.729 319 2HZ LYS 41 2HZ LYS 41 13.228 -5.775 5.207 320 H VAL 42 H VAL 42 9.643 0.633 4.769 321 HA VAL 42 HA VAL 42 9.071 1.809 7.263 322 HB VAL 42 HB VAL 42 7.329 0.474 5.116 323 1HG1 VAL 42 1HG2 VAL 42 6.247 1.659 7.177 324 2HG1 VAL 42 2HG2 VAL 42 6.903 3.171 6.479 325 3HG1 VAL 42 3HG2 VAL 42 5.765 2.195 5.525 326 1HG2 VAL 42 1HG1 VAL 42 8.543 3.308 5.072 327 2HG2 VAL 42 2HG1 VAL 42 8.928 2.025 3.886 328 3HG2 VAL 42 3HG1 VAL 42 7.300 2.734 3.945 329 H GLN 43 H GLN 43 6.763 0.068 7.420 330 HA GLN 43 HA GLN 43 6.448 -2.141 7.688 331 1HB GLN 43 1HB GLN 43 8.593 -2.554 9.667 332 2HB GLN 43 2HB GLN 43 7.200 -3.639 9.696 333 1HG GLN 43 1HG GLN 43 7.435 -4.318 7.451 334 2HG GLN 43 2HG GLN 43 8.535 -3.052 7.019 335 1HE2 GLN 43 1HE2 GLN 43 11.457 -4.904 7.969 336 2HE2 GLN 43 2HE2 GLN 43 10.723 -3.358 7.318 337 H LEU 44 H LEU 44 4.824 -3.173 8.351 338 HA LEU 44 HA LEU 44 3.126 -1.981 10.579 339 1HB LEU 44 2HB LEU 44 1.937 -2.681 7.822 340 2HB LEU 44 1HB LEU 44 1.172 -1.874 9.181 341 HG LEU 44 HG LEU 44 3.124 -0.044 8.659 342 1HD1 LEU 44 1HD1 LEU 44 4.164 -1.369 6.727 343 2HD1 LEU 44 2HD1 LEU 44 2.645 -1.187 5.830 344 3HD1 LEU 44 3HD1 LEU 44 3.610 0.244 6.281 345 1HD2 LEU 44 2HD2 LEU 44 0.650 0.392 8.636 346 2HD2 LEU 44 3HD2 LEU 44 1.466 1.229 7.300 347 3HD2 LEU 44 1HD2 LEU 44 0.532 -0.259 6.985 348 H ILE 45 H ILE 45 2.768 -3.773 11.905 349 HA ILE 45 HA ILE 45 2.870 -6.515 10.785 350 HB ILE 45 HB ILE 45 3.851 -6.006 12.998 351 1HG1 ILE 45 1HG1 ILE 45 3.115 -8.095 14.176 352 2HG1 ILE 45 2HG1 ILE 45 1.806 -8.305 13.028 353 1HG2 ILE 45 1HG2 ILE 45 2.086 -4.580 13.955 354 2HG2 ILE 45 2HG2 ILE 45 0.951 -5.956 14.012 355 3HG2 ILE 45 3HG2 ILE 45 2.425 -5.960 15.028 356 1HD1 ILE 45 2HD1 ILE 45 4.822 -8.299 12.302 357 2HD1 ILE 45 3HD1 ILE 45 3.811 -9.747 12.527 358 3HD1 ILE 45 1HD1 ILE 45 3.488 -8.651 11.169 359 H GLY 46 H GLY 46 1.222 -7.974 10.752 360 1HA GLY 46 1HA GLY 46 -0.923 -8.727 10.001 361 2HA GLY 46 2HA GLY 46 -1.611 -7.460 10.979 362 H PHE 47 H PHE 47 0.204 -5.877 8.601 363 HA PHE 47 HA PHE 47 -1.928 -5.912 6.468 364 1HB PHE 47 2HB PHE 47 -2.199 -4.193 8.398 365 2HB PHE 47 1HB PHE 47 -0.765 -3.373 7.842 366 HD1 PHE 47 HD2 PHE 47 -4.310 -4.202 6.910 367 HD2 PHE 47 HD1 PHE 47 -0.741 -2.131 5.668 368 HE1 PHE 47 HE2 PHE 47 -5.496 -3.236 4.958 369 HE2 PHE 47 HE1 PHE 47 -1.947 -1.255 3.714 370 HZ PHE 47 HZ PHE 47 -4.306 -1.919 3.326 371 H GLY 48 H GLY 48 1.504 -4.891 7.164 372 1HA GLY 48 1HA GLY 48 2.105 -4.989 4.309 373 2HA GLY 48 2HA GLY 48 1.906 -3.326 4.794 374 H ASN 49 H ASN 49 4.047 -4.289 3.552 375 HA ASN 49 HA ASN 49 6.219 -3.302 5.406 376 1HB ASN 49 1HB ASN 49 6.407 -5.718 5.752 377 2HB ASN 49 2HB ASN 49 6.384 -6.061 4.041 378 1HD2 ASN 49 1HD2 ASN 49 9.914 -6.444 4.799 379 2HD2 ASN 49 2HD2 ASN 49 8.289 -7.292 4.874 380 H PHE 50 H PHE 50 6.329 -1.461 4.207 381 HA PHE 50 HA PHE 50 6.577 -1.563 1.189 382 1HB PHE 50 2HB PHE 50 6.934 0.880 2.957 383 2HB PHE 50 1HB PHE 50 6.992 0.940 1.257 384 HD1 PHE 50 HD2 PHE 50 4.890 0.277 4.208 385 HD2 PHE 50 HD1 PHE 50 5.089 1.799 0.211 386 HE1 PHE 50 HE2 PHE 50 2.656 1.345 4.494 387 HE2 PHE 50 HE1 PHE 50 2.891 2.890 0.541 388 HZ PHE 50 HZ PHE 50 1.710 2.593 2.674 389 H GLU 51 H GLU 51 8.399 -0.999 0.126 390 HA GLU 51 HA GLU 51 10.745 0.069 1.340 391 1HB GLU 51 1HB GLU 51 12.408 -1.809 1.178 392 2HB GLU 51 2HB GLU 51 11.171 -2.232 2.325 393 1HG GLU 51 1HG GLU 51 11.337 -3.318 -0.569 394 2HG GLU 51 2HG GLU 51 11.984 -4.116 0.847 395 HE2 GLU 51 HE2 GLU 51 8.107 -4.418 -0.085 396 H VAL 52 H VAL 52 12.471 0.634 -0.070 397 HA VAL 52 HA VAL 52 11.478 0.812 -2.835 398 HB VAL 52 HB VAL 52 12.425 2.607 -0.860 399 1HG1 VAL 52 1HG2 VAL 52 14.809 2.064 -2.646 400 2HG1 VAL 52 2HG2 VAL 52 14.540 3.508 -1.601 401 3HG1 VAL 52 3HG2 VAL 52 14.671 1.870 -0.888 402 1HG2 VAL 52 3HG1 VAL 52 12.251 3.010 -3.853 403 2HG2 VAL 52 1HG1 VAL 52 10.988 3.247 -2.606 404 3HG2 VAL 52 2HG1 VAL 52 12.416 4.274 -2.630 405 NH1 ARG 53 NH2 ARG 53 12.637 -5.300 -10.026 406 NH2 ARG 53 NH1 ARG 53 14.715 -6.213 -10.141 407 H ARG 53 H ARG 53 12.928 0.586 -4.608 408 HA ARG 53 HA ARG 53 14.975 -1.707 -4.265 409 1HB ARG 53 1HB ARG 53 12.773 -2.471 -5.235 410 2HB ARG 53 2HB ARG 53 12.960 -1.336 -6.543 411 1HG ARG 53 1HG ARG 53 15.176 -2.514 -7.178 412 2HG ARG 53 2HG ARG 53 14.823 -3.719 -5.938 413 1HD ARG 53 1HD ARG 53 12.677 -4.328 -7.142 414 2HD ARG 53 2HD ARG 53 12.983 -3.055 -8.339 415 1HH1 ARG 53 2HH2 ARG 53 11.997 -4.665 -9.536 416 2HH1 ARG 53 1HH2 ARG 53 12.425 -5.869 -10.853 417 1HH2 ARG 53 1HH1 ARG 53 15.662 -6.269 -9.749 418 2HH2 ARG 53 2HH1 ARG 53 14.360 -6.713 -10.963 419 H GLU 54 H GLU 54 16.691 -0.287 -4.152 420 HA GLU 54 HA GLU 54 17.217 1.816 -6.171 421 1HB GLU 54 1HB GLU 54 19.370 2.172 -5.187 422 2HB GLU 54 2HB GLU 54 18.086 2.169 -3.999 423 1HG GLU 54 1HG GLU 54 18.783 -0.211 -3.298 424 2HG GLU 54 2HG GLU 54 20.120 -0.116 -4.442 425 HE1 GLU 54 HE2 GLU 54 20.139 1.975 -0.965 426 NH1 ARG 55 NH2 ARG 55 16.230 -3.672 -12.422 427 NH2 ARG 55 NH1 ARG 55 17.734 -4.609 -10.995 428 H ARG 55 H ARG 55 18.037 1.631 -8.111 429 HA ARG 55 HA ARG 55 18.406 -1.037 -9.292 430 1HB ARG 55 1HB ARG 55 17.361 0.952 -10.483 431 2HB ARG 55 2HB ARG 55 18.945 1.684 -10.598 432 1HG ARG 55 1HG ARG 55 18.521 0.785 -12.702 433 2HG ARG 55 2HG ARG 55 19.731 -0.283 -12.041 434 1HD ARG 55 1HD ARG 55 16.686 -0.874 -12.083 435 2HD ARG 55 2HD ARG 55 17.800 -1.336 -13.373 436 1HH1 ARG 55 2HH2 ARG 55 15.939 -2.840 -12.947 437 2HH1 ARG 55 1HH2 ARG 55 15.762 -4.585 -12.409 438 1HH2 ARG 55 1HH1 ARG 55 18.580 -4.493 -10.427 439 2HH2 ARG 55 2HH1 ARG 55 17.160 -5.456 -11.077 440 H ALA 56 H ALA 56 20.198 -2.082 -9.971 441 HA ALA 56 HA ALA 56 22.778 -1.360 -8.621 442 1HB ALA 56 2HB ALA 56 21.889 -3.641 -8.408 443 2HB ALA 56 3HB ALA 56 21.994 -3.894 -10.170 444 3HB ALA 56 1HB ALA 56 23.471 -3.658 -9.208 445 H ALA 57 H ALA 57 22.997 0.559 -10.092 446 HA ALA 57 HA ALA 57 23.998 1.409 -12.219 447 1HB ALA 57 3HB ALA 57 25.120 2.069 -10.074 448 2HB ALA 57 1HB ALA 57 26.200 0.659 -10.192 449 3HB ALA 57 2HB ALA 57 26.297 1.961 -11.393 450 NH1 ARG 58 NH2 ARG 58 22.183 -5.972 -16.998 451 NH2 ARG 58 NH1 ARG 58 21.104 -4.353 -18.173 452 H ARG 58 H ARG 58 24.282 0.952 -14.123 453 HA ARG 58 HA ARG 58 26.608 -0.648 -14.864 454 1HB ARG 58 2HB ARG 58 24.271 -1.464 -16.622 455 2HB ARG 58 1HB ARG 58 25.688 -2.396 -16.175 456 1HG ARG 58 1HG ARG 58 24.575 -2.768 -13.899 457 2HG ARG 58 2HG ARG 58 23.153 -1.914 -14.490 458 1HD ARG 58 1HD ARG 58 24.325 -4.502 -15.729 459 2HD ARG 58 2HD ARG 58 22.989 -4.450 -14.575 460 1HH1 ARG 58 2HH2 ARG 58 22.839 -6.200 -16.243 461 2HH1 ARG 58 1HH2 ARG 58 21.694 -6.636 -17.609 462 1HH2 ARG 58 1HH1 ARG 58 20.935 -3.351 -18.315 463 2HH2 ARG 58 2HH1 ARG 58 20.689 -5.127 -18.702 464 H LYS 59 H LYS 59 26.756 -0.761 -17.476 465 HA LYS 59 HA LYS 59 25.811 1.876 -18.733 466 1HB LYS 59 1HB LYS 59 28.743 0.910 -18.955 467 2HB LYS 59 2HB LYS 59 27.992 2.211 -19.869 468 1HG LYS 59 1HG LYS 59 27.514 3.394 -17.610 469 2HG LYS 59 2HG LYS 59 28.494 2.160 -16.831 470 1HD LYS 59 1HD LYS 59 30.469 2.810 -18.286 471 2HD LYS 59 2HD LYS 59 29.478 4.048 -19.068 472 1HE LYS 59 1HE LYS 59 29.155 5.204 -16.817 473 2HE LYS 59 2HE LYS 59 30.170 3.975 -16.048 474 1HZ LYS 59 1HZ LYS 59 31.443 5.913 -16.580 475 2HZ LYS 59 2HZ LYS 59 31.999 4.654 -17.462 476 H GLY 60 H GLY 60 24.379 0.925 -20.210 477 1HA GLY 60 1HA GLY 60 25.258 -0.848 -22.270 478 2HA GLY 60 2HA GLY 60 24.732 -1.928 -20.984 479 NH1 ARG 61 NH2 ARG 61 21.301 -1.965 -29.217 480 NH2 ARG 61 NH1 ARG 61 23.280 -0.852 -29.303 481 H ARG 61 H ARG 61 22.656 -2.539 -21.154 482 HA ARG 61 HA ARG 61 20.605 -0.767 -22.450 483 1HB ARG 61 1HB ARG 61 21.136 -3.501 -23.779 484 2HB ARG 61 2HB ARG 61 19.938 -2.292 -24.219 485 1HG ARG 61 1HG ARG 61 21.933 -0.711 -24.760 486 2HG ARG 61 2HG ARG 61 22.974 -2.117 -24.601 487 1HD ARG 61 1HD ARG 61 21.673 -3.305 -26.423 488 2HD ARG 61 2HD ARG 61 20.571 -1.920 -26.538 489 1HH1 ARG 61 2HH2 ARG 61 20.599 -2.439 -28.637 490 2HH1 ARG 61 1HH2 ARG 61 21.272 -1.835 -30.234 491 1HH2 ARG 61 1HH1 ARG 61 24.089 -0.477 -28.794 492 2HH2 ARG 61 2HH1 ARG 61 23.112 -0.800 -30.313 493 H ASN 62 H ASN 62 18.744 -1.052 -21.753 494 HA ASN 62 HA ASN 62 16.883 -1.740 -20.665 495 1HB ASN 62 1HB ASN 62 15.757 -3.652 -21.715 496 2HB ASN 62 2HB ASN 62 16.453 -2.429 -22.747 497 1HD2 ASN 62 2HD2 ASN 62 17.782 -6.238 -23.233 498 2HD2 ASN 62 1HD2 ASN 62 16.942 -5.736 -21.673 499 HA PRO 63 HA PRO 63 17.142 -4.635 -17.250 500 1HB PRO 63 1HB PRO 63 17.850 -3.125 -15.048 501 2HB PRO 63 2HB PRO 63 19.055 -3.750 -16.185 502 1HG PRO 63 1HG PRO 63 17.922 -0.924 -16.032 503 2HG PRO 63 2HG PRO 63 19.593 -1.433 -16.327 504 1HD PRO 63 1HD PRO 63 17.694 -0.715 -18.347 505 2HD PRO 63 2HD PRO 63 19.195 -1.643 -18.638 506 H GLN 64 H GLN 64 16.109 -1.449 -16.095 507 HA GLN 64 HA GLN 64 13.332 -2.424 -15.528 508 1HB GLN 64 1HB GLN 64 13.044 0.230 -14.988 509 2HB GLN 64 2HB GLN 64 13.665 -0.936 -13.857 510 1HG GLN 64 1HG GLN 64 16.002 -0.206 -14.284 511 2HG GLN 64 2HG GLN 64 15.471 0.879 -15.555 512 1HE2 GLN 64 2HE2 GLN 64 14.454 3.445 -13.225 513 2HE2 GLN 64 1HE2 GLN 64 14.536 2.873 -14.967 514 H THR 65 H THR 65 14.798 -0.176 -17.918 515 HA THR 65 HA THR 65 12.057 0.643 -18.816 516 HB THR 65 HB THR 65 13.228 2.580 -19.767 517 HG1 THR 65 HG1 THR 65 15.135 1.508 -20.343 518 1HG2 THR 65 2HG2 THR 65 12.657 2.533 -17.241 519 2HG2 THR 65 3HG2 THR 65 14.319 2.040 -16.935 520 3HG2 THR 65 1HG2 THR 65 14.022 3.625 -17.658 521 H GLY 66 H GLY 66 14.451 -1.479 -20.322 522 1HA GLY 66 1HA GLY 66 14.272 -2.350 -22.619 523 2HA GLY 66 2HA GLY 66 12.828 -1.445 -22.827 524 H GLU 67 H GLU 67 15.780 0.347 -21.952 525 HA GLU 67 HA GLU 67 16.129 1.349 -24.818 526 1HB GLU 67 2HB GLU 67 14.723 2.729 -23.109 527 2HB GLU 67 1HB GLU 67 16.177 2.945 -22.144 528 1HG GLU 67 1HG GLU 67 17.262 4.125 -24.167 529 2HG GLU 67 2HG GLU 67 15.753 3.920 -25.051 530 HE1 GLU 67 HE2 GLU 67 17.258 5.252 -22.320 531 H GLU 68 H GLU 68 18.222 2.262 -25.252 532 HA GLU 68 HA GLU 68 20.479 0.960 -23.733 533 1HB GLU 68 1HB GLU 68 21.963 1.538 -25.552 534 2HB GLU 68 2HB GLU 68 20.562 0.637 -26.093 535 1HG GLU 68 1HG GLU 68 19.544 2.802 -27.004 536 2HG GLU 68 2HG GLU 68 21.012 3.659 -26.541 537 HE1 GLU 68 HE2 GLU 68 23.010 2.334 -29.049 538 H MET 69 H MET 69 21.522 2.050 -22.079 539 HA MET 69 HA MET 69 22.181 4.852 -22.175 540 1HB MET 69 1HB MET 69 20.684 5.965 -20.659 541 2HB MET 69 2HB MET 69 19.694 5.257 -21.895 542 1HG MET 69 1HG MET 69 20.017 4.107 -19.039 543 2HG MET 69 2HG MET 69 18.700 5.130 -19.603 544 1HE MET 69 2HE MET 69 20.310 1.504 -19.781 545 2HE MET 69 1HE MET 69 19.040 1.719 -18.534 546 3HE MET 69 3HE MET 69 18.773 0.623 -19.913 547 H GLU 70 H GLU 70 22.984 5.781 -20.165 548 HA GLU 70 HA GLU 70 24.548 3.947 -18.526 549 1HB GLU 70 2HB GLU 70 24.765 6.632 -19.390 550 2HB GLU 70 1HB GLU 70 24.238 6.875 -17.765 551 1HG GLU 70 1HG GLU 70 26.248 5.294 -17.099 552 2HG GLU 70 2HG GLU 70 26.661 5.220 -18.813 553 HE2 GLU 70 HE2 GLU 70 28.150 8.325 -18.937 554 H ILE 71 H ILE 71 23.737 2.922 -16.898 555 HA ILE 71 HA ILE 71 21.063 3.429 -15.773 556 HB ILE 71 HB ILE 71 23.072 1.155 -15.642 557 1HG1 ILE 71 1HG1 ILE 71 20.237 0.910 -16.738 558 2HG1 ILE 71 2HG1 ILE 71 21.346 1.845 -17.701 559 1HG2 ILE 71 3HG2 ILE 71 20.402 1.272 -14.242 560 2HG2 ILE 71 1HG2 ILE 71 21.375 -0.222 -14.547 561 3HG2 ILE 71 2HG2 ILE 71 22.026 1.081 -13.519 562 1HD1 ILE 71 3HD1 ILE 71 21.902 -1.048 -16.866 563 2HD1 ILE 71 1HD1 ILE 71 21.338 -0.503 -18.463 564 3HD1 ILE 71 2HD1 ILE 71 22.954 -0.033 -17.892 565 HA PRO 72 HA PRO 72 23.993 3.519 -11.519 566 1HB PRO 72 1HB PRO 72 24.535 6.382 -12.349 567 2HB PRO 72 2HB PRO 72 25.334 5.415 -11.073 568 1HG PRO 72 1HG PRO 72 26.422 5.339 -13.580 569 2HG PRO 72 2HG PRO 72 26.206 3.802 -12.694 570 1HD PRO 72 1HD PRO 72 24.571 4.875 -14.987 571 2HD PRO 72 2HD PRO 72 24.952 3.177 -14.533 572 H ALA 73 H ALA 73 22.637 3.230 -10.167 573 HA ALA 73 HA ALA 73 20.565 2.913 -9.309 574 1HB ALA 73 1HB ALA 73 21.986 3.990 -7.635 575 2HB ALA 73 2HB ALA 73 21.265 5.599 -8.063 576 3HB ALA 73 3HB ALA 73 20.259 4.306 -7.362 577 H SER 74 H SER 74 18.703 3.141 -8.920 578 HA SER 74 HA SER 74 17.373 5.600 -8.694 579 1HB SER 74 1HB SER 74 15.386 5.477 -10.358 580 2HB SER 74 2HB SER 74 16.937 5.748 -11.138 581 HG SER 74 HG SER 74 17.051 3.506 -11.551 582 H LYS 75 H LYS 75 16.009 5.417 -7.107 583 HA LYS 75 HA LYS 75 15.294 2.752 -6.020 584 1HB LYS 75 2HB LYS 75 14.078 5.037 -4.580 585 2HB LYS 75 1HB LYS 75 14.834 3.576 -4.043 586 1HG LYS 75 1HG LYS 75 17.120 4.546 -4.541 587 2HG LYS 75 2HG LYS 75 16.348 6.036 -5.086 588 1HD LYS 75 1HD LYS 75 15.346 6.350 -2.752 589 2HD LYS 75 2HD LYS 75 16.175 4.887 -2.241 590 1HE LYS 75 1HE LYS 75 17.532 6.707 -1.481 591 2HE LYS 75 2HE LYS 75 18.423 5.946 -2.795 592 1HZ LYS 75 1HZ LYS 75 17.591 7.716 -4.267 593 2HZ LYS 75 2HZ LYS 75 16.766 8.405 -3.036 594 H VAL 76 H VAL 76 13.343 1.551 -6.528 595 HA VAL 76 HA VAL 76 11.135 2.919 -7.768 596 HB VAL 76 HB VAL 76 12.874 0.444 -7.793 597 1HG1 VAL 76 3HG2 VAL 76 10.053 0.166 -8.528 598 2HG1 VAL 76 1HG2 VAL 76 11.467 -0.956 -8.904 599 3HG1 VAL 76 2HG2 VAL 76 10.989 -0.650 -7.220 600 1HG2 VAL 76 2HG1 VAL 76 13.177 2.244 -9.448 601 2HG2 VAL 76 3HG1 VAL 76 12.774 0.676 -10.171 602 3HG2 VAL 76 1HG1 VAL 76 11.512 1.952 -10.047 603 HA PRO 77 HA PRO 77 9.240 1.877 -3.679 604 1HB PRO 77 1HB PRO 77 6.820 3.236 -3.986 605 2HB PRO 77 2HB PRO 77 8.363 4.099 -3.933 606 1HG PRO 77 1HG PRO 77 6.743 3.304 -6.395 607 2HG PRO 77 2HG PRO 77 7.481 4.872 -6.039 608 1HD PRO 77 1HD PRO 77 8.704 2.772 -7.655 609 2HD PRO 77 2HD PRO 77 9.646 4.051 -6.851 610 H ALA 78 H ALA 78 8.218 0.514 -2.788 611 HA ALA 78 HA ALA 78 6.005 -1.133 -4.102 612 1HB ALA 78 2HB ALA 78 8.384 -2.044 -4.433 613 2HB ALA 78 3HB ALA 78 8.521 -2.222 -2.672 614 3HB ALA 78 1HB ALA 78 7.299 -3.157 -3.564 615 H PHE 79 H PHE 79 5.017 -2.521 -2.704 616 HA PHE 79 HA PHE 79 4.623 -1.820 0.287 617 1HB PHE 79 2HB PHE 79 3.201 -0.304 -0.379 618 2HB PHE 79 1HB PHE 79 2.546 -1.304 -1.712 619 HD1 PHE 79 HD1 PHE 79 2.502 -0.919 2.025 620 HD2 PHE 79 HD2 PHE 79 0.729 -2.901 -1.350 621 HE1 PHE 79 HE1 PHE 79 0.732 -1.826 3.475 622 HE2 PHE 79 HE2 PHE 79 -0.997 -3.845 0.117 623 HZ PHE 79 HZ PHE 79 -0.982 -3.344 2.528 624 H LYS 80 H LYS 80 4.584 -3.718 1.007 625 HA LYS 80 HA LYS 80 3.797 -6.461 -0.310 626 1HB LYS 80 2HB LYS 80 5.090 -5.827 2.359 627 2HB LYS 80 1HB LYS 80 4.502 -7.405 1.951 628 1HG LYS 80 1HG LYS 80 6.723 -5.910 0.417 629 2HG LYS 80 2HG LYS 80 7.002 -7.089 1.677 630 1HD LYS 80 1HD LYS 80 5.636 -7.684 -1.028 631 2HD LYS 80 2HD LYS 80 7.323 -7.980 -0.639 632 1HE LYS 80 1HE LYS 80 6.637 -9.623 1.181 633 2HE LYS 80 2HE LYS 80 4.936 -9.359 0.773 634 1HZ LYS 80 1HZ LYS 80 7.008 -10.448 -1.045 635 2HZ LYS 80 2HZ LYS 80 5.823 -11.300 -0.310 636 HA PRO 81 HA PRO 81 -0.061 -5.884 2.136 637 1HB PRO 81 1HB PRO 81 -1.370 -8.199 1.435 638 2HB PRO 81 2HB PRO 81 -1.038 -6.924 0.257 639 1HG PRO 81 1HG PRO 81 0.572 -9.494 0.730 640 2HG PRO 81 2HG PRO 81 -0.078 -8.893 -0.816 641 1HD PRO 81 1HD PRO 81 2.543 -8.412 0.052 642 2HD PRO 81 2HD PRO 81 1.666 -7.269 -1.015 643 H GLY 82 H GLY 82 2.311 -6.578 3.554 644 1HA GLY 82 1HA GLY 82 3.417 -7.983 5.160 645 2HA GLY 82 2HA GLY 82 1.891 -7.648 5.949 646 H LYS 83 H LYS 83 1.696 -9.738 3.265 647 HA LYS 83 HA LYS 83 1.104 -12.051 3.017 648 1HB LYS 83 2HB LYS 83 2.781 -12.304 5.505 649 2HB LYS 83 1HB LYS 83 1.498 -13.454 5.481 650 1HG LYS 83 1HG LYS 83 2.275 -14.241 3.164 651 2HG LYS 83 2HG LYS 83 3.566 -13.037 3.210 652 1HD LYS 83 1HD LYS 83 4.525 -14.163 5.293 653 2HD LYS 83 2HD LYS 83 3.222 -15.339 5.236 654 1HE LYS 83 1HE LYS 83 5.139 -16.425 4.284 655 2HE LYS 83 2HE LYS 83 4.033 -16.129 2.945 656 1HZ LYS 83 1HZ LYS 83 5.371 -14.200 2.339 657 2HZ LYS 83 2HZ LYS 83 6.272 -15.564 2.352 658 H ALA 84 H ALA 84 0.371 -10.797 6.021 659 HA ALA 84 HA ALA 84 -1.994 -12.164 6.958 660 1HB ALA 84 2HB ALA 84 -0.406 -10.725 8.261 661 2HB ALA 84 3HB ALA 84 -0.851 -9.302 7.283 662 3HB ALA 84 1HB ALA 84 -2.061 -10.037 8.368 663 H LEU 85 H LEU 85 -1.765 -8.998 5.091 664 HA LEU 85 HA LEU 85 -4.660 -8.737 4.796 665 1HB LEU 85 2HB LEU 85 -3.201 -6.721 4.624 666 2HB LEU 85 1HB LEU 85 -2.361 -7.429 3.258 667 HG LEU 85 HG LEU 85 -4.601 -7.629 2.150 668 1HD1 LEU 85 1HD1 LEU 85 -6.155 -7.172 4.020 669 2HD1 LEU 85 2HD1 LEU 85 -5.483 -5.538 4.209 670 3HD1 LEU 85 3HD1 LEU 85 -6.400 -5.972 2.739 671 1HD2 LEU 85 1HD2 LEU 85 -2.872 -5.946 1.416 672 2HD2 LEU 85 2HD2 LEU 85 -4.478 -5.209 1.265 673 3HD2 LEU 85 3HD2 LEU 85 -3.427 -4.788 2.643 674 H LYS 86 H LYS 86 -2.065 -10.236 2.870 675 HA LYS 86 HA LYS 86 -3.732 -11.050 0.617 676 1HB LYS 86 1HB LYS 86 -1.126 -11.086 0.756 677 2HB LYS 86 2HB LYS 86 -1.285 -12.675 1.486 678 1HG LYS 86 1HG LYS 86 -2.537 -13.466 -0.574 679 2HG LYS 86 2HG LYS 86 -2.422 -11.844 -1.263 680 1HD LYS 86 1HD LYS 86 0.103 -12.005 -1.216 681 2HD LYS 86 2HD LYS 86 0.006 -13.632 -0.560 682 1HE LYS 86 1HE LYS 86 -1.148 -12.764 -3.307 683 2HE LYS 86 2HE LYS 86 0.439 -13.493 -3.071 684 1HZ LYS 86 1HZ LYS 86 -2.148 -14.790 -2.428 685 2HZ LYS 86 2HZ LYS 86 -1.210 -15.110 -3.728 686 H ASP 87 H ASP 87 -3.629 -12.407 3.852 687 HA ASP 87 HA ASP 87 -5.241 -14.809 3.136 688 1HB ASP 87 1HB ASP 87 -3.485 -13.946 5.285 689 2HB ASP 87 2HB ASP 87 -5.042 -13.868 5.989 690 HD1 ASP 87 HD2 ASP 87 -6.275 -15.706 5.976 691 H ALA 88 H ALA 88 -5.789 -11.599 4.672 692 HA ALA 88 HA ALA 88 -8.600 -11.688 5.343 693 1HB ALA 88 1HB ALA 88 -7.019 -9.641 5.738 694 2HB ALA 88 2HB ALA 88 -7.083 -9.301 4.011 695 3HB ALA 88 3HB ALA 88 -8.550 -9.170 4.940 696 H VAL 89 H VAL 89 -7.027 -10.811 2.268 697 HA VAL 89 HA VAL 89 -9.494 -10.183 0.834 698 HB VAL 89 HB VAL 89 -7.081 -9.033 1.288 699 1HG1 VAL 89 2HG2 VAL 89 -5.865 -11.184 0.475 700 2HG1 VAL 89 3HG2 VAL 89 -6.236 -10.637 -1.172 701 3HG1 VAL 89 1HG2 VAL 89 -5.306 -9.596 -0.042 702 1HG2 VAL 89 2HG1 VAL 89 -8.666 -8.031 -0.034 703 2HG2 VAL 89 3HG1 VAL 89 -7.005 -7.869 -0.652 704 3HG2 VAL 89 1HG1 VAL 89 -8.147 -9.001 -1.482 705 H LYS 90 H LYS 90 -7.761 -13.127 1.117 706 HA LYS 90 HA LYS 90 -7.632 -14.106 -1.564 707 1HB LYS 90 1HB LYS 90 -6.634 -14.888 0.849 708 2HB LYS 90 2HB LYS 90 -8.002 -15.957 0.872 709 1HG LYS 90 1HG LYS 90 -7.164 -17.143 -1.137 710 2HG LYS 90 2HG LYS 90 -6.033 -15.845 -1.493 711 1HD LYS 90 1HD LYS 90 -4.695 -17.553 -0.591 712 2HD LYS 90 2HD LYS 90 -4.746 -16.326 0.647 713 1HE LYS 90 1HE LYS 90 -6.530 -18.870 0.687 714 2HE LYS 90 2HE LYS 90 -4.914 -18.807 1.384 715 1HZ LYS 90 1HZ LYS 90 -5.624 -17.085 2.888 716 2HZ LYS 90 2HZ LYS 90 -6.545 -18.426 3.056 717 1H MET 1 1H MET 91 10.885 1.640 9.573 718 2H MET 1 2H MET 91 11.607 0.455 10.523 719 HA MET 1 HA MET 91 10.157 1.346 11.933 720 1HB MET 1 1HB MET 91 8.133 1.612 9.624 721 2HB MET 1 2HB MET 91 7.779 1.985 11.286 722 1HG MET 1 1HG MET 91 9.863 3.623 11.200 723 2HG MET 1 2HG MET 91 9.745 3.465 9.447 724 1HE MET 1 3HE MET 91 8.096 4.873 7.987 725 2HE MET 1 2HE MET 91 6.840 3.679 8.472 726 3HE MET 1 1HE MET 91 6.488 5.402 8.546 727 H ASN 2 H ASN 92 7.283 -0.118 11.316 728 HA ASN 2 HA ASN 92 7.448 -2.728 11.588 729 1HB ASN 2 1HB ASN 92 7.621 -3.712 13.721 730 2HB ASN 2 2HB ASN 92 9.055 -2.802 13.404 731 1HD2 ASN 2 1HD2 ASN 92 6.904 -1.844 16.709 732 2HD2 ASN 2 2HD2 ASN 92 6.257 -2.932 15.378 733 H LYS 3 H LYS 93 6.018 -0.115 13.209 734 HA LYS 3 HA LYS 93 3.476 0.215 12.670 735 1HB LYS 3 1HB LYS 93 2.929 -2.306 12.761 736 2HB LYS 3 2HB LYS 93 3.078 -2.243 14.502 737 1HG LYS 3 1HG LYS 93 1.139 -0.556 14.523 738 2HG LYS 3 2HG LYS 93 1.151 -0.535 12.758 739 1HD LYS 3 1HD LYS 93 0.577 -3.025 12.770 740 2HD LYS 3 2HD LYS 93 0.468 -2.958 14.534 741 1HE LYS 3 1HE LYS 93 -1.388 -1.211 14.330 742 2HE LYS 3 2HE LYS 93 -1.274 -1.318 12.566 743 1HZ LYS 3 1HZ LYS 93 -1.933 -3.585 14.362 744 2HZ LYS 3 2HZ LYS 93 -1.829 -3.676 12.734 745 H THR 4 H THR 94 5.708 -0.310 15.537 746 HA THR 4 HA THR 94 4.161 1.548 17.136 747 HB THR 4 HB THR 94 6.753 -0.115 17.440 748 HG1 THR 4 HG1 THR 94 4.144 -0.424 18.553 749 1HG2 THR 4 3HG2 THR 94 5.126 1.579 19.357 750 2HG2 THR 4 1HG2 THR 94 6.425 0.390 19.839 751 3HG2 THR 4 2HG2 THR 94 6.826 1.826 18.816 752 H GLU 5 H GLU 95 7.045 1.430 15.073 753 HA GLU 5 HA GLU 95 8.055 4.150 15.818 754 1HB GLU 5 1HB GLU 95 8.570 2.678 13.196 755 2HB GLU 5 2HB GLU 95 9.436 4.084 13.773 756 1HG GLU 5 1HG GLU 95 9.533 1.233 14.910 757 2HG GLU 5 2HG GLU 95 10.765 2.009 13.952 758 HE1 GLU 5 HE2 GLU 95 12.146 3.888 16.522 759 H LEU 6 H LEU 96 5.389 2.901 14.123 760 HA LEU 6 HA LEU 96 4.697 5.035 12.226 761 1HB LEU 6 2HB LEU 96 4.058 2.217 12.855 762 2HB LEU 6 1HB LEU 96 2.622 3.089 13.330 763 HG LEU 6 HG LEU 96 2.623 4.013 11.039 764 1HD1 LEU 6 2HD1 LEU 96 4.989 3.965 10.324 765 2HD1 LEU 6 3HD1 LEU 96 4.993 2.189 10.356 766 3HD1 LEU 6 1HD1 LEU 96 4.011 3.077 9.153 767 1HD2 LEU 6 2HD2 LEU 96 1.373 1.918 11.639 768 2HD2 LEU 6 3HD2 LEU 96 1.649 2.172 9.909 769 3HD2 LEU 6 1HD2 LEU 96 2.637 0.987 10.805 770 H ILE 7 H ILE 97 3.690 3.845 15.484 771 HA ILE 7 HA ILE 97 1.735 5.883 16.107 772 HB ILE 7 HB ILE 97 3.497 4.354 18.131 773 1HG1 ILE 7 1HG1 ILE 97 0.749 3.473 17.113 774 2HG1 ILE 7 2HG1 ILE 97 2.200 2.880 16.412 775 1HG2 ILE 7 2HG2 ILE 97 2.176 6.251 19.194 776 2HG2 ILE 7 3HG2 ILE 97 0.693 5.535 18.553 777 3HG2 ILE 7 1HG2 ILE 97 1.637 4.668 19.771 778 1HD1 ILE 7 3HD1 ILE 97 2.938 2.016 18.733 779 2HD1 ILE 7 1HD1 ILE 97 1.254 2.229 19.204 780 3HD1 ILE 7 2HD1 ILE 97 1.657 1.163 17.833 781 H ASN 8 H ASN 98 5.193 5.711 16.963 782 HA ASN 8 HA ASN 98 5.248 8.421 18.149 783 1HB ASN 8 1HB ASN 98 7.647 6.784 17.022 784 2HB ASN 8 2HB ASN 98 7.805 8.239 17.977 785 1HD2 ASN 8 2HD2 ASN 98 7.424 4.754 19.994 786 2HD2 ASN 8 1HD2 ASN 98 7.497 4.848 18.163 787 H ALA 9 H ALA 99 5.286 7.508 14.807 788 HA ALA 9 HA ALA 99 6.462 10.073 13.771 789 1HB ALA 9 2HB ALA 99 6.162 7.903 12.252 790 2HB ALA 9 3HB ALA 99 4.414 8.121 12.399 791 3HB ALA 9 1HB ALA 99 5.322 9.359 11.589 792 H VAL 10 H VAL 100 3.189 8.721 14.385 793 HA VAL 10 HA VAL 100 1.834 10.957 13.294 794 HB VAL 10 HB VAL 100 0.263 9.208 15.112 795 1HG1 VAL 10 3HG2 VAL 100 -0.562 11.065 13.501 796 2HG1 VAL 10 1HG2 VAL 100 -0.222 9.878 12.215 797 3HG1 VAL 10 2HG2 VAL 100 -1.397 9.468 13.496 798 1HG2 VAL 10 1HG1 VAL 100 1.727 8.218 12.629 799 2HG2 VAL 10 2HG1 VAL 100 1.627 7.568 14.296 800 3HG2 VAL 10 3HG1 VAL 100 0.200 7.438 13.213 801 H ALA 11 H ALA 101 2.285 9.855 16.404 802 HA ALA 11 HA ALA 101 1.154 12.179 17.549 803 1HB ALA 11 2HB ALA 101 1.293 10.022 18.843 804 2HB ALA 11 3HB ALA 101 3.069 10.160 18.915 805 3HB ALA 11 1HB ALA 101 2.033 11.315 19.816 806 H GLU 12 H GLU 102 4.394 11.744 16.368 807 HA GLU 12 HA GLU 102 5.410 14.225 17.716 808 1HB GLU 12 1HB GLU 102 6.982 12.340 17.185 809 2HB GLU 12 2HB GLU 102 6.681 12.556 15.461 810 1HG GLU 12 1HG GLU 102 7.687 14.906 15.628 811 2HG GLU 12 2HG GLU 102 7.966 14.647 17.348 812 HE1 GLU 12 HE2 GLU 102 10.258 12.859 14.517 813 H THR 13 H THR 103 4.395 13.315 14.348 814 HA THR 13 HA THR 103 4.523 16.113 13.478 815 HB THR 13 HB THR 103 3.297 15.344 11.372 816 HG1 THR 13 HG1 THR 103 1.936 13.988 12.540 817 1HG2 THR 13 3HG2 THR 103 5.413 13.239 12.079 818 2HG2 THR 13 1HG2 THR 103 4.707 13.557 10.485 819 3HG2 THR 13 2HG2 THR 103 5.712 14.803 11.267 820 H SER 14 H SER 104 2.255 14.864 15.210 821 HA SER 14 HA SER 104 0.148 16.987 14.407 822 1HB SER 14 1HB SER 104 -0.474 14.670 13.520 823 2HB SER 14 2HB SER 104 -0.640 14.115 15.184 824 HG SER 14 HG SER 104 -2.579 14.819 14.253 825 H GLY 15 H GLY 105 1.508 15.240 17.203 826 1HA GLY 15 1HA GLY 105 1.178 15.570 19.528 827 2HA GLY 15 2HA GLY 105 0.564 17.181 19.159 828 H LEU 16 H LEU 106 -0.560 13.908 18.532 829 HA LEU 16 HA LEU 106 -3.242 14.293 19.870 830 1HB LEU 16 1HB LEU 106 -4.010 12.364 18.676 831 2HB LEU 16 2HB LEU 106 -3.681 13.799 17.728 832 HG LEU 16 HG LEU 106 -1.736 12.995 16.845 833 1HD1 LEU 16 2HD1 LEU 106 -0.757 11.787 18.846 834 2HD1 LEU 16 3HD1 LEU 106 -1.909 10.468 18.463 835 3HD1 LEU 16 1HD1 LEU 106 -0.575 10.934 17.314 836 1HD2 LEU 16 1HD2 LEU 106 -3.192 12.427 15.357 837 2HD2 LEU 16 2HD2 LEU 106 -1.693 11.468 15.386 838 3HD2 LEU 16 3HD2 LEU 106 -3.166 10.746 15.995 839 H SER 17 H SER 107 -2.621 11.400 20.025 840 HA SER 17 HA SER 107 -1.131 11.252 22.698 841 1HB SER 17 1HB SER 107 -3.719 9.675 22.333 842 2HB SER 17 2HB SER 107 -2.647 9.669 23.713 843 HG SER 17 HG SER 107 -4.046 11.930 22.741 844 H LYS 18 H LYS 108 -0.302 9.134 23.165 845 HA LYS 18 HA LYS 108 0.784 7.661 20.762 846 1HB LYS 18 1HB LYS 108 1.068 6.896 23.725 847 2HB LYS 18 2HB LYS 108 1.813 6.044 22.386 848 1HG LYS 18 1HG LYS 108 2.407 8.955 23.192 849 2HG LYS 18 2HG LYS 108 3.395 7.557 23.581 850 1HD LYS 18 1HD LYS 108 3.873 7.149 21.157 851 2HD LYS 18 2HD LYS 108 2.852 8.492 20.681 852 1HE LYS 18 1HE LYS 108 5.420 8.757 22.383 853 2HE LYS 18 2HE LYS 108 5.309 9.021 20.644 854 1HZ LYS 18 1HZ LYS 108 5.213 11.076 21.866 855 2HZ LYS 18 2HZ LYS 108 3.884 10.608 22.695 856 H LYS 19 H LYS 109 -1.630 6.998 23.269 857 HA LYS 19 HA LYS 109 -2.713 4.538 22.061 858 1HB LYS 19 2HB LYS 109 -3.140 5.300 24.436 859 2HB LYS 19 1HB LYS 109 -4.174 6.605 23.839 860 1HG LYS 19 1HG LYS 109 -5.731 4.875 22.838 861 2HG LYS 19 2HG LYS 109 -4.662 3.583 23.391 862 1HD LYS 19 1HD LYS 109 -5.027 4.317 25.791 863 2HD LYS 19 2HD LYS 109 -6.094 5.611 25.232 864 1HE LYS 19 1HE LYS 109 -7.672 3.885 24.235 865 2HE LYS 19 2HE LYS 109 -6.602 2.586 24.782 866 1HZ LYS 19 1HZ LYS 109 -8.425 2.993 26.303 867 2HZ LYS 19 2HZ LYS 109 -7.979 4.550 26.530 868 H ASP 20 H ASP 110 -3.435 8.055 21.391 869 HA ASP 20 HA ASP 110 -5.634 7.343 19.458 870 1HB ASP 20 1HB ASP 110 -4.202 9.996 20.070 871 2HB ASP 20 2HB ASP 110 -5.220 9.860 18.663 872 HD1 ASP 20 HD2 ASP 110 -7.284 9.223 18.873 873 H ALA 21 H ALA 111 -2.165 7.788 19.157 874 HA ALA 21 HA ALA 111 -2.135 7.836 16.176 875 1HB ALA 21 1HB ALA 111 0.071 7.621 18.311 876 2HB ALA 21 2HB ALA 111 0.382 7.539 16.550 877 3HB ALA 21 3HB ALA 111 -0.341 8.949 17.258 878 H THR 22 H THR 112 -1.683 5.251 18.666 879 HA THR 22 HA THR 112 -1.200 3.044 16.861 880 HB THR 22 HB THR 112 -2.783 2.827 19.511 881 HG1 THR 22 HG1 THR 112 0.004 3.133 19.235 882 1HG2 THR 22 2HG2 THR 112 -0.641 1.100 18.136 883 2HG2 THR 22 3HG2 THR 112 -1.333 0.772 19.751 884 3HG2 THR 22 1HG2 THR 112 -2.374 0.711 18.284 885 H LYS 23 H LYS 113 -4.193 4.242 18.199 886 HA LYS 23 HA LYS 113 -6.100 2.544 16.760 887 1HB LYS 23 2HB LYS 113 -6.148 5.503 17.788 888 2HB LYS 23 1HB LYS 113 -7.566 4.820 17.090 889 1HG LYS 23 1HG LYS 113 -7.745 3.041 18.841 890 2HG LYS 23 2HG LYS 113 -6.260 3.605 19.607 891 1HD LYS 23 1HD LYS 113 -7.309 5.842 20.072 892 2HD LYS 23 2HD LYS 113 -8.790 5.344 19.249 893 1HE LYS 23 1HE LYS 113 -9.156 3.518 20.958 894 2HE LYS 23 2HE LYS 113 -7.649 3.960 21.772 895 1HZ LYS 23 1HZ LYS 113 -8.587 6.173 22.161 896 2HZ LYS 23 2HZ LYS 113 -9.979 5.764 21.408 897 H ALA 24 H ALA 114 -4.948 5.745 16.018 898 HA ALA 24 HA ALA 114 -6.376 6.248 13.612 899 1HB ALA 24 3HB ALA 114 -3.759 7.390 14.617 900 2HB ALA 24 1HB ALA 114 -4.725 8.071 13.264 901 3HB ALA 24 2HB ALA 114 -5.438 7.975 14.896 902 H VAL 25 H VAL 115 -3.168 4.735 13.905 903 HA VAL 25 HA VAL 115 -2.730 4.127 10.986 904 HB VAL 25 HB VAL 115 -1.879 3.184 13.899 905 1HG1 VAL 25 2HG2 VAL 115 -0.994 1.596 11.424 906 2HG1 VAL 25 3HG2 VAL 115 -0.340 1.443 13.096 907 3HG1 VAL 25 1HG2 VAL 115 -2.001 1.009 12.756 908 1HG2 VAL 25 1HG1 VAL 115 -0.777 5.181 12.951 909 2HG2 VAL 25 2HG1 VAL 115 0.356 3.873 13.306 910 3HG2 VAL 25 3HG1 VAL 115 -0.120 4.203 11.606 911 H ASP 26 H ASP 116 -4.050 2.051 13.680 912 HA ASP 26 HA ASP 116 -5.432 0.265 11.688 913 1HB ASP 26 1HB ASP 116 -4.486 -0.334 14.054 914 2HB ASP 26 2HB ASP 116 -5.928 0.432 14.717 915 HD2 ASP 26 HD2 ASP 116 -7.864 -2.376 14.249 916 H ALA 27 H ALA 117 -6.080 3.028 11.965 917 HA ALA 27 HA ALA 117 -9.110 3.035 11.621 918 1HB ALA 27 2HB ALA 117 -8.205 4.719 13.297 919 2HB ALA 27 3HB ALA 117 -7.350 5.463 11.932 920 3HB ALA 27 1HB ALA 117 -9.085 5.338 11.890 921 H VAL 28 H VAL 118 -6.143 4.236 10.150 922 HA VAL 28 HA VAL 118 -7.223 4.737 7.442 923 HB VAL 28 HB VAL 118 -4.270 3.881 8.032 924 1HG1 VAL 28 1HG2 VAL 118 -5.769 4.935 5.669 925 2HG1 VAL 28 2HG2 VAL 118 -4.197 5.682 5.949 926 3HG1 VAL 28 3HG2 VAL 118 -4.280 3.915 5.821 927 1HG2 VAL 28 2HG1 VAL 118 -5.392 6.628 8.314 928 2HG2 VAL 28 3HG1 VAL 118 -4.342 5.609 9.392 929 3HG2 VAL 28 1HG1 VAL 118 -3.656 6.258 7.908 930 H PHE 29 H PHE 119 -5.103 2.280 8.664 931 HA PHE 29 HA PHE 119 -5.363 0.330 6.493 932 1HB PHE 29 2HB PHE 119 -4.078 -0.086 9.233 933 2HB PHE 29 1HB PHE 119 -3.816 -1.101 7.827 934 HD1 PHE 29 HD1 PHE 119 -3.209 0.428 5.547 935 HD2 PHE 29 HD2 PHE 119 -2.273 1.435 9.610 936 HE1 PHE 29 HE1 PHE 119 -1.605 2.104 4.757 937 HE2 PHE 29 HE2 PHE 119 -0.709 3.148 8.820 938 HZ PHE 29 HZ PHE 119 -0.411 3.506 6.377 939 H ASP 30 H ASP 120 -7.441 0.689 9.245 940 HA ASP 30 HA ASP 120 -8.463 -2.124 8.931 941 1HB ASP 30 1HB ASP 120 -8.498 -0.609 11.097 942 2HB ASP 30 2HB ASP 120 -9.923 0.145 10.438 943 HD2 ASP 30 HD2 ASP 120 -10.055 -3.510 12.105 944 H SER 31 H SER 121 -9.345 1.047 7.956 945 HA SER 31 HA SER 121 -11.912 0.306 6.539 946 1HB SER 31 2HB SER 121 -10.265 2.897 6.296 947 2HB SER 31 1HB SER 121 -11.868 2.613 5.583 948 HG SER 31 HG SER 121 -12.647 2.226 7.694 949 H ILE 32 H ILE 122 -8.420 0.733 5.402 950 HA ILE 32 HA ILE 122 -8.833 0.275 2.709 951 HB ILE 32 HB ILE 122 -6.342 -0.625 4.207 952 1HG1 ILE 32 1HG1 ILE 122 -7.530 2.111 3.840 953 2HG1 ILE 32 2HG1 ILE 122 -6.762 1.263 5.169 954 1HG2 ILE 32 2HG2 ILE 122 -6.779 -1.012 1.615 955 2HG2 ILE 32 3HG2 ILE 122 -6.747 0.735 1.493 956 3HG2 ILE 32 1HG2 ILE 122 -5.285 -0.129 1.998 957 1HD1 ILE 32 2HD1 ILE 122 -5.065 2.223 2.902 958 2HD1 ILE 32 3HD1 ILE 122 -5.643 3.267 4.231 959 3HD1 ILE 32 1HD1 ILE 122 -4.651 1.830 4.628 960 H THR 33 H THR 123 -7.926 -2.051 5.246 961 HA THR 33 HA THR 123 -8.010 -4.487 3.560 962 HB THR 33 HB THR 123 -6.919 -4.597 5.574 963 HG1 THR 33 HG1 THR 123 -7.761 -6.517 6.408 964 1HG2 THR 33 2HG2 THR 123 -8.433 -3.078 6.965 965 2HG2 THR 33 3HG2 THR 123 -9.542 -4.415 7.198 966 3HG2 THR 33 1HG2 THR 123 -7.860 -4.493 7.854 967 H GLU 34 H GLU 124 -10.582 -2.719 5.084 968 HA GLU 34 HA GLU 124 -12.717 -4.719 4.329 969 1HB GLU 34 1HB GLU 124 -12.912 -1.807 5.385 970 2HB GLU 34 2HB GLU 124 -14.319 -2.757 4.939 971 1HG GLU 34 1HG GLU 124 -13.878 -4.435 6.714 972 2HG GLU 34 2HG GLU 124 -12.358 -3.663 7.140 973 HE2 GLU 34 HE2 GLU 124 -15.877 -2.185 8.415 974 H ALA 35 H ALA 125 -11.075 -1.930 2.872 975 HA ALA 35 HA ALA 125 -13.020 -1.702 0.665 976 1HB ALA 35 2HB ALA 125 -11.344 0.316 1.098 977 2HB ALA 35 3HB ALA 125 -10.039 -0.762 0.592 978 3HB ALA 35 1HB ALA 125 -11.249 -0.272 -0.566 979 H LEU 36 H LEU 126 -9.580 -3.090 0.776 980 HA LEU 36 HA LEU 126 -9.788 -4.432 -1.811 981 1HB LEU 36 2HB LEU 126 -8.175 -5.020 0.624 982 2HB LEU 36 1HB LEU 126 -7.819 -5.620 -0.956 983 HG LEU 36 HG LEU 126 -7.580 -3.271 -0.005 984 1HD1 LEU 36 3HD2 LEU 126 -8.774 -2.772 -2.659 985 2HD1 LEU 36 1HD2 LEU 126 -8.752 -1.763 -1.189 986 3HD1 LEU 36 2HD2 LEU 126 -7.451 -1.656 -2.346 987 1HD2 LEU 36 3HD1 LEU 126 -5.617 -3.233 0.264 988 2HD2 LEU 36 1HD1 LEU 126 -5.490 -2.664 -1.422 989 3HD2 LEU 36 2HD1 LEU 126 -6.378 -1.679 -0.290 990 NH1 ARG 37 NH2 ARG 127 -13.014 -9.639 7.400 991 NH2 ARG 37 NH1 ARG 127 -13.770 -11.684 6.756 992 H ARG 37 H ARG 127 -10.534 -5.651 1.518 993 HA ARG 37 HA ARG 127 -10.976 -8.268 0.593 994 1HB ARG 37 1HB ARG 127 -10.700 -7.753 2.996 995 2HB ARG 37 2HB ARG 127 -12.225 -6.853 3.015 996 1HG ARG 37 1HG ARG 127 -13.436 -9.098 2.574 997 2HG ARG 37 2HG ARG 127 -11.870 -9.891 2.752 998 1HD ARG 37 1HD ARG 127 -11.680 -8.674 5.062 999 2HD ARG 37 2HD ARG 127 -13.342 -8.113 4.815 1000 1HH1 ARG 37 2HH2 ARG 127 -12.654 -8.721 7.116 1001 2HH1 ARG 37 1HH2 ARG 127 -13.173 -9.967 8.359 1002 1HH2 ARG 37 1HH1 ARG 127 -13.985 -12.326 5.986 1003 2HH2 ARG 37 2HH1 ARG 127 -13.876 -11.869 7.759 1004 H LYS 38 H LYS 128 -13.095 -5.418 0.406 1005 HA LYS 38 HA LYS 128 -15.565 -7.121 -0.170 1006 1HB LYS 38 1HB LYS 128 -15.381 -4.145 0.555 1007 2HB LYS 38 2HB LYS 128 -16.856 -4.939 0.061 1008 1HG LYS 38 1HG LYS 128 -16.909 -6.418 2.000 1009 2HG LYS 38 2HG LYS 128 -15.305 -5.925 2.513 1010 1HD LYS 38 1HD LYS 128 -16.933 -4.849 3.927 1011 2HD LYS 38 2HD LYS 128 -16.063 -3.625 3.017 1012 1HE LYS 38 1HE LYS 128 -18.015 -3.350 1.445 1013 2HE LYS 38 2HE LYS 128 -18.890 -4.646 2.276 1014 1HZ LYS 38 1HZ LYS 128 -18.859 -3.314 4.288 1015 2HZ LYS 38 2HZ LYS 128 -19.587 -2.513 3.063 1016 H GLY 39 H GLY 129 -13.143 -6.106 -2.045 1017 1HA GLY 39 1HA GLY 129 -12.967 -5.621 -4.397 1018 2HA GLY 39 2HA GLY 129 -14.694 -5.861 -4.558 1019 H ASP 40 H ASP 130 -12.943 -3.523 -2.573 1020 HA ASP 40 HA ASP 130 -14.061 -1.148 -4.141 1021 1HB ASP 40 1HB ASP 130 -13.785 -1.351 -1.162 1022 2HB ASP 40 2HB ASP 130 -14.200 0.107 -2.019 1023 HD1 ASP 40 HD2 ASP 130 -17.459 -0.808 -2.757 1024 H LYS 41 H LYS 131 -12.978 0.511 -4.626 1025 HA LYS 41 HA LYS 131 -9.970 0.464 -4.414 1026 1HB LYS 41 2HB LYS 131 -11.694 2.696 -5.615 1027 2HB LYS 41 1HB LYS 131 -9.947 2.525 -5.757 1028 1HG LYS 41 1HG LYS 131 -10.294 0.400 -7.128 1029 2HG LYS 41 2HG LYS 131 -12.028 0.632 -7.005 1030 1HD LYS 41 1HD LYS 131 -11.380 1.468 -9.147 1031 2HD LYS 41 2HD LYS 131 -11.836 2.867 -8.182 1032 1HE LYS 41 1HE LYS 131 -9.397 3.417 -7.796 1033 2HE LYS 41 2HE LYS 131 -8.912 1.964 -8.663 1034 1HZ LYS 41 1HZ LYS 131 -10.453 4.213 -9.832 1035 2HZ LYS 41 2HZ LYS 131 -10.026 2.858 -10.640 1036 H VAL 42 H VAL 132 -8.851 1.702 -2.876 1037 HA VAL 42 HA VAL 132 -10.097 3.415 -0.950 1038 HB VAL 42 HB VAL 132 -7.238 2.594 -1.623 1039 1HG1 VAL 42 3HG2 VAL 132 -7.480 4.258 0.248 1040 2HG1 VAL 42 1HG2 VAL 132 -8.551 3.096 1.083 1041 3HG1 VAL 42 2HG2 VAL 132 -6.836 2.681 0.759 1042 1HG2 VAL 42 3HG1 VAL 132 -8.983 0.522 -1.234 1043 2HG2 VAL 42 1HG1 VAL 132 -7.468 0.546 -0.373 1044 3HG2 VAL 42 2HG1 VAL 132 -8.956 1.063 0.449 1045 H GLN 43 H GLN 133 -7.577 4.877 -1.242 1046 HA GLN 43 HA GLN 133 -6.639 6.107 -2.934 1047 1HB GLN 43 1HB GLN 133 -9.111 7.441 -3.784 1048 2HB GLN 43 2HB GLN 133 -7.563 8.266 -4.019 1049 1HG GLN 43 1HG GLN 133 -6.620 6.302 -5.159 1050 2HG GLN 43 2HG GLN 133 -8.066 5.379 -4.938 1051 1HE2 GLN 43 2HE2 GLN 133 -9.077 6.479 -8.199 1052 2HE2 GLN 43 1HE2 GLN 133 -8.630 5.118 -7.059 1053 H LEU 44 H LEU 134 -5.210 7.652 -2.929 1054 HA LEU 44 HA LEU 134 -5.101 9.441 -0.477 1055 1HB LEU 44 2HB LEU 134 -2.525 8.008 -1.197 1056 2HB LEU 44 1HB LEU 134 -2.960 8.766 0.309 1057 HG LEU 44 HG LEU 134 -4.080 6.051 -0.672 1058 1HD1 LEU 44 1HD1 LEU 134 -1.574 5.995 -0.462 1059 2HD1 LEU 44 2HD1 LEU 134 -1.705 6.506 1.241 1060 3HD1 LEU 44 3HD1 LEU 134 -2.365 4.946 0.715 1061 1HD2 LEU 44 2HD2 LEU 134 -5.439 7.092 1.201 1062 2HD2 LEU 44 3HD2 LEU 134 -4.628 5.603 1.708 1063 3HD2 LEU 44 1HD2 LEU 134 -3.957 7.182 2.186 1064 H ILE 45 H ILE 135 -5.009 11.380 -1.631 1065 HA ILE 45 HA ILE 135 -3.971 11.436 -4.381 1066 HB ILE 45 HB ILE 135 -6.000 12.690 -3.674 1067 1HG1 ILE 45 1HG1 ILE 135 -5.595 14.748 -5.063 1068 2HG1 ILE 45 2HG1 ILE 135 -3.885 14.365 -5.149 1069 1HG2 ILE 45 3HG2 ILE 135 -5.153 13.688 -1.568 1070 2HG2 ILE 45 1HG2 ILE 135 -4.038 14.732 -2.485 1071 3HG2 ILE 45 2HG2 ILE 135 -5.810 14.928 -2.663 1072 1HD1 ILE 45 2HD1 ILE 135 -6.176 12.573 -6.231 1073 2HD1 ILE 45 3HD1 ILE 135 -5.161 13.663 -7.204 1074 3HD1 ILE 45 1HD1 ILE 135 -4.433 12.242 -6.429 1075 H GLY 46 H GLY 136 -2.314 12.630 -5.183 1076 1HA GLY 46 1HA GLY 136 0.035 13.070 -5.381 1077 2HA GLY 46 2HA GLY 136 -0.123 13.879 -3.841 1078 H PHE 47 H PHE 137 -0.714 10.507 -3.493 1079 HA PHE 47 HA PHE 137 2.144 9.696 -3.088 1080 1HB PHE 47 2HB PHE 137 1.053 10.798 -1.112 1081 2HB PHE 47 1HB PHE 137 -0.255 9.658 -1.102 1082 HD1 PHE 47 HD2 PHE 137 3.576 9.506 -1.057 1083 HD2 PHE 47 HD1 PHE 137 -0.120 7.724 0.196 1084 HE1 PHE 47 HE2 PHE 137 4.790 7.542 -0.162 1085 HE2 PHE 47 HE1 PHE 137 1.119 5.772 1.048 1086 HZ PHE 47 HZ PHE 137 3.598 5.721 0.857 1087 H GLY 48 H GLY 138 -1.273 8.381 -3.305 1088 1HA GLY 48 1HA GLY 138 -0.254 5.820 -4.244 1089 2HA GLY 48 2HA GLY 138 -0.618 5.692 -2.548 1090 H ASN 49 H ASN 139 -1.784 4.545 -5.105 1091 HA ASN 49 HA ASN 139 -4.743 4.986 -4.342 1092 1HB ASN 49 1HB ASN 139 -3.675 4.579 -7.195 1093 2HB ASN 49 2HB ASN 139 -5.360 4.626 -6.724 1094 1HD2 ASN 49 1HD2 ASN 139 -4.648 7.951 -8.152 1095 2HD2 ASN 49 2HD2 ASN 139 -4.663 6.196 -8.684 1096 H PHE 50 H PHE 140 -5.150 3.156 -3.204 1097 HA PHE 50 HA PHE 140 -3.917 0.507 -4.004 1098 1HB PHE 50 2HB PHE 140 -5.942 0.996 -1.785 1099 2HB PHE 50 1HB PHE 140 -5.329 -0.554 -2.143 1100 HD1 PHE 50 HD2 PHE 140 -4.704 2.732 -0.733 1101 HD2 PHE 50 HD1 PHE 140 -3.522 -1.372 -0.883 1102 HE1 PHE 50 HE2 PHE 140 -3.268 3.063 1.282 1103 HE2 PHE 50 HE1 PHE 140 -2.086 -1.021 1.107 1104 HZ PHE 50 HZ PHE 140 -1.884 1.237 2.068 1105 H GLU 51 H GLU 141 -5.047 -1.167 -4.713 1106 HA GLU 51 HA GLU 141 -7.826 -1.453 -4.460 1107 1HB GLU 51 1HB GLU 141 -8.713 -1.385 -6.833 1108 2HB GLU 51 2HB GLU 141 -8.019 0.174 -6.464 1109 1HG GLU 51 1HG GLU 141 -5.905 -0.441 -7.728 1110 2HG GLU 51 2HG GLU 141 -6.580 -2.021 -8.101 1111 HE2 GLU 51 HE2 GLU 141 -7.294 0.987 -10.484 1112 H VAL 52 H VAL 142 -8.824 -3.462 -5.506 1113 HA VAL 52 HA VAL 142 -6.760 -5.549 -5.239 1114 HB VAL 52 HB VAL 142 -9.226 -4.882 -3.977 1115 1HG1 VAL 52 1HG2 VAL 142 -9.887 -7.063 -5.973 1116 2HG1 VAL 52 2HG2 VAL 142 -10.825 -6.604 -4.505 1117 3HG1 VAL 52 3HG2 VAL 142 -10.590 -5.438 -5.847 1118 1HG2 VAL 52 2HG1 VAL 142 -7.438 -6.141 -3.011 1119 2HG2 VAL 52 3HG1 VAL 142 -9.000 -6.920 -2.791 1120 3HG2 VAL 52 1HG1 VAL 142 -7.866 -7.582 -3.979 1121 NH1 ARG 53 NH2 ARG 143 -7.955 -9.644 -13.210 1122 NH2 ARG 53 NH1 ARG 143 -6.347 -10.272 -14.686 1123 H ARG 53 H ARG 143 -6.894 -7.481 -6.525 1124 HA ARG 53 HA ARG 143 -7.840 -6.999 -9.426 1125 1HB ARG 53 1HB ARG 143 -5.324 -6.843 -9.097 1126 2HB ARG 53 2HB ARG 143 -5.295 -8.521 -8.630 1127 1HG ARG 53 1HG ARG 143 -6.418 -7.565 -11.333 1128 2HG ARG 53 2HG ARG 143 -4.711 -7.892 -11.060 1129 1HD ARG 53 1HD ARG 143 -5.209 -10.285 -10.481 1130 2HD ARG 53 2HD ARG 143 -6.923 -10.034 -10.746 1131 1HH1 ARG 53 2HH2 ARG 143 -8.195 -9.408 -12.241 1132 2HH1 ARG 53 1HH2 ARG 143 -8.593 -9.668 -14.013 1133 1HH2 ARG 53 1HH1 ARG 143 -5.362 -10.511 -14.848 1134 2HH2 ARG 53 2HH1 ARG 143 -7.097 -10.249 -15.385 1135 H GLU 54 H GLU 144 -9.725 -8.037 -9.217 1136 HA GLU 54 HA GLU 144 -9.923 -10.798 -7.997 1137 1HB GLU 54 1HB GLU 144 -12.284 -10.773 -8.379 1138 2HB GLU 54 2HB GLU 144 -11.725 -9.418 -7.423 1139 1HG GLU 54 1HG GLU 144 -11.968 -7.891 -9.457 1140 2HG GLU 54 2HG GLU 144 -12.595 -9.251 -10.385 1141 HE1 GLU 54 HE2 GLU 144 -15.720 -9.285 -8.915 1142 NH1 ARG 55 NH2 ARG 145 -5.813 -18.464 -8.649 1143 NH2 ARG 55 NH1 ARG 145 -7.688 -19.079 -7.516 1144 H ARG 55 H ARG 145 -9.173 -12.406 -9.114 1145 HA ARG 55 HA ARG 145 -8.643 -12.265 -12.021 1146 1HB ARG 55 1HB ARG 145 -7.689 -14.469 -11.918 1147 2HB ARG 55 2HB ARG 145 -7.061 -13.475 -10.622 1148 1HG ARG 55 1HG ARG 145 -8.448 -14.618 -8.957 1149 2HG ARG 55 2HG ARG 145 -9.339 -15.509 -10.197 1150 1HD ARG 55 1HD ARG 145 -7.199 -16.717 -10.844 1151 2HD ARG 55 2HD ARG 145 -6.346 -15.852 -9.546 1152 1HH1 ARG 55 2HH2 ARG 145 -5.377 -17.811 -9.308 1153 2HH1 ARG 55 1HH2 ARG 145 -5.364 -19.262 -8.186 1154 1HH2 ARG 55 1HH1 ARG 145 -8.677 -18.897 -7.313 1155 2HH2 ARG 55 2HH1 ARG 145 -7.110 -19.834 -7.131 1156 H ALA 56 H ALA 146 -9.404 -13.717 -13.613 1157 HA ALA 56 HA ALA 146 -12.388 -13.819 -13.627 1158 1HB ALA 56 3HB ALA 146 -11.180 -13.041 -15.630 1159 2HB ALA 56 1HB ALA 146 -10.388 -14.625 -15.826 1160 3HB ALA 56 2HB ALA 146 -12.152 -14.475 -16.010 1161 H ALA 57 H ALA 147 -12.950 -15.443 -12.154 1162 HA ALA 57 HA ALA 147 -12.406 -18.032 -11.847 1163 1HB ALA 57 1HB ALA 147 -14.422 -16.930 -10.803 1164 2HB ALA 57 2HB ALA 147 -15.318 -17.059 -12.336 1165 3HB ALA 57 3HB ALA 147 -14.877 -18.522 -11.434 1166 NH1 ARG 58 NH2 ARG 148 -7.537 -20.598 -11.423 1167 NH2 ARG 58 NH1 ARG 148 -5.923 -19.210 -12.224 1168 H ARG 58 H ARG 148 -12.166 -19.878 -12.722 1169 HA ARG 58 HA ARG 148 -12.249 -19.832 -15.645 1170 1HB ARG 58 2HB ARG 148 -11.015 -22.103 -14.022 1171 2HB ARG 58 1HB ARG 148 -10.661 -21.661 -15.685 1172 1HG ARG 58 1HG ARG 148 -9.682 -19.462 -14.816 1173 2HG ARG 58 2HG ARG 148 -9.959 -20.044 -13.169 1174 1HD ARG 58 1HD ARG 148 -8.445 -22.036 -13.593 1175 2HD ARG 58 2HD ARG 148 -8.158 -21.460 -15.230 1176 1HH1 ARG 58 2HH2 ARG 148 -8.317 -21.230 -11.635 1177 2HH1 ARG 58 1HH2 ARG 148 -7.174 -20.359 -10.494 1178 1HH2 ARG 58 1HH1 ARG 148 -5.476 -18.780 -13.042 1179 2HH2 ARG 58 2HH1 ARG 148 -5.672 -19.065 -11.240 1180 H LYS 59 H LYS 149 -12.383 -22.537 -16.357 1181 HA LYS 59 HA LYS 149 -15.083 -23.568 -15.421 1182 1HB LYS 59 1HB LYS 149 -15.943 -24.123 -17.560 1183 2HB LYS 59 2HB LYS 149 -15.740 -22.394 -17.401 1184 1HG LYS 59 1HG LYS 149 -13.702 -22.460 -18.870 1185 2HG LYS 59 2HG LYS 149 -13.831 -24.204 -19.034 1186 1HD LYS 59 1HD LYS 149 -15.999 -22.211 -19.955 1187 2HD LYS 59 2HD LYS 149 -14.725 -22.858 -20.982 1188 1HE LYS 59 1HE LYS 149 -15.585 -25.220 -20.616 1189 2HE LYS 59 2HE LYS 149 -16.889 -24.591 -19.601 1190 1HZ LYS 59 1HZ LYS 149 -17.653 -23.283 -21.503 1191 2HZ LYS 59 2HZ LYS 149 -16.455 -23.874 -22.446 1192 H GLY 60 H GLY 150 -14.815 -25.515 -14.713 1193 1HA GLY 60 1HA GLY 150 -12.611 -27.365 -15.831 1194 2HA GLY 60 2HA GLY 150 -12.932 -27.247 -14.109 1195 NH1 ARG 61 NH2 ARG 151 -19.963 -25.206 -19.292 1196 NH2 ARG 61 NH1 ARG 151 -20.319 -24.882 -17.070 1197 H ARG 61 H ARG 151 -13.887 -28.668 -16.986 1198 HA ARG 61 HA ARG 151 -16.393 -29.893 -15.769 1199 1HB ARG 61 1HB ARG 151 -17.082 -27.748 -16.651 1200 2HB ARG 61 2HB ARG 151 -16.270 -27.988 -18.189 1201 1HG ARG 61 1HG ARG 151 -17.934 -29.795 -18.788 1202 2HG ARG 61 2HG ARG 151 -18.753 -29.564 -17.260 1203 1HD ARG 61 1HD ARG 151 -18.407 -27.450 -19.491 1204 2HD ARG 61 2HD ARG 151 -19.871 -28.390 -19.198 1205 1HH1 ARG 61 2HH2 ARG 151 -19.648 -25.842 -20.034 1206 2HH1 ARG 61 1HH2 ARG 151 -20.304 -24.246 -19.410 1207 1HH2 ARG 61 1HH1 ARG 151 -20.280 -25.267 -16.120 1208 2HH2 ARG 61 2HH1 ARG 151 -20.635 -23.944 -17.341 1209 H ASN 62 H ASN 152 -16.801 -31.837 -16.407 1210 HA ASN 62 HA ASN 152 -16.359 -34.032 -17.283 1211 1HB ASN 62 1HB ASN 152 -17.706 -32.340 -19.253 1212 2HB ASN 62 2HB ASN 152 -17.509 -34.094 -19.183 1213 1HD2 ASN 62 2HD2 ASN 152 -20.439 -34.377 -17.149 1214 2HD2 ASN 62 1HD2 ASN 152 -19.328 -35.072 -18.434 1215 HA PRO 63 HA PRO 153 -13.397 -35.370 -20.318 1216 1HB PRO 63 1HB PRO 153 -12.957 -33.015 -22.213 1217 2HB PRO 63 2HB PRO 153 -13.026 -34.762 -22.575 1218 1HG PRO 63 1HG PRO 153 -15.318 -33.346 -22.996 1219 2HG PRO 63 2HG PRO 153 -15.471 -34.835 -21.998 1220 1HD PRO 63 1HD PRO 153 -15.176 -31.962 -20.955 1221 2HD PRO 63 2HD PRO 153 -16.474 -33.178 -20.771 1222 H GLN 64 H GLN 154 -12.795 -32.104 -19.263 1223 HA GLN 64 HA GLN 154 -9.899 -32.662 -18.689 1224 1HB GLN 64 1HB GLN 154 -9.875 -30.297 -17.680 1225 2HB GLN 64 2HB GLN 154 -9.979 -30.452 -19.418 1226 1HG GLN 64 1HG GLN 154 -12.402 -29.914 -19.410 1227 2HG GLN 64 2HG GLN 154 -12.431 -29.894 -17.655 1228 1HE2 GLN 64 2HE2 GLN 154 -11.664 -26.401 -19.367 1229 2HE2 GLN 64 1HE2 GLN 154 -12.501 -27.844 -20.131 1230 H THR 65 H THR 155 -12.852 -31.957 -16.696 1231 HA THR 65 HA THR 155 -11.207 -32.946 -14.313 1232 HB THR 65 HB THR 155 -12.263 -31.397 -12.922 1233 HG1 THR 65 HG1 THR 155 -14.351 -31.608 -13.760 1234 1HG2 THR 65 2HG2 THR 155 -10.530 -30.446 -14.604 1235 2HG2 THR 65 3HG2 THR 155 -11.896 -29.839 -15.542 1236 3HG2 THR 65 1HG2 THR 155 -11.653 -29.232 -13.890 1237 H GLY 66 H GLY 156 -14.133 -33.650 -15.954 1238 1HA GLY 66 1HA GLY 156 -15.471 -35.659 -15.462 1239 2HA GLY 66 2HA GLY 156 -14.954 -35.666 -13.792 1240 H GLU 67 H GLU 157 -15.670 -33.191 -12.839 1241 HA GLU 67 HA GLU 157 -18.706 -33.341 -12.919 1242 1HB GLU 67 2HB GLU 157 -17.434 -33.810 -10.716 1243 2HB GLU 67 1HB GLU 157 -16.909 -32.131 -10.714 1244 1HG GLU 67 1HG GLU 157 -18.796 -32.274 -9.250 1245 2HG GLU 67 2HG GLU 157 -19.366 -31.401 -10.656 1246 HE2 GLU 67 HE2 GLU 157 -20.722 -32.353 -11.982 1247 H GLU 68 H GLU 158 -19.794 -31.552 -13.438 1248 HA GLU 68 HA GLU 158 -18.356 -29.371 -14.818 1249 1HB GLU 68 1HB GLU 158 -20.416 -28.616 -15.700 1250 2HB GLU 68 2HB GLU 158 -20.385 -30.350 -15.826 1251 1HG GLU 68 1HG GLU 158 -22.096 -28.670 -13.890 1252 2HG GLU 68 2HG GLU 158 -22.630 -29.476 -15.343 1253 HE2 GLU 68 HE2 GLU 158 -22.547 -31.400 -11.876 1254 H MET 69 H MET 159 -17.570 -27.594 -13.826 1255 HA MET 69 HA MET 159 -19.283 -25.970 -12.069 1256 1HB MET 69 1HB MET 159 -18.246 -25.988 -9.978 1257 2HB MET 69 2HB MET 159 -18.463 -27.673 -10.354 1258 1HG MET 69 1HG MET 159 -15.804 -26.108 -10.452 1259 2HG MET 69 2HG MET 159 -16.300 -27.250 -9.208 1260 1HE MET 69 1HE MET 159 -13.492 -27.472 -10.768 1261 2HE MET 69 3HE MET 159 -13.521 -28.457 -12.266 1262 3HE MET 69 2HE MET 159 -14.215 -26.817 -12.262 1263 H GLU 70 H GLU 160 -18.692 -23.882 -11.973 1264 HA GLU 70 HA GLU 160 -16.319 -22.954 -13.528 1265 1HB GLU 70 2HB GLU 160 -17.044 -20.717 -13.243 1266 2HB GLU 70 1HB GLU 160 -18.399 -21.722 -13.775 1267 1HG GLU 70 1HG GLU 160 -19.343 -21.684 -11.423 1268 2HG GLU 70 2HG GLU 160 -17.990 -20.692 -10.885 1269 HE1 GLU 70 HE2 GLU 160 -19.056 -17.744 -12.342 1270 H ILE 71 H ILE 161 -14.317 -22.660 -12.656 1271 HA ILE 71 HA ILE 161 -13.784 -23.337 -9.872 1272 HB ILE 71 HB ILE 161 -11.961 -22.370 -12.145 1273 1HG1 ILE 71 1HG1 ILE 161 -12.439 -25.260 -11.116 1274 2HG1 ILE 71 2HG1 ILE 161 -13.225 -24.627 -12.544 1275 1HG2 ILE 71 1HG2 ILE 161 -10.924 -22.034 -9.921 1276 2HG2 ILE 71 2HG2 ILE 161 -11.243 -23.747 -9.501 1277 3HG2 ILE 71 3HG2 ILE 161 -10.103 -23.322 -10.822 1278 1HD1 ILE 71 1HD1 ILE 161 -10.175 -24.958 -12.322 1279 2HD1 ILE 71 2HD1 ILE 161 -11.302 -26.032 -13.159 1280 3HD1 ILE 71 3HD1 ILE 161 -11.079 -24.373 -13.750 1281 HA PRO 72 HA PRO 162 -14.774 -18.997 -8.733 1282 1HB PRO 72 1HB PRO 162 -13.388 -19.733 -6.086 1283 2HB PRO 72 2HB PRO 162 -14.927 -18.882 -6.332 1284 1HG PRO 72 1HG PRO 162 -14.950 -21.520 -5.701 1285 2HG PRO 72 2HG PRO 162 -16.055 -20.932 -6.970 1286 1HD PRO 72 1HD PRO 162 -13.376 -22.379 -7.333 1287 2HD PRO 72 2HD PRO 162 -14.930 -22.631 -8.174 1288 H ALA 73 H ALA 163 -14.020 -16.996 -8.160 1289 HA ALA 73 HA ALA 163 -11.356 -16.209 -9.176 1290 1HB ALA 73 2HB ALA 163 -13.460 -14.693 -9.254 1291 2HB ALA 73 3HB ALA 163 -13.370 -14.546 -7.461 1292 3HB ALA 73 1HB ALA 163 -12.086 -13.892 -8.470 1293 H SER 74 H SER 164 -10.152 -14.588 -7.979 1294 HA SER 74 HA SER 164 -10.462 -14.425 -5.166 1295 1HB SER 74 1HB SER 164 -7.641 -15.552 -5.977 1296 2HB SER 74 2HB SER 164 -7.990 -14.917 -4.365 1297 HG SER 74 HG SER 164 -9.294 -17.096 -5.616 1298 H LYS 75 H LYS 165 -9.903 -12.586 -4.297 1299 HA LYS 75 HA LYS 165 -8.960 -10.404 -6.124 1300 1HB LYS 75 2HB LYS 165 -9.567 -9.536 -3.358 1301 2HB LYS 75 1HB LYS 165 -9.909 -8.847 -4.912 1302 1HG LYS 75 1HG LYS 165 -11.821 -10.475 -5.232 1303 2HG LYS 75 2HG LYS 165 -11.467 -11.172 -3.651 1304 1HD LYS 75 1HD LYS 165 -11.923 -8.909 -2.560 1305 2HD LYS 75 2HD LYS 165 -12.297 -8.252 -4.147 1306 1HE LYS 75 1HE LYS 165 -14.404 -8.720 -3.108 1307 2HE LYS 75 2HE LYS 165 -14.214 -9.902 -4.400 1308 1HZ LYS 75 1HZ LYS 165 -15.022 -10.921 -2.398 1309 2HZ LYS 75 2HZ LYS 165 -13.545 -11.532 -2.739 1310 H VAL 76 H VAL 166 -6.720 -9.631 -6.218 1311 HA VAL 76 HA VAL 166 -4.915 -10.441 -4.116 1312 HB VAL 76 HB VAL 166 -5.288 -10.204 -7.082 1313 1HG1 VAL 76 1HG2 VAL 166 -2.651 -9.382 -6.076 1314 2HG1 VAL 76 2HG2 VAL 166 -3.141 -9.870 -7.782 1315 3HG1 VAL 76 3HG2 VAL 166 -3.852 -8.435 -7.021 1316 1HG2 VAL 76 2HG1 VAL 166 -5.117 -12.350 -5.927 1317 2HG2 VAL 76 3HG1 VAL 166 -3.884 -12.118 -7.184 1318 3HG2 VAL 76 1HG1 VAL 166 -3.432 -11.945 -5.450 1319 HA PRO 77 HA PRO 167 -5.045 -5.883 -3.323 1320 1HB PRO 77 1HB PRO 167 -3.580 -5.825 -0.953 1321 2HB PRO 77 2HB PRO 167 -5.139 -6.659 -1.039 1322 1HG PRO 77 1HG PRO 167 -2.350 -7.878 -1.275 1323 2HG PRO 77 2HG PRO 167 -3.681 -8.435 -0.263 1324 1HD PRO 77 1HD PRO 167 -3.033 -9.443 -2.932 1325 2HD PRO 77 2HD PRO 167 -4.659 -9.590 -2.229 1326 H ALA 78 H ALA 168 -4.103 -4.272 -3.828 1327 HA ALA 78 HA ALA 168 -1.090 -4.109 -4.327 1328 1HB ALA 78 3HB ALA 168 -2.403 -4.903 -6.345 1329 2HB ALA 78 1HB ALA 168 -3.383 -3.421 -6.297 1330 3HB ALA 78 2HB ALA 168 -1.633 -3.319 -6.626 1331 H PHE 79 H PHE 169 -0.416 -2.078 -4.833 1332 HA PHE 79 HA PHE 169 -1.799 0.404 -3.634 1333 1HB PHE 79 2HB PHE 169 -0.924 -0.191 -1.735 1334 2HB PHE 79 1HB PHE 169 0.606 -0.774 -2.459 1335 HD1 PHE 79 HD2 PHE 169 2.431 0.792 -3.107 1336 HD2 PHE 79 HD1 PHE 169 -1.146 2.239 -1.206 1337 HE1 PHE 79 HE2 PHE 169 3.502 2.971 -2.737 1338 HE2 PHE 79 HE1 PHE 169 -0.023 4.379 -0.762 1339 HZ PHE 79 HZ PHE 169 2.269 4.780 -1.604 1340 H LYS 80 H LYS 170 -1.424 1.729 -5.101 1341 HA LYS 80 HA LYS 170 0.740 1.800 -7.380 1342 1HB LYS 80 2HB LYS 170 -1.750 3.506 -7.041 1343 2HB LYS 80 1HB LYS 170 -0.512 3.736 -8.269 1344 1HG LYS 80 1HG LYS 170 -0.969 1.433 -9.197 1345 2HG LYS 80 2HG LYS 170 -2.234 1.191 -7.990 1346 1HD LYS 80 1HD LYS 170 -3.507 3.168 -8.916 1347 2HD LYS 80 2HD LYS 170 -2.243 3.420 -10.125 1348 1HE LYS 80 1HE LYS 170 -2.712 1.106 -11.082 1349 2HE LYS 80 2HE LYS 170 -3.969 0.858 -9.860 1350 1HZ LYS 80 1HZ LYS 170 -5.162 2.750 -10.755 1351 2HZ LYS 80 2HZ LYS 170 -4.920 1.613 -11.904 1352 HA PRO 81 HA PRO 171 2.663 5.003 -4.734 1353 1HB PRO 81 1HB PRO 171 4.713 5.792 -6.398 1354 2HB PRO 81 2HB PRO 171 4.650 4.151 -5.746 1355 1HG PRO 81 1HG PRO 171 3.719 5.084 -8.515 1356 2HG PRO 81 2HG PRO 171 4.838 3.749 -8.139 1357 1HD PRO 81 1HD PRO 171 2.093 3.379 -8.553 1358 2HD PRO 81 2HD PRO 171 3.044 2.315 -7.467 1359 H GLY 82 H GLY 172 0.188 5.697 -5.988 1360 1HA GLY 82 1HA GLY 172 -1.083 7.245 -7.339 1361 2HA GLY 82 2HA GLY 172 -0.281 8.302 -6.196 1362 H LYS 83 H LYS 173 1.740 6.886 -8.549 1363 HA LYS 83 HA LYS 173 3.056 7.789 -10.352 1364 1HB LYS 83 2HB LYS 173 0.593 9.484 -10.726 1365 2HB LYS 83 1HB LYS 173 2.024 10.329 -11.160 1366 1HG LYS 83 1HG LYS 173 1.186 9.276 -13.161 1367 2HG LYS 83 2HG LYS 173 2.656 8.405 -12.744 1368 1HD LYS 83 1HD LYS 173 1.253 6.557 -11.700 1369 2HD LYS 83 2HD LYS 173 -0.217 7.455 -12.090 1370 1HE LYS 83 1HE LYS 173 0.339 7.292 -14.567 1371 2HE LYS 83 2HE LYS 173 1.820 6.404 -14.178 1372 1HZ LYS 83 1HZ LYS 173 0.487 4.666 -13.190 1373 2HZ LYS 83 2HZ LYS 173 0.046 4.915 -14.745 1374 H ALA 84 H ALA 174 1.923 10.097 -8.229 1375 HA ALA 84 HA ALA 174 3.892 12.213 -8.154 1376 1HB ALA 84 2HB ALA 174 1.527 12.244 -7.319 1377 2HB ALA 84 3HB ALA 174 1.918 10.997 -6.106 1378 3HB ALA 84 1HB ALA 174 2.647 12.621 -5.968 1379 H LEU 85 H LEU 175 3.584 9.289 -5.947 1380 HA LEU 85 HA LEU 175 6.073 9.848 -4.499 1381 1HB LEU 85 2HB LEU 175 4.385 8.423 -3.406 1382 2HB LEU 85 1HB LEU 175 4.424 7.299 -4.744 1383 HG LEU 85 HG LEU 175 6.873 7.069 -4.331 1384 1HD1 LEU 85 1HD1 LEU 175 7.126 8.984 -2.597 1385 2HD1 LEU 85 2HD1 LEU 175 6.513 7.809 -1.412 1386 3HD1 LEU 85 3HD1 LEU 175 7.994 7.463 -2.305 1387 1HD2 LEU 85 2HD2 LEU 175 5.153 5.270 -3.807 1388 2HD2 LEU 85 3HD2 LEU 175 6.532 5.192 -2.712 1389 3HD2 LEU 85 1HD2 LEU 175 4.993 5.903 -2.156 1390 H LYS 86 H LYS 176 5.230 8.029 -7.427 1391 HA LYS 86 HA LYS 176 7.881 6.923 -7.956 1392 1HB LYS 86 1HB LYS 176 5.631 6.327 -9.149 1393 2HB LYS 86 2HB LYS 176 5.985 7.655 -10.242 1394 1HG LYS 86 1HG LYS 176 8.164 6.550 -10.871 1395 2HG LYS 86 2HG LYS 176 7.851 5.260 -9.704 1396 1HD LYS 86 1HD LYS 176 5.749 4.624 -10.966 1397 2HD LYS 86 2HD LYS 176 6.064 5.910 -12.138 1398 1HE LYS 86 1HE LYS 176 8.263 4.792 -12.772 1399 2HE LYS 86 2HE LYS 176 7.946 3.506 -11.596 1400 1HZ LYS 86 1HZ LYS 176 7.273 2.840 -13.778 1401 2HZ LYS 86 2HZ LYS 176 5.950 2.931 -12.822 1402 H ASP 87 H ASP 177 6.826 10.247 -8.258 1403 HA ASP 87 HA ASP 177 9.317 11.080 -9.701 1404 1HB ASP 87 1HB ASP 177 6.610 12.078 -9.470 1405 2HB ASP 87 2HB ASP 177 7.490 13.108 -8.410 1406 HD1 ASP 87 HD2 ASP 177 8.175 13.019 -12.450 1407 H ALA 88 H ALA 178 7.933 11.225 -6.397 1408 HA ALA 88 HA ALA 178 9.976 12.712 -4.961 1409 1HB ALA 88 3HB ALA 178 7.768 11.755 -3.926 1410 2HB ALA 88 1HB ALA 178 8.486 10.144 -3.993 1411 3HB ALA 88 2HB ALA 178 9.210 11.346 -2.953 1412 H VAL 89 H VAL 179 9.879 9.243 -5.940 1413 HA VAL 89 HA VAL 179 12.195 8.494 -4.306 1414 HB VAL 89 HB VAL 179 9.623 7.691 -4.532 1415 1HG1 VAL 89 3HG2 VAL 179 9.835 7.464 -7.114 1416 2HG1 VAL 89 1HG2 VAL 179 10.736 5.969 -6.806 1417 3HG1 VAL 89 2HG2 VAL 179 9.063 6.171 -6.190 1418 1HG2 VAL 89 1HG1 VAL 179 11.164 6.671 -3.142 1419 2HG2 VAL 89 2HG1 VAL 179 10.050 5.542 -3.958 1420 3HG2 VAL 89 3HG1 VAL 179 11.770 5.646 -4.516 1421 H LYS 90 H LYS 180 11.717 9.254 -7.662 1422 HA LYS 90 HA LYS 180 13.297 7.308 -8.971 1423 1HB LYS 90 1HB LYS 180 13.032 8.590 -10.892 1424 2HB LYS 90 2HB LYS 180 11.621 8.906 -9.925 1425 1HG LYS 90 1HG LYS 180 12.666 11.137 -9.198 1426 2HG LYS 90 2HG LYS 180 14.004 10.828 -10.301 1427 1HD LYS 90 1HD LYS 180 12.380 10.687 -12.237 1428 2HD LYS 90 2HD LYS 180 11.038 11.030 -11.162 1429 1HE LYS 90 1HE LYS 180 13.423 12.940 -11.685 1430 2HE LYS 90 2HE LYS 180 11.862 13.025 -12.497 1431 1HZ LYS 90 1HZ LYS 180 11.978 14.576 -10.692 1432 2HZ LYS 90 2HZ LYS 180 10.795 13.484 -10.409 Start of MODEL 2 Raw file had 1432 H/Q atoms Start of MODEL 2 1 1H MET 1 1H MET 1 -10.459 7.318 -2.995 2 2H MET 1 2H MET 1 -11.627 8.360 -3.467 3 HA MET 1 HA MET 1 -11.553 9.543 -1.413 4 1HB MET 1 1HB MET 1 -9.362 7.528 -0.613 5 2HB MET 1 2HB MET 1 -9.712 9.000 0.255 6 1HG MET 1 1HG MET 1 -12.194 8.144 0.446 7 2HG MET 1 2HG MET 1 -11.570 6.571 -0.048 8 1HE MET 1 3HE MET 1 -10.432 4.973 1.316 9 2HE MET 1 2HE MET 1 -8.933 5.717 1.972 10 3HE MET 1 1HE MET 1 -10.165 5.092 3.071 11 H ASN 2 H ASN 2 -8.327 9.855 -1.114 12 HA ASN 2 HA ASN 2 -7.265 10.980 -3.243 13 1HB ASN 2 1HB ASN 2 -7.566 13.290 -3.648 14 2HB ASN 2 2HB ASN 2 -9.081 12.474 -3.807 15 1HD2 ASN 2 1HD2 ASN 2 -8.842 15.485 -1.090 16 2HD2 ASN 2 2HD2 ASN 2 -7.358 14.741 -1.875 17 H LYS 3 H LYS 3 -7.862 11.793 0.002 18 HA LYS 3 HA LYS 3 -5.782 11.474 1.541 19 1HB LYS 3 1HB LYS 3 -4.121 12.492 -0.144 20 2HB LYS 3 2HB LYS 3 -4.752 14.078 0.231 21 1HG LYS 3 1HG LYS 3 -3.967 13.744 2.643 22 2HG LYS 3 2HG LYS 3 -3.562 12.066 2.284 23 1HD LYS 3 1HD LYS 3 -1.825 12.898 0.597 24 2HD LYS 3 2HD LYS 3 -2.184 14.555 1.106 25 1HE LYS 3 1HE LYS 3 -1.501 13.941 3.494 26 2HE LYS 3 2HE LYS 3 -1.128 12.298 2.948 27 1HZ LYS 3 1HZ LYS 3 0.176 14.778 1.977 28 2HZ LYS 3 2HZ LYS 3 0.820 13.706 3.030 29 H THR 4 H THR 4 -8.156 14.104 0.573 30 HA THR 4 HA THR 4 -8.267 15.113 3.264 31 HB THR 4 HB THR 4 -9.741 15.616 0.600 32 HG1 THR 4 HG1 THR 4 -8.453 17.499 0.621 33 1HG2 THR 4 3HG2 THR 4 -9.650 17.052 3.276 34 2HG2 THR 4 1HG2 THR 4 -10.362 17.725 1.739 35 3HG2 THR 4 2HG2 THR 4 -11.060 16.243 2.505 36 H GLU 5 H GLU 5 -9.957 12.838 1.137 37 HA GLU 5 HA GLU 5 -12.348 12.461 2.893 38 1HB GLU 5 1HB GLU 5 -11.255 10.502 0.813 39 2HB GLU 5 2HB GLU 5 -12.823 10.402 1.586 40 1HG GLU 5 1HG GLU 5 -11.887 12.503 -0.451 41 2HG GLU 5 2HG GLU 5 -12.952 11.159 -0.763 42 HE2 GLU 5 HE2 GLU 5 -14.326 14.577 0.866 43 H LEU 6 H LEU 6 -9.071 11.668 3.010 44 HA LEU 6 HA LEU 6 -8.974 9.171 4.575 45 1HB LEU 6 2HB LEU 6 -7.253 10.939 2.920 46 2HB LEU 6 1HB LEU 6 -6.643 11.159 4.534 47 HG LEU 6 HG LEU 6 -6.508 8.635 4.573 48 1HD1 LEU 6 3HD1 LEU 6 -7.278 8.696 1.620 49 2HD1 LEU 6 1HD1 LEU 6 -6.569 7.273 2.446 50 3HD1 LEU 6 2HD1 LEU 6 -8.152 7.889 2.936 51 1HD2 LEU 6 1HD2 LEU 6 -4.559 10.105 4.006 52 2HD2 LEU 6 2HD2 LEU 6 -4.423 8.418 3.494 53 3HD2 LEU 6 3HD2 LEU 6 -4.806 9.685 2.295 54 H ILE 7 H ILE 7 -8.538 12.676 5.025 55 HA ILE 7 HA ILE 7 -8.074 12.777 7.864 56 HB ILE 7 HB ILE 7 -9.475 14.978 6.196 57 1HG1 ILE 7 1HG1 ILE 7 -6.464 14.423 6.365 58 2HG1 ILE 7 2HG1 ILE 7 -7.465 14.198 4.991 59 1HG2 ILE 7 2HG2 ILE 7 -9.353 15.373 8.700 60 2HG2 ILE 7 3HG2 ILE 7 -7.587 15.210 8.598 61 3HG2 ILE 7 1HG2 ILE 7 -8.408 16.557 7.781 62 1HD1 ILE 7 3HD1 ILE 7 -7.980 16.627 4.782 63 2HD1 ILE 7 1HD1 ILE 7 -6.892 16.967 6.126 64 3HD1 ILE 7 2HD1 ILE 7 -6.245 16.229 4.642 65 H ASN 8 H ASN 8 -11.100 13.220 6.043 66 HA ASN 8 HA ASN 8 -12.808 13.314 8.461 67 1HB ASN 8 1HB ASN 8 -13.639 12.636 5.543 68 2HB ASN 8 2HB ASN 8 -14.775 12.877 6.850 69 1HD2 ASN 8 2HD2 ASN 8 -13.438 16.197 4.970 70 2HD2 ASN 8 1HD2 ASN 8 -12.992 14.495 4.449 71 H ALA 9 H ALA 9 -11.413 10.549 6.890 72 HA ALA 9 HA ALA 9 -13.263 8.515 8.096 73 1HB ALA 9 2HB ALA 9 -11.474 7.960 6.173 74 2HB ALA 9 3HB ALA 9 -10.218 8.191 7.393 75 3HB ALA 9 1HB ALA 9 -11.350 6.896 7.630 76 H VAL 10 H VAL 10 -10.108 9.996 8.951 77 HA VAL 10 HA VAL 10 -9.703 8.399 11.248 78 HB VAL 10 HB VAL 10 -8.193 10.937 11.170 79 1HG1 VAL 10 3HG2 VAL 10 -7.843 8.862 12.676 80 2HG1 VAL 10 1HG2 VAL 10 -7.106 8.143 11.214 81 3HG1 VAL 10 2HG2 VAL 10 -6.425 9.646 11.891 82 1HG2 VAL 10 1HG1 VAL 10 -8.101 8.854 8.944 83 2HG2 VAL 10 2HG1 VAL 10 -8.330 10.627 8.883 84 3HG2 VAL 10 3HG1 VAL 10 -6.711 9.969 9.293 85 H ALA 11 H ALA 11 -10.533 11.620 10.844 86 HA ALA 11 HA ALA 11 -11.066 12.010 13.577 87 1HB ALA 11 2HB ALA 11 -10.555 13.929 12.047 88 2HB ALA 11 3HB ALA 11 -12.106 13.697 11.197 89 3HB ALA 11 1HB ALA 11 -12.080 14.273 12.898 90 H GLU 12 H GLU 12 -13.148 10.583 11.184 91 HA GLU 12 HA GLU 12 -15.581 10.759 12.934 92 1HB GLU 12 1HB GLU 12 -15.842 10.684 10.427 93 2HB GLU 12 2HB GLU 12 -15.113 9.089 10.390 94 1HG GLU 12 1HG GLU 12 -17.509 8.844 10.166 95 2HG GLU 12 2HG GLU 12 -17.056 8.162 11.715 96 HE1 GLU 12 HE2 GLU 12 -19.380 11.476 11.428 97 H THR 13 H THR 13 -13.237 8.153 11.996 98 HA THR 13 HA THR 13 -14.294 6.320 14.017 99 HB THR 13 HB THR 13 -12.170 4.940 13.602 100 HG1 THR 13 HG1 THR 13 -10.876 6.781 13.439 101 1HG2 THR 13 2HG2 THR 13 -13.282 5.909 10.913 102 2HG2 THR 13 3HG2 THR 13 -12.252 4.493 11.199 103 3HG2 THR 13 1HG2 THR 13 -13.897 4.540 11.881 104 H SER 14 H SER 14 -12.567 8.801 14.666 105 HA SER 14 HA SER 14 -11.580 7.707 17.384 106 1HB SER 14 1HB SER 14 -9.664 7.760 15.687 107 2HB SER 14 2HB SER 14 -9.812 9.511 15.615 108 HG SER 14 HG SER 14 -8.258 8.816 17.087 109 H GLY 15 H GLY 15 -12.638 10.696 15.730 110 1HA GLY 15 1HA GLY 15 -13.256 12.803 16.631 111 2HA GLY 15 2HA GLY 15 -13.442 12.031 18.204 112 H LEU 16 H LEU 16 -10.734 12.677 16.062 113 HA LEU 16 HA LEU 16 -9.119 14.195 18.116 114 1HB LEU 16 1HB LEU 16 -7.191 13.816 16.723 115 2HB LEU 16 2HB LEU 16 -7.863 12.429 17.549 116 HG LEU 16 HG LEU 16 -8.815 11.544 15.694 117 1HD1 LEU 16 2HD1 LEU 16 -9.655 13.651 14.538 118 2HD1 LEU 16 3HD1 LEU 16 -7.972 13.880 13.984 119 3HD1 LEU 16 1HD1 LEU 16 -8.968 12.439 13.463 120 1HD2 LEU 16 3HD2 LEU 16 -6.908 10.532 15.699 121 2HD2 LEU 16 1HD2 LEU 16 -7.732 10.625 14.126 122 3HD2 LEU 16 2HD2 LEU 16 -6.336 11.637 14.404 123 H SER 17 H SER 17 -8.261 15.182 15.448 124 HA SER 17 HA SER 17 -10.210 17.512 15.026 125 1HB SER 17 1HB SER 17 -7.210 18.066 15.119 126 2HB SER 17 2HB SER 17 -8.499 19.196 14.783 127 HG SER 17 HG SER 17 -8.171 17.758 17.198 128 H LYS 18 H LYS 18 -9.959 18.567 12.929 129 HA LYS 18 HA LYS 18 -9.397 16.614 10.690 130 1HB LYS 18 1HB LYS 18 -10.292 19.554 10.508 131 2HB LYS 18 2HB LYS 18 -9.816 18.588 9.121 132 1HG LYS 18 1HG LYS 18 -11.611 16.832 9.811 133 2HG LYS 18 2HG LYS 18 -12.162 17.991 11.009 134 1HD LYS 18 1HD LYS 18 -13.610 18.243 9.145 135 2HD LYS 18 2HD LYS 18 -12.593 19.680 9.131 136 1HE LYS 18 1HE LYS 18 -11.178 18.665 7.274 137 2HE LYS 18 2HE LYS 18 -12.127 17.176 7.350 138 1HZ LYS 18 1HZ LYS 18 -12.889 18.586 5.593 139 2HZ LYS 18 2HZ LYS 18 -14.078 18.430 6.704 140 H LYS 19 H LYS 19 -7.787 19.471 12.069 141 HA LYS 19 HA LYS 19 -5.377 19.176 10.355 142 1HB LYS 19 2HB LYS 19 -5.679 20.506 13.120 143 2HB LYS 19 1HB LYS 19 -4.163 20.493 12.229 144 1HG LYS 19 1HG LYS 19 -6.780 21.835 11.326 145 2HG LYS 19 2HG LYS 19 -5.388 22.644 12.010 146 1HD LYS 19 1HD LYS 19 -5.466 21.211 9.280 147 2HD LYS 19 2HD LYS 19 -5.567 22.942 9.552 148 1HE LYS 19 1HE LYS 19 -3.219 22.946 10.534 149 2HE LYS 19 2HE LYS 19 -3.098 21.205 10.240 150 1HZ LYS 19 1HZ LYS 19 -3.548 23.252 8.142 151 2HZ LYS 19 2HZ LYS 19 -3.444 21.642 7.875 152 H ASP 20 H ASP 20 -6.320 17.665 13.560 153 HA ASP 20 HA ASP 20 -3.646 16.301 13.718 154 1HB ASP 20 1HB ASP 20 -6.239 16.050 15.370 155 2HB ASP 20 2HB ASP 20 -5.052 14.790 15.494 156 HD2 ASP 20 HD2 ASP 20 -4.405 18.347 17.221 157 H ALA 21 H ALA 21 -6.648 15.422 12.201 158 HA ALA 21 HA ALA 21 -5.911 12.561 11.759 159 1HB ALA 21 2HB ALA 21 -8.110 14.421 10.635 160 2HB ALA 21 3HB ALA 21 -7.869 12.746 10.063 161 3HB ALA 21 1HB ALA 21 -8.259 13.067 11.720 162 H THR 22 H THR 22 -5.591 15.563 9.779 163 HA THR 22 HA THR 22 -4.472 14.044 7.542 164 HB THR 22 HB THR 22 -5.633 16.079 7.501 165 HG1 THR 22 HG1 THR 22 -4.585 14.877 5.781 166 1HG2 THR 22 2HG2 THR 22 -4.765 17.933 8.411 167 2HG2 THR 22 3HG2 THR 22 -3.319 17.868 7.290 168 3HG2 THR 22 1HG2 THR 22 -4.967 18.090 6.662 169 H LYS 23 H LYS 23 -3.082 15.818 10.095 170 HA LYS 23 HA LYS 23 -0.198 15.592 9.675 171 1HB LYS 23 2HB LYS 23 -2.433 15.662 11.844 172 2HB LYS 23 1HB LYS 23 -0.787 15.396 12.457 173 1HG LYS 23 1HG LYS 23 0.102 17.506 11.409 174 2HG LYS 23 2HG LYS 23 -1.509 17.918 10.857 175 1HD LYS 23 1HD LYS 23 -1.007 19.205 12.830 176 2HD LYS 23 2HD LYS 23 -2.319 18.112 13.220 177 1HE LYS 23 1HE LYS 23 -0.714 16.581 14.439 178 2HE LYS 23 2HE LYS 23 0.642 17.629 13.997 179 1HZ LYS 23 1HZ LYS 23 -1.695 18.391 15.662 180 2HZ LYS 23 2HZ LYS 23 -0.188 18.073 16.210 181 H ALA 24 H ALA 24 -2.578 13.511 11.308 182 HA ALA 24 HA ALA 24 -0.743 11.399 12.114 183 1HB ALA 24 3HB ALA 24 -3.765 11.538 11.873 184 2HB ALA 24 1HB ALA 24 -2.843 10.213 12.676 185 3HB ALA 24 2HB ALA 24 -2.728 11.882 13.297 186 H VAL 25 H VAL 25 -2.912 11.629 9.209 187 HA VAL 25 HA VAL 25 -2.039 9.179 7.833 188 HB VAL 25 HB VAL 25 -3.139 12.068 7.265 189 1HG1 VAL 25 3HG2 VAL 25 -1.563 11.799 5.349 190 2HG1 VAL 25 1HG2 VAL 25 -2.303 10.253 4.924 191 3HG1 VAL 25 2HG2 VAL 25 -3.227 11.792 4.814 192 1HG2 VAL 25 3HG1 VAL 25 -4.741 10.312 7.947 193 2HG2 VAL 25 1HG1 VAL 25 -5.098 11.002 6.362 194 3HG2 VAL 25 2HG1 VAL 25 -4.361 9.373 6.475 195 H ASP 26 H ASP 26 -0.735 12.538 7.577 196 HA ASP 26 HA ASP 26 1.885 11.547 6.456 197 1HB ASP 26 1HB ASP 26 0.648 13.779 5.952 198 2HB ASP 26 2HB ASP 26 1.177 14.336 7.541 199 HD2 ASP 26 HD2 ASP 26 4.257 15.320 6.378 200 H ALA 27 H ALA 27 1.030 10.826 9.016 201 HA ALA 27 HA ALA 27 3.623 10.987 10.615 202 1HB ALA 27 2HB ALA 27 1.342 11.730 11.721 203 2HB ALA 27 3HB ALA 27 1.067 10.000 11.856 204 3HB ALA 27 1HB ALA 27 2.462 10.787 12.621 205 H VAL 28 H VAL 28 1.103 8.737 9.616 206 HA VAL 28 HA VAL 28 2.597 6.197 9.961 207 HB VAL 28 HB VAL 28 0.257 6.864 7.988 208 1HG1 VAL 28 1HG2 VAL 28 1.288 4.647 7.477 209 2HG1 VAL 28 2HG2 VAL 28 0.955 4.079 9.129 210 3HG1 VAL 28 3HG2 VAL 28 -0.372 4.534 8.050 211 1HG2 VAL 28 2HG1 VAL 28 -0.440 7.342 10.268 212 2HG2 VAL 28 3HG1 VAL 28 -1.333 6.018 9.488 213 3HG2 VAL 28 1HG1 VAL 28 -0.072 5.657 10.738 214 H PHE 29 H PHE 29 1.592 7.988 7.214 215 HA PHE 29 HA PHE 29 3.449 6.774 5.232 216 1HB PHE 29 2HB PHE 29 1.817 9.311 4.775 217 2HB PHE 29 1HB PHE 29 2.505 8.297 3.522 218 HD1 PHE 29 HD1 PHE 29 1.876 5.534 4.062 219 HD2 PHE 29 HD2 PHE 29 -0.510 8.996 4.927 220 HE1 PHE 29 HE1 PHE 29 -0.059 4.097 4.447 221 HE2 PHE 29 HE2 PHE 29 -2.424 7.555 5.397 222 HZ PHE 29 HZ PHE 29 -2.161 5.076 5.242 223 H ASP 30 H ASP 30 3.944 9.561 7.292 224 HA ASP 30 HA ASP 30 6.359 10.481 5.826 225 1HB ASP 30 1HB ASP 30 5.009 11.739 7.668 226 2HB ASP 30 2HB ASP 30 5.889 10.824 8.862 227 HD1 ASP 30 HD2 ASP 30 7.592 13.882 6.866 228 H SER 31 H SER 31 5.711 8.258 8.455 229 HA SER 31 HA SER 31 8.552 7.366 8.832 230 1HB SER 31 1HB SER 31 6.008 6.043 9.813 231 2HB SER 31 2HB SER 31 7.638 5.566 10.266 232 HG SER 31 HG SER 31 6.486 8.123 10.699 233 H ILE 32 H ILE 32 5.819 6.103 6.679 234 HA ILE 32 HA ILE 32 7.303 3.716 5.844 235 HB ILE 32 HB ILE 32 5.271 5.430 4.265 236 1HG1 ILE 32 1HG1 ILE 32 3.732 3.771 4.030 237 2HG1 ILE 32 2HG1 ILE 32 4.637 2.553 4.928 238 1HG2 ILE 32 1HG2 ILE 32 7.019 2.971 3.726 239 2HG2 ILE 32 2HG2 ILE 32 5.516 2.995 2.813 240 3HG2 ILE 32 3HG2 ILE 32 6.727 4.304 2.655 241 1HD1 ILE 32 3HD1 ILE 32 2.880 4.796 6.032 242 2HD1 ILE 32 1HD1 ILE 32 2.545 3.087 6.010 243 3HD1 ILE 32 2HD1 ILE 32 3.810 3.681 7.091 244 H THR 33 H THR 33 6.926 7.120 4.574 245 HA THR 33 HA THR 33 8.824 6.768 2.406 246 HB THR 33 HB THR 33 9.045 9.115 2.156 247 HG1 THR 33 HG1 THR 33 7.559 9.349 4.566 248 1HG2 THR 33 2HG2 THR 33 6.237 8.024 2.625 249 2HG2 THR 33 3HG2 THR 33 6.392 9.732 2.225 250 3HG2 THR 33 1HG2 THR 33 7.000 8.476 1.116 251 H GLU 34 H GLU 34 9.427 7.382 5.683 252 HA GLU 34 HA GLU 34 12.363 7.944 5.357 253 1HB GLU 34 1HB GLU 34 11.092 9.105 7.273 254 2HB GLU 34 2HB GLU 34 10.720 7.531 7.946 255 1HG GLU 34 1HG GLU 34 12.491 8.389 9.258 256 2HG GLU 34 2HG GLU 34 13.230 7.122 8.307 257 HE1 GLU 34 HE2 GLU 34 14.160 7.867 6.310 258 H ALA 35 H ALA 35 10.127 5.154 6.056 259 HA ALA 35 HA ALA 35 12.391 3.343 6.479 260 1HB ALA 35 3HB ALA 35 9.906 2.601 7.096 261 2HB ALA 35 1HB ALA 35 9.551 2.649 5.368 262 3HB ALA 35 2HB ALA 35 10.654 1.448 5.974 263 H LEU 36 H LEU 36 10.302 3.781 3.471 264 HA LEU 36 HA LEU 36 12.101 2.099 1.925 265 1HB LEU 36 2HB LEU 36 10.131 4.199 1.124 266 2HB LEU 36 1HB LEU 36 10.809 3.040 0.018 267 HG LEU 36 HG LEU 36 9.150 2.711 1.936 268 1HD1 LEU 36 1HD2 LEU 36 10.904 0.329 2.046 269 2HD1 LEU 36 2HD2 LEU 36 9.978 1.154 3.328 270 3HD1 LEU 36 3HD2 LEU 36 9.211 -0.067 2.344 271 1HD2 LEU 36 2HD1 LEU 36 7.482 2.665 0.870 272 2HD2 LEU 36 3HD1 LEU 36 7.759 0.911 0.676 273 3HD2 LEU 36 1HD1 LEU 36 7.571 1.540 2.299 274 NH1 ARG 37 NH2 ARG 37 11.159 11.560 4.118 275 NH2 ARG 37 NH1 ARG 37 12.633 11.827 5.822 276 H ARG 37 H ARG 37 12.104 5.686 2.431 277 HA ARG 37 HA ARG 37 13.936 5.963 0.238 278 1HB ARG 37 1HB ARG 37 14.205 8.247 0.565 279 2HB ARG 37 2HB ARG 37 12.554 7.909 1.003 280 1HG ARG 37 1HG ARG 37 13.562 7.838 3.528 281 2HG ARG 37 2HG ARG 37 14.944 8.654 2.816 282 1HD ARG 37 1HD ARG 37 13.487 10.469 1.965 283 2HD ARG 37 2HD ARG 37 12.046 9.602 2.556 284 1HH1 ARG 37 2HH2 ARG 37 10.954 11.131 3.209 285 2HH1 ARG 37 1HH2 ARG 37 10.547 12.184 4.656 286 1HH2 ARG 37 1HH1 ARG 37 13.552 11.604 6.220 287 2HH2 ARG 37 2HH1 ARG 37 11.915 12.432 6.235 288 H LYS 38 H LYS 38 14.359 5.038 3.674 289 HA LYS 38 HA LYS 38 17.228 5.990 3.640 290 1HB LYS 38 1HB LYS 38 15.655 6.663 5.513 291 2HB LYS 38 2HB LYS 38 15.664 4.990 6.066 292 1HG LYS 38 1HG LYS 38 18.107 5.157 6.579 293 2HG LYS 38 2HG LYS 38 18.200 6.719 5.781 294 1HD LYS 38 1HD LYS 38 18.202 7.079 8.179 295 2HD LYS 38 2HD LYS 38 16.743 7.753 7.500 296 1HE LYS 38 1HE LYS 38 16.121 6.711 9.579 297 2HE LYS 38 2HE LYS 38 15.425 5.708 8.315 298 1HZ LYS 38 1HZ LYS 38 17.334 4.197 8.581 299 2HZ LYS 38 2HZ LYS 38 17.964 5.143 9.756 300 H GLY 39 H GLY 39 15.880 3.268 2.511 301 1HA GLY 39 1HA GLY 39 16.633 0.990 2.211 302 2HA GLY 39 2HA GLY 39 18.097 1.357 3.110 303 H ASP 40 H ASP 40 14.713 1.631 4.055 304 HA ASP 40 HA ASP 40 14.918 -0.511 6.230 305 1HB ASP 40 1HB ASP 40 14.186 2.395 6.530 306 2HB ASP 40 2HB ASP 40 13.477 1.203 7.611 307 HD2 ASP 40 HD2 ASP 40 14.741 0.157 8.933 308 H LYS 41 H LYS 41 13.308 -1.652 6.795 309 HA LYS 41 HA LYS 41 11.060 -1.892 4.755 310 1HB LYS 41 2HB LYS 41 11.730 -3.903 6.941 311 2HB LYS 41 1HB LYS 41 10.644 -4.140 5.579 312 1HG LYS 41 1HG LYS 41 12.613 -4.058 3.986 313 2HG LYS 41 2HG LYS 41 13.694 -3.780 5.336 314 1HD LYS 41 1HD LYS 41 13.886 -6.089 4.805 315 2HD LYS 41 2HD LYS 41 13.070 -5.988 6.360 316 1HE LYS 41 1HE LYS 41 10.829 -6.417 5.182 317 2HE LYS 41 2HE LYS 41 11.683 -6.510 3.636 318 1HZ LYS 41 1HZ LYS 41 12.104 -8.298 5.964 319 2HZ LYS 41 2HZ LYS 41 11.290 -8.676 4.598 320 H VAL 42 H VAL 42 8.989 -1.309 5.347 321 HA VAL 42 HA VAL 42 8.184 -0.633 7.960 322 HB VAL 42 HB VAL 42 6.584 -1.089 5.400 323 1HG1 VAL 42 1HG2 VAL 42 6.308 0.913 7.640 324 2HG1 VAL 42 2HG2 VAL 42 5.297 0.896 6.161 325 3HG1 VAL 42 3HG2 VAL 42 5.216 -0.495 7.290 326 1HG2 VAL 42 2HG1 VAL 42 8.561 0.468 4.913 327 2HG2 VAL 42 3HG1 VAL 42 6.982 1.279 4.830 328 3HG2 VAL 42 1HG1 VAL 42 8.005 1.475 6.295 329 H GLN 43 H GLN 43 6.544 -1.558 8.862 330 HA GLN 43 HA GLN 43 6.348 -4.616 8.681 331 1HB GLN 43 1HB GLN 43 7.236 -3.180 11.175 332 2HB GLN 43 2HB GLN 43 6.908 -4.892 11.123 333 1HG GLN 43 1HG GLN 43 9.117 -3.442 9.555 334 2HG GLN 43 2HG GLN 43 9.313 -4.307 11.058 335 1HE2 GLN 43 1HE2 GLN 43 9.753 -6.500 7.759 336 2HE2 GLN 43 2HE2 GLN 43 9.816 -4.669 7.851 337 H LEU 44 H LEU 44 3.939 -2.967 8.334 338 HA LEU 44 HA LEU 44 2.357 -3.467 10.785 339 1HB LEU 44 2HB LEU 44 1.184 -2.654 8.103 340 2HB LEU 44 1HB LEU 44 0.301 -2.861 9.602 341 HG LEU 44 HG LEU 44 2.000 -1.024 10.544 342 1HD1 LEU 44 2HD1 LEU 44 2.111 -0.440 7.506 343 2HD1 LEU 44 3HD1 LEU 44 2.583 0.711 8.774 344 3HD1 LEU 44 1HD1 LEU 44 3.488 -0.793 8.581 345 1HD2 LEU 44 3HD2 LEU 44 -0.344 -0.341 8.666 346 2HD2 LEU 44 1HD2 LEU 44 -0.459 -0.728 10.398 347 3HD2 LEU 44 2HD2 LEU 44 0.358 0.756 9.885 348 H ILE 45 H ILE 45 1.822 -5.389 11.420 349 HA ILE 45 HA ILE 45 1.102 -7.563 9.480 350 HB ILE 45 HB ILE 45 2.553 -8.093 11.441 351 1HG1 ILE 45 1HG1 ILE 45 1.441 -10.277 12.044 352 2HG1 ILE 45 2HG1 ILE 45 -0.019 -9.767 11.216 353 1HG2 ILE 45 1HG2 ILE 45 1.350 -6.760 13.190 354 2HG2 ILE 45 2HG2 ILE 45 -0.020 -7.898 13.109 355 3HG2 ILE 45 3HG2 ILE 45 1.579 -8.465 13.673 356 1HD1 ILE 45 2HD1 ILE 45 2.752 -10.139 9.872 357 2HD1 ILE 45 3HD1 ILE 45 1.410 -11.308 9.831 358 3HD1 ILE 45 1HD1 ILE 45 1.238 -9.742 9.015 359 H GLY 46 H GLY 46 -0.912 -8.428 9.429 360 1HA GLY 46 1HA GLY 46 -3.392 -8.234 9.555 361 2HA GLY 46 2HA GLY 46 -3.270 -6.703 10.349 362 H PHE 47 H PHE 47 -1.471 -5.440 8.365 363 HA PHE 47 HA PHE 47 -3.155 -5.288 5.874 364 1HB PHE 47 2HB PHE 47 -3.725 -3.693 7.926 365 2HB PHE 47 1HB PHE 47 -2.273 -2.827 7.536 366 HD1 PHE 47 HD1 PHE 47 -2.097 -1.754 5.134 367 HD2 PHE 47 HD2 PHE 47 -5.757 -3.520 6.558 368 HE1 PHE 47 HE1 PHE 47 -3.280 -0.936 3.152 369 HE2 PHE 47 HE2 PHE 47 -6.927 -2.561 4.611 370 HZ PHE 47 HZ PHE 47 -5.686 -1.485 2.833 371 H GLY 48 H GLY 48 0.155 -4.076 7.181 372 1HA GLY 48 1HA GLY 48 0.908 -3.661 4.250 373 2HA GLY 48 2HA GLY 48 0.842 -2.290 5.286 374 H ASN 49 H ASN 49 2.496 -5.374 4.760 375 HA ASN 49 HA ASN 49 4.915 -4.328 6.316 376 1HB ASN 49 1HB ASN 49 4.105 -6.672 6.738 377 2HB ASN 49 2HB ASN 49 4.533 -7.126 5.107 378 1HD2 ASN 49 1HD2 ASN 49 7.398 -7.580 7.751 379 2HD2 ASN 49 2HD2 ASN 49 5.584 -7.588 8.029 380 H PHE 50 H PHE 50 5.710 -2.808 5.050 381 HA PHE 50 HA PHE 50 5.790 -3.077 1.990 382 1HB PHE 50 2HB PHE 50 6.662 -0.545 3.474 383 2HB PHE 50 1HB PHE 50 6.626 -0.704 1.832 384 HD1 PHE 50 HD2 PHE 50 4.387 -0.981 4.778 385 HD2 PHE 50 HD1 PHE 50 5.091 0.773 0.959 386 HE1 PHE 50 HE2 PHE 50 2.308 0.348 5.027 387 HE2 PHE 50 HE1 PHE 50 3.025 2.139 1.227 388 HZ PHE 50 HZ PHE 50 1.655 1.851 3.264 389 H GLU 51 H GLU 51 7.729 -2.632 0.871 390 HA GLU 51 HA GLU 51 10.126 -2.014 2.205 391 1HB GLU 51 1HB GLU 51 11.554 -4.157 1.951 392 2HB GLU 51 2HB GLU 51 10.270 -4.401 3.087 393 1HG GLU 51 1HG GLU 51 10.161 -5.346 0.149 394 2HG GLU 51 2HG GLU 51 10.767 -6.326 1.466 395 HE1 GLU 51 HE2 GLU 51 7.645 -6.954 2.928 396 H VAL 52 H VAL 52 12.213 -2.002 1.019 397 HA VAL 52 HA VAL 52 11.600 -0.952 -1.646 398 HB VAL 52 HB VAL 52 13.150 -0.271 0.736 399 1HG1 VAL 52 1HG2 VAL 52 15.075 -1.306 -1.358 400 2HG1 VAL 52 2HG2 VAL 52 15.465 -0.183 -0.009 401 3HG1 VAL 52 3HG2 VAL 52 14.842 -1.842 0.303 402 1HG2 VAL 52 3HG1 VAL 52 13.066 0.950 -2.024 403 2HG2 VAL 52 1HG1 VAL 52 12.172 1.367 -0.555 404 3HG2 VAL 52 2HG1 VAL 52 13.924 1.626 -0.613 405 NH1 ARG 53 NH2 ARG 53 10.297 -7.078 -2.189 406 NH2 ARG 53 NH1 ARG 53 12.288 -7.110 -1.093 407 H ARG 53 H ARG 53 12.975 -1.581 -3.546 408 HA ARG 53 HA ARG 53 14.026 -4.466 -3.401 409 1HB ARG 53 1HB ARG 53 11.565 -3.621 -4.578 410 2HB ARG 53 2HB ARG 53 12.665 -3.195 -5.783 411 1HG ARG 53 1HG ARG 53 12.093 -5.290 -6.511 412 2HG ARG 53 2HG ARG 53 13.582 -5.699 -5.688 413 1HD ARG 53 1HD ARG 53 10.695 -5.985 -4.587 414 2HD ARG 53 2HD ARG 53 11.673 -7.309 -5.212 415 1HH1 ARG 53 2HH2 ARG 53 9.799 -6.935 -3.075 416 2HH1 ARG 53 1HH2 ARG 53 9.882 -7.319 -1.283 417 1HH2 ARG 53 1HH1 ARG 53 13.305 -6.982 -1.136 418 2HH2 ARG 53 2HH1 ARG 53 11.732 -7.343 -0.262 419 H GLU 54 H GLU 54 16.273 -3.914 -3.464 420 HA GLU 54 HA GLU 54 17.375 -1.945 -5.279 421 1HB GLU 54 1HB GLU 54 18.558 -2.920 -3.254 422 2HB GLU 54 2HB GLU 54 18.905 -4.363 -4.185 423 1HG GLU 54 1HG GLU 54 20.877 -2.995 -4.245 424 2HG GLU 54 2HG GLU 54 20.211 -2.924 -5.864 425 HE1 GLU 54 HE2 GLU 54 19.514 0.477 -5.780 426 NH1 ARG 55 NH2 ARG 55 13.912 -6.093 -9.289 427 NH2 ARG 55 NH1 ARG 55 15.373 -7.421 -10.414 428 H ARG 55 H ARG 55 16.718 -2.050 -7.346 429 HA ARG 55 HA ARG 55 16.435 -4.480 -8.905 430 1HB ARG 55 1HB ARG 55 15.026 -2.386 -9.047 431 2HB ARG 55 2HB ARG 55 16.390 -1.505 -9.696 432 1HG ARG 55 1HG ARG 55 14.988 -1.900 -11.486 433 2HG ARG 55 2HG ARG 55 16.324 -2.979 -11.787 434 1HD ARG 55 1HD ARG 55 13.595 -3.822 -10.557 435 2HD ARG 55 2HD ARG 55 13.947 -3.842 -12.269 436 1HH1 ARG 55 2HH2 ARG 55 13.443 -5.183 -9.225 437 2HH1 ARG 55 1HH2 ARG 55 13.800 -6.889 -8.651 438 1HH2 ARG 55 1HH1 ARG 55 16.019 -7.527 -11.204 439 2HH2 ARG 55 2HH1 ARG 55 15.158 -8.124 -9.697 440 H ALA 56 H ALA 56 17.615 -5.350 -10.503 441 HA ALA 56 HA ALA 56 20.452 -4.322 -11.053 442 1HB ALA 56 2HB ALA 56 20.291 -6.664 -10.265 443 2HB ALA 56 3HB ALA 56 19.206 -7.085 -11.615 444 3HB ALA 56 1HB ALA 56 20.889 -6.602 -11.935 445 H ALA 57 H ALA 57 19.653 -2.581 -12.319 446 HA ALA 57 HA ALA 57 18.644 -1.416 -13.992 447 1HB ALA 57 1HB ALA 57 20.998 -1.861 -14.571 448 2HB ALA 57 2HB ALA 57 20.537 -3.323 -15.485 449 3HB ALA 57 3HB ALA 57 20.040 -1.703 -16.060 450 NH1 ARG 58 NH2 ARG 58 11.763 -1.270 -11.649 451 NH2 ARG 58 NH1 ARG 58 10.021 -1.691 -13.045 452 H ARG 58 H ARG 58 17.047 -0.888 -15.095 453 HA ARG 58 HA ARG 58 15.223 -3.047 -15.848 454 1HB ARG 58 2HB ARG 58 14.452 -0.139 -16.295 455 2HB ARG 58 1HB ARG 58 13.404 -1.518 -16.033 456 1HG ARG 58 1HG ARG 58 14.258 -1.637 -13.622 457 2HG ARG 58 2HG ARG 58 15.210 -0.190 -13.931 458 1HD ARG 58 1HD ARG 58 13.277 0.633 -12.835 459 2HD ARG 58 2HD ARG 58 13.066 1.075 -14.513 460 1HH1 ARG 58 2HH2 ARG 58 12.682 -0.832 -11.519 461 2HH1 ARG 58 1HH2 ARG 58 11.228 -1.795 -10.948 462 1HH2 ARG 58 1HH1 ARG 58 9.609 -1.579 -13.978 463 2HH2 ARG 58 2HH1 ARG 58 9.610 -2.188 -12.247 464 H LYS 59 H LYS 59 13.787 -2.321 -17.954 465 HA LYS 59 HA LYS 59 15.619 -1.787 -20.352 466 1HB LYS 59 1HB LYS 59 15.334 -4.289 -20.216 467 2HB LYS 59 2HB LYS 59 13.598 -4.106 -20.118 468 1HG LYS 59 1HG LYS 59 13.745 -4.667 -22.304 469 2HG LYS 59 2HG LYS 59 13.773 -2.941 -22.518 470 1HD LYS 59 1HD LYS 59 16.160 -4.896 -22.671 471 2HD LYS 59 2HD LYS 59 15.325 -4.120 -23.990 472 1HE LYS 59 1HE LYS 59 17.198 -2.781 -23.937 473 2HE LYS 59 2HE LYS 59 16.130 -1.803 -22.934 474 1HZ LYS 59 1HZ LYS 59 17.174 -2.862 -20.979 475 2HZ LYS 59 2HZ LYS 59 18.146 -3.758 -21.940 476 H GLY 60 H GLY 60 14.818 0.018 -21.150 477 1HA GLY 60 1HA GLY 60 11.780 0.399 -21.480 478 2HA GLY 60 2HA GLY 60 12.705 1.650 -20.665 479 NH1 ARG 61 NH2 ARG 61 9.652 2.031 -29.890 480 NH2 ARG 61 NH1 ARG 61 10.363 -0.129 -29.910 481 H ARG 61 H ARG 61 12.592 3.231 -22.135 482 HA ARG 61 HA ARG 61 14.000 2.948 -24.780 483 1HB ARG 61 1HB ARG 61 10.993 3.661 -24.620 484 2HB ARG 61 2HB ARG 61 11.996 4.298 -25.909 485 1HG ARG 61 1HG ARG 61 12.727 1.936 -26.507 486 2HG ARG 61 2HG ARG 61 11.516 1.316 -25.380 487 1HD ARG 61 1HD ARG 61 9.684 2.411 -26.705 488 2HD ARG 61 2HD ARG 61 10.883 3.200 -27.747 489 1HH1 ARG 61 2HH2 ARG 61 9.573 2.911 -29.368 490 2HH1 ARG 61 1HH2 ARG 61 9.331 1.854 -30.848 491 1HH2 ARG 61 1HH1 ARG 61 10.821 -0.896 -29.406 492 2HH2 ARG 61 2HH1 ARG 61 9.992 -0.156 -30.866 493 H ASN 62 H ASN 62 14.595 4.816 -25.733 494 HA ASN 62 HA ASN 62 15.369 7.002 -23.935 495 1HB ASN 62 1HB ASN 62 16.727 6.066 -25.874 496 2HB ASN 62 2HB ASN 62 15.593 6.789 -27.002 497 1HD2 ASN 62 2HD2 ASN 62 18.515 9.147 -25.514 498 2HD2 ASN 62 1HD2 ASN 62 18.301 7.411 -24.959 499 HA PRO 63 HA PRO 63 11.558 9.504 -24.543 500 1HB PRO 63 1HB PRO 63 12.413 12.036 -23.715 501 2HB PRO 63 2HB PRO 63 12.040 10.675 -22.648 502 1HG PRO 63 1HG PRO 63 14.788 11.540 -23.671 503 2HG PRO 63 2HG PRO 63 14.318 11.147 -22.000 504 1HD PRO 63 1HD PRO 63 15.586 9.311 -23.601 505 2HD PRO 63 2HD PRO 63 14.322 8.771 -22.456 506 H GLN 64 H GLN 64 14.486 10.847 -26.134 507 HA GLN 64 HA GLN 64 12.918 12.503 -28.068 508 1HB GLN 64 1HB GLN 64 15.244 13.131 -27.238 509 2HB GLN 64 2HB GLN 64 15.924 11.739 -28.062 510 1HG GLN 64 1HG GLN 64 15.268 12.628 -30.283 511 2HG GLN 64 2HG GLN 64 14.377 13.935 -29.527 512 1HE2 GLN 64 2HE2 GLN 64 18.449 14.322 -29.928 513 2HE2 GLN 64 1HE2 GLN 64 17.569 12.766 -30.343 514 H THR 65 H THR 65 15.271 10.059 -28.681 515 HA THR 65 HA THR 65 14.415 9.377 -31.309 516 HB THR 65 HB THR 65 16.250 7.788 -31.351 517 HG1 THR 65 HG1 THR 65 15.872 6.822 -29.361 518 1HG2 THR 65 2HG2 THR 65 16.856 10.305 -31.282 519 2HG2 THR 65 3HG2 THR 65 17.121 10.146 -29.540 520 3HG2 THR 65 1HG2 THR 65 18.153 9.238 -30.657 521 H GLY 66 H GLY 66 13.625 7.548 -28.377 522 1HA GLY 66 1HA GLY 66 12.047 5.760 -28.095 523 2HA GLY 66 2HA GLY 66 11.589 5.894 -29.779 524 H GLU 67 H GLU 67 14.892 5.210 -28.560 525 HA GLU 67 HA GLU 67 14.815 2.440 -29.830 526 1HB GLU 67 2HB GLU 67 16.460 4.211 -30.692 527 2HB GLU 67 1HB GLU 67 17.253 4.202 -29.118 528 1HG GLU 67 1HG GLU 67 18.539 2.831 -30.636 529 2HG GLU 67 2HG GLU 67 17.859 1.774 -29.417 530 HE2 GLU 67 HE2 GLU 67 16.032 -0.135 -31.628 531 H GLU 68 H GLU 68 15.272 0.740 -28.567 532 HA GLU 68 HA GLU 68 14.688 0.973 -25.774 533 1HB GLU 68 1HB GLU 68 15.739 -1.507 -27.260 534 2HB GLU 68 2HB GLU 68 15.255 -1.531 -25.569 535 1HG GLU 68 1HG GLU 68 12.930 -0.761 -26.177 536 2HG GLU 68 2HG GLU 68 13.366 -0.760 -27.883 537 HE2 GLU 68 HE2 GLU 68 13.112 -4.162 -28.304 538 H MET 69 H MET 69 15.825 1.428 -24.106 539 HA MET 69 HA MET 69 18.851 0.994 -24.037 540 1HB MET 69 1HB MET 69 19.241 3.213 -23.160 541 2HB MET 69 2HB MET 69 18.406 3.305 -24.689 542 1HG MET 69 1HG MET 69 17.341 4.987 -23.440 543 2HG MET 69 2HG MET 69 16.191 3.653 -23.254 544 1HE MET 69 1HE MET 69 15.831 5.915 -21.476 545 2HE MET 69 3HE MET 69 15.059 4.436 -20.819 546 3HE MET 69 2HE MET 69 16.069 5.468 -19.765 547 H GLU 70 H GLU 70 19.723 0.426 -22.238 548 HA GLU 70 HA GLU 70 18.144 -0.629 -20.016 549 1HB GLU 70 2HB GLU 70 20.106 -1.484 -19.020 550 2HB GLU 70 1HB GLU 70 20.142 -1.841 -20.734 551 1HG GLU 70 1HG GLU 70 21.835 0.313 -19.299 552 2HG GLU 70 2HG GLU 70 22.372 -1.291 -19.734 553 HE1 GLU 70 HE2 GLU 70 22.792 -0.672 -23.127 554 H ILE 71 H ILE 71 17.469 0.336 -18.259 555 HA ILE 71 HA ILE 71 18.275 3.121 -17.523 556 HB ILE 71 HB ILE 71 16.046 1.199 -16.676 557 1HG1 ILE 71 1HG1 ILE 71 15.759 3.835 -18.249 558 2HG1 ILE 71 2HG1 ILE 71 16.010 2.325 -19.093 559 1HG2 ILE 71 3HG2 ILE 71 16.453 4.118 -15.849 560 2HG2 ILE 71 1HG2 ILE 71 14.972 3.149 -15.542 561 3HG2 ILE 71 2HG2 ILE 71 16.503 2.678 -14.789 562 1HD1 ILE 71 3HD1 ILE 71 13.579 2.860 -17.280 563 2HD1 ILE 71 1HD1 ILE 71 13.624 2.908 -19.051 564 3HD1 ILE 71 2HD1 ILE 71 13.898 1.364 -18.204 565 HA PRO 72 HA PRO 72 20.980 1.410 -14.113 566 1HB PRO 72 1HB PRO 72 20.328 4.132 -12.841 567 2HB PRO 72 2HB PRO 72 21.898 3.313 -12.962 568 1HG PRO 72 1HG PRO 72 21.318 5.325 -14.682 569 2HG PRO 72 2HG PRO 72 22.094 3.855 -15.319 570 1HD PRO 72 1HD PRO 72 19.130 4.632 -15.478 571 2HD PRO 72 2HD PRO 72 20.190 3.914 -16.731 572 H ALA 73 H ALA 73 20.900 1.175 -11.630 573 HA ALA 73 HA ALA 73 18.489 -0.191 -10.824 574 1HB ALA 73 1HB ALA 73 20.724 -0.535 -9.599 575 2HB ALA 73 2HB ALA 73 20.490 1.065 -8.797 576 3HB ALA 73 3HB ALA 73 19.366 -0.255 -8.501 577 H SER 74 H SER 74 17.156 0.135 -9.091 578 HA SER 74 HA SER 74 17.243 2.589 -7.617 579 1HB SER 74 1HB SER 74 14.558 1.894 -9.147 580 2HB SER 74 2HB SER 74 14.571 3.039 -7.816 581 HG SER 74 HG SER 74 16.081 3.262 -10.210 582 H LYS 75 H LYS 75 16.078 2.532 -5.625 583 HA LYS 75 HA LYS 75 15.539 -0.299 -4.622 584 1HB LYS 75 2HB LYS 75 15.179 1.961 -2.732 585 2HB LYS 75 1HB LYS 75 15.583 0.283 -2.506 586 1HG LYS 75 1HG LYS 75 17.912 0.689 -3.386 587 2HG LYS 75 2HG LYS 75 17.526 2.405 -3.573 588 1HD LYS 75 1HD LYS 75 17.021 2.545 -1.079 589 2HD LYS 75 2HD LYS 75 17.464 0.842 -0.909 590 1HE LYS 75 1HE LYS 75 19.813 1.367 -1.724 591 2HE LYS 75 2HE LYS 75 19.372 3.073 -1.896 592 1HZ LYS 75 1HZ LYS 75 18.916 3.156 0.468 593 2HZ LYS 75 2HZ LYS 75 20.454 2.676 0.189 594 H VAL 76 H VAL 76 13.643 -0.897 -5.252 595 HA VAL 76 HA VAL 76 11.523 0.967 -5.830 596 HB VAL 76 HB VAL 76 10.650 -0.185 -7.305 597 1HG1 VAL 76 2HG2 VAL 76 13.041 0.497 -7.707 598 2HG1 VAL 76 3HG2 VAL 76 13.479 -1.208 -7.435 599 3HG1 VAL 76 1HG2 VAL 76 12.462 -0.783 -8.849 600 1HG2 VAL 76 2HG1 VAL 76 10.497 -2.596 -6.242 601 2HG2 VAL 76 3HG1 VAL 76 10.216 -2.177 -7.950 602 3HG2 VAL 76 1HG1 VAL 76 11.757 -2.850 -7.510 603 HA PRO 77 HA PRO 77 9.434 -0.184 -2.066 604 1HB PRO 77 1HB PRO 77 7.547 1.878 -1.900 605 2HB PRO 77 2HB PRO 77 9.291 2.162 -1.747 606 1HG PRO 77 1HG PRO 77 7.581 2.464 -4.272 607 2HG PRO 77 2HG PRO 77 8.697 3.652 -3.574 608 1HD PRO 77 1HD PRO 77 9.435 1.881 -5.651 609 2HD PRO 77 2HD PRO 77 10.628 2.397 -4.432 610 H ALA 78 H ALA 78 8.299 -1.610 -1.729 611 HA ALA 78 HA ALA 78 5.822 -2.455 -3.309 612 1HB ALA 78 2HB ALA 78 7.989 -3.811 -3.386 613 2HB ALA 78 3HB ALA 78 7.886 -4.050 -1.626 614 3HB ALA 78 1HB ALA 78 6.632 -4.730 -2.694 615 H PHE 79 H PHE 79 4.443 -3.877 -1.948 616 HA PHE 79 HA PHE 79 3.864 -2.947 0.949 617 1HB PHE 79 2HB PHE 79 2.838 -1.239 0.108 618 2HB PHE 79 1HB PHE 79 2.243 -2.105 -1.339 619 HD1 PHE 79 HD1 PHE 79 1.499 -1.489 2.263 620 HD2 PHE 79 HD2 PHE 79 0.189 -3.431 -1.347 621 HE1 PHE 79 HE1 PHE 79 -0.664 -2.010 3.305 622 HE2 PHE 79 HE2 PHE 79 -1.941 -3.999 -0.264 623 HZ PHE 79 HZ PHE 79 -2.362 -3.321 2.071 624 H LYS 80 H LYS 80 3.462 -4.691 1.757 625 HA LYS 80 HA LYS 80 2.290 -7.329 0.532 626 1HB LYS 80 2HB LYS 80 3.490 -6.868 3.277 627 2HB LYS 80 1HB LYS 80 2.668 -8.332 2.841 628 1HG LYS 80 1HG LYS 80 5.228 -7.283 1.479 629 2HG LYS 80 2HG LYS 80 5.174 -8.501 2.732 630 1HD LYS 80 1HD LYS 80 3.997 -8.770 -0.101 631 2HD LYS 80 2HD LYS 80 5.499 -9.468 0.451 632 1HE LYS 80 1HE LYS 80 2.695 -10.261 1.504 633 2HE LYS 80 2HE LYS 80 3.617 -11.132 0.286 634 1HZ LYS 80 1HZ LYS 80 5.331 -11.573 1.909 635 2HZ LYS 80 2HZ LYS 80 3.885 -12.141 2.418 636 HA PRO 81 HA PRO 81 -1.604 -5.913 2.495 637 1HB PRO 81 1HB PRO 81 -3.235 -8.014 1.790 638 2HB PRO 81 2HB PRO 81 -2.555 -6.893 0.609 639 1HG PRO 81 1HG PRO 81 -1.474 -9.656 1.389 640 2HG PRO 81 2HG PRO 81 -1.884 -9.079 -0.249 641 1HD PRO 81 1HD PRO 81 0.691 -8.967 0.787 642 2HD PRO 81 2HD PRO 81 0.094 -7.718 -0.353 643 H GLY 82 H GLY 82 0.401 -6.867 4.278 644 1HA GLY 82 1HA GLY 82 0.992 -8.271 6.142 645 2HA GLY 82 2HA GLY 82 -0.569 -7.708 6.688 646 H LYS 83 H LYS 83 -0.685 -9.846 4.026 647 HA LYS 83 HA LYS 83 -1.427 -12.063 3.679 648 1HB LYS 83 2HB LYS 83 -0.230 -12.474 6.423 649 2HB LYS 83 1HB LYS 83 -1.586 -13.502 6.135 650 1HG LYS 83 1HG LYS 83 -0.468 -14.325 3.971 651 2HG LYS 83 2HG LYS 83 0.891 -13.240 4.283 652 1HD LYS 83 1HD LYS 83 1.368 -14.464 6.453 653 2HD LYS 83 2HD LYS 83 0.010 -15.551 6.136 654 1HE LYS 83 1HE LYS 83 1.141 -16.340 3.995 655 2HE LYS 83 2HE LYS 83 2.501 -15.253 4.315 656 1HZ LYS 83 1HZ LYS 83 2.925 -17.500 5.060 657 2HZ LYS 83 2HZ LYS 83 1.624 -17.495 6.051 658 H ALA 84 H ALA 84 -2.519 -10.740 6.543 659 HA ALA 84 HA ALA 84 -5.183 -11.834 6.959 660 1HB ALA 84 3HB ALA 84 -3.728 -9.208 7.629 661 2HB ALA 84 1HB ALA 84 -5.233 -9.725 8.432 662 3HB ALA 84 2HB ALA 84 -3.722 -10.685 8.624 663 H LEU 85 H LEU 85 -4.184 -8.618 5.354 664 HA LEU 85 HA LEU 85 -6.909 -7.972 4.555 665 1HB LEU 85 2HB LEU 85 -5.162 -6.215 4.662 666 2HB LEU 85 1HB LEU 85 -4.225 -7.033 3.438 667 HG LEU 85 HG LEU 85 -6.259 -6.897 1.980 668 1HD1 LEU 85 2HD1 LEU 85 -7.099 -4.770 3.992 669 2HD1 LEU 85 3HD1 LEU 85 -7.788 -4.867 2.343 670 3HD1 LEU 85 1HD1 LEU 85 -8.021 -6.195 3.497 671 1HD2 LEU 85 1HD2 LEU 85 -4.175 -5.582 1.540 672 2HD2 LEU 85 2HD2 LEU 85 -5.581 -4.614 1.104 673 3HD2 LEU 85 3HD2 LEU 85 -4.714 -4.297 2.633 674 H LYS 86 H LYS 86 -4.345 -9.914 3.075 675 HA LYS 86 HA LYS 86 -5.644 -10.428 0.511 676 1HB LYS 86 1HB LYS 86 -3.192 -11.119 1.319 677 2HB LYS 86 2HB LYS 86 -3.950 -12.623 1.797 678 1HG LYS 86 1HG LYS 86 -4.831 -12.861 -0.605 679 2HG LYS 86 2HG LYS 86 -3.952 -11.406 -1.044 680 1HD LYS 86 1HD LYS 86 -2.686 -14.001 0.063 681 2HD LYS 86 2HD LYS 86 -2.801 -13.573 -1.640 682 1HE LYS 86 1HE LYS 86 -1.347 -11.516 -1.231 683 2HE LYS 86 2HE LYS 86 -1.186 -11.981 0.469 684 1HZ LYS 86 1HZ LYS 86 0.665 -12.733 -0.855 685 2HZ LYS 86 2HZ LYS 86 -0.301 -13.593 -1.855 686 H ASP 87 H ASP 87 -6.422 -11.779 3.692 687 HA ASP 87 HA ASP 87 -8.319 -13.793 2.576 688 1HB ASP 87 1HB ASP 87 -6.870 -13.372 5.047 689 2HB ASP 87 2HB ASP 87 -8.471 -12.926 5.470 690 HD1 ASP 87 HD2 ASP 87 -9.744 -16.185 5.260 691 H ALA 88 H ALA 88 -8.539 -10.539 4.106 692 HA ALA 88 HA ALA 88 -11.410 -10.140 4.209 693 1HB ALA 88 1HB ALA 88 -9.650 -8.388 5.010 694 2HB ALA 88 2HB ALA 88 -9.275 -8.042 3.320 695 3HB ALA 88 3HB ALA 88 -10.869 -7.663 3.922 696 H VAL 89 H VAL 89 -9.114 -9.677 1.486 697 HA VAL 89 HA VAL 89 -11.102 -8.449 -0.283 698 HB VAL 89 HB VAL 89 -8.648 -7.797 0.642 699 1HG1 VAL 89 2HG2 VAL 89 -7.699 -10.098 -0.051 700 2HG1 VAL 89 3HG2 VAL 89 -7.696 -9.501 -1.712 701 3HG1 VAL 89 1HG2 VAL 89 -6.775 -8.644 -0.428 702 1HG2 VAL 89 2HG1 VAL 89 -9.832 -6.510 -0.869 703 2HG2 VAL 89 3HG1 VAL 89 -8.082 -6.601 -1.210 704 3HG2 VAL 89 1HG1 VAL 89 -9.242 -7.526 -2.255 705 H LYS 90 H LYS 90 -9.909 -11.666 0.103 706 HA LYS 90 HA LYS 90 -9.785 -12.605 -2.633 707 1HB LYS 90 1HB LYS 90 -9.720 -13.744 0.159 708 2HB LYS 90 2HB LYS 90 -10.486 -14.838 -0.950 709 1HG LYS 90 1HG LYS 90 -8.521 -14.848 -2.462 710 2HG LYS 90 2HG LYS 90 -7.738 -13.584 -1.518 711 1HD LYS 90 1HD LYS 90 -7.760 -15.141 0.522 712 2HD LYS 90 2HD LYS 90 -8.442 -16.414 -0.496 713 1HE LYS 90 1HE LYS 90 -6.379 -16.311 -1.986 714 2HE LYS 90 2HE LYS 90 -5.711 -15.026 -0.967 715 1HZ LYS 90 1HZ LYS 90 -5.715 -16.547 0.898 716 2HZ LYS 90 2HZ LYS 90 -4.827 -17.140 -0.340 717 1H MET 1 1H MET 91 7.799 -0.469 13.705 718 2H MET 1 2H MET 91 7.871 -1.780 12.654 719 HA MET 1 HA MET 91 6.176 0.573 12.633 720 1HB MET 1 1HB MET 91 7.443 -0.674 10.137 721 2HB MET 1 2HB MET 91 6.011 0.323 10.038 722 1HG MET 1 1HG MET 91 8.678 1.363 11.199 723 2HG MET 1 2HG MET 91 8.275 1.425 9.489 724 1HE MET 1 2HE MET 91 6.899 3.128 8.340 725 2HE MET 1 1HE MET 91 5.411 2.336 8.942 726 3HE MET 1 3HE MET 91 5.581 4.085 9.077 727 H ASN 2 H ASN 92 6.292 -2.831 12.629 728 HA ASN 2 HA ASN 92 4.262 -3.946 12.093 729 1HB ASN 2 1HB ASN 92 4.479 -5.580 13.884 730 2HB ASN 2 2HB ASN 92 5.951 -5.008 13.166 731 1HD2 ASN 2 1HD2 ASN 92 5.292 -3.931 17.113 732 2HD2 ASN 2 2HD2 ASN 92 3.937 -4.564 16.062 733 H LYS 3 H LYS 93 3.422 -1.775 12.951 734 HA LYS 3 HA LYS 93 1.057 -0.825 12.815 735 1HB LYS 3 1HB LYS 93 0.208 -3.115 12.222 736 2HB LYS 3 2HB LYS 93 0.029 -3.488 13.925 737 1HG LYS 3 1HG LYS 93 -1.648 -1.678 14.215 738 2HG LYS 3 2HG LYS 93 -1.390 -1.097 12.579 739 1HD LYS 3 1HD LYS 93 -2.411 -3.942 13.161 740 2HD LYS 3 2HD LYS 93 -3.499 -2.575 13.103 741 1HE LYS 3 1HE LYS 93 -1.696 -3.386 10.721 742 2HE LYS 3 2HE LYS 93 -3.345 -3.954 10.950 743 1HZ LYS 3 1HZ LYS 93 -2.545 -1.119 10.625 744 2HZ LYS 3 2HZ LYS 93 -3.246 -2.060 9.486 745 H THR 4 H THR 94 2.622 -2.227 15.654 746 HA THR 4 HA THR 94 1.359 -0.307 17.464 747 HB THR 4 HB THR 94 2.943 -2.957 17.620 748 HG1 THR 4 HG1 THR 94 1.010 -3.593 18.647 749 1HG2 THR 4 3HG2 THR 94 2.070 -1.076 19.814 750 2HG2 THR 4 1HG2 THR 94 2.565 -2.825 20.041 751 3HG2 THR 4 2HG2 THR 94 3.734 -1.617 19.382 752 H GLU 5 H GLU 95 4.483 -1.184 16.011 753 HA GLU 5 HA GLU 95 6.026 0.972 17.440 754 1HB GLU 5 1HB GLU 95 6.675 -0.816 15.050 755 2HB GLU 5 2HB GLU 95 7.730 0.497 15.549 756 1HG GLU 5 1HG GLU 95 6.994 -1.979 17.243 757 2HG GLU 5 2HG GLU 95 8.477 -1.749 16.341 758 HE2 GLU 5 HE2 GLU 95 6.704 -0.947 19.039 759 H LEU 6 H LEU 96 3.578 0.706 14.908 760 HA LEU 6 HA LEU 96 4.139 3.245 13.604 761 1HB LEU 6 2HB LEU 96 2.455 0.951 13.159 762 2HB LEU 6 1HB LEU 96 1.294 2.051 13.842 763 HG LEU 6 HG LEU 96 1.445 2.258 11.447 764 1HD1 LEU 6 2HD1 LEU 96 1.274 4.501 12.619 765 2HD1 LEU 6 3HD1 LEU 96 2.987 4.750 12.199 766 3HD1 LEU 6 1HD1 LEU 96 1.794 4.540 10.935 767 1HD2 LEU 6 2HD2 LEU 96 3.586 1.194 10.941 768 2HD2 LEU 6 3HD2 LEU 96 3.366 2.687 10.007 769 3HD2 LEU 6 1HD2 LEU 96 4.441 2.672 11.430 770 H ILE 7 H ILE 97 2.121 2.084 16.346 771 HA ILE 7 HA ILE 97 0.667 4.535 16.835 772 HB ILE 7 HB ILE 97 1.553 2.496 18.963 773 1HG1 ILE 7 1HG1 ILE 97 -1.116 2.592 17.457 774 2HG1 ILE 7 2HG1 ILE 97 0.179 1.651 16.845 775 1HG2 ILE 7 2HG2 ILE 97 0.679 4.664 19.968 776 2HG2 ILE 7 3HG2 ILE 97 -0.804 4.465 19.028 777 3HG2 ILE 7 1HG2 ILE 97 -0.402 3.299 20.302 778 1HD1 ILE 7 3HD1 ILE 97 0.318 0.397 19.078 779 2HD1 ILE 7 1HD1 ILE 97 -1.298 1.040 19.387 780 3HD1 ILE 7 2HD1 ILE 97 -1.000 0.053 17.921 781 H ASN 8 H ASN 98 3.770 3.423 18.110 782 HA ASN 8 HA ASN 98 4.399 6.120 19.314 783 1HB ASN 8 1HB ASN 98 6.422 3.861 18.555 784 2HB ASN 8 2HB ASN 98 6.812 5.260 19.523 785 1HD2 ASN 8 2HD2 ASN 98 5.129 2.063 21.416 786 2HD2 ASN 8 1HD2 ASN 98 5.339 2.116 19.593 787 H ALA 9 H ALA 99 4.367 5.257 16.055 788 HA ALA 9 HA ALA 99 6.448 7.251 15.129 789 1HB ALA 9 2HB ALA 99 5.595 5.183 13.551 790 2HB ALA 9 3HB ALA 99 4.062 6.032 13.477 791 3HB ALA 9 1HB ALA 99 5.424 6.815 12.796 792 H VAL 10 H VAL 100 2.866 6.972 15.320 793 HA VAL 10 HA VAL 100 2.407 9.455 14.062 794 HB VAL 10 HB VAL 100 0.263 8.134 15.752 795 1HG1 VAL 10 3HG2 VAL 100 0.048 10.278 14.124 796 2HG1 VAL 10 1HG2 VAL 100 -0.285 8.971 12.943 797 3HG1 VAL 10 2HG2 VAL 100 -1.260 9.079 14.413 798 1HG2 VAL 10 1HG1 VAL 100 1.534 7.000 13.261 799 2HG2 VAL 10 2HG1 VAL 100 1.106 6.279 14.848 800 3HG2 VAL 10 3HG1 VAL 100 -0.201 6.647 13.688 801 H ALA 11 H ALA 101 2.084 8.256 17.236 802 HA ALA 11 HA ALA 101 1.492 10.820 18.297 803 1HB ALA 11 2HB ALA 101 0.875 8.651 19.484 804 2HB ALA 11 3HB ALA 101 2.599 8.318 19.788 805 3HB ALA 11 1HB ALA 101 1.785 9.688 20.612 806 H GLU 12 H GLU 102 4.620 9.442 17.551 807 HA GLU 12 HA GLU 102 6.088 11.546 19.113 808 1HB GLU 12 1HB GLU 102 7.174 9.332 18.762 809 2HB GLU 12 2HB GLU 102 7.092 9.527 17.009 810 1HG GLU 12 1HG GLU 102 8.685 11.477 17.138 811 2HG GLU 12 2HG GLU 102 8.722 11.350 18.895 812 HE1 GLU 12 HE2 GLU 102 10.701 8.729 16.509 813 H THR 13 H THR 103 5.364 10.945 15.594 814 HA THR 13 HA THR 103 6.280 13.776 15.096 815 HB THR 13 HB THR 103 6.930 11.676 13.811 816 HG1 THR 13 HG1 THR 103 7.309 12.991 12.008 817 1HG2 THR 13 3HG2 THR 103 4.701 10.902 13.038 818 2HG2 THR 13 1HG2 THR 103 4.540 12.393 12.075 819 3HG2 THR 13 2HG2 THR 103 5.833 11.214 11.701 820 H SER 14 H SER 104 3.659 12.968 16.121 821 HA SER 14 HA SER 104 2.250 15.478 14.988 822 1HB SER 14 1HB SER 104 0.651 12.895 15.514 823 2HB SER 14 2HB SER 104 -0.007 14.443 15.019 824 HG SER 14 HG SER 104 0.334 13.064 13.284 825 H GLY 15 H GLY 105 2.695 13.519 17.952 826 1HA GLY 15 1HA GLY 105 2.129 14.009 20.192 827 2HA GLY 15 2HA GLY 105 2.019 15.699 19.721 828 H LEU 16 H LEU 106 0.194 12.752 19.236 829 HA LEU 16 HA LEU 106 -2.419 13.910 20.242 830 1HB LEU 16 1HB LEU 106 -3.555 12.263 18.922 831 2HB LEU 16 2HB LEU 106 -2.766 13.568 18.058 832 HG LEU 16 HG LEU 106 -1.024 12.289 17.335 833 1HD1 LEU 16 2HD1 LEU 106 -0.589 10.838 19.390 834 2HD1 LEU 16 3HD1 LEU 106 -1.980 9.861 18.826 835 3HD1 LEU 16 1HD1 LEU 106 -0.459 10.006 17.836 836 1HD2 LEU 16 2HD2 LEU 106 -2.502 12.120 15.752 837 2HD2 LEU 16 3HD2 LEU 106 -1.257 10.849 15.852 838 3HD2 LEU 16 1HD2 LEU 106 -2.897 10.463 16.343 839 H SER 17 H SER 107 -2.653 10.973 20.331 840 HA SER 17 HA SER 107 -1.621 10.371 23.152 841 1HB SER 17 1HB SER 107 -4.462 9.567 22.398 842 2HB SER 17 2HB SER 107 -3.626 9.278 23.904 843 HG SER 17 HG SER 107 -3.472 11.527 24.213 844 H LYS 18 H LYS 108 -1.441 8.125 23.613 845 HA LYS 18 HA LYS 108 -0.513 6.434 21.296 846 1HB LYS 18 1HB LYS 108 -0.814 5.582 24.230 847 2HB LYS 18 2HB LYS 108 -0.161 4.580 22.948 848 1HG LYS 18 1HG LYS 108 1.075 7.212 23.958 849 2HG LYS 18 2HG LYS 108 1.607 5.594 24.378 850 1HD LYS 18 1HD LYS 108 2.248 5.129 22.000 851 2HD LYS 18 2HD LYS 108 1.689 6.711 21.492 852 1HE LYS 18 1HE LYS 108 4.001 6.230 23.486 853 2HE LYS 18 2HE LYS 108 4.183 6.551 21.761 854 1HZ LYS 18 1HZ LYS 108 4.493 8.538 23.018 855 2HZ LYS 18 2HZ LYS 108 3.187 8.703 22.048 856 H LYS 19 H LYS 109 -3.339 6.411 23.454 857 HA LYS 19 HA LYS 109 -4.843 4.343 21.967 858 1HB LYS 19 2HB LYS 109 -5.920 6.665 23.674 859 2HB LYS 19 1HB LYS 109 -6.938 5.387 23.019 860 1HG LYS 19 1HG LYS 109 -4.658 4.967 25.052 861 2HG LYS 19 2HG LYS 109 -6.367 5.105 25.431 862 1HD LYS 19 1HD LYS 109 -6.853 3.034 24.042 863 2HD LYS 19 2HD LYS 109 -5.126 2.863 23.712 864 1HE LYS 19 1HE LYS 109 -4.665 2.635 26.202 865 2HE LYS 19 2HE LYS 109 -6.396 2.796 26.535 866 1HZ LYS 19 1HZ LYS 109 -5.692 0.500 26.451 867 2HZ LYS 19 2HZ LYS 109 -5.128 0.650 24.924 868 H ASP 20 H ASP 110 -4.489 7.917 21.380 869 HA ASP 20 HA ASP 110 -6.544 7.850 19.172 870 1HB ASP 20 1HB ASP 110 -4.499 9.980 20.074 871 2HB ASP 20 2HB ASP 110 -5.332 10.176 18.559 872 HD1 ASP 20 HD2 ASP 110 -8.474 10.841 19.835 873 H ALA 21 H ALA 111 -3.062 7.405 19.306 874 HA ALA 21 HA ALA 111 -2.629 7.421 16.366 875 1HB ALA 21 1HB ALA 111 -0.894 6.611 18.786 876 2HB ALA 21 2HB ALA 111 -0.347 6.456 17.089 877 3HB ALA 21 3HB ALA 111 -0.773 8.009 17.750 878 H THR 22 H THR 112 -3.202 4.792 18.783 879 HA THR 22 HA THR 112 -3.055 2.536 16.982 880 HB THR 22 HB THR 112 -4.980 2.776 19.393 881 HG1 THR 22 HG1 THR 112 -2.957 3.561 19.991 882 1HG2 THR 22 2HG2 THR 112 -3.277 0.490 18.230 883 2HG2 THR 22 3HG2 THR 112 -4.208 0.389 19.752 884 3HG2 THR 22 1HG2 THR 112 -5.054 0.618 18.180 885 H LYS 23 H LYS 113 -5.818 4.480 17.909 886 HA LYS 23 HA LYS 113 -7.824 3.255 16.147 887 1HB LYS 23 2HB LYS 113 -7.377 6.132 17.305 888 2HB LYS 23 1HB LYS 113 -8.805 5.779 16.410 889 1HG LYS 23 1HG LYS 113 -9.572 4.058 18.071 890 2HG LYS 23 2HG LYS 113 -8.071 4.214 18.978 891 1HD LYS 23 1HD LYS 113 -8.606 6.649 19.443 892 2HD LYS 23 2HD LYS 113 -10.140 6.476 18.608 893 1HE LYS 23 1HE LYS 113 -9.316 4.864 21.124 894 2HE LYS 23 2HE LYS 113 -10.257 6.353 21.151 895 1HZ LYS 23 1HZ LYS 113 -11.983 5.277 19.872 896 2HZ LYS 23 2HZ LYS 113 -11.693 4.469 21.263 897 H ALA 24 H ALA 114 -5.941 6.152 15.710 898 HA ALA 24 HA ALA 114 -6.857 6.902 13.128 899 1HB ALA 24 2HB ALA 114 -5.822 8.404 14.643 900 2HB ALA 24 3HB ALA 114 -4.254 7.526 14.556 901 3HB ALA 24 1HB ALA 114 -4.888 8.410 13.122 902 H VAL 25 H VAL 115 -4.126 4.787 13.845 903 HA VAL 25 HA VAL 115 -3.397 4.174 11.010 904 HB VAL 25 HB VAL 115 -3.142 3.016 13.948 905 1HG1 VAL 25 2HG2 VAL 115 -2.263 1.357 11.512 906 2HG1 VAL 25 3HG2 VAL 115 -1.772 1.060 13.223 907 3HG1 VAL 25 1HG2 VAL 115 -3.456 0.915 12.742 908 1HG2 VAL 25 1HG1 VAL 115 -1.589 4.805 13.224 909 2HG2 VAL 25 2HG1 VAL 115 -0.760 3.315 13.693 910 3HG2 VAL 25 3HG1 VAL 115 -0.932 3.733 11.953 911 H ASP 26 H ASP 116 -5.436 2.331 13.405 912 HA ASP 26 HA ASP 116 -6.807 0.867 11.118 913 1HB ASP 26 1HB ASP 116 -7.430 0.971 14.139 914 2HB ASP 26 2HB ASP 116 -8.292 -0.050 12.994 915 HD2 ASP 26 HD2 ASP 116 -4.762 -1.207 14.467 916 H ALA 27 H ALA 117 -6.990 3.668 11.456 917 HA ALA 27 HA ALA 117 -9.890 4.242 10.753 918 1HB ALA 27 2HB ALA 117 -8.864 5.719 12.526 919 2HB ALA 27 3HB ALA 117 -7.653 6.190 11.318 920 3HB ALA 27 1HB ALA 117 -9.346 6.533 11.027 921 H VAL 28 H VAL 118 -6.602 4.831 9.595 922 HA VAL 28 HA VAL 118 -7.327 5.488 6.792 923 HB VAL 28 HB VAL 118 -4.771 4.034 6.609 924 1HG1 VAL 28 1HG2 VAL 118 -5.493 5.812 5.315 925 2HG1 VAL 28 2HG2 VAL 118 -5.280 6.949 6.750 926 3HG1 VAL 28 3HG2 VAL 118 -3.871 6.046 6.048 927 1HG2 VAL 28 2HG1 VAL 118 -4.476 5.979 8.931 928 2HG2 VAL 28 3HG1 VAL 118 -4.271 4.193 8.975 929 3HG2 VAL 28 1HG1 VAL 118 -3.191 5.152 7.996 930 H PHE 29 H PHE 119 -5.830 2.812 8.122 931 HA PHE 29 HA PHE 119 -6.266 0.813 6.045 932 1HB PHE 29 2HB PHE 119 -5.305 0.313 8.891 933 2HB PHE 29 1HB PHE 119 -5.069 -0.772 7.538 934 HD1 PHE 29 HD2 PHE 119 -4.204 0.897 5.273 935 HD2 PHE 29 HD1 PHE 119 -3.132 1.181 9.423 936 HE1 PHE 29 HE2 PHE 119 -2.216 2.184 4.665 937 HE2 PHE 29 HE1 PHE 119 -1.145 2.476 8.805 938 HZ PHE 29 HZ PHE 119 -0.706 2.996 6.406 939 H ASP 30 H ASP 120 -8.529 1.720 8.373 940 HA ASP 30 HA ASP 120 -10.092 -0.819 7.894 941 1HB ASP 30 1HB ASP 120 -10.093 0.610 10.113 942 2HB ASP 30 2HB ASP 120 -11.171 1.717 9.309 943 HD2 ASP 30 HD2 ASP 120 -13.985 -0.260 9.504 944 H SER 31 H SER 121 -10.102 2.460 6.966 945 HA SER 31 HA SER 121 -12.587 2.380 5.234 946 1HB SER 31 2HB SER 121 -10.450 4.580 5.422 947 2HB SER 31 1HB SER 121 -11.947 4.670 4.463 948 HG SER 31 HG SER 121 -13.108 4.321 6.396 949 H ILE 32 H ILE 122 -8.939 2.143 4.516 950 HA ILE 32 HA ILE 122 -9.094 1.799 1.740 951 HB ILE 32 HB ILE 122 -7.122 0.307 3.445 952 1HG1 ILE 32 1HG1 ILE 122 -7.559 3.249 3.425 953 2HG1 ILE 32 2HG1 ILE 122 -6.986 2.064 4.582 954 1HG2 ILE 32 3HG2 ILE 122 -7.406 0.340 0.737 955 2HG2 ILE 32 1HG2 ILE 122 -6.614 1.903 0.909 956 3HG2 ILE 32 2HG2 ILE 122 -5.784 0.432 1.459 957 1HD1 ILE 32 3HD1 ILE 122 -4.787 2.049 3.468 958 2HD1 ILE 32 1HD1 ILE 122 -5.403 3.435 2.459 959 3HD1 ILE 32 2HD1 ILE 122 -5.310 3.596 4.255 960 H THR 33 H THR 123 -9.051 -0.703 4.306 961 HA THR 33 HA THR 123 -9.490 -2.920 2.382 962 HB THR 33 HB THR 123 -8.713 -3.508 4.626 963 HG1 THR 33 HG1 THR 123 -10.116 -5.161 5.137 964 1HG2 THR 33 2HG2 THR 123 -9.911 -1.736 5.926 965 2HG2 THR 33 3HG2 THR 123 -11.398 -2.679 5.851 966 3HG2 THR 33 1HG2 THR 123 -9.950 -3.320 6.712 967 H GLU 34 H GLU 124 -11.827 -0.708 3.814 968 HA GLU 34 HA GLU 124 -14.174 -2.211 2.694 969 1HB GLU 34 1HB GLU 124 -13.871 0.674 3.791 970 2HB GLU 34 2HB GLU 124 -15.368 0.134 3.071 971 1HG GLU 34 1HG GLU 124 -14.070 -1.153 5.562 972 2HG GLU 34 2HG GLU 124 -15.359 0.034 5.581 973 HE2 GLU 34 HE2 GLU 124 -16.099 -3.849 4.856 974 H ALA 35 H ALA 125 -12.013 0.396 1.423 975 HA ALA 35 HA ALA 125 -13.411 0.545 -1.133 976 1HB ALA 35 2HB ALA 125 -11.414 2.212 -0.352 977 2HB ALA 35 3HB ALA 125 -10.321 0.878 -0.696 978 3HB ALA 35 1HB ALA 125 -11.205 1.608 -2.000 979 H LEU 36 H LEU 126 -10.556 -1.413 -0.162 980 HA LEU 36 HA LEU 126 -10.144 -2.838 -2.644 981 1HB LEU 36 2HB LEU 126 -9.349 -3.769 0.051 982 2HB LEU 36 1HB LEU 126 -8.606 -4.128 -1.493 983 HG LEU 36 HG LEU 126 -8.513 -1.369 -0.167 984 1HD1 LEU 36 3HD2 LEU 126 -6.772 -2.818 0.573 985 2HD1 LEU 36 1HD2 LEU 126 -6.252 -3.102 -1.150 986 3HD1 LEU 36 2HD2 LEU 126 -6.137 -1.470 -0.410 987 1HD2 LEU 36 3HD1 LEU 126 -8.979 -0.943 -2.572 988 2HD2 LEU 36 1HD1 LEU 126 -7.378 -0.428 -2.099 989 3HD2 LEU 36 2HD1 LEU 126 -7.578 -1.966 -3.014 990 NH1 ARG 37 NH2 ARG 127 -14.208 -9.056 4.513 991 NH2 ARG 37 NH1 ARG 127 -16.350 -9.796 4.352 992 H ARG 37 H ARG 127 -11.818 -3.886 0.388 993 HA ARG 37 HA ARG 127 -12.584 -6.390 -0.693 994 1HB ARG 37 1HB ARG 127 -12.596 -5.825 1.760 995 2HB ARG 37 2HB ARG 127 -13.944 -4.714 1.504 996 1HG ARG 37 1HG ARG 127 -15.364 -6.787 0.820 997 2HG ARG 37 2HG ARG 127 -13.998 -7.781 1.326 998 1HD ARG 37 1HD ARG 127 -14.115 -6.539 3.630 999 2HD ARG 37 2HD ARG 127 -15.554 -5.730 3.035 1000 1HH1 ARG 37 2HH2 ARG 127 -13.526 -8.325 4.282 1001 2HH1 ARG 37 1HH2 ARG 127 -14.034 -9.913 5.048 1002 1HH2 ARG 37 1HH1 ARG 127 -17.301 -9.632 4.004 1003 2HH2 ARG 37 2HH1 ARG 127 -16.026 -10.602 4.897 1004 H LYS 38 H LYS 128 -14.001 -3.156 -1.214 1005 HA LYS 38 HA LYS 128 -16.638 -4.353 -2.186 1006 1HB LYS 38 1HB LYS 128 -16.613 -2.506 -0.420 1007 2HB LYS 38 2HB LYS 128 -16.001 -1.404 -1.651 1008 1HG LYS 38 1HG LYS 128 -18.157 -1.671 -2.938 1009 2HG LYS 38 2HG LYS 128 -18.670 -2.939 -1.836 1010 1HD LYS 38 1HD LYS 128 -19.848 -0.948 -1.227 1011 2HD LYS 38 2HD LYS 128 -18.709 -1.287 0.071 1012 1HE LYS 38 1HE LYS 128 -17.138 0.508 -0.865 1013 2HE LYS 38 2HE LYS 128 -18.291 0.821 -2.170 1014 1HZ LYS 38 1HZ LYS 128 -18.824 1.152 0.731 1015 2HZ LYS 38 2HZ LYS 128 -18.524 2.359 -0.330 1016 H GLY 39 H GLY 129 -13.768 -3.903 -3.660 1017 1HA GLY 39 1HA GLY 129 -13.117 -3.533 -5.955 1018 2HA GLY 39 2HA GLY 129 -14.810 -3.536 -6.407 1019 H ASP 40 H ASP 130 -13.059 -1.406 -4.216 1020 HA ASP 40 HA ASP 130 -13.513 1.057 -5.963 1021 1HB ASP 40 1HB ASP 130 -14.136 0.672 -3.030 1022 2HB ASP 40 2HB ASP 130 -13.913 2.271 -3.706 1023 HD1 ASP 40 HD2 ASP 130 -16.914 2.351 -5.404 1024 H LYS 41 H LYS 131 -12.301 2.746 -5.899 1025 HA LYS 41 HA LYS 131 -9.388 2.246 -5.231 1026 1HB LYS 41 2HB LYS 131 -10.534 4.645 -6.752 1027 2HB LYS 41 1HB LYS 131 -8.830 4.235 -6.548 1028 1HG LYS 41 1HG LYS 131 -9.359 2.014 -7.825 1029 2HG LYS 41 2HG LYS 131 -10.920 2.721 -8.221 1030 1HD LYS 41 1HD LYS 131 -9.763 4.683 -9.322 1031 2HD LYS 41 2HD LYS 131 -8.188 4.006 -8.886 1032 1HE LYS 41 1HE LYS 131 -8.677 1.945 -10.291 1033 2HE LYS 41 2HE LYS 131 -10.248 2.626 -10.741 1034 1HZ LYS 41 1HZ LYS 131 -8.569 3.053 -12.403 1035 2HZ LYS 41 2HZ LYS 131 -7.595 3.816 -11.335 1036 H VAL 42 H VAL 132 -8.357 3.330 -3.599 1037 HA VAL 42 HA VAL 132 -9.611 5.148 -1.771 1038 HB VAL 42 HB VAL 132 -6.834 3.862 -2.150 1039 1HG1 VAL 42 1HG2 VAL 132 -7.126 5.527 -0.180 1040 2HG1 VAL 42 2HG2 VAL 132 -8.305 4.362 0.471 1041 3HG1 VAL 42 3HG2 VAL 132 -6.614 3.863 0.205 1042 1HG2 VAL 42 3HG1 VAL 132 -8.783 2.071 -2.121 1043 2HG2 VAL 42 1HG1 VAL 132 -7.616 1.919 -0.847 1044 3HG2 VAL 42 2HG1 VAL 132 -9.168 2.685 -0.492 1045 H GLN 43 H GLN 133 -6.909 6.235 -1.604 1046 HA GLN 43 HA GLN 133 -5.563 7.292 -3.064 1047 1HB GLN 43 1HB GLN 133 -7.608 9.040 -4.270 1048 2HB GLN 43 2HB GLN 133 -5.938 9.602 -4.244 1049 1HG GLN 43 1HG GLN 133 -5.121 7.549 -5.270 1050 2HG GLN 43 2HG GLN 133 -6.686 6.808 -5.283 1051 1HE2 GLN 43 2HE2 GLN 133 -7.456 8.274 -8.474 1052 2HE2 GLN 43 1HE2 GLN 133 -7.768 6.994 -7.198 1053 H LEU 44 H LEU 134 -3.912 8.485 -2.857 1054 HA LEU 44 HA LEU 134 -3.766 10.346 -0.454 1055 1HB LEU 44 2HB LEU 134 -1.611 8.212 -1.026 1056 2HB LEU 44 1HB LEU 134 -1.725 9.316 0.335 1057 HG LEU 44 HG LEU 134 -4.085 7.950 0.672 1058 1HD1 LEU 44 1HD1 LEU 134 -3.749 6.405 -1.305 1059 2HD1 LEU 44 2HD1 LEU 134 -2.258 5.788 -0.563 1060 3HD1 LEU 44 3HD1 LEU 134 -3.835 5.539 0.232 1061 1HD2 LEU 44 3HD2 LEU 134 -2.255 8.200 2.390 1062 2HD2 LEU 44 1HD2 LEU 134 -2.956 6.569 2.392 1063 3HD2 LEU 44 2HD2 LEU 134 -1.366 6.851 1.646 1064 H ILE 45 H ILE 135 -3.084 12.265 -1.412 1065 HA ILE 45 HA ILE 135 -1.636 12.245 -3.991 1066 HB ILE 45 HB ILE 135 -3.415 13.888 -3.481 1067 1HG1 ILE 45 1HG1 ILE 135 -0.785 15.202 -4.381 1068 2HG1 ILE 45 2HG1 ILE 135 -1.702 14.081 -5.371 1069 1HG2 ILE 45 3HG2 ILE 135 -2.723 14.533 -1.171 1070 2HG2 ILE 45 1HG2 ILE 135 -1.275 15.347 -1.814 1071 3HG2 ILE 45 2HG2 ILE 135 -2.909 15.958 -2.218 1072 1HD1 ILE 45 2HD1 ILE 135 -3.709 15.623 -5.326 1073 2HD1 ILE 45 3HD1 ILE 135 -2.756 16.808 -4.392 1074 3HD1 ILE 45 1HD1 ILE 135 -2.261 16.371 -6.041 1075 H GLY 46 H GLY 136 0.380 13.037 -4.378 1076 1HA GLY 46 1HA GLY 136 2.761 12.923 -4.130 1077 2HA GLY 46 2HA GLY 136 2.506 13.620 -2.550 1078 H PHE 47 H PHE 137 1.123 10.462 -2.779 1079 HA PHE 47 HA PHE 137 3.578 8.951 -1.973 1080 1HB PHE 47 2HB PHE 137 2.352 10.173 -0.076 1081 2HB PHE 47 1HB PHE 137 0.923 9.223 -0.362 1082 HD1 PHE 47 HD1 PHE 137 4.645 8.658 0.260 1083 HD2 PHE 47 HD2 PHE 137 0.668 7.076 0.667 1084 HE1 PHE 47 HE1 PHE 137 5.547 6.531 1.140 1085 HE2 PHE 47 HE2 PHE 137 1.602 5.001 1.593 1086 HZ PHE 47 HZ PHE 137 4.065 4.744 1.795 1087 H GLY 48 H GLY 138 0.087 8.594 -2.970 1088 1HA GLY 48 1HA GLY 138 0.550 6.086 -4.161 1089 2HA GLY 48 2HA GLY 138 0.071 5.670 -2.525 1090 H ASN 49 H ASN 139 -1.035 4.693 -4.664 1091 HA ASN 49 HA ASN 139 -3.938 5.648 -4.471 1092 1HB ASN 49 1HB ASN 139 -2.675 4.772 -7.153 1093 2HB ASN 49 2HB ASN 139 -4.353 5.159 -6.857 1094 1HD2 ASN 49 1HD2 ASN 139 -3.101 8.083 -8.637 1095 2HD2 ASN 49 2HD2 ASN 139 -3.519 6.316 -8.902 1096 H PHE 50 H PHE 140 -4.623 3.921 -3.252 1097 HA PHE 50 HA PHE 140 -3.685 1.116 -3.895 1098 1HB PHE 50 2HB PHE 140 -5.786 1.914 -1.857 1099 2HB PHE 50 1HB PHE 140 -5.358 0.265 -2.189 1100 HD1 PHE 50 HD2 PHE 140 -4.313 3.465 -0.731 1101 HD2 PHE 50 HD1 PHE 140 -3.734 -0.772 -0.879 1102 HE1 PHE 50 HE2 PHE 140 -2.916 3.568 1.352 1103 HE2 PHE 50 HE1 PHE 140 -2.350 -0.634 1.165 1104 HZ PHE 50 HZ PHE 140 -1.800 1.544 2.122 1105 H GLU 51 H GLU 141 -4.899 -0.369 -4.844 1106 HA GLU 51 HA GLU 141 -7.762 -0.235 -5.122 1107 1HB GLU 51 1HB GLU 141 -8.061 -0.015 -7.604 1108 2HB GLU 51 2HB GLU 141 -7.338 1.436 -6.972 1109 1HG GLU 51 1HG GLU 141 -5.759 -0.777 -8.449 1110 2HG GLU 51 2HG GLU 141 -6.456 0.634 -9.216 1111 HE2 GLU 51 HE2 GLU 141 -2.925 0.856 -7.392 1112 H VAL 52 H VAL 142 -8.822 -2.095 -6.146 1113 HA VAL 52 HA VAL 142 -7.083 -4.431 -5.742 1114 HB VAL 52 HB VAL 142 -9.558 -3.433 -4.721 1115 1HG1 VAL 52 1HG2 VAL 142 -10.280 -5.527 -6.784 1116 2HG1 VAL 52 2HG2 VAL 142 -11.294 -4.970 -5.403 1117 3HG1 VAL 52 3HG2 VAL 142 -10.794 -3.833 -6.698 1118 1HG2 VAL 52 1HG1 VAL 142 -8.501 -6.263 -4.574 1119 2HG2 VAL 52 2HG1 VAL 142 -8.071 -4.864 -3.543 1120 3HG2 VAL 52 3HG1 VAL 142 -9.711 -5.498 -3.529 1121 NH1 ARG 53 NH2 ARG 143 -5.612 -11.506 -12.313 1122 NH2 ARG 53 NH1 ARG 143 -5.158 -10.656 -14.370 1123 H ARG 53 H ARG 143 -7.345 -6.337 -7.049 1124 HA ARG 53 HA ARG 143 -7.922 -5.749 -10.029 1125 1HB ARG 53 1HB ARG 143 -5.464 -5.900 -9.451 1126 2HB ARG 53 2HB ARG 143 -5.687 -7.546 -8.932 1127 1HG ARG 53 1HG ARG 143 -6.425 -6.662 -11.792 1128 2HG ARG 53 2HG ARG 143 -4.771 -7.024 -11.323 1129 1HD ARG 53 1HD ARG 143 -5.465 -9.352 -10.582 1130 2HD ARG 53 2HD ARG 143 -7.105 -9.041 -11.171 1131 1HH1 ARG 53 2HH2 ARG 143 -5.865 -11.321 -11.336 1132 2HH1 ARG 53 1HH2 ARG 143 -5.447 -12.424 -12.742 1133 1HH2 ARG 53 1HH1 ARG 143 -5.062 -9.826 -14.965 1134 2HH2 ARG 53 2HH1 ARG 143 -5.027 -11.634 -14.652 1135 H GLU 54 H GLU 144 -9.940 -6.585 -10.090 1136 HA GLU 54 HA GLU 144 -10.715 -9.173 -8.874 1137 1HB GLU 54 1HB GLU 144 -12.834 -9.027 -9.911 1138 2HB GLU 54 2HB GLU 144 -12.439 -7.540 -9.097 1139 1HG GLU 54 1HG GLU 144 -12.402 -7.957 -12.162 1140 2HG GLU 54 2HG GLU 144 -13.720 -7.274 -11.238 1141 HE2 GLU 54 HE2 GLU 144 -10.654 -5.005 -12.376 1142 NH1 ARG 55 NH2 ARG 145 -6.090 -17.104 -8.544 1143 NH2 ARG 55 NH1 ARG 145 -8.101 -17.157 -7.487 1144 H ARG 55 H ARG 145 -10.159 -11.089 -9.573 1145 HA ARG 55 HA ARG 145 -8.578 -11.405 -12.087 1146 1HB ARG 55 1HB ARG 145 -7.711 -12.411 -10.097 1147 2HB ARG 55 2HB ARG 145 -9.204 -13.244 -9.735 1148 1HG ARG 55 1HG ARG 145 -8.929 -14.796 -11.626 1149 2HG ARG 55 2HG ARG 145 -7.500 -13.917 -12.171 1150 1HD ARG 55 1HD ARG 145 -6.748 -15.893 -11.071 1151 2HD ARG 55 2HD ARG 145 -6.302 -14.532 -10.035 1152 1HH1 ARG 55 2HH2 ARG 145 -5.521 -16.711 -9.302 1153 2HH1 ARG 55 1HH2 ARG 145 -5.793 -17.798 -7.849 1154 1HH2 ARG 55 1HH1 ARG 145 -9.064 -16.806 -7.435 1155 2HH2 ARG 55 2HH1 ARG 145 -7.664 -17.847 -6.866 1156 H ALA 56 H ALA 146 -9.146 -12.455 -13.839 1157 HA ALA 56 HA ALA 146 -12.092 -12.979 -14.380 1158 1HB ALA 56 2HB ALA 146 -9.710 -12.873 -16.338 1159 2HB ALA 56 3HB ALA 146 -11.421 -13.100 -16.775 1160 3HB ALA 56 1HB ALA 146 -10.896 -11.579 -16.027 1161 H ALA 57 H ALA 147 -12.390 -14.877 -13.290 1162 HA ALA 57 HA ALA 147 -11.179 -17.176 -12.936 1163 1HB ALA 57 1HB ALA 147 -13.598 -16.852 -12.370 1164 2HB ALA 57 2HB ALA 147 -14.067 -17.087 -14.074 1165 3HB ALA 57 3HB ALA 147 -13.406 -18.439 -13.136 1166 NH1 ARG 58 NH2 ARG 148 -4.611 -17.500 -12.237 1167 NH2 ARG 58 NH1 ARG 148 -4.280 -15.351 -12.899 1168 H ARG 58 H ARG 148 -10.060 -18.639 -13.674 1169 HA ARG 58 HA ARG 148 -9.713 -18.723 -16.592 1170 1HB ARG 58 2HB ARG 148 -7.852 -20.072 -14.585 1171 2HB ARG 58 1HB ARG 148 -7.504 -19.681 -16.266 1172 1HG ARG 58 1HG ARG 148 -7.744 -17.180 -15.595 1173 2HG ARG 58 2HG ARG 148 -7.821 -17.730 -13.916 1174 1HD ARG 58 1HD ARG 148 -5.555 -18.905 -14.240 1175 2HD ARG 58 2HD ARG 148 -5.481 -18.244 -15.865 1176 1HH1 ARG 58 2HH2 ARG 148 -4.976 -18.430 -12.469 1177 2HH1 ARG 58 1HH2 ARG 148 -4.156 -17.219 -11.361 1178 1HH2 ARG 58 1HH1 ARG 148 -4.391 -14.642 -13.632 1179 2HH2 ARG 58 2HH1 ARG 148 -3.847 -15.221 -11.978 1180 H LYS 59 H LYS 149 -8.518 -21.242 -16.942 1181 HA LYS 59 HA LYS 149 -10.522 -23.371 -16.180 1182 1HB LYS 59 1HB LYS 149 -10.858 -24.258 -18.415 1183 2HB LYS 59 2HB LYS 149 -11.517 -22.648 -18.237 1184 1HG LYS 59 1HG LYS 149 -9.526 -21.695 -19.506 1185 2HG LYS 59 2HG LYS 149 -8.896 -23.329 -19.720 1186 1HD LYS 59 1HD LYS 149 -10.987 -23.990 -20.957 1187 2HD LYS 59 2HD LYS 149 -11.650 -22.376 -20.761 1188 1HE LYS 59 1HE LYS 149 -9.025 -23.019 -22.284 1189 2HE LYS 59 2HE LYS 149 -10.608 -22.865 -23.042 1190 1HZ LYS 59 1HZ LYS 149 -10.731 -20.583 -22.318 1191 2HZ LYS 59 2HZ LYS 149 -9.390 -20.832 -23.220 1192 H GLY 60 H GLY 150 -9.445 -25.066 -15.461 1193 1HA GLY 60 1HA GLY 150 -6.805 -25.936 -16.659 1194 2HA GLY 60 2HA GLY 150 -6.682 -25.279 -15.032 1195 NH1 ARG 61 NH2 ARG 151 -7.473 -34.161 -16.493 1196 NH2 ARG 61 NH1 ARG 151 -6.534 -33.167 -18.309 1197 H ARG 61 H ARG 151 -6.440 -26.970 -13.711 1198 HA ARG 61 HA ARG 151 -8.360 -29.293 -13.717 1199 1HB ARG 61 1HB ARG 151 -6.438 -29.807 -15.381 1200 2HB ARG 61 2HB ARG 151 -5.332 -29.813 -14.012 1201 1HG ARG 61 1HG ARG 151 -6.713 -31.732 -13.003 1202 2HG ARG 61 2HG ARG 151 -7.754 -31.710 -14.415 1203 1HD ARG 61 1HD ARG 151 -4.713 -32.268 -14.452 1204 2HD ARG 61 2HD ARG 151 -5.933 -33.516 -14.367 1205 1HH1 ARG 61 2HH2 ARG 151 -7.514 -34.232 -15.470 1206 2HH1 ARG 61 1HH2 ARG 151 -8.025 -34.700 -17.169 1207 1HH2 ARG 61 1HH1 ARG 151 -5.861 -32.484 -18.673 1208 2HH2 ARG 61 2HH1 ARG 151 -7.153 -33.774 -18.859 1209 H ASN 62 H ASN 152 -8.495 -30.372 -11.854 1210 HA ASN 62 HA ASN 152 -7.598 -29.029 -9.387 1211 1HB ASN 62 1HB ASN 152 -9.872 -30.104 -9.763 1212 2HB ASN 62 2HB ASN 152 -9.112 -31.686 -9.713 1213 1HD2 ASN 62 2HD2 ASN 152 -9.996 -29.916 -6.191 1214 2HD2 ASN 62 1HD2 ASN 152 -10.303 -29.086 -7.799 1215 HA PRO 63 HA PRO 153 -3.748 -31.553 -9.142 1216 1HB PRO 63 1HB PRO 153 -2.815 -30.853 -6.619 1217 2HB PRO 63 2HB PRO 153 -2.797 -29.786 -8.031 1218 1HG PRO 63 1HG PRO 153 -4.885 -29.876 -5.794 1219 2HG PRO 63 2HG PRO 153 -4.041 -28.449 -6.442 1220 1HD PRO 63 1HD PRO 153 -6.575 -29.148 -7.283 1221 2HD PRO 63 2HD PRO 153 -5.407 -28.420 -8.429 1222 H GLN 64 H GLN 154 -6.296 -32.191 -6.735 1223 HA GLN 64 HA GLN 154 -4.894 -34.673 -5.686 1224 1HB GLN 64 1HB GLN 154 -7.662 -33.556 -4.937 1225 2HB GLN 64 2HB GLN 154 -6.858 -34.901 -4.167 1226 1HG GLN 64 1HG GLN 154 -5.863 -31.974 -4.130 1227 2HG GLN 64 2HG GLN 154 -6.931 -32.732 -2.964 1228 1HE2 GLN 64 2HE2 GLN 154 -4.199 -34.386 -1.236 1229 2HE2 GLN 64 1HE2 GLN 154 -6.010 -34.137 -1.396 1230 H THR 65 H THR 155 -8.184 -34.032 -6.660 1231 HA THR 65 HA THR 155 -8.849 -36.614 -7.646 1232 HB THR 65 HB THR 155 -10.899 -35.724 -8.592 1233 HG1 THR 65 HG1 THR 155 -10.007 -33.928 -9.618 1234 1HG2 THR 65 1HG2 THR 155 -10.766 -35.787 -6.059 1235 2HG2 THR 65 2HG2 THR 155 -10.238 -34.087 -6.063 1236 3HG2 THR 65 3HG2 THR 155 -11.855 -34.507 -6.668 1237 H GLY 66 H GLY 156 -7.639 -33.981 -9.720 1238 1HA GLY 66 1HA GLY 156 -6.638 -34.155 -11.907 1239 2HA GLY 66 2HA GLY 156 -6.879 -35.890 -11.900 1240 H GLU 67 H GLU 157 -9.382 -33.374 -11.465 1241 HA GLU 67 HA GLU 157 -10.681 -34.140 -14.121 1242 1HB GLU 67 2HB GLU 157 -11.812 -34.779 -11.883 1243 2HB GLU 67 1HB GLU 157 -12.022 -33.063 -11.550 1244 1HG GLU 67 1HG GLU 157 -14.108 -33.908 -12.419 1245 2HG GLU 67 2HG GLU 157 -13.446 -32.827 -13.628 1246 HE1 GLU 67 HE2 GLU 157 -13.866 -36.807 -14.304 1247 H GLU 68 H GLU 158 -11.204 -32.540 -15.459 1248 HA GLU 68 HA GLU 158 -9.875 -29.934 -15.127 1249 1HB GLU 68 1HB GLU 158 -11.658 -30.915 -17.430 1250 2HB GLU 68 2HB GLU 158 -10.891 -29.331 -17.396 1251 1HG GLU 68 1HG GLU 158 -8.605 -30.409 -17.195 1252 2HG GLU 68 2HG GLU 158 -9.353 -31.999 -17.281 1253 HE2 GLU 68 HE2 GLU 158 -9.846 -31.982 -20.682 1254 H MET 69 H MET 159 -10.638 -28.156 -14.289 1255 HA MET 69 HA MET 159 -13.600 -27.531 -14.201 1256 1HB MET 69 1HB MET 159 -13.837 -27.387 -11.883 1257 2HB MET 69 2HB MET 159 -12.960 -28.877 -12.090 1258 1HG MET 69 1HG MET 159 -11.933 -26.198 -10.996 1259 2HG MET 69 2HG MET 159 -12.022 -27.752 -10.155 1260 1HE MET 69 2HE MET 159 -9.644 -25.542 -10.539 1261 2HE MET 69 1HE MET 159 -9.067 -26.944 -9.585 1262 3HE MET 69 3HE MET 159 -8.160 -26.404 -11.024 1263 H GLU 70 H GLU 160 -14.111 -25.391 -13.657 1264 HA GLU 70 HA GLU 160 -12.223 -23.386 -14.733 1265 1HB GLU 70 2HB GLU 160 -13.921 -21.716 -14.479 1266 2HB GLU 70 1HB GLU 160 -14.571 -23.148 -15.274 1267 1HG GLU 70 1HG GLU 160 -15.700 -23.817 -13.075 1268 2HG GLU 70 2HG GLU 160 -15.064 -22.359 -12.322 1269 HE2 GLU 70 HE2 GLU 160 -18.232 -22.230 -14.799 1270 H ILE 71 H ILE 161 -10.804 -22.075 -13.655 1271 HA ILE 71 HA ILE 161 -10.376 -22.395 -10.785 1272 HB ILE 71 HB ILE 161 -9.064 -20.406 -12.717 1273 1HG1 ILE 71 1HG1 ILE 161 -8.678 -22.410 -13.911 1274 2HG1 ILE 71 2HG1 ILE 161 -7.189 -21.938 -13.137 1275 1HG2 ILE 71 2HG2 ILE 161 -8.594 -19.990 -10.351 1276 2HG2 ILE 71 3HG2 ILE 161 -8.032 -21.676 -10.143 1277 3HG2 ILE 71 1HG2 ILE 161 -7.128 -20.544 -11.202 1278 1HD1 ILE 71 1HD1 ILE 161 -7.644 -23.719 -11.322 1279 2HD1 ILE 71 2HD1 ILE 161 -9.072 -24.210 -12.284 1280 3HD1 ILE 71 3HD1 ILE 161 -7.438 -24.363 -12.973 1281 HA PRO 72 HA PRO 162 -13.445 -18.964 -10.157 1282 1HB PRO 72 1HB PRO 162 -13.348 -18.680 -7.381 1283 2HB PRO 72 2HB PRO 162 -14.099 -20.042 -8.221 1284 1HG PRO 72 1HG PRO 162 -11.284 -19.920 -7.026 1285 2HG PRO 72 2HG PRO 162 -12.517 -21.181 -6.784 1286 1HD PRO 72 1HD PRO 162 -10.492 -21.470 -8.637 1287 2HD PRO 72 2HD PRO 162 -12.126 -22.122 -8.973 1288 H ALA 73 H ALA 163 -13.659 -16.770 -9.417 1289 HA ALA 73 HA ALA 163 -11.343 -15.046 -10.060 1290 1HB ALA 73 2HB ALA 163 -13.760 -14.258 -10.428 1291 2HB ALA 73 3HB ALA 163 -13.981 -14.188 -8.640 1292 3HB ALA 73 1HB ALA 163 -12.830 -13.122 -9.437 1293 H SER 74 H SER 164 -10.672 -13.310 -8.778 1294 HA SER 74 HA SER 164 -11.429 -13.044 -6.103 1295 1HB SER 74 1HB SER 164 -9.260 -13.460 -4.762 1296 2HB SER 74 2HB SER 164 -9.769 -14.941 -5.569 1297 HG SER 74 HG SER 164 -8.295 -14.436 -7.244 1298 H LYS 75 H LYS 165 -11.049 -11.073 -5.214 1299 HA LYS 75 HA LYS 165 -9.752 -8.972 -6.921 1300 1HB LYS 75 2HB LYS 165 -10.603 -8.055 -4.239 1301 2HB LYS 75 1HB LYS 165 -10.632 -7.308 -5.804 1302 1HG LYS 75 1HG LYS 165 -12.628 -8.761 -6.455 1303 2HG LYS 75 2HG LYS 165 -12.620 -9.425 -4.818 1304 1HD LYS 75 1HD LYS 165 -12.922 -7.017 -3.912 1305 2HD LYS 75 2HD LYS 165 -13.034 -6.469 -5.578 1306 1HE LYS 75 1HE LYS 165 -15.283 -6.630 -4.769 1307 2HE LYS 75 2HE LYS 165 -15.082 -7.934 -5.937 1308 1HZ LYS 75 1HZ LYS 165 -14.920 -8.229 -2.981 1309 2HZ LYS 75 2HZ LYS 165 -14.732 -9.453 -4.049 1310 H VAL 76 H VAL 166 -7.442 -8.470 -6.767 1311 HA VAL 76 HA VAL 166 -5.990 -9.461 -4.480 1312 HB VAL 76 HB VAL 166 -6.013 -9.239 -7.465 1313 1HG1 VAL 76 1HG2 VAL 166 -3.409 -8.774 -6.182 1314 2HG1 VAL 76 2HG2 VAL 166 -3.782 -9.219 -7.930 1315 3HG1 VAL 76 3HG2 VAL 166 -4.355 -7.683 -7.253 1316 1HG2 VAL 76 3HG1 VAL 166 -6.274 -11.359 -6.269 1317 2HG2 VAL 76 1HG1 VAL 166 -4.898 -11.337 -7.394 1318 3HG2 VAL 76 2HG1 VAL 166 -4.607 -11.183 -5.624 1319 HA PRO 77 HA PRO 167 -5.609 -4.934 -3.681 1320 1HB PRO 77 1HB PRO 167 -4.413 -5.058 -1.150 1321 2HB PRO 77 2HB PRO 167 -6.057 -5.653 -1.421 1322 1HG PRO 77 1HG PRO 167 -3.470 -7.278 -1.349 1323 2HG PRO 77 2HG PRO 167 -4.985 -7.623 -0.499 1324 1HD PRO 77 1HD PRO 167 -4.210 -8.752 -3.067 1325 2HD PRO 77 2HD PRO 167 -5.912 -8.607 -2.567 1326 H ALA 78 H ALA 168 -4.418 -3.490 -4.120 1327 HA ALA 78 HA ALA 168 -1.378 -3.766 -4.353 1328 1HB ALA 78 3HB ALA 168 -2.688 -4.272 -6.488 1329 2HB ALA 78 1HB ALA 168 -3.349 -2.620 -6.447 1330 3HB ALA 78 2HB ALA 168 -1.597 -2.869 -6.642 1331 H PHE 79 H PHE 169 -0.379 -1.822 -4.730 1332 HA PHE 79 HA PHE 169 -1.494 0.780 -3.551 1333 1HB PHE 79 2HB PHE 169 -0.999 0.021 -1.572 1334 2HB PHE 79 1HB PHE 169 0.483 -0.830 -2.096 1335 HD1 PHE 79 HD1 PHE 169 -0.870 2.543 -1.215 1336 HD2 PHE 79 HD2 PHE 169 2.642 0.294 -2.275 1337 HE1 PHE 79 HE1 PHE 169 0.547 4.475 -0.675 1338 HE2 PHE 79 HE2 PHE 169 4.037 2.258 -1.797 1339 HZ PHE 79 HZ PHE 169 2.998 4.358 -1.037 1340 H LYS 80 H LYS 170 -0.761 2.088 -4.805 1341 HA LYS 80 HA LYS 170 1.633 2.001 -6.843 1342 1HB LYS 80 2HB LYS 170 -0.599 4.040 -6.545 1343 2HB LYS 80 1HB LYS 170 0.764 4.202 -7.630 1344 1HG LYS 80 1HG LYS 170 -1.399 2.014 -7.768 1345 2HG LYS 80 2HG LYS 170 -1.327 3.445 -8.769 1346 1HD LYS 80 1HD LYS 170 0.723 1.140 -8.797 1347 2HD LYS 80 2HD LYS 170 -0.582 1.384 -9.947 1348 1HE LYS 80 1HE LYS 170 0.461 3.584 -10.694 1349 2HE LYS 80 2HE LYS 170 1.795 3.331 -9.560 1350 1HZ LYS 80 1HZ LYS 170 2.337 2.599 -11.780 1351 2HZ LYS 80 2HZ LYS 170 1.086 1.546 -11.818 1352 HA PRO 81 HA PRO 171 3.716 4.655 -3.735 1353 1HB PRO 81 1HB PRO 171 6.135 4.984 -5.004 1354 2HB PRO 81 2HB PRO 171 5.610 3.413 -4.384 1355 1HG PRO 81 1HG PRO 171 5.415 4.428 -7.270 1356 2HG PRO 81 2HG PRO 171 6.132 2.899 -6.701 1357 1HD PRO 81 1HD PRO 171 3.493 3.128 -7.618 1358 2HD PRO 81 2HD PRO 171 3.978 1.902 -6.404 1359 H GLY 82 H GLY 172 1.702 5.778 -5.417 1360 1HA GLY 82 1HA GLY 172 0.962 7.570 -6.826 1361 2HA GLY 82 2HA GLY 172 1.732 8.429 -5.509 1362 H LYS 83 H LYS 173 3.834 6.776 -7.613 1363 HA LYS 83 HA LYS 173 5.557 7.538 -9.123 1364 1HB LYS 83 2HB LYS 173 3.487 9.557 -9.767 1365 2HB LYS 83 1HB LYS 173 5.010 10.328 -9.801 1366 1HG LYS 83 1HG LYS 173 4.237 7.815 -11.425 1367 2HG LYS 83 2HG LYS 173 4.312 9.451 -12.046 1368 1HD LYS 83 1HD LYS 173 6.705 7.762 -11.088 1369 2HD LYS 83 2HD LYS 173 6.279 8.091 -12.748 1370 1HE LYS 83 1HE LYS 173 7.231 10.222 -10.711 1371 2HE LYS 83 2HE LYS 173 8.239 9.435 -11.917 1372 1HZ LYS 83 1HZ LYS 173 7.486 11.594 -12.640 1373 2HZ LYS 83 2HZ LYS 173 5.912 11.173 -12.506 1374 H ALA 84 H ALA 174 4.457 9.840 -6.992 1375 HA ALA 84 HA ALA 174 6.665 11.638 -6.455 1376 1HB ALA 84 2HB ALA 174 4.235 11.995 -5.962 1377 2HB ALA 84 3HB ALA 174 4.235 10.626 -4.823 1378 3HB ALA 84 1HB ALA 174 5.167 12.097 -4.434 1379 H LEU 85 H LEU 175 5.596 8.684 -4.530 1380 HA LEU 85 HA LEU 175 7.966 8.743 -2.798 1381 1HB LEU 85 2HB LEU 175 5.917 7.595 -1.988 1382 2HB LEU 85 1HB LEU 175 5.958 6.507 -3.357 1383 HG LEU 85 HG LEU 175 8.280 5.895 -2.642 1384 1HD1 LEU 85 1HD1 LEU 175 8.619 7.708 -0.841 1385 2HD1 LEU 85 2HD1 LEU 175 7.614 6.681 0.218 1386 3HD1 LEU 85 3HD1 LEU 175 9.133 6.059 -0.434 1387 1HD2 LEU 85 3HD2 LEU 175 6.361 4.302 -2.406 1388 2HD2 LEU 85 1HD2 LEU 175 7.431 4.104 -1.009 1389 3HD2 LEU 85 2HD2 LEU 175 5.908 5.012 -0.844 1390 H LYS 86 H LYS 176 7.138 7.158 -5.881 1391 HA LYS 86 HA LYS 176 9.607 5.656 -6.221 1392 1HB LYS 86 1HB LYS 176 7.486 5.427 -7.651 1393 2HB LYS 86 2HB LYS 176 8.027 6.816 -8.579 1394 1HG LYS 86 1HG LYS 176 10.152 5.577 -9.165 1395 2HG LYS 86 2HG LYS 176 9.612 4.203 -8.193 1396 1HD LYS 86 1HD LYS 176 7.589 3.941 -9.700 1397 2HD LYS 86 2HD LYS 176 8.134 5.317 -10.668 1398 1HE LYS 86 1HE LYS 176 10.273 4.064 -11.249 1399 2HE LYS 86 2HE LYS 176 9.728 2.685 -10.282 1400 1HZ LYS 86 1HZ LYS 176 7.832 2.449 -11.740 1401 2HZ LYS 86 2HZ LYS 176 9.226 2.372 -12.592 1402 H ASP 87 H ASP 177 9.096 9.135 -6.532 1403 HA ASP 87 HA ASP 177 11.748 9.681 -7.768 1404 1HB ASP 87 1HB ASP 177 9.204 11.032 -7.486 1405 2HB ASP 87 2HB ASP 177 10.209 11.858 -6.368 1406 HD1 ASP 87 HD2 ASP 177 12.191 13.370 -8.825 1407 H ALA 88 H ALA 178 10.260 9.873 -4.499 1408 HA ALA 88 HA ALA 178 12.446 10.892 -2.889 1409 1HB ALA 88 3HB ALA 178 10.048 10.294 -2.029 1410 2HB ALA 88 1HB ALA 178 10.482 8.586 -2.123 1411 3HB ALA 88 2HB ALA 178 11.340 9.612 -1.000 1412 H VAL 89 H VAL 179 11.730 7.545 -3.919 1413 HA VAL 89 HA VAL 179 13.987 6.344 -2.483 1414 HB VAL 89 HB VAL 179 11.273 5.983 -2.645 1415 1HG1 VAL 89 2HG2 VAL 179 11.450 5.766 -5.213 1416 2HG1 VAL 89 3HG2 VAL 179 12.028 4.125 -4.945 1417 3HG1 VAL 89 1HG2 VAL 179 10.426 4.643 -4.315 1418 1HG2 VAL 89 3HG1 VAL 179 13.222 3.738 -2.548 1419 2HG2 VAL 89 1HG1 VAL 179 12.580 4.801 -1.242 1420 3HG2 VAL 89 2HG1 VAL 179 11.456 3.723 -2.117 1421 H LYS 90 H LYS 180 13.754 7.522 -5.652 1422 HA LYS 90 HA LYS 180 14.921 5.369 -7.218 1423 1HB LYS 90 1HB LYS 180 13.891 8.117 -7.615 1424 2HB LYS 90 2HB LYS 180 15.441 8.056 -8.382 1425 1HG LYS 90 1HG LYS 180 14.752 6.139 -9.801 1426 2HG LYS 90 2HG LYS 180 13.256 5.944 -8.886 1427 1HD LYS 90 1HD LYS 180 12.555 8.304 -9.601 1428 2HD LYS 90 2HD LYS 180 14.005 8.395 -10.607 1429 1HE LYS 90 1HE LYS 180 13.202 6.377 -11.932 1430 2HE LYS 90 2HE LYS 180 11.768 6.268 -10.898 1431 1HZ LYS 90 1HZ LYS 180 11.331 7.446 -12.949 1432 2HZ LYS 90 2HZ LYS 180 12.478 8.568 -12.632 Start of MODEL 3 Raw file had 1432 H/Q atoms Start of MODEL 3 1 1H MET 1 1H MET 1 -9.040 6.926 1.447 2 2H MET 1 2H MET 1 -10.066 8.177 1.213 3 HA MET 1 HA MET 1 -8.380 6.894 -0.770 4 1HB MET 1 1HB MET 1 -10.851 6.289 -1.736 5 2HB MET 1 2HB MET 1 -9.696 5.312 -0.918 6 1HG MET 1 1HG MET 1 -11.234 6.206 1.280 7 2HG MET 1 2HG MET 1 -12.399 5.960 -0.023 8 1HE MET 1 3HE MET 1 -8.872 4.484 0.961 9 2HE MET 1 2HE MET 1 -9.715 4.103 2.467 10 3HE MET 1 1HE MET 1 -9.236 2.791 1.350 11 H ASN 2 H ASN 2 -7.676 8.900 -0.853 12 HA ASN 2 HA ASN 2 -7.322 10.036 -3.171 13 1HB ASN 2 1HB ASN 2 -8.341 12.018 -3.776 14 2HB ASN 2 2HB ASN 2 -9.508 10.741 -3.654 15 1HD2 ASN 2 1HD2 ASN 2 -10.043 14.085 -1.357 16 2HD2 ASN 2 2HD2 ASN 2 -8.418 13.690 -2.113 17 H LYS 3 H LYS 3 -7.808 10.833 0.037 18 HA LYS 3 HA LYS 3 -5.645 11.082 1.360 19 1HB LYS 3 1HB LYS 3 -4.400 12.300 -0.525 20 2HB LYS 3 2HB LYS 3 -5.302 13.749 -0.161 21 1HG LYS 3 1HG LYS 3 -4.200 13.787 2.147 22 2HG LYS 3 2HG LYS 3 -3.522 12.184 1.861 23 1HD LYS 3 1HD LYS 3 -2.183 13.173 -0.125 24 2HD LYS 3 2HD LYS 3 -2.785 14.756 0.338 25 1HE LYS 3 1HE LYS 3 -0.580 14.578 1.273 26 2HE LYS 3 2HE LYS 3 -1.681 14.463 2.646 27 1HZ LYS 3 1HZ LYS 3 -0.396 12.157 1.270 28 2HZ LYS 3 2HZ LYS 3 -1.407 12.032 2.549 29 H THR 4 H THR 4 -8.321 13.262 0.457 30 HA THR 4 HA THR 4 -8.621 14.273 3.168 31 HB THR 4 HB THR 4 -9.883 14.742 0.388 32 HG1 THR 4 HG1 THR 4 -7.750 15.571 0.700 33 1HG2 THR 4 3HG2 THR 4 -10.332 16.094 3.051 34 2HG2 THR 4 1HG2 THR 4 -10.866 16.747 1.429 35 3HG2 THR 4 2HG2 THR 4 -11.509 15.176 2.041 36 H GLU 5 H GLU 5 -10.040 11.889 0.832 37 HA GLU 5 HA GLU 5 -12.499 11.334 2.414 38 1HB GLU 5 1HB GLU 5 -12.579 11.113 0.004 39 2HB GLU 5 2HB GLU 5 -11.001 10.339 -0.071 40 1HG GLU 5 1HG GLU 5 -12.442 8.713 -0.596 41 2HG GLU 5 2HG GLU 5 -11.813 8.360 1.005 42 HE1 GLU 5 HE2 GLU 5 -15.777 9.013 0.390 43 H LEU 6 H LEU 6 -9.106 10.825 2.552 44 HA LEU 6 HA LEU 6 -8.926 8.311 4.109 45 1HB LEU 6 2HB LEU 6 -7.107 10.025 2.744 46 2HB LEU 6 1HB LEU 6 -6.783 10.458 4.398 47 HG LEU 6 HG LEU 6 -6.617 7.630 3.288 48 1HD1 LEU 6 3HD1 LEU 6 -4.417 9.600 4.121 49 2HD1 LEU 6 1HD1 LEU 6 -4.173 7.909 3.625 50 3HD1 LEU 6 2HD1 LEU 6 -4.804 9.095 2.462 51 1HD2 LEU 6 2HD2 LEU 6 -6.564 8.638 6.141 52 2HD2 LEU 6 3HD2 LEU 6 -7.104 7.087 5.489 53 3HD2 LEU 6 1HD2 LEU 6 -5.367 7.433 5.687 54 H ILE 7 H ILE 7 -8.919 11.816 4.795 55 HA ILE 7 HA ILE 7 -8.717 11.788 7.678 56 HB ILE 7 HB ILE 7 -10.136 13.891 5.922 57 1HG1 ILE 7 1HG1 ILE 7 -7.179 13.875 6.747 58 2HG1 ILE 7 2HG1 ILE 7 -7.708 13.318 5.205 59 1HG2 ILE 7 2HG2 ILE 7 -10.588 14.226 8.391 60 2HG2 ILE 7 3HG2 ILE 7 -8.848 14.285 8.676 61 3HG2 ILE 7 1HG2 ILE 7 -9.628 15.546 7.713 62 1HD1 ILE 7 3HD1 ILE 7 -8.790 15.593 4.736 63 2HD1 ILE 7 1HD1 ILE 7 -7.830 16.201 6.078 64 3HD1 ILE 7 2HD1 ILE 7 -7.013 15.436 4.688 65 H ASN 8 H ASN 8 -11.611 11.941 5.597 66 HA ASN 8 HA ASN 8 -13.506 11.651 7.858 67 1HB ASN 8 1HB ASN 8 -13.979 11.063 4.839 68 2HB ASN 8 2HB ASN 8 -15.247 11.046 6.042 69 1HD2 ASN 8 2HD2 ASN 8 -14.209 14.658 4.523 70 2HD2 ASN 8 1HD2 ASN 8 -13.437 13.087 3.975 71 H ALA 9 H ALA 9 -11.594 9.224 6.337 72 HA ALA 9 HA ALA 9 -13.258 6.869 7.202 73 1HB ALA 9 2HB ALA 9 -11.237 6.658 5.437 74 2HB ALA 9 3HB ALA 9 -10.139 6.993 6.779 75 3HB ALA 9 1HB ALA 9 -11.089 5.547 6.851 76 H VAL 10 H VAL 10 -10.478 8.725 8.465 77 HA VAL 10 HA VAL 10 -10.048 7.010 10.684 78 HB VAL 10 HB VAL 10 -8.867 9.742 10.815 79 1HG1 VAL 10 3HG2 VAL 10 -8.413 7.637 12.329 80 2HG1 VAL 10 1HG2 VAL 10 -7.390 7.126 10.958 81 3HG1 VAL 10 2HG2 VAL 10 -7.061 8.681 11.762 82 1HG2 VAL 10 1HG1 VAL 10 -8.295 7.723 8.611 83 2HG2 VAL 10 2HG1 VAL 10 -8.707 9.465 8.546 84 3HG2 VAL 10 3HG1 VAL 10 -7.079 8.972 9.122 85 H ALA 11 H ALA 11 -11.226 10.127 10.358 86 HA ALA 11 HA ALA 11 -12.058 10.251 13.054 87 1HB ALA 11 2HB ALA 11 -11.672 12.339 11.688 88 2HB ALA 11 3HB ALA 11 -13.094 11.969 10.679 89 3HB ALA 11 1HB ALA 11 -13.300 12.423 12.403 90 H GLU 12 H GLU 12 -13.713 8.769 10.375 91 HA GLU 12 HA GLU 12 -16.311 8.560 11.867 92 1HB GLU 12 1HB GLU 12 -16.331 8.680 9.388 93 2HB GLU 12 2HB GLU 12 -15.421 7.187 9.249 94 1HG GLU 12 1HG GLU 12 -18.221 7.390 10.559 95 2HG GLU 12 2HG GLU 12 -17.983 7.148 8.839 96 HE1 GLU 12 HE2 GLU 12 -16.792 3.859 9.075 97 H THR 13 H THR 13 -13.605 6.280 11.027 98 HA THR 13 HA THR 13 -14.718 4.206 12.773 99 HB THR 13 HB THR 13 -12.463 3.019 12.538 100 HG1 THR 13 HG1 THR 13 -11.338 4.958 12.729 101 1HG2 THR 13 3HG2 THR 13 -13.250 4.153 9.799 102 2HG2 THR 13 1HG2 THR 13 -12.132 2.816 10.122 103 3HG2 THR 13 2HG2 THR 13 -13.857 2.644 10.537 104 H SER 14 H SER 14 -13.139 6.742 13.694 105 HA SER 14 HA SER 14 -12.185 5.510 16.385 106 1HB SER 14 1HB SER 14 -10.699 7.826 15.021 107 2HB SER 14 2HB SER 14 -10.220 6.961 16.478 108 HG SER 14 HG SER 14 -10.061 5.071 15.193 109 H GLY 15 H GLY 15 -13.678 8.444 14.967 110 1HA GLY 15 1HA GLY 15 -14.681 10.316 16.016 111 2HA GLY 15 2HA GLY 15 -14.808 9.370 17.498 112 H LEU 16 H LEU 16 -12.075 10.594 15.634 113 HA LEU 16 HA LEU 16 -10.914 12.197 17.916 114 1HB LEU 16 1HB LEU 16 -8.856 12.270 16.706 115 2HB LEU 16 2HB LEU 16 -9.346 10.709 17.327 116 HG LEU 16 HG LEU 16 -9.971 9.892 15.294 117 1HD1 LEU 16 2HD1 LEU 16 -11.041 11.934 14.253 118 2HD1 LEU 16 3HD1 LEU 16 -9.371 12.501 13.927 119 3HD1 LEU 16 1HD1 LEU 16 -10.037 10.998 13.144 120 1HD2 LEU 16 3HD2 LEU 16 -7.920 9.228 15.456 121 2HD2 LEU 16 1HD2 LEU 16 -8.576 9.348 13.806 122 3HD2 LEU 16 2HD2 LEU 16 -7.423 10.549 14.345 123 H SER 17 H SER 17 -10.058 13.544 15.423 124 HA SER 17 HA SER 17 -12.348 15.523 14.981 125 1HB SER 17 1HB SER 17 -9.519 16.589 15.402 126 2HB SER 17 2HB SER 17 -10.961 17.501 15.024 127 HG SER 17 HG SER 17 -10.583 15.948 17.360 128 H LYS 18 H LYS 18 -12.148 16.714 12.998 129 HA LYS 18 HA LYS 18 -11.037 15.124 10.691 130 1HB LYS 18 1HB LYS 18 -12.398 17.882 10.656 131 2HB LYS 18 2HB LYS 18 -11.645 17.140 9.252 132 1HG LYS 18 1HG LYS 18 -13.162 15.070 9.582 133 2HG LYS 18 2HG LYS 18 -13.992 15.960 10.847 134 1HD LYS 18 1HD LYS 18 -15.322 16.176 8.887 135 2HD LYS 18 2HD LYS 18 -14.611 17.763 9.154 136 1HE LYS 18 1HE LYS 18 -12.894 17.306 7.334 137 2HE LYS 18 2HE LYS 18 -13.525 15.668 7.131 138 1HZ LYS 18 1HZ LYS 18 -15.660 16.644 6.496 139 2HZ LYS 18 2HZ LYS 18 -15.080 18.159 6.695 140 H LYS 19 H LYS 19 -10.159 18.124 12.365 141 HA LYS 19 HA LYS 19 -7.572 18.560 11.004 142 1HB LYS 19 2HB LYS 19 -8.453 19.386 13.835 143 2HB LYS 19 1HB LYS 19 -6.903 19.848 13.119 144 1HG LYS 19 1HG LYS 19 -8.113 21.017 11.234 145 2HG LYS 19 2HG LYS 19 -9.662 20.606 11.973 146 1HD LYS 19 1HD LYS 19 -9.004 21.870 14.062 147 2HD LYS 19 2HD LYS 19 -7.469 22.316 13.334 148 1HE LYS 19 1HE LYS 19 -10.249 23.110 12.208 149 2HE LYS 19 2HE LYS 19 -9.273 24.119 13.272 150 1HZ LYS 19 1HZ LYS 19 -8.411 23.191 10.592 151 2HZ LYS 19 2HZ LYS 19 -7.522 24.128 11.593 152 H ASP 20 H ASP 20 -8.456 16.440 13.841 153 HA ASP 20 HA ASP 20 -5.575 15.658 14.269 154 1HB ASP 20 1HB ASP 20 -8.206 14.544 15.411 155 2HB ASP 20 2HB ASP 20 -6.713 13.672 15.633 156 HD2 ASP 20 HD2 ASP 20 -7.546 16.562 18.107 157 H ALA 21 H ALA 21 -8.186 14.396 12.294 158 HA ALA 21 HA ALA 21 -6.789 11.869 11.558 159 1HB ALA 21 2HB ALA 21 -9.347 13.247 10.540 160 2HB ALA 21 3HB ALA 21 -8.695 11.726 9.858 161 3HB ALA 21 1HB ALA 21 -9.164 11.822 11.530 162 H THR 22 H THR 22 -7.072 15.129 10.015 163 HA THR 22 HA THR 22 -5.512 14.603 7.640 164 HB THR 22 HB THR 22 -5.497 17.274 9.200 165 HG1 THR 22 HG1 THR 22 -7.614 16.534 9.112 166 1HG2 THR 22 3HG2 THR 22 -5.546 16.522 6.216 167 2HG2 THR 22 1HG2 THR 22 -5.665 18.189 6.849 168 3HG2 THR 22 2HG2 THR 22 -4.171 17.218 7.110 169 H LYS 23 H LYS 23 -4.517 15.753 10.784 170 HA LYS 23 HA LYS 23 -1.607 15.804 10.400 171 1HB LYS 23 2HB LYS 23 -3.447 15.183 12.855 172 2HB LYS 23 1HB LYS 23 -1.735 15.272 13.054 173 1HG LYS 23 1HG LYS 23 -1.662 17.686 12.350 174 2HG LYS 23 2HG LYS 23 -3.399 17.672 12.061 175 1HD LYS 23 1HD LYS 23 -3.771 17.055 14.520 176 2HD LYS 23 2HD LYS 23 -2.029 17.160 14.784 177 1HE LYS 23 1HE LYS 23 -2.079 19.611 14.087 178 2HE LYS 23 2HE LYS 23 -3.827 19.494 13.821 179 1HZ LYS 23 1HZ LYS 23 -4.075 18.886 16.163 180 2HZ LYS 23 2HZ LYS 23 -2.463 18.991 16.409 181 H ALA 24 H ALA 24 -3.616 13.336 11.851 182 HA ALA 24 HA ALA 24 -1.675 11.349 12.420 183 1HB ALA 24 2HB ALA 24 -3.855 11.397 13.397 184 2HB ALA 24 3HB ALA 24 -4.640 11.059 11.821 185 3HB ALA 24 1HB ALA 24 -3.612 9.815 12.614 186 H VAL 25 H VAL 25 -3.459 11.709 9.402 187 HA VAL 25 HA VAL 25 -2.190 9.444 7.871 188 HB VAL 25 HB VAL 25 -3.710 12.211 7.444 189 1HG1 VAL 25 1HG2 VAL 25 -2.464 10.721 5.072 190 2HG1 VAL 25 2HG2 VAL 25 -3.715 12.010 4.975 191 3HG1 VAL 25 3HG2 VAL 25 -2.117 12.373 5.611 192 1HG2 VAL 25 1HG1 VAL 25 -5.059 10.240 7.986 193 2HG2 VAL 25 2HG1 VAL 25 -5.422 10.839 6.361 194 3HG2 VAL 25 3HG1 VAL 25 -4.397 9.374 6.578 195 H ASP 26 H ASP 26 -1.414 13.005 7.915 196 HA ASP 26 HA ASP 26 1.395 12.389 6.958 197 1HB ASP 26 1HB ASP 26 -0.027 14.531 6.497 198 2HB ASP 26 2HB ASP 26 0.348 15.022 8.150 199 HD2 ASP 26 HD2 ASP 26 3.387 16.353 7.251 200 H ALA 27 H ALA 27 0.384 11.446 9.433 201 HA ALA 27 HA ALA 27 2.831 11.725 11.200 202 1HB ALA 27 3HB ALA 27 0.277 12.182 12.074 203 2HB ALA 27 1HB ALA 27 0.360 10.448 12.310 204 3HB ALA 27 2HB ALA 27 1.500 11.559 13.103 205 H VAL 28 H VAL 28 0.644 9.317 9.878 206 HA VAL 28 HA VAL 28 2.458 6.985 10.247 207 HB VAL 28 HB VAL 28 0.272 7.300 8.025 208 1HG1 VAL 28 2HG2 VAL 28 2.036 5.036 8.956 209 2HG1 VAL 28 3HG2 VAL 28 0.370 4.626 8.541 210 3HG1 VAL 28 1HG2 VAL 28 1.363 5.451 7.335 211 1HG2 VAL 28 3HG1 VAL 28 -0.099 6.213 10.778 212 2HG2 VAL 28 1HG1 VAL 28 -0.940 7.557 9.907 213 3HG2 VAL 28 2HG1 VAL 28 -1.170 5.893 9.339 214 H PHE 29 H PHE 29 1.395 8.752 7.457 215 HA PHE 29 HA PHE 29 3.433 7.791 5.562 216 1HB PHE 29 2HB PHE 29 1.453 10.067 5.116 217 2HB PHE 29 1HB PHE 29 2.347 9.209 3.868 218 HD1 PHE 29 HD2 PHE 29 2.113 6.468 4.023 219 HD2 PHE 29 HD1 PHE 29 -0.796 9.290 5.427 220 HE1 PHE 29 HE2 PHE 29 0.436 4.680 4.144 221 HE2 PHE 29 HE1 PHE 29 -2.443 7.497 5.624 222 HZ PHE 29 HZ PHE 29 -1.818 5.178 4.987 223 H ASP 30 H ASP 30 3.640 10.514 7.751 224 HA ASP 30 HA ASP 30 5.804 11.805 6.121 225 1HB ASP 30 1HB ASP 30 4.182 12.892 7.907 226 2HB ASP 30 2HB ASP 30 5.292 12.320 9.124 227 HD1 ASP 30 HD2 ASP 30 7.803 14.606 8.444 228 H SER 31 H SER 31 5.570 9.617 8.746 229 HA SER 31 HA SER 31 8.542 9.367 9.288 230 1HB SER 31 1HB SER 31 6.409 7.354 10.145 231 2HB SER 31 2HB SER 31 8.060 7.492 10.757 232 HG SER 31 HG SER 31 7.566 9.578 11.514 233 H ILE 32 H ILE 32 6.102 7.384 7.281 234 HA ILE 32 HA ILE 32 7.849 5.454 6.414 235 HB ILE 32 HB ILE 32 5.595 6.538 4.703 236 1HG1 ILE 32 1HG1 ILE 32 5.554 5.162 7.374 237 2HG1 ILE 32 2HG1 ILE 32 4.718 6.546 6.707 238 1HG2 ILE 32 3HG2 ILE 32 7.488 4.448 4.336 239 2HG2 ILE 32 1HG2 ILE 32 6.147 3.586 5.054 240 3HG2 ILE 32 2HG2 ILE 32 5.923 4.492 3.540 241 1HD1 ILE 32 2HD1 ILE 32 3.951 3.805 5.751 242 2HD1 ILE 32 3HD1 ILE 32 3.372 4.543 7.272 243 3HD1 ILE 32 1HD1 ILE 32 3.051 5.380 5.722 244 H THR 33 H THR 33 6.958 8.513 4.827 245 HA THR 33 HA THR 33 8.879 8.324 2.560 246 HB THR 33 HB THR 33 7.099 9.806 2.390 247 HG1 THR 33 HG1 THR 33 9.515 11.245 2.459 248 1HG2 THR 33 3HG2 THR 33 7.092 10.581 4.870 249 2HG2 THR 33 1HG2 THR 33 8.309 11.759 4.450 250 3HG2 THR 33 2HG2 THR 33 6.667 11.823 3.690 251 H GLU 34 H GLU 34 9.304 9.381 5.869 252 HA GLU 34 HA GLU 34 12.159 10.237 5.438 253 1HB GLU 34 1HB GLU 34 10.709 11.279 7.272 254 2HB GLU 34 2HB GLU 34 10.643 9.722 8.090 255 1HG GLU 34 1HG GLU 34 13.159 9.793 8.404 256 2HG GLU 34 2HG GLU 34 13.237 11.320 7.529 257 HE1 GLU 34 HE2 GLU 34 12.044 13.268 10.133 258 H ALA 35 H ALA 35 10.391 7.210 6.232 259 HA ALA 35 HA ALA 35 12.855 5.747 6.855 260 1HB ALA 35 3HB ALA 35 10.492 4.699 7.486 261 2HB ALA 35 1HB ALA 35 10.201 4.494 5.756 262 3HB ALA 35 2HB ALA 35 11.469 3.581 6.531 263 H LEU 36 H LEU 36 10.783 5.745 3.812 264 HA LEU 36 HA LEU 36 12.752 4.318 2.176 265 1HB LEU 36 2HB LEU 36 10.591 6.258 1.458 266 2HB LEU 36 1HB LEU 36 11.317 5.153 0.355 267 HG LEU 36 HG LEU 36 9.694 4.729 2.277 268 1HD1 LEU 36 1HD2 LEU 36 11.648 2.542 2.530 269 2HD1 LEU 36 2HD2 LEU 36 10.518 3.223 3.729 270 3HD1 LEU 36 3HD2 LEU 36 10.006 1.929 2.680 271 1HD2 LEU 36 2HD1 LEU 36 8.013 4.520 1.252 272 2HD2 LEU 36 3HD1 LEU 36 8.441 2.799 1.082 273 3HD2 LEU 36 1HD1 LEU 36 8.211 3.436 2.691 274 NH1 ARG 37 NH2 ARG 37 13.201 15.412 2.633 275 NH2 ARG 37 NH1 ARG 37 14.792 16.005 1.120 276 H ARG 37 H ARG 37 12.211 7.879 2.614 277 HA ARG 37 HA ARG 37 14.140 8.518 0.654 278 1HB ARG 37 1HB ARG 37 12.493 10.174 1.537 279 2HB ARG 37 2HB ARG 37 13.345 10.207 3.087 280 1HG ARG 37 1HG ARG 37 15.388 11.174 1.735 281 2HG ARG 37 2HG ARG 37 14.273 11.304 0.371 282 1HD ARG 37 1HD ARG 37 12.694 12.643 1.959 283 2HD ARG 37 2HD ARG 37 13.979 12.576 3.177 284 1HH1 ARG 37 2HH2 ARG 37 12.702 14.654 3.111 285 2HH1 ARG 37 1HH2 ARG 37 13.059 16.420 2.763 286 1HH2 ARG 37 1HH1 ARG 37 15.504 15.702 0.447 287 2HH2 ARG 37 2HH1 ARG 37 14.539 16.971 1.355 288 H LYS 38 H LYS 38 14.585 7.466 4.029 289 HA LYS 38 HA LYS 38 17.483 8.406 4.052 290 1HB LYS 38 1HB LYS 38 15.806 9.119 5.917 291 2HB LYS 38 2HB LYS 38 15.885 7.458 6.484 292 1HG LYS 38 1HG LYS 38 18.453 7.827 6.750 293 2HG LYS 38 2HG LYS 38 18.202 9.500 6.288 294 1HD LYS 38 1HD LYS 38 16.941 8.074 8.724 295 2HD LYS 38 2HD LYS 38 18.367 9.102 8.767 296 1HE LYS 38 1HE LYS 38 16.965 11.090 7.994 297 2HE LYS 38 2HE LYS 38 15.527 10.062 8.002 298 1HZ LYS 38 1HZ LYS 38 17.227 10.610 10.368 299 2HZ LYS 38 2HZ LYS 38 15.898 9.658 10.367 300 H GLY 39 H GLY 39 16.155 5.791 2.833 301 1HA GLY 39 1HA GLY 39 16.874 3.533 2.490 302 2HA GLY 39 2HA GLY 39 18.379 3.930 3.293 303 H ASP 40 H ASP 40 15.088 3.965 4.556 304 HA ASP 40 HA ASP 40 15.685 1.712 6.540 305 1HB ASP 40 1HB ASP 40 14.101 4.191 7.148 306 2HB ASP 40 2HB ASP 40 14.290 2.834 8.219 307 HD1 ASP 40 HD2 ASP 40 17.576 3.521 9.121 308 H LYS 41 H LYS 41 14.318 0.262 7.082 309 HA LYS 41 HA LYS 41 11.943 -0.205 5.268 310 1HB LYS 41 2HB LYS 41 12.853 -2.091 7.495 311 2HB LYS 41 1HB LYS 41 11.731 -2.435 6.178 312 1HG LYS 41 1HG LYS 41 13.748 -2.078 4.554 313 2HG LYS 41 2HG LYS 41 14.776 -2.042 5.983 314 1HD LYS 41 1HD LYS 41 13.868 -4.334 6.653 315 2HD LYS 41 2HD LYS 41 12.923 -4.389 5.173 316 1HE LYS 41 1HE LYS 41 16.015 -4.197 5.300 317 2HE LYS 41 2HE LYS 41 15.103 -5.692 5.106 318 1HZ LYS 41 1HZ LYS 41 15.031 -3.426 3.195 319 2HZ LYS 41 2HZ LYS 41 14.194 -4.820 3.032 320 H VAL 42 H VAL 42 9.845 0.173 5.986 321 HA VAL 42 HA VAL 42 9.135 1.112 8.554 322 HB VAL 42 HB VAL 42 7.553 0.285 6.086 323 1HG1 VAL 42 1HG2 VAL 42 6.238 1.171 8.068 324 2HG1 VAL 42 2HG2 VAL 42 7.186 2.683 7.945 325 3HG1 VAL 42 3HG2 VAL 42 6.134 2.171 6.596 326 1HG2 VAL 42 2HG1 VAL 42 9.536 1.920 5.416 327 2HG2 VAL 42 3HG1 VAL 42 7.930 2.510 5.110 328 3HG2 VAL 42 1HG1 VAL 42 8.798 3.096 6.538 329 H GLN 43 H GLN 43 6.702 -0.465 8.131 330 HA GLN 43 HA GLN 43 6.235 -2.718 8.159 331 1HB GLN 43 1HB GLN 43 8.021 -3.358 10.421 332 2HB GLN 43 2HB GLN 43 6.603 -4.374 10.127 333 1HG GLN 43 1HG GLN 43 7.164 -4.823 7.864 334 2HG GLN 43 2HG GLN 43 8.470 -3.685 7.815 335 1HE2 GLN 43 2HE2 GLN 43 10.852 -6.065 9.098 336 2HE2 GLN 43 1HE2 GLN 43 10.509 -4.401 8.411 337 H LEU 44 H LEU 44 4.512 -3.725 8.493 338 HA LEU 44 HA LEU 44 2.560 -2.766 10.610 339 1HB LEU 44 2HB LEU 44 1.694 -3.126 7.687 340 2HB LEU 44 1HB LEU 44 0.749 -2.524 9.038 341 HG LEU 44 HG LEU 44 2.778 -0.647 8.984 342 1HD1 LEU 44 3HD1 LEU 44 3.885 -1.677 6.936 343 2HD1 LEU 44 1HD1 LEU 44 2.414 -1.346 5.998 344 3HD1 LEU 44 2HD1 LEU 44 3.368 -0.006 6.691 345 1HD2 LEU 44 3HD2 LEU 44 0.331 -0.132 8.964 346 2HD2 LEU 44 1HD2 LEU 44 1.226 0.885 7.815 347 3HD2 LEU 44 2HD2 LEU 44 0.252 -0.478 7.226 348 H ILE 45 H ILE 45 2.094 -4.698 11.666 349 HA ILE 45 HA ILE 45 2.867 -7.171 10.402 350 HB ILE 45 HB ILE 45 3.348 -6.502 12.776 351 1HG1 ILE 45 1HG1 ILE 45 2.234 -9.354 12.643 352 2HG1 ILE 45 2HG1 ILE 45 3.730 -8.859 11.869 353 1HG2 ILE 45 1HG2 ILE 45 1.052 -5.789 13.425 354 2HG2 ILE 45 2HG2 ILE 45 0.502 -7.483 13.397 355 3HG2 ILE 45 3HG2 ILE 45 1.727 -6.946 14.586 356 1HD1 ILE 45 3HD1 ILE 45 4.706 -8.176 14.103 357 2HD1 ILE 45 1HD1 ILE 45 3.218 -8.742 14.910 358 3HD1 ILE 45 2HD1 ILE 45 4.251 -9.895 14.038 359 H GLY 46 H GLY 46 0.052 -6.119 10.431 360 1HA GLY 46 1HA GLY 46 -1.172 -8.785 9.369 361 2HA GLY 46 2HA GLY 46 -2.211 -7.669 10.228 362 H PHE 47 H PHE 47 0.196 -6.264 8.101 363 HA PHE 47 HA PHE 47 -1.680 -6.013 5.753 364 1HB PHE 47 2HB PHE 47 -2.087 -4.371 7.741 365 2HB PHE 47 1HB PHE 47 -0.549 -3.643 7.416 366 HD1 PHE 47 HD1 PHE 47 -3.792 -4.522 5.607 367 HD2 PHE 47 HD2 PHE 47 -0.349 -1.944 5.721 368 HE1 PHE 47 HE1 PHE 47 -4.566 -3.330 3.577 369 HE2 PHE 47 HE2 PHE 47 -1.204 -0.732 3.765 370 HZ PHE 47 HZ PHE 47 -3.294 -1.485 2.678 371 H GLY 48 H GLY 48 1.684 -5.289 6.900 372 1HA GLY 48 1HA GLY 48 2.731 -5.430 4.246 373 2HA GLY 48 2HA GLY 48 2.427 -3.729 4.541 374 H ASN 49 H ASN 49 4.595 -4.321 3.672 375 HA ASN 49 HA ASN 49 6.570 -3.540 5.813 376 1HB ASN 49 1HB ASN 49 6.816 -6.015 5.852 377 2HB ASN 49 2HB ASN 49 7.048 -6.080 4.121 378 1HD2 ASN 49 1HD2 ASN 49 10.462 -6.401 5.332 379 2HD2 ASN 49 2HD2 ASN 49 8.907 -7.333 5.053 380 H PHE 50 H PHE 50 6.842 -1.599 4.852 381 HA PHE 50 HA PHE 50 7.225 -1.343 1.869 382 1HB PHE 50 2HB PHE 50 7.530 0.761 4.041 383 2HB PHE 50 1HB PHE 50 7.851 1.140 2.414 384 HD1 PHE 50 HD2 PHE 50 5.329 0.308 4.905 385 HD2 PHE 50 HD1 PHE 50 6.166 2.145 1.138 386 HE1 PHE 50 HE2 PHE 50 3.059 1.371 4.908 387 HE2 PHE 50 HE1 PHE 50 3.933 3.222 1.186 388 HZ PHE 50 HZ PHE 50 2.360 2.660 2.995 389 H GLU 51 H GLU 51 9.117 -0.827 0.921 390 HA GLU 51 HA GLU 51 11.308 0.271 2.335 391 1HB GLU 51 1HB GLU 51 13.135 -1.540 2.250 392 2HB GLU 51 2HB GLU 51 11.819 -1.983 3.282 393 1HG GLU 51 1HG GLU 51 12.315 -3.989 2.201 394 2HG GLU 51 2HG GLU 51 10.856 -3.461 1.393 395 HE1 GLU 51 HE2 GLU 51 14.451 -3.603 -0.504 396 H VAL 52 H VAL 52 13.455 0.646 1.160 397 HA VAL 52 HA VAL 52 12.661 1.569 -1.499 398 HB VAL 52 HB VAL 52 14.100 2.516 0.857 399 1HG1 VAL 52 1HG2 VAL 52 16.129 1.858 -1.283 400 2HG1 VAL 52 2HG2 VAL 52 16.348 3.000 0.093 401 3HG1 VAL 52 3HG2 VAL 52 16.032 1.252 0.377 402 1HG2 VAL 52 2HG1 VAL 52 13.756 3.668 -1.917 403 2HG2 VAL 52 3HG1 VAL 52 12.863 3.959 -0.419 404 3HG2 VAL 52 1HG1 VAL 52 14.540 4.505 -0.554 405 NH1 ARG 53 NH2 ARG 53 13.451 -5.870 -2.720 406 NH2 ARG 53 NH1 ARG 53 15.492 -5.360 -1.856 407 H ARG 53 H ARG 53 14.085 1.162 -3.416 408 HA ARG 53 HA ARG 53 15.494 -1.567 -3.278 409 1HB ARG 53 1HB ARG 53 13.007 -1.076 -4.528 410 2HB ARG 53 2HB ARG 53 14.051 -0.385 -5.662 411 1HG ARG 53 1HG ARG 53 13.746 -2.537 -6.495 412 2HG ARG 53 2HG ARG 53 15.363 -2.640 -5.838 413 1HD ARG 53 1HD ARG 53 12.816 -3.574 -4.317 414 2HD ARG 53 2HD ARG 53 13.717 -4.618 -5.418 415 1HH1 ARG 53 2HH2 ARG 53 12.737 -5.668 -3.428 416 2HH1 ARG 53 1HH2 ARG 53 13.405 -6.589 -1.989 417 1HH2 ARG 53 1HH1 ARG 53 16.331 -4.772 -1.903 418 2HH2 ARG 53 2HH1 ARG 53 15.306 -6.114 -1.185 419 H GLU 54 H GLU 54 17.625 -0.757 -3.237 420 HA GLU 54 HA GLU 54 18.528 1.465 -4.975 421 1HB GLU 54 1HB GLU 54 19.640 0.800 -2.823 422 2HB GLU 54 2HB GLU 54 20.271 -0.655 -3.590 423 1HG GLU 54 1HG GLU 54 21.539 0.801 -5.254 424 2HG GLU 54 2HG GLU 54 20.861 2.248 -4.513 425 HE1 GLU 54 HE2 GLU 54 22.931 2.243 -1.747 426 NH1 ARG 55 NH2 ARG 55 14.634 -4.112 -11.157 427 NH2 ARG 55 NH1 ARG 55 14.457 -3.474 -13.331 428 H ARG 55 H ARG 55 17.939 1.098 -7.129 429 HA ARG 55 HA ARG 55 18.272 -1.494 -8.449 430 1HB ARG 55 1HB ARG 55 16.416 0.246 -8.767 431 2HB ARG 55 2HB ARG 55 17.571 1.308 -9.519 432 1HG ARG 55 1HG ARG 55 16.294 0.333 -11.247 433 2HG ARG 55 2HG ARG 55 17.874 -0.421 -11.397 434 1HD ARG 55 1HD ARG 55 17.044 -2.515 -10.315 435 2HD ARG 55 2HD ARG 55 15.516 -1.732 -9.874 436 1HH1 ARG 55 2HH2 ARG 55 15.021 -3.917 -10.227 437 2HH1 ARG 55 1HH2 ARG 55 14.032 -4.900 -11.419 438 1HH2 ARG 55 1HH1 ARG 55 14.708 -2.797 -14.061 439 2HH2 ARG 55 2HH1 ARG 55 13.869 -4.307 -13.442 440 H ALA 56 H ALA 56 19.680 -2.049 -10.060 441 HA ALA 56 HA ALA 56 22.322 -0.501 -10.226 442 1HB ALA 56 3HB ALA 56 21.708 -3.434 -10.950 443 2HB ALA 56 1HB ALA 56 23.292 -2.629 -11.055 444 3HB ALA 56 2HB ALA 56 22.516 -2.847 -9.474 445 H ALA 57 H ALA 57 21.513 1.079 -11.734 446 HA ALA 57 HA ALA 57 20.414 0.817 -14.204 447 1HB ALA 57 3HB ALA 57 21.249 3.019 -13.274 448 2HB ALA 57 1HB ALA 57 22.918 2.578 -13.704 449 3HB ALA 57 2HB ALA 57 21.706 2.849 -14.976 450 NH1 ARG 58 NH2 ARG 58 17.819 -4.080 -14.133 451 NH2 ARG 58 NH1 ARG 58 18.598 -5.402 -12.458 452 H ARG 58 H ARG 58 20.460 -0.139 -15.909 453 HA ARG 58 HA ARG 58 22.969 -1.537 -16.710 454 1HB ARG 58 2HB ARG 58 20.172 -2.490 -17.498 455 2HB ARG 58 1HB ARG 58 21.678 -3.400 -17.624 456 1HG ARG 58 1HG ARG 58 21.789 -3.308 -15.031 457 2HG ARG 58 2HG ARG 58 20.160 -2.615 -15.101 458 1HD ARG 58 1HD ARG 58 19.347 -4.700 -16.352 459 2HD ARG 58 2HD ARG 58 20.951 -5.397 -16.160 460 1HH1 ARG 58 2HH2 ARG 58 17.974 -3.688 -15.069 461 2HH1 ARG 58 1HH2 ARG 58 17.011 -3.913 -13.523 462 1HH2 ARG 58 1HH1 ARG 58 19.342 -6.020 -12.114 463 2HH2 ARG 58 2HH1 ARG 58 17.736 -5.145 -11.964 464 H LYS 59 H LYS 59 22.371 -2.450 -19.220 465 HA LYS 59 HA LYS 59 21.681 -0.104 -21.032 466 1HB LYS 59 1HB LYS 59 24.261 -1.759 -21.339 467 2HB LYS 59 2HB LYS 59 23.550 -0.782 -22.618 468 1HG LYS 59 1HG LYS 59 23.750 1.290 -21.176 469 2HG LYS 59 2HG LYS 59 24.520 0.327 -19.914 470 1HD LYS 59 1HD LYS 59 26.393 -0.285 -21.534 471 2HD LYS 59 2HD LYS 59 25.601 0.663 -22.782 472 1HE LYS 59 1HE LYS 59 27.362 2.045 -21.925 473 2HE LYS 59 2HE LYS 59 25.860 2.766 -21.353 474 1HZ LYS 59 1HZ LYS 59 27.552 2.647 -19.639 475 2HZ LYS 59 2HZ LYS 59 27.683 1.023 -19.777 476 H GLY 60 H GLY 60 19.971 -0.860 -22.216 477 1HA GLY 60 1HA GLY 60 19.998 -3.487 -23.523 478 2HA GLY 60 2HA GLY 60 19.030 -3.599 -22.056 479 NH1 ARG 61 NH2 ARG 61 16.748 -5.411 -27.748 480 NH2 ARG 61 NH1 ARG 61 17.252 -3.955 -29.416 481 H ARG 61 H ARG 61 16.934 -3.170 -22.375 482 HA ARG 61 HA ARG 61 15.985 -1.194 -24.470 483 1HB ARG 61 1HB ARG 61 16.392 -3.400 -25.599 484 2HB ARG 61 2HB ARG 61 15.249 -4.199 -24.524 485 1HG ARG 61 1HG ARG 61 13.370 -2.965 -25.495 486 2HG ARG 61 2HG ARG 61 14.423 -1.883 -26.385 487 1HD ARG 61 1HD ARG 61 14.265 -4.934 -26.906 488 2HD ARG 61 2HD ARG 61 13.285 -3.745 -27.730 489 1HH1 ARG 61 2HH2 ARG 61 16.091 -5.687 -27.009 490 2HH1 ARG 61 1HH2 ARG 61 17.626 -5.880 -27.996 491 1HH2 ARG 61 1HH1 ARG 61 16.985 -3.121 -29.951 492 2HH2 ARG 61 2HH1 ARG 61 18.094 -4.526 -29.548 493 H ASN 62 H ASN 62 13.876 -0.589 -24.327 494 HA ASN 62 HA ASN 62 12.791 -0.359 -21.617 495 1HB ASN 62 1HB ASN 62 12.739 1.406 -23.493 496 2HB ASN 62 2HB ASN 62 11.450 0.492 -24.243 497 1HD2 ASN 62 2HD2 ASN 62 10.467 2.957 -21.201 498 2HD2 ASN 62 1HD2 ASN 62 12.196 2.763 -21.786 499 HA PRO 63 HA PRO 63 10.198 -4.206 -21.864 500 1HB PRO 63 1HB PRO 63 8.690 -2.842 -19.576 501 2HB PRO 63 2HB PRO 63 9.224 -4.530 -19.715 502 1HG PRO 63 1HG PRO 63 10.672 -2.786 -18.218 503 2HG PRO 63 2HG PRO 63 11.529 -3.924 -19.284 504 1HD PRO 63 1HD PRO 63 10.952 -0.954 -19.789 505 2HD PRO 63 2HD PRO 63 12.445 -1.896 -20.087 506 H GLN 64 H GLN 64 8.425 -1.081 -21.626 507 HA GLN 64 HA GLN 64 5.906 -2.198 -22.766 508 1HB GLN 64 1HB GLN 64 6.069 -0.211 -21.074 509 2HB GLN 64 2HB GLN 64 6.697 0.764 -22.370 510 1HG GLN 64 1HG GLN 64 4.425 1.328 -22.215 511 2HG GLN 64 2HG GLN 64 4.559 0.391 -23.689 512 1HE2 GLN 64 2HE2 GLN 64 2.200 -1.107 -20.672 513 2HE2 GLN 64 1HE2 GLN 64 3.268 0.364 -20.424 514 H THR 65 H THR 65 7.986 0.405 -23.870 515 HA THR 65 HA THR 65 6.914 0.484 -26.553 516 HB THR 65 HB THR 65 8.426 2.350 -26.936 517 HG1 THR 65 HG1 THR 65 10.257 1.470 -26.000 518 1HG2 THR 65 2HG2 THR 65 6.418 2.737 -25.341 519 2HG2 THR 65 3HG2 THR 65 7.513 2.478 -23.974 520 3HG2 THR 65 1HG2 THR 65 7.785 3.858 -25.052 521 H GLY 66 H GLY 66 9.940 -1.013 -25.490 522 1HA GLY 66 1HA GLY 66 11.361 -2.510 -26.717 523 2HA GLY 66 2HA GLY 66 10.333 -2.365 -28.124 524 H GLU 67 H GLU 67 11.929 0.372 -26.456 525 HA GLU 67 HA GLU 67 13.592 0.945 -28.954 526 1HB GLU 67 2HB GLU 67 11.870 2.647 -28.007 527 2HB GLU 67 1HB GLU 67 12.961 2.888 -26.646 528 1HG GLU 67 1HG GLU 67 13.701 3.330 -29.620 529 2HG GLU 67 2HG GLU 67 13.054 4.576 -28.573 530 HE2 GLU 67 HE2 GLU 67 16.917 3.978 -28.663 531 H GLU 68 H GLU 68 15.700 0.797 -28.776 532 HA GLU 68 HA GLU 68 16.920 -0.531 -26.441 533 1HB GLU 68 1HB GLU 68 17.461 -1.043 -28.863 534 2HB GLU 68 2HB GLU 68 18.313 0.476 -29.015 535 1HG GLU 68 1HG GLU 68 19.073 -1.832 -27.091 536 2HG GLU 68 2HG GLU 68 19.718 -1.621 -28.700 537 HE2 GLU 68 HE2 GLU 68 21.416 0.237 -25.671 538 H MET 69 H MET 69 17.780 0.506 -24.690 539 HA MET 69 HA MET 69 19.273 2.984 -24.776 540 1HB MET 69 1HB MET 69 17.795 4.595 -23.633 541 2HB MET 69 2HB MET 69 17.177 4.146 -25.193 542 1HG MET 69 1HG MET 69 15.272 4.299 -23.767 543 2HG MET 69 2HG MET 69 15.493 2.567 -24.015 544 1HE MET 69 1HE MET 69 15.778 0.891 -22.076 545 2HE MET 69 3HE MET 69 15.343 1.408 -20.419 546 3HE MET 69 2HE MET 69 14.227 1.728 -21.771 547 H GLU 70 H GLU 70 19.806 3.819 -22.663 548 HA GLU 70 HA GLU 70 20.590 1.639 -20.878 549 1HB GLU 70 2HB GLU 70 21.834 3.169 -19.584 550 2HB GLU 70 1HB GLU 70 22.133 3.494 -21.278 551 1HG GLU 70 1HG GLU 70 20.377 5.192 -19.379 552 2HG GLU 70 2HG GLU 70 22.031 5.535 -19.830 553 HE1 GLU 70 HE2 GLU 70 21.330 6.758 -23.005 554 H ILE 71 H ILE 71 19.563 0.758 -19.174 555 HA ILE 71 HA ILE 71 16.974 1.643 -18.288 556 HB ILE 71 HB ILE 71 18.824 -0.394 -16.919 557 1HG1 ILE 71 1HG1 ILE 71 18.905 -1.224 -19.122 558 2HG1 ILE 71 2HG1 ILE 71 17.855 -2.244 -18.173 559 1HG2 ILE 71 2HG2 ILE 71 16.820 0.207 -15.628 560 2HG2 ILE 71 3HG2 ILE 71 15.776 -0.201 -17.019 561 3HG2 ILE 71 1HG2 ILE 71 16.732 -1.477 -16.199 562 1HD1 ILE 71 2HD1 ILE 71 15.829 -1.060 -19.269 563 2HD1 ILE 71 3HD1 ILE 71 17.013 -0.202 -20.304 564 3HD1 ILE 71 1HD1 ILE 71 16.884 -1.974 -20.382 565 HA PRO 72 HA PRO 72 19.064 4.465 -15.208 566 1HB PRO 72 1HB PRO 72 16.945 6.079 -14.496 567 2HB PRO 72 2HB PRO 72 17.668 6.104 -16.111 568 1HG PRO 72 1HG PRO 72 15.133 4.625 -15.233 569 2HG PRO 72 2HG PRO 72 15.344 5.682 -16.649 570 1HD PRO 72 1HD PRO 72 15.542 2.892 -16.781 571 2HD PRO 72 2HD PRO 72 16.443 3.970 -17.886 572 H ALA 73 H ALA 73 19.417 4.554 -13.034 573 HA ALA 73 HA ALA 73 17.912 2.615 -11.255 574 1HB ALA 73 1HB ALA 73 20.418 2.542 -10.996 575 2HB ALA 73 2HB ALA 73 20.406 4.267 -10.444 576 3HB ALA 73 3HB ALA 73 19.619 3.017 -9.502 577 H SER 74 H SER 74 17.590 3.160 -9.203 578 HA SER 74 HA SER 74 17.758 5.602 -8.004 579 1HB SER 74 1HB SER 74 14.792 5.096 -8.927 580 2HB SER 74 2HB SER 74 15.053 6.065 -7.491 581 HG SER 74 HG SER 74 16.376 7.455 -8.711 582 H LYS 75 H LYS 75 16.466 5.683 -5.737 583 HA LYS 75 HA LYS 75 16.483 2.862 -4.542 584 1HB LYS 75 2HB LYS 75 15.857 5.061 -2.673 585 2HB LYS 75 1HB LYS 75 16.576 3.484 -2.465 586 1HG LYS 75 1HG LYS 75 18.712 4.325 -3.567 587 2HG LYS 75 2HG LYS 75 18.019 5.942 -3.630 588 1HD LYS 75 1HD LYS 75 18.537 4.299 -1.063 589 2HD LYS 75 2HD LYS 75 19.591 5.553 -1.705 590 1HE LYS 75 1HE LYS 75 17.730 7.280 -1.389 591 2HE LYS 75 2HE LYS 75 16.705 6.025 -0.679 592 1HZ LYS 75 1HZ LYS 75 17.868 7.299 0.988 593 2HZ LYS 75 2HZ LYS 75 19.332 6.913 0.370 594 H VAL 76 H VAL 76 14.662 1.988 -5.090 595 HA VAL 76 HA VAL 76 12.271 3.537 -5.595 596 HB VAL 76 HB VAL 76 11.551 2.291 -7.078 597 1HG1 VAL 76 2HG2 VAL 76 13.770 3.382 -7.502 598 2HG1 VAL 76 3HG2 VAL 76 14.507 1.771 -7.292 599 3HG1 VAL 76 1HG2 VAL 76 13.391 2.059 -8.677 600 1HG2 VAL 76 2HG1 VAL 76 11.791 -0.142 -6.112 601 2HG2 VAL 76 3HG1 VAL 76 11.460 0.276 -7.807 602 3HG2 VAL 76 1HG1 VAL 76 13.085 -0.152 -7.373 603 HA PRO 77 HA PRO 77 10.439 1.987 -1.812 604 1HB PRO 77 1HB PRO 77 8.319 3.779 -1.528 605 2HB PRO 77 2HB PRO 77 10.015 4.274 -1.373 606 1HG PRO 77 1HG PRO 77 8.257 4.468 -3.872 607 2HG PRO 77 2HG PRO 77 9.186 5.761 -3.108 608 1HD PRO 77 1HD PRO 77 10.162 4.229 -5.282 609 2HD PRO 77 2HD PRO 77 11.291 4.816 -4.033 610 H ALA 78 H ALA 78 9.517 0.387 -1.603 611 HA ALA 78 HA ALA 78 7.214 -0.684 -3.291 612 1HB ALA 78 2HB ALA 78 9.526 -1.762 -3.349 613 2HB ALA 78 3HB ALA 78 9.441 -2.038 -1.593 614 3HB ALA 78 1HB ALA 78 8.297 -2.864 -2.682 615 H PHE 79 H PHE 79 5.988 -2.262 -2.094 616 HA PHE 79 HA PHE 79 5.335 -1.815 0.865 617 1HB PHE 79 2HB PHE 79 4.102 -0.103 0.316 618 2HB PHE 79 1HB PHE 79 3.508 -0.859 -1.195 619 HD1 PHE 79 HD1 PHE 79 3.123 -0.952 2.538 620 HD2 PHE 79 HD2 PHE 79 1.578 -2.362 -1.223 621 HE1 PHE 79 HE1 PHE 79 1.209 -1.975 3.688 622 HE2 PHE 79 HE2 PHE 79 -0.302 -3.412 -0.053 623 HZ PHE 79 HZ PHE 79 -0.475 -3.261 2.395 624 H LYS 80 H LYS 80 5.265 -3.728 1.291 625 HA LYS 80 HA LYS 80 4.462 -6.325 -0.306 626 1HB LYS 80 2HB LYS 80 5.744 -5.931 2.413 627 2HB LYS 80 1HB LYS 80 4.879 -7.403 2.017 628 1HG LYS 80 1HG LYS 80 7.118 -7.915 1.585 629 2HG LYS 80 2HG LYS 80 6.364 -7.767 0.009 630 1HD LYS 80 1HD LYS 80 7.384 -5.404 -0.180 631 2HD LYS 80 2HD LYS 80 8.176 -5.675 1.379 632 1HE LYS 80 1HE LYS 80 9.418 -7.660 0.411 633 2HE LYS 80 2HE LYS 80 8.620 -7.402 -1.148 634 1HZ LYS 80 1HZ LYS 80 10.804 -6.400 -1.062 635 2HZ LYS 80 2HZ LYS 80 10.410 -5.475 0.227 636 HA PRO 81 HA PRO 81 0.364 -5.814 1.656 637 1HB PRO 81 1HB PRO 81 -0.891 -8.026 0.610 638 2HB PRO 81 2HB PRO 81 -0.385 -6.681 -0.420 639 1HG PRO 81 1HG PRO 81 1.117 -9.312 0.056 640 2HG PRO 81 2HG PRO 81 0.668 -8.587 -1.509 641 1HD PRO 81 1HD PRO 81 3.164 -8.219 -0.305 642 2HD PRO 81 2HD PRO 81 2.429 -6.972 -1.363 643 H GLY 82 H GLY 82 2.562 -6.770 3.216 644 1HA GLY 82 1HA GLY 82 3.425 -8.328 4.825 645 2HA GLY 82 2HA GLY 82 1.862 -7.909 5.496 646 H LYS 83 H LYS 83 1.815 -9.852 2.709 647 HA LYS 83 HA LYS 83 1.053 -12.133 2.318 648 1HB LYS 83 2HB LYS 83 2.412 -12.567 4.963 649 2HB LYS 83 1HB LYS 83 1.054 -13.592 4.774 650 1HG LYS 83 1HG LYS 83 3.041 -14.771 3.968 651 2HG LYS 83 2HG LYS 83 1.996 -14.477 2.594 652 1HD LYS 83 1HD LYS 83 4.269 -14.094 1.892 653 2HD LYS 83 2HD LYS 83 3.445 -12.543 1.870 654 1HE LYS 83 1HE LYS 83 4.537 -11.955 4.115 655 2HE LYS 83 2HE LYS 83 5.361 -13.521 4.106 656 1HZ LYS 83 1HZ LYS 83 6.467 -12.876 2.062 657 2HZ LYS 83 2HZ LYS 83 6.775 -11.804 3.258 658 H ALA 84 H ALA 84 0.095 -10.838 5.237 659 HA ALA 84 HA ALA 84 -2.458 -12.012 5.903 660 1HB ALA 84 2HB ALA 84 -0.918 -10.714 7.397 661 2HB ALA 84 3HB ALA 84 -1.147 -9.250 6.407 662 3HB ALA 84 1HB ALA 84 -2.517 -9.902 7.344 663 H LEU 85 H LEU 85 -1.793 -8.845 4.156 664 HA LEU 85 HA LEU 85 -4.620 -8.425 3.465 665 1HB LEU 85 2HB LEU 85 -3.149 -6.464 3.570 666 2HB LEU 85 1HB LEU 85 -2.078 -7.148 2.367 667 HG LEU 85 HG LEU 85 -4.078 -7.308 0.862 668 1HD1 LEU 85 1HD1 LEU 85 -5.898 -6.687 2.568 669 2HD1 LEU 85 2HD1 LEU 85 -5.382 -4.994 2.342 670 3HD1 LEU 85 3HD1 LEU 85 -5.997 -5.923 0.970 671 1HD2 LEU 85 1HD2 LEU 85 -2.205 -5.664 0.465 672 2HD2 LEU 85 2HD2 LEU 85 -3.738 -4.918 -0.010 673 3HD2 LEU 85 3HD2 LEU 85 -2.976 -4.480 1.539 674 H LYS 86 H LYS 86 -1.836 -9.979 1.909 675 HA LYS 86 HA LYS 86 -3.146 -10.673 -0.608 676 1HB LYS 86 1HB LYS 86 -0.608 -10.848 -0.028 677 2HB LYS 86 2HB LYS 86 -0.964 -12.435 0.630 678 1HG LYS 86 1HG LYS 86 -1.850 -13.160 -1.619 679 2HG LYS 86 2HG LYS 86 -1.586 -11.532 -2.254 680 1HD LYS 86 1HD LYS 86 0.897 -11.755 -1.786 681 2HD LYS 86 2HD LYS 86 0.631 -13.390 -1.169 682 1HE LYS 86 1HE LYS 86 -0.259 -14.103 -3.446 683 2HE LYS 86 2HE LYS 86 0.001 -12.464 -4.061 684 1HZ LYS 86 1HZ LYS 86 1.819 -13.948 -4.594 685 2HZ LYS 86 2HZ LYS 86 2.106 -14.279 -3.019 686 H ASP 87 H ASP 87 -3.676 -12.068 2.566 687 HA ASP 87 HA ASP 87 -5.318 -14.325 1.458 688 1HB ASP 87 1HB ASP 87 -3.754 -13.866 3.853 689 2HB ASP 87 2HB ASP 87 -5.365 -13.631 4.400 690 HD1 ASP 87 HD2 ASP 87 -3.942 -17.251 3.171 691 H ALA 88 H ALA 88 -5.784 -11.174 3.083 692 HA ALA 88 HA ALA 88 -8.672 -11.103 3.415 693 1HB ALA 88 1HB ALA 88 -7.001 -9.225 4.142 694 2HB ALA 88 2HB ALA 88 -6.825 -8.781 2.442 695 3HB ALA 88 3HB ALA 88 -8.383 -8.584 3.204 696 H VAL 89 H VAL 89 -6.632 -10.434 0.508 697 HA VAL 89 HA VAL 89 -8.850 -9.324 -1.052 698 HB VAL 89 HB VAL 89 -6.403 -8.479 -0.273 699 1HG1 VAL 89 2HG2 VAL 89 -5.293 -10.677 -1.123 700 2HG1 VAL 89 3HG2 VAL 89 -5.462 -10.000 -2.753 701 3HG1 VAL 89 1HG2 VAL 89 -4.543 -9.121 -1.487 702 1HG2 VAL 89 1HG1 VAL 89 -7.238 -8.166 -3.106 703 2HG2 VAL 89 2HG1 VAL 89 -7.767 -7.248 -1.632 704 3HG2 VAL 89 3HG1 VAL 89 -6.057 -7.196 -2.127 705 H LYS 90 H LYS 90 -7.314 -12.415 -0.886 706 HA LYS 90 HA LYS 90 -7.135 -13.108 -3.651 707 1HB LYS 90 1HB LYS 90 -6.506 -15.231 -2.953 708 2HB LYS 90 2HB LYS 90 -5.921 -14.117 -1.751 709 1HG LYS 90 1HG LYS 90 -7.837 -14.780 -0.213 710 2HG LYS 90 2HG LYS 90 -8.374 -15.958 -1.407 711 1HD LYS 90 1HD LYS 90 -6.198 -17.181 -1.256 712 2HD LYS 90 2HD LYS 90 -5.560 -15.974 -0.136 713 1HE LYS 90 1HE LYS 90 -7.365 -16.569 1.551 714 2HE LYS 90 2HE LYS 90 -8.012 -17.781 0.433 715 1HZ LYS 90 1HZ LYS 90 -6.526 -18.733 2.071 716 2HZ LYS 90 2HZ LYS 90 -5.284 -17.779 1.602 717 1H MET 1 1H MET 91 10.218 0.567 10.995 718 2H MET 1 2H MET 91 10.857 -0.558 12.070 719 HA MET 1 HA MET 91 9.228 0.292 13.278 720 1HB MET 1 1HB MET 91 7.445 0.441 10.781 721 2HB MET 1 2HB MET 91 6.941 0.892 12.377 722 1HG MET 1 1HG MET 91 8.647 2.758 12.421 723 2HG MET 1 2HG MET 91 9.155 2.298 10.777 724 1HE MET 1 1HE MET 91 8.469 4.065 9.145 725 2HE MET 1 3HE MET 91 7.012 5.082 9.289 726 3HE MET 1 2HE MET 91 8.297 5.177 10.534 727 H ASN 2 H ASN 92 6.523 -1.168 12.063 728 HA ASN 2 HA ASN 92 6.528 -3.768 12.118 729 1HB ASN 2 1HB ASN 92 6.266 -4.965 14.169 730 2HB ASN 2 2HB ASN 92 7.807 -4.186 14.114 731 1HD2 ASN 2 1HD2 ASN 92 5.312 -3.239 17.190 732 2HD2 ASN 2 2HD2 ASN 92 4.746 -4.157 15.704 733 H LYS 3 H LYS 93 4.992 -1.253 13.789 734 HA LYS 3 HA LYS 93 2.611 -0.741 12.781 735 1HB LYS 3 1HB LYS 93 1.849 -3.143 12.585 736 2HB LYS 3 2HB LYS 93 1.864 -3.320 14.322 737 1HG LYS 3 1HG LYS 93 -0.016 -1.761 14.560 738 2HG LYS 3 2HG LYS 93 0.145 -1.154 12.923 739 1HD LYS 3 1HD LYS 93 -0.661 -4.069 13.540 740 2HD LYS 3 2HD LYS 93 -1.817 -2.745 13.470 741 1HE LYS 3 1HE LYS 93 -1.147 -2.230 11.078 742 2HE LYS 3 2HE LYS 93 -0.008 -3.579 11.110 743 1HZ LYS 3 1HZ LYS 93 -2.932 -3.816 11.534 744 2HZ LYS 3 2HZ LYS 93 -1.878 -5.064 11.568 745 H THR 4 H THR 94 4.232 -1.473 15.864 746 HA THR 4 HA THR 94 2.510 0.315 17.403 747 HB THR 4 HB THR 94 4.871 -1.606 17.976 748 HG1 THR 4 HG1 THR 94 3.220 -2.850 18.942 749 1HG2 THR 4 3HG2 THR 94 2.996 -0.015 19.744 750 2HG2 THR 4 1HG2 THR 94 4.105 -1.354 20.308 751 3HG2 THR 4 2HG2 THR 94 4.783 0.154 19.572 752 H GLU 5 H GLU 95 5.675 0.122 15.850 753 HA GLU 5 HA GLU 95 6.760 2.678 17.043 754 1HB GLU 5 1HB GLU 95 7.630 1.442 14.401 755 2HB GLU 5 2HB GLU 95 8.463 2.688 15.298 756 1HG GLU 5 1HG GLU 95 8.183 -0.280 16.044 757 2HG GLU 5 2HG GLU 95 9.616 0.511 15.444 758 HE2 GLU 5 HE2 GLU 95 8.642 0.652 19.343 759 H LEU 6 H LEU 96 4.426 1.688 14.804 760 HA LEU 6 HA LEU 96 4.064 4.128 13.151 761 1HB LEU 6 2HB LEU 96 3.090 1.420 13.102 762 2HB LEU 6 1HB LEU 96 1.682 2.295 13.648 763 HG LEU 6 HG LEU 96 3.158 2.930 11.095 764 1HD1 LEU 6 3HD1 LEU 96 0.477 1.534 11.565 765 2HD1 LEU 6 1HD1 LEU 96 1.128 2.020 9.981 766 3HD1 LEU 6 2HD1 LEU 96 1.962 0.782 10.943 767 1HD2 LEU 6 1HD2 LEU 96 1.011 4.456 12.539 768 2HD2 LEU 6 2HD2 LEU 96 2.345 5.023 11.530 769 3HD2 LEU 6 3HD2 LEU 96 0.903 4.294 10.782 770 H ILE 7 H ILE 97 2.459 2.641 16.033 771 HA ILE 7 HA ILE 97 0.508 4.727 16.515 772 HB ILE 7 HB ILE 97 1.752 2.850 18.622 773 1HG1 ILE 7 1HG1 ILE 97 -0.809 2.329 17.005 774 2HG1 ILE 7 2HG1 ILE 97 0.710 1.701 16.508 775 1HG2 ILE 7 2HG2 ILE 97 0.365 4.740 19.623 776 2HG2 ILE 7 3HG2 ILE 97 -1.012 4.191 18.680 777 3HG2 ILE 7 1HG2 ILE 97 -0.333 3.144 19.935 778 1HD1 ILE 7 3HD1 ILE 97 0.968 0.493 18.763 779 2HD1 ILE 7 1HD1 ILE 97 -0.734 0.843 19.024 780 3HD1 ILE 7 2HD1 ILE 97 -0.235 -0.111 17.599 781 H ASN 8 H ASN 98 3.709 4.223 17.999 782 HA ASN 8 HA ASN 98 3.661 6.804 19.456 783 1HB ASN 8 1HB ASN 98 6.129 5.071 18.713 784 2HB ASN 8 2HB ASN 98 6.173 6.442 19.798 785 1HD2 ASN 8 2HD2 ASN 98 5.178 2.899 21.428 786 2HD2 ASN 8 1HD2 ASN 98 5.782 3.108 19.708 787 H ALA 9 H ALA 99 4.250 6.221 16.106 788 HA ALA 9 HA ALA 99 5.778 8.759 15.580 789 1HB ALA 9 2HB ALA 99 5.561 6.720 13.808 790 2HB ALA 9 3HB ALA 99 3.868 7.178 13.634 791 3HB ALA 9 1HB ALA 99 5.068 8.332 13.157 792 H VAL 10 H VAL 100 2.360 7.660 15.493 793 HA VAL 10 HA VAL 100 1.414 10.067 14.378 794 HB VAL 10 HB VAL 100 -0.471 8.190 15.817 795 1HG1 VAL 10 3HG2 VAL 100 -1.083 10.316 14.314 796 2HG1 VAL 10 1HG2 VAL 100 -0.981 9.089 13.013 797 3HG1 VAL 10 2HG2 VAL 100 -2.081 8.825 14.374 798 1HG2 VAL 10 1HG1 VAL 100 1.178 7.528 13.373 799 2HG2 VAL 10 2HG1 VAL 100 0.850 6.649 14.904 800 3HG2 VAL 10 3HG1 VAL 100 -0.443 6.748 13.669 801 H ALA 11 H ALA 101 1.139 8.597 17.432 802 HA ALA 11 HA ALA 101 -0.002 10.894 18.600 803 1HB ALA 11 2HB ALA 101 -0.233 8.562 19.609 804 2HB ALA 11 3HB ALA 101 1.501 8.548 20.008 805 3HB ALA 11 1HB ALA 101 0.387 9.661 20.866 806 H GLU 12 H GLU 102 3.369 10.270 18.010 807 HA GLU 12 HA GLU 102 4.218 12.507 19.833 808 1HB GLU 12 1HB GLU 102 5.785 10.558 19.476 809 2HB GLU 12 2HB GLU 102 5.884 10.948 17.767 810 1HG GLU 12 1HG GLU 102 7.893 11.743 18.838 811 2HG GLU 12 2HG GLU 102 6.988 13.150 18.321 812 HE1 GLU 12 HE2 GLU 102 7.646 12.343 22.239 813 H THR 13 H THR 103 3.882 12.019 16.243 814 HA THR 13 HA THR 103 4.246 15.014 15.984 815 HB THR 13 HB THR 103 5.432 13.140 14.645 816 HG1 THR 13 HG1 THR 103 4.511 15.544 13.468 817 1HG2 THR 13 3HG2 THR 103 3.580 12.103 13.471 818 2HG2 THR 13 1HG2 THR 103 3.167 13.647 12.678 819 3HG2 THR 13 2HG2 THR 103 4.725 12.847 12.338 820 H SER 14 H SER 104 1.806 13.592 16.720 821 HA SER 14 HA SER 104 -0.052 15.744 15.484 822 1HB SER 14 1HB SER 104 -1.131 12.940 16.137 823 2HB SER 14 2HB SER 104 -1.984 14.270 15.369 824 HG SER 14 HG SER 104 -1.211 12.758 13.894 825 H GLY 15 H GLY 105 0.620 13.907 18.494 826 1HA GLY 15 1HA GLY 105 -0.128 14.274 20.701 827 2HA GLY 15 2HA GLY 105 -0.601 15.902 20.225 828 H LEU 16 H LEU 106 -1.692 12.647 19.490 829 HA LEU 16 HA LEU 106 -4.525 13.128 20.455 830 1HB LEU 16 1HB LEU 106 -5.232 11.364 19.000 831 2HB LEU 16 2HB LEU 106 -4.702 12.846 18.230 832 HG LEU 16 HG LEU 106 -2.694 11.988 17.550 833 1HD1 LEU 16 2HD1 LEU 106 -2.070 10.543 19.530 834 2HD1 LEU 16 3HD1 LEU 106 -3.242 9.351 18.881 835 3HD1 LEU 16 1HD1 LEU 106 -1.738 9.804 17.961 836 1HD2 LEU 16 2HD2 LEU 106 -4.000 11.652 15.860 837 2HD2 LEU 16 3HD2 LEU 106 -2.555 10.614 15.975 838 3HD2 LEU 16 1HD2 LEU 106 -4.124 9.919 16.333 839 H SER 17 H SER 107 -4.083 10.211 20.412 840 HA SER 17 HA SER 107 -2.945 9.726 23.207 841 1HB SER 17 1HB SER 107 -5.544 8.340 22.428 842 2HB SER 17 2HB SER 107 -4.645 8.192 23.916 843 HG SER 17 HG SER 107 -5.004 10.399 24.320 844 H LYS 18 H LYS 108 -2.248 7.574 23.549 845 HA LYS 18 HA LYS 108 -0.985 6.208 21.183 846 1HB LYS 18 1HB LYS 108 0.030 6.307 23.555 847 2HB LYS 18 2HB LYS 108 -1.172 5.129 24.069 848 1HG LYS 18 1HG LYS 108 -0.259 3.475 22.396 849 2HG LYS 18 2HG LYS 108 0.851 4.704 21.774 850 1HD LYS 18 1HD LYS 108 2.011 4.854 23.972 851 2HD LYS 18 2HD LYS 108 0.920 3.640 24.655 852 1HE LYS 18 1HE LYS 108 1.748 1.934 22.963 853 2HE LYS 18 2HE LYS 108 2.807 3.152 22.241 854 1HZ LYS 18 1HZ LYS 108 3.977 3.330 24.339 855 2HZ LYS 18 2HZ LYS 108 4.011 1.796 23.776 856 H LYS 19 H LYS 109 -3.736 5.513 23.301 857 HA LYS 19 HA LYS 109 -4.800 3.222 21.779 858 1HB LYS 19 2HB LYS 109 -5.424 3.810 24.149 859 2HB LYS 19 1HB LYS 109 -6.322 5.222 23.582 860 1HG LYS 19 1HG LYS 109 -7.906 3.723 22.340 861 2HG LYS 19 2HG LYS 109 -6.944 2.305 22.764 862 1HD LYS 19 1HD LYS 109 -7.372 2.715 25.207 863 2HD LYS 19 2HD LYS 109 -8.320 4.147 24.842 864 1HE LYS 19 1HE LYS 109 -9.051 1.294 23.864 865 2HE LYS 19 2HE LYS 109 -9.632 1.997 25.372 866 1HZ LYS 19 1HZ LYS 109 -10.131 3.158 22.692 867 2HZ LYS 19 2HZ LYS 109 -10.666 3.781 24.105 868 H ASP 20 H ASP 110 -5.253 6.820 21.330 869 HA ASP 20 HA ASP 110 -7.251 6.397 19.111 870 1HB ASP 20 1HB ASP 110 -5.801 8.896 20.161 871 2HB ASP 20 2HB ASP 110 -6.568 8.952 18.599 872 HD2 ASP 20 HD2 ASP 110 -8.795 9.057 21.908 873 H ALA 21 H ALA 111 -3.758 6.661 19.241 874 HA ALA 21 HA ALA 111 -3.357 6.918 16.302 875 1HB ALA 21 1HB ALA 111 -1.451 6.394 18.663 876 2HB ALA 21 2HB ALA 111 -0.921 6.386 16.956 877 3HB ALA 21 3HB ALA 111 -1.631 7.815 17.658 878 H THR 22 H THR 112 -3.329 4.122 18.605 879 HA THR 22 HA THR 112 -2.798 2.033 16.701 880 HB THR 22 HB THR 112 -4.726 1.747 19.102 881 HG1 THR 22 HG1 THR 112 -2.915 2.906 19.767 882 1HG2 THR 22 2HG2 THR 112 -2.573 -0.056 17.841 883 2HG2 THR 22 3HG2 THR 112 -3.473 -0.439 19.337 884 3HG2 THR 22 1HG2 THR 112 -4.336 -0.304 17.764 885 H LYS 23 H LYS 113 -5.870 3.350 17.691 886 HA LYS 23 HA LYS 113 -7.660 1.886 15.876 887 1HB LYS 23 2HB LYS 113 -7.692 4.770 17.098 888 2HB LYS 23 1HB LYS 113 -9.034 4.211 16.171 889 1HG LYS 23 1HG LYS 113 -9.498 2.327 17.777 890 2HG LYS 23 2HG LYS 113 -8.132 2.824 18.774 891 1HD LYS 23 1HD LYS 113 -9.199 5.076 19.150 892 2HD LYS 23 2HD LYS 113 -10.571 4.633 18.147 893 1HE LYS 23 1HE LYS 113 -9.764 3.156 20.749 894 2HE LYS 23 2HE LYS 113 -10.934 4.472 20.677 895 1HZ LYS 23 1HZ LYS 113 -11.993 2.318 20.640 896 2HZ LYS 23 2HZ LYS 113 -11.201 1.871 19.281 897 H ALA 24 H ALA 114 -6.259 5.053 15.543 898 HA ALA 24 HA ALA 114 -7.252 5.752 12.958 899 1HB ALA 24 3HB ALA 114 -4.778 6.712 14.455 900 2HB ALA 24 1HB ALA 114 -5.500 7.531 13.031 901 3HB ALA 24 2HB ALA 114 -6.451 7.363 14.533 902 H VAL 25 H VAL 115 -4.231 4.045 13.683 903 HA VAL 25 HA VAL 115 -3.337 3.614 10.829 904 HB VAL 25 HB VAL 115 -3.045 2.433 13.791 905 1HG1 VAL 25 2HG2 VAL 115 -1.835 0.922 11.408 906 2HG1 VAL 25 3HG2 VAL 115 -1.461 0.660 13.145 907 3HG1 VAL 25 1HG2 VAL 115 -3.070 0.325 12.529 908 1HG2 VAL 25 3HG1 VAL 115 -0.971 3.511 11.853 909 2HG2 VAL 25 1HG1 VAL 115 -1.695 4.389 13.224 910 3HG2 VAL 25 2HG1 VAL 115 -0.673 2.979 13.548 911 H ASP 26 H ASP 116 -5.204 1.455 13.102 912 HA ASP 26 HA ASP 116 -6.307 -0.061 10.731 913 1HB ASP 26 1HB ASP 116 -5.782 -0.974 13.116 914 2HB ASP 26 2HB ASP 116 -7.256 -0.164 13.653 915 HD2 ASP 26 HD2 ASP 116 -8.961 -1.238 13.508 916 H ALA 27 H ALA 117 -6.824 2.647 11.103 917 HA ALA 27 HA ALA 117 -9.754 2.889 10.300 918 1HB ALA 27 2HB ALA 117 -9.016 4.424 12.157 919 2HB ALA 27 3HB ALA 117 -7.901 5.164 10.989 920 3HB ALA 27 1HB ALA 117 -9.602 5.166 10.658 921 H VAL 28 H VAL 118 -6.587 4.117 9.364 922 HA VAL 28 HA VAL 118 -7.183 4.718 6.538 923 HB VAL 28 HB VAL 118 -4.377 3.921 7.668 924 1HG1 VAL 28 1HG2 VAL 118 -5.392 5.266 5.148 925 2HG1 VAL 28 2HG2 VAL 118 -3.788 5.696 5.794 926 3HG1 VAL 28 3HG2 VAL 118 -4.137 4.004 5.402 927 1HG2 VAL 28 1HG1 VAL 118 -5.701 6.619 7.834 928 2HG2 VAL 28 2HG1 VAL 118 -4.884 5.607 9.072 929 3HG2 VAL 28 3HG1 VAL 118 -3.900 6.357 7.836 930 H PHE 29 H PHE 119 -5.318 2.231 8.032 931 HA PHE 29 HA PHE 119 -5.224 0.351 5.722 932 1HB PHE 29 2HB PHE 119 -4.368 -0.347 8.559 933 2HB PHE 29 1HB PHE 119 -3.898 -1.182 7.083 934 HD1 PHE 29 HD1 PHE 119 -2.961 0.667 5.144 935 HD2 PHE 29 HD2 PHE 119 -2.659 1.081 9.403 936 HE1 PHE 29 HE1 PHE 119 -1.302 2.441 4.849 937 HE2 PHE 29 HE2 PHE 119 -1.047 2.904 9.105 938 HZ PHE 29 HZ PHE 119 -0.404 3.606 6.806 939 H ASP 30 H ASP 120 -7.657 0.627 8.237 940 HA ASP 30 HA ASP 120 -8.835 -2.039 7.527 941 1HB ASP 30 1HB ASP 120 -9.225 -0.674 9.703 942 2HB ASP 30 2HB ASP 120 -10.334 0.339 8.809 943 HD1 ASP 30 HD2 ASP 120 -12.893 -1.979 8.628 944 H SER 31 H SER 121 -9.216 1.308 6.649 945 HA SER 31 HA SER 121 -11.403 0.926 4.653 946 1HB SER 31 2HB SER 121 -9.627 3.393 5.025 947 2HB SER 31 1HB SER 121 -11.052 3.271 3.962 948 HG SER 31 HG SER 121 -11.026 2.815 6.756 949 H ILE 32 H ILE 122 -7.712 0.814 4.267 950 HA ILE 32 HA ILE 122 -7.800 0.682 1.346 951 HB ILE 32 HB ILE 122 -5.817 -0.548 3.359 952 1HG1 ILE 32 1HG1 ILE 122 -3.997 0.643 2.567 953 2HG1 ILE 32 2HG1 ILE 122 -4.924 1.597 1.423 954 1HG2 ILE 32 2HG2 ILE 122 -6.148 -0.538 0.295 955 2HG2 ILE 32 3HG2 ILE 122 -4.486 -0.697 0.858 956 3HG2 ILE 32 1HG2 ILE 122 -5.729 -1.892 1.318 957 1HD1 ILE 32 2HD1 ILE 122 -4.676 1.948 4.460 958 2HD1 ILE 32 3HD1 ILE 122 -3.918 2.898 3.221 959 3HD1 ILE 32 1HD1 ILE 122 -5.676 3.017 3.428 960 H THR 33 H THR 123 -7.790 -1.765 4.063 961 HA THR 33 HA THR 123 -7.815 -4.057 2.304 962 HB THR 33 HB THR 123 -8.476 -5.474 4.049 963 HG1 THR 33 HG1 THR 123 -10.029 -4.140 5.033 964 1HG2 THR 33 1HG2 THR 123 -6.385 -3.355 4.725 965 2HG2 THR 33 2HG2 THR 123 -6.730 -4.582 5.942 966 3HG2 THR 33 3HG2 THR 123 -6.139 -5.040 4.327 967 H GLU 34 H GLU 124 -10.467 -2.186 3.337 968 HA GLU 34 HA GLU 124 -12.553 -4.000 2.126 969 1HB GLU 34 1HB GLU 124 -13.080 -2.661 4.271 970 2HB GLU 34 2HB GLU 124 -12.946 -1.175 3.338 971 1HG GLU 34 1HG GLU 124 -14.899 -1.948 1.884 972 2HG GLU 34 2HG GLU 124 -14.986 -3.449 2.800 973 HE1 GLU 34 HE2 GLU 124 -16.517 -2.064 5.584 974 H ALA 35 H ALA 125 -10.468 -1.361 1.160 975 HA ALA 35 HA ALA 125 -11.998 -0.819 -1.326 976 1HB ALA 35 3HB ALA 125 -10.182 0.982 -0.458 977 2HB ALA 35 1HB ALA 125 -8.959 -0.221 -0.871 978 3HB ALA 35 2HB ALA 125 -9.915 0.484 -2.139 979 H LEU 36 H LEU 126 -8.734 -2.504 -0.755 980 HA LEU 36 HA LEU 126 -8.649 -3.618 -3.389 981 1HB LEU 36 2HB LEU 126 -7.428 -4.436 -0.799 982 2HB LEU 36 1HB LEU 126 -6.787 -4.829 -2.393 983 HG LEU 36 HG LEU 126 -6.992 -1.954 -1.340 984 1HD1 LEU 36 3HD1 LEU 126 -4.798 -3.041 -0.834 985 2HD1 LEU 36 1HD1 LEU 126 -4.499 -2.842 -2.633 986 3HD1 LEU 36 2HD1 LEU 126 -4.877 -1.419 -1.592 987 1HD2 LEU 36 2HD2 LEU 126 -6.861 -2.260 -4.133 988 2HD2 LEU 36 3HD2 LEU 126 -7.901 -1.289 -3.079 989 3HD2 LEU 36 1HD2 LEU 126 -6.216 -0.855 -3.274 990 NH1 ARG 37 NH2 ARG 127 -10.780 -8.177 5.124 991 NH2 ARG 37 NH1 ARG 127 -11.453 -10.267 4.535 992 H ARG 37 H ARG 127 -9.955 -5.022 -0.299 993 HA ARG 37 HA ARG 127 -10.265 -7.538 -1.601 994 1HB ARG 37 1HB ARG 127 -11.182 -8.562 0.210 995 2HB ARG 37 2HB ARG 127 -10.110 -7.366 0.891 996 1HG ARG 37 1HG ARG 127 -12.424 -5.906 0.984 997 2HG ARG 37 2HG ARG 127 -13.190 -7.477 0.864 998 1HD ARG 37 1HD ARG 127 -11.136 -6.594 2.953 999 2HD ARG 37 2HD ARG 127 -12.897 -6.595 3.174 1000 1HH1 ARG 37 2HH2 ARG 127 -10.765 -7.177 4.897 1001 2HH1 ARG 37 1HH2 ARG 127 -10.355 -8.628 5.942 1002 1HH2 ARG 37 1HH1 ARG 127 -11.949 -10.861 3.862 1003 2HH2 ARG 37 2HH1 ARG 127 -10.982 -10.571 5.394 1004 H LYS 38 H LYS 128 -12.249 -4.601 -1.692 1005 HA LYS 38 HA LYS 128 -14.745 -6.159 -2.413 1006 1HB LYS 38 1HB LYS 128 -14.783 -4.381 -0.608 1007 2HB LYS 38 2HB LYS 128 -14.519 -3.170 -1.869 1008 1HG LYS 38 1HG LYS 128 -16.745 -3.728 -2.874 1009 2HG LYS 38 2HG LYS 128 -16.915 -5.101 -1.788 1010 1HD LYS 38 1HD LYS 128 -18.286 -3.339 -0.915 1011 2HD LYS 38 2HD LYS 128 -16.943 -3.551 0.201 1012 1HE LYS 38 1HE LYS 128 -15.793 -1.501 -0.842 1013 2HE LYS 38 2HE LYS 128 -17.174 -1.307 -1.930 1014 1HZ LYS 38 1HZ LYS 128 -18.589 -1.057 0.038 1015 2HZ LYS 38 2HZ LYS 128 -17.306 -1.238 1.035 1016 H GLY 39 H GLY 129 -12.146 -5.046 -4.159 1017 1HA GLY 39 1HA GLY 129 -11.864 -4.543 -6.510 1018 2HA GLY 39 2HA GLY 129 -13.598 -4.668 -6.756 1019 H ASP 40 H ASP 130 -11.810 -2.622 -4.533 1020 HA ASP 40 HA ASP 130 -12.544 -0.018 -5.963 1021 1HB ASP 40 1HB ASP 130 -13.001 -0.770 -3.073 1022 2HB ASP 40 2HB ASP 130 -12.856 0.908 -3.562 1023 HD2 ASP 40 HD2 ASP 130 -16.167 -1.254 -4.236 1024 H LYS 41 H LYS 131 -11.324 1.664 -5.895 1025 HA LYS 41 HA LYS 131 -8.373 1.156 -5.370 1026 1HB LYS 41 2HB LYS 131 -9.585 3.647 -6.683 1027 2HB LYS 41 1HB LYS 131 -7.883 3.183 -6.632 1028 1HG LYS 41 1HG LYS 131 -8.592 1.066 -8.007 1029 2HG LYS 41 2HG LYS 131 -10.137 1.849 -8.250 1030 1HD LYS 41 1HD LYS 131 -7.385 2.969 -9.081 1031 2HD LYS 41 2HD LYS 131 -8.506 2.167 -10.156 1032 1HE LYS 41 1HE LYS 131 -9.058 4.867 -8.740 1033 2HE LYS 41 2HE LYS 131 -8.482 4.680 -10.392 1034 1HZ LYS 41 1HZ LYS 131 -10.510 3.529 -10.962 1035 2HZ LYS 41 2HZ LYS 131 -10.831 5.016 -10.364 1036 H VAL 42 H VAL 132 -7.227 2.277 -3.707 1037 HA VAL 42 HA VAL 132 -8.540 3.823 -1.754 1038 HB VAL 42 HB VAL 132 -5.619 3.213 -2.256 1039 1HG1 VAL 42 3HG2 VAL 132 -6.371 4.639 -0.236 1040 2HG1 VAL 42 1HG2 VAL 132 -7.195 3.174 0.355 1041 3HG1 VAL 42 2HG2 VAL 132 -5.420 3.152 0.082 1042 1HG2 VAL 42 3HG1 VAL 132 -6.962 0.976 -2.361 1043 2HG2 VAL 42 1HG1 VAL 132 -5.895 1.097 -0.951 1044 3HG2 VAL 42 2HG1 VAL 132 -7.639 1.377 -0.773 1045 H GLN 43 H GLN 133 -6.048 5.385 -1.692 1046 HA GLN 43 HA GLN 133 -4.955 6.730 -3.192 1047 1HB GLN 43 1HB GLN 133 -7.378 8.107 -4.207 1048 2HB GLN 43 2HB GLN 133 -5.809 8.900 -4.315 1049 1HG GLN 43 1HG GLN 133 -4.817 6.925 -5.442 1050 2HG GLN 43 2HG GLN 133 -6.318 6.057 -5.370 1051 1HE2 GLN 43 2HE2 GLN 133 -6.518 7.272 -8.777 1052 2HE2 GLN 43 1HE2 GLN 133 -5.916 5.918 -7.695 1053 H LEU 44 H LEU 134 -3.523 8.110 -2.879 1054 HA LEU 44 HA LEU 134 -3.803 10.238 -0.742 1055 1HB LEU 44 2HB LEU 134 -1.278 8.496 -0.964 1056 2HB LEU 44 1HB LEU 134 -1.666 9.731 0.221 1057 HG LEU 44 HG LEU 134 -3.700 7.991 0.723 1058 1HD1 LEU 44 1HD1 LEU 134 -3.120 6.265 -0.989 1059 2HD1 LEU 44 2HD1 LEU 134 -1.504 6.067 -0.270 1060 3HD1 LEU 44 3HD1 LEU 134 -2.968 5.621 0.644 1061 1HD2 LEU 44 2HD2 LEU 134 -2.000 8.775 2.405 1062 2HD2 LEU 44 3HD2 LEU 134 -2.281 7.029 2.559 1063 3HD2 LEU 44 1HD2 LEU 134 -0.803 7.622 1.764 1064 H ILE 45 H ILE 135 -3.468 12.061 -2.012 1065 HA ILE 45 HA ILE 135 -2.019 11.803 -4.527 1066 HB ILE 45 HB ILE 135 -4.195 13.038 -4.202 1067 1HG1 ILE 45 1HG1 ILE 135 -2.143 14.729 -5.732 1068 2HG1 ILE 45 2HG1 ILE 135 -2.767 13.194 -6.314 1069 1HG2 ILE 45 3HG2 ILE 135 -3.566 14.362 -2.188 1070 2HG2 ILE 45 1HG2 ILE 135 -2.455 15.351 -3.168 1071 3HG2 ILE 45 2HG2 ILE 135 -4.217 15.400 -3.471 1072 1HD1 ILE 45 1HD1 ILE 135 -5.127 14.113 -6.310 1073 2HD1 ILE 45 2HD1 ILE 135 -4.491 15.698 -5.792 1074 3HD1 ILE 45 3HD1 ILE 135 -4.023 15.023 -7.368 1075 H GLY 46 H GLY 136 -0.857 12.676 -1.904 1076 1HA GLY 46 1HA GLY 136 1.748 13.870 -3.143 1077 2HA GLY 46 2HA GLY 136 1.300 14.255 -1.498 1078 H PHE 47 H PHE 137 0.649 10.930 -2.215 1079 HA PHE 47 HA PHE 137 3.386 9.978 -1.329 1080 1HB PHE 47 2HB PHE 137 1.768 10.694 0.545 1081 2HB PHE 47 1HB PHE 137 0.698 9.396 0.130 1082 HD1 PHE 47 HD1 PHE 137 4.144 10.100 1.475 1083 HD2 PHE 47 HD2 PHE 137 1.261 7.025 0.578 1084 HE1 PHE 47 HE1 PHE 137 5.624 8.367 2.445 1085 HE2 PHE 47 HE2 PHE 137 2.794 5.339 1.483 1086 HZ PHE 47 HZ PHE 137 5.027 6.031 2.312 1087 H GLY 48 H GLY 138 0.149 8.779 -2.460 1088 1HA GLY 48 1HA GLY 138 1.362 6.260 -3.399 1089 2HA GLY 48 2HA GLY 138 0.528 6.039 -1.892 1090 H ASN 49 H ASN 139 -0.006 5.143 -4.777 1091 HA ASN 49 HA ASN 139 -3.043 5.636 -4.603 1092 1HB ASN 49 1HB ASN 139 -1.462 5.549 -7.237 1093 2HB ASN 49 2HB ASN 139 -3.204 5.581 -7.080 1094 1HD2 ASN 49 1HD2 ASN 139 -2.029 9.063 -7.847 1095 2HD2 ASN 49 2HD2 ASN 139 -1.792 7.402 -8.590 1096 H PHE 50 H PHE 140 -3.576 3.720 -3.691 1097 HA PHE 50 HA PHE 140 -2.307 1.131 -4.641 1098 1HB PHE 50 2HB PHE 140 -4.544 1.455 -2.616 1099 2HB PHE 50 1HB PHE 140 -3.888 -0.050 -2.991 1100 HD1 PHE 50 HD2 PHE 140 -3.353 3.212 -1.441 1101 HD2 PHE 50 HD1 PHE 140 -2.427 -0.959 -1.424 1102 HE1 PHE 50 HE2 PHE 140 -2.339 3.443 0.823 1103 HE2 PHE 50 HE1 PHE 140 -1.430 -0.715 0.834 1104 HZ PHE 50 HZ PHE 140 -1.385 1.509 1.886 1105 H GLU 51 H GLU 141 -3.443 -0.488 -5.526 1106 HA GLU 51 HA GLU 141 -6.243 -0.629 -5.605 1107 1HB GLU 51 1HB GLU 141 -6.836 -0.351 -8.086 1108 2HB GLU 51 2HB GLU 141 -6.165 1.123 -7.463 1109 1HG GLU 51 1HG GLU 141 -5.157 0.971 -9.565 1110 2HG GLU 51 2HG GLU 141 -3.871 0.445 -8.500 1111 HE1 GLU 51 HE2 GLU 141 -5.647 -2.058 -11.159 1112 H VAL 52 H VAL 142 -7.249 -2.469 -6.969 1113 HA VAL 52 HA VAL 142 -5.371 -4.716 -6.596 1114 HB VAL 52 HB VAL 142 -7.905 -3.940 -5.546 1115 1HG1 VAL 52 1HG2 VAL 142 -8.486 -5.959 -7.729 1116 2HG1 VAL 52 2HG2 VAL 142 -9.542 -5.517 -6.337 1117 3HG1 VAL 52 3HG2 VAL 142 -9.094 -4.300 -7.574 1118 1HG2 VAL 52 1HG1 VAL 142 -6.655 -6.695 -5.569 1119 2HG2 VAL 52 2HG1 VAL 142 -6.333 -5.340 -4.450 1120 3HG2 VAL 52 3HG1 VAL 142 -7.920 -6.096 -4.492 1121 NH1 ARG 53 NH2 ARG 143 0.513 -8.119 -12.396 1122 NH2 ARG 53 NH1 ARG 143 -0.117 -10.026 -11.330 1123 H ARG 53 H ARG 143 -5.478 -6.536 -7.971 1124 HA ARG 53 HA ARG 143 -6.033 -5.878 -10.939 1125 1HB ARG 53 1HB ARG 143 -3.559 -5.773 -10.201 1126 2HB ARG 53 2HB ARG 143 -3.647 -7.482 -9.853 1127 1HG ARG 53 1HG ARG 143 -4.329 -7.898 -12.312 1128 2HG ARG 53 2HG ARG 143 -4.152 -6.173 -12.594 1129 1HD ARG 53 1HD ARG 143 -2.126 -7.160 -13.380 1130 2HD ARG 53 2HD ARG 143 -1.693 -6.332 -11.882 1131 1HH1 ARG 53 2HH2 ARG 143 0.232 -7.211 -12.783 1132 2HH1 ARG 53 1HH2 ARG 143 1.457 -8.521 -12.394 1133 1HH2 ARG 53 1HH1 ARG 143 -0.875 -10.573 -10.906 1134 2HH2 ARG 53 2HH1 ARG 143 0.870 -10.295 -11.401 1135 H GLU 54 H GLU 144 -7.982 -6.961 -11.022 1136 HA GLU 54 HA GLU 144 -8.384 -9.630 -9.883 1137 1HB GLU 54 1HB GLU 144 -10.568 -9.650 -10.585 1138 2HB GLU 54 2HB GLU 144 -10.214 -8.005 -10.167 1139 1HG GLU 54 1HG GLU 144 -11.493 -7.701 -12.073 1140 2HG GLU 54 2HG GLU 144 -9.880 -7.580 -12.762 1141 HE2 GLU 54 HE2 GLU 144 -10.576 -10.021 -15.057 1142 NH1 ARG 55 NH2 ARG 145 -5.679 -18.853 -10.998 1143 NH2 ARG 55 NH1 ARG 145 -4.670 -19.214 -13.003 1144 H ARG 55 H ARG 145 -8.126 -11.565 -10.628 1145 HA ARG 55 HA ARG 145 -6.675 -12.063 -13.184 1146 1HB ARG 55 1HB ARG 145 -6.199 -13.284 -10.987 1147 2HB ARG 55 2HB ARG 145 -7.757 -14.085 -11.121 1148 1HG ARG 55 1HG ARG 145 -6.949 -15.094 -13.363 1149 2HG ARG 55 2HG ARG 145 -5.365 -14.381 -13.042 1150 1HD ARG 55 1HD ARG 145 -5.227 -15.725 -10.887 1151 2HD ARG 55 2HD ARG 145 -6.852 -16.369 -11.198 1152 1HH1 ARG 55 1HH2 ARG 145 -5.547 -19.858 -10.838 1153 2HH1 ARG 55 2HH2 ARG 145 -6.115 -18.181 -10.358 1154 1HH2 ARG 55 1HH1 ARG 145 -4.336 -18.820 -13.890 1155 2HH2 ARG 55 2HH1 ARG 145 -4.608 -20.193 -12.703 1156 H ALA 56 H ALA 146 -7.420 -13.182 -14.925 1157 HA ALA 56 HA ALA 146 -10.373 -13.071 -15.528 1158 1HB ALA 56 3HB ALA 146 -8.793 -12.317 -17.274 1159 2HB ALA 56 1HB ALA 146 -8.012 -13.919 -17.327 1160 3HB ALA 56 2HB ALA 146 -9.706 -13.730 -17.839 1161 H ALA 57 H ALA 147 -11.293 -14.659 -14.320 1162 HA ALA 57 HA ALA 147 -10.761 -17.179 -13.634 1163 1HB ALA 57 1HB ALA 147 -12.987 -16.078 -13.215 1164 2HB ALA 57 2HB ALA 147 -13.471 -16.335 -14.911 1165 3HB ALA 57 3HB ALA 147 -13.276 -17.717 -13.823 1166 NH1 ARG 58 NH2 ARG 148 -5.950 -18.085 -18.860 1167 NH2 ARG 58 NH1 ARG 148 -7.867 -16.862 -18.848 1168 H ARG 58 H ARG 148 -10.401 -19.092 -14.087 1169 HA ARG 58 HA ARG 148 -9.987 -19.726 -16.932 1170 1HB ARG 58 2HB ARG 148 -9.116 -21.390 -14.524 1171 2HB ARG 58 1HB ARG 148 -8.562 -21.656 -16.160 1172 1HG ARG 58 1HG ARG 148 -7.915 -19.110 -14.536 1173 2HG ARG 58 2HG ARG 148 -6.945 -20.556 -14.589 1174 1HD ARG 58 1HD ARG 148 -5.892 -19.071 -16.099 1175 2HD ARG 58 2HD ARG 148 -6.643 -20.316 -17.102 1176 1HH1 ARG 58 2HH2 ARG 148 -5.387 -18.815 -18.409 1177 2HH1 ARG 58 1HH2 ARG 148 -5.706 -17.555 -19.704 1178 1HH2 ARG 58 1HH1 ARG 148 -8.762 -16.657 -18.390 1179 2HH2 ARG 58 2HH1 ARG 148 -7.492 -16.415 -19.692 1180 H LYS 59 H LYS 149 -10.094 -22.529 -16.916 1181 HA LYS 59 HA LYS 149 -12.783 -23.471 -16.094 1182 1HB LYS 59 1HB LYS 149 -13.057 -22.243 -18.464 1183 2HB LYS 59 2HB LYS 149 -12.384 -23.706 -19.131 1184 1HG LYS 59 1HG LYS 149 -14.931 -23.403 -17.410 1185 2HG LYS 59 2HG LYS 149 -14.886 -23.607 -19.144 1186 1HD LYS 59 1HD LYS 149 -14.160 -25.724 -17.038 1187 2HD LYS 59 2HD LYS 149 -15.624 -25.665 -17.973 1188 1HE LYS 59 1HE LYS 149 -12.812 -26.148 -19.177 1189 2HE LYS 59 2HE LYS 149 -13.968 -27.405 -18.758 1190 1HZ LYS 59 1HZ LYS 149 -14.460 -25.273 -20.759 1191 2HZ LYS 59 2HZ LYS 149 -15.524 -26.448 -20.358 1192 H GLY 60 H GLY 150 -12.418 -25.419 -15.353 1193 1HA GLY 60 1HA GLY 150 -10.602 -27.393 -16.744 1194 2HA GLY 60 2HA GLY 150 -9.961 -26.782 -15.227 1195 NH1 ARG 61 NH2 ARG 151 -14.734 -34.258 -14.991 1196 NH2 ARG 61 NH1 ARG 151 -14.127 -35.938 -13.586 1197 H ARG 61 H ARG 151 -10.838 -27.571 -13.318 1198 HA ARG 61 HA ARG 151 -13.148 -29.546 -13.393 1199 1HB ARG 61 1HB ARG 151 -10.848 -30.653 -14.048 1200 2HB ARG 61 2HB ARG 151 -10.333 -30.346 -12.407 1201 1HG ARG 61 1HG ARG 151 -10.973 -32.615 -12.548 1202 2HG ARG 61 2HG ARG 151 -12.228 -31.860 -11.579 1203 1HD ARG 61 1HD ARG 151 -13.814 -31.875 -13.502 1204 2HD ARG 61 2HD ARG 151 -12.531 -32.380 -14.617 1205 1HH1 ARG 61 2HH2 ARG 151 -14.625 -33.274 -15.260 1206 2HH1 ARG 61 1HH2 ARG 151 -15.344 -34.953 -15.434 1207 1HH2 ARG 61 1HH1 ARG 151 -13.559 -36.237 -12.785 1208 2HH2 ARG 61 2HH1 ARG 151 -14.780 -36.517 -14.126 1209 H ASN 62 H ASN 152 -14.034 -30.058 -11.451 1210 HA ASN 62 HA ASN 152 -13.550 -28.173 -9.169 1211 1HB ASN 62 1HB ASN 152 -15.889 -28.815 -10.074 1212 2HB ASN 62 2HB ASN 152 -15.678 -30.379 -9.323 1213 1HD2 ASN 62 2HD2 ASN 152 -16.853 -27.322 -6.964 1214 2HD2 ASN 62 1HD2 ASN 152 -16.553 -27.116 -8.763 1215 HA PRO 63 HA PRO 153 -10.979 -31.453 -7.156 1216 1HB PRO 63 1HB PRO 153 -10.512 -30.283 -4.681 1217 2HB PRO 63 2HB PRO 153 -9.770 -29.750 -6.196 1218 1HG PRO 63 1HG PRO 153 -12.236 -28.571 -4.819 1219 2HG PRO 63 2HG PRO 153 -10.812 -27.701 -5.437 1220 1HD PRO 63 1HD PRO 153 -13.146 -27.916 -6.899 1221 2HD PRO 63 2HD PRO 153 -11.555 -27.907 -7.720 1222 H GLN 64 H GLN 154 -14.078 -30.525 -5.648 1223 HA GLN 64 HA GLN 154 -14.012 -32.907 -3.754 1224 1HB GLN 64 1HB GLN 154 -16.178 -30.741 -4.048 1225 2HB GLN 64 2HB GLN 154 -16.134 -31.990 -2.830 1226 1HG GLN 64 1HG GLN 154 -14.087 -29.689 -3.109 1227 2HG GLN 64 2HG GLN 154 -15.551 -29.686 -2.146 1228 1HE2 GLN 64 2HE2 GLN 154 -13.991 -31.527 0.561 1229 2HE2 GLN 64 1HE2 GLN 154 -15.493 -30.713 -0.108 1230 H THR 65 H THR 155 -16.536 -31.494 -5.706 1231 HA THR 65 HA THR 155 -18.018 -33.837 -6.262 1232 HB THR 65 HB THR 155 -19.314 -32.635 -7.934 1233 HG1 THR 65 HG1 THR 155 -17.591 -31.680 -9.017 1234 1HG2 THR 65 1HG2 THR 155 -19.670 -31.950 -5.508 1235 2HG2 THR 65 2HG2 THR 155 -18.494 -30.633 -5.730 1236 3HG2 THR 65 3HG2 THR 155 -20.006 -30.628 -6.662 1237 H GLY 66 H GLY 156 -15.517 -32.607 -8.472 1238 1HA GLY 66 1HA GLY 156 -14.388 -33.808 -10.246 1239 2HA GLY 66 2HA GLY 156 -15.360 -35.235 -9.929 1240 H GLU 67 H GLU 157 -16.431 -31.918 -10.659 1241 HA GLU 67 HA GLU 157 -17.512 -32.765 -13.393 1242 1HB GLU 67 2HB GLU 157 -19.134 -32.324 -11.406 1243 2HB GLU 67 1HB GLU 157 -18.640 -30.630 -11.449 1244 1HG GLU 67 1HG GLU 157 -19.453 -30.495 -13.872 1245 2HG GLU 67 2HG GLU 157 -19.952 -32.183 -13.788 1246 HE1 GLU 67 HE2 GLU 157 -22.792 -31.609 -11.889 1247 H GLU 68 H GLU 158 -17.088 -31.409 -15.076 1248 HA GLU 68 HA GLU 158 -14.823 -29.553 -14.818 1249 1HB GLU 68 1HB GLU 158 -16.584 -30.047 -17.296 1250 2HB GLU 68 2HB GLU 158 -15.170 -29.000 -17.269 1251 1HG GLU 68 1HG GLU 158 -13.732 -30.993 -16.532 1252 2HG GLU 68 2HG GLU 158 -15.140 -32.031 -16.719 1253 HE2 GLU 68 HE2 GLU 158 -15.031 -32.159 -20.157 1254 H MET 69 H MET 159 -14.919 -27.560 -14.147 1255 HA MET 69 HA MET 159 -17.227 -25.703 -14.800 1256 1HB MET 69 1HB MET 159 -17.728 -25.148 -12.483 1257 2HB MET 69 2HB MET 159 -17.912 -26.863 -12.725 1258 1HG MET 69 1HG MET 159 -16.891 -26.720 -10.610 1259 2HG MET 69 2HG MET 159 -15.514 -27.131 -11.641 1260 1HE MET 69 1HE MET 159 -13.343 -25.710 -11.688 1261 2HE MET 69 3HE MET 159 -13.110 -24.409 -10.489 1262 3HE MET 69 2HE MET 159 -13.565 -26.043 -9.943 1263 H GLU 70 H GLU 160 -16.886 -23.505 -14.085 1264 HA GLU 70 HA GLU 160 -14.209 -22.567 -14.883 1265 1HB GLU 70 2HB GLU 160 -15.015 -20.359 -14.975 1266 2HB GLU 70 1HB GLU 160 -16.184 -21.429 -15.722 1267 1HG GLU 70 1HG GLU 160 -17.581 -19.963 -14.605 1268 2HG GLU 70 2HG GLU 160 -17.524 -21.268 -13.439 1269 HE1 GLU 70 HE2 GLU 160 -15.641 -17.701 -12.745 1270 H ILE 71 H ILE 161 -12.492 -21.874 -13.671 1271 HA ILE 71 HA ILE 161 -12.607 -22.001 -10.698 1272 HB ILE 71 HB ILE 161 -10.341 -21.458 -12.713 1273 1HG1 ILE 71 1HG1 ILE 161 -9.358 -23.620 -11.660 1274 2HG1 ILE 71 2HG1 ILE 161 -10.918 -23.925 -10.931 1275 1HG2 ILE 71 2HG2 ILE 161 -9.889 -20.207 -10.660 1276 2HG2 ILE 71 3HG2 ILE 161 -10.192 -21.663 -9.666 1277 3HG2 ILE 71 1HG2 ILE 161 -8.788 -21.591 -10.789 1278 1HD1 ILE 71 3HD1 ILE 161 -10.370 -23.705 -13.976 1279 2HD1 ILE 71 1HD1 ILE 161 -10.459 -25.224 -13.052 1280 3HD1 ILE 71 2HD1 ILE 161 -11.908 -24.224 -13.235 1281 HA PRO 72 HA PRO 162 -13.929 -17.567 -11.220 1282 1HB PRO 72 1HB PRO 162 -14.287 -16.846 -8.545 1283 2HB PRO 72 2HB PRO 162 -15.384 -17.884 -9.465 1284 1HG PRO 72 1HG PRO 162 -13.142 -18.760 -7.572 1285 2HG PRO 72 2HG PRO 162 -14.839 -19.304 -7.580 1286 1HD PRO 72 1HD PRO 162 -12.855 -20.768 -8.800 1287 2HD PRO 72 2HD PRO 162 -14.491 -20.689 -9.525 1288 H ALA 73 H ALA 163 -13.363 -15.376 -10.377 1289 HA ALA 73 HA ALA 163 -10.689 -14.620 -11.083 1290 1HB ALA 73 2HB ALA 163 -12.716 -13.019 -10.946 1291 2HB ALA 73 3HB ALA 163 -12.596 -13.074 -9.154 1292 3HB ALA 73 1HB ALA 163 -11.297 -12.361 -10.108 1293 H SER 74 H SER 164 -9.203 -13.356 -9.881 1294 HA SER 74 HA SER 164 -9.507 -13.252 -7.039 1295 1HB SER 74 1HB SER 164 -7.262 -14.193 -6.215 1296 2HB SER 74 2HB SER 164 -8.258 -15.431 -6.972 1297 HG SER 74 HG SER 164 -6.164 -13.970 -8.220 1298 H LYS 75 H LYS 165 -8.998 -11.454 -6.256 1299 HA LYS 75 HA LYS 165 -7.665 -9.349 -7.904 1300 1HB LYS 75 2HB LYS 165 -8.548 -8.547 -5.187 1301 2HB LYS 75 1HB LYS 165 -8.624 -7.755 -6.725 1302 1HG LYS 75 1HG LYS 165 -10.578 -9.176 -7.421 1303 2HG LYS 75 2HG LYS 165 -10.496 -10.037 -5.884 1304 1HD LYS 75 1HD LYS 165 -10.967 -7.855 -4.647 1305 2HD LYS 75 2HD LYS 165 -11.120 -7.050 -6.204 1306 1HE LYS 75 1HE LYS 165 -13.358 -7.524 -5.467 1307 2HE LYS 75 2HE LYS 165 -13.043 -8.588 -6.833 1308 1HZ LYS 75 1HZ LYS 165 -12.569 -10.367 -5.214 1309 2HZ LYS 75 2HZ LYS 165 -12.883 -9.361 -3.966 1310 H VAL 76 H VAL 166 -5.386 -8.725 -7.733 1311 HA VAL 76 HA VAL 166 -3.857 -9.693 -5.494 1312 HB VAL 76 HB VAL 166 -3.887 -9.233 -8.481 1313 1HG1 VAL 76 1HG2 VAL 166 -1.352 -8.852 -7.079 1314 2HG1 VAL 76 2HG2 VAL 166 -1.641 -9.203 -8.864 1315 3HG1 VAL 76 3HG2 VAL 166 -2.284 -7.719 -8.130 1316 1HG2 VAL 76 3HG1 VAL 166 -4.159 -11.483 -7.506 1317 2HG2 VAL 76 1HG1 VAL 166 -2.753 -11.340 -8.580 1318 3HG2 VAL 76 2HG1 VAL 166 -2.516 -11.354 -6.797 1319 HA PRO 77 HA PRO 167 -3.830 -5.160 -4.565 1320 1HB PRO 77 1HB PRO 167 -2.570 -5.249 -2.079 1321 2HB PRO 77 2HB PRO 167 -4.154 -5.993 -2.332 1322 1HG PRO 77 1HG PRO 167 -1.420 -7.358 -2.338 1323 2HG PRO 77 2HG PRO 167 -2.887 -7.876 -1.493 1324 1HD PRO 77 1HD PRO 167 -2.030 -8.829 -4.114 1325 2HD PRO 77 2HD PRO 167 -3.722 -8.901 -3.567 1326 H ALA 78 H ALA 168 -2.799 -3.581 -4.878 1327 HA ALA 78 HA ALA 168 0.248 -3.491 -5.143 1328 1HB ALA 78 3HB ALA 168 -1.063 -3.895 -7.306 1329 2HB ALA 78 1HB ALA 168 -1.879 -2.332 -7.074 1330 3HB ALA 78 2HB ALA 168 -0.118 -2.384 -7.320 1331 H PHE 79 H PHE 169 1.029 -1.427 -5.289 1332 HA PHE 79 HA PHE 169 -0.311 0.934 -3.806 1333 1HB PHE 79 2HB PHE 169 0.355 -0.009 -1.959 1334 2HB PHE 79 1HB PHE 169 1.943 -0.516 -2.633 1335 HD1 PHE 79 HD1 PHE 169 0.065 2.388 -1.242 1336 HD2 PHE 79 HD2 PHE 169 3.853 1.063 -2.775 1337 HE1 PHE 79 HE1 PHE 169 1.120 4.461 -0.449 1338 HE2 PHE 79 HE2 PHE 169 4.877 3.177 -2.057 1339 HZ PHE 79 HZ PHE 169 3.510 4.897 -0.936 1340 H LYS 80 H LYS 170 0.265 2.350 -5.156 1341 HA LYS 80 HA LYS 170 2.831 2.621 -6.954 1342 1HB LYS 80 2HB LYS 170 0.196 4.124 -7.131 1343 2HB LYS 80 1HB LYS 170 1.688 4.720 -7.821 1344 1HG LYS 80 1HG LYS 170 0.531 3.700 -9.599 1345 2HG LYS 80 2HG LYS 170 1.909 2.673 -9.248 1346 1HD LYS 80 1HD LYS 170 0.369 1.050 -8.033 1347 2HD LYS 80 2HD LYS 170 -1.004 2.109 -8.378 1348 1HE LYS 80 1HE LYS 170 -0.637 1.784 -10.863 1349 2HE LYS 80 2HE LYS 170 0.762 0.753 -10.528 1350 1HZ LYS 80 1HZ LYS 170 -0.685 -0.780 -9.368 1351 2HZ LYS 80 2HZ LYS 170 -1.185 -0.560 -10.909 1352 HA PRO 81 HA PRO 171 4.014 5.522 -3.628 1353 1HB PRO 81 1HB PRO 171 6.359 6.497 -4.682 1354 2HB PRO 81 2HB PRO 171 6.163 4.799 -4.226 1355 1HG PRO 81 1HG PRO 171 5.885 6.018 -7.031 1356 2HG PRO 81 2HG PRO 171 6.930 4.657 -6.543 1357 1HD PRO 81 1HD PRO 171 4.376 4.318 -7.626 1358 2HD PRO 81 2HD PRO 171 5.066 3.156 -6.447 1359 H GLY 82 H GLY 172 1.839 6.354 -5.243 1360 1HA GLY 82 1HA GLY 172 0.766 8.061 -6.528 1361 2HA GLY 82 2HA GLY 172 1.394 8.992 -5.184 1362 H LYS 83 H LYS 173 3.770 7.828 -7.339 1363 HA LYS 83 HA LYS 173 5.316 8.932 -8.793 1364 1HB LYS 83 2HB LYS 173 2.899 10.567 -9.419 1365 2HB LYS 83 1HB LYS 173 4.301 11.543 -9.508 1366 1HG LYS 83 1HG LYS 173 4.076 8.825 -11.006 1367 2HG LYS 83 2HG LYS 173 3.420 10.315 -11.641 1368 1HD LYS 83 1HD LYS 173 5.469 10.057 -12.748 1369 2HD LYS 83 2HD LYS 173 5.708 11.389 -11.627 1370 1HE LYS 83 1HE LYS 173 6.996 9.868 -10.071 1371 2HE LYS 83 2HE LYS 173 6.663 8.481 -11.117 1372 1HZ LYS 83 1HZ LYS 173 8.839 9.436 -11.492 1373 2HZ LYS 83 2HZ LYS 173 8.213 10.901 -11.858 1374 H ALA 84 H ALA 174 3.772 10.998 -6.682 1375 HA ALA 84 HA ALA 174 5.580 13.154 -6.080 1376 1HB ALA 84 2HB ALA 174 3.128 12.982 -5.554 1377 2HB ALA 84 3HB ALA 174 3.434 11.615 -4.452 1378 3HB ALA 84 1HB ALA 174 4.047 13.235 -4.033 1379 H LEU 85 H LEU 175 5.170 9.975 -4.301 1380 HA LEU 85 HA LEU 175 7.383 10.523 -2.457 1381 1HB LEU 85 2HB LEU 175 5.527 9.008 -1.774 1382 2HB LEU 85 1HB LEU 175 5.882 7.937 -3.115 1383 HG LEU 85 HG LEU 175 8.229 7.806 -2.197 1384 1HD1 LEU 85 3HD1 LEU 175 8.235 9.626 -0.527 1385 2HD1 LEU 85 1HD1 LEU 175 6.936 8.832 0.390 1386 3HD1 LEU 85 2HD1 LEU 175 8.556 8.085 0.285 1387 1HD2 LEU 85 3HD2 LEU 175 6.607 5.879 -2.074 1388 2HD2 LEU 85 1HD2 LEU 175 7.580 5.907 -0.592 1389 3HD2 LEU 85 2HD2 LEU 175 5.905 6.522 -0.573 1390 H LYS 86 H LYS 176 7.013 8.831 -5.570 1391 HA LYS 86 HA LYS 176 9.747 7.860 -5.799 1392 1HB LYS 86 1HB LYS 176 7.766 7.216 -7.309 1393 2HB LYS 86 2HB LYS 176 8.087 8.668 -8.243 1394 1HG LYS 86 1HG LYS 176 10.418 7.838 -8.722 1395 2HG LYS 86 2HG LYS 176 10.146 6.440 -7.676 1396 1HD LYS 86 1HD LYS 176 8.270 5.665 -9.223 1397 2HD LYS 86 2HD LYS 176 8.567 7.061 -10.248 1398 1HE LYS 86 1HE LYS 176 9.658 5.197 -11.307 1399 2HE LYS 86 2HE LYS 176 10.940 6.237 -10.694 1400 1HZ LYS 86 1HZ LYS 176 11.189 4.738 -8.810 1401 2HZ LYS 86 2HZ LYS 176 11.386 3.940 -10.223 1402 H ASP 87 H ASP 177 8.545 11.170 -6.095 1403 HA ASP 87 HA ASP 177 11.036 12.267 -7.286 1404 1HB ASP 87 1HB ASP 177 8.248 13.051 -6.922 1405 2HB ASP 87 2HB ASP 177 9.102 14.054 -5.835 1406 HD1 ASP 87 HD2 ASP 177 9.485 14.392 -9.870 1407 H ALA 88 H ALA 178 9.521 12.072 -4.014 1408 HA ALA 88 HA ALA 178 11.456 13.472 -2.370 1409 1HB ALA 88 3HB ALA 178 9.259 12.378 -1.480 1410 2HB ALA 88 1HB ALA 178 10.013 10.792 -1.657 1411 3HB ALA 88 2HB ALA 178 10.688 11.919 -0.509 1412 H VAL 89 H VAL 179 11.366 10.047 -3.356 1413 HA VAL 89 HA VAL 179 13.889 9.326 -2.059 1414 HB VAL 89 HB VAL 179 11.314 8.428 -2.112 1415 1HG1 VAL 89 2HG2 VAL 179 11.452 8.318 -4.718 1416 2HG1 VAL 89 3HG2 VAL 179 12.272 6.773 -4.488 1417 3HG1 VAL 89 1HG2 VAL 179 10.628 7.050 -3.815 1418 1HG2 VAL 89 3HG1 VAL 179 13.620 6.545 -2.248 1419 2HG2 VAL 89 1HG1 VAL 179 12.938 7.450 -0.842 1420 3HG2 VAL 89 2HG1 VAL 179 11.923 6.241 -1.673 1421 H LYS 90 H LYS 180 13.434 10.531 -5.177 1422 HA LYS 90 HA LYS 180 14.699 8.617 -6.873 1423 1HB LYS 90 1HB LYS 180 13.310 10.932 -7.279 1424 2HB LYS 90 2HB LYS 180 14.889 11.639 -7.447 1425 1HG LYS 90 1HG LYS 180 15.393 10.059 -9.349 1426 2HG LYS 90 2HG LYS 180 13.885 9.188 -9.047 1427 1HD LYS 90 1HD LYS 180 12.572 11.322 -9.499 1428 2HD LYS 90 2HD LYS 180 14.061 12.153 -9.917 1429 1HE LYS 90 1HE LYS 180 12.931 9.658 -11.372 1430 2HE LYS 90 2HE LYS 180 12.684 11.325 -11.887 1431 1HZ LYS 90 1HZ LYS 180 15.334 10.007 -11.682 1432 2HZ LYS 90 2HZ LYS 180 15.089 11.554 -12.148 Start of MODEL 4 Raw file had 1432 H/Q atoms Start of MODEL 4 1 1H MET 1 1H MET 1 -12.333 3.585 -1.817 2 2H MET 1 2H MET 1 -10.997 3.504 -2.754 3 HA MET 1 HA MET 1 -11.933 5.862 -1.279 4 1HB MET 1 1HB MET 1 -11.301 3.973 0.130 5 2HB MET 1 2HB MET 1 -9.752 3.816 -0.634 6 1HG MET 1 1HG MET 1 -8.759 5.439 0.669 7 2HG MET 1 2HG MET 1 -10.208 6.448 0.726 8 1HE MET 1 1HE MET 1 -9.795 2.478 1.582 9 2HE MET 1 3HE MET 1 -8.510 3.105 2.674 10 3HE MET 1 2HE MET 1 -10.030 2.491 3.330 11 H ASN 2 H ASN 2 -8.899 6.517 -1.228 12 HA ASN 2 HA ASN 2 -8.075 7.599 -3.527 13 1HB ASN 2 1HB ASN 2 -8.813 9.739 -4.161 14 2HB ASN 2 2HB ASN 2 -10.158 8.642 -4.167 15 1HD2 ASN 2 1HD2 ASN 2 -12.043 10.473 -1.683 16 2HD2 ASN 2 2HD2 ASN 2 -11.787 8.815 -2.425 17 H LYS 3 H LYS 3 -8.719 8.659 -0.370 18 HA LYS 3 HA LYS 3 -6.612 8.994 1.096 19 1HB LYS 3 1HB LYS 3 -5.157 9.917 -0.746 20 2HB LYS 3 2HB LYS 3 -6.052 11.428 -0.680 21 1HG LYS 3 1HG LYS 3 -5.201 11.730 1.720 22 2HG LYS 3 2HG LYS 3 -4.472 10.124 1.656 23 1HD LYS 3 1HD LYS 3 -3.054 10.964 -0.355 24 2HD LYS 3 2HD LYS 3 -3.702 12.567 -0.052 25 1HE LYS 3 1HE LYS 3 -1.556 12.558 0.977 26 2HE LYS 3 2HE LYS 3 -2.689 12.470 2.322 27 1HZ LYS 3 1HZ LYS 3 -2.278 10.081 2.432 28 2HZ LYS 3 2HZ LYS 3 -0.885 10.921 2.589 29 H THR 4 H THR 4 -9.407 10.812 -0.145 30 HA THR 4 HA THR 4 -9.709 12.386 2.279 31 HB THR 4 HB THR 4 -11.058 12.153 -0.494 32 HG1 THR 4 HG1 THR 4 -8.970 13.127 -0.454 33 1HG2 THR 4 3HG2 THR 4 -11.534 14.048 1.804 34 2HG2 THR 4 1HG2 THR 4 -12.130 14.278 0.091 35 3HG2 THR 4 2HG2 THR 4 -12.671 12.859 1.066 36 H GLU 5 H GLU 5 -11.110 9.491 0.562 37 HA GLU 5 HA GLU 5 -13.406 9.178 2.405 38 1HB GLU 5 1HB GLU 5 -13.731 8.410 0.182 39 2HB GLU 5 2HB GLU 5 -12.105 7.782 0.012 40 1HG GLU 5 1HG GLU 5 -13.524 5.987 0.040 41 2HG GLU 5 2HG GLU 5 -12.508 5.951 1.477 42 HE1 GLU 5 HE2 GLU 5 -16.570 6.516 1.727 43 H LEU 6 H LEU 6 -10.003 8.864 2.415 44 HA LEU 6 HA LEU 6 -9.585 6.846 4.538 45 1HB LEU 6 2HB LEU 6 -7.917 8.247 2.726 46 2HB LEU 6 1HB LEU 6 -7.613 9.152 4.179 47 HG LEU 6 HG LEU 6 -7.227 6.171 3.870 48 1HD1 LEU 6 1HD1 LEU 6 -5.200 8.428 4.042 49 2HD1 LEU 6 2HD1 LEU 6 -4.825 6.686 4.090 50 3HD1 LEU 6 3HD1 LEU 6 -5.572 7.403 2.645 51 1HD2 LEU 6 2HD2 LEU 6 -7.225 7.892 6.369 52 2HD2 LEU 6 3HD2 LEU 6 -7.732 6.212 6.158 53 3HD2 LEU 6 1HD2 LEU 6 -6.006 6.636 6.240 54 H ILE 7 H ILE 7 -9.763 10.446 4.355 55 HA ILE 7 HA ILE 7 -9.406 11.062 7.143 56 HB ILE 7 HB ILE 7 -11.069 12.693 5.125 57 1HG1 ILE 7 1HG1 ILE 7 -8.073 13.029 5.720 58 2HG1 ILE 7 2HG1 ILE 7 -8.619 12.075 4.394 59 1HG2 ILE 7 2HG2 ILE 7 -11.372 13.511 7.494 60 2HG2 ILE 7 3HG2 ILE 7 -9.622 13.703 7.626 61 3HG2 ILE 7 1HG2 ILE 7 -10.539 14.700 6.488 62 1HD1 ILE 7 3HD1 ILE 7 -9.885 14.085 3.444 63 2HD1 ILE 7 1HD1 ILE 7 -8.948 15.072 4.562 64 3HD1 ILE 7 2HD1 ILE 7 -8.105 14.058 3.358 65 H ASN 8 H ASN 8 -12.410 10.596 5.310 66 HA ASN 8 HA ASN 8 -14.137 10.765 7.710 67 1HB ASN 8 1HB ASN 8 -14.816 9.380 4.997 68 2HB ASN 8 2HB ASN 8 -15.984 9.741 6.243 69 1HD2 ASN 8 2HD2 ASN 8 -15.060 12.715 3.620 70 2HD2 ASN 8 1HD2 ASN 8 -14.209 11.090 3.591 71 H ALA 9 H ALA 9 -12.230 8.123 6.634 72 HA ALA 9 HA ALA 9 -13.719 5.970 8.128 73 1HB ALA 9 2HB ALA 9 -11.896 5.439 6.241 74 2HB ALA 9 3HB ALA 9 -10.679 6.128 7.322 75 3HB ALA 9 1HB ALA 9 -11.502 4.701 7.842 76 H VAL 10 H VAL 10 -10.925 8.149 8.707 77 HA VAL 10 HA VAL 10 -10.240 6.926 11.198 78 HB VAL 10 HB VAL 10 -9.213 9.680 10.510 79 1HG1 VAL 10 3HG2 VAL 10 -8.485 8.138 12.513 80 2HG1 VAL 10 1HG2 VAL 10 -7.528 7.306 11.259 81 3HG1 VAL 10 2HG2 VAL 10 -7.261 9.040 11.550 82 1HG2 VAL 10 1HG1 VAL 10 -8.697 7.173 8.881 83 2HG2 VAL 10 2HG1 VAL 10 -9.132 8.850 8.425 84 3HG2 VAL 10 3HG1 VAL 10 -7.466 8.506 8.980 85 H ALA 11 H ALA 11 -11.572 9.900 10.303 86 HA ALA 11 HA ALA 11 -12.153 10.535 12.998 87 1HB ALA 11 2HB ALA 11 -12.010 12.330 11.213 88 2HB ALA 11 3HB ALA 11 -13.484 11.699 10.438 89 3HB ALA 11 1HB ALA 11 -13.578 12.495 12.043 90 H GLU 12 H GLU 12 -13.953 8.469 10.886 91 HA GLU 12 HA GLU 12 -16.378 8.488 12.651 92 1HB GLU 12 1HB GLU 12 -16.656 8.048 10.216 93 2HB GLU 12 2HB GLU 12 -15.591 6.645 10.304 94 1HG GLU 12 1HG GLU 12 -17.250 5.460 11.783 95 2HG GLU 12 2HG GLU 12 -18.299 6.876 11.779 96 HE1 GLU 12 HE2 GLU 12 -19.587 6.338 8.612 97 H THR 13 H THR 13 -13.690 6.134 11.986 98 HA THR 13 HA THR 13 -14.513 4.671 14.473 99 HB THR 13 HB THR 13 -13.934 3.682 12.212 100 HG1 THR 13 HG1 THR 13 -13.295 1.787 13.251 101 1HG2 THR 13 3HG2 THR 13 -11.581 4.587 11.971 102 2HG2 THR 13 1HG2 THR 13 -11.086 3.518 13.303 103 3HG2 THR 13 2HG2 THR 13 -11.739 2.821 11.790 104 H SER 14 H SER 14 -12.875 7.117 14.373 105 HA SER 14 HA SER 14 -11.380 6.474 17.010 106 1HB SER 14 1HB SER 14 -9.723 6.803 15.099 107 2HB SER 14 2HB SER 14 -10.244 8.486 14.979 108 HG SER 14 HG SER 14 -8.445 8.217 16.297 109 H GLY 15 H GLY 15 -13.358 8.970 15.361 110 1HA GLY 15 1HA GLY 15 -14.381 10.920 16.219 111 2HA GLY 15 2HA GLY 15 -14.221 10.220 17.828 112 H LEU 16 H LEU 16 -12.017 11.474 15.406 113 HA LEU 16 HA LEU 16 -10.783 13.532 17.249 114 1HB LEU 16 1HB LEU 16 -8.827 13.464 15.863 115 2HB LEU 16 2HB LEU 16 -9.148 12.043 16.836 116 HG LEU 16 HG LEU 16 -9.867 10.774 15.081 117 1HD1 LEU 16 2HD1 LEU 16 -11.190 12.482 13.749 118 2HD1 LEU 16 3HD1 LEU 16 -9.602 13.061 13.153 119 3HD1 LEU 16 1HD1 LEU 16 -10.209 11.387 12.773 120 1HD2 LEU 16 1HD2 LEU 16 -7.764 10.313 15.161 121 2HD2 LEU 16 2HD2 LEU 16 -8.561 10.054 13.589 122 3HD2 LEU 16 3HD2 LEU 16 -7.484 11.423 13.768 123 H SER 17 H SER 17 -10.211 14.346 14.466 124 HA SER 17 HA SER 17 -12.634 16.113 13.846 125 1HB SER 17 1HB SER 17 -9.827 17.320 13.808 126 2HB SER 17 2HB SER 17 -11.327 18.101 13.361 127 HG SER 17 HG SER 17 -12.084 17.779 15.483 128 H LYS 18 H LYS 18 -12.640 16.939 11.677 129 HA LYS 18 HA LYS 18 -11.792 14.974 9.563 130 1HB LYS 18 1HB LYS 18 -12.723 17.798 8.863 131 2HB LYS 18 2HB LYS 18 -12.765 16.347 7.889 132 1HG LYS 18 1HG LYS 18 -14.594 17.151 10.203 133 2HG LYS 18 2HG LYS 18 -15.023 16.976 8.519 134 1HD LYS 18 1HD LYS 18 -14.338 14.674 10.461 135 2HD LYS 18 2HD LYS 18 -15.946 15.203 9.996 136 1HE LYS 18 1HE LYS 18 -15.428 14.565 7.559 137 2HE LYS 18 2HE LYS 18 -13.863 13.927 8.097 138 1HZ LYS 18 1HZ LYS 18 -15.074 12.447 9.610 139 2HZ LYS 18 2HZ LYS 18 -16.513 13.033 9.102 140 H LYS 19 H LYS 19 -10.761 18.230 10.500 141 HA LYS 19 HA LYS 19 -8.297 18.340 8.873 142 1HB LYS 19 2HB LYS 19 -8.985 19.814 11.484 143 2HB LYS 19 1HB LYS 19 -7.496 20.092 10.569 144 1HG LYS 19 1HG LYS 19 -8.850 20.782 8.553 145 2HG LYS 19 2HG LYS 19 -10.339 20.551 9.472 146 1HD LYS 19 1HD LYS 19 -9.582 22.292 11.146 147 2HD LYS 19 2HD LYS 19 -8.089 22.526 10.229 148 1HE LYS 19 1HE LYS 19 -9.446 23.271 8.208 149 2HE LYS 19 2HE LYS 19 -10.940 23.039 9.127 150 1HZ LYS 19 1HZ LYS 19 -10.187 24.702 10.700 151 2HZ LYS 19 2HZ LYS 19 -10.257 25.316 9.187 152 H ASP 20 H ASP 20 -8.916 16.927 12.187 153 HA ASP 20 HA ASP 20 -5.989 16.331 12.582 154 1HB ASP 20 1HB ASP 20 -8.469 15.399 14.126 155 2HB ASP 20 2HB ASP 20 -6.910 14.671 14.418 156 HD1 ASP 20 HD2 ASP 20 -5.399 17.387 15.938 157 H ALA 21 H ALA 21 -8.679 14.579 11.151 158 HA ALA 21 HA ALA 21 -7.222 12.005 10.813 159 1HB ALA 21 2HB ALA 21 -9.890 13.102 9.724 160 2HB ALA 21 3HB ALA 21 -9.221 11.507 9.266 161 3HB ALA 21 1HB ALA 21 -9.599 11.866 10.923 162 H THR 22 H THR 22 -7.856 14.821 8.617 163 HA THR 22 HA THR 22 -6.351 13.911 6.343 164 HB THR 22 HB THR 22 -6.474 16.857 7.275 165 HG1 THR 22 HG1 THR 22 -8.452 16.967 6.252 166 1HG2 THR 22 1HG2 THR 22 -6.616 15.458 4.538 167 2HG2 THR 22 2HG2 THR 22 -6.836 17.213 4.798 168 3HG2 THR 22 3HG2 THR 22 -5.256 16.429 5.158 169 H LYS 23 H LYS 23 -5.255 15.768 9.078 170 HA LYS 23 HA LYS 23 -2.386 15.931 8.460 171 1HB LYS 23 2HB LYS 23 -3.986 15.722 11.137 172 2HB LYS 23 1HB LYS 23 -2.273 15.939 11.176 173 1HG LYS 23 1HG LYS 23 -2.387 18.152 10.012 174 2HG LYS 23 2HG LYS 23 -4.131 18.001 9.835 175 1HD LYS 23 1HD LYS 23 -4.345 17.879 12.387 176 2HD LYS 23 2HD LYS 23 -2.602 18.121 12.519 177 1HE LYS 23 1HE LYS 23 -2.836 20.373 11.352 178 2HE LYS 23 2HE LYS 23 -4.583 20.115 11.211 179 1HZ LYS 23 1HZ LYS 23 -4.694 19.987 13.636 180 2HZ LYS 23 2HZ LYS 23 -3.082 20.221 13.770 181 H ALA 24 H ALA 24 -4.074 13.693 10.548 182 HA ALA 24 HA ALA 24 -1.932 11.981 11.296 183 1HB ALA 24 2HB ALA 24 -4.027 12.102 12.458 184 2HB ALA 24 3HB ALA 24 -4.915 11.412 11.060 185 3HB ALA 24 1HB ALA 24 -3.739 10.408 11.976 186 H VAL 25 H VAL 25 -3.997 11.639 8.468 187 HA VAL 25 HA VAL 25 -2.712 9.198 7.269 188 HB VAL 25 HB VAL 25 -4.462 11.725 6.470 189 1HG1 VAL 25 1HG2 VAL 25 -3.277 9.822 4.372 190 2HG1 VAL 25 2HG2 VAL 25 -4.659 10.948 4.097 191 3HG1 VAL 25 3HG2 VAL 25 -3.063 11.572 4.498 192 1HG2 VAL 25 2HG1 VAL 25 -5.008 8.735 6.335 193 2HG2 VAL 25 3HG1 VAL 25 -5.621 9.870 7.554 194 3HG2 VAL 25 1HG1 VAL 25 -6.157 10.045 5.875 195 H ASP 26 H ASP 26 -2.223 12.726 6.548 196 HA ASP 26 HA ASP 26 0.527 12.169 5.439 197 1HB ASP 26 1HB ASP 26 -1.124 14.092 4.803 198 2HB ASP 26 2HB ASP 26 -0.627 14.884 6.299 199 HD2 ASP 26 HD2 ASP 26 2.205 16.217 4.871 200 H ALA 27 H ALA 27 -0.173 11.600 8.139 201 HA ALA 27 HA ALA 27 2.414 12.298 9.585 202 1HB ALA 27 1HB ALA 27 0.036 12.854 10.671 203 2HB ALA 27 2HB ALA 27 0.042 11.128 11.022 204 3HB ALA 27 3HB ALA 27 1.308 12.192 11.633 205 H VAL 28 H VAL 28 0.274 9.621 8.786 206 HA VAL 28 HA VAL 28 2.253 7.463 9.329 207 HB VAL 28 HB VAL 28 -0.071 7.191 7.258 208 1HG1 VAL 28 2HG2 VAL 28 1.796 5.330 8.712 209 2HG1 VAL 28 3HG2 VAL 28 0.136 4.768 8.411 210 3HG1 VAL 28 1HG2 VAL 28 1.126 5.319 7.044 211 1HG2 VAL 28 3HG1 VAL 28 -0.411 6.960 10.218 212 2HG2 VAL 28 1HG1 VAL 28 -1.341 7.851 8.945 213 3HG2 VAL 28 2HG1 VAL 28 -1.423 6.092 8.989 214 H PHE 29 H PHE 29 0.826 8.659 6.401 215 HA PHE 29 HA PHE 29 2.983 7.738 4.550 216 1HB PHE 29 2HB PHE 29 0.569 9.480 3.822 217 2HB PHE 29 1HB PHE 29 1.526 8.542 2.701 218 HD1 PHE 29 HD1 PHE 29 1.654 5.852 3.214 219 HD2 PHE 29 HD2 PHE 29 -1.417 8.516 4.626 220 HE1 PHE 29 HE1 PHE 29 0.229 3.927 3.805 221 HE2 PHE 29 HE2 PHE 29 -2.794 6.616 5.238 222 HZ PHE 29 HZ PHE 29 -1.989 4.318 4.862 223 H ASP 30 H ASP 30 3.209 10.317 6.524 224 HA ASP 30 HA ASP 30 5.060 11.705 4.540 225 1HB ASP 30 1HB ASP 30 3.312 13.001 5.991 226 2HB ASP 30 2HB ASP 30 4.361 12.734 7.367 227 HD2 ASP 30 HD2 ASP 30 5.204 15.495 4.559 228 H SER 31 H SER 31 5.032 10.357 7.791 229 HA SER 31 HA SER 31 7.983 10.267 8.137 230 1HB SER 31 1HB SER 31 6.018 8.317 9.433 231 2HB SER 31 2HB SER 31 7.671 8.657 9.950 232 HG SER 31 HG SER 31 5.565 10.550 9.864 233 H ILE 32 H ILE 32 5.704 7.771 6.577 234 HA ILE 32 HA ILE 32 7.604 5.748 6.069 235 HB ILE 32 HB ILE 32 5.104 6.524 4.526 236 1HG1 ILE 32 1HG1 ILE 32 5.683 4.599 6.811 237 2HG1 ILE 32 2HG1 ILE 32 4.918 6.131 6.993 238 1HG2 ILE 32 1HG2 ILE 32 7.211 4.336 4.352 239 2HG2 ILE 32 2HG2 ILE 32 5.540 3.794 4.113 240 3HG2 ILE 32 3HG2 ILE 32 6.310 5.060 3.073 241 1HD1 ILE 32 3HD1 ILE 32 3.609 3.925 5.409 242 2HD1 ILE 32 1HD1 ILE 32 3.261 4.445 7.095 243 3HD1 ILE 32 2HD1 ILE 32 2.988 5.585 5.736 244 H THR 33 H THR 33 6.537 8.343 3.924 245 HA THR 33 HA THR 33 8.528 7.667 1.838 246 HB THR 33 HB THR 33 6.523 8.830 1.133 247 HG1 THR 33 HG1 THR 33 8.481 10.859 1.257 248 1HG2 THR 33 3HG2 THR 33 5.742 9.730 3.289 249 2HG2 THR 33 1HG2 THR 33 6.916 11.033 3.220 250 3HG2 THR 33 2HG2 THR 33 5.566 10.927 2.019 251 H GLU 34 H GLU 34 8.735 9.649 4.745 252 HA GLU 34 HA GLU 34 11.487 10.679 4.114 253 1HB GLU 34 1HB GLU 34 9.964 10.457 6.790 254 2HB GLU 34 2HB GLU 34 11.615 11.045 6.677 255 1HG GLU 34 1HG GLU 34 10.965 12.979 5.294 256 2HG GLU 34 2HG GLU 34 9.313 12.404 5.143 257 HE2 GLU 34 HE2 GLU 34 10.527 14.386 8.407 258 H ALA 35 H ALA 35 10.113 7.712 5.685 259 HA ALA 35 HA ALA 35 12.702 6.548 6.322 260 1HB ALA 35 3HB ALA 35 10.236 5.451 7.020 261 2HB ALA 35 1HB ALA 35 10.212 4.820 5.396 262 3HB ALA 35 2HB ALA 35 11.434 4.266 6.473 263 H LEU 36 H LEU 36 10.641 6.029 3.480 264 HA LEU 36 HA LEU 36 12.416 4.352 1.937 265 1HB LEU 36 2HB LEU 36 10.237 6.078 0.887 266 2HB LEU 36 1HB LEU 36 10.860 4.590 0.201 267 HG LEU 36 HG LEU 36 9.292 4.662 2.861 268 1HD1 LEU 36 1HD2 LEU 36 7.833 4.658 0.992 269 2HD1 LEU 36 2HD2 LEU 36 8.659 3.169 0.329 270 3HD1 LEU 36 3HD2 LEU 36 7.777 3.121 1.892 271 1HD2 LEU 36 1HD1 LEU 36 10.722 2.279 1.617 272 2HD2 LEU 36 2HD1 LEU 36 11.096 3.076 3.183 273 3HD2 LEU 36 3HD1 LEU 36 9.568 2.227 3.003 274 NH1 ARG 37 NH2 ARG 37 9.996 13.680 0.227 275 NH2 ARG 37 NH1 ARG 37 11.494 14.457 -1.295 276 H ARG 37 H ARG 37 11.807 7.923 1.740 277 HA ARG 37 HA ARG 37 13.701 8.172 -0.371 278 1HB ARG 37 1HB ARG 37 13.508 10.415 -0.513 279 2HB ARG 37 2HB ARG 37 11.952 9.900 0.076 280 1HG ARG 37 1HG ARG 37 13.062 10.489 2.494 281 2HG ARG 37 2HG ARG 37 14.206 11.413 1.536 282 1HD ARG 37 1HD ARG 37 11.167 11.682 1.583 283 2HD ARG 37 2HD ARG 37 12.331 12.731 2.427 284 1HH1 ARG 37 2HH2 ARG 37 9.826 13.095 1.053 285 2HH1 ARG 37 1HH2 ARG 37 9.303 14.238 -0.283 286 1HH2 ARG 37 1HH1 ARG 37 12.463 14.470 -1.630 287 2HH2 ARG 37 2HH1 ARG 37 10.697 14.962 -1.698 288 H LYS 38 H LYS 38 14.182 7.864 3.115 289 HA LYS 38 HA LYS 38 16.933 9.094 3.019 290 1HB LYS 38 1HB LYS 38 15.288 9.717 4.807 291 2HB LYS 38 2HB LYS 38 15.391 8.081 5.457 292 1HG LYS 38 1HG LYS 38 17.859 8.503 5.932 293 2HG LYS 38 2HG LYS 38 17.718 10.116 5.249 294 1HD LYS 38 1HD LYS 38 16.160 9.055 7.702 295 2HD LYS 38 2HD LYS 38 17.658 9.973 7.778 296 1HE LYS 38 1HE LYS 38 16.519 11.960 6.665 297 2HE LYS 38 2HE LYS 38 14.996 11.061 6.629 298 1HZ LYS 38 1HZ LYS 38 15.049 10.923 9.026 299 2HZ LYS 38 2HZ LYS 38 15.094 12.480 8.530 300 H GLY 39 H GLY 39 15.702 6.035 2.398 301 1HA GLY 39 1HA GLY 39 16.808 3.893 2.185 302 2HA GLY 39 2HA GLY 39 18.270 4.555 2.892 303 H ASP 40 H ASP 40 15.019 4.543 4.230 304 HA ASP 40 HA ASP 40 15.763 2.623 6.491 305 1HB ASP 40 1HB ASP 40 14.084 5.105 6.719 306 2HB ASP 40 2HB ASP 40 14.287 3.927 7.985 307 HD1 ASP 40 HD2 ASP 40 17.474 4.886 8.897 308 H LYS 41 H LYS 41 14.556 1.115 7.155 309 HA LYS 41 HA LYS 41 12.149 0.271 5.555 310 1HB LYS 41 2HB LYS 41 13.254 -1.063 8.091 311 2HB LYS 41 1HB LYS 41 12.022 -1.724 7.014 312 1HG LYS 41 1HG LYS 41 13.801 -1.737 5.143 313 2HG LYS 41 2HG LYS 41 15.007 -1.331 6.349 314 1HD LYS 41 1HD LYS 41 13.173 -3.823 6.451 315 2HD LYS 41 2HD LYS 41 14.804 -3.807 5.792 316 1HE LYS 41 1HE LYS 41 15.740 -3.159 8.064 317 2HE LYS 41 2HE LYS 41 14.107 -3.194 8.744 318 1HZ LYS 41 1HZ LYS 41 13.954 -5.532 8.090 319 2HZ LYS 41 2HZ LYS 41 15.468 -5.503 7.473 320 H VAL 42 H VAL 42 9.996 0.512 6.282 321 HA VAL 42 HA VAL 42 9.304 2.050 8.598 322 HB VAL 42 HB VAL 42 7.815 0.617 6.362 323 1HG1 VAL 42 1HG2 VAL 42 7.148 3.157 7.903 324 2HG1 VAL 42 2HG2 VAL 42 6.239 2.498 6.496 325 3HG1 VAL 42 3HG2 VAL 42 6.288 1.573 8.019 326 1HG2 VAL 42 2HG1 VAL 42 9.635 2.393 5.476 327 2HG2 VAL 42 3HG1 VAL 42 7.959 2.615 5.004 328 3HG2 VAL 42 1HG1 VAL 42 8.643 3.618 6.304 329 H GLN 43 H GLN 43 7.088 0.055 8.413 330 HA GLN 43 HA GLN 43 7.003 -2.224 8.990 331 1HB GLN 43 1HB GLN 43 8.524 -1.792 11.516 332 2HB GLN 43 2HB GLN 43 7.371 -3.120 11.446 333 1HG GLN 43 1HG GLN 43 8.323 -4.062 9.456 334 2HG GLN 43 2HG GLN 43 9.356 -2.701 9.153 335 1HE2 GLN 43 2HE2 GLN 43 12.014 -4.538 10.678 336 2HE2 GLN 43 1HE2 GLN 43 11.351 -3.545 9.291 337 H LEU 44 H LEU 44 5.323 -3.442 9.694 338 HA LEU 44 HA LEU 44 3.123 -2.015 11.206 339 1HB LEU 44 2HB LEU 44 2.685 -3.035 8.347 340 2HB LEU 44 1HB LEU 44 1.385 -2.553 9.432 341 HG LEU 44 HG LEU 44 3.587 -0.665 8.414 342 1HD1 LEU 44 1HD1 LEU 44 2.172 -1.491 6.520 343 2HD1 LEU 44 2HD1 LEU 44 0.709 -0.890 7.355 344 3HD1 LEU 44 3HD1 LEU 44 1.957 0.245 6.820 345 1HD2 LEU 44 2HD2 LEU 44 2.482 0.103 10.556 346 2HD2 LEU 44 3HD2 LEU 44 2.078 1.161 9.188 347 3HD2 LEU 44 1HD2 LEU 44 0.883 -0.020 9.788 348 H ILE 45 H ILE 45 2.838 -3.560 12.785 349 HA ILE 45 HA ILE 45 3.400 -6.395 12.245 350 HB ILE 45 HB ILE 45 3.919 -5.293 14.408 351 1HG1 ILE 45 1HG1 ILE 45 2.276 -7.872 14.724 352 2HG1 ILE 45 2HG1 ILE 45 3.873 -7.814 14.000 353 1HG2 ILE 45 3HG2 ILE 45 1.721 -4.114 14.737 354 2HG2 ILE 45 1HG2 ILE 45 0.937 -5.678 15.063 355 3HG2 ILE 45 2HG2 ILE 45 2.208 -5.063 16.165 356 1HD1 ILE 45 2HD1 ILE 45 4.858 -6.908 16.148 357 2HD1 ILE 45 3HD1 ILE 45 3.254 -7.039 16.920 358 3HD1 ILE 45 1HD1 ILE 45 4.087 -8.500 16.345 359 H GLY 46 H GLY 46 2.015 -8.068 12.240 360 1HA GLY 46 1HA GLY 46 0.241 -9.267 11.134 361 2HA GLY 46 2HA GLY 46 -0.797 -8.228 12.082 362 H PHE 47 H PHE 47 0.996 -6.503 9.683 363 HA PHE 47 HA PHE 47 -1.121 -6.698 7.541 364 1HB PHE 47 2HB PHE 47 -1.510 -4.986 9.441 365 2HB PHE 47 1HB PHE 47 -0.090 -4.119 8.934 366 HD1 PHE 47 HD2 PHE 47 -3.576 -5.056 7.882 367 HD2 PHE 47 HD1 PHE 47 -0.038 -2.876 6.780 368 HE1 PHE 47 HE2 PHE 47 -4.706 -4.149 5.872 369 HE2 PHE 47 HE1 PHE 47 -1.211 -1.974 4.818 370 HZ PHE 47 HZ PHE 47 -3.509 -2.752 4.315 371 H GLY 48 H GLY 48 2.246 -5.543 8.255 372 1HA GLY 48 1HA GLY 48 3.029 -5.733 5.495 373 2HA GLY 48 2HA GLY 48 2.611 -4.057 5.775 374 H ASN 49 H ASN 49 4.912 -4.685 4.778 375 HA ASN 49 HA ASN 49 6.833 -3.474 6.769 376 1HB ASN 49 1HB ASN 49 7.107 -5.956 7.100 377 2HB ASN 49 2HB ASN 49 7.450 -6.187 5.413 378 1HD2 ASN 49 1HD2 ASN 49 10.898 -4.916 5.814 379 2HD2 ASN 49 2HD2 ASN 49 9.502 -4.895 4.622 380 H PHE 50 H PHE 50 7.173 -1.677 5.561 381 HA PHE 50 HA PHE 50 7.490 -1.846 2.548 382 1HB PHE 50 2HB PHE 50 7.753 0.626 4.295 383 2HB PHE 50 1HB PHE 50 7.972 0.676 2.606 384 HD1 PHE 50 HD2 PHE 50 5.541 0.174 5.360 385 HD2 PHE 50 HD1 PHE 50 6.196 1.361 1.284 386 HE1 PHE 50 HE2 PHE 50 3.296 1.249 5.286 387 HE2 PHE 50 HE1 PHE 50 3.980 2.415 1.246 388 HZ PHE 50 HZ PHE 50 2.482 2.148 3.198 389 H GLU 51 H GLU 51 9.340 -1.432 1.528 390 HA GLU 51 HA GLU 51 11.608 -0.154 2.798 391 1HB GLU 51 1HB GLU 51 13.353 -1.997 2.718 392 2HB GLU 51 2HB GLU 51 12.051 -2.394 3.798 393 1HG GLU 51 1HG GLU 51 12.505 -4.434 2.755 394 2HG GLU 51 2HG GLU 51 11.026 -3.911 1.980 395 HE1 GLU 51 HE2 GLU 51 14.551 -4.164 -0.030 396 H VAL 52 H VAL 52 13.575 0.192 1.470 397 HA VAL 52 HA VAL 52 12.647 0.868 -1.250 398 HB VAL 52 HB VAL 52 14.013 2.137 0.979 399 1HG1 VAL 52 1HG2 VAL 52 16.138 1.353 -1.031 400 2HG1 VAL 52 2HG2 VAL 52 16.256 2.667 0.185 401 3HG1 VAL 52 3HG2 VAL 52 16.028 0.956 0.683 402 1HG2 VAL 52 3HG1 VAL 52 13.567 2.979 -1.878 403 2HG2 VAL 52 1HG1 VAL 52 12.732 3.429 -0.383 404 3HG2 VAL 52 2HG1 VAL 52 14.391 3.982 -0.663 405 NH1 ARG 53 NH2 ARG 53 16.852 -5.657 -3.333 406 NH2 ARG 53 NH1 ARG 53 16.527 -5.123 -1.148 407 H ARG 53 H ARG 53 14.187 0.449 -3.173 408 HA ARG 53 HA ARG 53 15.805 -2.128 -2.781 409 1HB ARG 53 1HB ARG 53 13.278 -1.905 -4.080 410 2HB ARG 53 2HB ARG 53 14.316 -1.312 -5.270 411 1HG ARG 53 1HG ARG 53 14.155 -3.564 -5.851 412 2HG ARG 53 2HG ARG 53 15.733 -3.525 -5.099 413 1HD ARG 53 1HD ARG 53 13.090 -4.461 -3.777 414 2HD ARG 53 2HD ARG 53 14.287 -5.531 -4.468 415 1HH1 ARG 53 2HH2 ARG 53 16.477 -5.658 -4.288 416 2HH1 ARG 53 1HH2 ARG 53 17.767 -6.010 -3.031 417 1HH2 ARG 53 1HH1 ARG 53 15.908 -4.721 -0.436 418 2HH2 ARG 53 2HH1 ARG 53 17.464 -5.515 -0.999 419 H GLU 54 H GLU 54 17.879 -1.198 -2.814 420 HA GLU 54 HA GLU 54 18.730 0.879 -4.633 421 1HB GLU 54 1HB GLU 54 19.920 0.166 -2.543 422 2HB GLU 54 2HB GLU 54 20.523 -1.270 -3.366 423 1HG GLU 54 1HG GLU 54 21.736 0.236 -5.039 424 2HG GLU 54 2HG GLU 54 21.087 1.654 -4.222 425 HE1 GLU 54 HE2 GLU 54 24.153 -0.476 -2.667 426 NH1 ARG 55 NH2 ARG 55 15.034 2.174 -13.293 427 NH2 ARG 55 NH1 ARG 55 15.300 0.464 -14.766 428 H ARG 55 H ARG 55 18.134 0.595 -6.751 429 HA ARG 55 HA ARG 55 18.440 -1.833 -8.302 430 1HB ARG 55 1HB ARG 55 16.736 0.020 -8.581 431 2HB ARG 55 2HB ARG 55 18.008 1.102 -9.129 432 1HG ARG 55 1HG ARG 55 18.357 -0.430 -11.157 433 2HG ARG 55 2HG ARG 55 17.000 -1.414 -10.590 434 1HD ARG 55 1HD ARG 55 15.502 0.652 -10.706 435 2HD ARG 55 2HD ARG 55 16.890 1.611 -11.251 436 1HH1 ARG 55 2HH2 ARG 55 15.202 2.535 -12.347 437 2HH1 ARG 55 1HH2 ARG 55 14.540 2.652 -14.054 438 1HH2 ARG 55 1HH1 ARG 55 15.668 -0.476 -14.948 439 2HH2 ARG 55 2HH1 ARG 55 14.787 1.061 -15.425 440 H ALA 56 H ALA 56 19.746 -2.275 -10.022 441 HA ALA 56 HA ALA 56 22.509 -0.930 -10.150 442 1HB ALA 56 3HB ALA 56 21.674 -3.747 -11.099 443 2HB ALA 56 1HB ALA 56 23.293 -3.022 -11.241 444 3HB ALA 56 2HB ALA 56 22.613 -3.353 -9.635 445 H ALA 57 H ALA 57 21.903 0.769 -11.480 446 HA ALA 57 HA ALA 57 20.517 1.282 -13.606 447 1HB ALA 57 3HB ALA 57 22.422 2.763 -12.873 448 2HB ALA 57 1HB ALA 57 23.594 1.710 -13.705 449 3HB ALA 57 2HB ALA 57 22.422 2.655 -14.640 450 NH1 ARG 58 NH2 ARG 58 19.670 -5.680 -14.776 451 NH2 ARG 58 NH1 ARG 58 21.683 -4.639 -14.582 452 H ARG 58 H ARG 58 19.976 1.121 -15.565 453 HA ARG 58 HA ARG 58 20.903 -1.387 -16.903 454 1HB ARG 58 2HB ARG 58 18.175 -0.033 -17.220 455 2HB ARG 58 1HB ARG 58 18.601 -1.584 -17.910 456 1HG ARG 58 1HG ARG 58 18.392 -1.035 -14.885 457 2HG ARG 58 2HG ARG 58 17.072 -1.522 -15.913 458 1HD ARG 58 1HD ARG 58 17.827 -3.508 -14.797 459 2HD ARG 58 2HD ARG 58 18.212 -3.684 -16.511 460 1HH1 ARG 58 2HH2 ARG 58 18.673 -5.599 -15.007 461 2HH1 ARG 58 1HH2 ARG 58 20.165 -6.528 -14.479 462 1HH2 ARG 58 1HH1 ARG 58 22.220 -3.769 -14.664 463 2HH2 ARG 58 2HH1 ARG 58 22.040 -5.558 -14.298 464 H LYS 59 H LYS 59 19.654 -0.918 -19.383 465 HA LYS 59 HA LYS 59 20.383 1.712 -20.487 466 1HB LYS 59 1HB LYS 59 21.916 1.137 -22.261 467 2HB LYS 59 2HB LYS 59 22.629 0.833 -20.694 468 1HG LYS 59 1HG LYS 59 22.254 -1.649 -20.978 469 2HG LYS 59 2HG LYS 59 21.509 -1.362 -22.553 470 1HD LYS 59 1HD LYS 59 23.632 -0.303 -23.388 471 2HD LYS 59 2HD LYS 59 24.418 -0.582 -21.843 472 1HE LYS 59 1HE LYS 59 23.316 -2.816 -23.692 473 2HE LYS 59 2HE LYS 59 24.987 -2.258 -23.679 474 1HZ LYS 59 1HZ LYS 59 24.685 -4.235 -22.353 475 2HZ LYS 59 2HZ LYS 59 23.589 -3.506 -21.384 476 H GLY 60 H GLY 60 19.126 2.216 -22.213 477 1HA GLY 60 1HA GLY 60 17.233 0.046 -23.340 478 2HA GLY 60 2HA GLY 60 16.564 1.573 -22.773 479 NH1 ARG 61 NH2 ARG 61 25.603 1.961 -23.971 480 NH2 ARG 61 NH1 ARG 61 24.510 3.790 -23.181 481 H ARG 61 H ARG 61 19.059 0.202 -24.744 482 HA ARG 61 HA ARG 61 19.629 2.772 -26.147 483 1HB ARG 61 1HB ARG 61 21.237 1.554 -24.874 484 2HB ARG 61 2HB ARG 61 21.086 0.098 -25.844 485 1HG ARG 61 1HG ARG 61 22.268 1.073 -27.698 486 2HG ARG 61 2HG ARG 61 21.965 2.714 -27.182 487 1HD ARG 61 1HD ARG 61 23.807 0.725 -25.698 488 2HD ARG 61 2HD ARG 61 24.363 1.942 -26.852 489 1HH1 ARG 61 2HH2 ARG 61 25.647 1.217 -24.677 490 2HH1 ARG 61 1HH2 ARG 61 26.258 2.112 -23.196 491 1HH2 ARG 61 1HH1 ARG 61 23.724 4.441 -23.281 492 2HH2 ARG 61 2HH1 ARG 61 25.240 3.814 -22.461 493 H ASN 62 H ASN 62 19.828 3.084 -28.284 494 HA ASN 62 HA ASN 62 17.886 2.228 -29.796 495 1HB ASN 62 1HB ASN 62 18.670 3.644 -31.675 496 2HB ASN 62 2HB ASN 62 19.045 4.355 -30.115 497 1HD2 ASN 62 1HD2 ASN 62 21.951 5.003 -32.096 498 2HD2 ASN 62 2HD2 ASN 62 20.162 5.365 -32.147 499 HA PRO 63 HA PRO 63 19.290 -1.134 -32.870 500 1HB PRO 63 1HB PRO 63 20.002 -3.366 -31.238 501 2HB PRO 63 2HB PRO 63 21.148 -2.320 -32.098 502 1HG PRO 63 1HG PRO 63 20.111 -1.925 -29.202 503 2HG PRO 63 2HG PRO 63 21.826 -2.044 -29.719 504 1HD PRO 63 1HD PRO 63 20.839 0.294 -29.319 505 2HD PRO 63 2HD PRO 63 21.645 0.137 -30.894 506 H GLN 64 H GLN 64 18.026 -1.547 -29.564 507 HA GLN 64 HA GLN 64 15.594 -3.101 -30.462 508 1HB GLN 64 1HB GLN 64 16.913 -3.692 -28.332 509 2HB GLN 64 2HB GLN 64 16.509 -2.128 -27.673 510 1HG GLN 64 1HG GLN 64 15.037 -3.546 -26.613 511 2HG GLN 64 2HG GLN 64 14.023 -2.759 -27.795 512 1HE2 GLN 64 2HE2 GLN 64 14.447 -6.823 -28.086 513 2HE2 GLN 64 1HE2 GLN 64 15.362 -5.827 -26.846 514 H THR 65 H THR 65 16.182 -0.147 -28.528 515 HA THR 65 HA THR 65 13.309 0.626 -28.721 516 HB THR 65 HB THR 65 13.766 2.143 -26.897 517 HG1 THR 65 HG1 THR 65 16.490 1.476 -27.269 518 1HG2 THR 65 2HG2 THR 65 13.591 -0.327 -26.290 519 2HG2 THR 65 3HG2 THR 65 15.363 -0.429 -26.320 520 3HG2 THR 65 1HG2 THR 65 14.570 0.627 -25.136 521 H GLY 66 H GLY 66 16.119 1.883 -30.383 522 1HA GLY 66 1HA GLY 66 16.078 3.659 -32.030 523 2HA GLY 66 2HA GLY 66 14.523 4.220 -31.471 524 H GLU 67 H GLU 67 15.946 4.293 -28.549 525 HA GLU 67 HA GLU 67 17.308 7.017 -28.917 526 1HB GLU 67 1HB GLU 67 15.418 7.043 -28.107 527 2HB GLU 67 2HB GLU 67 14.825 6.649 -27.323 528 1HG GLU 67 1HG GLU 67 17.346 7.753 -25.973 529 2HG GLU 67 2HG GLU 67 16.483 8.762 -27.124 530 HE1 GLU 67 HE2 GLU 67 13.726 9.306 -25.088 531 H GLU 68 H GLU 68 19.394 6.951 -28.352 532 HA GLU 68 HA GLU 68 20.616 4.534 -27.024 533 1HB GLU 68 1HB GLU 68 21.548 5.462 -29.080 534 2HB GLU 68 2HB GLU 68 21.826 7.031 -28.329 535 1HG GLU 68 1HG GLU 68 23.559 6.036 -26.818 536 2HG GLU 68 2HG GLU 68 23.238 4.430 -27.449 537 HE1 GLU 68 HE2 GLU 68 24.915 4.836 -30.440 538 H MET 69 H MET 69 20.247 4.559 -24.746 539 HA MET 69 HA MET 69 21.878 6.512 -23.285 540 1HB MET 69 1HB MET 69 20.418 7.782 -22.031 541 2HB MET 69 2HB MET 69 19.708 7.860 -23.617 542 1HG MET 69 1HG MET 69 18.707 6.224 -21.212 543 2HG MET 69 2HG MET 69 17.960 7.666 -21.897 544 1HE MET 69 3HE MET 69 16.542 4.897 -21.286 545 2HE MET 69 2HE MET 69 16.307 3.800 -22.676 546 3HE MET 69 1HE MET 69 17.890 3.877 -21.855 547 H GLU 70 H GLU 70 22.156 6.142 -21.099 548 HA GLU 70 HA GLU 70 21.805 3.308 -20.187 549 1HB GLU 70 2HB GLU 70 24.026 5.066 -20.256 550 2HB GLU 70 1HB GLU 70 23.482 5.301 -18.635 551 1HG GLU 70 1HG GLU 70 23.677 2.712 -18.358 552 2HG GLU 70 2HG GLU 70 24.136 2.592 -20.055 553 HE1 GLU 70 HE2 GLU 70 27.387 3.688 -19.625 554 H ILE 71 H ILE 71 20.198 2.905 -18.622 555 HA ILE 71 HA ILE 71 18.545 5.145 -17.662 556 HB ILE 71 HB ILE 71 18.305 2.093 -17.239 557 1HG1 ILE 71 1HG1 ILE 71 16.760 3.866 -19.257 558 2HG1 ILE 71 2HG1 ILE 71 18.144 2.900 -19.723 559 1HG2 ILE 71 2HG2 ILE 71 17.072 3.399 -15.545 560 2HG2 ILE 71 3HG2 ILE 71 16.271 4.356 -16.831 561 3HG2 ILE 71 1HG2 ILE 71 15.944 2.602 -16.660 562 1HD1 ILE 71 2HD1 ILE 71 16.975 0.780 -19.111 563 2HD1 ILE 71 3HD1 ILE 71 15.512 1.713 -18.680 564 3HD1 ILE 71 1HD1 ILE 71 16.115 1.723 -20.348 565 HA PRO 72 HA PRO 72 21.330 5.027 -13.906 566 1HB PRO 72 1HB PRO 72 20.324 7.202 -12.502 567 2HB PRO 72 2HB PRO 72 21.301 7.348 -13.969 568 1HG PRO 72 1HG PRO 72 18.249 7.455 -13.751 569 2HG PRO 72 2HG PRO 72 19.323 8.601 -14.591 570 1HD PRO 72 1HD PRO 72 18.018 6.554 -15.923 571 2HD PRO 72 2HD PRO 72 19.645 7.097 -16.438 572 H ALA 73 H ALA 73 21.171 4.682 -11.587 573 HA ALA 73 HA ALA 73 19.151 2.690 -10.818 574 1HB ALA 73 1HB ALA 73 21.442 2.759 -9.658 575 2HB ALA 73 2HB ALA 73 20.939 4.282 -8.827 576 3HB ALA 73 3HB ALA 73 20.096 2.777 -8.510 577 H SER 74 H SER 74 17.976 2.771 -8.947 578 HA SER 74 HA SER 74 17.532 5.215 -7.548 579 1HB SER 74 1HB SER 74 14.986 3.975 -8.953 580 2HB SER 74 2HB SER 74 14.810 5.098 -7.615 581 HG SER 74 HG SER 74 14.689 6.129 -9.606 582 H LYS 75 H LYS 75 16.357 5.034 -5.543 583 HA LYS 75 HA LYS 75 16.530 2.224 -4.354 584 1HB LYS 75 2HB LYS 75 15.675 4.501 -2.644 585 2HB LYS 75 1HB LYS 75 16.390 2.956 -2.266 586 1HG LYS 75 1HG LYS 75 18.609 3.684 -3.132 587 2HG LYS 75 2HG LYS 75 17.955 5.251 -3.585 588 1HD LYS 75 1HD LYS 75 18.116 4.146 -0.711 589 2HD LYS 75 2HD LYS 75 19.255 5.267 -1.421 590 1HE LYS 75 1HE LYS 75 16.271 5.880 -0.865 591 2HE LYS 75 2HE LYS 75 17.634 6.387 0.121 592 1HZ LYS 75 1HZ LYS 75 16.941 8.149 -1.306 593 2HZ LYS 75 2HZ LYS 75 18.460 7.702 -1.713 594 H VAL 76 H VAL 76 14.848 1.213 -4.985 595 HA VAL 76 HA VAL 76 12.411 2.511 -5.724 596 HB VAL 76 HB VAL 76 11.833 1.092 -7.111 597 1HG1 VAL 76 2HG2 VAL 76 14.053 2.207 -7.515 598 2HG1 VAL 76 3HG2 VAL 76 14.814 0.657 -7.083 599 3HG1 VAL 76 1HG2 VAL 76 13.792 0.750 -8.556 600 1HG2 VAL 76 2HG1 VAL 76 12.121 -1.201 -5.844 601 2HG2 VAL 76 3HG1 VAL 76 11.835 -0.992 -7.590 602 3HG2 VAL 76 1HG1 VAL 76 13.460 -1.300 -7.053 603 HA PRO 77 HA PRO 77 10.448 1.338 -1.908 604 1HB PRO 77 1HB PRO 77 8.190 2.924 -2.017 605 2HB PRO 77 2HB PRO 77 9.820 3.608 -1.854 606 1HG PRO 77 1HG PRO 77 8.162 3.342 -4.420 607 2HG PRO 77 2HG PRO 77 9.053 4.763 -3.837 608 1HD PRO 77 1HD PRO 77 10.131 2.945 -5.711 609 2HD PRO 77 2HD PRO 77 11.162 3.852 -4.575 610 H ALA 78 H ALA 78 9.523 -0.185 -1.348 611 HA ALA 78 HA ALA 78 7.220 -1.585 -2.805 612 1HB ALA 78 2HB ALA 78 9.563 -2.536 -3.015 613 2HB ALA 78 3HB ALA 78 9.678 -2.675 -1.247 614 3HB ALA 78 1HB ALA 78 8.482 -3.650 -2.143 615 H PHE 79 H PHE 79 6.144 -3.064 -1.462 616 HA PHE 79 HA PHE 79 5.622 -2.387 1.489 617 1HB PHE 79 2HB PHE 79 4.211 -0.866 0.866 618 2HB PHE 79 1HB PHE 79 3.564 -1.795 -0.517 619 HD1 PHE 79 HD2 PHE 79 1.894 -3.627 -0.178 620 HD2 PHE 79 HD1 PHE 79 3.301 -1.333 3.176 621 HE1 PHE 79 HE2 PHE 79 0.055 -4.496 1.190 622 HE2 PHE 79 HE1 PHE 79 1.433 -2.207 4.530 623 HZ PHE 79 HZ PHE 79 -0.164 -3.817 3.544 624 H LYS 80 H LYS 80 5.470 -4.220 2.258 625 HA LYS 80 HA LYS 80 4.787 -7.007 0.958 626 1HB LYS 80 2HB LYS 80 6.070 -6.270 3.625 627 2HB LYS 80 1HB LYS 80 5.405 -7.854 3.287 628 1HG LYS 80 1HG LYS 80 6.953 -8.135 1.322 629 2HG LYS 80 2HG LYS 80 7.594 -6.522 1.581 630 1HD LYS 80 1HD LYS 80 9.177 -8.095 2.404 631 2HD LYS 80 2HD LYS 80 8.590 -7.196 3.773 632 1HE LYS 80 1HE LYS 80 7.538 -10.022 3.018 633 2HE LYS 80 2HE LYS 80 8.964 -9.770 4.019 634 1HZ LYS 80 1HZ LYS 80 7.637 -8.619 5.638 635 2HZ LYS 80 2HZ LYS 80 7.051 -10.122 5.372 636 HA PRO 81 HA PRO 81 0.817 -6.499 3.241 637 1HB PRO 81 1HB PRO 81 -0.433 -8.825 2.444 638 2HB PRO 81 2HB PRO 81 -0.135 -7.499 1.314 639 1HG PRO 81 1HG PRO 81 1.511 -10.055 1.692 640 2HG PRO 81 2HG PRO 81 0.906 -9.362 0.167 641 1HD PRO 81 1HD PRO 81 3.501 -8.926 1.156 642 2HD PRO 81 2HD PRO 81 2.662 -7.748 0.098 643 H GLY 82 H GLY 82 3.173 -7.233 4.671 644 1HA GLY 82 1HA GLY 82 4.263 -8.649 6.266 645 2HA GLY 82 2HA GLY 82 2.720 -8.343 7.030 646 H LYS 83 H LYS 83 2.538 -10.397 4.345 647 HA LYS 83 HA LYS 83 1.890 -12.701 4.093 648 1HB LYS 83 2HB LYS 83 3.701 -13.000 6.488 649 2HB LYS 83 1HB LYS 83 2.431 -14.172 6.470 650 1HG LYS 83 1HG LYS 83 3.128 -14.860 4.102 651 2HG LYS 83 2HG LYS 83 4.384 -13.619 4.126 652 1HD LYS 83 1HD LYS 83 5.476 -14.785 6.122 653 2HD LYS 83 2HD LYS 83 4.212 -16.003 6.076 654 1HE LYS 83 1HE LYS 83 6.122 -16.979 4.995 655 2HE LYS 83 2HE LYS 83 4.942 -16.676 3.722 656 1HZ LYS 83 1HZ LYS 83 7.264 -14.931 4.365 657 2HZ LYS 83 2HZ LYS 83 6.181 -14.638 3.177 658 H ALA 84 H ALA 84 1.323 -11.550 7.175 659 HA ALA 84 HA ALA 84 -1.011 -12.890 8.193 660 1HB ALA 84 2HB ALA 84 0.634 -11.420 9.416 661 2HB ALA 84 3HB ALA 84 0.132 -10.014 8.443 662 3HB ALA 84 1HB ALA 84 -1.020 -10.742 9.592 663 H LEU 85 H LEU 85 -0.832 -9.776 6.249 664 HA LEU 85 HA LEU 85 -3.699 -9.391 6.171 665 1HB LEU 85 2HB LEU 85 -2.159 -7.478 5.691 666 2HB LEU 85 1HB LEU 85 -1.558 -8.329 4.270 667 HG LEU 85 HG LEU 85 -3.878 -8.469 3.465 668 1HD1 LEU 85 3HD1 LEU 85 -4.510 -6.487 5.687 669 2HD1 LEU 85 1HD1 LEU 85 -5.547 -6.673 4.235 670 3HD1 LEU 85 2HD1 LEU 85 -5.304 -8.032 5.342 671 1HD2 LEU 85 1HD2 LEU 85 -2.231 -6.773 2.523 672 2HD2 LEU 85 2HD2 LEU 85 -3.837 -6.013 2.564 673 3HD2 LEU 85 3HD2 LEU 85 -2.632 -5.619 3.813 674 H LYS 86 H LYS 86 -1.407 -11.120 4.013 675 HA LYS 86 HA LYS 86 -3.283 -11.950 1.947 676 1HB LYS 86 1HB LYS 86 -0.639 -12.365 2.156 677 2HB LYS 86 2HB LYS 86 -1.102 -13.909 2.825 678 1HG LYS 86 1HG LYS 86 -1.998 -12.804 0.082 679 2HG LYS 86 2HG LYS 86 -0.574 -13.791 0.334 680 1HD LYS 86 1HD LYS 86 -1.980 -15.722 1.094 681 2HD LYS 86 2HD LYS 86 -3.445 -14.756 0.891 682 1HE LYS 86 1HE LYS 86 -3.014 -14.484 -1.552 683 2HE LYS 86 2HE LYS 86 -1.502 -15.397 -1.420 684 1HZ LYS 86 1HZ LYS 86 -4.221 -16.435 -0.845 685 2HZ LYS 86 2HZ LYS 86 -3.335 -16.752 -2.181 686 H ASP 87 H ASP 87 -2.942 -13.157 5.287 687 HA ASP 87 HA ASP 87 -4.662 -15.540 4.997 688 1HB ASP 87 1HB ASP 87 -2.764 -14.477 6.881 689 2HB ASP 87 2HB ASP 87 -4.256 -14.238 7.683 690 HD1 ASP 87 HD2 ASP 87 -4.933 -17.660 8.130 691 H ALA 88 H ALA 88 -5.130 -12.120 6.041 692 HA ALA 88 HA ALA 88 -7.956 -12.203 6.794 693 1HB ALA 88 1HB ALA 88 -6.601 -9.968 6.821 694 2HB ALA 88 2HB ALA 88 -6.631 -9.969 5.070 695 3HB ALA 88 3HB ALA 88 -8.134 -9.808 5.900 696 H VAL 89 H VAL 89 -6.421 -11.787 3.532 697 HA VAL 89 HA VAL 89 -9.120 -11.854 2.212 698 HB VAL 89 HB VAL 89 -8.218 -9.728 2.423 699 1HG1 VAL 89 3HG2 VAL 89 -5.438 -10.839 1.829 700 2HG1 VAL 89 1HG2 VAL 89 -5.811 -9.085 1.587 701 3HG1 VAL 89 2HG2 VAL 89 -6.013 -9.765 3.148 702 1HG2 VAL 89 2HG1 VAL 89 -8.743 -10.330 0.103 703 2HG2 VAL 89 3HG1 VAL 89 -7.579 -8.955 0.331 704 3HG2 VAL 89 1HG1 VAL 89 -6.953 -10.570 -0.181 705 H LYS 90 H LYS 90 -7.072 -14.284 2.614 706 HA LYS 90 HA LYS 90 -6.166 -14.850 0.025 707 1HB LYS 90 1HB LYS 90 -5.360 -16.858 0.765 708 2HB LYS 90 2HB LYS 90 -5.381 -15.920 2.209 709 1HG LYS 90 1HG LYS 90 -7.471 -18.096 1.579 710 2HG LYS 90 2HG LYS 90 -5.989 -18.334 2.486 711 1HD LYS 90 1HD LYS 90 -6.732 -16.614 4.189 712 2HD LYS 90 2HD LYS 90 -8.244 -16.412 3.315 713 1HE LYS 90 1HE LYS 90 -8.736 -17.859 5.153 714 2HE LYS 90 2HE LYS 90 -8.774 -18.890 3.722 715 1HZ LYS 90 1HZ LYS 90 -6.526 -18.647 5.656 716 2HZ LYS 90 2HZ LYS 90 -7.586 -19.889 5.571 717 1H MET 1 1H MET 91 5.980 3.197 10.461 718 2H MET 1 2H MET 91 6.592 1.734 9.901 719 HA MET 1 HA MET 91 8.069 1.713 11.457 720 1HB MET 1 1HB MET 91 6.709 4.395 11.732 721 2HB MET 1 2HB MET 91 7.343 3.871 13.212 722 1HG MET 1 1HG MET 91 9.011 5.218 12.117 723 2HG MET 1 2HG MET 91 9.629 3.572 12.286 724 1HE MET 1 3HE MET 91 8.299 6.365 9.795 725 2HE MET 1 2HE MET 91 8.204 5.471 8.251 726 3HE MET 1 1HE MET 91 7.008 5.147 9.527 727 H ASN 2 H ASN 92 7.755 -0.095 12.516 728 HA ASN 2 HA ASN 92 6.145 -1.938 12.904 729 1HB ASN 2 1HB ASN 92 6.884 -2.786 15.049 730 2HB ASN 2 2HB ASN 92 8.039 -2.301 13.856 731 1HD2 ASN 2 2HD2 ASN 92 8.113 -0.388 17.506 732 2HD2 ASN 2 1HD2 ASN 92 6.723 -1.482 17.016 733 H LYS 3 H LYS 93 4.784 0.078 13.069 734 HA LYS 3 HA LYS 93 2.459 0.744 13.245 735 1HB LYS 3 1HB LYS 93 2.113 -1.939 13.108 736 2HB LYS 3 2HB LYS 93 1.749 -1.814 14.803 737 1HG LYS 3 1HG LYS 93 -0.183 -0.237 14.241 738 2HG LYS 3 2HG LYS 93 0.335 -0.202 12.561 739 1HD LYS 3 1HD LYS 93 -1.473 -1.687 12.482 740 2HD LYS 3 2HD LYS 93 -0.086 -2.747 12.449 741 1HE LYS 3 1HE LYS 93 -1.642 -3.781 13.950 742 2HE LYS 3 2HE LYS 93 -0.400 -3.118 15.009 743 1HZ LYS 3 1HZ LYS 93 -1.868 -1.193 15.381 744 2HZ LYS 3 2HZ LYS 93 -3.012 -1.834 14.405 745 H THR 4 H THR 94 4.452 0.284 15.926 746 HA THR 4 HA THR 94 2.868 2.025 17.639 747 HB THR 4 HB THR 94 5.135 -0.071 17.908 748 HG1 THR 4 HG1 THR 94 2.421 -0.032 18.780 749 1HG2 THR 4 3HG2 THR 94 3.672 1.609 19.963 750 2HG2 THR 4 1HG2 THR 94 4.705 0.148 20.327 751 3HG2 THR 4 2HG2 THR 94 5.430 1.616 19.561 752 H GLU 5 H GLU 95 6.075 1.790 15.974 753 HA GLU 5 HA GLU 95 7.030 4.410 17.110 754 1HB GLU 5 1HB GLU 95 8.026 2.722 14.751 755 2HB GLU 5 2HB GLU 95 8.733 4.258 15.226 756 1HG GLU 5 1HG GLU 95 8.638 1.642 16.842 757 2HG GLU 5 2HG GLU 95 9.982 2.193 15.875 758 HE1 GLU 5 HE2 GLU 95 11.184 4.493 18.184 759 H LEU 6 H LEU 96 4.723 3.196 14.860 760 HA LEU 6 HA LEU 96 4.310 5.492 13.074 761 1HB LEU 6 2HB LEU 96 3.326 2.866 13.185 762 2HB LEU 6 1HB LEU 96 1.945 3.684 13.849 763 HG LEU 6 HG LEU 96 3.233 4.086 11.143 764 1HD1 LEU 6 2HD1 LEU 96 1.908 2.065 11.403 765 2HD1 LEU 6 3HD1 LEU 96 0.492 3.002 11.844 766 3HD1 LEU 6 1HD1 LEU 96 1.199 3.184 10.219 767 1HD2 LEU 6 1HD2 LEU 96 1.089 5.804 12.496 768 2HD2 LEU 6 2HD2 LEU 96 2.553 6.342 11.653 769 3HD2 LEU 6 3HD2 LEU 96 1.197 5.668 10.742 770 H ILE 7 H ILE 97 2.789 4.321 16.120 771 HA ILE 7 HA ILE 97 0.833 6.392 16.478 772 HB ILE 7 HB ILE 97 2.268 4.854 18.727 773 1HG1 ILE 7 1HG1 ILE 97 -0.331 4.024 17.306 774 2HG1 ILE 7 2HG1 ILE 97 1.197 3.385 16.841 775 1HG2 ILE 7 2HG2 ILE 97 0.856 6.809 19.539 776 2HG2 ILE 7 3HG2 ILE 97 -0.543 6.076 18.776 777 3HG2 ILE 7 1HG2 ILE 97 0.263 5.246 20.117 778 1HD1 ILE 7 3HD1 ILE 97 1.598 2.507 19.204 779 2HD1 ILE 7 1HD1 ILE 97 -0.104 2.842 19.519 780 3HD1 ILE 7 2HD1 ILE 97 0.351 1.715 18.208 781 H ASN 8 H ASN 98 4.147 6.178 17.750 782 HA ASN 8 HA ASN 98 4.011 8.968 18.843 783 1HB ASN 8 1HB ASN 98 6.565 7.284 18.274 784 2HB ASN 8 2HB ASN 98 6.552 8.795 19.154 785 1HD2 ASN 8 2HD2 ASN 98 5.792 5.451 21.282 786 2HD2 ASN 8 1HD2 ASN 98 6.306 5.448 19.520 787 H ALA 9 H ALA 99 4.486 7.973 15.625 788 HA ALA 9 HA ALA 99 5.863 10.479 14.663 789 1HB ALA 9 2HB ALA 99 5.779 8.224 13.214 790 2HB ALA 9 3HB ALA 99 4.039 8.479 13.057 791 3HB ALA 9 1HB ALA 99 5.092 9.665 12.368 792 H VAL 10 H VAL 100 2.511 9.160 14.846 793 HA VAL 10 HA VAL 100 1.368 11.273 13.358 794 HB VAL 10 HB VAL 100 -0.327 9.538 15.166 795 1HG1 VAL 10 3HG2 VAL 100 -1.106 11.379 13.348 796 2HG1 VAL 10 1HG2 VAL 100 -0.995 9.943 12.284 797 3HG1 VAL 10 2HG2 VAL 100 -2.021 9.881 13.723 798 1HG2 VAL 10 1HG1 VAL 100 1.327 8.600 12.812 799 2HG2 VAL 10 2HG1 VAL 100 1.022 7.932 14.445 800 3HG2 VAL 10 3HG1 VAL 100 -0.256 7.802 13.206 801 H ALA 11 H ALA 101 1.328 10.356 16.622 802 HA ALA 11 HA ALA 101 0.036 12.734 17.424 803 1HB ALA 11 2HB ALA 101 0.053 10.616 18.860 804 2HB ALA 11 3HB ALA 101 1.796 10.818 19.155 805 3HB ALA 11 1HB ALA 101 0.622 11.975 19.859 806 H GLU 12 H GLU 102 3.407 12.278 16.795 807 HA GLU 12 HA GLU 102 4.147 14.874 18.112 808 1HB GLU 12 1HB GLU 102 5.826 12.983 18.016 809 2HB GLU 12 2HB GLU 102 5.823 13.066 16.264 810 1HG GLU 12 1HG GLU 102 7.817 14.153 17.075 811 2HG GLU 12 2HG GLU 102 6.808 15.396 16.364 812 HE2 GLU 12 HE2 GLU 102 6.386 17.186 19.287 813 H THR 13 H THR 103 3.717 13.716 14.699 814 HA THR 13 HA THR 103 3.834 16.600 13.837 815 HB THR 13 HB THR 103 5.076 14.633 12.787 816 HG1 THR 13 HG1 THR 103 5.092 15.780 10.841 817 1HG2 THR 13 2HG2 THR 103 3.201 13.158 12.153 818 2HG2 THR 13 3HG2 THR 103 2.585 14.402 11.036 819 3HG2 THR 13 1HG2 THR 103 4.178 13.646 10.750 820 H SER 14 H SER 104 1.523 15.157 14.959 821 HA SER 14 HA SER 104 -0.554 16.919 13.470 822 1HB SER 14 1HB SER 104 -1.381 14.201 14.641 823 2HB SER 14 2HB SER 104 -2.363 15.314 13.701 824 HG SER 14 HG SER 104 -1.523 13.630 12.466 825 H GLY 15 H GLY 105 0.414 15.747 16.711 826 1HA GLY 15 1HA GLY 105 -0.246 16.479 18.853 827 2HA GLY 15 2HA GLY 105 -0.892 17.938 18.107 828 H LEU 16 H LEU 106 -1.724 14.525 18.081 829 HA LEU 16 HA LEU 106 -4.522 14.971 19.153 830 1HB LEU 16 1HB LEU 106 -5.167 12.926 18.091 831 2HB LEU 16 2HB LEU 106 -4.805 14.272 17.031 832 HG LEU 16 HG LEU 106 -2.779 13.442 16.369 833 1HD1 LEU 16 2HD1 LEU 106 -1.924 12.440 18.527 834 2HD1 LEU 16 3HD1 LEU 106 -3.040 11.074 18.201 835 3HD1 LEU 16 1HD1 LEU 106 -1.633 11.436 17.103 836 1HD2 LEU 16 3HD2 LEU 106 -4.142 12.694 14.866 837 2HD2 LEU 16 1HD2 LEU 106 -2.609 11.804 15.069 838 3HD2 LEU 16 2HD2 LEU 106 -4.091 11.079 15.663 839 H SER 17 H SER 107 -3.825 12.136 19.603 840 HA SER 17 HA SER 107 -2.489 12.256 22.349 841 1HB SER 17 1HB SER 107 -5.059 10.642 22.016 842 2HB SER 17 2HB SER 107 -4.052 10.767 23.439 843 HG SER 17 HG SER 107 -5.832 12.154 23.527 844 H LYS 18 H LYS 108 -1.687 10.198 23.064 845 HA LYS 18 HA LYS 108 -0.458 8.493 20.901 846 1HB LYS 18 1HB LYS 108 0.689 9.069 23.126 847 2HB LYS 18 2HB LYS 108 -0.421 7.974 23.944 848 1HG LYS 18 1HG LYS 108 0.460 6.050 22.598 849 2HG LYS 18 2HG LYS 108 1.439 7.150 21.619 850 1HD LYS 18 1HD LYS 108 2.802 7.816 23.567 851 2HD LYS 18 2HD LYS 108 1.832 6.799 24.642 852 1HE LYS 18 1HE LYS 108 2.545 4.733 23.349 853 2HE LYS 18 2HE LYS 108 3.481 5.740 22.236 854 1HZ LYS 18 1HZ LYS 108 4.859 6.443 24.077 855 2HZ LYS 18 2HZ LYS 108 4.876 4.815 23.928 856 H LYS 19 H LYS 109 -3.047 8.060 23.283 857 HA LYS 19 HA LYS 109 -4.073 5.498 22.241 858 1HB LYS 19 2HB LYS 109 -4.650 6.426 24.500 859 2HB LYS 19 1HB LYS 109 -5.606 7.713 23.755 860 1HG LYS 19 1HG LYS 109 -7.150 5.971 22.768 861 2HG LYS 19 2HG LYS 109 -6.158 4.685 23.456 862 1HD LYS 19 1HD LYS 109 -6.674 5.535 25.793 863 2HD LYS 19 2HD LYS 109 -7.598 6.860 25.103 864 1HE LYS 19 1HE LYS 109 -9.199 5.220 25.829 865 2HE LYS 19 2HE LYS 109 -9.232 5.208 24.069 866 1HZ LYS 19 1HZ LYS 109 -7.776 3.257 25.778 867 2HZ LYS 19 2HZ LYS 109 -7.788 3.231 24.143 868 H ASP 20 H ASP 110 -4.737 8.949 21.222 869 HA ASP 20 HA ASP 110 -6.825 8.076 19.232 870 1HB ASP 20 1HB ASP 110 -5.420 10.770 19.685 871 2HB ASP 20 2HB ASP 110 -6.366 10.502 18.245 872 HD1 ASP 20 HD2 ASP 110 -9.482 10.450 19.727 873 H ALA 21 H ALA 111 -3.341 8.495 19.108 874 HA ALA 21 HA ALA 111 -3.122 8.273 16.148 875 1HB ALA 21 1HB ALA 111 -1.033 8.218 18.405 876 2HB ALA 21 2HB ALA 111 -0.635 7.966 16.680 877 3HB ALA 21 3HB ALA 111 -1.354 9.453 17.209 878 H THR 22 H THR 112 -2.840 5.903 18.878 879 HA THR 22 HA THR 112 -2.310 3.547 17.320 880 HB THR 22 HB THR 112 -4.106 3.596 19.832 881 HG1 THR 22 HG1 THR 112 -2.309 4.906 20.193 882 1HG2 THR 22 2HG2 THR 112 -1.949 1.679 18.756 883 2HG2 THR 22 3HG2 THR 112 -2.750 1.516 20.344 884 3HG2 THR 22 1HG2 THR 112 -3.701 1.366 18.822 885 H LYS 23 H LYS 113 -5.389 4.891 18.241 886 HA LYS 23 HA LYS 113 -7.183 3.097 16.750 887 1HB LYS 23 2HB LYS 113 -7.307 6.121 17.545 888 2HB LYS 23 1HB LYS 113 -8.669 5.369 16.799 889 1HG LYS 23 1HG LYS 113 -8.968 3.751 18.691 890 2HG LYS 23 2HG LYS 113 -7.524 4.369 19.490 891 1HD LYS 23 1HD LYS 113 -8.574 6.640 19.701 892 2HD LYS 23 2HD LYS 113 -10.031 6.086 18.897 893 1HE LYS 23 1HE LYS 113 -8.959 4.910 21.557 894 2HE LYS 23 2HE LYS 113 -10.133 6.219 21.457 895 1HZ LYS 23 1HZ LYS 113 -11.656 4.759 20.319 896 2HZ LYS 23 2HZ LYS 113 -11.225 4.131 21.765 897 H ALA 24 H ALA 114 -5.981 6.252 15.915 898 HA ALA 24 HA ALA 114 -7.065 6.481 13.293 899 1HB ALA 24 2HB ALA 114 -6.288 8.357 14.609 900 2HB ALA 24 3HB ALA 114 -4.583 7.789 14.485 901 3HB ALA 24 1HB ALA 114 -5.456 8.368 13.026 902 H VAL 25 H VAL 115 -4.043 4.998 14.131 903 HA VAL 25 HA VAL 115 -3.204 4.219 11.335 904 HB VAL 25 HB VAL 115 -2.686 3.518 14.381 905 1HG1 VAL 25 2HG2 VAL 115 -1.509 1.852 12.089 906 2HG1 VAL 25 3HG2 VAL 115 -0.917 1.861 13.788 907 3HG1 VAL 25 1HG2 VAL 115 -2.540 1.292 13.410 908 1HG2 VAL 25 3HG1 VAL 115 -0.878 4.658 12.195 909 2HG2 VAL 25 1HG1 VAL 115 -1.590 5.530 13.556 910 3HG2 VAL 25 2HG1 VAL 115 -0.371 4.291 13.886 911 H ASP 26 H ASP 116 -4.741 2.355 14.035 912 HA ASP 26 HA ASP 116 -5.852 0.294 12.163 913 1HB ASP 26 1HB ASP 116 -5.210 0.061 14.689 914 2HB ASP 26 2HB ASP 116 -6.725 0.878 15.058 915 HD2 ASP 26 HD2 ASP 116 -8.553 -2.021 14.825 916 H ALA 27 H ALA 117 -6.604 3.085 12.029 917 HA ALA 27 HA ALA 117 -9.544 2.989 11.276 918 1HB ALA 27 3HB ALA 117 -7.497 5.194 11.703 919 2HB ALA 27 1HB ALA 117 -8.967 5.510 10.895 920 3HB ALA 27 2HB ALA 117 -8.986 4.997 12.623 921 H VAL 28 H VAL 118 -6.451 4.055 9.975 922 HA VAL 28 HA VAL 118 -7.136 4.078 7.126 923 HB VAL 28 HB VAL 118 -4.274 3.448 8.210 924 1HG1 VAL 28 1HG2 VAL 118 -5.407 4.685 5.682 925 2HG1 VAL 28 2HG2 VAL 118 -3.702 4.890 6.205 926 3HG1 VAL 28 3HG2 VAL 118 -4.341 3.266 5.925 927 1HG2 VAL 28 3HG1 VAL 118 -5.626 6.118 8.388 928 2HG2 VAL 28 1HG1 VAL 118 -4.512 5.203 9.473 929 3HG2 VAL 28 2HG1 VAL 118 -3.855 5.977 8.039 930 H PHE 29 H PHE 119 -5.174 1.897 8.957 931 HA PHE 29 HA PHE 119 -5.246 -0.370 7.043 932 1HB PHE 29 2HB PHE 119 -4.115 -0.426 9.879 933 2HB PHE 29 1HB PHE 119 -3.723 -1.560 8.604 934 HD1 PHE 29 HD1 PHE 119 -2.977 -0.225 6.217 935 HD2 PHE 29 HD2 PHE 119 -2.449 1.207 10.229 936 HE1 PHE 29 HE1 PHE 119 -1.377 1.450 5.409 937 HE2 PHE 29 HE2 PHE 119 -0.900 2.918 9.407 938 HZ PHE 29 HZ PHE 119 -0.395 3.067 6.988 939 H ASP 30 H ASP 120 -7.624 0.471 9.323 940 HA ASP 30 HA ASP 120 -8.757 -2.340 9.286 941 1HB ASP 30 1HB ASP 120 -9.055 -0.664 11.220 942 2HB ASP 30 2HB ASP 120 -10.165 0.248 10.222 943 HD2 ASP 30 HD2 ASP 120 -12.820 -1.930 10.523 944 H SER 31 H SER 121 -9.291 0.806 7.908 945 HA SER 31 HA SER 121 -11.536 0.030 6.081 946 1HB SER 31 2HB SER 121 -9.932 2.638 6.118 947 2HB SER 31 1HB SER 121 -11.347 2.313 5.086 948 HG SER 31 HG SER 121 -12.537 1.856 6.960 949 H ILE 32 H ILE 122 -7.988 -0.225 5.622 950 HA ILE 32 HA ILE 122 -8.129 -0.615 2.674 951 HB ILE 32 HB ILE 122 -6.052 -1.500 4.782 952 1HG1 ILE 32 1HG1 ILE 122 -4.291 -0.453 3.667 953 2HG1 ILE 32 2HG1 ILE 122 -5.328 0.299 2.455 954 1HG2 ILE 32 2HG2 ILE 122 -6.497 -2.035 1.783 955 2HG2 ILE 32 3HG2 ILE 122 -4.823 -2.138 2.343 956 3HG2 ILE 32 1HG2 ILE 122 -6.087 -3.197 3.016 957 1HD1 ILE 32 2HD1 ILE 122 -4.849 1.104 5.382 958 2HD1 ILE 32 3HD1 ILE 122 -4.275 1.917 3.950 959 3HD1 ILE 32 1HD1 ILE 122 -6.006 1.975 4.316 960 H THR 33 H THR 123 -7.999 -2.606 5.749 961 HA THR 33 HA THR 123 -8.230 -5.137 4.354 962 HB THR 33 HB THR 123 -8.765 -6.273 6.353 963 HG1 THR 33 HG1 THR 123 -10.193 -4.768 7.276 964 1HG2 THR 33 2HG2 THR 123 -6.437 -5.526 5.968 965 2HG2 THR 33 3HG2 THR 123 -6.704 -4.038 6.824 966 3HG2 THR 33 1HG2 THR 123 -6.737 -5.573 7.732 967 H GLU 34 H GLU 124 -10.684 -2.935 5.059 968 HA GLU 34 HA GLU 124 -12.919 -4.846 4.395 969 1HB GLU 34 1HB GLU 124 -12.881 -1.761 4.906 970 2HB GLU 34 2HB GLU 124 -14.348 -2.607 4.447 971 1HG GLU 34 1HG GLU 124 -14.382 -3.916 6.535 972 2HG GLU 34 2HG GLU 124 -12.805 -3.310 7.024 973 HE2 GLU 34 HE2 GLU 124 -16.130 -1.157 7.623 974 H ALA 35 H ALA 125 -10.837 -2.490 2.723 975 HA ALA 35 HA ALA 125 -12.380 -2.757 0.215 976 1HB ALA 35 2HB ALA 125 -10.572 -0.770 0.608 977 2HB ALA 35 3HB ALA 125 -9.347 -2.036 0.552 978 3HB ALA 35 1HB ALA 125 -10.260 -1.690 -0.881 979 H LEU 36 H LEU 126 -9.109 -4.166 1.182 980 HA LEU 36 HA LEU 126 -9.017 -5.897 -1.100 981 1HB LEU 36 2HB LEU 126 -7.678 -6.061 1.550 982 2HB LEU 36 1HB LEU 126 -7.071 -6.749 0.045 983 HG LEU 36 HG LEU 126 -7.381 -3.738 0.500 984 1HD1 LEU 36 3HD1 LEU 126 -5.129 -4.646 1.124 985 2HD1 LEU 36 1HD1 LEU 126 -4.892 -4.763 -0.692 986 3HD1 LEU 36 2HD1 LEU 126 -5.306 -3.192 0.090 987 1HD2 LEU 36 2HD2 LEU 126 -7.332 -4.577 -2.185 988 2HD2 LEU 36 3HD2 LEU 126 -8.368 -3.450 -1.292 989 3HD2 LEU 36 1HD2 LEU 126 -6.716 -3.009 -1.636 990 NH1 ARG 37 NH2 ARG 127 -12.821 -6.674 8.245 991 NH2 ARG 37 NH1 ARG 127 -15.032 -6.354 7.827 992 H ARG 37 H ARG 127 -10.276 -6.536 2.292 993 HA ARG 37 HA ARG 127 -10.461 -9.315 1.639 994 1HB ARG 37 1HB ARG 127 -11.472 -9.845 3.660 995 2HB ARG 37 2HB ARG 127 -10.470 -8.475 4.045 996 1HG ARG 37 1HG ARG 127 -12.765 -7.063 3.702 997 2HG ARG 37 2HG ARG 127 -13.544 -8.637 3.802 998 1HD ARG 37 1HD ARG 127 -12.436 -9.026 6.027 999 2HD ARG 37 2HD ARG 127 -11.674 -7.417 5.898 1000 1HH1 ARG 37 2HH2 ARG 127 -11.922 -7.041 7.913 1001 2HH1 ARG 37 1HH2 ARG 127 -13.002 -6.210 9.142 1002 1HH2 ARG 37 1HH1 ARG 127 -15.819 -6.473 7.181 1003 2HH2 ARG 37 2HH1 ARG 127 -15.058 -5.913 8.753 1004 H LYS 38 H LYS 128 -12.556 -6.531 0.845 1005 HA LYS 38 HA LYS 128 -14.978 -8.299 0.542 1006 1HB LYS 38 1HB LYS 128 -15.050 -6.104 1.818 1007 2HB LYS 38 2HB LYS 128 -14.801 -5.257 0.289 1008 1HG LYS 38 1HG LYS 128 -17.028 -6.128 -0.529 1009 2HG LYS 38 2HG LYS 128 -17.172 -7.125 0.911 1010 1HD LYS 38 1HD LYS 128 -18.567 -5.210 1.244 1011 2HD LYS 38 2HD LYS 128 -17.214 -5.049 2.356 1012 1HE LYS 38 1HE LYS 128 -16.118 -3.379 0.745 1013 2HE LYS 38 2HE LYS 128 -17.489 -3.565 -0.357 1014 1HZ LYS 38 1HZ LYS 128 -17.709 -1.643 1.068 1015 2HZ LYS 38 2HZ LYS 128 -17.617 -2.547 2.427 1016 H GLY 39 H GLY 129 -12.420 -7.608 -1.454 1017 1HA GLY 39 1HA GLY 129 -12.126 -7.671 -3.860 1018 2HA GLY 39 2HA GLY 129 -13.854 -7.911 -4.073 1019 H ASP 40 H ASP 130 -12.134 -5.336 -2.412 1020 HA ASP 40 HA ASP 130 -12.953 -3.164 -4.403 1021 1HB ASP 40 1HB ASP 130 -13.489 -3.294 -1.418 1022 2HB ASP 40 2HB ASP 130 -13.362 -1.748 -2.235 1023 HD2 ASP 40 HD2 ASP 130 -16.578 -4.130 -2.627 1024 H LYS 41 H LYS 131 -11.924 -1.288 -4.460 1025 HA LYS 41 HA LYS 131 -8.922 -1.555 -3.974 1026 1HB LYS 41 2HB LYS 131 -10.314 0.604 -5.650 1027 2HB LYS 41 1HB LYS 131 -8.585 0.265 -5.563 1028 1HG LYS 41 1HG LYS 131 -9.155 -2.076 -6.584 1029 2HG LYS 41 2HG LYS 131 -10.759 -1.455 -6.906 1030 1HD LYS 41 1HD LYS 131 -8.128 -0.198 -7.933 1031 2HD LYS 41 2HD LYS 131 -9.132 -1.314 -8.850 1032 1HE LYS 41 1HE LYS 131 -11.058 0.337 -8.804 1033 2HE LYS 41 2HE LYS 131 -10.065 1.475 -7.882 1034 1HZ LYS 41 1HZ LYS 131 -10.005 1.987 -10.202 1035 2HZ LYS 41 2HZ LYS 131 -8.507 1.558 -9.709 1036 H VAL 42 H VAL 132 -7.837 -0.093 -2.535 1037 HA VAL 42 HA VAL 132 -9.194 1.802 -0.957 1038 HB VAL 42 HB VAL 132 -6.252 1.259 -1.358 1039 1HG1 VAL 42 3HG2 VAL 132 -7.085 3.006 0.356 1040 2HG1 VAL 42 1HG2 VAL 132 -7.767 1.621 1.252 1041 3HG1 VAL 42 2HG2 VAL 132 -6.010 1.684 0.936 1042 1HG2 VAL 42 3HG1 VAL 132 -7.463 -1.041 -0.977 1043 2HG2 VAL 42 1HG1 VAL 132 -6.381 -0.563 0.345 1044 3HG2 VAL 42 2HG1 VAL 132 -8.139 -0.352 0.510 1045 H GLN 43 H GLN 133 -6.714 3.346 -1.362 1046 HA GLN 43 HA GLN 133 -5.770 4.298 -3.156 1047 1HB GLN 43 1HB GLN 133 -8.201 5.547 -4.228 1048 2HB GLN 43 2HB GLN 133 -6.661 6.357 -4.535 1049 1HG GLN 43 1HG GLN 133 -5.679 4.384 -5.481 1050 2HG GLN 43 2HG GLN 133 -7.021 3.365 -5.050 1051 1HE2 GLN 43 2HE2 GLN 133 -8.916 4.229 -7.992 1052 2HE2 GLN 43 1HE2 GLN 133 -8.870 3.368 -6.374 1053 H LEU 44 H LEU 134 -4.234 5.727 -3.296 1054 HA LEU 44 HA LEU 134 -4.177 7.857 -1.108 1055 1HB LEU 44 2HB LEU 134 -2.211 5.542 -1.634 1056 2HB LEU 44 1HB LEU 134 -1.635 7.002 -0.852 1057 HG LEU 44 HG LEU 134 -4.061 5.490 0.244 1058 1HD1 LEU 44 1HD1 LEU 134 -2.215 3.864 0.188 1059 2HD1 LEU 44 2HD1 LEU 134 -1.125 5.004 1.026 1060 3HD1 LEU 44 3HD1 LEU 134 -2.556 4.344 1.858 1061 1HD2 LEU 44 1HD2 LEU 134 -2.049 7.488 1.515 1062 2HD2 LEU 44 2HD2 LEU 134 -3.758 7.819 1.135 1063 3HD2 LEU 44 3HD2 LEU 134 -3.336 6.642 2.393 1064 H ILE 45 H ILE 135 -4.096 9.652 -2.334 1065 HA ILE 45 HA ILE 135 -2.517 9.806 -4.844 1066 HB ILE 45 HB ILE 135 -4.673 10.974 -4.506 1067 1HG1 ILE 45 1HG1 ILE 135 -3.212 11.408 -6.449 1068 2HG1 ILE 45 2HG1 ILE 135 -4.365 12.647 -6.031 1069 1HG2 ILE 45 3HG2 ILE 135 -4.367 11.958 -2.298 1070 2HG2 ILE 45 1HG2 ILE 135 -3.074 13.025 -2.899 1071 3HG2 ILE 45 2HG2 ILE 135 -4.753 13.228 -3.493 1072 1HD1 ILE 45 3HD1 ILE 135 -2.515 14.088 -5.054 1073 2HD1 ILE 45 1HD1 ILE 135 -1.325 12.863 -5.563 1074 3HD1 ILE 45 2HD1 ILE 135 -2.299 13.708 -6.775 1075 H GLY 46 H GLY 136 -0.688 10.983 -5.084 1076 1HA GLY 46 1HA GLY 136 1.585 11.577 -4.494 1077 2HA GLY 46 2HA GLY 136 1.124 11.706 -2.803 1078 H PHE 47 H PHE 137 0.253 8.534 -3.291 1079 HA PHE 47 HA PHE 137 2.970 7.324 -3.367 1080 1HB PHE 47 2HB PHE 137 0.588 7.477 -1.478 1081 2HB PHE 47 1HB PHE 137 0.864 5.889 -1.966 1082 HD1 PHE 47 HD1 PHE 137 2.378 8.957 -0.388 1083 HD2 PHE 47 HD2 PHE 137 2.857 4.728 -0.883 1084 HE1 PHE 47 HE1 PHE 137 4.060 8.914 1.404 1085 HE2 PHE 47 HE2 PHE 137 4.502 4.687 0.923 1086 HZ PHE 47 HZ PHE 137 5.142 6.748 2.053 1087 H GLY 48 H GLY 138 -0.225 5.782 -3.599 1088 1HA GLY 48 1HA GLY 138 -0.671 6.022 -6.478 1089 2HA GLY 48 2HA GLY 138 0.171 4.519 -6.216 1090 H ASN 49 H ASN 139 -1.144 2.764 -5.697 1091 HA ASN 49 HA ASN 139 -3.989 3.109 -4.661 1092 1HB ASN 49 1HB ASN 139 -4.085 3.527 -7.128 1093 2HB ASN 49 2HB ASN 139 -3.210 2.048 -7.468 1094 1HD2 ASN 49 1HD2 ASN 139 -6.616 1.180 -8.388 1095 2HD2 ASN 49 2HD2 ASN 139 -5.135 2.101 -8.960 1096 H PHE 50 H PHE 140 -4.379 1.490 -3.224 1097 HA PHE 50 HA PHE 140 -2.959 -1.191 -3.464 1098 1HB PHE 50 2HB PHE 140 -5.171 -0.445 -1.530 1099 2HB PHE 50 1HB PHE 140 -4.551 -2.025 -1.583 1100 HD1 PHE 50 HD2 PHE 140 -3.921 1.437 -0.631 1101 HD2 PHE 50 HD1 PHE 140 -2.998 -2.688 0.010 1102 HE1 PHE 50 HE2 PHE 140 -2.801 2.008 1.529 1103 HE2 PHE 50 HE1 PHE 140 -1.893 -2.103 2.147 1104 HZ PHE 50 HZ PHE 140 -1.785 0.260 2.841 1105 H GLU 51 H GLU 141 -3.903 -2.984 -4.155 1106 HA GLU 51 HA GLU 141 -6.697 -3.419 -4.012 1107 1HB GLU 51 1HB GLU 141 -7.399 -3.657 -6.448 1108 2HB GLU 51 2HB GLU 141 -6.879 -2.018 -6.135 1109 1HG GLU 51 1HG GLU 141 -4.617 -2.528 -7.195 1110 2HG GLU 51 2HG GLU 141 -5.158 -4.168 -7.541 1111 HE1 GLU 51 HE2 GLU 141 -7.320 -3.286 -10.127 1112 H VAL 52 H VAL 142 -7.564 -5.510 -4.956 1113 HA VAL 52 HA VAL 142 -5.609 -7.523 -4.111 1114 HB VAL 52 HB VAL 142 -8.327 -6.706 -3.519 1115 1HG1 VAL 52 1HG2 VAL 142 -8.496 -9.124 -5.333 1116 2HG1 VAL 52 2HG2 VAL 142 -9.710 -8.647 -4.100 1117 3HG1 VAL 52 3HG2 VAL 142 -9.286 -7.556 -5.467 1118 1HG2 VAL 52 1HG1 VAL 142 -6.841 -9.221 -2.734 1119 2HG2 VAL 52 2HG1 VAL 142 -6.920 -7.639 -1.924 1120 3HG2 VAL 52 3HG1 VAL 142 -8.379 -8.622 -2.065 1121 NH1 ARG 53 NH2 ARG 143 0.644 -11.379 -9.404 1122 NH2 ARG 53 NH1 ARG 143 0.028 -13.193 -8.179 1123 H ARG 53 H ARG 143 -5.479 -9.586 -5.256 1124 HA ARG 53 HA ARG 143 -6.075 -9.440 -8.286 1125 1HB ARG 53 1HB ARG 143 -3.615 -8.884 -7.634 1126 2HB ARG 53 2HB ARG 143 -3.489 -10.537 -7.082 1127 1HG ARG 53 1HG ARG 143 -4.199 -11.311 -9.468 1128 2HG ARG 53 2HG ARG 143 -4.082 -9.625 -9.946 1129 1HD ARG 53 1HD ARG 143 -2.005 -10.623 -10.588 1130 2HD ARG 53 2HD ARG 143 -1.620 -9.632 -9.177 1131 1HH1 ARG 53 2HH2 ARG 143 0.350 -10.526 -9.892 1132 2HH1 ARG 53 1HH2 ARG 143 1.599 -11.743 -9.322 1133 1HH2 ARG 53 1HH1 ARG 143 -0.730 -13.723 -7.734 1134 2HH2 ARG 53 2HH1 ARG 143 1.026 -13.431 -8.181 1135 H GLU 54 H GLU 144 -7.798 -10.848 -8.264 1136 HA GLU 54 HA GLU 144 -7.788 -13.467 -6.904 1137 1HB GLU 54 1HB GLU 144 -9.802 -14.053 -8.120 1138 2HB GLU 54 2HB GLU 144 -9.906 -12.521 -7.283 1139 1HG GLU 54 1HG GLU 144 -9.659 -11.281 -9.466 1140 2HG GLU 54 2HG GLU 144 -9.521 -12.810 -10.334 1141 HE1 GLU 54 HE2 GLU 144 -12.876 -13.625 -10.195 1142 NH1 ARG 55 NH2 ARG 145 0.382 -15.963 -5.423 1143 NH2 ARG 55 NH1 ARG 145 -0.581 -17.223 -3.794 1144 H ARG 55 H ARG 145 -6.556 -15.086 -7.389 1145 HA ARG 55 HA ARG 145 -5.373 -15.312 -10.220 1146 1HB ARG 55 1HB ARG 145 -3.265 -15.905 -9.429 1147 2HB ARG 55 2HB ARG 145 -3.760 -14.472 -8.564 1148 1HG ARG 55 1HG ARG 145 -4.290 -15.907 -6.530 1149 2HG ARG 55 2HG ARG 145 -3.791 -17.345 -7.413 1150 1HD ARG 55 1HD ARG 145 -1.468 -16.421 -7.676 1151 2HD ARG 55 2HD ARG 145 -1.955 -14.934 -6.842 1152 1HH1 ARG 55 2HH2 ARG 145 0.275 -15.491 -6.327 1153 2HH1 ARG 55 1HH2 ARG 145 1.226 -15.993 -4.841 1154 1HH2 ARG 55 1HH1 ARG 145 -1.417 -17.709 -3.454 1155 2HH2 ARG 55 2HH1 ARG 145 0.330 -17.164 -3.325 1156 H ALA 56 H ALA 146 -4.645 -17.228 -11.009 1157 HA ALA 56 HA ALA 146 -5.212 -19.234 -11.974 1158 1HB ALA 56 3HB ALA 146 -3.324 -19.490 -10.401 1159 2HB ALA 56 1HB ALA 146 -4.437 -20.026 -9.115 1160 3HB ALA 56 2HB ALA 146 -4.206 -21.017 -10.583 1161 H ALA 57 H ALA 147 -7.777 -18.258 -11.205 1162 HA ALA 57 HA ALA 147 -9.306 -20.832 -10.711 1163 1HB ALA 57 2HB ALA 147 -10.253 -18.658 -9.759 1164 2HB ALA 57 3HB ALA 147 -10.562 -18.098 -11.410 1165 3HB ALA 57 1HB ALA 147 -11.386 -19.543 -10.773 1166 NH1 ARG 58 NH2 ARG 148 -4.134 -21.966 -13.605 1167 NH2 ARG 58 NH1 ARG 148 -3.501 -23.551 -12.103 1168 H ARG 58 H ARG 148 -10.115 -22.203 -12.182 1169 HA ARG 58 HA ARG 148 -8.872 -21.669 -14.818 1170 1HB ARG 58 2HB ARG 148 -10.113 -24.281 -13.921 1171 2HB ARG 58 1HB ARG 148 -9.113 -24.052 -15.348 1172 1HG ARG 58 1HG ARG 148 -8.232 -23.906 -12.414 1173 2HG ARG 58 2HG ARG 148 -7.856 -25.160 -13.581 1174 1HD ARG 58 1HD ARG 148 -6.472 -23.516 -14.933 1175 2HD ARG 58 2HD ARG 148 -6.886 -22.230 -13.784 1176 1HH1 ARG 58 2HH2 ARG 148 -4.865 -21.611 -14.232 1177 2HH1 ARG 58 1HH2 ARG 148 -3.205 -21.557 -13.451 1178 1HH2 ARG 58 1HH1 ARG 148 -3.745 -24.402 -11.585 1179 2HH2 ARG 58 2HH1 ARG 148 -2.617 -23.033 -12.052 1180 H LYS 59 H LYS 149 -10.566 -23.291 -16.437 1181 HA LYS 59 HA LYS 149 -13.215 -21.742 -16.544 1182 1HB LYS 59 1HB LYS 149 -11.531 -20.629 -18.082 1183 2HB LYS 59 2HB LYS 149 -11.418 -22.109 -19.026 1184 1HG LYS 59 1HG LYS 149 -13.927 -21.956 -19.485 1185 2HG LYS 59 2HG LYS 149 -14.006 -20.470 -18.555 1186 1HD LYS 59 1HD LYS 149 -12.333 -20.881 -21.115 1187 2HD LYS 59 2HD LYS 149 -13.936 -20.183 -21.084 1188 1HE LYS 59 1HE LYS 149 -11.456 -18.930 -19.718 1189 2HE LYS 59 2HE LYS 149 -12.099 -18.474 -21.291 1190 1HZ LYS 59 1HZ LYS 149 -13.592 -18.247 -18.740 1191 2HZ LYS 59 2HZ LYS 149 -14.177 -17.833 -20.209 1192 H GLY 60 H GLY 150 -14.571 -23.329 -16.138 1193 1HA GLY 60 1HA GLY 150 -14.260 -26.083 -17.495 1194 2HA GLY 60 2HA GLY 150 -14.890 -25.882 -15.868 1195 NH1 ARG 61 NH2 ARG 151 -19.299 -25.470 -25.164 1196 NH2 ARG 61 NH1 ARG 151 -19.090 -27.719 -24.897 1197 H ARG 61 H ARG 151 -16.212 -27.088 -18.046 1198 HA ARG 61 HA ARG 151 -18.739 -25.395 -18.083 1199 1HB ARG 61 1HB ARG 151 -17.357 -24.994 -20.198 1200 2HB ARG 61 2HB ARG 151 -17.610 -26.681 -20.631 1201 1HG ARG 61 1HG ARG 151 -20.191 -26.159 -20.497 1202 2HG ARG 61 2HG ARG 151 -19.751 -24.490 -20.233 1203 1HD ARG 61 1HD ARG 151 -20.278 -24.652 -22.551 1204 2HD ARG 61 2HD ARG 151 -18.520 -24.484 -22.490 1205 1HH1 ARG 61 1HH2 ARG 151 -19.274 -25.665 -26.172 1206 2HH1 ARG 61 2HH2 ARG 151 -19.388 -24.551 -24.717 1207 1HH2 ARG 61 1HH1 ARG 151 -19.022 -28.513 -24.252 1208 2HH2 ARG 61 2HH1 ARG 151 -19.080 -27.757 -25.923 1209 H ASN 62 H ASN 152 -20.099 -26.534 -17.095 1210 HA ASN 62 HA ASN 152 -21.319 -28.194 -16.194 1211 1HB ASN 62 1HB ASN 152 -22.673 -29.548 -17.739 1212 2HB ASN 62 2HB ASN 152 -22.585 -27.830 -18.002 1213 1HD2 ASN 62 2HD2 ASN 152 -21.312 -30.282 -20.996 1214 2HD2 ASN 62 1HD2 ASN 152 -21.345 -30.878 -19.255 1215 HA PRO 63 HA PRO 153 -19.127 -32.118 -15.550 1216 1HB PRO 63 1HB PRO 153 -17.307 -31.701 -13.507 1217 2HB PRO 63 2HB PRO 153 -16.928 -31.344 -15.203 1218 1HG PRO 63 1HG PRO 153 -17.800 -29.368 -13.032 1219 2HG PRO 63 2HG PRO 153 -16.494 -29.185 -14.222 1220 1HD PRO 63 1HD PRO 153 -19.077 -28.103 -14.549 1221 2HD PRO 63 2HD PRO 153 -17.974 -28.518 -15.897 1222 H GLN 64 H GLN 154 -19.422 -30.166 -12.602 1223 HA GLN 64 HA GLN 154 -21.294 -32.138 -11.334 1224 1HB GLN 64 1HB GLN 154 -21.263 -30.261 -9.421 1225 2HB GLN 64 2HB GLN 154 -19.992 -31.435 -9.609 1226 1HG GLN 64 1HG GLN 154 -18.458 -29.805 -10.610 1227 2HG GLN 64 2HG GLN 154 -19.732 -28.610 -10.774 1228 1HE2 GLN 64 2HE2 GLN 154 -17.867 -28.935 -7.142 1229 2HE2 GLN 64 1HE2 GLN 154 -17.496 -30.068 -8.537 1230 H THR 65 H THR 155 -21.594 -28.741 -12.545 1231 HA THR 65 HA THR 155 -24.434 -28.691 -11.522 1232 HB THR 65 HB THR 155 -24.138 -26.272 -11.495 1233 HG1 THR 65 HG1 THR 155 -21.580 -26.757 -12.598 1234 1HG2 THR 65 3HG2 THR 155 -23.123 -27.642 -9.557 1235 2HG2 THR 65 1HG2 THR 155 -21.558 -27.505 -10.362 1236 3HG2 THR 65 2HG2 THR 155 -22.360 -26.031 -9.802 1237 H GLY 66 H GLY 156 -23.074 -28.925 -14.746 1238 1HA GLY 66 1HA GLY 156 -24.355 -28.644 -16.824 1239 2HA GLY 66 2HA GLY 156 -25.734 -28.181 -15.909 1240 H GLU 67 H GLU 157 -22.840 -26.233 -15.300 1241 HA GLU 67 HA GLU 157 -23.708 -24.060 -17.235 1242 1HB GLU 67 2HB GLU 157 -24.693 -24.080 -14.782 1243 2HB GLU 67 1HB GLU 157 -23.082 -23.728 -14.199 1244 1HG GLU 67 1HG GLU 157 -24.342 -21.668 -14.285 1245 2HG GLU 67 2HG GLU 157 -23.071 -21.551 -15.481 1246 HE2 GLU 67 HE2 GLU 157 -25.196 -21.182 -18.164 1247 H GLU 68 H GLU 158 -22.135 -22.482 -17.653 1248 HA GLU 68 HA GLU 158 -19.297 -23.410 -17.493 1249 1HB GLU 68 1HB GLU 158 -20.396 -22.332 -19.569 1250 2HB GLU 68 2HB GLU 158 -20.277 -20.783 -18.773 1251 1HG GLU 68 1HG GLU 158 -17.900 -22.670 -19.424 1252 2HG GLU 68 2HG GLU 158 -18.450 -21.371 -20.458 1253 HE2 GLU 68 HE2 GLU 158 -16.561 -22.237 -17.969 1254 H MET 69 H MET 159 -18.036 -22.919 -15.836 1255 HA MET 69 HA MET 159 -18.285 -20.268 -14.371 1256 1HB MET 69 1HB MET 159 -18.400 -21.203 -12.184 1257 2HB MET 69 2HB MET 159 -19.711 -21.886 -13.108 1258 1HG MET 69 1HG MET 159 -17.087 -23.369 -12.389 1259 2HG MET 69 2HG MET 159 -18.621 -23.526 -11.540 1260 1HE MET 69 1HE MET 159 -16.419 -24.811 -14.334 1261 2HE MET 69 3HE MET 159 -16.870 -26.041 -13.116 1262 3HE MET 69 2HE MET 159 -17.376 -26.231 -14.822 1263 H GLU 70 H GLU 160 -16.494 -19.459 -13.516 1264 HA GLU 70 HA GLU 160 -13.859 -20.589 -14.164 1265 1HB GLU 70 2HB GLU 160 -12.806 -18.689 -13.148 1266 2HB GLU 70 1HB GLU 160 -14.106 -18.165 -14.219 1267 1HG GLU 70 1HG GLU 160 -15.574 -17.694 -12.212 1268 2HG GLU 70 2HG GLU 160 -14.307 -18.260 -11.129 1269 HE1 GLU 70 HE2 GLU 160 -12.336 -15.441 -11.328 1270 H ILE 71 H ILE 161 -12.555 -21.865 -12.934 1271 HA ILE 71 HA ILE 161 -13.676 -23.018 -10.550 1272 HB ILE 71 HB ILE 161 -11.154 -24.002 -11.837 1273 1HG1 ILE 71 1HG1 ILE 161 -13.998 -24.365 -12.966 1274 2HG1 ILE 71 2HG1 ILE 161 -12.619 -23.675 -13.786 1275 1HG2 ILE 71 2HG2 ILE 161 -12.344 -24.943 -9.645 1276 2HG2 ILE 71 3HG2 ILE 161 -13.575 -25.535 -10.771 1277 3HG2 ILE 71 1HG2 ILE 161 -11.860 -26.072 -10.947 1278 1HD1 ILE 71 3HD1 ILE 161 -11.465 -26.009 -13.655 1279 2HD1 ILE 71 1HD1 ILE 161 -13.042 -26.635 -13.118 1280 3HD1 ILE 71 2HD1 ILE 161 -12.886 -25.868 -14.710 1281 HA PRO 72 HA PRO 162 -11.265 -21.555 -7.236 1282 1HB PRO 72 1HB PRO 162 -8.876 -22.622 -6.420 1283 2HB PRO 72 2HB PRO 162 -10.274 -23.650 -6.780 1284 1HG PRO 72 1HG PRO 162 -7.924 -22.983 -8.661 1285 2HG PRO 72 2HG PRO 162 -8.566 -24.592 -8.256 1286 1HD PRO 72 1HD PRO 162 -9.394 -23.144 -10.539 1287 2HD PRO 72 2HD PRO 162 -10.376 -24.345 -9.680 1288 H ALA 73 H ALA 163 -11.000 -19.584 -6.767 1289 HA ALA 73 HA ALA 163 -8.692 -17.910 -7.850 1290 1HB ALA 73 2HB ALA 163 -10.978 -16.850 -7.935 1291 2HB ALA 73 3HB ALA 163 -11.089 -16.967 -6.137 1292 3HB ALA 73 1HB ALA 163 -9.869 -15.946 -6.891 1293 H SER 74 H SER 164 -7.591 -16.501 -6.487 1294 HA SER 74 HA SER 164 -8.279 -16.407 -3.723 1295 1HB SER 74 1HB SER 164 -6.044 -16.850 -2.568 1296 2HB SER 74 2HB SER 164 -6.683 -18.299 -3.335 1297 HG SER 74 HG SER 164 -4.735 -16.544 -4.427 1298 H LYS 75 H LYS 165 -8.365 -14.362 -3.285 1299 HA LYS 75 HA LYS 165 -7.146 -12.349 -5.049 1300 1HB LYS 75 2HB LYS 165 -8.337 -11.358 -2.504 1301 2HB LYS 75 1HB LYS 165 -8.148 -10.644 -4.052 1302 1HG LYS 75 1HG LYS 165 -10.422 -10.989 -4.108 1303 2HG LYS 75 2HG LYS 165 -9.863 -12.406 -4.960 1304 1HD LYS 75 1HD LYS 165 -11.581 -13.137 -3.487 1305 2HD LYS 75 2HD LYS 165 -10.094 -13.752 -2.783 1306 1HE LYS 75 1HE LYS 165 -10.109 -11.784 -1.122 1307 2HE LYS 75 2HE LYS 165 -11.615 -11.210 -1.843 1308 1HZ LYS 75 1HZ LYS 165 -11.226 -13.858 -0.556 1309 2HZ LYS 75 2HZ LYS 165 -12.625 -13.343 -1.227 1310 H VAL 76 H VAL 166 -4.995 -11.436 -4.880 1311 HA VAL 76 HA VAL 166 -3.509 -11.905 -2.447 1312 HB VAL 76 HB VAL 166 -3.385 -12.139 -5.367 1313 1HG1 VAL 76 1HG2 VAL 166 -1.070 -10.644 -4.254 1314 2HG1 VAL 76 2HG2 VAL 166 -1.223 -11.467 -5.887 1315 3HG1 VAL 76 3HG2 VAL 166 -2.249 -10.088 -5.476 1316 1HG2 VAL 76 3HG1 VAL 166 -2.994 -13.968 -3.894 1317 2HG2 VAL 76 1HG1 VAL 166 -1.592 -13.654 -4.940 1318 3HG2 VAL 76 2HG1 VAL 166 -1.540 -13.151 -3.215 1319 HA PRO 77 HA PRO 167 -4.190 -7.353 -2.137 1320 1HB PRO 77 1HB PRO 167 -3.476 -7.020 0.525 1321 2HB PRO 77 2HB PRO 167 -4.930 -7.905 0.045 1322 1HG PRO 77 1HG PRO 167 -2.180 -9.073 0.761 1323 2HG PRO 77 2HG PRO 167 -3.723 -9.600 1.395 1324 1HD PRO 77 1HD PRO 167 -2.432 -10.832 -0.836 1325 2HD PRO 77 2HD PRO 167 -4.217 -10.860 -0.659 1326 H ALA 78 H ALA 168 -3.112 -5.912 -2.765 1327 HA ALA 78 HA ALA 168 -0.071 -5.663 -2.422 1328 1HB ALA 78 3HB ALA 168 -0.859 -6.782 -4.558 1329 2HB ALA 78 1HB ALA 168 -1.872 -5.371 -4.941 1330 3HB ALA 78 2HB ALA 168 -0.095 -5.208 -4.899 1331 H PHE 79 H PHE 169 0.673 -3.657 -3.074 1332 HA PHE 79 HA PHE 169 -1.089 -1.197 -2.645 1333 1HB PHE 79 2HB PHE 169 -0.300 -1.507 -0.499 1334 2HB PHE 79 1HB PHE 169 1.395 -1.436 -1.033 1335 HD1 PHE 79 HD1 PHE 169 -1.041 1.068 -2.525 1336 HD2 PHE 79 HD2 PHE 169 1.675 0.278 0.730 1337 HE1 PHE 79 HE1 PHE 169 -0.757 3.466 -2.165 1338 HE2 PHE 79 HE2 PHE 169 1.819 2.712 1.132 1339 HZ PHE 79 HZ PHE 169 0.812 4.277 -0.391 1340 H LYS 80 H LYS 170 -0.522 0.184 -4.156 1341 HA LYS 80 HA LYS 170 2.202 0.246 -5.723 1342 1HB LYS 80 2HB LYS 170 -0.534 0.514 -6.782 1343 2HB LYS 80 1HB LYS 170 0.316 2.040 -6.907 1344 1HG LYS 80 1HG LYS 170 2.239 0.812 -8.060 1345 2HG LYS 80 2HG LYS 170 1.321 -0.681 -7.928 1346 1HD LYS 80 1HD LYS 170 1.003 0.139 -10.170 1347 2HD LYS 80 2HD LYS 170 -0.525 0.290 -9.332 1348 1HE LYS 80 1HE LYS 170 -0.208 2.264 -10.720 1349 2HE LYS 80 2HE LYS 170 -0.141 2.787 -9.042 1350 1HZ LYS 80 1HZ LYS 170 1.589 3.776 -10.391 1351 2HZ LYS 80 2HZ LYS 170 2.192 2.318 -10.822 1352 HA PRO 81 HA PRO 171 2.266 3.923 -2.879 1353 1HB PRO 81 1HB PRO 171 4.764 3.561 -1.786 1354 2HB PRO 81 2HB PRO 171 3.480 2.491 -1.254 1355 1HG PRO 81 1HG PRO 171 5.652 1.915 -3.319 1356 2HG PRO 81 2HG PRO 171 5.132 0.893 -1.956 1357 1HD PRO 81 1HD PRO 171 4.141 0.742 -4.653 1358 2HD PRO 81 2HD PRO 171 3.332 0.044 -3.208 1359 H GLY 82 H GLY 172 2.800 3.729 -5.723 1360 1HA GLY 82 1HA GLY 172 5.849 3.689 -6.081 1361 2HA GLY 82 2HA GLY 172 4.771 3.051 -7.282 1362 H LYS 83 H LYS 173 3.442 4.694 -8.239 1363 HA LYS 83 HA LYS 173 5.344 6.161 -9.892 1364 1HB LYS 83 2HB LYS 173 2.297 6.139 -9.614 1365 2HB LYS 83 1HB LYS 173 2.869 7.612 -10.313 1366 1HG LYS 83 1HG LYS 173 4.092 6.302 -12.129 1367 2HG LYS 83 2HG LYS 173 3.545 4.790 -11.399 1368 1HD LYS 83 1HD LYS 173 1.132 5.482 -11.782 1369 2HD LYS 83 2HD LYS 173 1.686 6.988 -12.524 1370 1HE LYS 83 1HE LYS 173 2.887 5.656 -14.331 1371 2HE LYS 83 2HE LYS 173 2.337 4.148 -13.584 1372 1HZ LYS 83 1HZ LYS 173 0.046 4.885 -13.942 1373 2HZ LYS 83 2HZ LYS 173 0.554 6.276 -14.633 1374 H ALA 84 H ALA 174 3.600 7.514 -7.478 1375 HA ALA 84 HA ALA 174 4.569 10.384 -7.805 1376 1HB ALA 84 2HB ALA 174 2.217 9.774 -7.170 1377 2HB ALA 84 3HB ALA 174 2.846 8.868 -5.764 1378 3HB ALA 84 1HB ALA 174 3.065 10.642 -5.833 1379 H LEU 85 H LEU 175 4.873 7.690 -5.122 1380 HA LEU 85 HA LEU 175 6.932 9.102 -3.653 1381 1HB LEU 85 2HB LEU 175 5.340 7.201 -2.982 1382 2HB LEU 85 1HB LEU 175 6.314 6.183 -4.139 1383 HG LEU 85 HG LEU 175 8.276 6.690 -2.833 1384 1HD1 LEU 85 2HD1 LEU 175 6.195 7.793 -0.813 1385 2HD1 LEU 85 3HD1 LEU 175 7.875 7.393 -0.354 1386 3HD1 LEU 85 1HD1 LEU 175 7.541 8.706 -1.515 1387 1HD2 LEU 85 3HD2 LEU 175 6.727 4.568 -2.642 1388 2HD2 LEU 85 1HD2 LEU 175 7.596 4.885 -1.127 1389 3HD2 LEU 85 2HD2 LEU 175 5.890 5.346 -1.304 1390 H LYS 86 H LYS 176 7.012 7.004 -6.607 1391 HA LYS 86 HA LYS 176 9.837 6.535 -6.744 1392 1HB LYS 86 1HB LYS 176 8.010 5.480 -8.183 1393 2HB LYS 86 2HB LYS 176 7.958 6.961 -9.117 1394 1HG LYS 86 1HG LYS 176 9.274 5.362 -10.304 1395 2HG LYS 86 2HG LYS 176 10.374 6.627 -9.767 1396 1HD LYS 86 1HD LYS 176 11.141 5.132 -7.856 1397 2HD LYS 86 2HD LYS 176 10.034 3.872 -8.373 1398 1HE LYS 86 1HE LYS 176 12.382 4.982 -10.072 1399 2HE LYS 86 2HE LYS 176 12.475 3.557 -9.040 1400 1HZ LYS 86 1HZ LYS 176 10.628 3.832 -11.341 1401 2HZ LYS 86 2HZ LYS 176 10.741 2.519 -10.374 1402 H ASP 87 H ASP 177 8.031 9.547 -7.348 1403 HA ASP 87 HA ASP 177 10.435 10.986 -8.372 1404 1HB ASP 87 1HB ASP 177 7.586 11.302 -8.570 1405 2HB ASP 87 2HB ASP 177 7.982 12.474 -7.381 1406 HD1 ASP 87 HD2 ASP 177 9.130 12.774 -11.285 1407 H ALA 88 H ALA 178 8.627 10.791 -5.260 1408 HA ALA 88 HA ALA 178 10.257 12.680 -3.705 1409 1HB ALA 88 3HB ALA 178 8.184 11.503 -2.724 1410 2HB ALA 88 1HB ALA 178 9.099 9.980 -2.676 1411 3HB ALA 88 2HB ALA 178 9.607 11.324 -1.669 1412 H VAL 89 H VAL 179 10.888 9.234 -4.555 1413 HA VAL 89 HA VAL 179 13.114 8.958 -2.647 1414 HB VAL 89 HB VAL 179 10.744 7.663 -3.080 1415 1HG1 VAL 89 2HG2 VAL 179 11.405 7.291 -5.572 1416 2HG1 VAL 89 3HG2 VAL 179 12.414 5.963 -4.972 1417 3HG1 VAL 89 1HG2 VAL 179 10.647 5.993 -4.640 1418 1HG2 VAL 89 3HG1 VAL 179 13.284 6.265 -2.466 1419 2HG2 VAL 89 1HG1 VAL 179 12.080 7.111 -1.408 1420 3HG2 VAL 89 2HG1 VAL 179 11.580 5.644 -2.280 1421 H LYS 90 H LYS 180 12.882 9.654 -6.010 1422 HA LYS 90 HA LYS 180 14.935 8.018 -7.116 1423 1HB LYS 90 1HB LYS 180 14.750 9.342 -9.052 1424 2HB LYS 90 2HB LYS 180 13.176 9.229 -8.328 1425 1HG LYS 90 1HG LYS 180 13.448 11.587 -7.392 1426 2HG LYS 90 2HG LYS 180 14.986 11.722 -8.235 1427 1HD LYS 90 1HD LYS 180 13.864 11.431 -10.454 1428 2HD LYS 90 2HD LYS 180 12.335 11.080 -9.672 1429 1HE LYS 90 1HE LYS 180 12.174 13.341 -10.447 1430 2HE LYS 90 2HE LYS 180 12.267 13.425 -8.691 1431 1HZ LYS 90 1HZ LYS 180 14.615 13.990 -8.896 1432 2HZ LYS 90 2HZ LYS 180 13.677 15.057 -9.704 Start of MODEL 5 Raw file had 1432 H/Q atoms Start of MODEL 5 1 1H MET 1 1H MET 1 -10.644 6.439 -0.869 2 2H MET 1 2H MET 1 -11.551 5.905 0.381 3 HA MET 1 HA MET 1 -11.036 7.836 1.684 4 1HB MET 1 1HB MET 1 -8.689 6.164 0.803 5 2HB MET 1 2HB MET 1 -8.514 7.435 1.988 6 1HG MET 1 1HG MET 1 -8.812 5.337 3.126 7 2HG MET 1 2HG MET 1 -10.219 6.360 3.469 8 1HE MET 1 3HE MET 1 -10.949 3.927 4.318 9 2HE MET 1 2HE MET 1 -11.427 2.560 3.250 10 3HE MET 1 1HE MET 1 -9.700 2.957 3.501 11 H ASN 2 H ASN 2 -9.783 8.217 -1.387 12 HA ASN 2 HA ASN 2 -8.042 9.665 -2.088 13 1HB ASN 2 1HB ASN 2 -9.135 11.622 -3.220 14 2HB ASN 2 2HB ASN 2 -9.715 10.003 -3.462 15 1HD2 ASN 2 1HD2 ASN 2 -12.120 12.443 -1.134 16 2HD2 ASN 2 2HD2 ASN 2 -10.371 12.848 -1.439 17 H LYS 3 H LYS 3 -7.988 9.870 0.266 18 HA LYS 3 HA LYS 3 -6.558 10.630 2.046 19 1HB LYS 3 1HB LYS 3 -5.062 11.515 -0.019 20 2HB LYS 3 2HB LYS 3 -5.681 13.087 0.382 21 1HG LYS 3 1HG LYS 3 -4.591 12.941 2.658 22 2HG LYS 3 2HG LYS 3 -4.266 11.228 2.411 23 1HD LYS 3 1HD LYS 3 -2.184 12.297 2.123 24 2HD LYS 3 2HD LYS 3 -2.684 11.767 0.521 25 1HE LYS 3 1HE LYS 3 -3.451 14.166 0.008 26 2HE LYS 3 2HE LYS 3 -2.920 14.661 1.623 27 1HZ LYS 3 1HZ LYS 3 -0.676 13.935 1.030 28 2HZ LYS 3 2HZ LYS 3 -1.166 13.471 -0.458 29 H THR 4 H THR 4 -9.275 12.334 0.891 30 HA THR 4 HA THR 4 -9.567 13.803 3.376 31 HB THR 4 HB THR 4 -10.731 13.840 0.515 32 HG1 THR 4 HG1 THR 4 -8.603 14.659 0.793 33 1HG2 THR 4 2HG2 THR 4 -11.251 15.597 2.926 34 2HG2 THR 4 3HG2 THR 4 -11.727 15.984 1.206 35 3HG2 THR 4 1HG2 THR 4 -12.413 14.538 2.043 36 H GLU 5 H GLU 5 -11.153 11.178 1.435 37 HA GLU 5 HA GLU 5 -13.377 10.952 3.440 38 1HB GLU 5 1HB GLU 5 -12.802 8.735 1.461 39 2HB GLU 5 2HB GLU 5 -14.246 9.078 2.337 40 1HG GLU 5 1HG GLU 5 -13.084 10.652 -0.047 41 2HG GLU 5 2HG GLU 5 -14.380 9.489 -0.119 42 HE2 GLU 5 HE2 GLU 5 -15.066 13.303 0.914 43 H LEU 6 H LEU 6 -10.059 10.296 3.193 44 HA LEU 6 HA LEU 6 -9.705 8.097 5.131 45 1HB LEU 6 2HB LEU 6 -8.000 9.464 3.372 46 2HB LEU 6 1HB LEU 6 -7.569 10.292 4.837 47 HG LEU 6 HG LEU 6 -7.451 7.330 4.264 48 1HD1 LEU 6 1HD1 LEU 6 -5.204 9.347 4.573 49 2HD1 LEU 6 2HD1 LEU 6 -4.985 7.588 4.412 50 3HD1 LEU 6 3HD1 LEU 6 -5.712 8.521 3.091 51 1HD2 LEU 6 1HD2 LEU 6 -7.112 8.750 6.932 52 2HD2 LEU 6 2HD2 LEU 6 -7.909 7.212 6.574 53 3HD2 LEU 6 3HD2 LEU 6 -6.143 7.321 6.600 54 H ILE 7 H ILE 7 -9.585 11.678 5.261 55 HA ILE 7 HA ILE 7 -9.043 12.089 8.049 56 HB ILE 7 HB ILE 7 -10.742 13.908 6.236 57 1HG1 ILE 7 1HG1 ILE 7 -7.709 14.051 6.685 58 2HG1 ILE 7 2HG1 ILE 7 -8.395 13.252 5.320 59 1HG2 ILE 7 2HG2 ILE 7 -10.872 14.589 8.675 60 2HG2 ILE 7 3HG2 ILE 7 -9.108 14.703 8.709 61 3HG2 ILE 7 1HG2 ILE 7 -10.048 15.804 7.692 62 1HD1 ILE 7 3HD1 ILE 7 -9.606 15.418 4.655 63 2HD1 ILE 7 1HD1 ILE 7 -8.534 16.236 5.785 64 3HD1 ILE 7 2HD1 ILE 7 -7.841 15.305 4.428 65 H ASN 8 H ASN 8 -12.163 11.857 6.371 66 HA ASN 8 HA ASN 8 -13.738 11.968 8.892 67 1HB ASN 8 1HB ASN 8 -14.656 10.743 6.175 68 2HB ASN 8 2HB ASN 8 -15.719 11.098 7.515 69 1HD2 ASN 8 2HD2 ASN 8 -14.878 14.131 4.948 70 2HD2 ASN 8 1HD2 ASN 8 -14.170 12.449 4.759 71 H ALA 9 H ALA 9 -12.043 9.294 7.555 72 HA ALA 9 HA ALA 9 -13.505 7.144 9.078 73 1HB ALA 9 2HB ALA 9 -11.809 6.602 7.072 74 2HB ALA 9 3HB ALA 9 -10.505 7.156 8.127 75 3HB ALA 9 1HB ALA 9 -11.408 5.749 8.611 76 H VAL 10 H VAL 10 -10.585 9.168 9.538 77 HA VAL 10 HA VAL 10 -9.735 7.830 11.905 78 HB VAL 10 HB VAL 10 -8.655 10.543 11.299 79 1HG1 VAL 10 3HG2 VAL 10 -7.912 8.672 13.095 80 2HG1 VAL 10 1HG2 VAL 10 -6.970 8.102 11.695 81 3HG1 VAL 10 2HG2 VAL 10 -6.753 9.769 12.268 82 1HG2 VAL 10 1HG1 VAL 10 -8.387 8.117 9.487 83 2HG2 VAL 10 2HG1 VAL 10 -8.817 9.819 9.144 84 3HG2 VAL 10 3HG1 VAL 10 -7.118 9.416 9.544 85 H ALA 11 H ALA 11 -11.064 10.832 11.270 86 HA ALA 11 HA ALA 11 -11.420 11.380 14.027 87 1HB ALA 11 2HB ALA 11 -11.334 13.242 12.326 88 2HB ALA 11 3HB ALA 11 -12.893 12.710 11.643 89 3HB ALA 11 1HB ALA 11 -12.822 13.423 13.288 90 H GLU 12 H GLU 12 -13.448 9.489 11.960 91 HA GLU 12 HA GLU 12 -15.743 9.486 13.896 92 1HB GLU 12 1HB GLU 12 -16.140 9.169 11.431 93 2HB GLU 12 2HB GLU 12 -15.210 7.671 11.460 94 1HG GLU 12 1HG GLU 12 -16.941 6.682 13.064 95 2HG GLU 12 2HG GLU 12 -17.845 8.193 13.005 96 HE1 GLU 12 HE2 GLU 12 -19.208 7.653 9.870 97 H THR 13 H THR 13 -13.134 7.139 12.969 98 HA THR 13 HA THR 13 -13.834 5.357 15.178 99 HB THR 13 HB THR 13 -11.659 4.124 14.679 100 HG1 THR 13 HG1 THR 13 -10.334 5.050 13.124 101 1HG2 THR 13 2HG2 THR 13 -12.975 4.879 12.010 102 2HG2 THR 13 3HG2 THR 13 -11.797 3.584 12.291 103 3HG2 THR 13 1HG2 THR 13 -13.407 3.496 13.053 104 H SER 14 H SER 14 -12.204 8.010 15.442 105 HA SER 14 HA SER 14 -10.853 7.188 18.110 106 1HB SER 14 1HB SER 14 -9.141 7.371 16.238 107 2HB SER 14 2HB SER 14 -9.505 9.092 16.102 108 HG SER 14 HG SER 14 -8.932 9.289 18.311 109 H GLY 15 H GLY 15 -12.641 9.814 16.505 110 1HA GLY 15 1HA GLY 15 -13.484 11.853 17.366 111 2HA GLY 15 2HA GLY 15 -13.352 11.155 18.979 112 H LEU 16 H LEU 16 -11.054 12.145 16.516 113 HA LEU 16 HA LEU 16 -9.555 14.056 18.318 114 1HB LEU 16 1HB LEU 16 -7.727 13.933 16.775 115 2HB LEU 16 2HB LEU 16 -8.068 12.492 17.706 116 HG LEU 16 HG LEU 16 -9.023 11.368 15.957 117 1HD1 LEU 16 2HD1 LEU 16 -10.281 13.235 14.808 118 2HD1 LEU 16 3HD1 LEU 16 -8.697 13.743 14.137 119 3HD1 LEU 16 1HD1 LEU 16 -9.450 12.143 13.700 120 1HD2 LEU 16 3HD2 LEU 16 -6.961 10.719 15.879 121 2HD2 LEU 16 1HD2 LEU 16 -7.890 10.584 14.366 122 3HD2 LEU 16 2HD2 LEU 16 -6.681 11.843 14.504 123 H SER 17 H SER 17 -9.144 15.012 15.548 124 HA SER 17 HA SER 17 -11.528 16.899 15.201 125 1HB SER 17 1HB SER 17 -8.697 18.018 14.991 126 2HB SER 17 2HB SER 17 -10.204 18.862 14.728 127 HG SER 17 HG SER 17 -9.362 19.214 16.800 128 H LYS 18 H LYS 18 -11.677 17.796 13.063 129 HA LYS 18 HA LYS 18 -10.942 15.891 10.843 130 1HB LYS 18 1HB LYS 18 -12.230 18.672 10.603 131 2HB LYS 18 2HB LYS 18 -11.918 17.593 9.259 132 1HG LYS 18 1HG LYS 18 -13.820 16.991 11.604 133 2HG LYS 18 2HG LYS 18 -14.300 17.571 10.019 134 1HD LYS 18 1HD LYS 18 -13.451 15.479 8.934 135 2HD LYS 18 2HD LYS 18 -12.889 14.853 10.471 136 1HE LYS 18 1HE LYS 18 -15.847 15.453 9.796 137 2HE LYS 18 2HE LYS 18 -15.077 13.870 9.707 138 1HZ LYS 18 1HZ LYS 18 -16.259 14.099 11.745 139 2HZ LYS 18 2HZ LYS 18 -14.664 13.934 12.062 140 H LYS 19 H LYS 19 -9.865 19.091 11.892 141 HA LYS 19 HA LYS 19 -7.533 19.285 10.077 142 1HB LYS 19 2HB LYS 19 -7.839 20.566 12.844 143 2HB LYS 19 1HB LYS 19 -6.599 20.984 11.665 144 1HG LYS 19 1HG LYS 19 -9.630 21.496 11.393 145 2HG LYS 19 2HG LYS 19 -8.389 22.645 11.812 146 1HD LYS 19 1HD LYS 19 -8.655 23.221 9.609 147 2HD LYS 19 2HD LYS 19 -7.296 22.136 9.471 148 1HE LYS 19 1HE LYS 19 -8.821 21.682 7.641 149 2HE LYS 19 2HE LYS 19 -8.896 20.277 8.688 150 1HZ LYS 19 1HZ LYS 19 -10.941 21.209 9.657 151 2HZ LYS 19 2HZ LYS 19 -10.862 22.501 8.659 152 H ASP 20 H ASP 20 -7.908 17.671 13.322 153 HA ASP 20 HA ASP 20 -4.975 16.970 13.395 154 1HB ASP 20 1HB ASP 20 -7.344 16.120 15.154 155 2HB ASP 20 2HB ASP 20 -5.863 15.206 15.212 156 HD2 ASP 20 HD2 ASP 20 -6.079 18.723 17.050 157 H ALA 21 H ALA 21 -7.844 15.423 12.085 158 HA ALA 21 HA ALA 21 -6.531 12.800 11.560 159 1HB ALA 21 2HB ALA 21 -9.261 13.976 10.776 160 2HB ALA 21 3HB ALA 21 -8.661 12.409 10.158 161 3HB ALA 21 1HB ALA 21 -8.861 12.668 11.861 162 H THR 22 H THR 22 -7.121 15.763 9.561 163 HA THR 22 HA THR 22 -5.895 14.865 7.115 164 HB THR 22 HB THR 22 -5.646 17.740 8.221 165 HG1 THR 22 HG1 THR 22 -7.683 18.118 7.409 166 1HG2 THR 22 3HG2 THR 22 -6.195 16.546 5.435 167 2HG2 THR 22 1HG2 THR 22 -6.188 18.291 5.811 168 3HG2 THR 22 2HG2 THR 22 -4.680 17.319 5.965 169 H LYS 23 H LYS 23 -4.432 16.497 9.837 170 HA LYS 23 HA LYS 23 -1.618 16.424 9.010 171 1HB LYS 23 2HB LYS 23 -3.041 16.276 11.791 172 2HB LYS 23 1HB LYS 23 -1.317 16.390 11.698 173 1HG LYS 23 1HG LYS 23 -1.419 18.648 10.594 174 2HG LYS 23 2HG LYS 23 -3.180 18.571 10.553 175 1HD LYS 23 1HD LYS 23 -3.202 18.394 13.107 176 2HD LYS 23 2HD LYS 23 -1.447 18.572 13.110 177 1HE LYS 23 1HE LYS 23 -1.683 20.857 12.012 178 2HE LYS 23 2HE LYS 23 -3.444 20.665 11.998 179 1HZ LYS 23 1HZ LYS 23 -2.750 21.928 13.889 180 2HZ LYS 23 2HZ LYS 23 -3.411 20.523 14.403 181 H ALA 24 H ALA 24 -3.343 14.305 11.183 182 HA ALA 24 HA ALA 24 -1.329 12.393 11.764 183 1HB ALA 24 3HB ALA 24 -4.358 12.092 11.710 184 2HB ALA 24 1HB ALA 24 -3.228 10.956 12.518 185 3HB ALA 24 2HB ALA 24 -3.323 12.651 13.066 186 H VAL 25 H VAL 25 -3.586 12.290 9.061 187 HA VAL 25 HA VAL 25 -2.622 9.772 7.778 188 HB VAL 25 HB VAL 25 -4.118 12.464 7.089 189 1HG1 VAL 25 1HG2 VAL 25 -3.225 10.507 4.892 190 2HG1 VAL 25 2HG2 VAL 25 -4.465 11.796 4.716 191 3HG1 VAL 25 3HG2 VAL 25 -2.786 12.211 5.043 192 1HG2 VAL 25 2HG1 VAL 25 -4.962 9.544 6.875 193 2HG2 VAL 25 3HG1 VAL 25 -5.400 10.680 8.166 194 3HG2 VAL 25 1HG1 VAL 25 -5.990 10.984 6.524 195 H ASP 26 H ASP 26 -1.773 13.224 7.082 196 HA ASP 26 HA ASP 26 0.868 12.354 5.851 197 1HB ASP 26 1HB ASP 26 -0.237 15.140 6.569 198 2HB ASP 26 2HB ASP 26 1.297 14.872 5.747 199 HD2 ASP 26 HD2 ASP 26 -2.128 14.820 3.691 200 H ALA 27 H ALA 27 0.267 11.874 8.539 201 HA ALA 27 HA ALA 27 2.919 12.463 9.904 202 1HB ALA 27 3HB ALA 27 0.577 13.071 11.017 203 2HB ALA 27 1HB ALA 27 0.615 11.358 11.439 204 3HB ALA 27 2HB ALA 27 1.895 12.477 11.940 205 H VAL 28 H VAL 28 0.626 9.843 9.387 206 HA VAL 28 HA VAL 28 2.443 7.540 9.860 207 HB VAL 28 HB VAL 28 -0.155 7.720 8.130 208 1HG1 VAL 28 2HG2 VAL 28 1.136 5.197 9.339 209 2HG1 VAL 28 3HG2 VAL 28 -0.421 5.295 8.470 210 3HG1 VAL 28 1HG2 VAL 28 1.075 5.628 7.597 211 1HG2 VAL 28 3HG1 VAL 28 0.194 6.793 10.976 212 2HG2 VAL 28 1HG1 VAL 28 -0.609 8.295 10.427 213 3HG2 VAL 28 2HG1 VAL 28 -1.333 6.732 9.971 214 H PHE 29 H PHE 29 0.990 8.888 7.062 215 HA PHE 29 HA PHE 29 2.779 7.646 5.017 216 1HB PHE 29 2HB PHE 29 0.804 9.895 4.453 217 2HB PHE 29 1HB PHE 29 1.511 8.820 3.260 218 HD1 PHE 29 HD2 PHE 29 1.275 6.105 4.033 219 HD2 PHE 29 HD1 PHE 29 -1.423 9.300 5.005 220 HE1 PHE 29 HE2 PHE 29 -0.366 4.476 4.836 221 HE2 PHE 29 HE1 PHE 29 -3.024 7.667 5.898 222 HZ PHE 29 HZ PHE 29 -2.450 5.269 5.880 223 H ASP 30 H ASP 30 3.172 10.650 6.750 224 HA ASP 30 HA ASP 30 5.317 11.671 4.976 225 1HB ASP 30 1HB ASP 30 4.032 12.989 6.743 226 2HB ASP 30 2HB ASP 30 4.961 12.204 7.997 227 HD1 ASP 30 HD2 ASP 30 6.792 14.864 5.501 228 H SER 31 H SER 31 5.221 9.763 7.916 229 HA SER 31 HA SER 31 8.154 9.208 8.082 230 1HB SER 31 1HB SER 31 5.961 7.602 9.423 231 2HB SER 31 2HB SER 31 7.674 7.486 9.771 232 HG SER 31 HG SER 31 6.662 8.892 11.215 233 H ILE 32 H ILE 32 5.545 7.474 6.314 234 HA ILE 32 HA ILE 32 7.161 5.089 5.652 235 HB ILE 32 HB ILE 32 4.847 6.438 4.128 236 1HG1 ILE 32 1HG1 ILE 32 3.528 4.526 4.138 237 2HG1 ILE 32 2HG1 ILE 32 4.634 3.605 5.159 238 1HG2 ILE 32 1HG2 ILE 32 6.769 4.089 3.642 239 2HG2 ILE 32 2HG2 ILE 32 5.215 3.964 2.816 240 3HG2 ILE 32 3HG2 ILE 32 6.318 5.330 2.496 241 1HD1 ILE 32 3HD1 ILE 32 2.603 5.764 5.962 242 2HD1 ILE 32 1HD1 ILE 32 2.506 4.057 6.255 243 3HD1 ILE 32 2HD1 ILE 32 3.712 5.002 7.146 244 H THR 33 H THR 33 6.396 8.331 4.152 245 HA THR 33 HA THR 33 8.386 7.924 2.030 246 HB THR 33 HB THR 33 8.266 10.181 1.333 247 HG1 THR 33 HG1 THR 33 6.928 11.664 2.425 248 1HG2 THR 33 1HG2 THR 33 6.374 8.439 1.009 249 2HG2 THR 33 2HG2 THR 33 5.402 9.413 2.084 250 3HG2 THR 33 3HG2 THR 33 5.991 10.127 0.557 251 H GLU 34 H GLU 34 8.975 8.628 5.219 252 HA GLU 34 HA GLU 34 11.809 9.528 4.586 253 1HB GLU 34 1HB GLU 34 10.313 9.441 7.323 254 2HB GLU 34 2HB GLU 34 12.052 9.409 7.257 255 1HG GLU 34 1HG GLU 34 11.665 11.659 7.624 256 2HG GLU 34 2HG GLU 34 12.030 11.615 5.912 257 HE1 GLU 34 HE2 GLU 34 8.356 12.593 7.339 258 H ALA 35 H ALA 35 9.900 6.673 5.463 259 HA ALA 35 HA ALA 35 12.384 5.082 5.731 260 1HB ALA 35 2HB ALA 35 10.045 4.177 6.633 261 2HB ALA 35 3HB ALA 35 9.530 4.124 4.940 262 3HB ALA 35 1HB ALA 35 10.782 3.044 5.479 263 H LEU 36 H LEU 36 9.946 5.137 2.989 264 HA LEU 36 HA LEU 36 11.731 3.675 1.229 265 1HB LEU 36 2HB LEU 36 9.426 5.480 0.643 266 2HB LEU 36 1HB LEU 36 10.108 4.353 -0.484 267 HG LEU 36 HG LEU 36 8.733 3.956 1.631 268 1HD1 LEU 36 1HD2 LEU 36 10.771 1.846 1.775 269 2HD1 LEU 36 2HD2 LEU 36 9.793 2.604 3.057 270 3HD1 LEU 36 3HD2 LEU 36 9.161 1.242 2.174 271 1HD2 LEU 36 2HD1 LEU 36 7.012 3.658 0.681 272 2HD2 LEU 36 3HD1 LEU 36 7.465 1.927 0.606 273 3HD2 LEU 36 1HD1 LEU 36 7.322 2.675 2.184 274 NH1 ARG 37 NH2 ARG 37 10.366 13.839 -1.470 275 NH2 ARG 37 NH1 ARG 37 12.143 14.585 -2.671 276 H ARG 37 H ARG 37 11.213 7.283 1.614 277 HA ARG 37 HA ARG 37 12.783 7.698 -0.765 278 1HB ARG 37 1HB ARG 37 11.123 9.374 0.218 279 2HB ARG 37 2HB ARG 37 12.371 9.786 1.421 280 1HG ARG 37 1HG ARG 37 13.891 10.547 -0.452 281 2HG ARG 37 2HG ARG 37 12.607 10.144 -1.602 282 1HD ARG 37 1HD ARG 37 11.031 11.643 -0.183 283 2HD ARG 37 2HD ARG 37 12.440 12.110 0.774 284 1HH1 ARG 37 1HH2 ARG 37 9.831 14.567 -1.956 285 2HH1 ARG 37 2HH2 ARG 37 10.008 13.174 -0.775 286 1HH2 ARG 37 1HH1 ARG 37 13.141 14.495 -2.893 287 2HH2 ARG 37 2HH1 ARG 37 11.484 15.262 -3.071 288 H LYS 38 H LYS 38 13.675 6.982 2.656 289 HA LYS 38 HA LYS 38 16.375 8.311 2.242 290 1HB LYS 38 1HB LYS 38 14.876 8.847 4.313 291 2HB LYS 38 2HB LYS 38 15.331 7.249 4.900 292 1HG LYS 38 1HG LYS 38 17.791 8.015 4.845 293 2HG LYS 38 2HG LYS 38 17.249 9.567 4.229 294 1HD LYS 38 1HD LYS 38 17.629 9.857 6.567 295 2HD LYS 38 2HD LYS 38 15.886 9.929 6.341 296 1HE LYS 38 1HE LYS 38 15.700 7.503 7.153 297 2HE LYS 38 2HE LYS 38 17.457 7.447 7.353 298 1HZ LYS 38 1HZ LYS 38 16.374 7.938 9.414 299 2HZ LYS 38 2HZ LYS 38 17.287 9.220 8.975 300 H GLY 39 H GLY 39 15.255 5.389 1.409 301 1HA GLY 39 1HA GLY 39 16.243 3.208 1.135 302 2HA GLY 39 2HA GLY 39 17.751 3.816 1.797 303 H ASP 40 H ASP 40 14.531 3.699 3.209 304 HA ASP 40 HA ASP 40 15.292 1.683 5.374 305 1HB ASP 40 1HB ASP 40 14.362 4.554 5.706 306 2HB ASP 40 2HB ASP 40 13.962 3.371 6.940 307 HD1 ASP 40 HD2 ASP 40 17.187 3.082 8.161 308 H LYS 41 H LYS 41 13.774 0.781 6.608 309 HA LYS 41 HA LYS 41 11.322 -0.044 4.984 310 1HB LYS 41 2HB LYS 41 12.462 -1.480 7.449 311 2HB LYS 41 1HB LYS 41 11.187 -2.056 6.371 312 1HG LYS 41 1HG LYS 41 12.974 -2.096 4.480 313 2HG LYS 41 2HG LYS 41 14.179 -1.763 5.720 314 1HD LYS 41 1HD LYS 41 13.405 -3.851 6.989 315 2HD LYS 41 2HD LYS 41 12.260 -4.185 5.684 316 1HE LYS 41 1HE LYS 41 14.222 -4.316 4.040 317 2HE LYS 41 2HE LYS 41 15.340 -4.049 5.386 318 1HZ LYS 41 1HZ LYS 41 14.528 -6.068 6.415 319 2HZ LYS 41 2HZ LYS 41 15.102 -6.374 4.916 320 H VAL 42 H VAL 42 9.217 0.282 5.828 321 HA VAL 42 HA VAL 42 8.689 1.733 8.218 322 HB VAL 42 HB VAL 42 6.955 0.248 6.168 323 1HG1 VAL 42 3HG2 VAL 42 5.784 1.462 8.106 324 2HG1 VAL 42 1HG2 VAL 42 6.500 2.974 7.463 325 3HG1 VAL 42 2HG2 VAL 42 5.382 2.015 6.455 326 1HG2 VAL 42 2HG1 VAL 42 8.576 1.803 4.880 327 2HG2 VAL 42 3HG1 VAL 42 6.902 2.384 4.821 328 3HG2 VAL 42 1HG1 VAL 42 8.045 3.127 5.956 329 H GLN 43 H GLN 43 6.370 0.015 8.496 330 HA GLN 43 HA GLN 43 6.052 -2.187 8.923 331 1HB GLN 43 1HB GLN 43 8.138 -2.449 10.973 332 2HB GLN 43 2HB GLN 43 6.718 -3.509 11.038 333 1HG GLN 43 1HG GLN 43 6.991 -4.291 8.806 334 2HG GLN 43 2HG GLN 43 8.263 -3.174 8.427 335 1HE2 GLN 43 2HE2 GLN 43 10.803 -5.383 9.729 336 2HE2 GLN 43 1HE2 GLN 43 10.366 -3.874 8.783 337 H LEU 44 H LEU 44 4.445 -3.221 9.748 338 HA LEU 44 HA LEU 44 2.647 -1.747 11.712 339 1HB LEU 44 2HB LEU 44 1.898 -2.519 8.825 340 2HB LEU 44 1HB LEU 44 0.681 -2.149 10.038 341 HG LEU 44 HG LEU 44 2.845 -0.131 9.210 342 1HD1 LEU 44 1HD1 LEU 44 1.555 -0.785 7.176 343 2HD1 LEU 44 2HD1 LEU 44 0.021 -0.422 8.005 344 3HD1 LEU 44 3HD1 LEU 44 1.188 0.880 7.660 345 1HD2 LEU 44 2HD2 LEU 44 1.675 0.375 11.392 346 2HD2 LEU 44 3HD2 LEU 44 1.230 1.557 10.147 347 3HD2 LEU 44 1HD2 LEU 44 0.094 0.259 10.588 348 H ILE 45 H ILE 45 2.209 -3.390 13.168 349 HA ILE 45 HA ILE 45 2.419 -6.231 12.355 350 HB ILE 45 HB ILE 45 3.272 -5.424 14.532 351 1HG1 ILE 45 1HG1 ILE 45 1.316 -7.780 14.806 352 2HG1 ILE 45 2HG1 ILE 45 2.823 -7.866 13.912 353 1HG2 ILE 45 1HG2 ILE 45 1.346 -3.997 15.223 354 2HG2 ILE 45 2HG2 ILE 45 0.327 -5.444 15.431 355 3HG2 ILE 45 3HG2 ILE 45 1.754 -5.189 16.480 356 1HD1 ILE 45 2HD1 ILE 45 4.144 -7.322 15.997 357 2HD1 ILE 45 3HD1 ILE 45 2.628 -7.304 16.937 358 3HD1 ILE 45 1HD1 ILE 45 3.170 -8.803 16.152 359 H GLY 46 H GLY 46 0.797 -7.701 12.363 360 1HA GLY 46 1HA GLY 46 -1.279 -8.556 11.527 361 2HA GLY 46 2HA GLY 46 -2.045 -7.275 12.427 362 H PHE 47 H PHE 47 -0.136 -5.821 9.992 363 HA PHE 47 HA PHE 47 -2.222 -5.950 7.828 364 1HB PHE 47 2HB PHE 47 -2.494 -4.117 9.695 365 2HB PHE 47 1HB PHE 47 -1.074 -3.339 9.052 366 HD1 PHE 47 HD2 PHE 47 -4.629 -4.264 8.302 367 HD2 PHE 47 HD1 PHE 47 -1.145 -2.243 6.773 368 HE1 PHE 47 HE2 PHE 47 -5.912 -3.446 6.361 369 HE2 PHE 47 HE1 PHE 47 -2.447 -1.508 4.821 370 HZ PHE 47 HZ PHE 47 -4.804 -2.235 4.568 371 H GLY 48 H GLY 48 1.204 -4.925 8.565 372 1HA GLY 48 1HA GLY 48 1.910 -5.318 5.780 373 2HA GLY 48 2HA GLY 48 1.694 -3.601 6.042 374 H ASN 49 H ASN 49 3.809 -4.628 4.950 375 HA ASN 49 HA ASN 49 5.994 -3.498 6.706 376 1HB ASN 49 1HB ASN 49 6.181 -5.910 7.204 377 2HB ASN 49 2HB ASN 49 6.181 -6.337 5.509 378 1HD2 ASN 49 1HD2 ASN 49 9.713 -6.626 6.327 379 2HD2 ASN 49 2HD2 ASN 49 8.100 -7.494 6.436 380 H PHE 50 H PHE 50 6.195 -1.773 5.376 381 HA PHE 50 HA PHE 50 6.320 -2.095 2.365 382 1HB PHE 50 2HB PHE 50 6.812 0.402 4.019 383 2HB PHE 50 1HB PHE 50 6.885 0.435 2.331 384 HD1 PHE 50 HD2 PHE 50 4.751 -0.034 5.259 385 HD2 PHE 50 HD1 PHE 50 5.058 1.400 1.249 386 HE1 PHE 50 HE2 PHE 50 2.573 1.140 5.517 387 HE2 PHE 50 HE1 PHE 50 2.882 2.573 1.515 388 HZ PHE 50 HZ PHE 50 1.681 2.385 3.665 389 H GLU 51 H GLU 51 8.112 -1.658 1.184 390 HA GLU 51 HA GLU 51 10.417 -0.434 2.225 391 1HB GLU 51 1HB GLU 51 12.203 -2.279 2.210 392 2HB GLU 51 2HB GLU 51 10.973 -2.609 3.404 393 1HG GLU 51 1HG GLU 51 9.852 -4.244 1.773 394 2HG GLU 51 2HG GLU 51 11.162 -3.964 0.632 395 HE2 GLU 51 HE2 GLU 51 13.454 -5.950 2.263 396 H VAL 52 H VAL 52 12.351 -0.154 0.819 397 HA VAL 52 HA VAL 52 11.291 0.199 -1.887 398 HB VAL 52 HB VAL 52 12.607 1.760 0.136 399 1HG1 VAL 52 1HG2 VAL 52 14.718 1.015 -1.901 400 2HG1 VAL 52 2HG2 VAL 52 14.746 2.431 -0.789 401 3HG1 VAL 52 3HG2 VAL 52 14.724 0.754 -0.150 402 1HG2 VAL 52 3HG1 VAL 52 12.249 2.381 -2.804 403 2HG2 VAL 52 1HG1 VAL 52 11.111 2.645 -1.459 404 3HG2 VAL 52 2HG1 VAL 52 12.643 3.522 -1.500 405 NH1 ARG 53 NH2 ARG 53 15.050 -3.779 -8.802 406 NH2 ARG 53 NH1 ARG 53 13.617 -2.340 -9.821 407 H ARG 53 H ARG 53 12.617 -0.212 -3.729 408 HA ARG 53 HA ARG 53 14.507 -2.640 -3.490 409 1HB ARG 53 1HB ARG 53 12.114 -3.221 -4.299 410 2HB ARG 53 2HB ARG 53 12.405 -2.197 -5.673 411 1HG ARG 53 1HG ARG 53 14.637 -3.767 -5.961 412 2HG ARG 53 2HG ARG 53 13.708 -4.860 -4.960 413 1HD ARG 53 1HD ARG 53 13.347 -5.473 -7.288 414 2HD ARG 53 2HD ARG 53 11.838 -4.825 -6.674 415 1HH1 ARG 53 2HH2 ARG 53 15.196 -4.475 -8.063 416 2HH1 ARG 53 1HH2 ARG 53 15.741 -3.455 -9.488 417 1HH2 ARG 53 1HH1 ARG 53 12.673 -1.939 -9.862 418 2HH2 ARG 53 2HH1 ARG 53 14.408 -2.117 -10.436 419 H GLU 54 H GLU 54 16.334 -1.386 -3.645 420 HA GLU 54 HA GLU 54 16.742 0.716 -5.667 421 1HB GLU 54 1HB GLU 54 19.019 0.897 -4.948 422 2HB GLU 54 2HB GLU 54 17.894 0.911 -3.609 423 1HG GLU 54 1HG GLU 54 18.521 -1.527 -3.087 424 2HG GLU 54 2HG GLU 54 19.695 -1.476 -4.397 425 HE1 GLU 54 HE2 GLU 54 20.351 0.435 -0.887 426 NH1 ARG 55 NH2 ARG 55 18.094 -4.945 -13.212 427 NH2 ARG 55 NH1 ARG 55 18.645 -3.862 -15.133 428 H ARG 55 H ARG 55 17.254 0.585 -7.728 429 HA ARG 55 HA ARG 55 17.863 -2.098 -8.990 430 1HB ARG 55 1HB ARG 55 16.098 -0.772 -10.027 431 2HB ARG 55 2HB ARG 55 17.120 0.639 -10.154 432 1HG ARG 55 1HG ARG 55 16.854 -0.314 -12.338 433 2HG ARG 55 2HG ARG 55 18.541 -0.416 -11.865 434 1HD ARG 55 1HD ARG 55 18.181 -2.889 -11.256 435 2HD ARG 55 2HD ARG 55 16.508 -2.755 -11.828 436 1HH1 ARG 55 2HH2 ARG 55 17.772 -4.872 -12.240 437 2HH1 ARG 55 1HH2 ARG 55 18.314 -5.806 -13.724 438 1HH2 ARG 55 1HH1 ARG 55 18.746 -2.968 -15.627 439 2HH2 ARG 55 2HH1 ARG 55 18.828 -4.797 -15.512 440 H ALA 56 H ALA 56 19.847 -2.639 -9.628 441 HA ALA 56 HA ALA 56 22.212 -0.893 -9.045 442 1HB ALA 56 3HB ALA 56 22.075 -3.735 -10.232 443 2HB ALA 56 1HB ALA 56 23.559 -2.878 -9.754 444 3HB ALA 56 2HB ALA 56 22.346 -3.296 -8.527 445 H ALA 57 H ALA 57 22.133 0.798 -10.491 446 HA ALA 57 HA ALA 57 21.715 0.923 -13.193 447 1HB ALA 57 3HB ALA 57 22.296 2.924 -11.736 448 2HB ALA 57 1HB ALA 57 24.011 2.461 -11.776 449 3HB ALA 57 2HB ALA 57 23.188 2.976 -13.266 450 NH1 ARG 58 NH2 ARG 58 23.711 -5.485 -12.316 451 NH2 ARG 58 NH1 ARG 58 21.515 -6.051 -12.146 452 H ARG 58 H ARG 58 22.310 0.377 -15.009 453 HA ARG 58 HA ARG 58 24.775 -1.284 -15.182 454 1HB ARG 58 2HB ARG 58 22.454 -1.431 -17.156 455 2HB ARG 58 1HB ARG 58 23.771 -2.575 -17.031 456 1HG ARG 58 1HG ARG 58 21.530 -2.178 -14.968 457 2HG ARG 58 2HG ARG 58 21.622 -3.434 -16.190 458 1HD ARG 58 1HD ARG 58 23.739 -4.355 -15.122 459 2HD ARG 58 2HD ARG 58 23.644 -3.095 -13.876 460 1HH1 ARG 58 2HH2 ARG 58 24.428 -4.939 -12.806 461 2HH1 ARG 58 1HH2 ARG 58 23.857 -6.124 -11.526 462 1HH2 ARG 58 1HH1 ARG 58 20.559 -5.936 -12.502 463 2HH2 ARG 58 2HH1 ARG 58 21.813 -6.648 -11.368 464 H LYS 59 H LYS 59 25.195 -1.478 -17.835 465 HA LYS 59 HA LYS 59 25.357 1.161 -19.193 466 1HB LYS 59 1HB LYS 59 27.424 1.345 -17.819 467 2HB LYS 59 2HB LYS 59 27.997 -0.210 -18.390 468 1HG LYS 59 1HG LYS 59 29.211 1.547 -19.531 469 2HG LYS 59 2HG LYS 59 28.248 0.674 -20.710 470 1HD LYS 59 1HD LYS 59 26.513 2.546 -20.640 471 2HD LYS 59 2HD LYS 59 27.527 3.419 -19.487 472 1HE LYS 59 1HE LYS 59 29.389 3.516 -21.230 473 2HE LYS 59 2HE LYS 59 28.363 2.628 -22.368 474 1HZ LYS 59 1HZ LYS 59 27.763 5.288 -21.197 475 2HZ LYS 59 2HZ LYS 59 28.268 4.999 -22.725 476 H GLY 60 H GLY 60 24.589 0.596 -21.101 477 1HA GLY 60 1HA GLY 60 25.620 -1.798 -22.618 478 2HA GLY 60 2HA GLY 60 23.955 -1.981 -22.070 479 NH1 ARG 61 NH2 ARG 61 27.163 -2.711 -27.717 480 NH2 ARG 61 NH1 ARG 61 28.102 -1.472 -29.375 481 H ARG 61 H ARG 61 22.565 -1.407 -23.597 482 HA ARG 61 HA ARG 61 23.029 0.974 -25.432 483 1HB ARG 61 1HB ARG 61 22.631 -1.941 -26.387 484 2HB ARG 61 2HB ARG 61 22.169 -0.588 -27.399 485 1HG ARG 61 1HG ARG 61 24.468 0.343 -27.380 486 2HG ARG 61 2HG ARG 61 25.033 -1.000 -26.381 487 1HD ARG 61 1HD ARG 61 24.430 -2.644 -28.203 488 2HD ARG 61 2HD ARG 61 23.746 -1.342 -29.167 489 1HH1 ARG 61 2HH2 ARG 61 26.311 -2.971 -27.207 490 2HH1 ARG 61 1HH2 ARG 61 28.113 -3.059 -27.544 491 1HH2 ARG 61 1HH1 ARG 61 27.969 -0.788 -30.128 492 2HH2 ARG 61 2HH1 ARG 61 28.986 -1.905 -29.087 493 H ASN 62 H ASN 62 21.246 1.629 -26.598 494 HA ASN 62 HA ASN 62 18.705 1.606 -25.115 495 1HB ASN 62 1HB ASN 62 19.727 3.583 -26.368 496 2HB ASN 62 2HB ASN 62 19.352 2.784 -27.885 497 1HD2 ASN 62 2HD2 ASN 62 16.389 4.837 -26.048 498 2HD2 ASN 62 1HD2 ASN 62 18.022 4.594 -25.247 499 HA PRO 63 HA PRO 63 16.934 -2.061 -27.217 500 1HB PRO 63 1HB PRO 63 14.195 -1.713 -26.733 501 2HB PRO 63 2HB PRO 63 15.392 -2.274 -25.555 502 1HG PRO 63 1HG PRO 63 14.333 0.569 -25.928 503 2HG PRO 63 2HG PRO 63 14.501 -0.344 -24.410 504 1HD PRO 63 1HD PRO 63 16.381 1.499 -25.180 505 2HD PRO 63 2HD PRO 63 16.897 -0.004 -24.359 506 H GLN 64 H GLN 64 15.474 1.068 -28.211 507 HA GLN 64 HA GLN 64 14.449 -0.026 -30.806 508 1HB GLN 64 1HB GLN 64 13.302 1.871 -29.551 509 2HB GLN 64 2HB GLN 64 14.695 2.904 -29.822 510 1HG GLN 64 1HG GLN 64 14.360 2.827 -32.290 511 2HG GLN 64 2HG GLN 64 13.072 1.653 -32.095 512 1HE2 GLN 64 2HE2 GLN 64 12.222 5.631 -31.447 513 2HE2 GLN 64 1HE2 GLN 64 13.937 5.029 -31.705 514 H THR 65 H THR 65 16.538 2.653 -30.216 515 HA THR 65 HA THR 65 17.816 2.684 -32.760 516 HB THR 65 HB THR 65 19.056 4.617 -31.958 517 HG1 THR 65 HG1 THR 65 18.205 3.856 -29.380 518 1HG2 THR 65 2HG2 THR 65 16.503 4.897 -32.305 519 2HG2 THR 65 3HG2 THR 65 16.286 4.650 -30.567 520 3HG2 THR 65 1HG2 THR 65 17.197 6.060 -31.131 521 H GLY 66 H GLY 66 19.192 1.269 -29.818 522 1HA GLY 66 1HA GLY 66 21.153 -0.099 -29.578 523 2HA GLY 66 2HA GLY 66 21.413 -0.036 -31.308 524 H GLU 67 H GLU 67 21.252 2.779 -29.106 525 HA GLU 67 HA GLU 67 24.111 3.555 -29.831 526 1HB GLU 67 2HB GLU 67 22.106 5.127 -30.273 527 2HB GLU 67 1HB GLU 67 21.927 5.309 -28.531 528 1HG GLU 67 1HG GLU 67 24.468 6.020 -30.147 529 2HG GLU 67 2HG GLU 67 23.176 7.150 -29.797 530 HE1 GLU 67 HE2 GLU 67 23.882 7.374 -26.329 531 H GLU 68 H GLU 68 25.565 3.560 -28.261 532 HA GLU 68 HA GLU 68 25.072 2.035 -25.847 533 1HB GLU 68 1HB GLU 68 27.610 3.592 -26.632 534 2HB GLU 68 2HB GLU 68 27.495 2.640 -25.157 535 1HG GLU 68 1HG GLU 68 26.984 0.558 -26.479 536 2HG GLU 68 2HG GLU 68 27.109 1.467 -27.980 537 HE1 GLU 68 HE2 GLU 68 30.373 0.314 -25.910 538 H MET 69 H MET 69 24.332 2.617 -23.968 539 HA MET 69 HA MET 69 24.683 5.411 -22.857 540 1HB MET 69 1HB MET 69 22.293 5.861 -22.617 541 2HB MET 69 2HB MET 69 22.705 5.614 -24.293 542 1HG MET 69 1HG MET 69 20.646 4.478 -24.109 543 2HG MET 69 2HG MET 69 21.783 3.130 -23.973 544 1HE MET 69 1HE MET 69 18.970 2.706 -23.224 545 2HE MET 69 3HE MET 69 20.116 1.454 -22.642 546 3HE MET 69 2HE MET 69 18.882 2.133 -21.540 547 H GLU 70 H GLU 70 24.469 5.613 -20.747 548 HA GLU 70 HA GLU 70 24.623 3.216 -19.018 549 1HB GLU 70 2HB GLU 70 25.071 4.587 -17.163 550 2HB GLU 70 1HB GLU 70 26.065 5.131 -18.499 551 1HG GLU 70 1HG GLU 70 23.546 6.564 -17.411 552 2HG GLU 70 2HG GLU 70 25.203 6.959 -17.021 553 HE2 GLU 70 HE2 GLU 70 23.497 8.371 -20.334 554 H ILE 71 H ILE 71 23.019 2.221 -17.931 555 HA ILE 71 HA ILE 71 20.185 3.170 -18.213 556 HB ILE 71 HB ILE 71 21.534 0.544 -17.406 557 1HG1 ILE 71 1HG1 ILE 71 19.691 0.956 -19.835 558 2HG1 ILE 71 2HG1 ILE 71 21.355 1.463 -19.977 559 1HG2 ILE 71 3HG2 ILE 71 18.538 1.152 -17.647 560 2HG2 ILE 71 1HG2 ILE 71 19.260 -0.479 -17.464 561 3HG2 ILE 71 2HG2 ILE 71 19.428 0.719 -16.159 562 1HD1 ILE 71 2HD1 ILE 71 20.507 -1.418 -19.352 563 2HD1 ILE 71 3HD1 ILE 71 21.101 -0.775 -20.904 564 3HD1 ILE 71 1HD1 ILE 71 22.192 -0.830 -19.501 565 HA PRO 72 HA PRO 72 21.172 4.790 -13.967 566 1HB PRO 72 1HB PRO 72 18.986 6.444 -13.555 567 2HB PRO 72 2HB PRO 72 20.284 6.799 -14.703 568 1HG PRO 72 1HG PRO 72 17.564 5.526 -15.311 569 2HG PRO 72 2HG PRO 72 18.330 6.908 -16.135 570 1HD PRO 72 1HD PRO 72 18.501 4.325 -17.123 571 2HD PRO 72 2HD PRO 72 19.846 5.487 -17.327 572 H ALA 73 H ALA 73 20.497 4.684 -11.829 573 HA ALA 73 HA ALA 73 18.940 2.256 -11.029 574 1HB ALA 73 1HB ALA 73 20.954 3.005 -9.647 575 2HB ALA 73 2HB ALA 73 20.083 4.524 -9.217 576 3HB ALA 73 3HB ALA 73 19.482 2.965 -8.666 577 H SER 74 H SER 74 17.425 2.343 -9.369 578 HA SER 74 HA SER 74 16.410 4.678 -8.333 579 1HB SER 74 1HB SER 74 13.929 4.840 -9.033 580 2HB SER 74 2HB SER 74 15.012 5.160 -10.374 581 HG SER 74 HG SER 74 13.348 3.730 -10.911 582 H LYS 75 H LYS 75 15.267 4.479 -6.522 583 HA LYS 75 HA LYS 75 14.887 1.725 -5.327 584 1HB LYS 75 2HB LYS 75 14.045 4.048 -3.708 585 2HB LYS 75 1HB LYS 75 14.746 2.523 -3.284 586 1HG LYS 75 1HG LYS 75 17.003 3.251 -4.050 587 2HG LYS 75 2HG LYS 75 16.367 4.801 -4.574 588 1HD LYS 75 1HD LYS 75 16.380 3.792 -1.669 589 2HD LYS 75 2HD LYS 75 17.570 4.868 -2.357 590 1HE LYS 75 1HE LYS 75 14.566 5.563 -2.076 591 2HE LYS 75 2HE LYS 75 15.825 6.020 -0.938 592 1HZ LYS 75 1HZ LYS 75 15.302 7.785 -2.474 593 2HZ LYS 75 2HZ LYS 75 15.683 6.870 -3.774 594 H VAL 76 H VAL 76 12.847 0.619 -5.591 595 HA VAL 76 HA VAL 76 10.564 2.121 -6.522 596 HB VAL 76 HB VAL 76 12.200 -0.358 -6.894 597 1HG1 VAL 76 3HG2 VAL 76 9.298 -0.611 -7.209 598 2HG1 VAL 76 1HG2 VAL 76 10.628 -1.700 -7.873 599 3HG1 VAL 76 2HG2 VAL 76 10.423 -1.505 -6.124 600 1HG2 VAL 76 3HG1 VAL 76 12.285 1.511 -8.486 601 2HG2 VAL 76 1HG1 VAL 76 11.759 -0.013 -9.222 602 3HG2 VAL 76 2HG1 VAL 76 10.549 1.263 -8.856 603 HA PRO 77 HA PRO 77 9.103 1.022 -2.259 604 1HB PRO 77 1HB PRO 77 6.920 2.727 -2.132 605 2HB PRO 77 2HB PRO 77 8.581 3.342 -2.180 606 1HG PRO 77 1HG PRO 77 6.639 3.061 -4.532 607 2HG PRO 77 2HG PRO 77 7.582 4.481 -4.070 608 1HD PRO 77 1HD PRO 77 8.443 2.552 -6.034 609 2HD PRO 77 2HD PRO 77 9.638 3.464 -5.065 610 H ALA 78 H ALA 78 8.092 -0.405 -1.532 611 HA ALA 78 HA ALA 78 5.648 -1.718 -2.841 612 1HB ALA 78 2HB ALA 78 7.937 -2.793 -3.212 613 2HB ALA 78 3HB ALA 78 8.119 -2.982 -1.454 614 3HB ALA 78 1HB ALA 78 6.821 -3.849 -2.314 615 H PHE 79 H PHE 79 4.621 -3.180 -1.373 616 HA PHE 79 HA PHE 79 4.310 -2.354 1.597 617 1HB PHE 79 2HB PHE 79 2.925 -0.830 0.898 618 2HB PHE 79 1HB PHE 79 2.231 -1.859 -0.392 619 HD1 PHE 79 HD2 PHE 79 2.197 -1.310 3.325 620 HD2 PHE 79 HD1 PHE 79 0.380 -3.386 0.026 621 HE1 PHE 79 HE2 PHE 79 0.413 -2.131 4.808 622 HE2 PHE 79 HE1 PHE 79 -1.358 -4.246 1.531 623 HZ PHE 79 HZ PHE 79 -1.327 -3.660 3.921 624 H LYS 80 H LYS 80 4.228 -4.202 2.423 625 HA LYS 80 HA LYS 80 3.385 -7.006 1.270 626 1HB LYS 80 2HB LYS 80 4.712 -6.263 3.894 627 2HB LYS 80 1HB LYS 80 4.114 -7.857 3.542 628 1HG LYS 80 1HG LYS 80 6.315 -6.440 1.902 629 2HG LYS 80 2HG LYS 80 6.609 -7.530 3.247 630 1HD LYS 80 1HD LYS 80 5.459 -9.410 2.011 631 2HD LYS 80 2HD LYS 80 5.162 -8.334 0.641 632 1HE LYS 80 1HE LYS 80 7.659 -8.000 0.342 633 2HE LYS 80 2HE LYS 80 7.972 -9.066 1.720 634 1HZ LYS 80 1HZ LYS 80 6.539 -9.870 -0.753 635 2HZ LYS 80 2HZ LYS 80 6.855 -10.853 0.515 636 HA PRO 81 HA PRO 81 -0.457 -6.295 3.662 637 1HB PRO 81 1HB PRO 81 -1.754 -8.660 3.127 638 2HB PRO 81 2HB PRO 81 -1.395 -7.492 1.849 639 1HG PRO 81 1HG PRO 81 0.209 -10.008 2.584 640 2HG PRO 81 2HG PRO 81 -0.415 -9.557 0.978 641 1HD PRO 81 1HD PRO 81 2.188 -8.972 1.844 642 2HD PRO 81 2HD PRO 81 1.320 -7.947 0.657 643 H GLY 82 H GLY 82 1.925 -6.944 5.120 644 1HA GLY 82 1HA GLY 82 2.974 -8.244 6.863 645 2HA GLY 82 2HA GLY 82 1.435 -7.840 7.600 646 H LYS 83 H LYS 83 1.236 -10.068 5.035 647 HA LYS 83 HA LYS 83 0.601 -12.387 4.909 648 1HB LYS 83 2HB LYS 83 2.236 -12.533 7.434 649 2HB LYS 83 1HB LYS 83 0.934 -13.654 7.446 650 1HG LYS 83 1HG LYS 83 2.851 -14.802 6.547 651 2HG LYS 83 2HG LYS 83 1.750 -14.591 5.193 652 1HD LYS 83 1HD LYS 83 3.104 -12.594 4.411 653 2HD LYS 83 2HD LYS 83 4.196 -12.770 5.772 654 1HE LYS 83 1HE LYS 83 3.766 -14.921 3.578 655 2HE LYS 83 2HE LYS 83 5.038 -13.702 3.546 656 1HZ LYS 83 1HZ LYS 83 4.726 -15.787 5.628 657 2HZ LYS 83 2HZ LYS 83 5.822 -15.794 4.415 658 H ALA 84 H ALA 84 -0.151 -10.947 7.823 659 HA ALA 84 HA ALA 84 -2.553 -12.221 8.802 660 1HB ALA 84 2HB ALA 84 -0.962 -10.740 10.047 661 2HB ALA 84 3HB ALA 84 -1.364 -9.367 8.983 662 3HB ALA 84 1HB ALA 84 -2.606 -10.015 10.089 663 H LEU 85 H LEU 85 -2.241 -9.166 6.769 664 HA LEU 85 HA LEU 85 -5.130 -8.867 6.401 665 1HB LEU 85 2HB LEU 85 -3.635 -6.912 6.159 666 2HB LEU 85 1HB LEU 85 -2.758 -7.709 4.868 667 HG LEU 85 HG LEU 85 -4.968 -7.929 3.682 668 1HD1 LEU 85 2HD1 LEU 85 -6.563 -7.269 5.466 669 2HD1 LEU 85 3HD1 LEU 85 -5.832 -5.659 5.556 670 3HD1 LEU 85 1HD1 LEU 85 -6.719 -6.159 4.091 671 1HD2 LEU 85 1HD2 LEU 85 -3.094 -6.357 2.969 672 2HD2 LEU 85 2HD2 LEU 85 -4.672 -5.668 2.587 673 3HD2 LEU 85 3HD2 LEU 85 -3.761 -5.076 4.003 674 H LYS 86 H LYS 86 -2.549 -10.563 4.658 675 HA LYS 86 HA LYS 86 -4.145 -11.468 2.392 676 1HB LYS 86 1HB LYS 86 -1.548 -11.624 2.704 677 2HB LYS 86 2HB LYS 86 -1.854 -13.180 3.456 678 1HG LYS 86 1HG LYS 86 -3.001 -13.974 1.360 679 2HG LYS 86 2HG LYS 86 -2.826 -12.370 0.639 680 1HD LYS 86 1HD LYS 86 -0.306 -12.573 0.784 681 2HD LYS 86 2HD LYS 86 -0.478 -14.189 1.481 682 1HE LYS 86 1HE LYS 86 -1.658 -14.974 -0.633 683 2HE LYS 86 2HE LYS 86 -1.500 -13.353 -1.326 684 1HZ LYS 86 1HZ LYS 86 0.245 -14.843 -2.056 685 2HZ LYS 86 2HZ LYS 86 0.747 -15.119 -0.524 686 H ASP 87 H ASP 87 -4.321 -12.522 5.727 687 HA ASP 87 HA ASP 87 -6.039 -14.889 5.078 688 1HB ASP 87 1HB ASP 87 -4.256 -14.142 7.221 689 2HB ASP 87 2HB ASP 87 -5.805 -13.836 7.902 690 HD1 ASP 87 HD2 ASP 87 -6.759 -17.239 7.942 691 H ALA 88 H ALA 88 -6.407 -11.539 6.368 692 HA ALA 88 HA ALA 88 -9.263 -11.488 6.933 693 1HB ALA 88 1HB ALA 88 -7.665 -9.453 7.273 694 2HB ALA 88 2HB ALA 88 -7.615 -9.248 5.517 695 3HB ALA 88 3HB ALA 88 -9.133 -9.015 6.352 696 H VAL 89 H VAL 89 -7.488 -11.082 3.822 697 HA VAL 89 HA VAL 89 -9.857 -10.243 2.320 698 HB VAL 89 HB VAL 89 -7.391 -9.256 2.789 699 1HG1 VAL 89 2HG2 VAL 89 -6.288 -11.521 2.142 700 2HG1 VAL 89 3HG2 VAL 89 -6.577 -11.053 0.451 701 3HG1 VAL 89 1HG2 VAL 89 -5.620 -10.002 1.545 702 1HG2 VAL 89 2HG1 VAL 89 -8.857 -8.236 1.349 703 2HG2 VAL 89 3HG1 VAL 89 -7.177 -8.230 0.771 704 3HG2 VAL 89 1HG1 VAL 89 -8.369 -9.339 -0.016 705 H LYS 90 H LYS 90 -8.309 -13.308 2.756 706 HA LYS 90 HA LYS 90 -8.344 -14.255 0.072 707 1HB LYS 90 1HB LYS 90 -7.349 -16.069 0.767 708 2HB LYS 90 2HB LYS 90 -7.096 -15.155 2.211 709 1HG LYS 90 1HG LYS 90 -9.317 -17.281 1.878 710 2HG LYS 90 2HG LYS 90 -7.712 -17.597 2.509 711 1HD LYS 90 1HD LYS 90 -8.041 -16.080 4.410 712 2HD LYS 90 2HD LYS 90 -9.625 -15.566 3.809 713 1HE LYS 90 1HE LYS 90 -10.489 -17.942 4.087 714 2HE LYS 90 2HE LYS 90 -8.900 -18.449 4.685 715 1HZ LYS 90 1HZ LYS 90 -9.135 -16.888 6.512 716 2HZ LYS 90 2HZ LYS 90 -10.362 -17.969 6.498 717 1H MET 1 1H MET 91 10.377 1.338 10.580 718 2H MET 1 2H MET 91 11.276 0.507 11.733 719 HA MET 1 HA MET 91 9.887 1.425 13.112 720 1HB MET 1 1HB MET 91 7.794 1.546 10.851 721 2HB MET 1 2HB MET 91 7.500 2.083 12.483 722 1HG MET 1 1HG MET 91 9.603 3.645 12.213 723 2HG MET 1 2HG MET 91 9.477 3.319 10.482 724 1HE MET 1 3HE MET 91 7.874 4.507 8.908 725 2HE MET 1 2HE MET 91 6.451 3.583 9.500 726 3HE MET 1 1HE MET 91 6.375 5.348 9.372 727 H ASN 2 H ASN 92 6.951 -0.041 12.447 728 HA ASN 2 HA ASN 92 6.976 -2.630 12.894 729 1HB ASN 2 1HB ASN 92 6.922 -3.504 15.095 730 2HB ASN 2 2HB ASN 92 8.456 -2.759 14.783 731 1HD2 ASN 2 1HD2 ASN 92 8.257 -0.673 17.685 732 2HD2 ASN 2 2HD2 ASN 92 9.226 -1.231 16.230 733 H LYS 3 H LYS 93 5.634 0.120 14.326 734 HA LYS 3 HA LYS 93 3.166 0.516 13.534 735 1HB LYS 3 1HB LYS 93 2.425 -1.925 13.902 736 2HB LYS 3 2HB LYS 93 2.503 -1.658 15.626 737 1HG LYS 3 1HG LYS 93 0.691 0.130 15.368 738 2HG LYS 3 2HG LYS 93 0.784 -0.024 13.616 739 1HD LYS 3 1HD LYS 93 0.011 -2.450 13.826 740 2HD LYS 3 2HD LYS 93 -0.173 -2.204 15.570 741 1HE LYS 3 1HE LYS 93 -1.860 -0.338 15.106 742 2HE LYS 3 2HE LYS 93 -1.671 -0.617 13.368 743 1HZ LYS 3 1HZ LYS 93 -2.446 -2.892 13.709 744 2HZ LYS 3 2HZ LYS 93 -2.615 -2.645 15.316 745 H THR 4 H THR 94 5.126 0.164 16.493 746 HA THR 4 HA THR 94 3.606 2.110 18.009 747 HB THR 4 HB THR 94 6.048 0.290 18.494 748 HG1 THR 4 HG1 THR 94 3.346 0.159 19.409 749 1HG2 THR 4 3HG2 THR 94 4.401 2.126 20.255 750 2HG2 THR 4 1HG2 THR 94 5.568 0.855 20.860 751 3HG2 THR 4 2HG2 THR 94 6.152 2.236 19.848 752 H GLU 5 H GLU 95 6.547 1.777 16.115 753 HA GLU 5 HA GLU 95 7.792 4.386 16.952 754 1HB GLU 5 1HB GLU 95 8.349 2.893 14.346 755 2HB GLU 5 2HB GLU 95 9.295 4.190 15.033 756 1HG GLU 5 1HG GLU 95 9.040 1.315 16.069 757 2HG GLU 5 2HG GLU 95 10.407 1.990 15.227 758 HE1 GLU 5 HE2 GLU 95 11.806 3.591 17.959 759 H LEU 6 H LEU 96 5.066 3.285 14.998 760 HA LEU 6 HA LEU 96 4.907 5.566 13.211 761 1HB LEU 6 2HB LEU 96 3.846 2.810 13.566 762 2HB LEU 6 1HB LEU 96 2.486 3.784 13.935 763 HG LEU 6 HG LEU 96 2.224 3.979 11.744 764 1HD1 LEU 6 2HD1 LEU 96 3.189 6.161 11.543 765 2HD1 LEU 6 3HD1 LEU 96 4.749 5.465 11.047 766 3HD1 LEU 6 1HD1 LEU 96 3.327 5.265 10.013 767 1HD2 LEU 6 2HD2 LEU 96 3.478 1.817 11.457 768 2HD2 LEU 6 3HD2 LEU 96 3.596 2.783 9.974 769 3HD2 LEU 6 1HD2 LEU 96 4.965 2.719 11.118 770 H ILE 7 H ILE 97 3.512 4.421 16.270 771 HA ILE 7 HA ILE 97 1.498 6.474 16.637 772 HB ILE 7 HB ILE 97 3.049 5.043 18.896 773 1HG1 ILE 7 1HG1 ILE 97 0.594 4.029 17.345 774 2HG1 ILE 7 2HG1 ILE 97 2.184 3.416 17.203 775 1HG2 ILE 7 2HG2 ILE 97 1.506 6.957 19.600 776 2HG2 ILE 7 3HG2 ILE 97 0.167 6.110 18.829 777 3HG2 ILE 7 1HG2 ILE 97 0.981 5.383 20.228 778 1HD1 ILE 7 3HD1 ILE 97 2.279 2.661 19.561 779 2HD1 ILE 7 1HD1 ILE 97 0.597 3.142 19.769 780 3HD1 ILE 7 2HD1 ILE 97 1.008 1.887 18.564 781 H ASN 8 H ASN 98 4.853 6.273 17.820 782 HA ASN 8 HA ASN 98 4.936 9.110 18.755 783 1HB ASN 8 1HB ASN 98 7.350 7.336 17.916 784 2HB ASN 8 2HB ASN 98 7.470 8.852 18.780 785 1HD2 ASN 8 2HD2 ASN 98 7.061 5.549 21.015 786 2HD2 ASN 8 1HD2 ASN 98 7.392 5.558 19.209 787 H ALA 9 H ALA 99 4.924 7.925 15.553 788 HA ALA 9 HA ALA 99 6.357 10.255 14.292 789 1HB ALA 9 2HB ALA 99 5.858 7.910 12.969 790 2HB ALA 9 3HB ALA 99 4.167 8.386 12.980 791 3HB ALA 9 1HB ALA 99 5.244 9.393 12.130 792 H VAL 10 H VAL 100 3.003 9.225 14.911 793 HA VAL 10 HA VAL 100 1.861 11.426 13.570 794 HB VAL 10 HB VAL 100 0.169 9.883 15.510 795 1HG1 VAL 10 3HG2 VAL 100 -0.536 11.729 13.735 796 2HG1 VAL 10 1HG2 VAL 100 -0.578 10.297 12.654 797 3HG1 VAL 10 2HG2 VAL 100 -1.553 10.303 14.134 798 1HG2 VAL 10 1HG1 VAL 100 1.509 8.710 13.058 799 2HG2 VAL 10 2HG1 VAL 100 1.372 8.134 14.755 800 3HG2 VAL 10 3HG1 VAL 100 -0.070 8.068 13.693 801 H ALA 11 H ALA 101 2.062 10.456 16.820 802 HA ALA 11 HA ALA 101 1.021 12.902 17.780 803 1HB ALA 11 2HB ALA 101 1.016 10.773 19.165 804 2HB ALA 11 3HB ALA 101 2.793 10.832 19.292 805 3HB ALA 11 1HB ALA 101 1.786 12.069 20.116 806 H GLU 12 H GLU 102 4.305 12.212 16.770 807 HA GLU 12 HA GLU 102 5.313 14.742 18.052 808 1HB GLU 12 1HB GLU 102 6.894 12.783 17.804 809 2HB GLU 12 2HB GLU 102 6.748 12.890 16.058 810 1HG GLU 12 1HG GLU 102 8.846 13.895 16.714 811 2HG GLU 12 2HG GLU 102 7.822 15.174 16.095 812 HE1 GLU 12 HE2 GLU 102 8.987 15.050 19.979 813 H THR 13 H THR 103 4.524 13.632 14.674 814 HA THR 13 HA THR 103 4.630 16.562 13.897 815 HB THR 13 HB THR 103 5.753 14.581 12.736 816 HG1 THR 13 HG1 THR 103 5.811 16.790 12.190 817 1HG2 THR 13 3HG2 THR 103 3.922 13.208 12.008 818 2HG2 THR 13 1HG2 THR 103 3.209 14.553 11.074 819 3HG2 THR 13 2HG2 THR 103 4.788 13.862 10.609 820 H SER 14 H SER 104 2.429 15.272 15.247 821 HA SER 14 HA SER 104 0.328 17.171 14.024 822 1HB SER 14 1HB SER 104 -0.223 14.781 13.335 823 2HB SER 14 2HB SER 104 -0.499 14.382 15.035 824 HG SER 14 HG SER 104 -2.379 14.967 13.956 825 H GLY 15 H GLY 105 1.444 15.687 17.107 826 1HA GLY 15 1HA GLY 105 0.978 16.299 19.340 827 2HA GLY 15 2HA GLY 105 0.415 17.852 18.736 828 H LEU 16 H LEU 106 -0.612 14.517 18.832 829 HA LEU 16 HA LEU 106 -3.331 15.139 20.006 830 1HB LEU 16 1HB LEU 106 -4.182 13.215 18.821 831 2HB LEU 16 2HB LEU 106 -3.784 14.625 17.858 832 HG LEU 16 HG LEU 106 -1.862 13.744 17.014 833 1HD1 LEU 16 2HD1 LEU 106 -0.940 12.529 19.058 834 2HD1 LEU 16 3HD1 LEU 106 -2.106 11.233 18.659 835 3HD1 LEU 16 1HD1 LEU 106 -0.747 11.689 17.523 836 1HD2 LEU 16 2HD2 LEU 106 -3.344 13.176 15.553 837 2HD2 LEU 16 3HD2 LEU 106 -1.843 12.210 15.593 838 3HD2 LEU 16 1HD2 LEU 106 -3.321 11.502 16.223 839 H SER 17 H SER 107 -2.879 12.222 20.168 840 HA SER 17 HA SER 107 -1.528 12.002 22.915 841 1HB SER 17 1HB SER 107 -4.165 10.555 22.420 842 2HB SER 17 2HB SER 107 -3.172 10.521 23.857 843 HG SER 17 HG SER 107 -4.413 12.821 22.773 844 H LYS 18 H LYS 108 -0.853 9.878 23.489 845 HA LYS 18 HA LYS 108 0.381 8.264 21.262 846 1HB LYS 18 1HB LYS 108 1.409 8.596 23.662 847 2HB LYS 18 2HB LYS 108 0.125 7.581 24.276 848 1HG LYS 18 1HG LYS 108 1.895 6.087 24.131 849 2HG LYS 18 2HG LYS 108 1.018 5.711 22.661 850 1HD LYS 18 1HD LYS 108 2.674 7.322 21.428 851 2HD LYS 18 2HD LYS 108 3.579 7.448 22.916 852 1HE LYS 18 1HE LYS 108 3.009 4.754 21.478 853 2HE LYS 18 2HE LYS 108 4.430 5.740 21.173 854 1HZ LYS 18 1HZ LYS 108 3.710 4.547 23.787 855 2HZ LYS 18 2HZ LYS 108 4.859 3.996 22.764 856 H LYS 19 H LYS 109 -2.334 7.761 23.506 857 HA LYS 19 HA LYS 109 -3.303 5.339 22.096 858 1HB LYS 19 2HB LYS 109 -4.826 7.261 23.974 859 2HB LYS 19 1HB LYS 109 -5.577 5.855 23.216 860 1HG LYS 19 1HG LYS 109 -5.067 5.036 25.305 861 2HG LYS 19 2HG LYS 109 -3.768 4.379 24.329 862 1HD LYS 19 1HD LYS 109 -2.220 6.235 25.228 863 2HD LYS 19 2HD LYS 109 -3.576 6.882 26.135 864 1HE LYS 19 1HE LYS 109 -2.262 5.629 27.699 865 2HE LYS 19 2HE LYS 109 -3.722 4.677 27.440 866 1HZ LYS 19 1HZ LYS 109 -2.466 3.272 25.912 867 2HZ LYS 19 2HZ LYS 109 -1.777 3.298 27.394 868 H ASP 20 H ASP 110 -3.949 8.901 21.539 869 HA ASP 20 HA ASP 110 -6.012 8.227 19.456 870 1HB ASP 20 1HB ASP 110 -4.569 10.859 20.226 871 2HB ASP 20 2HB ASP 110 -5.491 10.799 18.758 872 HD1 ASP 20 HD2 ASP 110 -8.617 10.837 20.183 873 H ALA 21 H ALA 111 -2.560 8.710 19.319 874 HA ALA 21 HA ALA 111 -2.374 8.800 16.351 875 1HB ALA 21 1HB ALA 111 -0.362 8.320 18.655 876 2HB ALA 21 2HB ALA 111 0.108 8.258 16.931 877 3HB ALA 21 3HB ALA 111 -0.542 9.715 17.623 878 H THR 22 H THR 112 -2.043 6.097 18.726 879 HA THR 22 HA THR 112 -1.588 4.194 16.548 880 HB THR 22 HB THR 112 -0.985 4.033 18.821 881 HG1 THR 22 HG1 THR 112 -0.712 1.737 18.438 882 1HG2 THR 22 1HG2 THR 112 -2.528 3.802 20.421 883 2HG2 THR 22 2HG2 THR 112 -3.131 2.236 19.686 884 3HG2 THR 22 3HG2 THR 112 -1.476 2.386 20.317 885 H LYS 23 H LYS 113 -4.431 5.095 18.190 886 HA LYS 23 HA LYS 113 -6.455 3.381 16.957 887 1HB LYS 23 2HB LYS 113 -5.884 6.215 18.169 888 2HB LYS 23 1HB LYS 113 -7.496 6.030 17.491 889 1HG LYS 23 1HG LYS 113 -7.992 4.004 18.964 890 2HG LYS 23 2HG LYS 113 -6.486 4.295 19.826 891 1HD LYS 23 1HD LYS 113 -7.326 6.634 20.424 892 2HD LYS 23 2HD LYS 113 -8.839 6.305 19.601 893 1HE LYS 23 1HE LYS 113 -7.768 4.696 22.026 894 2HE LYS 23 2HE LYS 113 -8.882 6.055 22.142 895 1HZ LYS 23 1HZ LYS 113 -10.029 3.950 22.184 896 2HZ LYS 23 2HZ LYS 113 -9.435 3.511 20.726 897 H ALA 24 H ALA 114 -5.006 6.438 16.071 898 HA ALA 24 HA ALA 114 -6.597 6.926 13.685 899 1HB ALA 24 3HB ALA 114 -4.025 8.110 14.755 900 2HB ALA 24 1HB ALA 114 -4.942 8.750 13.347 901 3HB ALA 24 2HB ALA 114 -5.725 8.671 14.952 902 H VAL 25 H VAL 115 -3.239 5.580 14.026 903 HA VAL 25 HA VAL 115 -2.806 4.779 11.184 904 HB VAL 25 HB VAL 115 -2.035 3.928 14.149 905 1HG1 VAL 25 2HG2 VAL 115 -1.079 2.294 11.728 906 2HG1 VAL 25 3HG2 VAL 115 -0.435 2.165 13.403 907 3HG1 VAL 25 1HG2 VAL 115 -2.093 1.721 13.055 908 1HG2 VAL 25 1HG1 VAL 115 -0.848 5.892 13.160 909 2HG2 VAL 25 2HG1 VAL 115 0.217 4.587 13.689 910 3HG2 VAL 25 3HG1 VAL 115 -0.107 4.803 11.944 911 H ASP 26 H ASP 116 -4.139 2.866 13.985 912 HA ASP 26 HA ASP 116 -5.313 0.778 12.302 913 1HB ASP 26 1HB ASP 116 -4.866 0.647 14.826 914 2HB ASP 26 2HB ASP 116 -6.267 1.664 15.107 915 HD2 ASP 26 HD2 ASP 116 -8.554 -0.886 14.717 916 H ALA 27 H ALA 117 -6.437 4.006 12.827 917 HA ALA 27 HA ALA 117 -9.247 3.673 11.991 918 1HB ALA 27 2HB ALA 117 -8.473 5.714 13.275 919 2HB ALA 27 3HB ALA 117 -7.599 6.195 11.815 920 3HB ALA 27 1HB ALA 117 -9.345 5.966 11.751 921 H VAL 28 H VAL 118 -6.303 4.615 10.329 922 HA VAL 28 HA VAL 118 -7.387 4.852 7.625 923 HB VAL 28 HB VAL 118 -4.512 3.762 8.121 924 1HG1 VAL 28 1HG2 VAL 118 -5.989 4.659 5.843 925 2HG1 VAL 28 2HG2 VAL 118 -4.715 5.868 6.151 926 3HG1 VAL 28 3HG2 VAL 118 -4.266 4.154 6.031 927 1HG2 VAL 28 3HG1 VAL 118 -5.163 6.660 8.490 928 2HG2 VAL 28 1HG1 VAL 118 -4.355 5.468 9.600 929 3HG2 VAL 28 2HG1 VAL 118 -3.545 5.950 8.105 930 H PHE 29 H PHE 119 -5.480 2.394 9.063 931 HA PHE 29 HA PHE 119 -5.770 0.238 7.155 932 1HB PHE 29 2HB PHE 119 -4.581 0.178 9.958 933 2HB PHE 29 1HB PHE 119 -4.263 -1.022 8.733 934 HD1 PHE 29 HD2 PHE 119 -3.731 0.507 6.232 935 HD2 PHE 29 HD1 PHE 119 -2.518 1.327 10.264 936 HE1 PHE 29 HE2 PHE 119 -2.024 2.056 5.397 937 HE2 PHE 29 HE1 PHE 119 -0.830 2.914 9.418 938 HZ PHE 29 HZ PHE 119 -0.627 3.308 6.987 939 H ASP 30 H ASP 120 -7.968 0.990 9.692 940 HA ASP 30 HA ASP 120 -9.131 -1.795 9.571 941 1HB ASP 30 1HB ASP 120 -9.378 -0.269 11.625 942 2HB ASP 30 2HB ASP 120 -10.527 0.701 10.746 943 HD1 ASP 30 HD2 ASP 120 -11.509 -3.062 11.972 944 H SER 31 H SER 121 -9.839 1.339 8.339 945 HA SER 31 HA SER 121 -12.321 0.601 6.815 946 1HB SER 31 2HB SER 121 -10.599 3.118 6.495 947 2HB SER 31 1HB SER 121 -12.207 2.829 5.776 948 HG SER 31 HG SER 121 -12.301 3.997 7.703 949 H ILE 32 H ILE 122 -8.741 0.787 5.781 950 HA ILE 32 HA ILE 122 -9.039 0.110 3.114 951 HB ILE 32 HB ILE 122 -6.796 -0.870 4.858 952 1HG1 ILE 32 1HG1 ILE 122 -7.638 1.922 4.318 953 2HG1 ILE 32 2HG1 ILE 122 -6.946 1.042 5.647 954 1HG2 ILE 32 3HG2 ILE 122 -7.213 -1.498 2.296 955 2HG2 ILE 32 1HG2 ILE 122 -6.624 0.097 1.937 956 3HG2 ILE 32 2HG2 ILE 122 -5.603 -1.109 2.769 957 1HD1 ILE 32 1HD1 ILE 122 -4.715 1.124 4.340 958 2HD1 ILE 32 2HD1 ILE 122 -5.554 2.513 3.494 959 3HD1 ILE 32 3HD1 ILE 122 -5.380 2.497 5.272 960 H THR 33 H THR 123 -8.470 -2.036 5.942 961 HA THR 33 HA THR 123 -8.626 -4.514 4.348 962 HB THR 33 HB THR 123 -7.583 -4.668 6.473 963 HG1 THR 33 HG1 THR 123 -8.594 -6.479 7.319 964 1HG2 THR 33 2HG2 THR 123 -8.947 -2.997 7.744 965 2HG2 THR 33 3HG2 THR 123 -10.263 -4.152 7.896 966 3HG2 THR 33 1HG2 THR 123 -8.671 -4.469 8.683 967 H GLU 34 H GLU 124 -11.231 -2.605 5.758 968 HA GLU 34 HA GLU 124 -13.339 -4.566 4.868 969 1HB GLU 34 1HB GLU 124 -13.415 -1.682 6.005 970 2HB GLU 34 2HB GLU 124 -14.795 -2.262 5.117 971 1HG GLU 34 1HG GLU 124 -15.321 -2.665 7.383 972 2HG GLU 34 2HG GLU 124 -15.060 -4.234 6.653 973 HE2 GLU 34 HE2 GLU 124 -12.783 -2.872 9.683 974 H ALA 35 H ALA 125 -11.623 -1.852 3.364 975 HA ALA 35 HA ALA 125 -13.257 -1.901 0.912 976 1HB ALA 35 2HB ALA 125 -11.582 0.123 1.426 977 2HB ALA 35 3HB ALA 125 -10.245 -0.983 1.156 978 3HB ALA 35 1HB ALA 125 -11.283 -0.569 -0.170 979 H LEU 36 H LEU 126 -10.064 -3.327 1.658 980 HA LEU 36 HA LEU 126 -9.584 -4.833 -0.777 981 1HB LEU 36 2HB LEU 126 -8.568 -5.378 1.963 982 2HB LEU 36 1HB LEU 126 -7.820 -5.844 0.476 983 HG LEU 36 HG LEU 126 -7.585 -3.979 -0.170 984 1HD1 LEU 36 1HD2 LEU 126 -5.691 -4.568 0.613 985 2HD1 LEU 36 2HD2 LEU 126 -5.620 -2.825 0.974 986 3HD1 LEU 36 3HD2 LEU 126 -6.090 -3.956 2.272 987 1HD2 LEU 36 3HD1 LEU 126 -8.825 -2.478 -0.699 988 2HD2 LEU 36 1HD1 LEU 126 -7.824 -1.522 0.330 989 3HD2 LEU 36 2HD1 LEU 126 -7.066 -2.355 -1.002 990 NH1 ARG 37 NH2 ARG 127 -12.231 -10.618 7.452 991 NH2 ARG 37 NH1 ARG 127 -14.138 -11.850 7.383 992 H ARG 37 H ARG 127 -10.887 -5.897 2.447 993 HA ARG 37 HA ARG 127 -11.354 -8.539 1.574 994 1HB ARG 37 1HB ARG 127 -11.278 -7.831 3.969 995 2HB ARG 37 2HB ARG 127 -12.768 -6.898 3.754 996 1HG ARG 37 1HG ARG 127 -13.999 -9.139 3.372 997 2HG ARG 37 2HG ARG 127 -12.490 -9.953 3.790 998 1HD ARG 37 1HD ARG 127 -12.505 -8.465 5.981 999 2HD ARG 37 2HD ARG 127 -14.111 -7.952 5.501 1000 1HH1 ARG 37 2HH2 ARG 127 -11.714 -9.804 7.103 1001 2HH1 ARG 37 1HH2 ARG 127 -11.907 -11.302 8.144 1002 1HH2 ARG 37 1HH1 ARG 127 -15.075 -11.979 6.985 1003 2HH2 ARG 37 2HH1 ARG 127 -13.679 -12.447 8.080 1004 H LYS 38 H LYS 128 -13.250 -5.615 0.987 1005 HA LYS 38 HA LYS 128 -15.708 -7.252 0.216 1006 1HB LYS 38 1HB LYS 128 -15.901 -5.460 2.089 1007 2HB LYS 38 2HB LYS 128 -15.760 -4.260 0.812 1008 1HG LYS 38 1HG LYS 128 -17.863 -5.306 -0.257 1009 2HG LYS 38 2HG LYS 128 -17.946 -6.432 1.085 1010 1HD LYS 38 1HD LYS 128 -18.118 -3.356 1.271 1011 2HD LYS 38 2HD LYS 128 -19.494 -4.435 1.268 1012 1HE LYS 38 1HE LYS 128 -17.344 -4.324 3.496 1013 2HE LYS 38 2HE LYS 128 -18.923 -3.553 3.550 1014 1HZ LYS 38 1HZ LYS 128 -19.956 -5.742 3.388 1015 2HZ LYS 38 2HZ LYS 128 -18.498 -6.479 3.327 1016 H GLY 39 H GLY 129 -13.133 -6.398 -1.402 1017 1HA GLY 39 1HA GLY 129 -12.661 -5.870 -3.694 1018 2HA GLY 39 2HA GLY 129 -14.347 -6.160 -4.054 1019 H ASP 40 H ASP 130 -12.907 -3.665 -2.010 1020 HA ASP 40 HA ASP 130 -13.919 -1.448 -3.846 1021 1HB ASP 40 1HB ASP 130 -13.589 -1.016 -0.904 1022 2HB ASP 40 2HB ASP 130 -14.386 -0.015 -2.064 1023 HD2 ASP 40 HD2 ASP 130 -16.641 -2.196 0.055 1024 H LYS 41 H LYS 131 -12.896 0.352 -4.244 1025 HA LYS 41 HA LYS 131 -9.883 0.362 -3.949 1026 1HB LYS 41 2HB LYS 131 -11.587 2.490 -5.334 1027 2HB LYS 41 1HB LYS 131 -9.831 2.371 -5.371 1028 1HG LYS 41 1HG LYS 131 -10.055 0.136 -6.606 1029 2HG LYS 41 2HG LYS 131 -11.800 0.398 -6.674 1030 1HD LYS 41 1HD LYS 131 -11.377 2.622 -7.877 1031 2HD LYS 41 2HD LYS 131 -9.645 2.269 -7.860 1032 1HE LYS 41 1HE LYS 131 -10.087 0.149 -9.220 1033 2HE LYS 41 2HE LYS 131 -11.811 0.546 -9.251 1034 1HZ LYS 41 1HZ LYS 131 -10.746 1.300 -11.233 1035 2HZ LYS 41 2HZ LYS 131 -11.272 2.601 -10.396 1036 H VAL 42 H VAL 132 -8.868 1.636 -2.424 1037 HA VAL 42 HA VAL 132 -10.220 3.440 -0.598 1038 HB VAL 42 HB VAL 132 -7.398 2.251 -1.030 1039 1HG1 VAL 42 3HG2 VAL 132 -7.400 4.027 0.700 1040 2HG1 VAL 42 1HG2 VAL 132 -8.719 3.138 1.548 1041 3HG1 VAL 42 2HG2 VAL 132 -7.112 2.386 1.367 1042 1HG2 VAL 42 2HG1 VAL 132 -9.714 1.244 0.757 1043 2HG2 VAL 42 3HG1 VAL 132 -9.114 0.376 -0.700 1044 3HG2 VAL 42 1HG1 VAL 132 -8.111 0.542 0.715 1045 H GLN 43 H GLN 133 -7.513 4.634 -1.001 1046 HA GLN 43 HA GLN 133 -6.644 5.936 -2.789 1047 1HB GLN 43 1HB GLN 133 -9.195 7.452 -3.134 1048 2HB GLN 43 2HB GLN 133 -7.669 8.192 -3.610 1049 1HG GLN 43 1HG GLN 133 -7.025 6.327 -5.006 1050 2HG GLN 43 2HG GLN 133 -8.393 5.369 -4.534 1051 1HE2 GLN 43 2HE2 GLN 133 -10.350 6.718 -7.224 1052 2HE2 GLN 43 1HE2 GLN 133 -9.975 5.352 -6.059 1053 H LEU 44 H LEU 134 -5.045 7.223 -2.599 1054 HA LEU 44 HA LEU 134 -5.020 9.371 -0.444 1055 1HB LEU 44 2HB LEU 134 -2.600 7.555 -0.917 1056 2HB LEU 44 1HB LEU 134 -2.806 8.818 0.291 1057 HG LEU 44 HG LEU 134 -4.886 7.132 0.975 1058 1HD1 LEU 44 1HD1 LEU 134 -4.308 5.403 -0.777 1059 2HD1 LEU 44 2HD1 LEU 134 -2.715 5.178 -0.021 1060 3HD1 LEU 44 3HD1 LEU 134 -4.205 4.768 0.870 1061 1HD2 LEU 44 2HD2 LEU 134 -3.148 7.988 2.553 1062 2HD2 LEU 44 3HD2 LEU 134 -3.474 6.264 2.816 1063 3HD2 LEU 44 1HD2 LEU 134 -1.992 6.769 1.973 1064 H ILE 45 H ILE 135 -4.929 11.164 -1.777 1065 HA ILE 45 HA ILE 135 -4.078 10.873 -4.467 1066 HB ILE 45 HB ILE 135 -5.976 12.325 -3.709 1067 1HG1 ILE 45 1HG1 ILE 135 -5.726 14.233 -5.327 1068 2HG1 ILE 45 2HG1 ILE 135 -4.052 13.780 -5.609 1069 1HG2 ILE 45 3HG2 ILE 135 -4.839 13.479 -1.835 1070 2HG2 ILE 45 1HG2 ILE 135 -3.827 14.396 -2.978 1071 3HG2 ILE 45 2HG2 ILE 135 -5.600 14.638 -2.940 1072 1HD1 ILE 45 1HD1 ILE 135 -6.514 11.983 -6.198 1073 2HD1 ILE 45 2HD1 ILE 135 -5.598 12.921 -7.403 1074 3HD1 ILE 45 3HD1 ILE 135 -4.821 11.557 -6.569 1075 H GLY 46 H GLY 136 -2.224 11.923 -2.297 1076 1HA GLY 46 1HA GLY 136 0.083 12.598 -4.304 1077 2HA GLY 46 2HA GLY 136 0.083 13.302 -2.704 1078 H PHE 47 H PHE 137 -0.892 9.938 -2.970 1079 HA PHE 47 HA PHE 137 1.856 8.870 -2.277 1080 1HB PHE 47 2HB PHE 137 0.509 9.951 -0.334 1081 2HB PHE 47 1HB PHE 137 -0.672 8.698 -0.472 1082 HD1 PHE 47 HD2 PHE 137 3.025 9.213 0.180 1083 HD2 PHE 47 HD1 PHE 137 -0.304 6.496 0.476 1084 HE1 PHE 47 HE2 PHE 137 4.458 7.499 1.256 1085 HE2 PHE 47 HE1 PHE 137 1.155 4.848 1.568 1086 HZ PHE 47 HZ PHE 137 3.576 5.338 1.807 1087 H GLY 48 H GLY 138 -1.548 7.883 -3.014 1088 1HA GLY 48 1HA GLY 138 -0.826 5.317 -3.996 1089 2HA GLY 48 2HA GLY 138 -1.162 5.075 -2.299 1090 H ASN 49 H ASN 139 -2.374 3.567 -3.672 1091 HA ASN 49 HA ASN 139 -5.260 4.167 -3.267 1092 1HB ASN 49 1HB ASN 139 -5.015 5.098 -5.581 1093 2HB ASN 49 2HB ASN 139 -4.320 3.597 -6.155 1094 1HD2 ASN 49 1HD2 ASN 139 -7.790 3.388 -7.300 1095 2HD2 ASN 49 2HD2 ASN 139 -6.169 4.160 -7.677 1096 H PHE 50 H PHE 140 -5.423 2.447 -1.939 1097 HA PHE 50 HA PHE 140 -4.166 -0.204 -2.605 1098 1HB PHE 50 2HB PHE 140 -6.131 0.338 -0.339 1099 2HB PHE 50 1HB PHE 140 -5.347 -1.186 -0.644 1100 HD1 PHE 50 HD1 PHE 140 -4.761 2.368 0.264 1101 HD2 PHE 50 HD2 PHE 140 -3.471 -1.709 0.617 1102 HE1 PHE 50 HE1 PHE 140 -3.122 3.027 2.023 1103 HE2 PHE 50 HE2 PHE 140 -1.874 -1.030 2.385 1104 HZ PHE 50 HZ PHE 140 -1.638 1.335 2.958 1105 H GLU 51 H GLU 141 -5.185 -1.851 -3.509 1106 HA GLU 51 HA GLU 141 -8.047 -2.216 -3.422 1107 1HB GLU 51 1HB GLU 141 -8.672 -2.069 -5.864 1108 2HB GLU 51 2HB GLU 141 -8.159 -0.515 -5.248 1109 1HG GLU 51 1HG GLU 141 -5.863 -0.843 -6.322 1110 2HG GLU 51 2HG GLU 141 -6.413 -2.378 -6.987 1111 HE1 GLU 51 HE2 GLU 141 -8.370 -0.994 -9.483 1112 H VAL 52 H VAL 142 -8.863 -4.214 -4.326 1113 HA VAL 52 HA VAL 142 -6.758 -6.212 -3.958 1114 HB VAL 52 HB VAL 142 -9.324 -5.614 -2.878 1115 1HG1 VAL 52 1HG2 VAL 142 -9.813 -7.826 -4.893 1116 2HG1 VAL 52 2HG2 VAL 142 -10.859 -7.364 -3.503 1117 3HG1 VAL 52 3HG2 VAL 142 -10.536 -6.211 -4.837 1118 1HG2 VAL 52 1HG1 VAL 142 -7.759 -8.182 -2.712 1119 2HG2 VAL 52 2HG1 VAL 142 -7.711 -6.739 -1.656 1120 3HG2 VAL 52 3HG1 VAL 142 -9.155 -7.750 -1.724 1121 NH1 ARG 53 NH2 ARG 143 -7.280 -4.430 -9.840 1122 NH2 ARG 53 NH1 ARG 143 -5.189 -3.719 -9.304 1123 H ARG 53 H ARG 143 -6.799 -8.268 -5.194 1124 HA ARG 53 HA ARG 143 -7.835 -7.967 -8.074 1125 1HB ARG 53 1HB ARG 143 -5.127 -7.651 -7.574 1126 2HB ARG 53 2HB ARG 143 -5.172 -9.381 -7.714 1127 1HG ARG 53 1HG ARG 143 -4.592 -8.573 -9.834 1128 2HG ARG 53 2HG ARG 143 -6.176 -9.309 -9.947 1129 1HD ARG 53 1HD ARG 143 -6.113 -7.270 -11.325 1130 2HD ARG 53 2HD ARG 143 -7.278 -7.060 -10.030 1131 1HH1 ARG 53 2HH2 ARG 143 -7.882 -5.212 -10.120 1132 2HH1 ARG 53 1HH2 ARG 143 -7.569 -3.458 -9.680 1133 1HH2 ARG 53 1HH1 ARG 143 -4.199 -3.957 -9.175 1134 2HH2 ARG 53 2HH1 ARG 143 -5.620 -2.797 -9.181 1135 H GLU 54 H GLU 144 -9.479 -9.386 -7.984 1136 HA GLU 54 HA GLU 144 -9.365 -12.028 -6.770 1137 1HB GLU 54 1HB GLU 144 -11.404 -12.616 -7.779 1138 2HB GLU 54 2HB GLU 144 -11.501 -11.011 -7.114 1139 1HG GLU 54 1HG GLU 144 -11.274 -11.697 -10.118 1140 2HG GLU 54 2HG GLU 144 -12.753 -11.336 -9.252 1141 HE2 GLU 54 HE2 GLU 144 -10.482 -8.406 -10.691 1142 NH1 ARG 55 NH2 ARG 145 -4.672 -20.323 -6.826 1143 NH2 ARG 55 NH1 ARG 145 -3.494 -20.746 -8.723 1144 H ARG 55 H ARG 145 -8.244 -13.741 -7.305 1145 HA ARG 55 HA ARG 145 -6.465 -13.841 -9.586 1146 1HB ARG 55 1HB ARG 145 -6.011 -14.910 -7.375 1147 2HB ARG 55 2HB ARG 145 -7.319 -16.047 -7.626 1148 1HG ARG 55 1HG ARG 145 -6.051 -17.010 -9.624 1149 2HG ARG 55 2HG ARG 145 -4.688 -15.967 -9.205 1150 1HD ARG 55 1HD ARG 145 -4.487 -17.114 -6.975 1151 2HD ARG 55 2HD ARG 145 -5.998 -17.995 -7.267 1152 1HH1 ARG 55 2HH2 ARG 145 -5.202 -19.643 -6.270 1153 2HH1 ARG 55 1HH2 ARG 145 -4.480 -21.300 -6.580 1154 1HH2 ARG 55 1HH1 ARG 145 -3.127 -20.392 -9.613 1155 2HH2 ARG 55 2HH1 ARG 145 -3.384 -21.694 -8.346 1156 H ALA 56 H ALA 146 -6.377 -15.168 -11.355 1157 HA ALA 56 HA ALA 146 -8.948 -15.683 -12.749 1158 1HB ALA 56 3HB ALA 146 -7.032 -14.739 -13.978 1159 2HB ALA 56 1HB ALA 146 -6.060 -16.204 -13.681 1160 3HB ALA 56 2HB ALA 146 -7.521 -16.287 -14.692 1161 H ALA 57 H ALA 147 -9.829 -17.335 -11.367 1162 HA ALA 57 HA ALA 147 -9.113 -20.029 -11.075 1163 1HB ALA 57 2HB ALA 147 -11.877 -18.884 -11.979 1164 2HB ALA 57 3HB ALA 147 -11.648 -20.457 -11.223 1165 3HB ALA 57 1HB ALA 147 -11.296 -19.003 -10.300 1166 NH1 ARG 58 NH2 ARG 148 -4.457 -20.047 -13.161 1167 NH2 ARG 58 NH1 ARG 148 -5.322 -19.105 -15.041 1168 H ARG 58 H ARG 148 -9.343 -22.093 -12.112 1169 HA ARG 58 HA ARG 148 -8.329 -21.676 -14.877 1170 1HB ARG 58 2HB ARG 148 -8.334 -24.248 -13.272 1171 2HB ARG 58 1HB ARG 148 -7.583 -24.071 -14.833 1172 1HG ARG 58 1HG ARG 148 -6.674 -22.363 -12.426 1173 2HG ARG 58 2HG ARG 148 -6.163 -24.011 -12.659 1174 1HD ARG 58 1HD ARG 148 -4.399 -22.706 -13.573 1175 2HD ARG 58 2HD ARG 148 -5.205 -23.451 -14.929 1176 1HH1 ARG 58 2HH2 ARG 148 -4.297 -20.902 -12.617 1177 2HH1 ARG 58 1HH2 ARG 148 -4.176 -19.094 -12.904 1178 1HH2 ARG 58 1HH1 ARG 148 -5.816 -19.239 -15.931 1179 2HH2 ARG 58 2HH1 ARG 148 -4.980 -18.218 -14.656 1180 H LYS 59 H LYS 149 -9.178 -24.269 -15.859 1181 HA LYS 59 HA LYS 149 -12.205 -24.119 -15.860 1182 1HB LYS 59 1HB LYS 149 -11.310 -22.656 -17.816 1183 2HB LYS 59 2HB LYS 149 -10.781 -24.138 -18.583 1184 1HG LYS 59 1HG LYS 149 -12.911 -23.618 -19.545 1185 2HG LYS 59 2HG LYS 149 -13.216 -24.983 -18.483 1186 1HD LYS 59 1HD LYS 149 -14.009 -23.256 -16.682 1187 2HD LYS 59 2HD LYS 149 -13.834 -22.004 -17.908 1188 1HE LYS 59 1HE LYS 149 -15.540 -23.206 -19.359 1189 2HE LYS 59 2HE LYS 149 -15.662 -24.496 -18.149 1190 1HZ LYS 59 1HZ LYS 149 -16.313 -21.642 -17.658 1191 2HZ LYS 59 2HZ LYS 149 -16.418 -22.836 -16.545 1192 H GLY 60 H GLY 150 -13.008 -26.007 -15.506 1193 1HA GLY 60 1HA GLY 150 -11.515 -28.579 -16.329 1194 2HA GLY 60 2HA GLY 150 -12.529 -28.465 -14.905 1195 NH1 ARG 61 NH2 ARG 151 -13.877 -33.711 -22.955 1196 NH2 ARG 61 NH1 ARG 151 -14.312 -34.989 -21.127 1197 H ARG 61 H ARG 151 -13.329 -30.409 -16.368 1198 HA ARG 61 HA ARG 151 -15.871 -29.518 -17.743 1199 1HB ARG 61 1HB ARG 151 -13.896 -29.242 -19.377 1200 2HB ARG 61 2HB ARG 151 -13.584 -30.960 -19.247 1201 1HG ARG 61 1HG ARG 151 -16.394 -30.672 -20.063 1202 2HG ARG 61 2HG ARG 151 -15.531 -29.393 -20.846 1203 1HD ARG 61 1HD ARG 151 -15.614 -31.314 -22.365 1204 2HD ARG 61 2HD ARG 151 -13.931 -31.053 -21.898 1205 1HH1 ARG 61 2HH2 ARG 151 -13.914 -32.782 -23.390 1206 2HH1 ARG 61 1HH2 ARG 151 -13.515 -34.573 -23.377 1207 1HH2 ARG 61 1HH1 ARG 151 -14.678 -35.038 -20.169 1208 2HH2 ARG 61 2HH1 ARG 151 -13.919 -35.763 -21.674 1209 H ASN 62 H ASN 152 -17.346 -30.895 -18.006 1210 HA ASN 62 HA ASN 152 -17.213 -33.622 -16.753 1211 1HB ASN 62 1HB ASN 152 -18.999 -31.785 -16.276 1212 2HB ASN 62 2HB ASN 152 -19.670 -32.124 -17.852 1213 1HD2 ASN 62 2HD2 ASN 152 -20.615 -34.641 -14.836 1214 2HD2 ASN 62 1HD2 ASN 152 -19.432 -33.257 -14.603 1215 HA PRO 63 HA PRO 153 -17.007 -35.677 -20.922 1216 1HB PRO 63 1HB PRO 153 -18.499 -37.903 -19.439 1217 2HB PRO 63 2HB PRO 153 -17.125 -38.036 -20.557 1218 1HG PRO 63 1HG PRO 153 -16.680 -38.151 -17.882 1219 2HG PRO 63 2HG PRO 153 -15.581 -37.185 -18.895 1220 1HD PRO 63 1HD PRO 153 -17.866 -36.179 -17.116 1221 2HD PRO 63 2HD PRO 153 -16.224 -35.504 -17.359 1222 H GLN 64 H GLN 154 -20.164 -35.573 -19.280 1223 HA GLN 64 HA GLN 154 -21.793 -36.269 -21.653 1224 1HB GLN 64 1HB GLN 154 -22.525 -36.613 -19.244 1225 2HB GLN 64 2HB GLN 154 -22.586 -34.876 -18.997 1226 1HG GLN 64 1HG GLN 154 -24.418 -34.608 -20.629 1227 2HG GLN 64 2HG GLN 154 -24.267 -36.282 -21.123 1228 1HE2 GLN 64 2HE2 GLN 154 -26.402 -35.430 -17.712 1229 2HE2 GLN 64 1HE2 GLN 154 -25.449 -34.148 -18.614 1230 H THR 65 H THR 155 -21.789 -33.310 -19.842 1231 HA THR 65 HA THR 155 -23.053 -31.715 -21.817 1232 HB THR 65 HB THR 155 -22.961 -29.885 -20.265 1233 HG1 THR 65 HG1 THR 155 -21.006 -31.386 -18.875 1234 1HG2 THR 65 1HG2 THR 155 -24.436 -31.887 -19.606 1235 2HG2 THR 65 2HG2 THR 155 -23.126 -32.460 -18.562 1236 3HG2 THR 65 3HG2 THR 155 -23.898 -30.901 -18.211 1237 H GLY 66 H GLY 156 -19.543 -31.808 -21.264 1238 1HA GLY 66 1HA GLY 156 -17.956 -31.123 -23.013 1239 2HA GLY 66 2HA GLY 156 -19.142 -30.088 -23.760 1240 H GLU 67 H GLU 157 -19.525 -28.925 -20.771 1241 HA GLU 67 HA GLU 157 -16.882 -27.496 -20.346 1242 1HB GLU 67 2HB GLU 157 -18.735 -26.352 -21.888 1243 2HB GLU 67 1HB GLU 157 -19.648 -26.120 -20.404 1244 1HG GLU 67 1HG GLU 157 -17.734 -24.816 -19.405 1245 2HG GLU 67 2HG GLU 157 -16.771 -25.067 -20.860 1246 HE1 GLU 67 HE2 GLU 157 -18.426 -22.716 -22.793 1247 H GLU 68 H GLU 158 -16.494 -27.352 -18.163 1248 HA GLU 68 HA GLU 158 -18.566 -28.442 -16.391 1249 1HB GLU 68 1HB GLU 158 -16.981 -29.906 -16.103 1250 2HB GLU 68 2HB GLU 158 -15.952 -28.749 -15.268 1251 1HG GLU 68 1HG GLU 158 -17.819 -28.637 -13.514 1252 2HG GLU 68 2HG GLU 158 -18.776 -29.742 -14.492 1253 HE1 GLU 68 HE2 GLU 158 -17.731 -31.686 -15.089 1254 H MET 69 H MET 159 -16.283 -27.031 -14.929 1255 HA MET 69 HA MET 159 -17.464 -24.218 -14.419 1256 1HB MET 69 1HB MET 159 -17.364 -24.394 -12.085 1257 2HB MET 69 2HB MET 159 -18.041 -25.918 -12.576 1258 1HG MET 69 1HG MET 159 -15.054 -25.563 -11.745 1259 2HG MET 69 2HG MET 159 -16.359 -25.941 -10.637 1260 1HE MET 69 1HE MET 159 -14.466 -27.341 -13.937 1261 2HE MET 69 3HE MET 159 -13.509 -27.675 -12.465 1262 3HE MET 69 2HE MET 159 -14.275 -29.008 -13.366 1263 H GLU 70 H GLU 160 -16.194 -22.632 -13.432 1264 HA GLU 70 HA GLU 160 -13.318 -22.564 -14.203 1265 1HB GLU 70 2HB GLU 160 -13.219 -20.285 -13.657 1266 2HB GLU 70 1HB GLU 160 -14.694 -20.539 -14.573 1267 1HG GLU 70 1HG GLU 160 -14.510 -20.066 -11.519 1268 2HG GLU 70 2HG GLU 160 -14.885 -18.858 -12.725 1269 HE2 GLU 70 HE2 GLU 160 -15.999 -21.320 -10.861 1270 H ILE 71 H ILE 161 -11.647 -23.090 -12.874 1271 HA ILE 71 HA ILE 161 -12.214 -24.154 -10.257 1272 HB ILE 71 HB ILE 161 -9.561 -24.255 -11.606 1273 1HG1 ILE 71 1HG1 ILE 161 -11.980 -26.047 -12.241 1274 2HG1 ILE 71 2HG1 ILE 161 -11.180 -24.982 -13.367 1275 1HG2 ILE 71 2HG2 ILE 161 -10.107 -25.118 -9.168 1276 2HG2 ILE 71 3HG2 ILE 161 -11.009 -26.399 -10.002 1277 3HG2 ILE 71 1HG2 ILE 161 -9.240 -26.178 -10.317 1278 1HD1 ILE 71 3HD1 ILE 161 -9.068 -26.386 -13.253 1279 2HD1 ILE 71 1HD1 ILE 161 -9.921 -27.525 -12.177 1280 3HD1 ILE 71 2HD1 ILE 161 -10.488 -27.281 -13.833 1281 HA PRO 72 HA PRO 162 -10.397 -21.351 -7.427 1282 1HB PRO 72 1HB PRO 162 -7.750 -21.177 -6.814 1283 2HB PRO 72 2HB PRO 162 -8.584 -22.736 -6.911 1284 1HG PRO 72 1HG PRO 162 -6.902 -21.393 -9.123 1285 2HG PRO 72 2HG PRO 162 -6.723 -23.042 -8.476 1286 1HD PRO 72 1HD PRO 162 -8.271 -22.499 -10.758 1287 2HD PRO 72 2HD PRO 162 -8.580 -23.815 -9.621 1288 H ALA 73 H ALA 163 -10.994 -19.395 -7.176 1289 HA ALA 73 HA ALA 163 -9.251 -17.053 -8.118 1290 1HB ALA 73 2HB ALA 163 -11.661 -16.781 -8.853 1291 2HB ALA 73 3HB ALA 163 -12.180 -16.884 -7.126 1292 3HB ALA 73 1HB ALA 163 -11.160 -15.547 -7.675 1293 H SER 74 H SER 164 -8.951 -15.466 -6.703 1294 HA SER 74 HA SER 164 -10.235 -15.270 -4.254 1295 1HB SER 74 1HB SER 164 -8.590 -17.115 -3.395 1296 2HB SER 74 2HB SER 164 -7.239 -16.010 -3.669 1297 HG SER 74 HG SER 164 -7.975 -16.026 -1.536 1298 H LYS 75 H LYS 165 -9.975 -13.341 -3.188 1299 HA LYS 75 HA LYS 165 -8.866 -11.159 -4.869 1300 1HB LYS 75 2HB LYS 165 -9.836 -10.270 -2.215 1301 2HB LYS 75 1HB LYS 165 -9.946 -9.575 -3.800 1302 1HG LYS 75 1HG LYS 165 -11.721 -11.386 -4.382 1303 2HG LYS 75 2HG LYS 165 -11.705 -11.800 -2.665 1304 1HD LYS 75 1HD LYS 165 -12.235 -9.259 -2.200 1305 2HD LYS 75 2HD LYS 165 -12.430 -9.090 -3.938 1306 1HE LYS 75 1HE LYS 165 -14.637 -9.324 -3.054 1307 2HE LYS 75 2HE LYS 165 -14.297 -10.839 -3.890 1308 1HZ LYS 75 1HZ LYS 165 -15.328 -11.167 -1.734 1309 2HZ LYS 75 2HZ LYS 165 -14.129 -10.372 -0.958 1310 H VAL 76 H VAL 166 -6.738 -10.519 -4.852 1311 HA VAL 76 HA VAL 166 -5.043 -11.112 -2.593 1312 HB VAL 76 HB VAL 166 -5.159 -11.449 -5.396 1313 1HG1 VAL 76 3HG2 VAL 166 -4.463 -9.098 -5.773 1314 2HG1 VAL 76 1HG2 VAL 166 -2.921 -9.462 -4.979 1315 3HG1 VAL 76 2HG2 VAL 166 -3.418 -10.337 -6.494 1316 1HG2 VAL 76 3HG1 VAL 166 -4.163 -12.899 -3.921 1317 2HG2 VAL 76 1HG1 VAL 166 -3.161 -12.490 -5.344 1318 3HG2 VAL 76 2HG1 VAL 166 -2.757 -11.761 -3.730 1319 HA PRO 77 HA PRO 167 -5.146 -6.578 -1.874 1320 1HB PRO 77 1HB PRO 167 -3.718 -6.463 0.540 1321 2HB PRO 77 2HB PRO 167 -5.289 -7.264 0.439 1322 1HG PRO 77 1HG PRO 167 -2.522 -8.538 0.283 1323 2HG PRO 77 2HG PRO 167 -3.872 -9.055 1.290 1324 1HD PRO 77 1HD PRO 167 -3.182 -10.160 -1.307 1325 2HD PRO 77 2HD PRO 167 -4.839 -10.240 -0.664 1326 H ALA 78 H ALA 168 -4.200 -4.969 -2.438 1327 HA ALA 78 HA ALA 168 -1.176 -4.793 -2.818 1328 1HB ALA 78 3HB ALA 168 -2.357 -5.790 -4.829 1329 2HB ALA 78 1HB ALA 168 -3.372 -4.340 -4.957 1330 3HB ALA 78 2HB ALA 168 -1.613 -4.213 -5.207 1331 H PHE 79 H PHE 169 -0.525 -2.777 -3.521 1332 HA PHE 79 HA PHE 169 -2.023 -0.264 -2.531 1333 1HB PHE 79 2HB PHE 169 -1.099 -0.673 -0.605 1334 2HB PHE 79 1HB PHE 169 0.414 -1.310 -1.295 1335 HD1 PHE 79 HD1 PHE 169 -1.434 1.883 -0.622 1336 HD2 PHE 79 HD2 PHE 169 2.305 0.122 -1.814 1337 HE1 PHE 79 HE1 PHE 169 -0.329 4.068 -0.428 1338 HE2 PHE 79 HE2 PHE 169 3.382 2.323 -1.669 1339 HZ PHE 79 HZ PHE 169 2.070 4.302 -1.016 1340 H LYS 80 H LYS 170 -1.727 1.044 -3.971 1341 HA LYS 80 HA LYS 170 0.267 1.159 -6.397 1342 1HB LYS 80 2HB LYS 170 -2.205 2.784 -5.716 1343 2HB LYS 80 1HB LYS 170 -1.076 3.264 -6.942 1344 1HG LYS 80 1HG LYS 170 -2.677 0.630 -6.945 1345 2HG LYS 80 2HG LYS 170 -3.122 2.085 -7.805 1346 1HD LYS 80 1HD LYS 170 -0.640 0.349 -8.354 1347 2HD LYS 80 2HD LYS 170 -2.103 0.381 -9.306 1348 1HE LYS 80 1HE LYS 170 -0.122 2.745 -9.022 1349 2HE LYS 80 2HE LYS 170 -0.200 1.622 -10.372 1350 1HZ LYS 80 1HZ LYS 170 -2.370 3.477 -9.573 1351 2HZ LYS 80 2HZ LYS 170 -1.347 3.683 -10.831 1352 HA PRO 81 HA PRO 171 2.408 4.329 -3.833 1353 1HB PRO 81 1HB PRO 171 4.591 4.737 -5.466 1354 2HB PRO 81 2HB PRO 171 4.373 3.241 -4.545 1355 1HG PRO 81 1HG PRO 171 3.684 3.717 -7.493 1356 2HG PRO 81 2HG PRO 171 4.671 2.401 -6.804 1357 1HD PRO 81 1HD PRO 171 1.954 2.180 -7.394 1358 2HD PRO 81 2HD PRO 171 2.712 1.236 -6.069 1359 H GLY 82 H GLY 172 0.077 4.955 -5.342 1360 1HA GLY 82 1HA GLY 172 -1.058 6.345 -6.939 1361 2HA GLY 82 2HA GLY 172 -0.399 7.453 -5.759 1362 H LYS 83 H LYS 173 1.798 6.039 -7.910 1363 HA LYS 83 HA LYS 173 3.264 6.990 -9.609 1364 1HB LYS 83 2HB LYS 173 0.784 8.577 -10.208 1365 2HB LYS 83 1HB LYS 173 2.217 9.478 -10.534 1366 1HG LYS 83 1HG LYS 173 3.064 7.556 -12.013 1367 2HG LYS 83 2HG LYS 173 1.597 6.646 -11.640 1368 1HD LYS 83 1HD LYS 173 0.193 8.480 -12.685 1369 2HD LYS 83 2HD LYS 173 1.661 9.390 -13.059 1370 1HE LYS 83 1HE LYS 173 2.472 7.477 -14.530 1371 2HE LYS 83 2HE LYS 173 1.000 6.567 -14.156 1372 1HZ LYS 83 1HZ LYS 173 -0.301 8.329 -15.160 1373 2HZ LYS 83 2HZ LYS 173 0.781 7.723 -16.224 1374 H ALA 84 H ALA 174 1.872 9.270 -7.619 1375 HA ALA 84 HA ALA 174 3.729 11.458 -7.362 1376 1HB ALA 84 2HB ALA 174 1.316 11.361 -6.645 1377 2HB ALA 84 3HB ALA 174 1.704 10.113 -5.433 1378 3HB ALA 84 1HB ALA 174 2.347 11.764 -5.233 1379 H LEU 85 H LEU 175 3.430 8.475 -5.243 1380 HA LEU 85 HA LEU 175 5.751 9.144 -3.627 1381 1HB LEU 85 2HB LEU 175 3.954 7.600 -2.771 1382 2HB LEU 85 1HB LEU 175 4.341 6.460 -4.058 1383 HG LEU 85 HG LEU 175 6.676 6.468 -3.225 1384 1HD1 LEU 85 3HD1 LEU 175 5.458 7.871 -0.821 1385 2HD1 LEU 85 1HD1 LEU 175 7.029 7.006 -0.727 1386 3HD1 LEU 85 2HD1 LEU 175 6.839 8.407 -1.796 1387 1HD2 LEU 85 3HD2 LEU 175 5.107 4.532 -2.760 1388 2HD2 LEU 85 1HD2 LEU 175 6.124 4.772 -1.328 1389 3HD2 LEU 85 2HD2 LEU 175 4.444 5.366 -1.337 1390 H LYS 86 H LYS 176 5.298 7.256 -6.602 1391 HA LYS 86 HA LYS 176 8.074 6.361 -6.935 1392 1HB LYS 86 1HB LYS 176 6.129 6.918 -9.230 1393 2HB LYS 86 2HB LYS 176 7.726 6.221 -9.413 1394 1HG LYS 86 1HG LYS 176 7.094 4.316 -7.878 1395 2HG LYS 86 2HG LYS 176 5.469 4.969 -7.767 1396 1HD LYS 86 1HD LYS 176 6.824 4.046 -10.386 1397 2HD LYS 86 2HD LYS 176 5.773 3.044 -9.393 1398 1HE LYS 86 1HE LYS 176 3.844 4.659 -9.768 1399 2HE LYS 86 2HE LYS 176 4.882 5.649 -10.805 1400 1HZ LYS 86 1HZ LYS 176 4.204 2.804 -11.296 1401 2HZ LYS 86 2HZ LYS 176 5.171 3.715 -12.248 1402 H ASP 87 H ASP 177 6.724 9.601 -7.361 1403 HA ASP 87 HA ASP 177 9.124 10.712 -8.703 1404 1HB ASP 87 1HB ASP 177 6.327 11.413 -8.239 1405 2HB ASP 87 2HB ASP 177 7.195 12.514 -7.272 1406 HD1 ASP 87 HD2 ASP 177 6.820 11.211 -10.370 1407 H ALA 88 H ALA 178 7.785 10.635 -5.351 1408 HA ALA 88 HA ALA 178 9.767 12.192 -3.912 1409 1HB ALA 88 3HB ALA 178 7.704 11.080 -2.761 1410 2HB ALA 88 1HB ALA 178 8.480 9.508 -2.949 1411 3HB ALA 88 2HB ALA 178 9.230 10.689 -1.914 1412 H VAL 89 H VAL 179 9.704 8.703 -4.639 1413 HA VAL 89 HA VAL 179 12.318 8.129 -3.465 1414 HB VAL 89 HB VAL 179 9.793 7.153 -3.304 1415 1HG1 VAL 89 2HG2 VAL 179 9.772 6.932 -5.917 1416 2HG1 VAL 89 3HG2 VAL 179 10.612 5.406 -5.664 1417 3HG1 VAL 89 1HG2 VAL 179 9.015 5.705 -4.905 1418 1HG2 VAL 89 1HG1 VAL 179 11.573 6.256 -2.134 1419 2HG2 VAL 89 2HG1 VAL 179 10.458 5.025 -2.794 1420 3HG2 VAL 89 3HG1 VAL 179 12.082 5.269 -3.563 1421 H LYS 90 H LYS 180 11.660 9.160 -6.597 1422 HA LYS 90 HA LYS 180 12.988 7.266 -8.276 1423 1HB LYS 90 1HB LYS 180 11.415 9.421 -8.720 1424 2HB LYS 90 2HB LYS 180 12.908 10.291 -8.885 1425 1HG LYS 90 1HG LYS 180 13.547 8.907 -10.852 1426 2HG LYS 90 2HG LYS 180 12.283 7.736 -10.497 1427 1HD LYS 90 1HD LYS 180 11.452 9.025 -12.319 1428 2HD LYS 90 2HD LYS 180 10.496 9.464 -10.912 1429 1HE LYS 90 1HE LYS 180 11.903 11.597 -10.651 1430 2HE LYS 90 2HE LYS 180 12.830 11.139 -12.087 1431 1HZ LYS 90 1HZ LYS 180 11.054 12.670 -12.602 1432 2HZ LYS 90 2HZ LYS 180 9.913 11.679 -11.980 Start of MODEL 6 Raw file had 1432 H/Q atoms Start of MODEL 6 1 1H MET 1 1H MET 1 -9.893 5.782 1.993 2 2H MET 1 2H MET 1 -10.770 7.161 2.024 3 HA MET 1 HA MET 1 -9.977 5.657 -0.371 4 1HB MET 1 1HB MET 1 -12.658 5.829 1.074 5 2HB MET 1 2HB MET 1 -12.436 5.174 -0.546 6 1HG MET 1 1HG MET 1 -12.561 3.297 0.869 7 2HG MET 1 2HG MET 1 -10.845 3.422 0.506 8 1HE MET 1 1HE MET 1 -9.826 2.237 2.342 9 2HE MET 1 3HE MET 1 -8.976 3.796 2.598 10 3HE MET 1 2HE MET 1 -9.603 2.883 3.987 11 H ASN 2 H ASN 2 -9.203 7.990 -0.322 12 HA ASN 2 HA ASN 2 -9.169 9.258 -2.579 13 1HB ASN 2 1HB ASN 2 -10.433 11.065 -3.071 14 2HB ASN 2 2HB ASN 2 -11.435 9.639 -2.907 15 1HD2 ASN 2 1HD2 ASN 2 -13.747 11.612 -1.093 16 2HD2 ASN 2 2HD2 ASN 2 -13.333 10.232 -2.232 17 H LYS 3 H LYS 3 -9.492 9.833 0.660 18 HA LYS 3 HA LYS 3 -7.287 10.334 1.875 19 1HB LYS 3 1HB LYS 3 -6.414 11.889 -0.078 20 2HB LYS 3 2HB LYS 3 -7.555 13.083 0.447 21 1HG LYS 3 1HG LYS 3 -5.468 13.775 1.324 22 2HG LYS 3 2HG LYS 3 -6.222 13.080 2.745 23 1HD LYS 3 1HD LYS 3 -4.889 10.978 2.476 24 2HD LYS 3 2HD LYS 3 -4.291 11.516 0.905 25 1HE LYS 3 1HE LYS 3 -3.058 13.432 1.954 26 2HE LYS 3 2HE LYS 3 -3.640 12.953 3.552 27 1HZ LYS 3 1HZ LYS 3 -2.494 10.842 3.290 28 2HZ LYS 3 2HZ LYS 3 -1.452 12.093 3.143 29 H THR 4 H THR 4 -10.344 12.050 1.221 30 HA THR 4 HA THR 4 -10.548 13.050 3.946 31 HB THR 4 HB THR 4 -12.218 13.261 1.350 32 HG1 THR 4 HG1 THR 4 -10.177 14.324 1.228 33 1HG2 THR 4 3HG2 THR 4 -12.262 14.701 4.017 34 2HG2 THR 4 1HG2 THR 4 -13.192 15.203 2.527 35 3HG2 THR 4 2HG2 THR 4 -13.520 13.611 3.322 36 H GLU 5 H GLU 5 -11.722 10.461 1.811 37 HA GLU 5 HA GLU 5 -13.944 9.561 3.658 38 1HB GLU 5 1HB GLU 5 -12.476 7.824 1.657 39 2HB GLU 5 2HB GLU 5 -14.012 7.457 2.421 40 1HG GLU 5 1HG GLU 5 -13.360 9.502 0.264 41 2HG GLU 5 2HG GLU 5 -14.149 7.972 0.010 42 HE2 GLU 5 HE2 GLU 5 -16.231 11.215 1.201 43 H LEU 6 H LEU 6 -10.554 9.569 3.435 44 HA LEU 6 HA LEU 6 -9.820 7.211 5.083 45 1HB LEU 6 2HB LEU 6 -8.428 9.073 3.376 46 2HB LEU 6 1HB LEU 6 -7.898 9.551 4.969 47 HG LEU 6 HG LEU 6 -7.666 6.740 3.843 48 1HD1 LEU 6 2HD1 LEU 6 -6.113 8.318 2.749 49 2HD1 LEU 6 3HD1 LEU 6 -5.503 8.840 4.334 50 3HD1 LEU 6 1HD1 LEU 6 -5.230 7.173 3.776 51 1HD2 LEU 6 3HD2 LEU 6 -7.438 7.698 6.666 52 2HD2 LEU 6 1HD2 LEU 6 -7.697 6.072 6.020 53 3HD2 LEU 6 2HD2 LEU 6 -6.067 6.776 6.099 54 H ILE 7 H ILE 7 -10.160 10.765 5.562 55 HA ILE 7 HA ILE 7 -9.562 10.856 8.396 56 HB ILE 7 HB ILE 7 -11.374 12.784 6.808 57 1HG1 ILE 7 1HG1 ILE 7 -8.372 13.144 7.302 58 2HG1 ILE 7 2HG1 ILE 7 -8.942 12.377 5.878 59 1HG2 ILE 7 2HG2 ILE 7 -11.512 13.150 9.333 60 2HG2 ILE 7 3HG2 ILE 7 -9.759 13.343 9.377 61 3HG2 ILE 7 1HG2 ILE 7 -10.752 14.525 8.521 62 1HD1 ILE 7 3HD1 ILE 7 -10.378 14.495 5.386 63 2HD1 ILE 7 1HD1 ILE 7 -9.301 15.295 6.523 64 3HD1 ILE 7 2HD1 ILE 7 -8.619 14.487 5.086 65 H ASN 8 H ASN 8 -12.717 10.691 6.736 66 HA ASN 8 HA ASN 8 -14.244 10.323 9.252 67 1HB ASN 8 1HB ASN 8 -15.071 9.617 6.333 68 2HB ASN 8 2HB ASN 8 -16.156 9.500 7.697 69 1HD2 ASN 8 2HD2 ASN 8 -15.708 13.163 6.027 70 2HD2 ASN 8 1HD2 ASN 8 -14.822 11.679 5.409 71 H ALA 9 H ALA 9 -12.326 8.033 7.548 72 HA ALA 9 HA ALA 9 -13.693 5.567 8.615 73 1HB ALA 9 2HB ALA 9 -11.926 5.532 6.579 74 2HB ALA 9 3HB ALA 9 -10.688 5.959 7.762 75 3HB ALA 9 1HB ALA 9 -11.493 4.432 7.947 76 H VAL 10 H VAL 10 -10.905 7.662 9.484 77 HA VAL 10 HA VAL 10 -10.078 5.981 11.594 78 HB VAL 10 HB VAL 10 -9.180 8.866 11.499 79 1HG1 VAL 10 3HG2 VAL 10 -8.319 6.878 13.081 80 2HG1 VAL 10 1HG2 VAL 10 -7.247 6.600 11.673 81 3HG1 VAL 10 2HG2 VAL 10 -7.257 8.186 12.456 82 1HG2 VAL 10 1HG1 VAL 10 -8.646 6.761 9.394 83 2HG2 VAL 10 2HG1 VAL 10 -9.171 8.476 9.308 84 3HG2 VAL 10 3HG1 VAL 10 -7.465 8.111 9.713 85 H ALA 11 H ALA 11 -11.507 9.070 11.424 86 HA ALA 11 HA ALA 11 -11.976 9.157 14.205 87 1HB ALA 11 2HB ALA 11 -11.911 11.241 12.749 88 2HB ALA 11 3HB ALA 11 -13.429 10.752 11.955 89 3HB ALA 11 1HB ALA 11 -13.430 11.245 13.681 90 H GLU 12 H GLU 12 -13.875 7.537 11.788 91 HA GLU 12 HA GLU 12 -16.208 7.211 13.659 92 1HB GLU 12 1HB GLU 12 -16.635 7.289 11.171 93 2HB GLU 12 2HB GLU 12 -15.691 5.823 10.964 94 1HG GLU 12 1HG GLU 12 -18.020 5.231 10.863 95 2HG GLU 12 2HG GLU 12 -17.387 4.534 12.340 96 HE2 GLU 12 HE2 GLU 12 -19.445 6.327 14.451 97 H THR 13 H THR 13 -13.523 5.097 12.411 98 HA THR 13 HA THR 13 -14.281 3.135 14.587 99 HB THR 13 HB THR 13 -13.862 2.653 12.081 100 HG1 THR 13 HG1 THR 13 -13.447 0.516 12.715 101 1HG2 THR 13 1HG2 THR 13 -11.520 3.248 11.820 102 2HG2 THR 13 2HG2 THR 13 -11.045 2.057 13.063 103 3HG2 THR 13 3HG2 THR 13 -11.780 1.518 11.529 104 H SER 14 H SER 14 -12.668 5.541 14.885 105 HA SER 14 HA SER 14 -11.018 4.397 17.234 106 1HB SER 14 1HB SER 14 -9.462 5.071 15.334 107 2HB SER 14 2HB SER 14 -9.975 6.751 15.543 108 HG SER 14 HG SER 14 -8.103 6.254 16.670 109 H GLY 15 H GLY 15 -13.004 7.202 16.180 110 1HA GLY 15 1HA GLY 15 -13.995 8.929 17.455 111 2HA GLY 15 2HA GLY 15 -13.763 7.927 18.885 112 H LEU 16 H LEU 16 -11.746 9.719 16.655 113 HA LEU 16 HA LEU 16 -10.422 11.376 18.814 114 1HB LEU 16 1HB LEU 16 -8.515 11.574 17.368 115 2HB LEU 16 2HB LEU 16 -8.804 9.997 18.075 116 HG LEU 16 HG LEU 16 -9.593 9.067 16.147 117 1HD1 LEU 16 2HD1 LEU 16 -10.970 10.981 15.200 118 2HD1 LEU 16 3HD1 LEU 16 -9.411 11.664 14.644 119 3HD1 LEU 16 1HD1 LEU 16 -10.035 10.073 14.010 120 1HD2 LEU 16 3HD2 LEU 16 -7.474 8.650 16.081 121 2HD2 LEU 16 1HD2 LEU 16 -8.343 8.633 14.524 122 3HD2 LEU 16 2HD2 LEU 16 -7.276 9.980 14.879 123 H SER 17 H SER 17 -9.930 12.682 16.210 124 HA SER 17 HA SER 17 -12.343 14.566 16.035 125 1HB SER 17 1HB SER 17 -9.514 15.710 16.090 126 2HB SER 17 2HB SER 17 -11.011 16.588 15.872 127 HG SER 17 HG SER 17 -11.682 15.886 17.928 128 H LYS 18 H LYS 18 -12.445 15.777 14.088 129 HA LYS 18 HA LYS 18 -11.756 14.304 11.561 130 1HB LYS 18 1HB LYS 18 -12.924 17.120 12.041 131 2HB LYS 18 2HB LYS 18 -12.523 16.560 10.443 132 1HG LYS 18 1HG LYS 18 -14.496 15.072 12.278 133 2HG LYS 18 2HG LYS 18 -14.989 16.360 11.209 134 1HD LYS 18 1HD LYS 18 -13.637 13.774 10.170 135 2HD LYS 18 2HD LYS 18 -15.354 13.953 10.420 136 1HE LYS 18 1HE LYS 18 -15.132 14.353 8.121 137 2HE LYS 18 2HE LYS 18 -15.383 15.954 8.794 138 1HZ LYS 18 1HZ LYS 18 -12.759 14.786 8.028 139 2HZ LYS 18 2HZ LYS 18 -12.960 16.283 8.653 140 H LYS 19 H LYS 19 -10.600 17.283 13.087 141 HA LYS 19 HA LYS 19 -8.227 17.674 11.371 142 1HB LYS 19 2HB LYS 19 -8.709 18.619 14.257 143 2HB LYS 19 1HB LYS 19 -7.303 19.093 13.309 144 1HG LYS 19 1HG LYS 19 -10.225 19.759 12.584 145 2HG LYS 19 2HG LYS 19 -9.101 20.821 13.415 146 1HD LYS 19 1HD LYS 19 -7.555 20.781 11.400 147 2HD LYS 19 2HD LYS 19 -8.716 19.760 10.544 148 1HE LYS 19 1HE LYS 19 -10.478 21.585 10.753 149 2HE LYS 19 2HE LYS 19 -9.306 22.614 11.591 150 1HZ LYS 19 1HZ LYS 19 -7.908 22.554 9.629 151 2HZ LYS 19 2HZ LYS 19 -9.392 23.141 9.273 152 H ASP 20 H ASP 20 -8.687 15.655 14.371 153 HA ASP 20 HA ASP 20 -5.744 14.997 14.464 154 1HB ASP 20 1HB ASP 20 -8.159 13.812 15.960 155 2HB ASP 20 2HB ASP 20 -6.614 13.006 16.011 156 HD1 ASP 20 HD2 ASP 20 -4.924 15.359 17.915 157 H ALA 21 H ALA 21 -8.533 13.542 12.910 158 HA ALA 21 HA ALA 21 -7.128 11.069 12.036 159 1HB ALA 21 2HB ALA 21 -9.844 12.356 11.326 160 2HB ALA 21 3HB ALA 21 -9.236 10.858 10.559 161 3HB ALA 21 1HB ALA 21 -9.503 10.934 12.275 162 H THR 22 H THR 22 -7.874 14.217 10.409 163 HA THR 22 HA THR 22 -6.533 13.712 7.911 164 HB THR 22 HB THR 22 -6.579 16.459 9.336 165 HG1 THR 22 HG1 THR 22 -8.715 15.212 7.982 166 1HG2 THR 22 3HG2 THR 22 -6.937 15.544 6.420 167 2HG2 THR 22 1HG2 THR 22 -7.126 17.228 6.991 168 3HG2 THR 22 2HG2 THR 22 -5.527 16.407 7.091 169 H LYS 23 H LYS 23 -5.242 15.087 10.845 170 HA LYS 23 HA LYS 23 -2.426 15.370 10.034 171 1HB LYS 23 2HB LYS 23 -3.818 14.724 12.756 172 2HB LYS 23 1HB LYS 23 -2.104 14.948 12.689 173 1HG LYS 23 1HG LYS 23 -2.301 17.323 11.942 174 2HG LYS 23 2HG LYS 23 -4.050 17.181 11.822 175 1HD LYS 23 1HD LYS 23 -4.149 16.640 14.324 176 2HD LYS 23 2HD LYS 23 -2.404 16.887 14.421 177 1HE LYS 23 1HE LYS 23 -2.711 19.295 13.648 178 2HE LYS 23 2HE LYS 23 -4.460 19.034 13.539 179 1HZ LYS 23 1HZ LYS 23 -2.821 18.813 16.003 180 2HZ LYS 23 2HZ LYS 23 -3.819 20.051 15.620 181 H ALA 24 H ALA 24 -3.967 12.811 11.864 182 HA ALA 24 HA ALA 24 -1.783 11.027 12.187 183 1HB ALA 24 2HB ALA 24 -3.772 10.952 13.499 184 2HB ALA 24 3HB ALA 24 -4.770 10.475 12.088 185 3HB ALA 24 1HB ALA 24 -3.525 9.355 12.746 186 H VAL 25 H VAL 25 -4.054 11.097 9.486 187 HA VAL 25 HA VAL 25 -2.864 8.884 7.827 188 HB VAL 25 HB VAL 25 -4.647 11.520 7.593 189 1HG1 VAL 25 1HG2 VAL 25 -3.688 10.045 5.088 190 2HG1 VAL 25 2HG2 VAL 25 -5.048 11.219 5.162 191 3HG1 VAL 25 3HG2 VAL 25 -3.409 11.735 5.530 192 1HG2 VAL 25 2HG1 VAL 25 -5.248 8.619 6.913 193 2HG2 VAL 25 3HG1 VAL 25 -5.754 9.478 8.386 194 3HG2 VAL 25 1HG1 VAL 25 -6.408 9.992 6.822 195 H ASP 26 H ASP 26 -2.396 12.488 7.653 196 HA ASP 26 HA ASP 26 0.235 12.141 6.208 197 1HB ASP 26 1HB ASP 26 -1.032 14.594 7.593 198 2HB ASP 26 2HB ASP 26 0.449 14.666 6.649 199 HD1 ASP 26 HD2 ASP 26 -1.038 14.385 3.515 200 H ALA 27 H ALA 27 -0.251 11.155 8.914 201 HA ALA 27 HA ALA 27 2.438 11.685 10.215 202 1HB ALA 27 3HB ALA 27 0.071 12.028 11.519 203 2HB ALA 27 1HB ALA 27 0.227 10.287 11.704 204 3HB ALA 27 2HB ALA 27 1.456 11.404 12.317 205 H VAL 28 H VAL 28 0.261 9.107 9.239 206 HA VAL 28 HA VAL 28 2.287 6.928 9.367 207 HB VAL 28 HB VAL 28 -0.178 6.953 7.438 208 1HG1 VAL 28 1HG2 VAL 28 1.883 4.959 8.253 209 2HG1 VAL 28 2HG2 VAL 28 0.219 4.343 8.258 210 3HG1 VAL 28 3HG2 VAL 28 0.855 5.115 6.788 211 1HG2 VAL 28 3HG1 VAL 28 -0.281 6.122 10.305 212 2HG2 VAL 28 1HG1 VAL 28 -1.283 7.286 9.345 213 3HG2 VAL 28 2HG1 VAL 28 -1.398 5.561 8.991 214 H PHE 29 H PHE 29 0.681 8.547 6.768 215 HA PHE 29 HA PHE 29 2.563 7.786 4.599 216 1HB PHE 29 2HB PHE 29 0.213 9.751 4.403 217 2HB PHE 29 1HB PHE 29 0.970 8.920 3.060 218 HD1 PHE 29 HD1 PHE 29 1.122 6.143 3.501 219 HD2 PHE 29 HD2 PHE 29 -1.878 8.843 4.972 220 HE1 PHE 29 HE1 PHE 29 -0.323 4.240 4.081 221 HE2 PHE 29 HE2 PHE 29 -3.341 6.955 5.468 222 HZ PHE 29 HZ PHE 29 -2.565 4.636 4.996 223 H ASP 30 H ASP 30 3.080 10.190 6.831 224 HA ASP 30 HA ASP 30 4.783 11.718 4.815 225 1HB ASP 30 1HB ASP 30 3.443 12.840 6.767 226 2HB ASP 30 2HB ASP 30 4.640 12.205 7.873 227 HD2 ASP 30 HD2 ASP 30 5.696 15.523 7.417 228 H SER 31 H SER 31 5.115 9.732 7.644 229 HA SER 31 HA SER 31 8.097 9.490 7.576 230 1HB SER 31 1HB SER 31 6.125 7.507 8.830 231 2HB SER 31 2HB SER 31 7.864 7.591 9.139 232 HG SER 31 HG SER 31 6.668 8.652 10.727 233 H ILE 32 H ILE 32 5.459 7.433 5.945 234 HA ILE 32 HA ILE 32 7.156 5.476 4.797 235 HB ILE 32 HB ILE 32 4.544 6.546 3.746 236 1HG1 ILE 32 1HG1 ILE 32 5.264 4.586 5.960 237 2HG1 ILE 32 2HG1 ILE 32 4.400 6.092 6.064 238 1HG2 ILE 32 1HG2 ILE 32 6.116 4.950 2.309 239 2HG2 ILE 32 2HG2 ILE 32 5.848 3.743 3.543 240 3HG2 ILE 32 3HG2 ILE 32 4.470 4.344 2.617 241 1HD1 ILE 32 3HD1 ILE 32 3.117 3.819 4.622 242 2HD1 ILE 32 1HD1 ILE 32 2.965 4.185 6.379 243 3HD1 ILE 32 2HD1 ILE 32 2.450 5.406 5.173 244 H THR 33 H THR 33 5.859 8.455 3.317 245 HA THR 33 HA THR 33 7.512 8.132 0.876 246 HB THR 33 HB THR 33 5.564 9.503 0.693 247 HG1 THR 33 HG1 THR 33 6.318 11.489 -0.002 248 1HG2 THR 33 3HG2 THR 33 5.337 10.152 3.142 249 2HG2 THR 33 1HG2 THR 33 6.528 11.409 2.930 250 3HG2 THR 33 2HG2 THR 33 4.941 11.471 2.058 251 H GLU 34 H GLU 34 8.254 9.630 3.972 252 HA GLU 34 HA GLU 34 10.957 10.627 3.099 253 1HB GLU 34 1HB GLU 34 9.778 10.180 5.922 254 2HB GLU 34 2HB GLU 34 11.425 10.724 5.639 255 1HG GLU 34 1HG GLU 34 10.639 12.791 4.490 256 2HG GLU 34 2HG GLU 34 8.960 12.295 4.641 257 HE1 GLU 34 HE2 GLU 34 8.126 12.026 6.640 258 H ALA 35 H ALA 35 9.631 7.585 4.500 259 HA ALA 35 HA ALA 35 12.212 6.236 4.693 260 1HB ALA 35 3HB ALA 35 9.815 5.189 5.627 261 2HB ALA 35 1HB ALA 35 9.455 4.829 3.966 262 3HB ALA 35 2HB ALA 35 10.778 4.029 4.715 263 H LEU 36 H LEU 36 9.800 6.191 2.052 264 HA LEU 36 HA LEU 36 11.321 4.574 0.173 265 1HB LEU 36 2HB LEU 36 9.187 6.522 -0.491 266 2HB LEU 36 1HB LEU 36 9.636 5.065 -1.352 267 HG LEU 36 HG LEU 36 8.110 5.147 1.281 268 1HD1 LEU 36 1HD2 LEU 36 6.767 5.019 -0.689 269 2HD1 LEU 36 2HD2 LEU 36 7.597 3.466 -1.158 270 3HD1 LEU 36 3HD2 LEU 36 6.618 3.571 0.343 271 1HD2 LEU 36 2HD1 LEU 36 9.906 3.474 1.773 272 2HD2 LEU 36 3HD1 LEU 36 8.330 2.733 1.640 273 3HD2 LEU 36 1HD1 LEU 36 9.490 2.605 0.270 274 NH1 ARG 37 NH2 ARG 37 9.297 14.027 -0.165 275 NH2 ARG 37 NH1 ARG 37 10.668 14.964 -1.717 276 H ARG 37 H ARG 37 10.951 8.158 0.413 277 HA ARG 37 HA ARG 37 12.660 8.528 -1.824 278 1HB ARG 37 1HB ARG 37 12.567 10.802 -1.676 279 2HB ARG 37 2HB ARG 37 11.051 10.286 -0.988 280 1HG ARG 37 1HG ARG 37 12.446 10.506 1.348 281 2HG ARG 37 2HG ARG 37 13.524 11.503 0.388 282 1HD ARG 37 1HD ARG 37 10.533 11.871 0.838 283 2HD ARG 37 2HD ARG 37 11.843 12.759 1.655 284 1HH1 ARG 37 1HH2 ARG 37 8.577 14.657 -0.533 285 2HH1 ARG 37 2HH2 ARG 37 9.189 13.347 0.596 286 1HH2 ARG 37 1HH1 ARG 37 11.602 15.001 -2.140 287 2HH2 ARG 37 2HH1 ARG 37 9.851 15.527 -1.978 288 H LYS 38 H LYS 38 13.420 7.845 1.530 289 HA LYS 38 HA LYS 38 16.259 8.896 1.277 290 1HB LYS 38 1HB LYS 38 14.745 9.607 3.193 291 2HB LYS 38 2HB LYS 38 14.854 7.966 3.823 292 1HG LYS 38 1HG LYS 38 17.385 8.317 4.042 293 2HG LYS 38 2HG LYS 38 17.197 9.949 3.419 294 1HD LYS 38 1HD LYS 38 15.892 8.837 5.993 295 2HD LYS 38 2HD LYS 38 17.385 9.762 5.933 296 1HE LYS 38 1HE LYS 38 16.130 11.768 5.000 297 2HE LYS 38 2HE LYS 38 14.615 10.858 5.082 298 1HZ LYS 38 1HZ LYS 38 16.349 11.549 7.381 299 2HZ LYS 38 2HZ LYS 38 14.916 12.242 7.005 300 H GLY 39 H GLY 39 14.767 6.004 0.605 301 1HA GLY 39 1HA GLY 39 15.636 3.772 0.338 302 2HA GLY 39 2HA GLY 39 17.185 4.298 0.947 303 H ASP 40 H ASP 40 14.197 4.554 2.803 304 HA ASP 40 HA ASP 40 15.095 2.430 4.782 305 1HB ASP 40 1HB ASP 40 12.995 4.469 5.437 306 2HB ASP 40 2HB ASP 40 13.795 3.365 6.500 307 HD1 ASP 40 HD2 ASP 40 16.806 5.156 6.700 308 H LYS 41 H LYS 41 13.927 0.764 5.406 309 HA LYS 41 HA LYS 41 11.561 -0.007 3.674 310 1HB LYS 41 2HB LYS 41 12.794 -1.769 5.800 311 2HB LYS 41 1HB LYS 41 11.615 -2.243 4.590 312 1HG LYS 41 1HG LYS 41 13.348 -1.721 2.769 313 2HG LYS 41 2HG LYS 41 14.539 -1.446 4.037 314 1HD LYS 41 1HD LYS 41 14.221 -3.816 4.872 315 2HD LYS 41 2HD LYS 41 12.965 -4.072 3.671 316 1HE LYS 41 1HE LYS 41 14.940 -5.124 2.805 317 2HE LYS 41 2HE LYS 41 14.655 -3.704 1.802 318 1HZ LYS 41 1HZ LYS 41 16.963 -3.925 2.395 319 2HZ LYS 41 2HZ LYS 41 16.370 -2.539 3.027 320 H VAL 42 H VAL 42 9.598 0.455 4.398 321 HA VAL 42 HA VAL 42 8.851 1.045 7.132 322 HB VAL 42 HB VAL 42 7.432 0.807 4.396 323 1HG1 VAL 42 3HG2 VAL 42 5.844 0.914 6.263 324 2HG1 VAL 42 1HG2 VAL 42 6.604 2.490 6.770 325 3HG1 VAL 42 2HG2 VAL 42 5.797 2.343 5.172 326 1HG2 VAL 42 1HG1 VAL 42 8.526 3.280 5.867 327 2HG2 VAL 42 2HG1 VAL 42 9.175 2.571 4.331 328 3HG2 VAL 42 3HG1 VAL 42 7.604 3.348 4.355 329 H GLN 43 H GLN 43 7.403 -0.056 8.033 330 HA GLN 43 HA GLN 43 6.864 -3.010 7.382 331 1HB GLN 43 1HB GLN 43 8.446 -2.393 9.853 332 2HB GLN 43 2HB GLN 43 7.659 -3.929 9.516 333 1HG GLN 43 1HG GLN 43 9.004 -4.069 7.365 334 2HG GLN 43 2HG GLN 43 9.781 -2.543 7.770 335 1HE2 GLN 43 2HE2 GLN 43 12.345 -4.846 8.808 336 2HE2 GLN 43 1HE2 GLN 43 11.592 -4.053 7.340 337 H LEU 44 H LEU 44 5.096 -3.912 7.945 338 HA LEU 44 HA LEU 44 3.207 -2.667 9.968 339 1HB LEU 44 2HB LEU 44 2.260 -3.422 7.151 340 2HB LEU 44 1HB LEU 44 1.255 -2.790 8.440 341 HG LEU 44 HG LEU 44 3.473 -1.225 6.973 342 1HD1 LEU 44 2HD1 LEU 44 0.415 -1.198 6.535 343 2HD1 LEU 44 3HD1 LEU 44 1.575 -0.100 5.761 344 3HD1 LEU 44 1HD1 LEU 44 1.641 -1.838 5.408 345 1HD2 LEU 44 2HD2 LEU 44 2.954 -0.288 9.256 346 2HD2 LEU 44 3HD2 LEU 44 2.415 0.805 7.968 347 3HD2 LEU 44 1HD2 LEU 44 1.227 -0.203 8.838 348 H ILE 45 H ILE 45 2.638 -4.412 11.260 349 HA ILE 45 HA ILE 45 2.932 -7.196 10.242 350 HB ILE 45 HB ILE 45 3.665 -6.523 12.537 351 1HG1 ILE 45 1HG1 ILE 45 1.751 -8.928 12.510 352 2HG1 ILE 45 2HG1 ILE 45 3.324 -8.918 11.731 353 1HG2 ILE 45 1HG2 ILE 45 1.603 -5.188 13.162 354 2HG2 ILE 45 2HG2 ILE 45 0.685 -6.707 13.289 355 3HG2 ILE 45 3HG2 ILE 45 2.059 -6.393 14.394 356 1HD1 ILE 45 3HD1 ILE 45 4.467 -8.499 13.947 357 2HD1 ILE 45 1HD1 ILE 45 2.882 -8.578 14.764 358 3HD1 ILE 45 2HD1 ILE 45 3.521 -10.006 13.923 359 H GLY 46 H GLY 46 1.345 -8.665 10.063 360 1HA GLY 46 1HA GLY 46 -0.662 -9.463 9.018 361 2HA GLY 46 2HA GLY 46 -1.482 -8.383 10.115 362 H PHE 47 H PHE 47 0.391 -6.586 7.843 363 HA PHE 47 HA PHE 47 -1.771 -6.433 5.748 364 1HB PHE 47 2HB PHE 47 -1.949 -4.829 7.817 365 2HB PHE 47 1HB PHE 47 -0.548 -3.992 7.220 366 HD1 PHE 47 HD1 PHE 47 -4.149 -4.761 6.537 367 HD2 PHE 47 HD2 PHE 47 -0.697 -2.661 5.061 368 HE1 PHE 47 HE1 PHE 47 -5.520 -3.659 4.810 369 HE2 PHE 47 HE2 PHE 47 -2.089 -1.611 3.326 370 HZ PHE 47 HZ PHE 47 -4.479 -2.216 3.129 371 H GLY 48 H GLY 48 1.694 -5.512 6.511 372 1HA GLY 48 1HA GLY 48 2.573 -5.867 3.872 373 2HA GLY 48 2HA GLY 48 2.044 -4.185 3.891 374 H ASN 49 H ASN 49 4.277 -4.525 3.001 375 HA ASN 49 HA ASN 49 6.123 -3.198 4.989 376 1HB ASN 49 1HB ASN 49 6.665 -5.592 5.288 377 2HB ASN 49 2HB ASN 49 6.874 -5.818 3.568 378 1HD2 ASN 49 1HD2 ASN 49 10.264 -5.598 5.180 379 2HD2 ASN 49 2HD2 ASN 49 8.737 -6.570 5.481 380 H PHE 50 H PHE 50 6.250 -1.335 3.847 381 HA PHE 50 HA PHE 50 6.477 -1.350 0.851 382 1HB PHE 50 2HB PHE 50 6.857 1.191 2.516 383 2HB PHE 50 1HB PHE 50 6.772 1.112 0.823 384 HD1 PHE 50 HD1 PHE 50 4.839 0.362 3.950 385 HD2 PHE 50 HD2 PHE 50 4.786 1.941 -0.046 386 HE1 PHE 50 HE1 PHE 50 2.577 1.305 4.326 387 HE2 PHE 50 HE2 PHE 50 2.537 2.871 0.381 388 HZ PHE 50 HZ PHE 50 1.381 2.271 2.470 389 H GLU 51 H GLU 51 8.250 -0.848 -0.260 390 HA GLU 51 HA GLU 51 10.637 0.246 0.976 391 1HB GLU 51 1HB GLU 51 12.286 -1.662 0.689 392 2HB GLU 51 2HB GLU 51 11.060 -2.017 1.883 393 1HG GLU 51 1HG GLU 51 9.808 -3.430 0.113 394 2HG GLU 51 2HG GLU 51 11.151 -3.147 -0.991 395 HE1 GLU 51 HE2 GLU 51 11.482 -5.638 2.199 396 H VAL 52 H VAL 52 12.298 0.971 -0.414 397 HA VAL 52 HA VAL 52 11.239 1.288 -3.131 398 HB VAL 52 HB VAL 52 12.232 2.952 -1.028 399 1HG1 VAL 52 1HG2 VAL 52 14.487 2.655 -3.021 400 2HG1 VAL 52 2HG2 VAL 52 14.271 3.976 -1.810 401 3HG1 VAL 52 3HG2 VAL 52 14.486 2.275 -1.287 402 1HG2 VAL 52 3HG1 VAL 52 11.886 3.628 -3.958 403 2HG2 VAL 52 1HG1 VAL 52 10.655 3.625 -2.660 404 3HG2 VAL 52 2HG1 VAL 52 11.992 4.760 -2.606 405 NH1 ARG 53 NH2 ARG 53 13.430 -1.101 -11.580 406 NH2 ARG 53 NH1 ARG 53 14.853 0.606 -11.100 407 H ARG 53 H ARG 53 12.586 1.151 -4.939 408 HA ARG 53 HA ARG 53 14.690 -1.104 -4.826 409 1HB ARG 53 1HB ARG 53 12.479 -1.769 -5.867 410 2HB ARG 53 2HB ARG 53 12.651 -0.512 -7.043 411 1HG ARG 53 1HG ARG 53 15.127 -2.108 -7.137 412 2HG ARG 53 2HG ARG 53 13.785 -3.214 -6.988 413 1HD ARG 53 1HD ARG 53 14.144 -2.990 -9.330 414 2HD ARG 53 2HD ARG 53 12.663 -2.080 -9.010 415 1HH1 ARG 53 2HH2 ARG 53 12.943 -1.941 -11.247 416 2HH1 ARG 53 1HH2 ARG 53 13.377 -0.690 -12.519 417 1HH2 ARG 53 1HH1 ARG 53 15.449 1.068 -10.405 418 2HH2 ARG 53 2HH1 ARG 53 14.700 0.898 -12.072 419 H GLU 54 H GLU 54 16.220 0.499 -4.410 420 HA GLU 54 HA GLU 54 16.686 2.756 -6.331 421 1HB GLU 54 1HB GLU 54 18.483 3.491 -4.924 422 2HB GLU 54 2HB GLU 54 16.976 3.280 -4.063 423 1HG GLU 54 1HG GLU 54 17.895 1.049 -3.116 424 2HG GLU 54 2HG GLU 54 19.440 1.433 -3.871 425 HE1 GLU 54 HE2 GLU 54 18.078 3.460 -0.624 426 NH1 ARG 55 NH2 ARG 55 21.566 -2.829 -12.319 427 NH2 ARG 55 NH1 ARG 55 21.984 -1.941 -14.370 428 H ARG 55 H ARG 55 17.693 2.540 -8.179 429 HA ARG 55 HA ARG 55 19.152 -0.021 -8.834 430 1HB ARG 55 1HB ARG 55 17.594 0.759 -10.481 431 2HB ARG 55 2HB ARG 55 18.249 2.378 -10.508 432 1HG ARG 55 1HG ARG 55 18.843 1.227 -12.539 433 2HG ARG 55 2HG ARG 55 20.303 1.622 -11.648 434 1HD ARG 55 1HD ARG 55 20.476 -0.767 -10.833 435 2HD ARG 55 2HD ARG 55 18.979 -1.180 -11.687 436 1HH1 ARG 55 2HH2 ARG 55 21.088 -2.732 -11.417 437 2HH1 ARG 55 1HH2 ARG 55 22.167 -3.606 -12.616 438 1HH2 ARG 55 1HH1 ARG 55 21.827 -1.172 -15.031 439 2HH2 ARG 55 2HH1 ARG 55 22.555 -2.779 -14.526 440 H ALA 56 H ALA 56 21.284 -0.203 -8.638 441 HA ALA 56 HA ALA 56 23.006 2.128 -7.812 442 1HB ALA 56 3HB ALA 56 23.735 -0.841 -8.205 443 2HB ALA 56 1HB ALA 56 24.798 0.418 -7.532 444 3HB ALA 56 2HB ALA 56 23.315 -0.042 -6.670 445 H ALA 57 H ALA 57 22.936 3.393 -9.694 446 HA ALA 57 HA ALA 57 23.387 2.949 -12.298 447 1HB ALA 57 3HB ALA 57 23.178 5.255 -11.325 448 2HB ALA 57 1HB ALA 57 24.869 5.198 -10.768 449 3HB ALA 57 2HB ALA 57 24.498 5.220 -12.506 450 NH1 ARG 58 NH2 ARG 58 26.686 -2.372 -9.165 451 NH2 ARG 58 NH1 ARG 58 24.728 -3.529 -9.131 452 H ARG 58 H ARG 58 24.460 2.012 -13.644 453 HA ARG 58 HA ARG 58 27.204 1.116 -12.918 454 1HB ARG 58 2HB ARG 58 25.379 -0.106 -15.049 455 2HB ARG 58 1HB ARG 58 26.896 -0.805 -14.509 456 1HG ARG 58 1HG ARG 58 24.320 -0.562 -12.867 457 2HG ARG 58 2HG ARG 58 24.928 -1.993 -13.678 458 1HD ARG 58 1HD ARG 58 26.983 -2.005 -12.180 459 2HD ARG 58 2HD ARG 58 26.360 -0.573 -11.337 460 1HH1 ARG 58 1HH2 ARG 58 26.829 -2.732 -8.215 461 2HH1 ARG 58 2HH2 ARG 58 27.319 -1.759 -9.691 462 1HH2 ARG 58 1HH1 ARG 58 23.871 -3.796 -9.627 463 2HH2 ARG 58 2HH1 ARG 58 25.004 -3.811 -8.184 464 H LYS 59 H LYS 59 28.122 0.340 -15.450 465 HA LYS 59 HA LYS 59 27.976 2.621 -17.360 466 1HB LYS 59 1HB LYS 59 29.856 3.307 -15.759 467 2HB LYS 59 2HB LYS 59 30.787 1.917 -16.309 468 1HG LYS 59 1HG LYS 59 30.706 2.832 -18.683 469 2HG LYS 59 2HG LYS 59 29.706 4.176 -18.132 470 1HD LYS 59 1HD LYS 59 31.593 4.912 -16.577 471 2HD LYS 59 2HD LYS 59 32.597 3.603 -17.215 472 1HE LYS 59 1HE LYS 59 32.391 4.616 -19.554 473 2HE LYS 59 2HE LYS 59 31.408 5.926 -18.893 474 1HZ LYS 59 1HZ LYS 59 33.291 6.522 -17.467 475 2HZ LYS 59 2HZ LYS 59 34.197 5.309 -18.083 476 H GLY 60 H GLY 60 27.521 1.601 -19.146 477 1HA GLY 60 1HA GLY 60 28.836 -1.090 -19.845 478 2HA GLY 60 2HA GLY 60 27.083 -0.974 -19.811 479 NH1 ARG 61 NH2 ARG 61 32.306 1.215 -26.347 480 NH2 ARG 61 NH1 ARG 61 33.788 -0.166 -25.319 481 H ARG 61 H ARG 61 26.557 -1.087 -21.896 482 HA ARG 61 HA ARG 61 27.796 0.841 -23.939 483 1HB ARG 61 1HB ARG 61 27.235 -2.173 -24.292 484 2HB ARG 61 2HB ARG 61 27.485 -1.110 -25.655 485 1HG ARG 61 1HG ARG 61 29.593 -1.508 -23.447 486 2HG ARG 61 2HG ARG 61 29.505 -2.466 -24.918 487 1HD ARG 61 1HD ARG 61 29.862 -0.451 -26.351 488 2HD ARG 61 2HD ARG 61 29.850 0.601 -24.929 489 1HH1 ARG 61 2HH2 ARG 61 31.323 1.456 -26.515 490 2HH1 ARG 61 1HH2 ARG 61 33.129 1.753 -26.641 491 1HH2 ARG 61 1HH1 ARG 61 33.941 -0.999 -24.739 492 2HH2 ARG 61 2HH1 ARG 61 34.507 0.456 -25.705 493 H ASN 62 H ASN 62 26.544 1.476 -25.603 494 HA ASN 62 HA ASN 62 23.663 1.772 -25.070 495 1HB ASN 62 1HB ASN 62 25.162 3.551 -26.059 496 2HB ASN 62 2HB ASN 62 25.246 2.627 -27.549 497 1HD2 ASN 62 2HD2 ASN 62 22.020 4.989 -27.001 498 2HD2 ASN 62 1HD2 ASN 62 23.356 4.852 -25.751 499 HA PRO 63 HA PRO 63 22.395 -2.097 -27.217 500 1HB PRO 63 1HB PRO 63 19.801 -0.545 -27.730 501 2HB PRO 63 2HB PRO 63 20.007 -2.218 -27.169 502 1HG PRO 63 1HG PRO 63 19.454 -0.263 -25.368 503 2HG PRO 63 2HG PRO 63 20.684 -1.484 -24.963 504 1HD PRO 63 1HD PRO 63 21.138 1.389 -25.928 505 2HD PRO 63 2HD PRO 63 21.992 0.455 -24.659 506 H GLN 64 H GLN 64 21.860 0.925 -29.089 507 HA GLN 64 HA GLN 64 21.701 -0.654 -31.697 508 1HB GLN 64 1HB GLN 64 21.315 2.365 -31.276 509 2HB GLN 64 2HB GLN 64 21.080 1.494 -32.770 510 1HG GLN 64 1HG GLN 64 19.389 1.132 -30.205 511 2HG GLN 64 2HG GLN 64 19.075 2.232 -31.525 512 1HE2 GLN 64 2HE2 GLN 64 18.037 -1.721 -32.000 513 2HE2 GLN 64 1HE2 GLN 64 18.901 -1.095 -30.507 514 H THR 65 H THR 65 23.131 2.407 -30.833 515 HA THR 65 HA THR 65 25.320 2.358 -32.634 516 HB THR 65 HB THR 65 26.288 4.291 -31.505 517 HG1 THR 65 HG1 THR 65 26.068 3.559 -29.397 518 1HG2 THR 65 3HG2 THR 65 24.150 4.692 -32.824 519 2HG2 THR 65 1HG2 THR 65 23.214 4.499 -31.323 520 3HG2 THR 65 2HG2 THR 65 24.363 5.844 -31.475 521 H GLY 66 H GLY 66 25.582 1.152 -29.301 522 1HA GLY 66 1HA GLY 66 27.322 -0.209 -28.340 523 2HA GLY 66 2HA GLY 66 28.150 -0.257 -29.884 524 H GLU 67 H GLU 67 27.233 2.610 -27.969 525 HA GLU 67 HA GLU 67 30.153 3.483 -27.749 526 1HB GLU 67 2HB GLU 67 28.421 4.913 -28.996 527 2HB GLU 67 1HB GLU 67 27.576 5.179 -27.476 528 1HG GLU 67 1HG GLU 67 30.516 5.969 -28.032 529 2HG GLU 67 2HG GLU 67 29.145 7.020 -28.323 530 HE2 GLU 67 HE2 GLU 67 30.829 7.144 -24.843 531 H GLU 68 H GLU 68 30.968 3.832 -25.760 532 HA GLU 68 HA GLU 68 29.725 2.431 -23.538 533 1HB GLU 68 1HB GLU 68 32.272 2.615 -24.012 534 2HB GLU 68 2HB GLU 68 32.242 4.197 -23.263 535 1HG GLU 68 1HG GLU 68 31.418 3.121 -21.102 536 2HG GLU 68 2HG GLU 68 31.370 1.554 -21.901 537 HE2 GLU 68 HE2 GLU 68 34.716 0.885 -21.701 538 H MET 69 H MET 69 28.238 3.182 -22.213 539 HA MET 69 HA MET 69 28.102 6.124 -21.451 540 1HB MET 69 1HB MET 69 25.768 6.366 -22.059 541 2HB MET 69 2HB MET 69 26.721 5.928 -23.451 542 1HG MET 69 1HG MET 69 24.710 4.699 -23.718 543 2HG MET 69 2HG MET 69 25.844 3.470 -23.141 544 1HE MET 69 1HE MET 69 22.969 2.643 -22.966 545 2HE MET 69 3HE MET 69 24.171 1.729 -21.998 546 3HE MET 69 2HE MET 69 22.641 2.260 -21.250 547 H GLU 70 H GLU 70 27.177 6.595 -19.577 548 HA GLU 70 HA GLU 70 27.158 4.537 -17.488 549 1HB GLU 70 2HB GLU 70 26.729 6.236 -15.866 550 2HB GLU 70 1HB GLU 70 28.047 6.692 -16.942 551 1HG GLU 70 1HG GLU 70 26.448 8.267 -18.179 552 2HG GLU 70 2HG GLU 70 25.166 7.818 -17.058 553 HE1 GLU 70 HE2 GLU 70 28.141 10.319 -15.971 554 H ILE 71 H ILE 71 25.514 3.272 -16.752 555 HA ILE 71 HA ILE 71 22.801 3.557 -17.784 556 HB ILE 71 HB ILE 71 23.754 1.615 -15.607 557 1HG1 ILE 71 1HG1 ILE 71 25.438 1.203 -17.232 558 2HG1 ILE 71 2HG1 ILE 71 24.306 -0.124 -17.206 559 1HG2 ILE 71 2HG2 ILE 71 21.330 1.729 -16.018 560 2HG2 ILE 71 3HG2 ILE 71 21.589 1.417 -17.759 561 3HG2 ILE 71 1HG2 ILE 71 21.991 0.156 -16.550 562 1HD1 ILE 71 2HD1 ILE 71 23.247 0.747 -19.346 563 2HD1 ILE 71 3HD1 ILE 71 24.439 2.083 -19.349 564 3HD1 ILE 71 1HD1 ILE 71 24.987 0.396 -19.520 565 HA PRO 72 HA PRO 72 22.093 6.295 -14.116 566 1HB PRO 72 1HB PRO 72 19.564 7.289 -14.682 567 2HB PRO 72 2HB PRO 72 21.007 7.694 -15.620 568 1HG PRO 72 1HG PRO 72 18.905 5.561 -16.276 569 2HG PRO 72 2HG PRO 72 19.524 6.844 -17.345 570 1HD PRO 72 1HD PRO 72 20.540 4.261 -17.399 571 2HD PRO 72 2HD PRO 72 21.587 5.676 -17.717 572 H ALA 73 H ALA 73 20.962 6.553 -12.221 573 HA ALA 73 HA ALA 73 19.625 4.079 -11.098 574 1HB ALA 73 1HB ALA 73 21.367 5.247 -9.662 575 2HB ALA 73 2HB ALA 73 20.333 6.724 -9.623 576 3HB ALA 73 3HB ALA 73 19.780 5.228 -8.881 577 H SER 74 H SER 74 17.921 4.308 -9.712 578 HA SER 74 HA SER 74 16.586 6.604 -9.133 579 1HB SER 74 1HB SER 74 15.517 6.616 -11.512 580 2HB SER 74 2HB SER 74 14.667 5.121 -11.113 581 HG SER 74 HG SER 74 13.670 6.273 -9.400 582 H LYS 75 H LYS 75 15.077 6.414 -7.516 583 HA LYS 75 HA LYS 75 14.802 3.651 -6.298 584 1HB LYS 75 2HB LYS 75 13.639 5.776 -4.610 585 2HB LYS 75 1HB LYS 75 14.513 4.320 -4.256 586 1HG LYS 75 1HG LYS 75 16.680 5.523 -5.006 587 2HG LYS 75 2HG LYS 75 15.730 7.006 -5.107 588 1HD LYS 75 1HD LYS 75 15.096 6.754 -2.662 589 2HD LYS 75 2HD LYS 75 16.050 5.283 -2.550 590 1HE LYS 75 1HE LYS 75 17.209 8.072 -3.227 591 2HE LYS 75 2HE LYS 75 17.183 7.349 -1.619 592 1HZ LYS 75 1HZ LYS 75 19.291 7.004 -2.648 593 2HZ LYS 75 2HZ LYS 75 18.571 5.557 -2.409 594 H VAL 76 H VAL 76 12.938 2.437 -6.805 595 HA VAL 76 HA VAL 76 10.563 3.733 -7.766 596 HB VAL 76 HB VAL 76 12.449 1.365 -8.048 597 1HG1 VAL 76 3HG2 VAL 76 9.672 1.139 -8.887 598 2HG1 VAL 76 1HG2 VAL 76 11.126 0.122 -9.406 599 3HG1 VAL 76 2HG2 VAL 76 10.627 0.163 -7.701 600 1HG2 VAL 76 1HG1 VAL 76 11.160 3.191 -10.130 601 2HG2 VAL 76 2HG1 VAL 76 12.822 3.335 -9.486 602 3HG2 VAL 76 3HG1 VAL 76 12.381 1.909 -10.426 603 HA PRO 77 HA PRO 77 9.038 2.139 -3.671 604 1HB PRO 77 1HB PRO 77 6.593 3.464 -3.602 605 2HB PRO 77 2HB PRO 77 8.122 4.346 -3.567 606 1HG PRO 77 1HG PRO 77 6.341 3.817 -6.002 607 2HG PRO 77 2HG PRO 77 7.021 5.365 -5.473 608 1HD PRO 77 1HD PRO 77 8.278 3.653 -7.434 609 2HD PRO 77 2HD PRO 77 9.231 4.763 -6.410 610 H ALA 78 H ALA 78 8.034 0.696 -2.851 611 HA ALA 78 HA ALA 78 5.937 -0.980 -4.316 612 1HB ALA 78 2HB ALA 78 8.398 -1.724 -4.629 613 2HB ALA 78 3HB ALA 78 8.439 -2.076 -2.886 614 3HB ALA 78 1HB ALA 78 7.309 -2.951 -3.943 615 H PHE 79 H PHE 79 5.076 -2.615 -2.901 616 HA PHE 79 HA PHE 79 4.615 -1.990 0.107 617 1HB PHE 79 2HB PHE 79 3.147 -0.533 -0.585 618 2HB PHE 79 1HB PHE 79 2.536 -1.618 -1.895 619 HD1 PHE 79 HD1 PHE 79 2.472 -1.165 1.842 620 HD2 PHE 79 HD2 PHE 79 0.805 -3.221 -1.551 621 HE1 PHE 79 HE1 PHE 79 0.735 -2.155 3.273 622 HE2 PHE 79 HE2 PHE 79 -0.887 -4.240 -0.097 623 HZ PHE 79 HZ PHE 79 -0.914 -3.738 2.309 624 H LYS 80 H LYS 80 4.699 -3.965 0.748 625 HA LYS 80 HA LYS 80 4.051 -6.680 -0.709 626 1HB LYS 80 2HB LYS 80 5.270 -6.159 2.029 627 2HB LYS 80 1HB LYS 80 4.665 -7.709 1.492 628 1HG LYS 80 1HG LYS 80 6.308 -7.204 -0.642 629 2HG LYS 80 2HG LYS 80 7.111 -6.160 0.511 630 1HD LYS 80 1HD LYS 80 6.571 -9.190 0.825 631 2HD LYS 80 2HD LYS 80 8.084 -8.470 0.293 632 1HE LYS 80 1HE LYS 80 8.360 -7.340 2.550 633 2HE LYS 80 2HE LYS 80 6.851 -8.089 3.102 634 1HZ LYS 80 1HZ LYS 80 9.288 -9.533 2.227 635 2HZ LYS 80 2HZ LYS 80 8.788 -9.337 3.771 636 HA PRO 81 HA PRO 81 0.012 -6.373 1.423 637 1HB PRO 81 1HB PRO 81 -1.174 -8.642 0.427 638 2HB PRO 81 2HB PRO 81 -0.806 -7.274 -0.628 639 1HG PRO 81 1HG PRO 81 0.863 -9.818 -0.252 640 2HG PRO 81 2HG PRO 81 0.304 -9.097 -1.783 641 1HD PRO 81 1HD PRO 81 2.835 -8.626 -0.680 642 2HD PRO 81 2HD PRO 81 2.002 -7.412 -1.703 643 H GLY 82 H GLY 82 2.335 -7.194 2.871 644 1HA GLY 82 1HA GLY 82 3.380 -8.733 4.398 645 2HA GLY 82 2HA GLY 82 1.853 -8.383 5.177 646 H LYS 83 H LYS 83 1.690 -10.316 2.401 647 HA LYS 83 HA LYS 83 0.983 -12.595 2.026 648 1HB LYS 83 2HB LYS 83 2.596 -13.034 4.470 649 2HB LYS 83 1HB LYS 83 1.228 -14.055 4.548 650 1HG LYS 83 1HG LYS 83 3.247 -13.957 2.213 651 2HG LYS 83 2HG LYS 83 3.215 -15.167 3.480 652 1HD LYS 83 1HD LYS 83 1.033 -14.763 1.331 653 2HD LYS 83 2HD LYS 83 2.284 -15.993 1.320 654 1HE LYS 83 1HE LYS 83 1.324 -17.034 3.422 655 2HE LYS 83 2HE LYS 83 0.059 -15.796 3.465 656 1HZ LYS 83 1HZ LYS 83 -0.692 -17.822 2.426 657 2HZ LYS 83 2HZ LYS 83 0.477 -17.760 1.285 658 H ALA 84 H ALA 84 0.213 -11.387 5.030 659 HA ALA 84 HA ALA 84 -2.257 -12.674 5.849 660 1HB ALA 84 3HB ALA 84 -0.957 -9.911 6.364 661 2HB ALA 84 1HB ALA 84 -2.248 -10.621 7.371 662 3HB ALA 84 2HB ALA 84 -0.638 -11.411 7.274 663 H LEU 85 H LEU 85 -1.795 -9.408 4.193 664 HA LEU 85 HA LEU 85 -4.659 -9.006 3.747 665 1HB LEU 85 2HB LEU 85 -3.114 -7.053 3.785 666 2HB LEU 85 1HB LEU 85 -2.196 -7.720 2.446 667 HG LEU 85 HG LEU 85 -4.407 -7.774 1.188 668 1HD1 LEU 85 2HD1 LEU 85 -5.977 -7.196 3.004 669 2HD1 LEU 85 3HD1 LEU 85 -5.190 -5.611 3.206 670 3HD1 LEU 85 1HD1 LEU 85 -6.084 -5.986 1.708 671 1HD2 LEU 85 1HD2 LEU 85 -2.476 -6.249 0.584 672 2HD2 LEU 85 2HD2 LEU 85 -4.016 -5.450 0.265 673 3HD2 LEU 85 3HD2 LEU 85 -3.073 -5.019 1.719 674 H LYS 86 H LYS 86 -1.986 -10.515 1.945 675 HA LYS 86 HA LYS 86 -3.441 -11.087 -0.515 676 1HB LYS 86 1HB LYS 86 -0.882 -11.278 -0.122 677 2HB LYS 86 2HB LYS 86 -1.181 -12.872 0.546 678 1HG LYS 86 1HG LYS 86 -2.230 -13.578 -1.638 679 2HG LYS 86 2HG LYS 86 -1.972 -11.956 -2.289 680 1HD LYS 86 1HD LYS 86 0.528 -12.232 -1.974 681 2HD LYS 86 2HD LYS 86 0.268 -13.855 -1.323 682 1HE LYS 86 1HE LYS 86 -0.772 -14.578 -3.528 683 2HE LYS 86 2HE LYS 86 -0.530 -12.951 -4.180 684 1HZ LYS 86 1HZ LYS 86 1.842 -13.224 -3.893 685 2HZ LYS 86 2HZ LYS 86 1.231 -14.408 -4.841 686 H ASP 87 H ASP 87 -3.707 -12.695 2.628 687 HA ASP 87 HA ASP 87 -5.387 -14.903 1.493 688 1HB ASP 87 1HB ASP 87 -3.738 -14.483 3.843 689 2HB ASP 87 2HB ASP 87 -5.332 -14.333 4.463 690 HD1 ASP 87 HD2 ASP 87 -6.123 -17.725 4.004 691 H ALA 88 H ALA 88 -5.881 -11.849 3.333 692 HA ALA 88 HA ALA 88 -8.748 -11.862 3.775 693 1HB ALA 88 1HB ALA 88 -7.170 -9.940 4.524 694 2HB ALA 88 2HB ALA 88 -7.003 -9.442 2.835 695 3HB ALA 88 3HB ALA 88 -8.567 -9.322 3.594 696 H VAL 89 H VAL 89 -6.862 -10.927 0.862 697 HA VAL 89 HA VAL 89 -9.157 -9.853 -0.587 698 HB VAL 89 HB VAL 89 -6.699 -8.972 0.074 699 1HG1 VAL 89 2HG2 VAL 89 -5.575 -11.089 -0.847 700 2HG1 VAL 89 3HG2 VAL 89 -5.859 -10.446 -2.467 701 3HG1 VAL 89 1HG2 VAL 89 -4.897 -9.512 -1.275 702 1HG2 VAL 89 2HG1 VAL 89 -8.188 -7.765 -1.184 703 2HG2 VAL 89 3HG1 VAL 89 -6.498 -7.631 -1.743 704 3HG2 VAL 89 1HG1 VAL 89 -7.680 -8.626 -2.702 705 H LYS 90 H LYS 90 -7.473 -12.878 -0.549 706 HA LYS 90 HA LYS 90 -7.983 -13.772 -3.317 707 1HB LYS 90 1HB LYS 90 -6.866 -14.944 -0.735 708 2HB LYS 90 2HB LYS 90 -7.585 -16.104 -1.820 709 1HG LYS 90 1HG LYS 90 -6.141 -15.361 -3.713 710 2HG LYS 90 2HG LYS 90 -5.408 -14.120 -2.698 711 1HD LYS 90 1HD LYS 90 -4.572 -15.917 -1.114 712 2HD LYS 90 2HD LYS 90 -5.278 -17.166 -2.126 713 1HE LYS 90 1HE LYS 90 -3.103 -15.173 -3.074 714 2HE LYS 90 2HE LYS 90 -2.762 -16.772 -2.416 715 1HZ LYS 90 1HZ LYS 90 -4.361 -16.252 -4.860 716 2HZ LYS 90 2HZ LYS 90 -4.072 -17.734 -4.233 717 1H MET 1 1H MET 91 8.744 0.871 9.242 718 2H MET 1 2H MET 91 9.927 0.307 10.295 719 HA MET 1 HA MET 91 8.980 1.004 11.923 720 1HB MET 1 1HB MET 91 7.253 2.760 11.697 721 2HB MET 1 2HB MET 91 8.394 2.845 10.393 722 1HG MET 1 1HG MET 91 6.698 1.687 8.865 723 2HG MET 1 2HG MET 91 5.563 1.604 10.215 724 1HE MET 1 1HE MET 91 7.820 3.895 8.059 725 2HE MET 1 3HE MET 91 6.846 5.379 7.884 726 3HE MET 1 2HE MET 91 7.865 5.143 9.336 727 H ASN 2 H ASN 92 7.997 -1.433 11.110 728 HA ASN 2 HA ASN 92 6.359 -3.142 11.370 729 1HB ASN 2 1HB ASN 92 6.975 -4.518 13.324 730 2HB ASN 2 2HB ASN 92 8.180 -3.964 12.203 731 1HD2 ASN 2 1HD2 ASN 92 8.223 -2.093 15.875 732 2HD2 ASN 2 2HD2 ASN 92 6.778 -3.045 15.323 733 H LYS 3 H LYS 93 5.195 -1.141 11.909 734 HA LYS 3 HA LYS 93 2.903 -0.358 12.168 735 1HB LYS 3 1HB LYS 93 2.378 -2.997 11.924 736 2HB LYS 3 2HB LYS 93 2.009 -2.917 13.610 737 1HG LYS 3 1HG LYS 93 0.141 -1.349 13.192 738 2HG LYS 3 2HG LYS 93 0.739 -0.958 11.576 739 1HD LYS 3 1HD LYS 93 0.290 -3.334 10.829 740 2HD LYS 3 2HD LYS 93 -0.412 -3.691 12.412 741 1HE LYS 3 1HE LYS 93 -2.190 -1.932 12.021 742 2HE LYS 3 2HE LYS 93 -1.453 -1.507 10.469 743 1HZ LYS 3 1HZ LYS 93 -1.868 -3.784 9.726 744 2HZ LYS 3 2HZ LYS 93 -2.557 -4.174 11.157 745 H THR 4 H THR 94 4.983 -1.164 14.736 746 HA THR 4 HA THR 94 3.562 0.473 16.666 747 HB THR 4 HB THR 94 5.770 -1.682 16.580 748 HG1 THR 4 HG1 THR 94 4.202 -2.817 17.801 749 1HG2 THR 4 3HG2 THR 94 4.666 -0.126 18.922 750 2HG2 THR 4 1HG2 THR 94 5.632 -1.674 19.037 751 3HG2 THR 4 2HG2 THR 94 6.358 -0.193 18.307 752 H GLU 5 H GLU 95 6.601 0.377 14.762 753 HA GLU 5 HA GLU 95 7.639 2.854 16.128 754 1HB GLU 5 1HB GLU 95 8.658 2.243 13.410 755 2HB GLU 5 2HB GLU 95 9.450 2.960 14.747 756 1HG GLU 5 1HG GLU 95 9.592 0.619 15.864 757 2HG GLU 5 2HG GLU 95 8.923 -0.050 14.381 758 HE1 GLU 5 HE2 GLU 95 12.716 1.395 14.473 759 H LEU 6 H LEU 96 5.265 1.866 13.875 760 HA LEU 6 HA LEU 96 4.678 4.371 12.441 761 1HB LEU 6 2HB LEU 96 3.633 1.760 12.339 762 2HB LEU 6 1HB LEU 96 2.324 2.546 13.185 763 HG LEU 6 HG LEU 96 3.445 3.253 10.468 764 1HD1 LEU 6 3HD1 LEU 96 2.030 1.224 10.631 765 2HD1 LEU 6 1HD1 LEU 96 0.691 2.223 11.150 766 3HD1 LEU 6 2HD1 LEU 96 1.394 2.482 9.542 767 1HD2 LEU 6 1HD2 LEU 96 1.447 4.831 12.156 768 2HD2 LEU 6 2HD2 LEU 96 2.891 5.429 11.321 769 3HD2 LEU 6 3HD2 LEU 96 1.478 4.923 10.396 770 H ILE 7 H ILE 97 3.413 2.864 15.454 771 HA ILE 7 HA ILE 97 1.479 4.847 16.198 772 HB ILE 7 HB ILE 97 3.124 3.098 18.129 773 1HG1 ILE 7 1HG1 ILE 97 0.394 2.431 16.898 774 2HG1 ILE 7 2HG1 ILE 97 1.853 1.870 16.192 775 1HG2 ILE 7 2HG2 ILE 97 1.799 4.906 19.322 776 2HG2 ILE 7 3HG2 ILE 97 0.332 4.286 18.574 777 3HG2 ILE 7 1HG2 ILE 97 1.231 3.279 19.719 778 1HD1 ILE 7 3HD1 ILE 97 2.495 0.728 18.407 779 2HD1 ILE 7 1HD1 ILE 97 0.819 0.963 18.884 780 3HD1 ILE 7 2HD1 ILE 97 1.194 0.029 17.407 781 H ASN 8 H ASN 98 4.896 4.557 17.145 782 HA ASN 8 HA ASN 98 4.880 7.159 18.607 783 1HB ASN 8 1HB ASN 98 7.338 5.605 17.468 784 2HB ASN 8 2HB ASN 98 7.469 7.007 18.500 785 1HD2 ASN 8 2HD2 ASN 98 6.755 3.411 20.304 786 2HD2 ASN 8 1HD2 ASN 98 6.710 3.593 18.479 787 H ALA 9 H ALA 99 5.062 6.607 15.229 788 HA ALA 9 HA ALA 99 6.277 9.265 14.483 789 1HB ALA 9 2HB ALA 99 6.059 7.201 12.776 790 2HB ALA 9 3HB ALA 99 4.313 7.455 12.822 791 3HB ALA 9 1HB ALA 99 5.303 8.733 12.182 792 H VAL 10 H VAL 100 2.983 7.856 14.842 793 HA VAL 10 HA VAL 100 1.682 10.117 13.768 794 HB VAL 10 HB VAL 100 0.195 8.119 15.486 795 1HG1 VAL 10 3HG2 VAL 100 -0.800 10.151 14.025 796 2HG1 VAL 10 1HG2 VAL 100 -0.775 8.878 12.765 797 3HG1 VAL 10 2HG2 VAL 100 -1.647 8.590 14.278 798 1HG2 VAL 10 1HG1 VAL 100 1.579 7.549 12.859 799 2HG2 VAL 10 2HG1 VAL 100 1.523 6.678 14.423 800 3HG2 VAL 10 3HG1 VAL 100 0.086 6.634 13.361 801 H ALA 11 H ALA 101 1.955 8.766 16.880 802 HA ALA 11 HA ALA 101 0.738 10.999 18.108 803 1HB ALA 11 1HB ALA 101 0.880 8.724 19.234 804 2HB ALA 11 2HB ALA 101 2.648 8.894 19.386 805 3HB ALA 11 3HB ALA 101 1.553 9.945 20.345 806 H GLU 12 H GLU 102 4.033 10.689 17.087 807 HA GLU 12 HA GLU 102 4.902 13.083 18.677 808 1HB GLU 12 1HB GLU 102 6.567 11.255 18.123 809 2HB GLU 12 2HB GLU 102 6.376 11.598 16.414 810 1HG GLU 12 1HG GLU 102 8.440 12.591 17.156 811 2HG GLU 12 2HG GLU 102 7.355 13.910 16.765 812 HE2 GLU 12 HE2 GLU 102 7.269 15.217 19.960 813 H THR 13 H THR 103 4.118 12.416 15.193 814 HA THR 13 HA THR 103 4.089 15.406 14.773 815 HB THR 13 HB THR 103 5.273 13.656 13.347 816 HG1 THR 13 HG1 THR 103 3.778 15.754 12.178 817 1HG2 THR 13 3HG2 THR 103 3.441 12.230 12.612 818 2HG2 THR 13 1HG2 THR 103 2.654 13.607 11.795 819 3HG2 THR 13 2HG2 THR 103 4.242 13.012 11.235 820 H SER 14 H SER 104 1.948 13.783 15.916 821 HA SER 14 HA SER 104 -0.301 15.671 14.926 822 1HB SER 14 1HB SER 104 -0.708 13.316 14.066 823 2HB SER 14 2HB SER 104 -0.864 12.755 15.735 824 HG SER 14 HG SER 104 -2.841 13.250 14.820 825 H GLY 15 H GLY 105 1.019 14.026 17.838 826 1HA GLY 15 1HA GLY 105 0.582 14.395 20.128 827 2HA GLY 15 2HA GLY 105 -0.102 15.960 19.695 828 H LEU 16 H LEU 106 -0.981 12.597 19.224 829 HA LEU 16 HA LEU 106 -3.689 12.871 20.547 830 1HB LEU 16 1HB LEU 106 -4.420 11.001 19.236 831 2HB LEU 16 2HB LEU 106 -4.131 12.498 18.374 832 HG LEU 16 HG LEU 106 -2.170 11.802 17.439 833 1HD1 LEU 16 2HD1 LEU 106 -1.139 10.500 19.354 834 2HD1 LEU 16 3HD1 LEU 106 -2.261 9.177 18.903 835 3HD1 LEU 16 1HD1 LEU 106 -0.951 9.743 17.771 836 1HD2 LEU 16 2HD2 LEU 106 -3.649 11.268 15.955 837 2HD2 LEU 16 3HD2 LEU 106 -2.103 10.379 15.897 838 3HD2 LEU 16 1HD2 LEU 106 -3.532 9.552 16.492 839 H SER 17 H SER 107 -2.985 9.999 20.495 840 HA SER 17 HA SER 107 -1.490 9.696 23.145 841 1HB SER 17 1HB SER 107 -4.064 8.117 22.709 842 2HB SER 17 2HB SER 107 -2.980 8.046 24.077 843 HG SER 17 HG SER 107 -4.409 10.345 23.249 844 H LYS 18 H LYS 108 -0.636 7.593 23.492 845 HA LYS 18 HA LYS 108 0.515 6.229 21.079 846 1HB LYS 18 1HB LYS 108 1.478 6.407 23.647 847 2HB LYS 18 2HB LYS 108 0.525 4.973 23.885 848 1HG LYS 18 1HG LYS 108 2.689 4.167 23.383 849 2HG LYS 18 2HG LYS 108 1.802 3.901 21.902 850 1HD LYS 18 1HD LYS 108 3.949 4.762 21.234 851 2HD LYS 18 2HD LYS 108 2.820 6.064 20.951 852 1HE LYS 18 1HE LYS 108 4.794 7.057 21.881 853 2HE LYS 18 2HE LYS 108 3.559 7.191 23.121 854 1HZ LYS 18 1HZ LYS 108 4.528 5.261 24.224 855 2HZ LYS 18 2HZ LYS 108 5.624 6.463 24.053 856 H LYS 19 H LYS 109 -1.992 5.384 23.429 857 HA LYS 19 HA LYS 109 -3.030 3.018 22.008 858 1HB LYS 19 2HB LYS 109 -3.516 3.546 24.422 859 2HB LYS 19 1HB LYS 109 -4.525 4.915 23.939 860 1HG LYS 19 1HG LYS 109 -6.068 3.300 22.722 861 2HG LYS 19 2HG LYS 109 -5.030 1.955 23.196 862 1HD LYS 19 1HD LYS 109 -5.494 2.479 25.649 863 2HD LYS 19 2HD LYS 109 -6.482 3.846 25.156 864 1HE LYS 19 1HE LYS 109 -8.018 2.084 25.687 865 2HE LYS 19 2HE LYS 109 -8.073 2.262 23.935 866 1HZ LYS 19 1HZ LYS 109 -6.556 0.188 25.433 867 2HZ LYS 19 2HZ LYS 109 -7.974 -0.044 24.654 868 H ASP 20 H ASP 110 -3.799 6.583 21.636 869 HA ASP 20 HA ASP 110 -5.986 6.005 19.649 870 1HB ASP 20 1HB ASP 110 -4.610 8.618 20.487 871 2HB ASP 20 2HB ASP 110 -5.584 8.576 19.044 872 HD2 ASP 20 HD2 ASP 110 -7.353 8.794 22.573 873 H ALA 21 H ALA 111 -2.524 6.530 19.378 874 HA ALA 21 HA ALA 111 -2.491 6.757 16.413 875 1HB ALA 21 1HB ALA 111 -0.292 6.404 18.545 876 2HB ALA 21 2HB ALA 111 0.045 6.372 16.791 877 3HB ALA 21 3HB ALA 111 -0.658 7.777 17.529 878 H THR 22 H THR 112 -1.947 4.002 18.706 879 HA THR 22 HA THR 112 -1.544 1.910 16.768 880 HB THR 22 HB THR 112 -3.150 1.559 19.391 881 HG1 THR 22 HG1 THR 112 -1.348 2.858 19.803 882 1HG2 THR 22 2HG2 THR 112 -1.043 -0.150 17.935 883 2HG2 THR 22 3HG2 THR 112 -1.742 -0.540 19.532 884 3HG2 THR 22 1HG2 THR 112 -2.784 -0.504 18.065 885 H LYS 23 H LYS 113 -4.528 3.034 18.151 886 HA LYS 23 HA LYS 113 -6.405 1.388 16.607 887 1HB LYS 23 2HB LYS 113 -6.537 4.249 17.874 888 2HB LYS 23 1HB LYS 113 -7.955 3.542 17.189 889 1HG LYS 23 1HG LYS 113 -8.018 1.655 18.821 890 2HG LYS 23 2HG LYS 113 -6.431 2.064 19.433 891 1HD LYS 23 1HD LYS 113 -7.900 2.787 21.099 892 2HD LYS 23 2HD LYS 113 -7.314 4.257 20.338 893 1HE LYS 23 1HE LYS 113 -9.493 4.424 19.028 894 2HE LYS 23 2HE LYS 113 -10.066 2.935 19.787 895 1HZ LYS 23 1HZ LYS 113 -9.902 4.021 21.935 896 2HZ LYS 23 2HZ LYS 113 -10.896 4.850 20.936 897 H ALA 24 H ALA 114 -5.446 4.705 16.115 898 HA ALA 24 HA ALA 114 -6.853 5.319 13.726 899 1HB ALA 24 2HB ALA 114 -5.899 6.963 15.166 900 2HB ALA 24 3HB ALA 114 -4.229 6.424 14.788 901 3HB ALA 24 1HB ALA 114 -5.247 7.196 13.522 902 H VAL 25 H VAL 115 -3.623 3.888 13.959 903 HA VAL 25 HA VAL 115 -3.083 3.534 10.999 904 HB VAL 25 HB VAL 115 -2.238 2.369 13.852 905 1HG1 VAL 25 2HG2 VAL 115 -1.297 1.106 11.222 906 2HG1 VAL 25 3HG2 VAL 115 -0.532 0.861 12.830 907 3HG1 VAL 25 1HG2 VAL 115 -2.181 0.331 12.538 908 1HG2 VAL 25 3HG1 VAL 115 -0.613 3.860 11.745 909 2HG2 VAL 25 1HG1 VAL 115 -1.216 4.493 13.287 910 3HG2 VAL 25 2HG1 VAL 115 0.006 3.219 13.307 911 H ASP 26 H ASP 116 -4.321 1.184 13.487 912 HA ASP 26 HA ASP 116 -5.518 -0.595 11.396 913 1HB ASP 26 1HB ASP 116 -6.021 -0.374 14.443 914 2HB ASP 26 2HB ASP 116 -6.796 -1.582 13.442 915 HD2 ASP 26 HD2 ASP 116 -2.977 -2.039 14.568 916 H ALA 27 H ALA 117 -6.406 2.350 11.996 917 HA ALA 27 HA ALA 117 -9.347 2.085 11.393 918 1HB ALA 27 1HB ALA 117 -8.286 3.727 13.291 919 2HB ALA 27 2HB ALA 117 -8.009 4.743 11.891 920 3HB ALA 27 3HB ALA 117 -9.639 4.227 12.351 921 H VAL 28 H VAL 118 -6.397 3.431 10.055 922 HA VAL 28 HA VAL 118 -7.506 4.138 7.391 923 HB VAL 28 HB VAL 118 -4.561 3.245 7.935 924 1HG1 VAL 28 1HG2 VAL 118 -5.986 4.169 5.547 925 2HG1 VAL 28 2HG2 VAL 118 -4.684 5.302 5.949 926 3HG1 VAL 28 3HG2 VAL 118 -4.284 3.614 5.811 927 1HG2 VAL 28 3HG1 VAL 118 -5.561 6.040 8.234 928 2HG2 VAL 28 1HG1 VAL 118 -4.755 4.935 9.438 929 3HG2 VAL 28 2HG1 VAL 118 -3.839 5.496 8.027 930 H PHE 29 H PHE 119 -5.416 1.617 8.506 931 HA PHE 29 HA PHE 119 -5.467 -0.138 6.192 932 1HB PHE 29 2HB PHE 119 -4.342 -0.732 8.944 933 2HB PHE 29 1HB PHE 119 -3.992 -1.673 7.511 934 HD1 PHE 29 HD2 PHE 119 -3.374 0.083 5.306 935 HD2 PHE 29 HD1 PHE 119 -2.489 0.634 9.469 936 HE1 PHE 29 HE2 PHE 119 -1.703 1.780 4.725 937 HE2 PHE 29 HE1 PHE 119 -0.850 2.364 8.885 938 HZ PHE 29 HZ PHE 119 -0.499 2.975 6.507 939 H ASP 30 H ASP 120 -7.734 -0.127 8.823 940 HA ASP 30 HA ASP 120 -8.666 -2.897 8.074 941 1HB ASP 30 1HB ASP 120 -8.972 -1.777 10.399 942 2HB ASP 30 2HB ASP 120 -10.268 -0.825 9.724 943 HD2 ASP 30 HD2 ASP 120 -12.618 -3.213 10.283 944 H SER 31 H SER 121 -9.592 0.308 7.445 945 HA SER 31 HA SER 121 -12.054 -0.264 5.788 946 1HB SER 31 2HB SER 121 -10.452 2.343 6.068 947 2HB SER 31 1HB SER 121 -11.925 2.170 5.090 948 HG SER 31 HG SER 121 -12.344 2.900 7.183 949 H ILE 32 H ILE 122 -8.504 0.236 4.910 950 HA ILE 32 HA ILE 122 -8.725 0.081 2.103 951 HB ILE 32 HB ILE 122 -6.426 -1.054 3.687 952 1HG1 ILE 32 1HG1 ILE 122 -7.484 1.738 3.698 953 2HG1 ILE 32 2HG1 ILE 122 -6.764 0.675 4.864 954 1HG2 ILE 32 2HG2 ILE 122 -6.772 -1.038 0.988 955 2HG2 ILE 32 3HG2 ILE 122 -6.449 0.679 1.188 956 3HG2 ILE 32 1HG2 ILE 122 -5.208 -0.510 1.651 957 1HD1 ILE 32 1HD1 ILE 122 -4.545 1.159 3.437 958 2HD1 ILE 32 2HD1 ILE 122 -5.512 2.677 3.104 959 3HD1 ILE 32 3HD1 ILE 122 -5.186 2.131 4.781 960 H THR 33 H THR 123 -7.996 -2.535 4.432 961 HA THR 33 HA THR 123 -8.119 -4.600 2.296 962 HB THR 33 HB THR 123 -6.962 -5.112 4.410 963 HG1 THR 33 HG1 THR 123 -7.841 -7.124 4.829 964 1HG2 THR 33 1HG2 THR 123 -8.411 -3.858 6.029 965 2HG2 THR 33 2HG2 THR 123 -9.665 -5.089 5.888 966 3HG2 THR 33 3HG2 THR 123 -8.062 -5.500 6.594 967 H GLU 34 H GLU 124 -10.687 -3.144 4.232 968 HA GLU 34 HA GLU 124 -12.837 -4.933 3.172 969 1HB GLU 34 1HB GLU 124 -12.972 -2.124 4.448 970 2HB GLU 34 2HB GLU 124 -14.395 -2.997 3.905 971 1HG GLU 34 1HG GLU 124 -14.045 -4.824 5.527 972 2HG GLU 34 2HG GLU 124 -12.485 -4.184 6.016 973 HE2 GLU 34 HE2 GLU 124 -15.905 -2.652 7.468 974 H ALA 35 H ALA 125 -11.247 -1.942 2.005 975 HA ALA 35 HA ALA 125 -12.965 -1.702 -0.346 976 1HB ALA 35 3HB ALA 125 -11.175 0.240 0.392 977 2HB ALA 35 1HB ALA 125 -9.932 -0.814 -0.251 978 3HB ALA 35 2HB ALA 125 -11.108 -0.148 -1.330 979 H LEU 36 H LEU 126 -9.724 -3.161 0.014 980 HA LEU 36 HA LEU 126 -9.436 -4.262 -2.650 981 1HB LEU 36 2HB LEU 126 -8.123 -5.234 -0.172 982 2HB LEU 36 1HB LEU 126 -7.538 -5.319 -1.825 983 HG LEU 36 HG LEU 126 -7.770 -2.698 -0.236 984 1HD1 LEU 36 3HD2 LEU 126 -5.710 -3.849 0.146 985 2HD1 LEU 36 1HD2 LEU 126 -5.383 -3.872 -1.647 986 3HD1 LEU 36 2HD2 LEU 126 -5.484 -2.317 -0.749 987 1HD2 LEU 36 2HD1 LEU 126 -7.225 -2.972 -3.220 988 2HD2 LEU 36 3HD1 LEU 126 -8.620 -2.149 -2.455 989 3HD2 LEU 36 1HD1 LEU 126 -7.017 -1.474 -2.249 990 NH1 ARG 37 NH2 ARG 127 -11.744 -9.606 6.042 991 NH2 ARG 37 NH1 ARG 127 -9.921 -8.262 6.120 992 H ARG 37 H ARG 127 -10.582 -5.816 0.398 993 HA ARG 37 HA ARG 127 -10.880 -8.329 -0.977 994 1HB ARG 37 1HB ARG 127 -11.667 -9.416 0.866 995 2HB ARG 37 2HB ARG 127 -10.468 -8.290 1.458 996 1HG ARG 37 1HG ARG 127 -12.503 -6.747 2.140 997 2HG ARG 37 2HG ARG 127 -13.535 -8.057 1.656 998 1HD ARG 37 1HD ARG 127 -13.340 -8.241 3.973 999 2HD ARG 37 2HD ARG 127 -12.429 -9.600 3.266 1000 1HH1 ARG 37 2HH2 ARG 127 -12.570 -9.917 5.519 1001 2HH1 ARG 37 1HH2 ARG 127 -11.439 -9.939 6.963 1002 1HH2 ARG 37 1HH1 ARG 127 -9.344 -7.549 5.660 1003 2HH2 ARG 37 2HH1 ARG 127 -9.748 -8.697 7.033 1004 H LYS 38 H LYS 128 -12.928 -5.449 -0.820 1005 HA LYS 38 HA LYS 128 -15.403 -7.056 -1.600 1006 1HB LYS 38 1HB LYS 128 -15.450 -5.478 0.435 1007 2HB LYS 38 2HB LYS 128 -15.352 -4.137 -0.705 1008 1HG LYS 38 1HG LYS 128 -17.579 -4.861 -1.693 1009 2HG LYS 38 2HG LYS 128 -17.568 -6.284 -0.664 1010 1HD LYS 38 1HD LYS 128 -19.056 -4.693 0.326 1011 2HD LYS 38 2HD LYS 128 -17.661 -4.821 1.389 1012 1HE LYS 38 1HE LYS 128 -16.744 -2.635 0.436 1013 2HE LYS 38 2HE LYS 128 -18.129 -2.534 -0.659 1014 1HZ LYS 38 1HZ LYS 128 -18.414 -1.224 1.347 1015 2HZ LYS 38 2HZ LYS 128 -18.264 -2.540 2.307 1016 H GLY 39 H GLY 129 -12.967 -5.870 -3.368 1017 1HA GLY 39 1HA GLY 129 -12.810 -5.208 -5.674 1018 2HA GLY 39 2HA GLY 129 -14.543 -5.397 -5.827 1019 H ASP 40 H ASP 130 -12.760 -3.269 -3.673 1020 HA ASP 40 HA ASP 130 -13.737 -0.740 -5.087 1021 1HB ASP 40 1HB ASP 130 -13.743 -1.248 -2.125 1022 2HB ASP 40 2HB ASP 130 -14.008 0.318 -2.845 1023 HD1 ASP 40 HD2 ASP 130 -17.229 -0.344 -3.940 1024 H LYS 41 H LYS 131 -12.603 0.949 -5.251 1025 HA LYS 41 HA LYS 131 -9.608 0.718 -4.911 1026 1HB LYS 41 2HB LYS 131 -11.144 3.086 -6.095 1027 2HB LYS 41 1HB LYS 131 -9.409 2.803 -6.185 1028 1HG LYS 41 1HG LYS 131 -9.825 0.767 -7.646 1029 2HG LYS 41 2HG LYS 131 -11.548 1.059 -7.553 1030 1HD LYS 41 1HD LYS 131 -10.784 1.897 -9.661 1031 2HD LYS 41 2HD LYS 131 -11.301 3.270 -8.691 1032 1HE LYS 41 1HE LYS 131 -8.889 3.848 -8.183 1033 2HE LYS 41 2HE LYS 131 -8.345 2.411 -9.052 1034 1HZ LYS 41 1HZ LYS 131 -9.866 4.658 -10.253 1035 2HZ LYS 41 2HZ LYS 131 -9.361 3.332 -11.065 1036 H VAL 42 H VAL 132 -8.531 1.814 -3.236 1037 HA VAL 42 HA VAL 132 -9.759 3.461 -1.333 1038 HB VAL 42 HB VAL 132 -6.842 2.756 -1.882 1039 1HG1 VAL 42 3HG2 VAL 132 -7.363 4.248 0.141 1040 2HG1 VAL 42 1HG2 VAL 132 -8.460 2.959 0.701 1041 3HG1 VAL 42 2HG2 VAL 132 -6.713 2.651 0.599 1042 1HG2 VAL 42 3HG1 VAL 132 -8.416 0.589 -1.860 1043 2HG2 VAL 42 1HG1 VAL 132 -7.087 0.664 -0.726 1044 3HG2 VAL 42 2HG1 VAL 132 -8.747 1.009 -0.170 1045 H GLN 43 H GLN 133 -7.272 5.008 -1.436 1046 HA GLN 43 HA GLN 133 -6.327 6.421 -2.942 1047 1HB GLN 43 1HB GLN 133 -8.918 7.603 -3.825 1048 2HB GLN 43 2HB GLN 133 -7.491 8.619 -3.950 1049 1HG GLN 43 1HG GLN 133 -6.289 6.948 -5.230 1050 2HG GLN 43 2HG GLN 133 -7.537 5.747 -5.032 1051 1HE2 GLN 43 2HE2 GLN 133 -9.526 7.068 -7.756 1052 2HE2 GLN 43 1HE2 GLN 133 -9.424 5.909 -6.337 1053 H LEU 44 H LEU 134 -5.116 8.134 -2.877 1054 HA LEU 44 HA LEU 134 -5.332 9.973 -0.468 1055 1HB LEU 44 2HB LEU 134 -2.701 8.652 -1.364 1056 2HB LEU 44 1HB LEU 134 -2.957 9.706 0.017 1057 HG LEU 44 HG LEU 134 -4.691 7.662 0.652 1058 1HD1 LEU 44 1HD1 LEU 134 -4.134 6.262 -1.388 1059 2HD1 LEU 44 2HD1 LEU 134 -2.444 6.195 -0.868 1060 3HD1 LEU 44 3HD1 LEU 134 -3.720 5.439 0.120 1061 1HD2 LEU 44 2HD2 LEU 134 -2.881 8.531 2.140 1062 2HD2 LEU 44 3HD2 LEU 134 -2.911 6.758 2.156 1063 3HD2 LEU 44 1HD2 LEU 134 -1.655 7.615 1.226 1064 H ILE 45 H ILE 135 -5.187 12.072 -1.267 1065 HA ILE 45 HA ILE 135 -4.613 12.365 -4.080 1066 HB ILE 45 HB ILE 135 -6.571 13.449 -2.926 1067 1HG1 ILE 45 1HG1 ILE 135 -6.587 15.638 -4.169 1068 2HG1 ILE 45 2HG1 ILE 135 -4.916 15.381 -4.644 1069 1HG2 ILE 45 3HG2 ILE 135 -5.353 14.345 -0.945 1070 2HG2 ILE 45 1HG2 ILE 135 -4.553 15.560 -1.970 1071 3HG2 ILE 45 2HG2 ILE 135 -6.328 15.591 -1.750 1072 1HD1 ILE 45 1HD1 ILE 135 -7.286 13.514 -5.381 1073 2HD1 ILE 45 2HD1 ILE 135 -6.554 14.734 -6.451 1074 3HD1 ILE 45 3HD1 ILE 135 -5.607 13.317 -5.951 1075 H GLY 46 H GLY 136 -2.719 13.137 -1.820 1076 1HA GLY 46 1HA GLY 136 -0.604 14.352 -3.778 1077 2HA GLY 46 2HA GLY 136 -0.557 14.800 -2.087 1078 H PHE 47 H PHE 137 -1.275 11.448 -2.895 1079 HA PHE 47 HA PHE 137 1.612 10.551 -2.687 1080 1HB PHE 47 2HB PHE 137 0.327 10.914 -0.452 1081 2HB PHE 47 1HB PHE 137 -0.705 9.589 -0.856 1082 HD1 PHE 47 HD1 PHE 137 0.546 7.217 -1.431 1083 HD2 PHE 47 HD2 PHE 137 2.292 10.402 0.890 1084 HE1 PHE 47 HE1 PHE 137 2.159 5.649 -0.478 1085 HE2 PHE 47 HE2 PHE 137 3.806 8.754 1.933 1086 HZ PHE 47 HZ PHE 137 3.786 6.408 1.210 1087 H GLY 48 H GLY 138 -1.812 9.505 -3.455 1088 1HA GLY 48 1HA GLY 138 -0.820 7.015 -4.575 1089 2HA GLY 48 2HA GLY 138 -1.420 6.817 -2.957 1090 H ASN 49 H ASN 139 -1.977 5.298 -4.542 1091 HA ASN 49 HA ASN 139 -4.987 5.274 -4.561 1092 1HB ASN 49 1HB ASN 139 -4.570 6.343 -6.808 1093 2HB ASN 49 2HB ASN 139 -3.547 5.003 -7.287 1094 1HD2 ASN 49 1HD2 ASN 139 -6.640 4.225 -9.033 1095 2HD2 ASN 49 2HD2 ASN 139 -5.105 5.227 -9.112 1096 H PHE 50 H PHE 140 -5.267 3.328 -3.457 1097 HA PHE 50 HA PHE 140 -3.724 0.879 -4.482 1098 1HB PHE 50 1HB PHE 140 -5.461 1.049 -2.409 1099 2HB PHE 50 2HB PHE 140 -5.479 -0.019 -2.115 1100 HD1 PHE 50 HD2 PHE 140 -4.819 2.342 -0.659 1101 HD2 PHE 50 HD1 PHE 140 -2.689 -1.226 -1.727 1102 HE1 PHE 50 HE2 PHE 140 -3.649 2.369 1.520 1103 HE2 PHE 50 HE1 PHE 140 -1.485 -1.126 0.429 1104 HZ PHE 50 HZ PHE 140 -1.902 0.707 1.962 1105 H GLU 51 H GLU 141 -4.870 -0.933 -5.161 1106 HA GLU 51 HA GLU 141 -7.751 -1.066 -5.205 1107 1HB GLU 51 1HB GLU 141 -8.233 -0.912 -7.683 1108 2HB GLU 51 2HB GLU 141 -7.533 0.596 -7.146 1109 1HG GLU 51 1HG GLU 141 -5.261 -0.146 -8.073 1110 2HG GLU 51 2HG GLU 141 -6.004 -1.632 -8.656 1111 HE1 GLU 51 HE2 GLU 141 -7.793 -0.121 -11.253 1112 H VAL 52 H VAL 142 -8.661 -3.048 -6.486 1113 HA VAL 52 HA VAL 142 -6.616 -5.196 -6.402 1114 HB VAL 52 HB VAL 142 -8.985 -4.524 -4.893 1115 1HG1 VAL 52 1HG2 VAL 142 -9.768 -6.647 -6.909 1116 2HG1 VAL 52 2HG2 VAL 142 -10.620 -6.262 -5.371 1117 3HG1 VAL 52 3HG2 VAL 142 -10.476 -5.040 -6.675 1118 1HG2 VAL 52 1HG1 VAL 142 -7.550 -7.189 -5.088 1119 2HG2 VAL 52 2HG1 VAL 142 -7.157 -5.786 -4.044 1120 3HG2 VAL 52 3HG1 VAL 142 -8.660 -6.663 -3.817 1121 NH1 ARG 53 NH2 ARG 143 -1.740 -8.037 -13.033 1122 NH2 ARG 53 NH1 ARG 143 -1.789 -5.764 -13.013 1123 H ARG 53 H ARG 143 -6.887 -6.983 -7.779 1124 HA ARG 53 HA ARG 143 -8.006 -6.301 -10.573 1125 1HB ARG 53 1HB ARG 143 -5.504 -6.255 -10.433 1126 2HB ARG 53 2HB ARG 143 -5.483 -7.896 -9.846 1127 1HG ARG 53 1HG ARG 143 -6.650 -8.632 -12.024 1128 2HG ARG 53 2HG ARG 143 -6.520 -6.983 -12.614 1129 1HD ARG 53 1HD ARG 143 -4.147 -8.798 -11.797 1130 2HD ARG 53 2HD ARG 143 -4.720 -8.571 -13.451 1131 1HH1 ARG 53 2HH2 ARG 143 -2.265 -8.914 -12.937 1132 2HH1 ARG 53 1HH2 ARG 143 -0.737 -7.938 -13.225 1133 1HH2 ARG 53 1HH1 ARG 143 -2.346 -4.908 -12.906 1134 2HH2 ARG 53 2HH1 ARG 143 -0.783 -5.822 -13.206 1135 H GLU 54 H GLU 144 -9.977 -7.100 -9.891 1136 HA GLU 54 HA GLU 144 -10.334 -9.716 -8.611 1137 1HB GLU 54 1HB GLU 144 -12.694 -9.383 -8.669 1138 2HB GLU 54 2HB GLU 144 -11.815 -8.024 -8.009 1139 1HG GLU 54 1HG GLU 144 -12.156 -6.770 -10.238 1140 2HG GLU 54 2HG GLU 144 -13.141 -8.120 -10.796 1141 HE1 GLU 54 HE2 GLU 144 -12.789 -5.635 -8.542 1142 NH1 ARG 55 NH2 ARG 145 -11.891 -18.262 -10.636 1143 NH2 ARG 55 NH1 ARG 145 -10.150 -18.493 -9.189 1144 H ARG 55 H ARG 145 -10.374 -11.631 -9.407 1145 HA ARG 55 HA ARG 145 -10.459 -12.099 -12.402 1146 1HB ARG 55 1HB ARG 145 -8.655 -13.141 -11.084 1147 2HB ARG 55 2HB ARG 145 -9.788 -14.024 -10.088 1148 1HG ARG 55 1HG ARG 145 -9.807 -14.375 -13.145 1149 2HG ARG 55 2HG ARG 145 -8.536 -15.123 -12.211 1150 1HD ARG 55 1HD ARG 145 -11.540 -15.668 -11.720 1151 2HD ARG 55 2HD ARG 145 -10.509 -16.631 -12.772 1152 1HH1 ARG 55 2HH2 ARG 145 -12.299 -17.742 -11.421 1153 2HH1 ARG 55 1HH2 ARG 145 -12.301 -19.070 -10.154 1154 1HH2 ARG 55 1HH1 ARG 145 -9.234 -18.154 -8.872 1155 2HH2 ARG 55 2HH1 ARG 145 -10.676 -19.287 -8.808 1156 H ALA 56 H ALA 146 -12.280 -12.698 -13.335 1157 HA ALA 56 HA ALA 146 -14.818 -12.806 -11.928 1158 1HB ALA 56 3HB ALA 146 -14.641 -11.956 -14.240 1159 2HB ALA 56 1HB ALA 146 -14.206 -13.573 -14.852 1160 3HB ALA 56 2HB ALA 146 -15.822 -13.276 -14.168 1161 H ALA 57 H ALA 147 -15.392 -14.432 -10.678 1162 HA ALA 57 HA ALA 147 -14.780 -17.116 -10.647 1163 1HB ALA 57 2HB ALA 147 -16.190 -15.952 -8.887 1164 2HB ALA 57 3HB ALA 147 -17.588 -15.945 -9.988 1165 3HB ALA 57 1HB ALA 147 -16.958 -17.478 -9.358 1166 NH1 ARG 58 NH2 ARG 148 -14.152 -16.767 -17.699 1167 NH2 ARG 58 NH1 ARG 148 -15.735 -15.782 -16.397 1168 H ARG 58 H ARG 148 -15.067 -18.918 -11.478 1169 HA ARG 58 HA ARG 148 -16.445 -18.933 -14.101 1170 1HB ARG 58 2HB ARG 148 -14.456 -21.003 -13.054 1171 2HB ARG 58 1HB ARG 148 -15.007 -20.900 -14.711 1172 1HG ARG 58 1HG ARG 148 -13.312 -18.726 -13.323 1173 2HG ARG 58 2HG ARG 148 -12.676 -20.091 -14.197 1174 1HD ARG 58 1HD ARG 148 -12.578 -18.219 -15.696 1175 2HD ARG 58 2HD ARG 148 -13.788 -19.338 -16.331 1176 1HH1 ARG 58 2HH2 ARG 148 -13.434 -17.495 -17.786 1177 2HH1 ARG 58 1HH2 ARG 148 -14.420 -16.080 -18.413 1178 1HH2 ARG 58 1HH1 ARG 148 -16.225 -15.759 -15.496 1179 2HH2 ARG 58 2HH1 ARG 148 -15.896 -15.162 -17.199 1180 H LYS 59 H LYS 149 -16.773 -21.684 -14.498 1181 HA LYS 59 HA LYS 149 -18.392 -22.891 -12.345 1182 1HB LYS 59 1HB LYS 149 -20.098 -21.320 -13.447 1183 2HB LYS 59 2HB LYS 149 -19.986 -22.284 -14.914 1184 1HG LYS 59 1HG LYS 149 -20.744 -24.329 -13.581 1185 2HG LYS 59 2HG LYS 149 -20.795 -23.344 -12.119 1186 1HD LYS 59 1HD LYS 149 -22.541 -21.841 -13.219 1187 2HD LYS 59 2HD LYS 149 -22.526 -22.902 -14.634 1188 1HE LYS 59 1HE LYS 149 -23.260 -24.851 -13.157 1189 2HE LYS 59 2HE LYS 149 -23.283 -23.775 -11.755 1190 1HZ LYS 59 1HZ LYS 149 -25.457 -24.021 -12.705 1191 2HZ LYS 59 2HZ LYS 149 -24.982 -22.462 -12.834 1192 H GLY 60 H GLY 150 -17.604 -24.845 -12.384 1193 1HA GLY 60 1HA GLY 150 -16.659 -26.142 -15.034 1194 2HA GLY 60 2HA GLY 150 -15.782 -26.297 -13.527 1195 NH1 ARG 61 NH2 ARG 151 -19.406 -35.051 -16.357 1196 NH2 ARG 61 NH1 ARG 151 -17.502 -35.686 -15.288 1197 H ARG 61 H ARG 151 -16.056 -28.295 -12.799 1198 HA ARG 61 HA ARG 151 -18.723 -29.377 -12.175 1199 1HB ARG 61 1HB ARG 151 -18.276 -30.020 -14.721 1200 2HB ARG 61 2HB ARG 151 -17.130 -31.188 -14.087 1201 1HG ARG 61 1HG ARG 151 -19.141 -32.104 -12.623 1202 2HG ARG 61 2HG ARG 151 -20.157 -30.976 -13.492 1203 1HD ARG 61 1HD ARG 151 -20.474 -33.062 -14.575 1204 2HD ARG 61 2HD ARG 151 -19.476 -32.131 -15.698 1205 1HH1 ARG 61 2HH2 ARG 151 -20.146 -34.347 -16.461 1206 2HH1 ARG 61 1HH2 ARG 151 -19.310 -35.924 -16.887 1207 1HH2 ARG 61 1HH1 ARG 151 -16.794 -35.471 -14.578 1208 2HH2 ARG 61 2HH1 ARG 151 -17.538 -36.517 -15.889 1209 H ASN 62 H ASN 152 -18.695 -30.824 -10.606 1210 HA ASN 62 HA ASN 152 -16.269 -31.154 -8.987 1211 1HB ASN 62 1HB ASN 152 -18.633 -30.814 -8.115 1212 2HB ASN 62 2HB ASN 152 -19.046 -32.440 -8.636 1213 1HD2 ASN 62 2HD2 ASN 152 -17.157 -32.029 -5.086 1214 2HD2 ASN 62 1HD2 ASN 152 -17.485 -30.589 -6.177 1215 HA PRO 63 HA PRO 153 -14.959 -35.064 -11.045 1216 1HB PRO 63 1HB PRO 153 -13.020 -35.984 -9.266 1217 2HB PRO 63 2HB PRO 153 -12.817 -34.621 -10.376 1218 1HG PRO 63 1HG PRO 153 -13.580 -34.511 -7.417 1219 2HG PRO 63 2HG PRO 153 -12.336 -33.559 -8.261 1220 1HD PRO 63 1HD PRO 153 -14.848 -32.542 -7.754 1221 2HD PRO 63 2HD PRO 153 -13.985 -32.109 -9.261 1222 H GLN 64 H GLN 154 -15.956 -35.405 -7.604 1223 HA GLN 64 HA GLN 154 -16.384 -38.345 -7.770 1224 1HB GLN 64 1HB GLN 154 -15.806 -37.091 -5.624 1225 2HB GLN 64 2HB GLN 154 -17.371 -36.299 -5.656 1226 1HG GLN 64 1HG GLN 154 -18.568 -38.431 -5.365 1227 2HG GLN 64 2HG GLN 154 -17.081 -39.344 -5.588 1228 1HE2 GLN 64 2HE2 GLN 154 -16.088 -38.937 -2.136 1229 2HE2 GLN 64 1HE2 GLN 154 -15.673 -39.568 -3.808 1230 H THR 65 H THR 155 -18.651 -35.866 -6.998 1231 HA THR 65 HA THR 155 -21.026 -37.291 -7.664 1232 HB THR 65 HB THR 155 -22.247 -35.308 -6.984 1233 HG1 THR 65 HG1 THR 155 -21.170 -33.384 -6.597 1234 1HG2 THR 65 1HG2 THR 155 -20.951 -36.599 -5.148 1235 2HG2 THR 65 2HG2 THR 155 -19.657 -35.402 -5.286 1236 3HG2 THR 65 3HG2 THR 155 -21.260 -34.882 -4.738 1237 H GLY 66 H GLY 156 -19.424 -34.881 -9.725 1238 1HA GLY 66 1HA GLY 156 -19.782 -34.458 -12.064 1239 2HA GLY 66 2HA GLY 156 -21.064 -35.646 -12.104 1240 H GLU 67 H GLU 157 -21.016 -32.815 -9.904 1241 HA GLU 67 HA GLU 157 -23.436 -31.643 -11.340 1242 1HB GLU 67 2HB GLU 157 -23.639 -32.454 -8.911 1243 2HB GLU 67 1HB GLU 157 -22.486 -31.210 -8.430 1244 1HG GLU 67 1HG GLU 157 -24.735 -30.429 -7.949 1245 2HG GLU 67 2HG GLU 157 -24.060 -29.415 -9.207 1246 HE1 GLU 67 HE2 GLU 157 -27.203 -31.895 -9.925 1247 H GLU 68 H GLU 158 -23.308 -29.603 -12.030 1248 HA GLU 68 HA GLU 158 -20.627 -28.471 -12.481 1249 1HB GLU 68 1HB GLU 158 -23.347 -27.320 -13.345 1250 2HB GLU 68 2HB GLU 158 -21.792 -26.615 -13.733 1251 1HG GLU 68 1HG GLU 158 -22.364 -27.793 -15.676 1252 2HG GLU 68 2HG GLU 158 -21.094 -28.745 -14.934 1253 HE1 GLU 68 HE2 GLU 158 -24.932 -30.104 -15.168 1254 H MET 69 H MET 159 -19.594 -27.385 -10.980 1255 HA MET 69 HA MET 159 -21.123 -25.758 -8.897 1256 1HB MET 69 1HB MET 159 -19.633 -26.319 -7.253 1257 2HB MET 69 2HB MET 159 -19.814 -27.816 -8.123 1258 1HG MET 69 1HG MET 159 -17.395 -25.912 -8.123 1259 2HG MET 69 2HG MET 159 -17.467 -27.553 -7.467 1260 1HE MET 69 3HE MET 159 -15.406 -26.125 -9.366 1261 2HE MET 69 2HE MET 159 -14.941 -27.848 -9.332 1262 3HE MET 69 1HE MET 159 -15.173 -27.010 -10.896 1263 H GLU 70 H GLU 160 -20.673 -23.710 -8.538 1264 HA GLU 70 HA GLU 160 -19.093 -22.129 -10.441 1265 1HB GLU 70 2HB GLU 160 -19.726 -20.136 -9.279 1266 2HB GLU 70 1HB GLU 160 -21.117 -21.163 -9.616 1267 1HG GLU 70 1HG GLU 160 -21.091 -21.918 -7.155 1268 2HG GLU 70 2HG GLU 160 -19.755 -20.809 -6.860 1269 HE1 GLU 70 HE2 GLU 160 -23.542 -19.486 -7.304 1270 H ILE 71 H ILE 161 -16.958 -21.688 -10.416 1271 HA ILE 71 HA ILE 161 -15.254 -22.459 -8.108 1272 HB ILE 71 HB ILE 161 -14.653 -21.459 -10.961 1273 1HG1 ILE 71 1HG1 ILE 161 -14.247 -24.321 -9.877 1274 2HG1 ILE 71 2HG1 ILE 161 -15.759 -23.871 -10.631 1275 1HG2 ILE 71 2HG2 ILE 161 -12.775 -20.946 -9.432 1276 2HG2 ILE 71 3HG2 ILE 161 -12.740 -22.647 -8.875 1277 3HG2 ILE 71 1HG2 ILE 161 -12.329 -22.235 -10.570 1278 1HD1 ILE 71 2HD1 ILE 161 -13.054 -23.760 -12.092 1279 2HD1 ILE 71 3HD1 ILE 161 -14.299 -25.015 -12.241 1280 3HD1 ILE 71 1HD1 ILE 161 -14.651 -23.362 -12.790 1281 HA PRO 72 HA PRO 162 -15.925 -18.009 -6.918 1282 1HB PRO 72 1HB PRO 162 -14.454 -17.912 -4.537 1283 2HB PRO 72 2HB PRO 162 -16.052 -18.648 -4.721 1284 1HG PRO 72 1HG PRO 162 -13.337 -20.053 -4.793 1285 2HG PRO 72 2HG PRO 162 -14.782 -20.514 -3.862 1286 1HD PRO 72 1HD PRO 162 -14.172 -21.708 -6.265 1287 2HD PRO 72 2HD PRO 162 -15.879 -21.405 -5.817 1288 H ALA 73 H ALA 163 -14.874 -16.033 -6.787 1289 HA ALA 73 HA ALA 163 -12.794 -15.481 -8.676 1290 1HB ALA 73 2HB ALA 163 -14.453 -13.741 -7.698 1291 2HB ALA 73 3HB ALA 163 -13.506 -13.757 -6.166 1292 3HB ALA 73 1HB ALA 163 -12.783 -13.156 -7.649 1293 H SER 74 H SER 164 -10.952 -14.102 -8.252 1294 HA SER 74 HA SER 164 -9.854 -14.144 -5.604 1295 1HB SER 74 1HB SER 164 -7.886 -15.258 -7.759 1296 2HB SER 74 2HB SER 164 -7.381 -14.745 -6.143 1297 HG SER 74 HG SER 164 -8.800 -16.294 -5.274 1298 H LYS 75 H LYS 165 -9.514 -12.238 -5.128 1299 HA LYS 75 HA LYS 165 -8.913 -10.080 -7.185 1300 1HB LYS 75 2HB LYS 165 -9.490 -9.234 -4.405 1301 2HB LYS 75 1HB LYS 165 -9.816 -8.489 -5.943 1302 1HG LYS 75 1HG LYS 165 -11.587 -10.297 -6.404 1303 2HG LYS 75 2HG LYS 165 -11.381 -10.834 -4.740 1304 1HD LYS 75 1HD LYS 165 -12.162 -8.582 -3.908 1305 2HD LYS 75 2HD LYS 165 -12.340 -8.026 -5.579 1306 1HE LYS 75 1HE LYS 165 -13.994 -9.926 -6.030 1307 2HE LYS 75 2HE LYS 165 -13.841 -10.447 -4.347 1308 1HZ LYS 75 1HZ LYS 165 -15.770 -9.082 -4.707 1309 2HZ LYS 75 2HZ LYS 165 -14.880 -7.833 -5.274 1310 H VAL 76 H VAL 166 -6.772 -9.361 -7.477 1311 HA VAL 76 HA VAL 166 -4.735 -10.209 -5.651 1312 HB VAL 76 HB VAL 166 -5.449 -9.598 -8.544 1313 1HG1 VAL 76 1HG2 VAL 166 -2.681 -9.513 -7.649 1314 2HG1 VAL 76 2HG2 VAL 166 -3.333 -9.725 -9.364 1315 3HG1 VAL 76 3HG2 VAL 166 -3.707 -8.246 -8.443 1316 1HG2 VAL 76 3HG1 VAL 166 -5.699 -11.927 -7.686 1317 2HG2 VAL 76 1HG1 VAL 166 -4.507 -11.798 -8.988 1318 3HG2 VAL 76 2HG1 VAL 166 -3.955 -11.952 -7.285 1319 HA PRO 77 HA PRO 167 -4.787 -5.716 -4.597 1320 1HB PRO 77 1HB PRO 167 -2.998 -5.746 -2.444 1321 2HB PRO 77 2HB PRO 167 -4.599 -6.492 -2.384 1322 1HG PRO 77 1HG PRO 167 -1.922 -7.860 -2.873 1323 2HG PRO 77 2HG PRO 167 -3.246 -8.380 -1.818 1324 1HD PRO 77 1HD PRO 167 -2.836 -9.324 -4.542 1325 2HD PRO 77 2HD PRO 167 -4.416 -9.385 -3.716 1326 H ALA 78 H ALA 168 -3.954 -4.061 -4.972 1327 HA ALA 78 HA ALA 168 -1.154 -3.645 -6.113 1328 1HB ALA 78 2HB ALA 168 -2.903 -4.000 -7.906 1329 2HB ALA 78 3HB ALA 168 -3.877 -2.667 -7.238 1330 3HB ALA 78 1HB ALA 168 -2.266 -2.333 -7.931 1331 H PHE 79 H PHE 169 -0.744 -1.305 -6.202 1332 HA PHE 79 HA PHE 169 -1.834 0.243 -3.751 1333 1HB PHE 79 2HB PHE 169 -0.376 -0.206 -2.348 1334 2HB PHE 79 1HB PHE 169 0.169 -1.559 -3.265 1335 HD1 PHE 79 HD2 PHE 169 1.943 -0.889 -5.235 1336 HD2 PHE 79 HD1 PHE 169 1.230 1.380 -1.701 1337 HE1 PHE 79 HE2 PHE 169 4.137 0.262 -5.543 1338 HE2 PHE 79 HE1 PHE 169 3.391 2.581 -2.018 1339 HZ PHE 79 HZ PHE 169 4.827 2.019 -3.942 1340 H LYS 80 H LYS 170 -1.517 2.080 -3.761 1341 HA LYS 80 HA LYS 170 -0.989 4.212 -5.182 1342 1HB LYS 80 2HB LYS 170 -0.620 5.017 -2.354 1343 2HB LYS 80 1HB LYS 170 -2.138 4.407 -2.920 1344 1HG LYS 80 1HG LYS 170 -2.190 3.401 -1.083 1345 2HG LYS 80 2HG LYS 170 -1.315 2.117 -1.854 1346 1HD LYS 80 1HD LYS 170 -0.007 2.354 0.035 1347 2HD LYS 80 2HD LYS 170 0.849 3.480 -1.005 1348 1HE LYS 80 1HE LYS 170 0.584 4.525 1.166 1349 2HE LYS 80 2HE LYS 170 -0.441 5.411 0.037 1350 1HZ LYS 80 1HZ LYS 170 -1.575 4.971 2.080 1351 2HZ LYS 80 2HZ LYS 170 -2.340 4.195 0.862 1352 HA PRO 81 HA PRO 171 2.942 5.964 -5.169 1353 1HB PRO 81 1HB PRO 171 3.002 5.312 -8.156 1354 2HB PRO 81 2HB PRO 171 4.376 5.440 -7.031 1355 1HG PRO 81 1HG PRO 171 3.459 2.976 -7.791 1356 2HG PRO 81 2HG PRO 171 3.919 3.268 -6.086 1357 1HD PRO 81 1HD PRO 171 1.104 3.227 -7.282 1358 2HD PRO 81 2HD PRO 171 1.753 2.427 -5.804 1359 H GLY 82 H GLY 172 0.085 6.579 -5.771 1360 1HA GLY 82 1HA GLY 172 -1.382 7.671 -7.614 1361 2HA GLY 82 2HA GLY 172 -0.947 8.605 -6.214 1362 H LYS 83 H LYS 173 1.251 8.053 -8.332 1363 HA LYS 83 HA LYS 173 2.525 9.313 -10.121 1364 1HB LYS 83 2HB LYS 173 -0.031 10.916 -10.206 1365 2HB LYS 83 1HB LYS 173 1.367 11.897 -10.449 1366 1HG LYS 83 1HG LYS 173 2.109 10.339 -12.346 1367 2HG LYS 83 2HG LYS 173 0.675 9.345 -12.065 1368 1HD LYS 83 1HD LYS 173 -0.804 11.336 -12.590 1369 2HD LYS 83 2HD LYS 173 0.631 12.329 -12.868 1370 1HE LYS 83 1HE LYS 173 1.328 10.791 -14.772 1371 2HE LYS 83 2HE LYS 173 -0.111 9.798 -14.495 1372 1HZ LYS 83 1HZ LYS 173 -1.486 11.704 -15.001 1373 2HZ LYS 83 2HZ LYS 173 -0.477 11.376 -16.245 1374 H ALA 84 H ALA 174 1.173 11.191 -7.613 1375 HA ALA 84 HA ALA 174 3.087 13.287 -7.129 1376 1HB ALA 84 2HB ALA 174 0.723 13.135 -6.311 1377 2HB ALA 84 3HB ALA 174 1.137 11.706 -5.324 1378 3HB ALA 84 1HB ALA 174 1.843 13.293 -4.916 1379 H LEU 85 H LEU 175 2.836 9.998 -5.513 1380 HA LEU 85 HA LEU 175 5.236 10.417 -3.885 1381 1HB LEU 85 2HB LEU 175 3.478 8.833 -3.180 1382 2HB LEU 85 1HB LEU 175 3.701 7.888 -4.643 1383 HG LEU 85 HG LEU 175 6.147 7.725 -3.936 1384 1HD1 LEU 85 2HD1 LEU 175 6.158 9.313 -2.014 1385 2HD1 LEU 85 3HD1 LEU 175 4.973 8.305 -1.151 1386 3HD1 LEU 85 1HD1 LEU 175 6.622 7.695 -1.452 1387 1HD2 LEU 85 2HD2 LEU 175 3.968 6.085 -2.491 1388 2HD2 LEU 85 3HD2 LEU 175 4.770 5.714 -4.040 1389 3HD2 LEU 85 1HD2 LEU 175 5.689 5.616 -2.544 1390 H LYS 86 H LYS 176 4.564 9.009 -7.101 1391 HA LYS 86 HA LYS 176 7.287 8.093 -7.614 1392 1HB LYS 86 1HB LYS 176 4.873 8.344 -9.310 1393 2HB LYS 86 2HB LYS 176 6.258 8.876 -10.205 1394 1HG LYS 86 1HG LYS 176 5.942 6.151 -8.819 1395 2HG LYS 86 2HG LYS 176 5.777 6.466 -10.533 1396 1HD LYS 86 1HD LYS 176 8.392 6.654 -8.903 1397 2HD LYS 86 2HD LYS 176 7.919 5.349 -9.972 1398 1HE LYS 86 1HE LYS 176 7.997 6.912 -11.966 1399 2HE LYS 86 2HE LYS 176 8.454 8.252 -10.906 1400 1HZ LYS 86 1HZ LYS 176 10.017 5.770 -11.327 1401 2HZ LYS 86 2HZ LYS 176 10.360 7.244 -11.944 1402 H ASP 87 H ASP 177 6.048 11.387 -7.588 1403 HA ASP 87 HA ASP 177 8.477 12.556 -8.837 1404 1HB ASP 87 1HB ASP 177 5.727 13.328 -8.249 1405 2HB ASP 87 2HB ASP 177 6.653 14.238 -7.139 1406 HD1 ASP 87 HD2 ASP 177 6.186 13.400 -10.378 1407 H ALA 88 H ALA 178 7.178 12.158 -5.496 1408 HA ALA 88 HA ALA 178 9.240 13.427 -3.904 1409 1HB ALA 88 3HB ALA 178 7.092 12.351 -2.939 1410 2HB ALA 88 1HB ALA 178 7.754 10.750 -3.290 1411 3HB ALA 88 2HB ALA 178 8.556 11.755 -2.104 1412 H VAL 89 H VAL 179 9.035 10.081 -5.095 1413 HA VAL 89 HA VAL 179 11.581 9.216 -3.965 1414 HB VAL 89 HB VAL 179 8.972 8.334 -4.102 1415 1HG1 VAL 89 2HG2 VAL 179 9.126 8.320 -6.691 1416 2HG1 VAL 89 3HG2 VAL 179 10.039 6.814 -6.515 1417 3HG1 VAL 89 1HG2 VAL 179 8.375 6.953 -5.848 1418 1HG2 VAL 89 1HG1 VAL 179 10.626 7.342 -2.834 1419 2HG2 VAL 89 2HG1 VAL 179 9.585 6.172 -3.684 1420 3HG2 VAL 89 3HG1 VAL 179 11.277 6.460 -4.275 1421 H LYS 90 H LYS 180 10.958 10.635 -6.995 1422 HA LYS 90 HA LYS 180 12.323 8.927 -8.848 1423 1HB LYS 90 1HB LYS 180 10.733 11.146 -9.047 1424 2HB LYS 90 2HB LYS 180 12.239 11.991 -9.192 1425 1HG LYS 90 1HG LYS 180 12.788 10.730 -11.270 1426 2HG LYS 90 2HG LYS 180 11.497 9.576 -10.965 1427 1HD LYS 90 1HD LYS 180 10.657 11.037 -12.672 1428 2HD LYS 90 2HD LYS 180 9.753 11.349 -11.212 1429 1HE LYS 90 1HE LYS 180 10.169 13.481 -12.266 1430 2HE LYS 90 2HE LYS 180 11.128 13.455 -10.791 1431 1HZ LYS 90 1HZ LYS 180 12.354 14.311 -12.677 1432 2HZ LYS 90 2HZ LYS 180 12.129 12.943 -13.543 Start of MODEL 7 Raw file had 1432 H/Q atoms Start of MODEL 7 1 1H MET 1 1H MET 1 -14.073 8.332 -1.318 2 2H MET 1 2H MET 1 -13.880 7.098 -0.264 3 HA MET 1 HA MET 1 -13.861 9.172 0.854 4 1HB MET 1 1HB MET 1 -11.171 7.660 0.932 5 2HB MET 1 2HB MET 1 -11.626 8.894 2.080 6 1HG MET 1 1HG MET 1 -13.797 7.424 2.531 7 2HG MET 1 2HG MET 1 -12.884 6.119 1.763 8 1HE MET 1 2HE MET 1 -10.311 5.388 2.787 9 2HE MET 1 1HE MET 1 -10.368 5.094 4.538 10 3HE MET 1 3HE MET 1 -11.668 4.458 3.501 11 H ASN 2 H ASN 2 -10.574 9.607 0.110 12 HA ASN 2 HA ASN 2 -10.027 10.916 -1.925 13 1HB ASN 2 1HB ASN 2 -10.324 13.241 -2.255 14 2HB ASN 2 2HB ASN 2 -11.875 12.477 -2.096 15 1HD2 ASN 2 1HD2 ASN 2 -12.898 14.671 0.561 16 2HD2 ASN 2 2HD2 ASN 2 -13.319 13.260 -0.534 17 H LYS 3 H LYS 3 -9.908 11.523 1.340 18 HA LYS 3 HA LYS 3 -7.562 11.177 2.414 19 1HB LYS 3 1HB LYS 3 -6.274 12.357 0.552 20 2HB LYS 3 2HB LYS 3 -6.912 13.891 1.101 21 1HG LYS 3 1HG LYS 3 -5.692 13.560 3.307 22 2HG LYS 3 2HG LYS 3 -5.260 11.916 2.839 23 1HD LYS 3 1HD LYS 3 -3.916 12.863 0.882 24 2HD LYS 3 2HD LYS 3 -4.273 14.493 1.468 25 1HE LYS 3 1HE LYS 3 -3.115 13.932 3.677 26 2HE LYS 3 2HE LYS 3 -2.766 12.306 3.070 27 1HZ LYS 3 1HZ LYS 3 -1.821 14.827 1.824 28 2HZ LYS 3 2HZ LYS 3 -1.510 13.328 1.253 29 H THR 4 H THR 4 -10.085 13.653 2.022 30 HA THR 4 HA THR 4 -9.767 14.680 4.720 31 HB THR 4 HB THR 4 -11.502 15.292 2.237 32 HG1 THR 4 HG1 THR 4 -9.322 16.712 3.422 33 1HG2 THR 4 3HG2 THR 4 -11.182 16.648 4.922 34 2HG2 THR 4 1HG2 THR 4 -11.962 17.406 3.450 35 3HG2 THR 4 2HG2 THR 4 -12.659 15.913 4.196 36 H GLU 5 H GLU 5 -11.749 12.488 2.833 37 HA GLU 5 HA GLU 5 -13.932 12.248 4.910 38 1HB GLU 5 1HB GLU 5 -13.315 10.140 2.812 39 2HB GLU 5 2HB GLU 5 -14.760 10.278 3.778 40 1HG GLU 5 1HG GLU 5 -13.885 12.111 1.471 41 2HG GLU 5 2HG GLU 5 -15.140 10.905 1.414 42 HE2 GLU 5 HE2 GLU 5 -15.865 14.578 2.872 43 H LEU 6 H LEU 6 -10.590 11.271 4.465 44 HA LEU 6 HA LEU 6 -10.579 8.977 6.261 45 1HB LEU 6 2HB LEU 6 -8.883 10.376 4.237 46 2HB LEU 6 1HB LEU 6 -8.051 10.608 5.709 47 HG LEU 6 HG LEU 6 -7.238 8.616 5.234 48 1HD1 LEU 6 2HD1 LEU 6 -8.455 7.682 7.119 49 2HD1 LEU 6 3HD1 LEU 6 -9.682 7.017 6.008 50 3HD1 LEU 6 1HD1 LEU 6 -8.011 6.446 5.921 51 1HD2 LEU 6 1HD2 LEU 6 -8.026 8.648 2.881 52 2HD2 LEU 6 2HD2 LEU 6 -7.968 6.970 3.452 53 3HD2 LEU 6 3HD2 LEU 6 -9.525 7.833 3.350 54 H ILE 7 H ILE 7 -9.993 12.501 6.383 55 HA ILE 7 HA ILE 7 -8.874 12.612 9.092 56 HB ILE 7 HB ILE 7 -10.406 14.820 7.592 57 1HG1 ILE 7 1HG1 ILE 7 -7.367 14.376 7.747 58 2HG1 ILE 7 2HG1 ILE 7 -8.277 13.745 6.446 59 1HG2 ILE 7 2HG2 ILE 7 -10.115 15.292 10.083 60 2HG2 ILE 7 3HG2 ILE 7 -8.376 15.159 9.863 61 3HG2 ILE 7 1HG2 ILE 7 -9.262 16.453 9.046 62 1HD1 ILE 7 3HD1 ILE 7 -9.158 16.142 5.967 63 2HD1 ILE 7 1HD1 ILE 7 -7.758 16.652 6.892 64 3HD1 ILE 7 2HD1 ILE 7 -7.527 15.612 5.453 65 H ASN 8 H ASN 8 -12.180 13.052 7.858 66 HA ASN 8 HA ASN 8 -13.424 12.957 10.583 67 1HB ASN 8 1HB ASN 8 -14.763 12.359 7.844 68 2HB ASN 8 2HB ASN 8 -15.621 12.556 9.355 69 1HD2 ASN 8 1HD2 ASN 8 -14.437 14.226 6.661 70 2HD2 ASN 8 2HD2 ASN 8 -14.777 15.920 7.280 71 H ALA 9 H ALA 9 -11.978 10.435 8.811 72 HA ALA 9 HA ALA 9 -13.580 8.181 10.003 73 1HB ALA 9 2HB ALA 9 -11.956 7.893 7.817 74 2HB ALA 9 3HB ALA 9 -10.610 8.061 8.931 75 3HB ALA 9 1HB ALA 9 -11.644 6.717 9.151 76 H VAL 10 H VAL 10 -10.492 9.830 10.578 77 HA VAL 10 HA VAL 10 -9.734 8.158 12.751 78 HB VAL 10 HB VAL 10 -8.276 10.744 12.510 79 1HG1 VAL 10 3HG2 VAL 10 -7.752 8.645 13.977 80 2HG1 VAL 10 1HG2 VAL 10 -7.186 7.939 12.438 81 3HG1 VAL 10 2HG2 VAL 10 -6.433 9.443 13.041 82 1HG2 VAL 10 1HG1 VAL 10 -8.401 8.648 10.302 83 2HG2 VAL 10 2HG1 VAL 10 -8.621 10.430 10.263 84 3HG2 VAL 10 3HG1 VAL 10 -6.977 9.750 10.521 85 H ALA 11 H ALA 11 -10.667 11.360 12.464 86 HA ALA 11 HA ALA 11 -10.858 11.757 15.256 87 1HB ALA 11 2HB ALA 11 -10.617 13.688 13.643 88 2HB ALA 11 3HB ALA 11 -12.249 13.389 12.999 89 3HB ALA 11 1HB ALA 11 -12.035 13.989 14.674 90 H GLU 12 H GLU 12 -13.196 10.267 13.096 91 HA GLU 12 HA GLU 12 -15.374 10.360 15.173 92 1HB GLU 12 1HB GLU 12 -15.994 10.350 12.745 93 2HB GLU 12 2HB GLU 12 -15.272 8.750 12.553 94 1HG GLU 12 1HG GLU 12 -16.984 7.822 14.201 95 2HG GLU 12 2HG GLU 12 -17.672 9.433 14.391 96 HE1 GLU 12 HE2 GLU 12 -19.370 9.444 11.376 97 H THR 13 H THR 13 -13.167 7.802 13.818 98 HA THR 13 HA THR 13 -13.887 5.933 15.943 99 HB THR 13 HB THR 13 -11.790 4.606 15.262 100 HG1 THR 13 HG1 THR 13 -10.517 5.553 13.681 101 1HG2 THR 13 2HG2 THR 13 -13.256 5.562 12.746 102 2HG2 THR 13 3HG2 THR 13 -12.115 4.209 12.867 103 3HG2 THR 13 1HG2 THR 13 -13.661 4.138 13.748 104 H SER 14 H SER 14 -12.103 8.440 16.399 105 HA SER 14 HA SER 14 -10.717 7.293 18.927 106 1HB SER 14 1HB SER 14 -9.248 9.248 17.059 107 2HB SER 14 2HB SER 14 -8.605 8.469 18.503 108 HG SER 14 HG SER 14 -9.505 7.166 16.149 109 H GLY 15 H GLY 15 -12.044 10.312 17.512 110 1HA GLY 15 1HA GLY 15 -12.551 12.388 18.540 111 2HA GLY 15 2HA GLY 15 -12.515 11.577 20.104 112 H LEU 16 H LEU 16 -10.157 12.351 17.619 113 HA LEU 16 HA LEU 16 -8.270 13.822 19.471 114 1HB LEU 16 1HB LEU 16 -6.573 13.548 17.802 115 2HB LEU 16 2HB LEU 16 -7.098 12.105 18.645 116 HG LEU 16 HG LEU 16 -8.304 11.292 16.890 117 1HD1 LEU 16 2HD1 LEU 16 -9.341 13.432 15.984 118 2HD1 LEU 16 3HD1 LEU 16 -7.760 13.713 15.192 119 3HD1 LEU 16 1HD1 LEU 16 -8.804 12.279 14.765 120 1HD2 LEU 16 3HD2 LEU 16 -6.375 10.363 16.617 121 2HD2 LEU 16 1HD2 LEU 16 -7.389 10.504 15.163 122 3HD2 LEU 16 2HD2 LEU 16 -5.999 11.555 15.325 123 H SER 17 H SER 17 -7.811 14.936 16.772 124 HA SER 17 HA SER 17 -9.817 17.249 16.747 125 1HB SER 17 1HB SER 17 -6.872 17.874 16.308 126 2HB SER 17 2HB SER 17 -8.229 18.970 16.316 127 HG SER 17 HG SER 17 -7.124 18.982 18.282 128 H LYS 18 H LYS 18 -10.039 18.266 14.726 129 HA LYS 18 HA LYS 18 -9.874 16.444 12.335 130 1HB LYS 18 1HB LYS 18 -11.757 18.178 12.814 131 2HB LYS 18 2HB LYS 18 -10.642 19.433 12.286 132 1HG LYS 18 1HG LYS 18 -10.495 18.374 10.022 133 2HG LYS 18 2HG LYS 18 -11.407 16.969 10.590 134 1HD LYS 18 1HD LYS 18 -13.424 18.346 11.008 135 2HD LYS 18 2HD LYS 18 -12.574 19.801 10.464 136 1HE LYS 18 1HE LYS 18 -12.262 18.755 8.162 137 2HE LYS 18 2HE LYS 18 -13.078 17.286 8.714 138 1HZ LYS 18 1HZ LYS 18 -14.559 18.760 7.533 139 2HZ LYS 18 2HZ LYS 18 -14.286 19.991 8.574 140 H LYS 19 H LYS 19 -8.120 19.347 13.391 141 HA LYS 19 HA LYS 19 -6.040 19.189 11.290 142 1HB LYS 19 2HB LYS 19 -5.952 20.487 14.066 143 2HB LYS 19 1HB LYS 19 -4.584 20.566 12.968 144 1HG LYS 19 1HG LYS 19 -7.357 21.604 12.098 145 2HG LYS 19 2HG LYS 19 -6.296 22.545 13.113 146 1HD LYS 19 1HD LYS 19 -5.995 23.316 10.869 147 2HD LYS 19 2HD LYS 19 -4.508 22.588 11.423 148 1HE LYS 19 1HE LYS 19 -4.873 22.054 9.068 149 2HE LYS 19 2HE LYS 19 -4.899 20.565 9.994 150 1HZ LYS 19 1HZ LYS 19 -6.663 20.669 8.357 151 2HZ LYS 19 2HZ LYS 19 -7.273 22.049 8.988 152 H ASP 20 H ASP 20 -6.314 17.521 14.518 153 HA ASP 20 HA ASP 20 -3.553 16.325 14.234 154 1HB ASP 20 1HB ASP 20 -5.884 15.851 16.200 155 2HB ASP 20 2HB ASP 20 -4.647 14.643 16.092 156 HD2 ASP 20 HD2 ASP 20 -3.919 18.042 18.025 157 H ALA 21 H ALA 21 -6.746 15.392 13.120 158 HA ALA 21 HA ALA 21 -5.985 12.598 12.390 159 1HB ALA 21 2HB ALA 21 -8.486 14.316 11.881 160 2HB ALA 21 3HB ALA 21 -8.271 12.652 11.246 161 3HB ALA 21 1HB ALA 21 -8.259 12.963 12.956 162 H THR 22 H THR 22 -6.298 15.699 10.550 163 HA THR 22 HA THR 22 -5.418 14.795 7.958 164 HB THR 22 HB THR 22 -4.620 17.512 9.202 165 HG1 THR 22 HG1 THR 22 -6.763 17.125 9.733 166 1HG2 THR 22 2HG2 THR 22 -5.543 16.619 6.406 167 2HG2 THR 22 3HG2 THR 22 -5.272 18.318 6.891 168 3HG2 THR 22 1HG2 THR 22 -3.907 17.145 6.870 169 H LYS 23 H LYS 23 -3.553 15.944 10.628 170 HA LYS 23 HA LYS 23 -0.831 15.536 9.603 171 1HB LYS 23 2HB LYS 23 -2.227 15.454 12.416 172 2HB LYS 23 1HB LYS 23 -0.543 15.256 12.346 173 1HG LYS 23 1HG LYS 23 -1.743 17.818 11.130 174 2HG LYS 23 2HG LYS 23 -1.605 17.638 12.876 175 1HD LYS 23 1HD LYS 23 0.828 17.248 12.738 176 2HD LYS 23 2HD LYS 23 0.779 17.317 10.969 177 1HE LYS 23 1HE LYS 23 0.004 19.734 11.080 178 2HE LYS 23 2HE LYS 23 0.018 19.663 12.849 179 1HZ LYS 23 1HZ LYS 23 2.029 20.634 11.961 180 2HZ LYS 23 2HZ LYS 23 2.371 19.303 11.076 181 H ALA 24 H ALA 24 -2.836 13.530 11.651 182 HA ALA 24 HA ALA 24 -0.977 11.382 11.993 183 1HB ALA 24 3HB ALA 24 -3.983 11.451 12.330 184 2HB ALA 24 1HB ALA 24 -2.894 10.152 12.947 185 3HB ALA 24 2HB ALA 24 -2.700 11.826 13.542 186 H VAL 25 H VAL 25 -3.481 11.657 9.514 187 HA VAL 25 HA VAL 25 -2.763 9.121 8.039 188 HB VAL 25 HB VAL 25 -4.146 11.960 7.647 189 1HG1 VAL 25 1HG2 VAL 25 -3.736 10.055 5.269 190 2HG1 VAL 25 2HG2 VAL 25 -4.790 11.514 5.291 191 3HG1 VAL 25 3HG2 VAL 25 -3.052 11.676 5.459 192 1HG2 VAL 25 3HG1 VAL 25 -5.478 10.192 8.749 193 2HG2 VAL 25 1HG1 VAL 25 -6.214 10.753 7.246 194 3HG2 VAL 25 2HG1 VAL 25 -5.377 9.165 7.290 195 H ASP 26 H ASP 26 -1.829 12.609 7.463 196 HA ASP 26 HA ASP 26 0.566 11.794 5.851 197 1HB ASP 26 1HB ASP 26 -0.896 13.941 5.646 198 2HB ASP 26 2HB ASP 26 -0.062 14.537 7.081 199 HD1 ASP 26 HD2 ASP 26 1.818 14.197 3.462 200 H ALA 27 H ALA 27 0.300 11.083 8.578 201 HA ALA 27 HA ALA 27 3.125 11.366 9.675 202 1HB ALA 27 3HB ALA 27 0.494 10.459 10.866 203 2HB ALA 27 1HB ALA 27 1.986 10.125 11.644 204 3HB ALA 27 2HB ALA 27 1.458 11.826 11.429 205 H VAL 28 H VAL 28 0.648 8.909 9.162 206 HA VAL 28 HA VAL 28 2.350 6.537 9.049 207 HB VAL 28 HB VAL 28 -0.285 6.819 7.390 208 1HG1 VAL 28 2HG2 VAL 28 1.425 4.578 8.421 209 2HG1 VAL 28 3HG2 VAL 28 -0.336 4.339 8.399 210 3HG1 VAL 28 1HG2 VAL 28 0.495 4.798 6.897 211 1HG2 VAL 28 2HG1 VAL 28 -0.193 6.499 10.378 212 2HG2 VAL 28 3HG1 VAL 28 -1.163 7.547 9.266 213 3HG2 VAL 28 1HG1 VAL 28 -1.524 5.838 9.341 214 H PHE 29 H PHE 29 0.713 8.223 6.516 215 HA PHE 29 HA PHE 29 2.275 7.182 4.242 216 1HB PHE 29 2HB PHE 29 0.304 9.516 4.179 217 2HB PHE 29 1HB PHE 29 0.835 8.596 2.784 218 HD1 PHE 29 HD1 PHE 29 0.669 5.768 3.460 219 HD2 PHE 29 HD2 PHE 29 -1.949 8.949 4.666 220 HE1 PHE 29 HE1 PHE 29 -1.016 4.122 4.110 221 HE2 PHE 29 HE2 PHE 29 -3.647 7.289 5.309 222 HZ PHE 29 HZ PHE 29 -3.109 4.859 5.116 223 H ASP 30 H ASP 30 2.986 9.933 6.266 224 HA ASP 30 HA ASP 30 4.957 11.039 4.296 225 1HB ASP 30 1HB ASP 30 3.920 12.283 6.326 226 2HB ASP 30 2HB ASP 30 5.024 11.417 7.365 227 HD2 ASP 30 HD2 ASP 30 6.236 14.540 5.150 228 H SER 31 H SER 31 4.974 8.884 7.041 229 HA SER 31 HA SER 31 7.867 8.158 6.940 230 1HB SER 31 1HB SER 31 5.671 6.526 8.264 231 2HB SER 31 2HB SER 31 7.403 6.402 8.531 232 HG SER 31 HG SER 31 5.848 8.702 9.068 233 H ILE 32 H ILE 32 4.951 6.668 5.298 234 HA ILE 32 HA ILE 32 6.386 4.322 4.256 235 HB ILE 32 HB ILE 32 4.007 5.891 3.071 236 1HG1 ILE 32 1HG1 ILE 32 2.542 4.144 3.100 237 2HG1 ILE 32 2HG1 ILE 32 3.649 2.999 3.851 238 1HG2 ILE 32 1HG2 ILE 32 5.727 3.491 2.245 239 2HG2 ILE 32 2HG2 ILE 32 4.089 3.461 1.598 240 3HG2 ILE 32 3HG2 ILE 32 5.206 4.803 1.223 241 1HD1 ILE 32 3HD1 ILE 32 1.989 5.188 5.188 242 2HD1 ILE 32 1HD1 ILE 32 1.734 3.468 5.239 243 3HD1 ILE 32 2HD1 ILE 32 3.135 4.143 6.092 244 H THR 33 H THR 33 5.599 7.686 3.031 245 HA THR 33 HA THR 33 7.084 7.335 0.547 246 HB THR 33 HB THR 33 7.128 9.666 0.172 247 HG1 THR 33 HG1 THR 33 7.530 10.357 2.303 248 1HG2 THR 33 2HG2 THR 33 4.505 8.494 1.201 249 2HG2 THR 33 3HG2 THR 33 4.514 10.163 0.628 250 3HG2 THR 33 1HG2 THR 33 4.983 8.826 -0.452 251 H GLU 34 H GLU 34 8.240 8.063 3.630 252 HA GLU 34 HA GLU 34 11.057 8.730 2.753 253 1HB GLU 34 1HB GLU 34 9.841 8.369 5.594 254 2HB GLU 34 2HB GLU 34 11.552 8.601 5.334 255 1HG GLU 34 1HG GLU 34 9.381 10.665 4.618 256 2HG GLU 34 2HG GLU 34 10.344 10.665 6.082 257 HE2 GLU 34 HE2 GLU 34 11.623 12.992 3.499 258 H ALA 35 H ALA 35 9.089 5.929 3.827 259 HA ALA 35 HA ALA 35 11.462 4.199 3.957 260 1HB ALA 35 3HB ALA 35 9.155 3.426 5.040 261 2HB ALA 35 1HB ALA 35 8.509 3.337 3.399 262 3HB ALA 35 2HB ALA 35 9.761 2.226 3.884 263 H LEU 36 H LEU 36 8.854 4.430 1.365 264 HA LEU 36 HA LEU 36 10.390 2.766 -0.487 265 1HB LEU 36 2HB LEU 36 8.220 4.774 -0.902 266 2HB LEU 36 1HB LEU 36 8.726 3.620 -2.097 267 HG LEU 36 HG LEU 36 7.490 3.269 0.116 268 1HD1 LEU 36 1HD2 LEU 36 9.329 0.963 -0.084 269 2HD1 LEU 36 2HD2 LEU 36 8.618 1.767 1.343 270 3HD1 LEU 36 3HD2 LEU 36 7.740 0.501 0.523 271 1HD2 LEU 36 2HD1 LEU 36 5.647 3.154 -0.583 272 2HD2 LEU 36 3HD1 LEU 36 5.946 1.412 -0.836 273 3HD2 LEU 36 1HD1 LEU 36 6.066 2.043 0.794 274 NH1 ARG 37 NH2 ARG 37 13.534 12.533 -0.556 275 NH2 ARG 37 NH1 ARG 37 13.402 13.103 1.639 276 H ARG 37 H ARG 37 10.320 6.380 -0.031 277 HA ARG 37 HA ARG 37 11.706 6.638 -2.540 278 1HB ARG 37 1HB ARG 37 11.805 8.926 -2.406 279 2HB ARG 37 2HB ARG 37 10.340 8.561 -1.541 280 1HG ARG 37 1HG ARG 37 11.912 8.747 0.657 281 2HG ARG 37 2HG ARG 37 13.081 9.464 -0.444 282 1HD ARG 37 1HD ARG 37 11.250 11.140 -1.137 283 2HD ARG 37 2HD ARG 37 10.255 10.449 0.159 284 1HH1 ARG 37 2HH2 ARG 37 13.167 11.962 -1.325 285 2HH1 ARG 37 1HH2 ARG 37 14.305 13.208 -0.606 286 1HH2 ARG 37 1HH1 ARG 37 12.937 12.970 2.544 287 2HH2 ARG 37 2HH1 ARG 37 14.181 13.739 1.436 288 H LYS 38 H LYS 38 12.749 5.861 0.778 289 HA LYS 38 HA LYS 38 15.525 6.918 0.221 290 1HB LYS 38 1HB LYS 38 14.190 7.586 2.331 291 2HB LYS 38 2HB LYS 38 14.541 5.969 2.943 292 1HG LYS 38 1HG LYS 38 17.054 6.570 2.664 293 2HG LYS 38 2HG LYS 38 16.560 8.186 2.189 294 1HD LYS 38 1HD LYS 38 15.968 6.814 4.894 295 2HD LYS 38 2HD LYS 38 17.242 7.988 4.592 296 1HE LYS 38 1HE LYS 38 15.466 9.749 4.022 297 2HE LYS 38 2HE LYS 38 14.205 8.573 4.416 298 1HZ LYS 38 1HZ LYS 38 16.279 9.573 6.281 299 2HZ LYS 38 2HZ LYS 38 14.704 10.011 6.265 300 H GLY 39 H GLY 39 14.117 4.105 -0.527 301 1HA GLY 39 1HA GLY 39 14.896 1.844 -0.846 302 2HA GLY 39 2HA GLY 39 16.478 2.312 -0.246 303 H ASP 40 H ASP 40 13.335 2.484 1.327 304 HA ASP 40 HA ASP 40 14.034 0.369 3.426 305 1HB ASP 40 1HB ASP 40 13.227 3.239 3.831 306 2HB ASP 40 2HB ASP 40 12.786 2.043 5.042 307 HD1 ASP 40 HD2 ASP 40 16.030 1.577 6.184 308 H LYS 41 H LYS 41 12.612 -0.829 4.343 309 HA LYS 41 HA LYS 41 10.014 -1.205 2.806 310 1HB LYS 41 2HB LYS 41 11.210 -3.127 4.850 311 2HB LYS 41 1HB LYS 41 9.805 -3.426 3.843 312 1HG LYS 41 1HG LYS 41 11.386 -3.133 1.779 313 2HG LYS 41 2HG LYS 41 12.730 -3.199 2.914 314 1HD LYS 41 1HD LYS 41 11.938 -5.463 3.733 315 2HD LYS 41 2HD LYS 41 10.560 -5.385 2.628 316 1HE LYS 41 1HE LYS 41 12.154 -5.290 0.646 317 2HE LYS 41 2HE LYS 41 13.530 -5.405 1.757 318 1HZ LYS 41 1HZ LYS 41 12.910 -7.541 0.840 319 2HZ LYS 41 2HZ LYS 41 11.386 -7.432 1.422 320 H VAL 42 H VAL 42 8.099 -0.703 3.740 321 HA VAL 42 HA VAL 42 7.725 0.092 6.427 322 HB VAL 42 HB VAL 42 5.746 -0.492 4.157 323 1HG1 VAL 42 3HG2 VAL 42 4.737 0.178 6.280 324 2HG1 VAL 42 1HG2 VAL 42 5.789 1.657 6.304 325 3HG1 VAL 42 2HG2 VAL 42 4.547 1.450 5.028 326 1HG2 VAL 42 2HG1 VAL 42 7.577 1.030 3.264 327 2HG2 VAL 42 3HG1 VAL 42 6.006 1.849 3.428 328 3HG2 VAL 42 1HG1 VAL 42 7.273 2.102 4.679 329 H GLN 43 H GLN 43 6.276 -0.840 7.596 330 HA GLN 43 HA GLN 43 5.404 -3.722 7.352 331 1HB GLN 43 1HB GLN 43 7.466 -3.406 9.469 332 2HB GLN 43 2HB GLN 43 6.427 -4.802 9.215 333 1HG GLN 43 1HG GLN 43 7.411 -4.939 6.850 334 2HG GLN 43 2HG GLN 43 8.497 -3.621 7.281 335 1HE2 GLN 43 2HE2 GLN 43 10.637 -6.513 7.715 336 2HE2 GLN 43 1HE2 GLN 43 9.881 -5.446 6.434 337 H LEU 44 H LEU 44 3.609 -4.130 7.966 338 HA LEU 44 HA LEU 44 2.362 -3.049 10.510 339 1HB LEU 44 2HB LEU 44 0.732 -3.443 7.936 340 2HB LEU 44 1HB LEU 44 0.227 -2.731 9.461 341 HG LEU 44 HG LEU 44 2.176 -0.948 8.789 342 1HD1 LEU 44 1HD1 LEU 44 2.869 -2.078 6.638 343 2HD1 LEU 44 2HD1 LEU 44 1.221 -1.894 6.004 344 3HD1 LEU 44 3HD1 LEU 44 2.222 -0.461 6.349 345 1HD2 LEU 44 2HD2 LEU 44 -0.262 -0.387 9.189 346 2HD2 LEU 44 3HD2 LEU 44 0.371 0.508 7.794 347 3HD2 LEU 44 1HD2 LEU 44 -0.668 -0.917 7.541 348 H ILE 45 H ILE 45 2.286 -4.982 11.687 349 HA ILE 45 HA ILE 45 2.381 -7.492 10.286 350 HB ILE 45 HB ILE 45 3.679 -6.895 12.348 351 1HG1 ILE 45 1HG1 ILE 45 2.348 -9.641 12.647 352 2HG1 ILE 45 2HG1 ILE 45 3.543 -9.265 11.416 353 1HG2 ILE 45 2HG2 ILE 45 1.806 -5.991 13.717 354 2HG2 ILE 45 3HG2 ILE 45 1.130 -7.629 13.903 355 3HG2 ILE 45 1HG2 ILE 45 2.723 -7.220 14.608 356 1HD1 ILE 45 3HD1 ILE 45 5.251 -8.695 13.196 357 2HD1 ILE 45 1HD1 ILE 45 4.069 -9.148 14.454 358 3HD1 ILE 45 2HD1 ILE 45 4.659 -10.370 13.306 359 H GLY 46 H GLY 46 -0.172 -6.221 11.232 360 1HA GLY 46 1HA GLY 46 -1.884 -8.784 10.737 361 2HA GLY 46 2HA GLY 46 -2.487 -7.556 11.828 362 H PHE 47 H PHE 47 -0.812 -6.397 8.924 363 HA PHE 47 HA PHE 47 -3.388 -6.078 7.382 364 1HB PHE 47 2HB PHE 47 -2.775 -4.286 9.302 365 2HB PHE 47 1HB PHE 47 -1.566 -3.707 8.213 366 HD1 PHE 47 HD1 PHE 47 -5.173 -4.162 8.835 367 HD2 PHE 47 HD2 PHE 47 -2.365 -2.574 5.983 368 HE1 PHE 47 HE1 PHE 47 -6.989 -3.182 7.595 369 HE2 PHE 47 HE2 PHE 47 -4.239 -1.636 4.682 370 HZ PHE 47 HZ PHE 47 -6.563 -1.975 5.438 371 H GLY 48 H GLY 48 0.178 -5.508 7.258 372 1HA GLY 48 1HA GLY 48 0.324 -5.859 4.428 373 2HA GLY 48 2HA GLY 48 0.156 -4.134 4.681 374 H ASN 49 H ASN 49 2.158 -5.105 3.328 375 HA ASN 49 HA ASN 49 4.511 -4.103 4.932 376 1HB ASN 49 1HB ASN 49 4.580 -6.573 5.279 377 2HB ASN 49 2HB ASN 49 4.626 -6.862 3.553 378 1HD2 ASN 49 1HD2 ASN 49 8.121 -7.113 4.921 379 2HD2 ASN 49 2HD2 ASN 49 6.494 -7.851 5.338 380 H PHE 50 H PHE 50 4.647 -2.323 3.681 381 HA PHE 50 HA PHE 50 4.464 -2.471 0.686 382 1HB PHE 50 2HB PHE 50 5.472 -0.019 2.213 383 2HB PHE 50 1HB PHE 50 5.177 -0.066 0.570 384 HD1 PHE 50 HD1 PHE 50 3.528 -0.500 3.847 385 HD2 PHE 50 HD2 PHE 50 3.355 1.200 -0.067 386 HE1 PHE 50 HE1 PHE 50 1.439 0.707 4.470 387 HE2 PHE 50 HE2 PHE 50 1.266 2.407 0.568 388 HZ PHE 50 HZ PHE 50 0.333 2.067 2.830 389 H GLU 51 H GLU 51 6.150 -2.119 -0.695 390 HA GLU 51 HA GLU 51 8.715 -1.379 0.182 391 1HB GLU 51 1HB GLU 51 10.162 -3.447 -0.138 392 2HB GLU 51 2HB GLU 51 9.033 -3.716 1.151 393 1HG GLU 51 1HG GLU 51 8.669 -4.816 -1.719 394 2HG GLU 51 2HG GLU 51 9.467 -5.674 -0.418 395 HE2 GLU 51 HE2 GLU 51 5.485 -5.643 -0.695 396 H VAL 52 H VAL 52 10.529 -1.291 -1.352 397 HA VAL 52 HA VAL 52 9.362 -0.527 -3.921 398 HB VAL 52 HB VAL 52 11.136 0.530 -1.855 399 1HG1 VAL 52 1HG2 VAL 52 12.797 -0.300 -4.238 400 2HG1 VAL 52 2HG2 VAL 52 13.221 0.950 -3.007 401 3HG1 VAL 52 3HG2 VAL 52 12.966 -0.766 -2.540 402 1HG2 VAL 52 3HG1 VAL 52 10.487 1.585 -4.622 403 2HG2 VAL 52 1HG1 VAL 52 9.666 1.881 -3.069 404 3HG2 VAL 52 2HG1 VAL 52 11.319 2.453 -3.306 405 NH1 ARG 53 NH2 ARG 53 7.704 -6.663 -11.087 406 NH2 ARG 53 NH1 ARG 53 9.403 -8.137 -11.422 407 H ARG 53 H ARG 53 10.346 -1.142 -5.875 408 HA ARG 53 HA ARG 53 11.765 -3.889 -5.895 409 1HB ARG 53 1HB ARG 53 9.265 -3.933 -6.542 410 2HB ARG 53 2HB ARG 53 9.671 -2.919 -7.908 411 1HG ARG 53 1HG ARG 53 11.314 -4.707 -8.719 412 2HG ARG 53 2HG ARG 53 10.777 -5.746 -7.394 413 1HD ARG 53 1HD ARG 53 8.411 -5.693 -8.303 414 2HD ARG 53 2HD ARG 53 8.925 -4.584 -9.588 415 1HH1 ARG 53 2HH2 ARG 53 7.345 -5.863 -10.555 416 2HH1 ARG 53 1HH2 ARG 53 7.228 -7.156 -11.851 417 1HH2 ARG 53 1HH1 ARG 53 10.337 -8.461 -11.147 418 2HH2 ARG 53 2HH1 ARG 53 8.809 -8.529 -12.161 419 H GLU 54 H GLU 54 13.791 -3.093 -6.185 420 HA GLU 54 HA GLU 54 14.474 -0.883 -7.990 421 1HB GLU 54 1HB GLU 54 15.813 -1.579 -5.938 422 2HB GLU 54 2HB GLU 54 16.350 -3.009 -6.795 423 1HG GLU 54 1HG GLU 54 18.143 -1.454 -6.957 424 2HG GLU 54 2HG GLU 54 17.442 -1.471 -8.562 425 HE2 GLU 54 HE2 GLU 54 17.642 1.872 -6.391 426 NH1 ARG 55 NH2 ARG 55 11.741 -5.995 -15.132 427 NH2 ARG 55 NH1 ARG 55 12.065 -5.287 -17.269 428 H ARG 55 H ARG 55 14.452 -0.964 -10.113 429 HA ARG 55 HA ARG 55 14.407 -3.534 -11.660 430 1HB ARG 55 1HB ARG 55 12.905 -1.543 -12.199 431 2HB ARG 55 2HB ARG 55 14.316 -0.625 -12.678 432 1HG ARG 55 1HG ARG 55 13.253 -1.423 -14.663 433 2HG ARG 55 2HG ARG 55 14.773 -2.299 -14.531 434 1HD ARG 55 1HD ARG 55 13.554 -4.326 -13.643 435 2HD ARG 55 2HD ARG 55 12.021 -3.435 -13.659 436 1HH1 ARG 55 2HH2 ARG 55 11.856 -5.803 -14.131 437 2HH1 ARG 55 1HH2 ARG 55 11.313 -6.827 -15.553 438 1HH2 ARG 55 1HH1 ARG 55 12.421 -4.559 -17.897 439 2HH2 ARG 55 2HH1 ARG 55 11.615 -6.168 -17.541 440 H ALA 56 H ALA 56 16.222 -4.458 -12.351 441 HA ALA 56 HA ALA 56 18.825 -3.620 -11.642 442 1HB ALA 56 2HB ALA 56 18.243 -5.968 -12.080 443 2HB ALA 56 3HB ALA 56 18.084 -5.656 -13.827 444 3HB ALA 56 1HB ALA 56 19.669 -5.512 -13.029 445 H ALA 57 H ALA 57 19.751 -1.802 -12.300 446 HA ALA 57 HA ALA 57 19.848 -0.485 -14.767 447 1HB ALA 57 3HB ALA 57 20.887 0.419 -12.653 448 2HB ALA 57 1HB ALA 57 22.220 -0.754 -12.780 449 3HB ALA 57 2HB ALA 57 22.041 0.531 -13.992 450 NH1 ARG 58 NH2 ARG 58 17.926 -6.387 -16.692 451 NH2 ARG 58 NH1 ARG 58 15.856 -5.455 -16.793 452 H ARG 58 H ARG 58 20.512 -0.671 -16.673 453 HA ARG 58 HA ARG 58 21.773 -3.232 -17.371 454 1HB ARG 58 2HB ARG 58 20.647 -1.220 -19.368 455 2HB ARG 58 1HB ARG 58 21.038 -2.895 -19.706 456 1HG ARG 58 1HG ARG 58 18.778 -1.879 -17.888 457 2HG ARG 58 2HG ARG 58 18.611 -2.458 -19.536 458 1HD ARG 58 1HD ARG 58 19.323 -4.772 -18.870 459 2HD ARG 58 2HD ARG 58 19.646 -4.222 -17.217 460 1HH1 ARG 58 2HH2 ARG 58 18.923 -6.307 -16.922 461 2HH1 ARG 58 1HH2 ARG 58 17.470 -7.161 -16.196 462 1HH2 ARG 58 1HH1 ARG 58 15.273 -4.668 -17.097 463 2HH2 ARG 58 2HH1 ARG 58 15.544 -6.293 -16.290 464 H LYS 59 H LYS 59 23.025 -2.639 -19.825 465 HA LYS 59 HA LYS 59 25.106 -0.545 -19.411 466 1HB LYS 59 1HB LYS 59 25.945 -2.553 -18.040 467 2HB LYS 59 2HB LYS 59 26.152 -3.445 -19.539 468 1HG LYS 59 1HG LYS 59 27.815 -1.725 -20.337 469 2HG LYS 59 2HG LYS 59 27.484 -0.717 -18.927 470 1HD LYS 59 1HD LYS 59 28.308 -2.570 -17.403 471 2HD LYS 59 2HD LYS 59 28.691 -3.556 -18.819 472 1HE LYS 59 1HE LYS 59 30.346 -1.817 -19.602 473 2HE LYS 59 2HE LYS 59 29.934 -0.777 -18.231 474 1HZ LYS 59 1HZ LYS 59 31.075 -3.510 -18.022 475 2HZ LYS 59 2HZ LYS 59 30.693 -2.555 -16.751 476 H GLY 60 H GLY 60 25.347 0.342 -21.318 477 1HA GLY 60 1HA GLY 60 24.850 -1.287 -23.906 478 2HA GLY 60 2HA GLY 60 24.192 0.316 -23.659 479 NH1 ARG 61 NH2 ARG 61 31.571 -0.622 -30.342 480 NH2 ARG 61 NH1 ARG 61 32.951 1.182 -30.217 481 H ARG 61 H ARG 61 25.262 1.539 -25.053 482 HA ARG 61 HA ARG 61 28.231 1.926 -24.826 483 1HB ARG 61 1HB ARG 61 27.994 0.082 -26.529 484 2HB ARG 61 2HB ARG 61 27.033 1.132 -27.563 485 1HG ARG 61 1HG ARG 61 28.974 2.686 -27.849 486 2HG ARG 61 2HG ARG 61 29.908 1.799 -26.647 487 1HD ARG 61 1HD ARG 61 29.821 -0.274 -28.151 488 2HD ARG 61 2HD ARG 61 28.972 0.683 -29.380 489 1HH1 ARG 61 2HH2 ARG 61 30.686 -1.055 -30.055 490 2HH1 ARG 61 1HH2 ARG 61 32.283 -1.030 -30.958 491 1HH2 ARG 61 1HH1 ARG 61 33.120 2.119 -29.836 492 2HH2 ARG 61 2HH1 ARG 61 33.567 0.652 -30.843 493 H ASN 62 H ASN 62 28.729 3.980 -25.078 494 HA ASN 62 HA ASN 62 26.623 6.004 -25.365 495 1HB ASN 62 1HB ASN 62 28.607 6.130 -23.778 496 2HB ASN 62 2HB ASN 62 29.649 6.469 -25.163 497 1HD2 ASN 62 2HD2 ASN 62 28.721 9.942 -25.075 498 2HD2 ASN 62 1HD2 ASN 62 29.777 8.620 -25.786 499 HA PRO 63 HA PRO 63 26.988 6.341 -29.955 500 1HB PRO 63 1HB PRO 63 25.780 9.111 -29.459 501 2HB PRO 63 2HB PRO 63 25.350 7.911 -30.696 502 1HG PRO 63 1HG PRO 63 23.829 8.123 -28.458 503 2HG PRO 63 2HG PRO 63 24.244 6.502 -29.065 504 1HD PRO 63 1HD PRO 63 25.521 8.013 -26.724 505 2HD PRO 63 2HD PRO 63 25.066 6.287 -26.863 506 H GLN 64 H GLN 64 28.211 9.188 -28.115 507 HA GLN 64 HA GLN 64 29.774 10.249 -30.420 508 1HB GLN 64 1HB GLN 64 28.768 11.679 -28.494 509 2HB GLN 64 2HB GLN 64 29.965 10.998 -27.429 510 1HG GLN 64 1HG GLN 64 30.778 13.117 -28.025 511 2HG GLN 64 2HG GLN 64 31.813 11.970 -28.863 512 1HE2 GLN 64 2HE2 GLN 64 31.013 13.337 -32.095 513 2HE2 GLN 64 1HE2 GLN 64 32.007 12.174 -31.082 514 H THR 65 H THR 65 30.789 9.160 -27.244 515 HA THR 65 HA THR 65 33.588 8.855 -27.963 516 HB THR 65 HB THR 65 33.945 8.324 -25.611 517 HG1 THR 65 HG1 THR 65 32.199 6.931 -25.346 518 1HG2 THR 65 2HG2 THR 65 33.355 10.768 -26.202 519 2HG2 THR 65 3HG2 THR 65 31.676 10.427 -25.757 520 3HG2 THR 65 1HG2 THR 65 32.937 10.319 -24.517 521 H GLY 66 H GLY 66 31.123 6.344 -27.586 522 1HA GLY 66 1HA GLY 66 31.251 4.011 -28.138 523 2HA GLY 66 2HA GLY 66 32.917 4.197 -28.645 524 H GLU 67 H GLU 67 31.611 5.037 -25.422 525 HA GLU 67 HA GLU 67 33.369 2.918 -24.099 526 1HB GLU 67 2HB GLU 67 33.777 5.414 -23.669 527 2HB GLU 67 1HB GLU 67 32.197 5.527 -22.906 528 1HG GLU 67 1HG GLU 67 34.472 3.660 -21.954 529 2HG GLU 67 2HG GLU 67 34.265 5.307 -21.394 530 HE2 GLU 67 HE2 GLU 67 32.537 2.533 -19.377 531 H GLU 68 H GLU 68 32.378 1.497 -22.786 532 HA GLU 68 HA GLU 68 29.474 1.061 -23.146 533 1HB GLU 68 1HB GLU 68 31.325 -0.570 -21.317 534 2HB GLU 68 2HB GLU 68 29.713 -1.024 -21.835 535 1HG GLU 68 1HG GLU 68 32.234 -0.840 -23.592 536 2HG GLU 68 2HG GLU 68 31.454 -2.297 -23.016 537 HE2 GLU 68 HE2 GLU 68 30.237 -0.464 -26.345 538 H MET 69 H MET 69 28.126 2.362 -22.066 539 HA MET 69 HA MET 69 28.789 3.275 -19.242 540 1HB MET 69 1HB MET 69 27.600 5.201 -19.512 541 2HB MET 69 2HB MET 69 28.393 5.016 -21.052 542 1HG MET 69 1HG MET 69 25.407 4.511 -20.435 543 2HG MET 69 2HG MET 69 26.078 5.893 -21.299 544 1HE MET 69 1HE MET 69 23.717 4.394 -22.391 545 2HE MET 69 3HE MET 69 24.016 3.222 -23.711 546 3HE MET 69 2HE MET 69 24.140 2.700 -22.015 547 H GLU 70 H GLU 70 27.563 2.850 -17.544 548 HA GLU 70 HA GLU 70 25.489 0.768 -17.660 549 1HB GLU 70 2HB GLU 70 25.283 0.849 -15.288 550 2HB GLU 70 1HB GLU 70 26.975 0.757 -15.774 551 1HG GLU 70 1HG GLU 70 27.236 3.240 -15.254 552 2HG GLU 70 2HG GLU 70 25.549 3.310 -14.751 553 HE1 GLU 70 HE2 GLU 70 25.985 1.689 -11.726 554 H ILE 71 H ILE 71 23.340 0.980 -17.955 555 HA ILE 71 HA ILE 71 22.102 3.658 -18.282 556 HB ILE 71 HB ILE 71 21.125 0.790 -18.790 557 1HG1 ILE 71 1HG1 ILE 71 22.020 2.912 -20.859 558 2HG1 ILE 71 2HG1 ILE 71 23.092 1.658 -20.270 559 1HG2 ILE 71 2HG2 ILE 71 19.221 2.321 -18.410 560 2HG2 ILE 71 3HG2 ILE 71 19.864 3.455 -19.637 561 3HG2 ILE 71 1HG2 ILE 71 19.298 1.819 -20.110 562 1HD1 ILE 71 3HD1 ILE 71 21.664 -0.147 -21.207 563 2HD1 ILE 71 1HD1 ILE 71 20.533 1.074 -21.862 564 3HD1 ILE 71 2HD1 ILE 71 22.208 1.007 -22.443 565 HA PRO 72 HA PRO 72 21.071 3.262 -13.831 566 1HB PRO 72 1HB PRO 72 19.034 5.489 -14.468 567 2HB PRO 72 2HB PRO 72 20.147 5.377 -13.088 568 1HG PRO 72 1HG PRO 72 20.801 6.950 -15.198 569 2HG PRO 72 2HG PRO 72 22.059 5.916 -14.473 570 1HD PRO 72 1HD PRO 72 20.472 5.421 -17.044 571 2HD PRO 72 2HD PRO 72 22.209 5.168 -16.703 572 H ALA 73 H ALA 73 19.586 2.823 -12.292 573 HA ALA 73 HA ALA 73 17.448 0.871 -13.024 574 1HB ALA 73 1HB ALA 73 19.069 0.653 -10.987 575 2HB ALA 73 2HB ALA 73 18.256 2.079 -10.251 576 3HB ALA 73 3HB ALA 73 17.368 0.586 -10.514 577 H SER 74 H SER 74 15.554 0.898 -11.438 578 HA SER 74 HA SER 74 14.845 3.334 -10.299 579 1HB SER 74 1HB SER 74 12.564 3.959 -11.307 580 2HB SER 74 2HB SER 74 13.852 4.102 -12.492 581 HG SER 74 HG SER 74 13.290 2.013 -13.248 582 H LYS 75 H LYS 75 13.639 3.236 -8.596 583 HA LYS 75 HA LYS 75 12.782 0.558 -7.583 584 1HB LYS 75 2HB LYS 75 12.222 2.861 -5.794 585 2HB LYS 75 1HB LYS 75 12.822 1.274 -5.503 586 1HG LYS 75 1HG LYS 75 15.092 1.889 -6.203 587 2HG LYS 75 2HG LYS 75 14.577 3.480 -6.740 588 1HD LYS 75 1HD LYS 75 14.533 2.489 -3.832 589 2HD LYS 75 2HD LYS 75 15.796 3.458 -4.541 590 1HE LYS 75 1HE LYS 75 12.863 4.404 -4.236 591 2HE LYS 75 2HE LYS 75 14.168 4.746 -3.109 592 1HZ LYS 75 1HZ LYS 75 15.346 5.901 -4.887 593 2HZ LYS 75 2HZ LYS 75 14.146 5.583 -5.952 594 H VAL 76 H VAL 76 10.513 -0.255 -7.712 595 HA VAL 76 HA VAL 76 8.412 1.630 -8.274 596 HB VAL 76 HB VAL 76 9.631 -0.988 -9.045 597 1HG1 VAL 76 3HG2 VAL 76 6.692 -0.875 -9.028 598 2HG1 VAL 76 1HG2 VAL 76 7.805 -2.075 -9.874 599 3HG1 VAL 76 2HG2 VAL 76 7.782 -1.965 -8.106 600 1HG2 VAL 76 2HG1 VAL 76 9.724 1.000 -10.479 601 2HG2 VAL 76 3HG1 VAL 76 8.924 -0.384 -11.250 602 3HG2 VAL 76 1HG1 VAL 76 7.936 0.977 -10.612 603 HA PRO 77 HA PRO 77 7.124 0.358 -4.024 604 1HB PRO 77 1HB PRO 77 5.129 2.242 -3.618 605 2HB PRO 77 2HB PRO 77 6.831 2.702 -3.788 606 1HG PRO 77 1HG PRO 77 4.666 2.751 -5.948 607 2HG PRO 77 2HG PRO 77 5.807 4.037 -5.523 608 1HD PRO 77 1HD PRO 77 6.231 2.107 -7.647 609 2HD PRO 77 2HD PRO 77 7.589 2.895 -6.803 610 H ALA 78 H ALA 78 6.038 -0.985 -3.252 611 HA ALA 78 HA ALA 78 3.365 -2.016 -4.353 612 1HB ALA 78 2HB ALA 78 5.510 -3.308 -4.894 613 2HB ALA 78 3HB ALA 78 5.804 -3.521 -3.154 614 3HB ALA 78 1HB ALA 78 4.371 -4.260 -3.913 615 H PHE 79 H PHE 79 2.359 -3.483 -2.760 616 HA PHE 79 HA PHE 79 2.405 -2.689 0.228 617 1HB PHE 79 2HB PHE 79 1.146 -0.989 -0.371 618 2HB PHE 79 1HB PHE 79 0.177 -1.989 -1.513 619 HD1 PHE 79 HD2 PHE 79 0.879 -1.603 2.182 620 HD2 PHE 79 HD1 PHE 79 -1.872 -3.022 -0.798 621 HE1 PHE 79 HE2 PHE 79 -0.765 -2.125 3.938 622 HE2 PHE 79 HE1 PHE 79 -3.472 -3.612 0.971 623 HZ PHE 79 HZ PHE 79 -2.915 -3.188 3.338 624 H LYS 80 H LYS 80 2.359 -4.587 0.913 625 HA LYS 80 HA LYS 80 1.136 -7.273 -0.191 626 1HB LYS 80 2HB LYS 80 2.819 -6.760 2.269 627 2HB LYS 80 1HB LYS 80 2.121 -8.299 1.843 628 1HG LYS 80 1HG LYS 80 4.205 -6.789 0.139 629 2HG LYS 80 2HG LYS 80 4.569 -8.046 1.307 630 1HD LYS 80 1HD LYS 80 3.207 -9.707 -0.032 631 2HD LYS 80 2HD LYS 80 2.848 -8.450 -1.222 632 1HE LYS 80 1HE LYS 80 5.330 -8.179 -1.701 633 2HE LYS 80 2HE LYS 80 5.696 -9.441 -0.516 634 1HZ LYS 80 1HZ LYS 80 4.071 -9.791 -2.974 635 2HZ LYS 80 2HZ LYS 80 5.615 -10.285 -2.768 636 HA PRO 81 HA PRO 81 -2.273 -6.533 2.716 637 1HB PRO 81 1HB PRO 81 -3.700 -8.869 2.314 638 2HB PRO 81 2HB PRO 81 -3.506 -7.692 1.015 639 1HG PRO 81 1HG PRO 81 -1.886 -10.251 1.470 640 2HG PRO 81 2HG PRO 81 -2.702 -9.732 -0.027 641 1HD PRO 81 1HD PRO 81 0.014 -9.240 0.517 642 2HD PRO 81 2HD PRO 81 -0.969 -8.180 -0.542 643 H GLY 82 H GLY 82 0.300 -7.472 3.716 644 1HA GLY 82 1HA GLY 82 1.449 -8.970 5.284 645 2HA GLY 82 2HA GLY 82 0.106 -8.370 6.249 646 H LYS 83 H LYS 83 -0.772 -10.430 3.721 647 HA LYS 83 HA LYS 83 -1.784 -12.621 3.645 648 1HB LYS 83 2HB LYS 83 0.104 -13.122 5.901 649 2HB LYS 83 1HB LYS 83 -1.351 -13.988 6.154 650 1HG LYS 83 1HG LYS 83 0.355 -14.130 3.567 651 2HG LYS 83 2HG LYS 83 0.467 -15.268 4.905 652 1HD LYS 83 1HD LYS 83 -1.914 -15.991 4.556 653 2HD LYS 83 2HD LYS 83 -2.098 -14.835 3.236 654 1HE LYS 83 1HE LYS 83 -0.272 -16.019 1.927 655 2HE LYS 83 2HE LYS 83 -0.096 -17.195 3.240 656 1HZ LYS 83 1HZ LYS 83 -2.431 -17.800 2.915 657 2HZ LYS 83 2HZ LYS 83 -2.593 -16.712 1.706 658 H ALA 84 H ALA 84 -1.931 -11.159 6.646 659 HA ALA 84 HA ALA 84 -4.377 -12.049 7.902 660 1HB ALA 84 2HB ALA 84 -2.456 -10.820 8.948 661 2HB ALA 84 3HB ALA 84 -2.788 -9.388 7.939 662 3HB ALA 84 1HB ALA 84 -3.966 -9.878 9.186 663 H LEU 85 H LEU 85 -3.844 -9.082 5.833 664 HA LEU 85 HA LEU 85 -6.660 -8.307 5.795 665 1HB LEU 85 2HB LEU 85 -4.842 -6.682 5.429 666 2HB LEU 85 1HB LEU 85 -4.308 -7.558 4.003 667 HG LEU 85 HG LEU 85 -6.623 -7.299 3.101 668 1HD1 LEU 85 1HD1 LEU 85 -7.830 -6.445 5.086 669 2HD1 LEU 85 2HD1 LEU 85 -6.814 -4.985 5.106 670 3HD1 LEU 85 3HD1 LEU 85 -7.940 -5.285 3.749 671 1HD2 LEU 85 1HD2 LEU 85 -4.623 -6.073 2.151 672 2HD2 LEU 85 2HD2 LEU 85 -6.040 -5.028 2.066 673 3HD2 LEU 85 3HD2 LEU 85 -4.822 -4.771 3.344 674 H LYS 86 H LYS 86 -4.635 -10.388 3.779 675 HA LYS 86 HA LYS 86 -6.569 -11.004 1.696 676 1HB LYS 86 1HB LYS 86 -4.030 -11.698 1.831 677 2HB LYS 86 2HB LYS 86 -4.600 -13.129 2.672 678 1HG LYS 86 1HG LYS 86 -6.120 -13.623 0.664 679 2HG LYS 86 2HG LYS 86 -5.405 -12.254 -0.173 680 1HD LYS 86 1HD LYS 86 -3.882 -14.742 0.856 681 2HD LYS 86 2HD LYS 86 -4.438 -14.498 -0.795 682 1HE LYS 86 1HE LYS 86 -2.919 -12.465 -1.023 683 2HE LYS 86 2HE LYS 86 -2.327 -12.732 0.624 684 1HZ LYS 86 1HZ LYS 86 -0.885 -13.699 -1.038 685 2HZ LYS 86 2HZ LYS 86 -2.080 -14.649 -1.624 686 H ASP 87 H ASP 87 -6.536 -12.066 5.072 687 HA ASP 87 HA ASP 87 -8.667 -14.106 4.743 688 1HB ASP 87 1HB ASP 87 -6.633 -13.431 6.676 689 2HB ASP 87 2HB ASP 87 -8.076 -12.906 7.438 690 HD1 ASP 87 HD2 ASP 87 -9.349 -16.134 7.931 691 H ALA 88 H ALA 88 -8.456 -10.677 5.929 692 HA ALA 88 HA ALA 88 -11.238 -10.175 6.615 693 1HB ALA 88 1HB ALA 88 -9.393 -8.358 6.828 694 2HB ALA 88 2HB ALA 88 -9.384 -8.197 5.065 695 3HB ALA 88 3HB ALA 88 -10.823 -7.755 5.952 696 H VAL 89 H VAL 89 -9.615 -9.938 3.456 697 HA VAL 89 HA VAL 89 -12.016 -9.114 1.986 698 HB VAL 89 HB VAL 89 -9.445 -8.237 2.315 699 1HG1 VAL 89 2HG2 VAL 89 -8.589 -10.586 1.577 700 2HG1 VAL 89 3HG2 VAL 89 -8.886 -10.041 -0.078 701 3HG1 VAL 89 1HG2 VAL 89 -7.784 -9.123 1.005 702 1HG2 VAL 89 1HG1 VAL 89 -10.721 -8.273 -0.368 703 2HG2 VAL 89 2HG1 VAL 89 -11.016 -7.149 1.023 704 3HG2 VAL 89 3HG1 VAL 89 -9.396 -7.210 0.268 705 H LYS 90 H LYS 90 -10.933 -12.220 2.643 706 HA LYS 90 HA LYS 90 -10.851 -13.499 0.077 707 1HB LYS 90 1HB LYS 90 -10.148 -14.234 2.590 708 2HB LYS 90 2HB LYS 90 -11.720 -14.968 2.644 709 1HG LYS 90 1HG LYS 90 -11.120 -16.489 0.765 710 2HG LYS 90 2HG LYS 90 -9.690 -15.535 0.391 711 1HD LYS 90 1HD LYS 90 -8.886 -17.467 1.529 712 2HD LYS 90 2HD LYS 90 -8.659 -16.104 2.614 713 1HE LYS 90 1HE LYS 90 -10.757 -16.800 3.906 714 2HE LYS 90 2HE LYS 90 -10.969 -18.168 2.804 715 1HZ LYS 90 1HZ LYS 90 -8.634 -17.698 4.575 716 2HZ LYS 90 2HZ LYS 90 -9.828 -18.785 4.829 717 1H MET 1 1H MET 91 9.157 -0.586 8.740 718 2H MET 1 2H MET 91 10.294 -1.242 9.792 719 HA MET 1 HA MET 91 9.198 -0.138 11.310 720 1HB MET 1 1HB MET 91 6.694 -0.338 9.531 721 2HB MET 1 2HB MET 91 6.722 0.472 11.065 722 1HG MET 1 1HG MET 91 8.339 2.179 10.181 723 2HG MET 1 2HG MET 91 8.344 1.342 8.604 724 1HE MET 1 2HE MET 91 7.535 4.258 8.491 725 2HE MET 1 1HE MET 91 7.248 3.223 7.066 726 3HE MET 1 3HE MET 91 5.941 4.280 7.666 727 H ASN 2 H ASN 92 6.264 -1.727 10.925 728 HA ASN 2 HA ASN 92 6.145 -4.166 11.374 729 1HB ASN 2 1HB ASN 92 6.307 -5.202 13.508 730 2HB ASN 2 2HB ASN 92 7.816 -4.432 13.126 731 1HD2 ASN 2 1HD2 ASN 92 7.843 -2.568 16.204 732 2HD2 ASN 2 2HD2 ASN 92 8.694 -2.974 14.630 733 H LYS 3 H LYS 93 5.046 -1.427 12.806 734 HA LYS 3 HA LYS 93 2.558 -0.832 12.387 735 1HB LYS 3 1HB LYS 93 1.764 -3.290 12.526 736 2HB LYS 3 2HB LYS 93 1.922 -3.197 14.259 737 1HG LYS 3 1HG LYS 93 0.109 -1.419 14.300 738 2HG LYS 3 2HG LYS 93 0.164 -1.294 12.549 739 1HD LYS 3 1HD LYS 93 -1.804 -2.557 13.060 740 2HD LYS 3 2HD LYS 93 -0.664 -3.649 12.309 741 1HE LYS 3 1HE LYS 93 -1.717 -4.863 14.108 742 2HE LYS 3 2HE LYS 93 -0.057 -4.584 14.620 743 1HZ LYS 3 1HZ LYS 93 -1.585 -4.127 16.390 744 2HZ LYS 3 2HZ LYS 93 -0.840 -2.733 15.974 745 H THR 4 H THR 94 4.721 -1.507 15.089 746 HA THR 4 HA THR 94 3.483 0.462 16.854 747 HB THR 4 HB THR 94 5.785 -1.603 17.008 748 HG1 THR 4 HG1 THR 94 3.643 -2.478 16.944 749 1HG2 THR 4 3HG2 THR 94 4.487 0.206 19.055 750 2HG2 THR 4 1HG2 THR 94 5.586 -1.202 19.434 751 3HG2 THR 4 2HG2 THR 94 6.195 0.207 18.478 752 H GLU 5 H GLU 95 6.222 -0.033 14.659 753 HA GLU 5 HA GLU 95 7.689 2.490 15.463 754 1HB GLU 5 1HB GLU 95 7.945 1.111 12.763 755 2HB GLU 5 2HB GLU 95 8.998 2.333 13.424 756 1HG GLU 5 1HG GLU 95 8.724 -0.580 14.347 757 2HG GLU 5 2HG GLU 95 10.048 0.096 13.436 758 HE1 GLU 5 HE2 GLU 95 11.637 1.617 16.137 759 H LEU 6 H LEU 96 4.884 1.576 13.837 760 HA LEU 6 HA LEU 96 4.330 3.944 12.133 761 1HB LEU 6 2HB LEU 96 3.161 1.343 12.493 762 2HB LEU 6 1HB LEU 96 1.988 2.363 13.279 763 HG LEU 6 HG LEU 96 2.916 2.712 10.440 764 1HD1 LEU 6 1HD1 LEU 96 1.491 0.723 10.729 765 2HD1 LEU 6 2HD1 LEU 96 0.250 1.702 11.539 766 3HD1 LEU 6 3HD1 LEU 96 0.627 1.982 9.822 767 1HD2 LEU 6 1HD2 LEU 96 1.312 4.570 12.189 768 2HD2 LEU 6 2HD2 LEU 96 2.405 4.928 10.850 769 3HD2 LEU 6 3HD2 LEU 96 0.754 4.348 10.534 770 H ILE 7 H ILE 97 3.311 2.763 15.383 771 HA ILE 7 HA ILE 97 1.687 5.035 16.151 772 HB ILE 7 HB ILE 97 3.247 3.146 18.033 773 1HG1 ILE 7 1HG1 ILE 97 0.361 2.743 17.049 774 2HG1 ILE 7 2HG1 ILE 97 1.699 1.964 16.296 775 1HG2 ILE 7 2HG2 ILE 97 2.254 5.180 19.201 776 2HG2 ILE 7 3HG2 ILE 97 0.665 4.688 18.635 777 3HG2 ILE 7 1HG2 ILE 97 1.555 3.655 19.764 778 1HD1 ILE 7 3HD1 ILE 97 2.344 0.877 18.532 779 2HD1 ILE 7 1HD1 ILE 97 0.763 1.380 19.115 780 3HD1 ILE 7 2HD1 ILE 97 0.880 0.306 17.694 781 H ASN 8 H ASN 98 5.093 4.325 16.902 782 HA ASN 8 HA ASN 98 5.570 6.979 18.140 783 1HB ASN 8 1HB ASN 98 7.671 5.001 16.986 784 2HB ASN 8 2HB ASN 98 8.061 6.416 17.936 785 1HD2 ASN 8 2HD2 ASN 98 7.216 3.057 19.986 786 2HD2 ASN 8 1HD2 ASN 98 7.415 3.128 18.163 787 H ALA 9 H ALA 99 5.311 6.177 14.803 788 HA ALA 9 HA ALA 99 6.871 8.532 13.756 789 1HB ALA 9 2HB ALA 99 6.115 6.460 12.207 790 2HB ALA 9 3HB ALA 99 4.455 7.024 12.410 791 3HB ALA 9 1HB ALA 99 5.571 8.071 11.601 792 H VAL 10 H VAL 100 3.457 7.751 14.515 793 HA VAL 10 HA VAL 100 2.439 10.223 13.520 794 HB VAL 10 HB VAL 100 0.787 8.563 15.416 795 1HG1 VAL 10 3HG2 VAL 100 0.010 10.645 14.006 796 2HG1 VAL 10 1HG2 VAL 100 -0.059 9.461 12.673 797 3HG1 VAL 10 2HG2 VAL 100 -1.026 9.180 14.137 798 1HG2 VAL 10 1HG1 VAL 100 1.828 7.605 12.729 799 2HG2 VAL 10 2HG1 VAL 100 1.764 6.835 14.345 800 3HG2 VAL 10 3HG1 VAL 100 0.252 7.005 13.403 801 H ALA 11 H ALA 101 2.787 8.887 16.606 802 HA ALA 11 HA ALA 101 2.123 11.334 17.843 803 1HB ALA 11 2HB ALA 101 1.972 9.086 19.065 804 2HB ALA 11 3HB ALA 101 3.745 8.947 19.056 805 3HB ALA 11 1HB ALA 101 2.945 10.198 20.058 806 H GLU 12 H GLU 102 5.198 10.385 16.527 807 HA GLU 12 HA GLU 102 6.687 12.584 17.924 808 1HB GLU 12 1HB GLU 102 7.940 10.551 17.287 809 2HB GLU 12 2HB GLU 102 7.504 10.749 15.588 810 1HG GLU 12 1HG GLU 102 8.859 12.851 15.450 811 2HG GLU 12 2HG GLU 102 9.231 12.756 17.169 812 HE1 GLU 12 HE2 GLU 102 11.061 10.377 14.442 813 H THR 13 H THR 103 5.442 12.016 14.555 814 HA THR 13 HA THR 103 5.997 14.892 13.974 815 HB THR 13 HB THR 103 6.449 12.908 12.480 816 HG1 THR 13 HG1 THR 103 5.190 15.203 11.424 817 1HG2 THR 13 3HG2 THR 103 4.057 12.002 12.362 818 2HG2 THR 13 1HG2 THR 103 3.651 13.406 11.354 819 3HG2 THR 13 2HG2 THR 103 4.888 12.236 10.801 820 H SER 14 H SER 104 3.645 13.840 15.458 821 HA SER 14 HA SER 104 1.984 16.358 14.810 822 1HB SER 14 1HB SER 104 -0.150 15.324 14.715 823 2HB SER 14 2HB SER 104 0.916 14.390 13.659 824 HG SER 14 HG SER 104 -0.380 13.101 14.963 825 H GLY 15 H GLY 105 3.031 14.316 17.467 826 1HA GLY 15 1HA GLY 105 2.816 14.622 19.797 827 2HA GLY 15 2HA GLY 105 2.422 16.304 19.475 828 H LEU 16 H LEU 106 0.788 13.238 18.907 829 HA LEU 16 HA LEU 106 -1.658 13.979 20.530 830 1HB LEU 16 1HB LEU 106 -2.831 12.210 19.428 831 2HB LEU 16 2HB LEU 106 -2.396 13.593 18.446 832 HG LEU 16 HG LEU 106 -0.699 12.530 17.376 833 1HD1 LEU 16 2HD1 LEU 106 0.284 11.142 19.257 834 2HD1 LEU 16 3HD1 LEU 106 -1.074 10.009 18.960 835 3HD1 LEU 16 1HD1 LEU 106 0.206 10.325 17.699 836 1HD2 LEU 16 2HD2 LEU 106 -2.353 12.211 16.035 837 2HD2 LEU 16 3HD2 LEU 106 -1.021 11.040 15.915 838 3HD2 LEU 16 1HD2 LEU 106 -2.518 10.529 16.660 839 H SER 17 H SER 107 -1.484 11.031 20.616 840 HA SER 17 HA SER 107 0.259 10.600 23.095 841 1HB SER 17 1HB SER 107 -2.558 9.430 23.021 842 2HB SER 17 2HB SER 107 -1.347 9.228 24.265 843 HG SER 17 HG SER 107 -2.488 11.701 23.491 844 H LYS 18 H LYS 108 0.828 8.397 23.433 845 HA LYS 18 HA LYS 108 1.430 6.835 20.928 846 1HB LYS 18 1HB LYS 108 2.974 6.964 23.001 847 2HB LYS 18 2HB LYS 108 1.853 5.896 23.838 848 1HG LYS 18 1HG LYS 108 2.244 4.124 22.088 849 2HG LYS 18 2HG LYS 108 3.258 5.240 21.164 850 1HD LYS 18 1HD LYS 108 4.901 5.390 23.006 851 2HD LYS 18 2HD LYS 108 3.945 4.312 24.016 852 1HE LYS 18 1HE LYS 108 5.176 3.539 21.273 853 2HE LYS 18 2HE LYS 108 5.939 3.227 22.829 854 1HZ LYS 18 1HZ LYS 108 4.039 1.847 23.437 855 2HZ LYS 18 2HZ LYS 108 3.310 2.135 22.003 856 H LYS 19 H LYS 109 -0.796 6.441 23.665 857 HA LYS 19 HA LYS 109 -2.346 4.200 22.515 858 1HB LYS 19 2HB LYS 109 -3.266 6.366 24.495 859 2HB LYS 19 1HB LYS 109 -4.232 4.957 24.071 860 1HG LYS 19 1HG LYS 109 -1.498 4.870 25.491 861 2HG LYS 19 2HG LYS 109 -3.069 4.770 26.267 862 1HD LYS 19 1HD LYS 109 -3.583 2.639 24.993 863 2HD LYS 19 2HD LYS 109 -1.985 2.711 24.240 864 1HE LYS 19 1HE LYS 109 -0.889 2.571 26.527 865 2HE LYS 19 2HE LYS 109 -2.485 2.495 27.288 866 1HZ LYS 19 1HZ LYS 109 -2.917 0.468 26.006 867 2HZ LYS 19 2HZ LYS 109 -1.434 0.534 25.323 868 H ASP 20 H ASP 110 -2.599 7.796 21.993 869 HA ASP 20 HA ASP 110 -5.090 7.496 20.326 870 1HB ASP 20 1HB ASP 110 -3.139 9.847 20.707 871 2HB ASP 20 2HB ASP 110 -4.407 9.922 19.516 872 HD2 ASP 20 HD2 ASP 110 -5.339 11.297 22.899 873 H ALA 21 H ALA 111 -1.647 7.441 19.631 874 HA ALA 21 HA ALA 111 -1.913 7.566 16.671 875 1HB ALA 21 1HB ALA 111 0.430 6.909 18.557 876 2HB ALA 21 2HB ALA 111 0.544 6.828 16.771 877 3HB ALA 21 3HB ALA 111 0.155 8.324 17.569 878 H THR 22 H THR 112 -1.589 4.855 19.050 879 HA THR 22 HA THR 112 -1.681 2.665 17.192 880 HB THR 22 HB THR 112 -3.038 2.637 19.970 881 HG1 THR 22 HG1 THR 112 -1.022 2.197 20.814 882 1HG2 THR 22 2HG2 THR 112 -1.363 0.613 18.366 883 2HG2 THR 22 3HG2 THR 112 -1.936 0.357 20.039 884 3HG2 THR 22 1HG2 THR 112 -3.114 0.513 18.686 885 H LYS 23 H LYS 113 -4.332 4.289 18.775 886 HA LYS 23 HA LYS 113 -6.598 2.940 17.472 887 1HB LYS 23 2HB LYS 113 -6.145 5.851 18.530 888 2HB LYS 23 1HB LYS 113 -7.700 5.361 17.966 889 1HG LYS 23 1HG LYS 113 -7.890 3.580 19.751 890 2HG LYS 23 2HG LYS 113 -6.292 4.011 20.354 891 1HD LYS 23 1HD LYS 113 -7.149 6.400 20.803 892 2HD LYS 23 2HD LYS 113 -8.734 5.895 20.243 893 1HE LYS 23 1HE LYS 113 -8.832 5.839 22.637 894 2HE LYS 23 2HE LYS 113 -8.827 4.153 22.123 895 1HZ LYS 23 1HZ LYS 113 -6.498 5.690 23.151 896 2HZ LYS 23 2HZ LYS 113 -7.340 4.555 23.972 897 H ALA 24 H ALA 114 -5.081 5.976 16.720 898 HA ALA 24 HA ALA 114 -6.531 6.701 14.375 899 1HB ALA 24 2HB ALA 114 -5.273 8.270 15.671 900 2HB ALA 24 3HB ALA 114 -3.719 7.468 15.247 901 3HB ALA 24 1HB ALA 114 -4.675 8.316 13.988 902 H VAL 25 H VAL 115 -3.600 4.727 14.523 903 HA VAL 25 HA VAL 115 -3.323 4.157 11.600 904 HB VAL 25 HB VAL 115 -2.574 2.986 14.438 905 1HG1 VAL 25 2HG2 VAL 115 -2.111 1.361 11.855 906 2HG1 VAL 25 3HG2 VAL 115 -1.319 1.037 13.435 907 3HG1 VAL 25 1HG2 VAL 115 -3.059 0.868 13.261 908 1HG2 VAL 25 1HG1 VAL 115 -1.187 4.785 13.543 909 2HG2 VAL 25 2HG1 VAL 115 -0.259 3.283 13.689 910 3HG2 VAL 25 3HG1 VAL 115 -0.857 3.828 12.080 911 H ASP 26 H ASP 116 -4.887 2.235 14.243 912 HA ASP 26 HA ASP 116 -6.572 0.702 12.262 913 1HB ASP 26 1HB ASP 116 -6.687 0.884 15.341 914 2HB ASP 26 2HB ASP 116 -7.680 -0.210 14.390 915 HD2 ASP 26 HD2 ASP 116 -3.952 -1.215 15.338 916 H ALA 27 H ALA 117 -6.824 3.528 12.622 917 HA ALA 27 HA ALA 117 -9.831 3.980 12.378 918 1HB ALA 27 2HB ALA 117 -8.625 5.453 14.020 919 2HB ALA 27 3HB ALA 117 -7.564 5.958 12.700 920 3HB ALA 27 1HB ALA 117 -9.257 6.310 12.594 921 H VAL 28 H VAL 118 -6.758 4.821 10.834 922 HA VAL 28 HA VAL 118 -7.733 5.571 8.168 923 HB VAL 28 HB VAL 118 -4.983 4.153 8.550 924 1HG1 VAL 28 2HG2 VAL 118 -5.790 4.745 6.280 925 2HG1 VAL 28 3HG2 VAL 118 -5.783 6.481 6.775 926 3HG1 VAL 28 1HG2 VAL 118 -4.268 5.504 6.797 927 1HG2 VAL 28 1HG1 VAL 118 -5.547 6.956 9.459 928 2HG2 VAL 28 2HG1 VAL 118 -4.543 5.596 10.141 929 3HG2 VAL 28 3HG1 VAL 118 -3.953 6.481 8.753 930 H PHE 29 H PHE 119 -6.093 2.738 9.252 931 HA PHE 29 HA PHE 119 -6.776 0.935 7.050 932 1HB PHE 29 2HB PHE 119 -5.506 0.244 9.744 933 2HB PHE 29 1HB PHE 119 -5.457 -0.779 8.331 934 HD1 PHE 29 HD1 PHE 119 -4.663 0.637 6.012 935 HD2 PHE 29 HD2 PHE 119 -3.425 1.335 10.067 936 HE1 PHE 29 HE1 PHE 119 -2.799 2.015 5.209 937 HE2 PHE 29 HE2 PHE 119 -1.590 2.730 9.263 938 HZ PHE 29 HZ PHE 119 -1.320 3.134 6.826 939 H ASP 30 H ASP 120 -8.625 1.601 9.879 940 HA ASP 30 HA ASP 120 -10.391 -0.787 9.596 941 1HB ASP 30 1HB ASP 120 -10.211 0.693 11.675 942 2HB ASP 30 2HB ASP 120 -11.108 1.947 10.848 943 HD2 ASP 30 HD2 ASP 120 -14.200 0.488 11.209 944 H SER 31 H SER 121 -10.477 2.585 8.620 945 HA SER 31 HA SER 121 -12.838 2.430 6.841 946 1HB SER 31 2HB SER 121 -10.704 4.623 6.965 947 2HB SER 31 1HB SER 121 -12.217 4.698 6.025 948 HG SER 31 HG SER 121 -12.411 5.620 8.076 949 H ILE 32 H ILE 122 -9.339 1.731 6.061 950 HA ILE 32 HA ILE 122 -9.722 1.361 3.124 951 HB ILE 32 HB ILE 122 -7.773 0.158 5.149 952 1HG1 ILE 32 1HG1 ILE 122 -5.907 0.970 3.848 953 2HG1 ILE 32 2HG1 ILE 122 -6.956 1.872 2.769 954 1HG2 ILE 32 2HG2 ILE 122 -8.224 -0.243 2.119 955 2HG2 ILE 32 3HG2 ILE 122 -6.696 -0.784 2.851 956 3HG2 ILE 32 1HG2 ILE 122 -8.234 -1.492 3.360 957 1HD1 ILE 32 2HD1 ILE 122 -6.158 2.501 5.677 958 2HD1 ILE 32 3HD1 ILE 122 -5.607 3.306 4.234 959 3HD1 ILE 32 1HD1 ILE 122 -7.296 3.524 4.745 960 H THR 33 H THR 123 -9.960 -0.746 6.038 961 HA THR 33 HA THR 123 -10.751 -2.983 4.280 962 HB THR 33 HB THR 123 -11.293 -4.343 6.357 963 HG1 THR 33 HG1 THR 123 -10.763 -3.385 8.334 964 1HG2 THR 33 2HG2 THR 123 -9.021 -4.172 5.367 965 2HG2 THR 33 3HG2 THR 123 -8.654 -2.777 6.354 966 3HG2 THR 33 1HG2 THR 123 -8.903 -4.363 7.145 967 H GLU 34 H GLU 124 -12.726 -0.522 5.345 968 HA GLU 34 HA GLU 124 -15.232 -2.128 4.767 969 1HB GLU 34 1HB GLU 124 -15.296 -0.218 6.499 970 2HB GLU 34 2HB GLU 124 -15.059 0.937 5.189 971 1HG GLU 34 1HG GLU 124 -17.236 0.157 4.131 972 2HG GLU 34 2HG GLU 124 -17.431 -1.056 5.392 973 HE1 GLU 34 HE2 GLU 124 -18.469 1.146 7.856 974 H ALA 35 H ALA 125 -13.061 0.148 3.047 975 HA ALA 35 HA ALA 125 -14.348 -0.077 0.298 976 1HB ALA 35 3HB ALA 125 -12.330 1.570 1.217 977 2HB ALA 35 1HB ALA 125 -11.325 0.155 1.146 978 3HB ALA 35 2HB ALA 125 -11.977 0.699 -0.303 979 H LEU 36 H LEU 126 -11.646 -1.907 1.676 980 HA LEU 36 HA LEU 126 -11.592 -3.657 -0.615 981 1HB LEU 36 2HB LEU 126 -10.387 -4.278 2.023 982 2HB LEU 36 1HB LEU 126 -9.851 -4.776 0.420 983 HG LEU 36 HG LEU 126 -9.569 -1.982 1.592 984 1HD1 LEU 36 3HD2 LEU 126 -7.649 -3.484 1.830 985 2HD1 LEU 36 1HD2 LEU 126 -7.585 -3.681 0.025 986 3HD1 LEU 36 2HD2 LEU 126 -7.272 -2.092 0.771 987 1HD2 LEU 36 3HD1 LEU 126 -10.518 -1.532 -0.711 988 2HD2 LEU 36 1HD1 LEU 126 -8.869 -1.006 -0.539 989 3HD2 LEU 36 2HD1 LEU 126 -9.231 -2.535 -1.416 990 NH1 ARG 37 NH2 ARG 127 -14.551 -3.318 7.896 991 NH2 ARG 37 NH1 ARG 127 -16.776 -2.945 8.155 992 H ARG 37 H ARG 127 -12.914 -4.240 2.726 993 HA ARG 37 HA ARG 127 -13.743 -6.864 1.835 994 1HB ARG 37 1HB ARG 127 -14.596 -7.402 3.915 995 2HB ARG 37 2HB ARG 127 -13.343 -6.259 4.320 996 1HG ARG 37 1HG ARG 127 -15.380 -4.464 4.311 997 2HG ARG 37 2HG ARG 127 -16.410 -5.881 4.356 998 1HD ARG 37 1HD ARG 127 -15.387 -6.660 6.428 999 2HD ARG 37 2HD ARG 127 -14.148 -5.387 6.355 1000 1HH1 ARG 37 2HH2 ARG 127 -13.812 -3.892 7.476 1001 2HH1 ARG 37 1HH2 ARG 127 -14.424 -2.501 8.504 1002 1HH2 ARG 37 1HH1 ARG 127 -17.736 -3.232 7.933 1003 2HH2 ARG 37 2HH1 ARG 127 -16.490 -2.156 8.744 1004 H LYS 38 H LYS 128 -15.237 -3.668 1.350 1005 HA LYS 38 HA LYS 128 -17.946 -5.033 1.189 1006 1HB LYS 38 1HB LYS 128 -17.646 -3.177 3.022 1007 2HB LYS 38 2HB LYS 128 -17.856 -2.063 1.674 1008 1HG LYS 38 1HG LYS 128 -20.104 -3.096 1.168 1009 2HG LYS 38 2HG LYS 128 -19.840 -4.282 2.437 1010 1HD LYS 38 1HD LYS 128 -21.291 -2.624 3.353 1011 2HD LYS 38 2HD LYS 128 -19.742 -2.447 4.169 1012 1HE LYS 38 1HE LYS 128 -19.199 -0.447 2.662 1013 2HE LYS 38 2HE LYS 128 -20.757 -0.650 1.850 1014 1HZ LYS 38 1HZ LYS 128 -21.858 -0.249 3.958 1015 2HZ LYS 38 2HZ LYS 128 -20.888 1.005 3.558 1016 H GLY 39 H GLY 129 -15.659 -4.427 -0.850 1017 1HA GLY 39 1HA GLY 129 -16.472 -4.653 -3.370 1018 2HA GLY 39 2HA GLY 129 -17.352 -3.145 -3.075 1019 H ASP 40 H ASP 130 -15.659 -1.699 -1.878 1020 HA ASP 40 HA ASP 130 -13.342 -1.004 -1.990 1021 1HB ASP 40 1HB ASP 130 -12.377 -0.148 -4.289 1022 2HB ASP 40 2HB ASP 130 -12.294 -1.748 -3.654 1023 HD2 ASP 40 HD2 ASP 130 -13.024 -3.020 -6.725 1024 H LYS 41 H LYS 131 -13.277 1.168 -1.269 1025 HA LYS 41 HA LYS 131 -13.152 3.277 -3.319 1026 1HB LYS 41 1HB LYS 131 -15.204 2.744 -1.284 1027 2HB LYS 41 2HB LYS 131 -14.976 3.521 -0.756 1028 1HG LYS 41 1HG LYS 131 -15.673 3.875 -3.836 1029 2HG LYS 41 2HG LYS 131 -16.634 2.782 -2.841 1030 1HD LYS 41 1HD LYS 131 -17.349 4.729 -1.394 1031 2HD LYS 41 2HD LYS 131 -16.402 5.838 -2.373 1032 1HE LYS 41 1HE LYS 131 -18.756 4.132 -3.455 1033 2HE LYS 41 2HE LYS 131 -18.910 5.786 -2.867 1034 1HZ LYS 41 1HZ LYS 131 -18.701 5.768 -5.229 1035 2HZ LYS 41 2HZ LYS 131 -17.406 6.529 -4.586 1036 H VAL 42 H VAL 132 -11.059 2.415 -1.484 1037 HA VAL 42 HA VAL 132 -10.666 4.615 0.191 1038 HB VAL 42 HB VAL 132 -8.497 2.932 -1.055 1039 1HG1 VAL 42 3HG2 VAL 132 -7.985 4.835 0.624 1040 2HG1 VAL 42 1HG2 VAL 132 -9.054 3.972 1.797 1041 3HG1 VAL 42 2HG2 VAL 132 -7.538 3.197 1.241 1042 1HG2 VAL 42 2HG1 VAL 132 -10.365 2.249 1.205 1043 2HG2 VAL 42 3HG1 VAL 132 -9.988 1.300 -0.312 1044 3HG2 VAL 42 1HG1 VAL 132 -8.797 1.418 1.003 1045 H GLN 43 H GLN 133 -9.601 6.192 -0.087 1046 HA GLN 43 HA GLN 133 -8.373 7.250 -2.644 1047 1HB GLN 43 1HB GLN 133 -10.918 8.572 -1.894 1048 2HB GLN 43 2HB GLN 133 -9.784 9.133 -3.128 1049 1HG GLN 43 1HG GLN 133 -10.244 6.924 -4.341 1050 2HG GLN 43 2HG GLN 133 -11.386 6.507 -3.076 1051 1HE2 GLN 43 1HE2 GLN 133 -13.999 8.030 -4.925 1052 2HE2 GLN 43 2HE2 GLN 133 -13.397 6.699 -3.814 1053 H LEU 44 H LEU 134 -6.712 8.326 -2.371 1054 HA LEU 44 HA LEU 134 -6.252 10.210 -0.021 1055 1HB LEU 44 2HB LEU 134 -4.398 7.906 -0.890 1056 2HB LEU 44 1HB LEU 134 -3.817 9.231 0.100 1057 HG LEU 44 HG LEU 134 -6.166 7.469 1.001 1058 1HD1 LEU 44 1HD1 LEU 134 -4.189 5.983 0.543 1059 2HD1 LEU 44 2HD1 LEU 134 -3.190 6.971 1.640 1060 3HD1 LEU 44 3HD1 LEU 134 -4.583 6.063 2.271 1061 1HD2 LEU 44 1HD2 LEU 134 -4.168 9.232 2.596 1062 2HD2 LEU 44 2HD2 LEU 134 -5.871 9.626 2.271 1063 3HD2 LEU 44 3HD2 LEU 134 -5.466 8.243 3.304 1064 H ILE 45 H ILE 135 -5.607 12.126 -0.955 1065 HA ILE 45 HA ILE 135 -4.738 12.186 -3.795 1066 HB ILE 45 HB ILE 135 -6.422 13.722 -2.787 1067 1HG1 ILE 45 1HG1 ILE 135 -5.513 14.021 -5.068 1068 2HG1 ILE 45 2HG1 ILE 135 -6.222 15.413 -4.294 1069 1HG2 ILE 45 3HG2 ILE 135 -5.262 14.412 -0.744 1070 2HG2 ILE 45 1HG2 ILE 135 -4.026 15.274 -1.692 1071 3HG2 ILE 45 2HG2 ILE 135 -5.730 15.829 -1.725 1072 1HD1 ILE 45 3HD1 ILE 135 -3.923 16.400 -3.877 1073 2HD1 ILE 45 1HD1 ILE 135 -3.197 15.023 -4.741 1074 3HD1 ILE 45 2HD1 ILE 135 -4.286 16.127 -5.593 1075 H GLY 46 H GLY 136 -2.884 12.987 -4.544 1076 1HA GLY 46 1HA GLY 136 -0.497 12.901 -4.815 1077 2HA GLY 46 2HA GLY 136 -0.437 13.641 -3.234 1078 H PHE 47 H PHE 137 -1.742 10.450 -3.159 1079 HA PHE 47 HA PHE 137 0.853 9.008 -2.802 1080 1HB PHE 47 2HB PHE 137 -0.029 10.255 -0.717 1081 2HB PHE 47 1HB PHE 137 -1.421 9.214 -0.683 1082 HD1 PHE 47 HD2 PHE 137 2.385 8.942 -0.767 1083 HD2 PHE 47 HD1 PHE 137 -1.312 7.036 0.328 1084 HE1 PHE 47 HE2 PHE 137 3.604 6.910 -0.052 1085 HE2 PHE 47 HE1 PHE 137 -0.059 5.061 1.074 1086 HZ PHE 47 HZ PHE 137 2.408 5.010 0.846 1087 H GLY 48 H GLY 138 -2.772 8.585 -3.069 1088 1HA GLY 48 1HA GLY 138 -2.524 6.163 -4.442 1089 2HA GLY 48 2HA GLY 138 -2.561 5.638 -2.757 1090 H ASN 49 H ASN 139 -4.039 4.503 -4.303 1091 HA ASN 49 HA ASN 139 -6.830 5.196 -3.402 1092 1HB ASN 49 1HB ASN 139 -6.597 6.366 -5.608 1093 2HB ASN 49 2HB ASN 139 -6.175 4.870 -6.404 1094 1HD2 ASN 49 1HD2 ASN 139 -9.922 5.752 -6.747 1095 2HD2 ASN 49 2HD2 ASN 139 -8.389 6.755 -6.857 1096 H PHE 50 H PHE 140 -7.248 3.375 -2.358 1097 HA PHE 50 HA PHE 140 -6.062 0.734 -3.309 1098 1HB PHE 50 2HB PHE 140 -7.541 1.012 -0.678 1099 2HB PHE 50 1HB PHE 140 -6.882 -0.431 -1.299 1100 HD1 PHE 50 HD1 PHE 140 -5.846 3.086 -0.483 1101 HD2 PHE 50 HD2 PHE 140 -5.234 -1.109 0.158 1102 HE1 PHE 50 HE1 PHE 140 -4.354 3.586 1.426 1103 HE2 PHE 50 HE2 PHE 140 -3.772 -0.576 2.083 1104 HZ PHE 50 HZ PHE 140 -3.347 1.788 2.642 1105 H GLU 51 H GLU 141 -7.253 -0.848 -3.884 1106 HA GLU 51 HA GLU 141 -10.117 -1.055 -3.478 1107 1HB GLU 51 1HB GLU 141 -10.859 -0.947 -5.908 1108 2HB GLU 51 2HB GLU 141 -10.207 0.583 -5.425 1109 1HG GLU 51 1HG GLU 141 -8.691 -1.540 -7.100 1110 2HG GLU 51 2HG GLU 141 -9.647 -0.242 -7.779 1111 HE2 GLU 51 HE2 GLU 141 -6.774 -1.146 -6.492 1112 H VAL 52 H VAL 142 -11.138 -3.026 -4.191 1113 HA VAL 52 HA VAL 142 -9.244 -5.259 -3.944 1114 HB VAL 52 HB VAL 142 -11.765 -4.417 -2.840 1115 1HG1 VAL 52 1HG2 VAL 142 -12.475 -6.499 -4.931 1116 2HG1 VAL 52 2HG2 VAL 142 -13.466 -5.977 -3.516 1117 3HG1 VAL 52 3HG2 VAL 142 -13.025 -4.834 -4.808 1118 1HG2 VAL 52 1HG1 VAL 142 -10.364 -7.068 -2.734 1119 2HG2 VAL 52 2HG1 VAL 142 -10.383 -5.701 -1.593 1120 3HG2 VAL 52 3HG1 VAL 142 -11.846 -6.666 -1.837 1121 NH1 ARG 53 NH2 ARG 143 -8.576 -3.062 -9.635 1122 NH2 ARG 53 NH1 ARG 143 -6.512 -2.963 -8.693 1123 H ARG 53 H ARG 143 -9.596 -7.280 -5.428 1124 HA ARG 53 HA ARG 143 -10.366 -6.403 -8.264 1125 1HB ARG 53 1HB ARG 143 -7.744 -6.893 -7.312 1126 2HB ARG 53 2HB ARG 143 -8.294 -8.481 -7.561 1127 1HG ARG 53 1HG ARG 143 -7.133 -7.804 -9.571 1128 2HG ARG 53 2HG ARG 143 -8.822 -8.037 -9.979 1129 1HD ARG 53 1HD ARG 143 -7.947 -6.043 -11.128 1130 2HD ARG 53 2HD ARG 143 -9.230 -5.587 -10.022 1131 1HH1 ARG 53 2HH2 ARG 143 -9.300 -3.641 -10.075 1132 2HH1 ARG 53 1HH2 ARG 143 -8.622 -2.053 -9.453 1133 1HH2 ARG 53 1HH1 ARG 143 -5.660 -3.461 -8.414 1134 2HH2 ARG 53 2HH1 ARG 143 -6.704 -1.962 -8.578 1135 H GLU 54 H GLU 144 -12.364 -7.372 -8.398 1136 HA GLU 54 HA GLU 144 -12.942 -10.081 -7.371 1137 1HB GLU 54 1HB GLU 144 -14.683 -8.314 -7.767 1138 2HB GLU 54 2HB GLU 144 -14.519 -8.535 -9.507 1139 1HG GLU 54 1HG GLU 144 -15.224 -10.986 -9.219 1140 2HG GLU 54 2HG GLU 144 -15.366 -10.726 -7.484 1141 HE1 GLU 54 HE2 GLU 144 -18.176 -9.414 -10.069 1142 NH1 ARG 55 NH2 ARG 145 -8.294 -17.044 -6.524 1143 NH2 ARG 55 NH1 ARG 145 -6.675 -15.555 -5.950 1144 H ARG 55 H ARG 145 -11.411 -11.526 -8.070 1145 HA ARG 55 HA ARG 145 -10.400 -11.770 -10.725 1146 1HB ARG 55 1HB ARG 145 -9.248 -12.525 -8.624 1147 2HB ARG 55 2HB ARG 145 -10.517 -13.693 -8.349 1148 1HG ARG 55 1HG ARG 145 -9.600 -14.672 -10.761 1149 2HG ARG 55 2HG ARG 145 -8.146 -13.832 -10.268 1150 1HD ARG 55 1HD ARG 145 -9.745 -15.834 -8.537 1151 2HD ARG 55 2HD ARG 145 -8.437 -16.322 -9.607 1152 1HH1 ARG 55 2HH2 ARG 145 -9.007 -17.327 -7.205 1153 2HH1 ARG 55 1HH2 ARG 145 -8.056 -17.524 -5.649 1154 1HH2 ARG 55 1HH1 ARG 145 -6.155 -14.704 -6.190 1155 2HH2 ARG 55 2HH1 ARG 145 -6.550 -16.137 -5.114 1156 H ALA 56 H ALA 146 -13.056 -12.904 -9.687 1157 HA ALA 56 HA ALA 146 -14.879 -14.330 -10.254 1158 1HB ALA 56 3HB ALA 146 -14.947 -12.414 -11.710 1159 2HB ALA 56 1HB ALA 146 -14.015 -13.266 -12.969 1160 3HB ALA 56 2HB ALA 146 -15.653 -13.845 -12.508 1161 H ALA 57 H ALA 147 -14.815 -16.334 -9.877 1162 HA ALA 57 HA ALA 147 -13.168 -18.335 -10.529 1163 1HB ALA 57 1HB ALA 147 -15.150 -18.566 -8.952 1164 2HB ALA 57 2HB ALA 147 -16.241 -18.768 -10.342 1165 3HB ALA 57 3HB ALA 147 -15.009 -19.999 -9.985 1166 NH1 ARG 58 NH2 ARG 148 -11.150 -14.780 -15.297 1167 NH2 ARG 58 NH1 ARG 148 -9.189 -14.380 -14.216 1168 H ARG 58 H ARG 148 -12.449 -19.624 -11.844 1169 HA ARG 58 HA ARG 148 -13.340 -19.368 -14.620 1170 1HB ARG 58 2HB ARG 148 -10.935 -21.035 -13.780 1171 2HB ARG 58 1HB ARG 148 -11.245 -20.373 -15.370 1172 1HG ARG 58 1HG ARG 148 -10.470 -18.780 -12.858 1173 2HG ARG 58 2HG ARG 148 -9.425 -19.207 -14.203 1174 1HD ARG 58 1HD ARG 148 -10.816 -17.787 -15.775 1175 2HD ARG 58 2HD ARG 148 -11.894 -17.361 -14.434 1176 1HH1 ARG 58 2HH2 ARG 148 -11.848 -15.470 -15.594 1177 2HH1 ARG 58 1HH2 ARG 148 -11.170 -13.769 -15.473 1178 1HH2 ARG 58 1HH1 ARG 148 -8.394 -14.762 -13.692 1179 2HH2 ARG 58 2HH1 ARG 148 -9.345 -13.398 -14.467 1180 H LYS 59 H LYS 149 -12.740 -21.654 -15.880 1181 HA LYS 59 HA LYS 149 -14.353 -23.953 -14.692 1182 1HB LYS 59 1HB LYS 149 -15.103 -22.589 -17.362 1183 2HB LYS 59 2HB LYS 149 -15.543 -24.239 -16.971 1184 1HG LYS 59 1HG LYS 149 -16.766 -23.465 -14.902 1185 2HG LYS 59 2HG LYS 149 -16.384 -21.790 -15.309 1186 1HD LYS 59 1HD LYS 149 -17.630 -22.028 -17.496 1187 2HD LYS 59 2HD LYS 149 -18.001 -23.712 -17.106 1188 1HE LYS 59 1HE LYS 149 -19.278 -22.951 -15.037 1189 2HE LYS 59 2HE LYS 149 -18.914 -21.265 -15.437 1190 1HZ LYS 59 1HZ LYS 149 -20.115 -21.533 -17.505 1191 2HZ LYS 59 2HZ LYS 149 -21.073 -21.884 -16.228 1192 H GLY 60 H GLY 150 -12.914 -25.472 -14.748 1193 1HA GLY 60 1HA GLY 150 -11.674 -26.544 -17.187 1194 2HA GLY 60 2HA GLY 150 -10.458 -25.580 -16.325 1195 NH1 ARG 61 NH2 ARG 151 -14.292 -32.818 -11.889 1196 NH2 ARG 61 NH1 ARG 151 -13.408 -34.897 -11.658 1197 H ARG 61 H ARG 151 -10.227 -28.355 -16.704 1198 HA ARG 61 HA ARG 151 -11.062 -29.616 -14.100 1199 1HB ARG 61 1HB ARG 151 -11.796 -30.705 -16.243 1200 2HB ARG 61 2HB ARG 151 -10.183 -31.251 -16.489 1201 1HG ARG 61 1HG ARG 151 -11.774 -32.932 -15.379 1202 2HG ARG 61 2HG ARG 151 -10.242 -32.782 -14.644 1203 1HD ARG 61 1HD ARG 151 -11.275 -31.460 -12.754 1204 2HD ARG 61 2HD ARG 151 -12.822 -31.456 -13.605 1205 1HH1 ARG 61 2HH2 ARG 151 -14.186 -31.869 -12.266 1206 2HH1 ARG 61 1HH2 ARG 151 -15.085 -33.178 -11.346 1207 1HH2 ARG 61 1HH1 ARG 151 -12.630 -35.536 -11.855 1208 2HH2 ARG 61 2HH1 ARG 151 -14.262 -35.112 -11.131 1209 H ASN 62 H ASN 152 -9.399 -31.645 -14.016 1210 HA ASN 62 HA ASN 152 -6.651 -30.631 -13.146 1211 1HB ASN 62 1HB ASN 152 -8.307 -33.240 -12.709 1212 2HB ASN 62 2HB ASN 152 -6.620 -33.174 -12.352 1213 1HD2 ASN 62 2HD2 ASN 152 -9.068 -31.678 -9.541 1214 2HD2 ASN 62 1HD2 ASN 152 -9.662 -32.509 -11.065 1215 HA PRO 63 HA PRO 153 -4.834 -32.363 -16.950 1216 1HB PRO 63 1HB PRO 153 -2.354 -33.362 -16.138 1217 2HB PRO 63 2HB PRO 153 -2.773 -31.648 -16.256 1218 1HG PRO 63 1HG PRO 153 -2.835 -33.409 -13.753 1219 2HG PRO 63 2HG PRO 153 -2.075 -31.810 -13.944 1220 1HD PRO 63 1HD PRO 153 -4.564 -32.078 -12.814 1221 2HD PRO 63 2HD PRO 153 -4.211 -30.677 -13.868 1222 H GLN 64 H GLN 154 -5.689 -34.692 -14.540 1223 HA GLN 64 HA GLN 154 -4.849 -37.107 -16.092 1224 1HB GLN 64 1HB GLN 154 -4.883 -37.027 -13.554 1225 2HB GLN 64 2HB GLN 154 -6.629 -36.832 -13.569 1226 1HG GLN 64 1HG GLN 154 -6.958 -39.075 -14.567 1227 2HG GLN 64 2HG GLN 154 -5.230 -39.255 -14.802 1228 1HE2 GLN 64 2HE2 GLN 154 -6.793 -40.032 -11.077 1229 2HE2 GLN 64 1HE2 GLN 154 -7.807 -39.336 -12.438 1230 H THR 65 H THR 155 -7.972 -36.246 -14.872 1231 HA THR 65 HA THR 155 -9.428 -37.993 -16.585 1232 HB THR 65 HB THR 155 -11.429 -37.249 -15.425 1233 HG1 THR 65 HG1 THR 155 -11.010 -35.037 -15.504 1234 1HG2 THR 65 1HG2 THR 155 -9.739 -38.664 -14.083 1235 2HG2 THR 65 2HG2 THR 155 -9.088 -37.168 -13.398 1236 3HG2 THR 65 3HG2 THR 155 -10.768 -37.618 -13.056 1237 H GLY 66 H GLY 156 -9.051 -34.518 -17.121 1238 1HA GLY 66 1HA GLY 156 -9.819 -33.139 -18.936 1239 2HA GLY 66 2HA GLY 156 -10.071 -34.605 -19.859 1240 H GLU 67 H GLU 157 -11.673 -33.510 -16.882 1241 HA GLU 67 HA GLU 157 -14.450 -33.442 -18.210 1242 1HB GLU 67 2HB GLU 157 -13.876 -35.211 -16.453 1243 2HB GLU 67 1HB GLU 157 -13.816 -33.904 -15.273 1244 1HG GLU 67 1HG GLU 157 -16.247 -33.312 -15.918 1245 2HG GLU 67 2HG GLU 157 -16.244 -34.681 -17.023 1246 HE2 GLU 67 HE2 GLU 157 -16.646 -35.158 -13.047 1247 H GLU 68 H GLU 158 -14.283 -32.063 -15.449 1248 HA GLU 68 HA GLU 158 -13.436 -29.363 -15.824 1249 1HB GLU 68 1HB GLU 158 -15.418 -29.305 -17.596 1250 2HB GLU 68 2HB GLU 158 -16.529 -29.356 -16.250 1251 1HG GLU 68 1HG GLU 158 -15.488 -27.135 -15.419 1252 2HG GLU 68 2HG GLU 158 -14.427 -27.159 -16.824 1253 HE2 GLU 68 HE2 GLU 158 -18.314 -26.114 -17.098 1254 H MET 69 H MET 159 -13.236 -28.400 -14.016 1255 HA MET 69 HA MET 159 -15.357 -28.562 -11.835 1256 1HB MET 69 1HB MET 159 -13.740 -28.720 -10.019 1257 2HB MET 69 2HB MET 159 -13.688 -30.113 -11.068 1258 1HG MET 69 1HG MET 159 -11.426 -29.680 -10.467 1259 2HG MET 69 2HG MET 159 -11.565 -29.162 -12.144 1260 1HE MET 69 2HE MET 159 -9.222 -28.399 -11.468 1261 2HE MET 69 1HE MET 159 -9.558 -26.888 -12.346 1262 3HE MET 69 3HE MET 159 -8.883 -26.811 -10.711 1263 H GLU 70 H GLU 160 -15.710 -26.738 -10.742 1264 HA GLU 70 HA GLU 160 -14.847 -24.195 -11.954 1265 1HB GLU 70 2HB GLU 160 -16.316 -22.986 -10.613 1266 2HB GLU 70 1HB GLU 160 -17.142 -24.438 -11.142 1267 1HG GLU 70 1HG GLU 160 -17.892 -24.204 -8.949 1268 2HG GLU 70 2HG GLU 160 -16.654 -25.428 -8.765 1269 HE1 GLU 70 HE2 GLU 160 -15.992 -21.612 -7.418 1270 H ILE 71 H ILE 161 -13.176 -22.936 -11.471 1271 HA ILE 71 HA ILE 161 -11.363 -23.563 -9.150 1272 HB ILE 71 HB ILE 161 -11.091 -21.953 -11.755 1273 1HG1 ILE 71 1HG1 ILE 161 -9.577 -24.552 -11.097 1274 2HG1 ILE 71 2HG1 ILE 161 -11.170 -24.648 -11.800 1275 1HG2 ILE 71 2HG2 ILE 161 -9.607 -21.006 -10.026 1276 2HG2 ILE 71 3HG2 ILE 161 -8.938 -22.629 -9.677 1277 3HG2 ILE 71 1HG2 ILE 161 -8.654 -21.853 -11.267 1278 1HD1 ILE 71 2HD1 ILE 161 -8.810 -23.239 -13.171 1279 2HD1 ILE 71 3HD1 ILE 161 -9.496 -24.830 -13.571 1280 3HD1 ILE 71 1HD1 ILE 161 -10.472 -23.369 -13.818 1281 HA PRO 72 HA PRO 162 -14.008 -20.111 -7.515 1282 1HB PRO 72 1HB PRO 162 -13.063 -19.948 -4.876 1283 2HB PRO 72 2HB PRO 162 -14.178 -21.165 -5.512 1284 1HG PRO 72 1HG PRO 162 -11.146 -21.407 -5.185 1285 2HG PRO 72 2HG PRO 162 -12.398 -22.559 -4.660 1286 1HD PRO 72 1HD PRO 162 -11.030 -22.923 -7.008 1287 2HD PRO 72 2HD PRO 162 -12.770 -23.337 -6.921 1288 H ALA 73 H ALA 163 -14.033 -17.976 -6.956 1289 HA ALA 73 HA ALA 163 -11.774 -16.289 -7.913 1290 1HB ALA 73 2HB ALA 163 -14.273 -15.612 -8.227 1291 2HB ALA 73 3HB ALA 163 -14.331 -15.274 -6.464 1292 3HB ALA 73 1HB ALA 163 -13.262 -14.355 -7.508 1293 H SER 74 H SER 164 -11.415 -14.290 -6.741 1294 HA SER 74 HA SER 164 -11.969 -14.116 -3.986 1295 1HB SER 74 1HB SER 164 -8.879 -14.101 -4.617 1296 2HB SER 74 2HB SER 164 -9.522 -13.519 -3.088 1297 HG SER 74 HG SER 164 -9.842 -16.139 -4.125 1298 H LYS 75 H LYS 165 -11.834 -12.021 -3.110 1299 HA LYS 75 HA LYS 165 -11.605 -9.813 -5.196 1300 1HB LYS 75 2HB LYS 165 -12.333 -9.034 -2.422 1301 2HB LYS 75 1HB LYS 165 -12.650 -8.301 -3.967 1302 1HG LYS 75 1HG LYS 165 -14.319 -10.114 -4.523 1303 2HG LYS 75 2HG LYS 165 -14.067 -10.813 -2.919 1304 1HD LYS 75 1HD LYS 165 -14.817 -8.653 -1.848 1305 2HD LYS 75 2HD LYS 165 -15.076 -7.927 -3.426 1306 1HE LYS 75 1HE LYS 165 -16.581 -10.428 -2.382 1307 2HE LYS 75 2HE LYS 165 -17.178 -8.775 -2.261 1308 1HZ LYS 75 1HZ LYS 165 -17.122 -8.622 -4.683 1309 2HZ LYS 75 2HZ LYS 165 -16.574 -10.156 -4.814 1310 H VAL 76 H VAL 166 -9.600 -9.318 -5.469 1311 HA VAL 76 HA VAL 166 -7.601 -9.754 -3.442 1312 HB VAL 76 HB VAL 166 -6.096 -10.217 -4.784 1313 1HG1 VAL 76 3HG2 VAL 166 -8.105 -11.692 -4.877 1314 2HG1 VAL 76 1HG2 VAL 166 -8.490 -10.930 -6.442 1315 3HG1 VAL 76 2HG2 VAL 166 -6.989 -11.909 -6.281 1316 1HG2 VAL 76 3HG1 VAL 166 -6.230 -8.253 -6.564 1317 2HG2 VAL 76 1HG1 VAL 166 -5.233 -9.719 -6.663 1318 3HG2 VAL 76 2HG1 VAL 166 -6.733 -9.691 -7.536 1319 HA PRO 77 HA PRO 167 -7.383 -5.361 -2.635 1320 1HB PRO 77 1HB PRO 167 -5.864 -5.383 -0.283 1321 2HB PRO 77 2HB PRO 167 -7.509 -6.042 -0.355 1322 1HG PRO 77 1HG PRO 167 -4.876 -7.572 -0.650 1323 2HG PRO 77 2HG PRO 167 -6.201 -7.934 0.465 1324 1HD PRO 77 1HD PRO 167 -5.903 -9.186 -2.055 1325 2HD PRO 77 2HD PRO 167 -7.531 -8.877 -1.409 1326 H ALA 78 H ALA 168 -6.416 -3.943 -3.407 1327 HA ALA 78 HA ALA 168 -3.408 -3.926 -3.989 1328 1HB ALA 78 3HB ALA 168 -4.971 -4.581 -5.888 1329 2HB ALA 78 1HB ALA 168 -5.799 -3.014 -5.736 1330 3HB ALA 78 2HB ALA 168 -4.085 -3.072 -6.223 1331 H PHE 79 H PHE 169 -2.671 -1.884 -4.529 1332 HA PHE 79 HA PHE 169 -3.752 0.612 -3.020 1333 1HB PHE 79 2HB PHE 169 -2.608 -0.145 -1.300 1334 2HB PHE 79 1HB PHE 169 -1.298 -0.810 -2.314 1335 HD1 PHE 79 HD1 PHE 169 -2.718 2.519 -1.231 1336 HD2 PHE 79 HD2 PHE 169 0.709 0.392 -2.730 1337 HE1 PHE 79 HE1 PHE 169 -1.377 4.572 -1.116 1338 HE2 PHE 79 HE2 PHE 169 2.022 2.464 -2.648 1339 HZ PHE 79 HZ PHE 169 0.982 4.560 -1.872 1340 H LYS 80 H LYS 170 -3.517 1.968 -4.521 1341 HA LYS 80 HA LYS 170 -1.638 2.021 -7.047 1342 1HB LYS 80 2HB LYS 170 -4.038 3.751 -6.334 1343 2HB LYS 80 1HB LYS 170 -2.897 4.132 -7.613 1344 1HG LYS 80 1HG LYS 170 -3.376 1.940 -8.749 1345 2HG LYS 80 2HG LYS 170 -4.520 1.508 -7.477 1346 1HD LYS 80 1HD LYS 170 -5.989 3.425 -8.070 1347 2HD LYS 80 2HD LYS 170 -4.831 3.993 -9.279 1348 1HE LYS 80 1HE LYS 170 -5.147 1.871 -10.611 1349 2HE LYS 80 2HE LYS 170 -6.247 1.237 -9.380 1350 1HZ LYS 80 1HZ LYS 170 -7.742 3.070 -9.814 1351 2HZ LYS 80 2HZ LYS 170 -7.461 2.210 -11.175 1352 HA PRO 81 HA PRO 171 0.889 4.828 -4.475 1353 1HB PRO 81 1HB PRO 171 3.002 5.198 -6.198 1354 2HB PRO 81 2HB PRO 171 2.668 3.631 -5.450 1355 1HG PRO 81 1HG PRO 171 1.871 4.549 -8.263 1356 2HG PRO 81 2HG PRO 171 2.749 3.066 -7.811 1357 1HD PRO 81 1HD PRO 171 -0.019 3.154 -8.193 1358 2HD PRO 81 2HD PRO 171 0.745 2.004 -7.049 1359 H GLY 82 H GLY 172 -1.446 5.848 -5.763 1360 1HA GLY 82 1HA GLY 172 -2.493 7.594 -7.026 1361 2HA GLY 82 2HA GLY 172 -1.510 8.503 -5.897 1362 H LYS 83 H LYS 173 0.200 6.850 -8.326 1363 HA LYS 83 HA LYS 173 1.579 7.609 -10.156 1364 1HB LYS 83 2HB LYS 173 -0.631 9.579 -10.428 1365 2HB LYS 83 1HB LYS 173 0.847 10.350 -10.802 1366 1HG LYS 83 1HG LYS 173 -0.225 7.769 -12.126 1367 2HG LYS 83 2HG LYS 173 -0.313 9.377 -12.814 1368 1HD LYS 83 1HD LYS 173 2.263 7.756 -12.322 1369 2HD LYS 83 2HD LYS 173 1.477 7.984 -13.862 1370 1HE LYS 83 1HE LYS 173 2.791 10.248 -12.205 1371 2HE LYS 83 2HE LYS 173 3.544 9.393 -13.545 1372 1HZ LYS 83 1HZ LYS 173 2.634 11.454 -14.285 1373 2HZ LYS 83 2HZ LYS 173 1.845 10.227 -15.023 1374 H ALA 84 H ALA 174 0.844 9.950 -7.912 1375 HA ALA 84 HA ALA 174 3.063 11.809 -7.852 1376 1HB ALA 84 2HB ALA 174 0.763 12.123 -6.908 1377 2HB ALA 84 3HB ALA 174 1.026 10.790 -5.755 1378 3HB ALA 84 1HB ALA 174 1.970 12.296 -5.593 1379 H LEU 85 H LEU 175 2.457 8.891 -5.678 1380 HA LEU 85 HA LEU 175 5.111 9.046 -4.438 1381 1HB LEU 85 2HB LEU 175 3.298 7.867 -3.245 1382 2HB LEU 85 1HB LEU 175 3.106 6.746 -4.574 1383 HG LEU 85 HG LEU 175 5.530 6.204 -4.312 1384 1HD1 LEU 85 3HD1 LEU 175 6.151 8.062 -2.622 1385 2HD1 LEU 85 1HD1 LEU 175 5.437 6.996 -1.380 1386 3HD1 LEU 85 2HD1 LEU 175 6.810 6.439 -2.342 1387 1HD2 LEU 85 2HD2 LEU 175 3.739 4.570 -3.686 1388 2HD2 LEU 85 3HD2 LEU 175 5.076 4.414 -2.536 1389 3HD2 LEU 85 1HD2 LEU 175 3.596 5.286 -2.069 1390 H LYS 86 H LYS 176 3.789 7.377 -7.289 1391 HA LYS 86 HA LYS 176 6.217 5.948 -8.039 1392 1HB LYS 86 1HB LYS 176 3.871 5.563 -8.997 1393 2HB LYS 86 2HB LYS 176 4.131 6.936 -10.061 1394 1HG LYS 86 1HG LYS 176 6.124 5.781 -11.061 1395 2HG LYS 86 2HG LYS 176 5.924 4.431 -9.937 1396 1HD LYS 86 1HD LYS 176 3.640 3.956 -10.924 1397 2HD LYS 86 2HD LYS 176 3.841 5.309 -12.045 1398 1HE LYS 86 1HE LYS 176 5.880 4.169 -13.057 1399 2HE LYS 86 2HE LYS 176 5.685 2.817 -11.931 1400 1HZ LYS 86 1HZ LYS 176 3.527 2.369 -12.893 1401 2HZ LYS 86 2HZ LYS 176 4.690 2.329 -14.040 1402 H ASP 87 H ASP 177 5.546 9.382 -8.319 1403 HA ASP 87 HA ASP 177 7.906 9.939 -10.064 1404 1HB ASP 87 1HB ASP 177 5.402 11.238 -9.345 1405 2HB ASP 87 2HB ASP 177 6.575 12.137 -8.481 1406 HD1 ASP 87 HD2 ASP 177 7.985 13.602 -11.324 1407 H ALA 88 H ALA 178 6.995 10.228 -6.591 1408 HA ALA 88 HA ALA 178 9.359 11.388 -5.393 1409 1HB ALA 88 3HB ALA 178 7.163 10.687 -4.138 1410 2HB ALA 88 1HB ALA 178 7.681 9.007 -4.257 1411 3HB ALA 88 2HB ALA 178 8.647 10.113 -3.318 1412 H VAL 89 H VAL 179 8.628 7.979 -6.133 1413 HA VAL 89 HA VAL 179 11.146 6.914 -5.100 1414 HB VAL 89 HB VAL 179 8.474 6.436 -4.819 1415 1HG1 VAL 89 2HG2 VAL 179 8.249 6.191 -7.408 1416 2HG1 VAL 89 3HG2 VAL 179 8.921 4.570 -7.188 1417 3HG1 VAL 89 1HG2 VAL 179 7.419 5.068 -6.333 1418 1HG2 VAL 89 3HG1 VAL 179 10.392 4.183 -5.107 1419 2HG2 VAL 89 1HG1 VAL 179 10.091 5.265 -3.687 1420 3HG2 VAL 89 2HG1 VAL 179 8.769 4.231 -4.298 1421 H LYS 90 H LYS 180 10.370 8.001 -8.232 1422 HA LYS 90 HA LYS 180 11.213 5.953 -9.987 1423 1HB LYS 90 1HB LYS 180 10.169 8.492 -10.300 1424 2HB LYS 90 2HB LYS 180 11.822 8.895 -10.614 1425 1HG LYS 90 1HG LYS 180 11.094 8.516 -12.741 1426 2HG LYS 90 2HG LYS 180 11.695 6.902 -12.441 1427 1HD LYS 90 1HD LYS 180 8.752 7.808 -12.046 1428 2HD LYS 90 2HD LYS 180 9.351 7.189 -13.559 1429 1HE LYS 90 1HE LYS 180 9.196 5.569 -10.927 1430 2HE LYS 90 2HE LYS 180 8.063 5.491 -12.266 1431 1HZ LYS 90 1HZ LYS 180 10.924 4.765 -12.471 1432 2HZ LYS 90 2HZ LYS 180 9.843 4.695 -13.695 Start of MODEL 8 Raw file had 1432 H/Q atoms Start of MODEL 8 1 1H MET 1 1H MET 1 -12.650 4.673 -3.681 2 2H MET 1 2H MET 1 -11.137 4.134 -3.377 3 HA MET 1 HA MET 1 -12.767 5.849 -1.631 4 1HB MET 1 1HB MET 1 -9.907 4.847 -1.137 5 2HB MET 1 2HB MET 1 -10.706 6.058 -0.190 6 1HG MET 1 1HG MET 1 -12.443 4.346 0.539 7 2HG MET 1 2HG MET 1 -11.541 3.110 -0.373 8 1HE MET 1 3HE MET 1 -10.364 1.534 1.227 9 2HE MET 1 2HE MET 1 -9.785 2.010 2.845 10 3HE MET 1 1HE MET 1 -11.532 2.104 2.454 11 H ASN 2 H ASN 2 -9.682 6.992 -1.754 12 HA ASN 2 HA ASN 2 -9.048 8.262 -3.955 13 1HB ASN 2 1HB ASN 2 -9.889 10.482 -4.331 14 2HB ASN 2 2HB ASN 2 -11.145 9.310 -4.496 15 1HD2 ASN 2 1HD2 ASN 2 -11.653 12.259 -1.748 16 2HD2 ASN 2 2HD2 ASN 2 -10.057 11.946 -2.601 17 H LYS 3 H LYS 3 -9.716 9.061 -0.708 18 HA LYS 3 HA LYS 3 -7.503 9.176 0.703 19 1HB LYS 3 1HB LYS 3 -6.296 10.668 -1.057 20 2HB LYS 3 2HB LYS 3 -7.260 12.009 -0.507 21 1HG LYS 3 1HG LYS 3 -6.169 11.727 1.806 22 2HG LYS 3 2HG LYS 3 -5.389 10.247 1.248 23 1HD LYS 3 1HD LYS 3 -4.182 11.678 -0.551 24 2HD LYS 3 2HD LYS 3 -4.868 13.099 0.217 25 1HE LYS 3 1HE LYS 3 -2.631 12.912 1.045 26 2HE LYS 3 2HE LYS 3 -3.664 12.447 2.393 27 1HZ LYS 3 1HZ LYS 3 -2.278 10.559 0.554 28 2HZ LYS 3 2HZ LYS 3 -3.215 10.110 1.815 29 H THR 4 H THR 4 -10.477 10.927 -0.010 30 HA THR 4 HA THR 4 -10.681 12.138 2.641 31 HB THR 4 HB THR 4 -12.271 12.195 -0.016 32 HG1 THR 4 HG1 THR 4 -11.464 14.327 -0.086 33 1HG2 THR 4 3HG2 THR 4 -12.557 13.706 2.588 34 2HG2 THR 4 1HG2 THR 4 -13.373 14.141 1.012 35 3HG2 THR 4 2HG2 THR 4 -13.723 12.562 1.821 36 H GLU 5 H GLU 5 -11.857 9.458 0.673 37 HA GLU 5 HA GLU 5 -14.037 8.595 2.581 38 1HB GLU 5 1HB GLU 5 -12.621 6.817 0.552 39 2HB GLU 5 2HB GLU 5 -14.098 6.453 1.409 40 1HG GLU 5 1HG GLU 5 -13.699 8.534 -0.824 41 2HG GLU 5 2HG GLU 5 -14.507 6.995 -0.965 42 HE2 GLU 5 HE2 GLU 5 -16.439 10.217 0.452 43 H LEU 6 H LEU 6 -10.673 8.637 2.407 44 HA LEU 6 HA LEU 6 -9.900 6.511 4.334 45 1HB LEU 6 2HB LEU 6 -8.526 8.230 2.479 46 2HB LEU 6 1HB LEU 6 -8.097 8.940 4.013 47 HG LEU 6 HG LEU 6 -7.623 6.049 3.287 48 1HD1 LEU 6 3HD1 LEU 6 -5.668 8.383 3.556 49 2HD1 LEU 6 1HD1 LEU 6 -5.217 6.683 3.285 50 3HD1 LEU 6 2HD1 LEU 6 -6.131 7.569 2.047 51 1HD2 LEU 6 3HD2 LEU 6 -7.460 7.407 5.954 52 2HD2 LEU 6 1HD2 LEU 6 -7.832 5.732 5.537 53 3HD2 LEU 6 2HD2 LEU 6 -6.150 6.310 5.503 54 H ILE 7 H ILE 7 -10.336 10.103 4.407 55 HA ILE 7 HA ILE 7 -9.799 10.521 7.229 56 HB ILE 7 HB ILE 7 -11.620 12.231 5.421 57 1HG1 ILE 7 1HG1 ILE 7 -8.621 12.684 5.911 58 2HG1 ILE 7 2HG1 ILE 7 -9.176 11.786 4.551 59 1HG2 ILE 7 2HG2 ILE 7 -11.815 12.852 7.879 60 2HG2 ILE 7 3HG2 ILE 7 -10.066 13.097 7.925 61 3HG2 ILE 7 1HG2 ILE 7 -11.081 14.150 6.929 62 1HD1 ILE 7 3HD1 ILE 7 -10.607 13.819 3.830 63 2HD1 ILE 7 1HD1 ILE 7 -9.625 14.746 4.957 64 3HD1 ILE 7 2HD1 ILE 7 -8.838 13.861 3.621 65 H ASN 8 H ASN 8 -12.907 10.103 5.545 66 HA ASN 8 HA ASN 8 -14.492 9.973 8.040 67 1HB ASN 8 1HB ASN 8 -15.226 8.811 5.243 68 2HB ASN 8 2HB ASN 8 -16.346 8.950 6.576 69 1HD2 ASN 8 2HD2 ASN 8 -15.848 12.221 4.234 70 2HD2 ASN 8 1HD2 ASN 8 -14.957 10.646 3.937 71 H ALA 9 H ALA 9 -12.488 7.542 6.627 72 HA ALA 9 HA ALA 9 -13.767 5.180 7.976 73 1HB ALA 9 2HB ALA 9 -11.970 4.920 6.018 74 2HB ALA 9 3HB ALA 9 -10.765 5.588 7.125 75 3HB ALA 9 1HB ALA 9 -11.485 4.080 7.542 76 H VAL 10 H VAL 10 -11.101 7.460 8.649 77 HA VAL 10 HA VAL 10 -10.227 6.114 10.998 78 HB VAL 10 HB VAL 10 -9.333 8.928 10.641 79 1HG1 VAL 10 3HG2 VAL 10 -8.498 7.120 12.328 80 2HG1 VAL 10 1HG2 VAL 10 -7.644 6.450 10.911 81 3HG1 VAL 10 2HG2 VAL 10 -7.305 8.124 11.426 82 1HG2 VAL 10 1HG1 VAL 10 -8.822 6.701 8.625 83 2HG2 VAL 10 2HG1 VAL 10 -9.397 8.385 8.414 84 3HG2 VAL 10 3HG1 VAL 10 -7.676 8.091 8.836 85 H ALA 11 H ALA 11 -11.782 9.014 10.406 86 HA ALA 11 HA ALA 11 -12.337 9.451 13.151 87 1HB ALA 11 2HB ALA 11 -12.324 11.349 11.490 88 2HB ALA 11 3HB ALA 11 -13.789 10.699 10.709 89 3HB ALA 11 1HB ALA 11 -13.872 11.373 12.369 90 H GLU 12 H GLU 12 -14.090 7.451 10.899 91 HA GLU 12 HA GLU 12 -16.472 7.211 12.709 92 1HB GLU 12 1HB GLU 12 -16.770 6.937 10.226 93 2HB GLU 12 2HB GLU 12 -15.726 5.525 10.248 94 1HG GLU 12 1HG GLU 12 -18.012 4.777 10.121 95 2HG GLU 12 2HG GLU 12 -17.413 4.306 11.698 96 HE2 GLU 12 HE2 GLU 12 -19.677 6.206 13.479 97 H THR 13 H THR 13 -13.619 5.121 11.866 98 HA THR 13 HA THR 13 -14.300 3.224 13.996 99 HB THR 13 HB THR 13 -11.975 2.228 13.632 100 HG1 THR 13 HG1 THR 13 -10.661 3.302 12.181 101 1HG2 THR 13 2HG2 THR 13 -13.209 2.865 10.895 102 2HG2 THR 13 3HG2 THR 13 -11.941 1.676 11.249 103 3HG2 THR 13 1HG2 THR 13 -13.578 1.448 11.917 104 H SER 14 H SER 14 -12.999 6.019 14.434 105 HA SER 14 HA SER 14 -11.756 5.275 17.174 106 1HB SER 14 1HB SER 14 -9.940 5.690 15.439 107 2HB SER 14 2HB SER 14 -10.487 7.357 15.291 108 HG SER 14 HG SER 14 -10.097 7.589 17.538 109 H GLY 15 H GLY 15 -13.554 7.838 15.458 110 1HA GLY 15 1HA GLY 15 -14.644 9.770 16.301 111 2HA GLY 15 2HA GLY 15 -14.573 9.062 17.914 112 H LEU 16 H LEU 16 -12.117 10.176 15.643 113 HA LEU 16 HA LEU 16 -10.886 12.163 17.549 114 1HB LEU 16 1HB LEU 16 -8.972 12.212 16.118 115 2HB LEU 16 2HB LEU 16 -9.267 10.720 16.985 116 HG LEU 16 HG LEU 16 -10.012 9.584 15.155 117 1HD1 LEU 16 2HD1 LEU 16 -11.371 11.380 13.995 118 2HD1 LEU 16 3HD1 LEU 16 -9.805 12.023 13.407 119 3HD1 LEU 16 1HD1 LEU 16 -10.408 10.376 12.912 120 1HD2 LEU 16 1HD2 LEU 16 -7.903 9.106 15.152 121 2HD2 LEU 16 2HD2 LEU 16 -8.731 8.965 13.585 122 3HD2 LEU 16 3HD2 LEU 16 -7.646 10.311 13.844 123 H SER 17 H SER 17 -10.403 13.220 14.820 124 HA SER 17 HA SER 17 -12.885 14.967 14.411 125 1HB SER 17 1HB SER 17 -10.121 16.259 14.341 126 2HB SER 17 2HB SER 17 -11.667 17.015 14.039 127 HG SER 17 HG SER 17 -12.291 16.506 16.167 128 H LYS 18 H LYS 18 -13.001 15.922 12.290 129 HA LYS 18 HA LYS 18 -12.097 14.097 10.064 130 1HB LYS 18 1HB LYS 18 -13.514 16.810 9.800 131 2HB LYS 18 2HB LYS 18 -13.121 15.735 8.471 132 1HG LYS 18 1HG LYS 18 -15.063 15.097 10.772 133 2HG LYS 18 2HG LYS 18 -15.512 15.595 9.151 134 1HD LYS 18 1HD LYS 18 -14.534 13.506 8.176 135 2HD LYS 18 2HD LYS 18 -13.990 12.967 9.752 136 1HE LYS 18 1HE LYS 18 -16.951 13.387 8.974 137 2HE LYS 18 2HE LYS 18 -16.097 11.844 8.972 138 1HZ LYS 18 1HZ LYS 18 -17.349 12.097 10.968 139 2HZ LYS 18 2HZ LYS 18 -15.756 12.024 11.332 140 H LYS 19 H LYS 19 -11.219 17.361 11.166 141 HA LYS 19 HA LYS 19 -8.860 17.649 9.426 142 1HB LYS 19 2HB LYS 19 -9.904 19.591 10.568 143 2HB LYS 19 1HB LYS 19 -9.439 18.969 12.152 144 1HG LYS 19 1HG LYS 19 -7.948 20.765 11.516 145 2HG LYS 19 2HG LYS 19 -7.022 19.276 11.590 146 1HD LYS 19 1HD LYS 19 -7.113 19.099 9.055 147 2HD LYS 19 2HD LYS 19 -8.063 20.588 8.990 148 1HE LYS 19 1HE LYS 19 -6.126 21.859 10.048 149 2HE LYS 19 2HE LYS 19 -5.189 20.359 10.132 150 1HZ LYS 19 1HZ LYS 19 -4.644 21.672 8.193 151 2HZ LYS 19 2HZ LYS 19 -6.185 21.640 7.649 152 H ASP 20 H ASP 20 -9.261 16.024 12.678 153 HA ASP 20 HA ASP 20 -6.307 15.487 12.901 154 1HB ASP 20 1HB ASP 20 -8.714 14.405 14.478 155 2HB ASP 20 2HB ASP 20 -7.143 13.673 14.661 156 HD1 ASP 20 HD2 ASP 20 -5.443 14.879 15.238 157 H ALA 21 H ALA 21 -8.996 13.762 11.449 158 HA ALA 21 HA ALA 21 -7.509 11.233 10.952 159 1HB ALA 21 2HB ALA 21 -10.213 12.332 9.975 160 2HB ALA 21 3HB ALA 21 -9.526 10.771 9.428 161 3HB ALA 21 1HB ALA 21 -9.874 11.051 11.108 162 H THR 22 H THR 22 -8.233 14.149 8.927 163 HA THR 22 HA THR 22 -6.801 13.367 6.559 164 HB THR 22 HB THR 22 -6.919 16.266 7.638 165 HG1 THR 22 HG1 THR 22 -8.944 16.399 6.705 166 1HG2 THR 22 3HG2 THR 22 -7.188 14.995 4.848 167 2HG2 THR 22 1HG2 THR 22 -7.398 16.736 5.201 168 3HG2 THR 22 2HG2 THR 22 -5.799 15.944 5.445 169 H LYS 23 H LYS 23 -5.645 15.126 9.340 170 HA LYS 23 HA LYS 23 -2.810 15.370 8.659 171 1HB LYS 23 2HB LYS 23 -4.368 15.037 11.346 172 2HB LYS 23 1HB LYS 23 -2.664 15.315 11.367 173 1HG LYS 23 1HG LYS 23 -2.855 17.543 10.241 174 2HG LYS 23 2HG LYS 23 -4.570 17.312 9.981 175 1HD LYS 23 1HD LYS 23 -4.359 18.832 11.820 176 2HD LYS 23 2HD LYS 23 -5.009 17.337 12.441 177 1HE LYS 23 1HE LYS 23 -3.411 18.163 14.058 178 2HE LYS 23 2HE LYS 23 -2.724 16.710 13.348 179 1HZ LYS 23 1HZ LYS 23 -1.347 18.109 11.930 180 2HZ LYS 23 2HZ LYS 23 -1.087 18.430 13.511 181 H ALA 24 H ALA 24 -4.396 13.021 10.688 182 HA ALA 24 HA ALA 24 -2.226 11.263 11.273 183 1HB ALA 24 3HB ALA 24 -5.218 10.742 11.162 184 2HB ALA 24 1HB ALA 24 -4.015 9.672 11.956 185 3HB ALA 24 2HB ALA 24 -4.240 11.342 12.544 186 H VAL 25 H VAL 25 -4.384 11.118 8.473 187 HA VAL 25 HA VAL 25 -3.170 8.761 7.123 188 HB VAL 25 HB VAL 25 -4.885 11.344 6.534 189 1HG1 VAL 25 1HG2 VAL 25 -3.762 9.626 4.234 190 2HG1 VAL 25 2HG2 VAL 25 -5.095 10.821 4.090 191 3HG1 VAL 25 3HG2 VAL 25 -3.472 11.347 4.514 192 1HG2 VAL 25 2HG1 VAL 25 -6.023 9.372 7.421 193 2HG2 VAL 25 3HG1 VAL 25 -6.585 9.753 5.784 194 3HG2 VAL 25 1HG1 VAL 25 -5.426 8.400 6.056 195 H ASP 26 H ASP 26 -2.596 12.285 6.623 196 HA ASP 26 HA ASP 26 0.127 11.728 5.403 197 1HB ASP 26 1HB ASP 26 -1.209 14.371 6.284 198 2HB ASP 26 2HB ASP 26 0.344 14.284 5.460 199 HD2 ASP 26 HD2 ASP 26 -3.028 14.200 3.366 200 H ALA 27 H ALA 27 -0.488 11.078 8.082 201 HA ALA 27 HA ALA 27 2.073 11.827 9.540 202 1HB ALA 27 2HB ALA 27 -0.101 12.244 10.788 203 2HB ALA 27 3HB ALA 27 -0.395 10.489 10.660 204 3HB ALA 27 1HB ALA 27 1.012 11.076 11.494 205 H VAL 28 H VAL 28 0.015 9.028 8.868 206 HA VAL 28 HA VAL 28 2.049 6.905 9.233 207 HB VAL 28 HB VAL 28 -0.530 6.975 7.468 208 1HG1 VAL 28 2HG2 VAL 28 1.141 4.533 8.331 209 2HG1 VAL 28 3HG2 VAL 28 -0.476 4.482 7.587 210 3HG1 VAL 28 1HG2 VAL 28 0.860 5.148 6.652 211 1HG2 VAL 28 3HG1 VAL 28 -0.962 7.174 9.836 212 2HG2 VAL 28 1HG1 VAL 28 -1.585 5.664 9.077 213 3HG2 VAL 28 2HG1 VAL 28 -0.069 5.613 10.102 214 H PHE 29 H PHE 29 0.528 8.220 6.450 215 HA PHE 29 HA PHE 29 2.412 7.210 4.415 216 1HB PHE 29 2HB PHE 29 0.275 9.323 3.918 217 2HB PHE 29 1HB PHE 29 1.105 8.388 2.682 218 HD1 PHE 29 HD1 PHE 29 1.107 5.653 3.223 219 HD2 PHE 29 HD2 PHE 29 -1.898 8.481 4.404 220 HE1 PHE 29 HE1 PHE 29 -0.384 3.811 3.835 221 HE2 PHE 29 HE2 PHE 29 -3.353 6.642 5.094 222 HZ PHE 29 HZ PHE 29 -2.535 4.302 4.908 223 H ASP 30 H ASP 30 2.652 10.144 6.272 224 HA ASP 30 HA ASP 30 4.634 11.306 4.342 225 1HB ASP 30 1HB ASP 30 3.111 12.591 6.065 226 2HB ASP 30 2HB ASP 30 4.283 12.181 7.288 227 HD1 ASP 30 HD2 ASP 30 5.038 15.019 4.517 228 H SER 31 H SER 31 4.689 9.527 7.264 229 HA SER 31 HA SER 31 7.691 9.455 7.630 230 1HB SER 31 1HB SER 31 5.652 7.579 8.917 231 2HB SER 31 2HB SER 31 7.358 7.732 9.357 232 HG SER 31 HG SER 31 6.998 9.910 9.868 233 H ILE 32 H ILE 32 5.280 7.143 5.987 234 HA ILE 32 HA ILE 32 7.112 5.174 5.198 235 HB ILE 32 HB ILE 32 4.725 6.040 3.578 236 1HG1 ILE 32 1HG1 ILE 32 4.870 4.987 6.372 237 2HG1 ILE 32 2HG1 ILE 32 3.858 6.138 5.527 238 1HG2 ILE 32 3HG2 ILE 32 6.544 4.179 2.911 239 2HG2 ILE 32 1HG2 ILE 32 5.770 3.216 4.142 240 3HG2 ILE 32 2HG2 ILE 32 4.817 3.779 2.761 241 1HD1 ILE 32 3HD1 ILE 32 3.448 3.187 5.225 242 2HD1 ILE 32 1HD1 ILE 32 2.759 4.216 6.514 243 3HD1 ILE 32 2HD1 ILE 32 2.340 4.576 4.803 244 H THR 33 H THR 33 5.931 7.970 3.332 245 HA THR 33 HA THR 33 7.926 7.561 1.165 246 HB THR 33 HB THR 33 6.006 9.012 0.714 247 HG1 THR 33 HG1 THR 33 8.338 10.574 0.654 248 1HG2 THR 33 2HG2 THR 33 5.842 10.029 3.060 249 2HG2 THR 33 3HG2 THR 33 7.055 11.199 2.599 250 3HG2 THR 33 1HG2 THR 33 5.466 11.132 1.739 251 H GLU 34 H GLU 34 8.291 9.205 4.250 252 HA GLU 34 HA GLU 34 11.051 10.194 3.661 253 1HB GLU 34 1HB GLU 34 9.585 11.249 5.418 254 2HB GLU 34 2HB GLU 34 9.628 9.787 6.379 255 1HG GLU 34 1HG GLU 34 12.169 11.390 5.629 256 2HG GLU 34 2HG GLU 34 11.166 11.804 7.005 257 HE2 GLU 34 HE2 GLU 34 13.882 8.963 7.334 258 H ALA 35 H ALA 35 9.667 7.178 5.069 259 HA ALA 35 HA ALA 35 12.244 5.891 5.482 260 1HB ALA 35 3HB ALA 35 9.808 4.882 6.312 261 2HB ALA 35 1HB ALA 35 9.547 4.455 4.643 262 3HB ALA 35 2HB ALA 35 10.820 3.676 5.514 263 H LEU 36 H LEU 36 10.011 5.696 2.682 264 HA LEU 36 HA LEU 36 11.648 3.990 0.996 265 1HB LEU 36 2HB LEU 36 9.573 5.886 0.064 266 2HB LEU 36 1HB LEU 36 10.106 4.395 -0.675 267 HG LEU 36 HG LEU 36 8.421 4.562 1.858 268 1HD1 LEU 36 1HD2 LEU 36 7.161 4.456 -0.150 269 2HD1 LEU 36 2HD2 LEU 36 8.004 2.914 -0.628 270 3HD1 LEU 36 3HD2 LEU 36 6.955 2.980 0.828 271 1HD2 LEU 36 1HD1 LEU 36 9.833 2.014 0.931 272 2HD2 LEU 36 2HD1 LEU 36 10.161 2.899 2.450 273 3HD2 LEU 36 3HD1 LEU 36 8.595 2.145 2.232 274 NH1 ARG 37 NH2 ARG 37 14.455 13.344 2.427 275 NH2 ARG 37 NH1 ARG 37 13.099 13.789 4.195 276 H ARG 37 H ARG 37 11.286 7.602 1.059 277 HA ARG 37 HA ARG 37 13.105 7.861 -1.128 278 1HB ARG 37 1HB ARG 37 13.173 10.213 -0.911 279 2HB ARG 37 2HB ARG 37 11.544 9.743 -0.484 280 1HG ARG 37 1HG ARG 37 12.268 9.914 2.002 281 2HG ARG 37 2HG ARG 37 13.816 10.535 1.478 282 1HD ARG 37 1HD ARG 37 12.812 12.481 0.398 283 2HD ARG 37 2HD ARG 37 11.181 11.879 0.761 284 1HH1 ARG 37 2HH2 ARG 37 14.560 12.905 1.505 285 2HH1 ARG 37 1HH2 ARG 37 15.173 13.863 2.946 286 1HH2 ARG 37 1HH1 ARG 37 12.173 13.692 4.624 287 2HH2 ARG 37 2HH1 ARG 37 13.911 14.276 4.590 288 H LYS 38 H LYS 38 13.640 7.367 2.336 289 HA LYS 38 HA LYS 38 16.522 8.310 2.081 290 1HB LYS 38 1HB LYS 38 14.945 9.408 3.835 291 2HB LYS 38 2HB LYS 38 15.112 7.924 4.749 292 1HG LYS 38 1HG LYS 38 17.720 8.364 4.659 293 2HG LYS 38 2HG LYS 38 17.333 9.872 3.858 294 1HD LYS 38 1HD LYS 38 17.669 10.469 6.112 295 2HD LYS 38 2HD LYS 38 15.924 10.541 5.908 296 1HE LYS 38 1HE LYS 38 15.748 8.212 7.002 297 2HE LYS 38 2HE LYS 38 17.504 8.195 7.199 298 1HZ LYS 38 1HZ LYS 38 16.358 8.928 9.182 299 2HZ LYS 38 2HZ LYS 38 15.635 10.166 8.396 300 H GLY 39 H GLY 39 15.294 5.533 1.381 301 1HA GLY 39 1HA GLY 39 16.082 3.275 1.412 302 2HA GLY 39 2HA GLY 39 17.572 3.853 2.120 303 H ASP 40 H ASP 40 14.334 3.981 3.522 304 HA ASP 40 HA ASP 40 15.106 2.011 5.733 305 1HB ASP 40 1HB ASP 40 13.042 4.130 6.181 306 2HB ASP 40 2HB ASP 40 13.731 3.030 7.322 307 HD2 ASP 40 HD2 ASP 40 15.591 6.448 6.371 308 H LYS 41 H LYS 41 13.962 0.324 6.216 309 HA LYS 41 HA LYS 41 11.633 -0.415 4.443 310 1HB LYS 41 2HB LYS 41 12.705 -2.155 6.679 311 2HB LYS 41 1HB LYS 41 11.628 -2.627 5.370 312 1HG LYS 41 1HG LYS 41 13.592 -2.092 3.739 313 2HG LYS 41 2HG LYS 41 14.620 -1.947 5.162 314 1HD LYS 41 1HD LYS 41 14.042 -4.333 5.824 315 2HD LYS 41 2HD LYS 41 12.973 -4.450 4.434 316 1HE LYS 41 1HE LYS 41 14.998 -5.578 3.815 317 2HE LYS 41 2HE LYS 41 14.946 -4.096 2.864 318 1HZ LYS 41 1HZ LYS 41 16.541 -4.540 5.335 319 2HZ LYS 41 2HZ LYS 41 17.123 -4.520 3.807 320 H VAL 42 H VAL 42 9.617 0.080 5.101 321 HA VAL 42 HA VAL 42 8.850 0.814 7.804 322 HB VAL 42 HB VAL 42 7.491 0.499 5.036 323 1HG1 VAL 42 1HG2 VAL 42 6.596 2.043 7.463 324 2HG1 VAL 42 2HG2 VAL 42 5.833 2.124 5.836 325 3HG1 VAL 42 3HG2 VAL 42 5.801 0.575 6.720 326 1HG2 VAL 42 2HG1 VAL 42 8.483 3.007 6.502 327 2HG2 VAL 42 3HG1 VAL 42 9.220 2.261 5.022 328 3HG2 VAL 42 1HG1 VAL 42 7.636 3.015 4.936 329 H GLN 43 H GLN 43 7.280 -0.193 8.714 330 HA GLN 43 HA GLN 43 6.476 -3.023 8.044 331 1HB GLN 43 1HB GLN 43 8.170 -2.810 10.473 332 2HB GLN 43 2HB GLN 43 7.181 -4.201 10.014 333 1HG GLN 43 1HG GLN 43 8.551 -4.220 7.817 334 2HG GLN 43 2HG GLN 43 9.531 -2.930 8.501 335 1HE2 GLN 43 2HE2 GLN 43 11.641 -5.766 9.189 336 2HE2 GLN 43 1HE2 GLN 43 11.130 -4.575 7.896 337 H LEU 44 H LEU 44 4.619 -3.614 8.372 338 HA LEU 44 HA LEU 44 2.923 -2.579 10.679 339 1HB LEU 44 2HB LEU 44 1.802 -2.944 7.849 340 2HB LEU 44 1HB LEU 44 0.856 -2.558 9.255 341 HG LEU 44 HG LEU 44 3.079 -0.628 8.373 342 1HD1 LEU 44 2HD1 LEU 44 0.287 -0.739 7.076 343 2HD1 LEU 44 3HD1 LEU 44 1.495 0.556 6.866 344 3HD1 LEU 44 1HD1 LEU 44 1.842 -1.077 6.276 345 1HD2 LEU 44 1HD2 LEU 44 0.333 -0.175 9.727 346 2HD2 LEU 44 2HD2 LEU 44 1.918 -0.148 10.536 347 3HD2 LEU 44 3HD2 LEU 44 1.519 1.090 9.329 348 H ILE 45 H ILE 45 2.583 -4.466 11.772 349 HA ILE 45 HA ILE 45 3.270 -6.968 10.554 350 HB ILE 45 HB ILE 45 3.974 -6.394 12.796 351 1HG1 ILE 45 1HG1 ILE 45 4.142 -8.732 11.997 352 2HG1 ILE 45 2HG1 ILE 45 4.195 -8.471 13.728 353 1HG2 ILE 45 1HG2 ILE 45 1.925 -5.403 13.727 354 2HG2 ILE 45 2HG2 ILE 45 1.138 -6.999 13.782 355 3HG2 ILE 45 3HG2 ILE 45 2.571 -6.669 14.795 356 1HD1 ILE 45 1HD1 ILE 45 1.844 -9.359 13.977 357 2HD1 ILE 45 2HD1 ILE 45 1.775 -9.661 12.222 358 3HD1 ILE 45 3HD1 ILE 45 2.947 -10.531 13.227 359 H GLY 46 H GLY 46 0.442 -6.160 11.539 360 1HA GLY 46 1HA GLY 46 -1.042 -8.666 10.505 361 2HA GLY 46 2HA GLY 46 -1.857 -7.325 11.274 362 H PHE 47 H PHE 47 0.196 -6.094 8.792 363 HA PHE 47 HA PHE 47 -1.889 -6.372 6.623 364 1HB PHE 47 2HB PHE 47 -2.265 -4.473 8.339 365 2HB PHE 47 1HB PHE 47 -0.836 -3.679 7.754 366 HD1 PHE 47 HD1 PHE 47 -4.286 -4.800 6.714 367 HD2 PHE 47 HD2 PHE 47 -0.778 -2.607 5.515 368 HE1 PHE 47 HE1 PHE 47 -5.419 -4.056 4.639 369 HE2 PHE 47 HE2 PHE 47 -1.919 -1.932 3.454 370 HZ PHE 47 HZ PHE 47 -4.206 -2.742 2.986 371 H GLY 48 H GLY 48 1.472 -5.027 7.200 372 1HA GLY 48 1HA GLY 48 2.257 -5.566 4.545 373 2HA GLY 48 2HA GLY 48 1.630 -3.946 4.468 374 H ASN 49 H ASN 49 4.278 -5.318 4.139 375 HA ASN 49 HA ASN 49 5.969 -3.385 5.833 376 1HB ASN 49 1HB ASN 49 6.831 -6.100 4.696 377 2HB ASN 49 2HB ASN 49 7.880 -4.951 5.504 378 1HD2 ASN 49 1HD2 ASN 49 7.066 -7.456 8.082 379 2HD2 ASN 49 2HD2 ASN 49 7.965 -7.331 6.487 380 H PHE 50 H PHE 50 6.310 -1.670 4.566 381 HA PHE 50 HA PHE 50 6.661 -1.929 1.577 382 1HB PHE 50 2HB PHE 50 6.949 0.700 3.129 383 2HB PHE 50 1HB PHE 50 6.989 0.559 1.454 384 HD1 PHE 50 HD1 PHE 50 4.870 0.005 4.468 385 HD2 PHE 50 HD2 PHE 50 5.041 1.291 0.378 386 HE1 PHE 50 HE1 PHE 50 2.529 0.820 4.616 387 HE2 PHE 50 HE2 PHE 50 2.707 2.124 0.570 388 HZ PHE 50 HZ PHE 50 1.455 1.701 2.634 389 H GLU 51 H GLU 51 8.536 -1.344 0.530 390 HA GLU 51 HA GLU 51 10.850 -0.296 1.871 391 1HB GLU 51 1HB GLU 51 12.492 -2.187 1.742 392 2HB GLU 51 2HB GLU 51 11.227 -2.543 2.878 393 1HG GLU 51 1HG GLU 51 11.340 -3.717 0.017 394 2HG GLU 51 2HG GLU 51 12.040 -4.479 1.432 395 HE2 GLU 51 HE2 GLU 51 8.177 -4.906 0.635 396 H VAL 52 H VAL 52 12.695 0.231 0.538 397 HA VAL 52 HA VAL 52 11.770 0.538 -2.230 398 HB VAL 52 HB VAL 52 12.717 2.203 -0.102 399 1HG1 VAL 52 1HG2 VAL 52 15.062 1.787 -1.976 400 2HG1 VAL 52 2HG2 VAL 52 14.818 3.149 -0.821 401 3HG1 VAL 52 3HG2 VAL 52 14.966 1.459 -0.241 402 1HG2 VAL 52 3HG1 VAL 52 12.499 2.828 -3.054 403 2HG2 VAL 52 1HG1 VAL 52 11.234 2.900 -1.793 404 3HG2 VAL 52 2HG1 VAL 52 12.617 3.982 -1.719 405 NH1 ARG 53 NH2 ARG 53 14.574 -3.944 -9.503 406 NH2 ARG 53 NH1 ARG 53 14.235 -1.819 -10.233 407 H ARG 53 H ARG 53 13.255 0.399 -4.007 408 HA ARG 53 HA ARG 53 15.433 -1.767 -3.685 409 1HB ARG 53 1HB ARG 53 13.225 -2.575 -4.704 410 2HB ARG 53 2HB ARG 53 13.501 -1.521 -6.058 411 1HG ARG 53 1HG ARG 53 15.402 -3.770 -5.174 412 2HG ARG 53 2HG ARG 53 14.139 -3.946 -6.378 413 1HD ARG 53 1HD ARG 53 16.689 -2.255 -6.653 414 2HD ARG 53 2HD ARG 53 16.360 -3.770 -7.441 415 1HH1 ARG 53 2HH2 ARG 53 14.944 -4.558 -8.769 416 2HH1 ARG 53 1HH2 ARG 53 14.113 -4.234 -10.373 417 1HH2 ARG 53 1HH1 ARG 53 14.347 -0.814 -10.059 418 2HH2 ARG 53 2HH1 ARG 53 13.798 -2.256 -11.051 419 H GLU 54 H GLU 54 17.143 -0.458 -3.690 420 HA GLU 54 HA GLU 54 17.494 1.863 -5.526 421 1HB GLU 54 1HB GLU 54 18.508 1.743 -3.233 422 2HB GLU 54 2HB GLU 54 19.653 0.531 -3.805 423 1HG GLU 54 1HG GLU 54 20.553 2.209 -5.500 424 2HG GLU 54 2HG GLU 54 19.347 3.384 -4.987 425 HE1 GLU 54 HE2 GLU 54 22.116 1.665 -4.163 426 NH1 ARG 55 NH2 ARG 55 20.474 -2.458 -12.717 427 NH2 ARG 55 NH1 ARG 55 19.442 -2.703 -14.725 428 H ARG 55 H ARG 55 17.979 1.727 -7.581 429 HA ARG 55 HA ARG 55 18.747 -0.892 -8.842 430 1HB ARG 55 1HB ARG 55 16.880 0.497 -9.776 431 2HB ARG 55 2HB ARG 55 17.988 1.816 -10.098 432 1HG ARG 55 1HG ARG 55 17.525 0.693 -12.168 433 2HG ARG 55 2HG ARG 55 19.215 0.418 -11.782 434 1HD ARG 55 1HD ARG 55 18.571 -1.933 -10.893 435 2HD ARG 55 2HD ARG 55 16.913 -1.604 -11.360 436 1HH1 ARG 55 2HH2 ARG 55 20.402 -2.160 -11.738 437 2HH1 ARG 55 1HH2 ARG 55 21.300 -2.851 -13.182 438 1HH2 ARG 55 1HH1 ARG 55 18.587 -2.591 -15.281 439 2HH2 ARG 55 2HH1 ARG 55 20.341 -3.076 -15.048 440 H ALA 56 H ALA 56 20.682 -1.329 -9.710 441 HA ALA 56 HA ALA 56 23.052 0.302 -9.020 442 1HB ALA 56 2HB ALA 56 23.161 -2.169 -8.996 443 2HB ALA 56 3HB ALA 56 22.869 -2.244 -10.752 444 3HB ALA 56 1HB ALA 56 24.361 -1.508 -10.122 445 H ALA 57 H ALA 57 23.225 2.164 -10.096 446 HA ALA 57 HA ALA 57 22.614 3.135 -12.486 447 1HB ALA 57 3HB ALA 57 23.962 4.408 -10.783 448 2HB ALA 57 1HB ALA 57 25.444 3.549 -11.276 449 3HB ALA 57 2HB ALA 57 24.641 4.667 -12.395 450 NH1 ARG 58 NH2 ARG 58 17.258 0.180 -17.693 451 NH2 ARG 58 NH1 ARG 58 16.547 0.141 -15.534 452 H ARG 58 H ARG 58 22.794 3.119 -14.484 453 HA ARG 58 HA ARG 58 24.193 0.776 -15.601 454 1HB ARG 58 2HB ARG 58 22.201 2.372 -17.256 455 2HB ARG 58 1HB ARG 58 22.639 0.679 -17.406 456 1HG ARG 58 1HG ARG 58 21.404 0.258 -15.190 457 2HG ARG 58 2HG ARG 58 20.933 1.964 -15.194 458 1HD ARG 58 1HD ARG 58 19.788 1.633 -17.449 459 2HD ARG 58 2HD ARG 58 20.167 -0.100 -17.358 460 1HH1 ARG 58 2HH2 ARG 58 18.041 0.312 -18.343 461 2HH1 ARG 58 1HH2 ARG 58 16.286 -0.036 -17.938 462 1HH2 ARG 58 1HH1 ARG 58 16.785 0.241 -14.541 463 2HH2 ARG 58 2HH1 ARG 58 15.624 -0.073 -15.926 464 H LYS 59 H LYS 59 24.581 1.241 -18.218 465 HA LYS 59 HA LYS 59 25.803 3.854 -18.854 466 1HB LYS 59 1HB LYS 59 27.702 2.823 -17.560 467 2HB LYS 59 2HB LYS 59 27.779 1.483 -18.698 468 1HG LYS 59 1HG LYS 59 28.397 3.021 -20.543 469 2HG LYS 59 2HG LYS 59 28.103 4.442 -19.537 470 1HD LYS 59 1HD LYS 59 29.981 3.751 -17.999 471 2HD LYS 59 2HD LYS 59 30.283 2.323 -19.000 472 1HE LYS 59 1HE LYS 59 30.828 3.804 -20.980 473 2HE LYS 59 2HE LYS 59 30.479 5.247 -20.018 474 1HZ LYS 59 1HZ LYS 59 32.262 4.585 -18.503 475 2HZ LYS 59 2HZ LYS 59 32.582 3.249 -19.388 476 H GLY 60 H GLY 60 25.036 4.124 -20.883 477 1HA GLY 60 1HA GLY 60 25.075 1.960 -22.935 478 2HA GLY 60 2HA GLY 60 23.479 2.077 -22.231 479 NH1 ARG 61 NH2 ARG 61 20.421 5.963 -27.098 480 NH2 ARG 61 NH1 ARG 61 19.279 7.924 -27.236 481 H ARG 61 H ARG 61 25.902 3.828 -23.973 482 HA ARG 61 HA ARG 61 23.932 4.884 -25.733 483 1HB ARG 61 1HB ARG 61 24.665 6.659 -23.765 484 2HB ARG 61 2HB ARG 61 25.366 7.333 -25.204 485 1HG ARG 61 1HG ARG 61 22.408 6.608 -24.768 486 2HG ARG 61 2HG ARG 61 23.099 8.219 -24.660 487 1HD ARG 61 1HD ARG 61 23.639 8.223 -27.102 488 2HD ARG 61 2HD ARG 61 23.054 6.577 -27.286 489 1HH1 ARG 61 2HH2 ARG 61 21.326 5.497 -26.972 490 2HH1 ARG 61 1HH2 ARG 61 19.511 5.511 -27.236 491 1HH2 ARG 61 1HH1 ARG 61 19.309 8.949 -27.215 492 2HH2 ARG 61 2HH1 ARG 61 18.448 7.335 -27.364 493 H ASN 62 H ASN 62 26.162 3.218 -26.222 494 HA ASN 62 HA ASN 62 26.720 4.346 -28.876 495 1HB ASN 62 1HB ASN 62 28.397 2.461 -29.077 496 2HB ASN 62 2HB ASN 62 28.522 3.342 -27.561 497 1HD2 ASN 62 1HD2 ASN 62 29.013 -0.088 -26.645 498 2HD2 ASN 62 2HD2 ASN 62 29.845 1.299 -27.500 499 HA PRO 63 HA PRO 63 24.154 0.982 -31.095 500 1HB PRO 63 1HB PRO 63 21.455 1.745 -30.891 501 2HB PRO 63 2HB PRO 63 22.225 0.516 -29.866 502 1HG PRO 63 1HG PRO 63 21.976 3.537 -29.236 503 2HG PRO 63 2HG PRO 63 21.415 2.180 -28.206 504 1HD PRO 63 1HD PRO 63 23.637 3.356 -27.723 505 2HD PRO 63 2HD PRO 63 23.694 1.561 -27.675 506 H GLN 64 H GLN 64 23.063 4.356 -30.642 507 HA GLN 64 HA GLN 64 23.020 4.920 -33.593 508 1HB GLN 64 1HB GLN 64 22.479 7.370 -32.739 509 2HB GLN 64 2HB GLN 64 21.269 6.119 -32.793 510 1HG GLN 64 1HG GLN 64 21.411 5.770 -30.329 511 2HG GLN 64 2HG GLN 64 22.741 6.920 -30.212 512 1HE2 GLN 64 2HE2 GLN 64 20.535 9.792 -30.372 513 2HE2 GLN 64 1HE2 GLN 64 22.263 9.179 -30.431 514 H THR 65 H THR 65 24.931 6.223 -30.772 515 HA THR 65 HA THR 65 26.585 7.798 -32.744 516 HB THR 65 HB THR 65 27.125 9.186 -30.801 517 HG1 THR 65 HG1 THR 65 25.555 7.381 -29.310 518 1HG2 THR 65 3HG2 THR 65 24.854 9.548 -31.999 519 2HG2 THR 65 1HG2 THR 65 24.100 8.570 -30.740 520 3HG2 THR 65 2HG2 THR 65 24.862 10.099 -30.286 521 H GLY 66 H GLY 66 27.148 5.004 -30.754 522 1HA GLY 66 1HA GLY 66 29.236 3.816 -30.430 523 2HA GLY 66 2HA GLY 66 30.063 5.013 -31.373 524 H GLU 67 H GLU 67 28.167 6.100 -28.394 525 HA GLU 67 HA GLU 67 30.707 6.239 -26.774 526 1HB GLU 67 2HB GLU 67 30.239 8.213 -28.534 527 2HB GLU 67 1HB GLU 67 28.985 8.689 -27.425 528 1HG GLU 67 1HG GLU 67 31.988 8.425 -26.698 529 2HG GLU 67 2HG GLU 67 31.200 9.927 -27.140 530 HE2 GLU 67 HE2 GLU 67 31.756 7.688 -24.784 531 H GLU 68 H GLU 68 29.938 5.459 -25.024 532 HA GLU 68 HA GLU 68 26.971 5.423 -24.369 533 1HB GLU 68 1HB GLU 68 29.262 4.053 -22.762 534 2HB GLU 68 2HB GLU 68 27.535 3.852 -22.496 535 1HG GLU 68 1HG GLU 68 27.333 2.793 -24.808 536 2HG GLU 68 2HG GLU 68 29.079 2.909 -24.980 537 HE2 GLU 68 HE2 GLU 68 27.442 -0.115 -23.046 538 H MET 69 H MET 69 26.062 6.476 -22.702 539 HA MET 69 HA MET 69 27.796 8.116 -20.778 540 1HB MET 69 1HB MET 69 26.041 9.702 -20.394 541 2HB MET 69 2HB MET 69 26.533 9.645 -22.067 542 1HG MET 69 1HG MET 69 24.140 10.000 -21.983 543 2HG MET 69 2HG MET 69 24.432 8.411 -22.665 544 1HE MET 69 1HE MET 69 22.172 7.648 -22.473 545 2HE MET 69 3HE MET 69 22.942 6.253 -21.650 546 3HE MET 69 2HE MET 69 21.447 6.982 -21.001 547 H GLU 70 H GLU 70 27.517 7.993 -18.681 548 HA GLU 70 HA GLU 70 26.409 5.592 -17.482 549 1HB GLU 70 2HB GLU 70 28.509 7.263 -16.883 550 2HB GLU 70 1HB GLU 70 27.377 7.933 -15.777 551 1HG GLU 70 1HG GLU 70 28.249 4.944 -16.066 552 2HG GLU 70 2HG GLU 70 28.991 6.089 -14.960 553 HE2 GLU 70 HE2 GLU 70 26.548 3.893 -13.262 554 H ILE 71 H ILE 71 24.393 5.277 -16.782 555 HA ILE 71 HA ILE 71 22.432 7.530 -16.570 556 HB ILE 71 HB ILE 71 22.196 4.464 -16.751 557 1HG1 ILE 71 1HG1 ILE 71 21.303 6.422 -18.944 558 2HG1 ILE 71 2HG1 ILE 71 22.987 6.000 -18.883 559 1HG2 ILE 71 2HG2 ILE 71 20.211 5.399 -15.627 560 2HG2 ILE 71 3HG2 ILE 71 19.989 6.583 -16.954 561 3HG2 ILE 71 1HG2 ILE 71 19.796 4.830 -17.266 562 1HD1 ILE 71 2HD1 ILE 71 20.781 3.899 -19.229 563 2HD1 ILE 71 3HD1 ILE 71 21.820 4.570 -20.505 564 3HD1 ILE 71 1HD1 ILE 71 22.550 3.605 -19.213 565 HA PRO 72 HA PRO 72 23.235 6.942 -12.031 566 1HB PRO 72 1HB PRO 72 21.453 8.812 -10.969 567 2HB PRO 72 2HB PRO 72 22.969 9.219 -11.784 568 1HG PRO 72 1HG PRO 72 20.158 9.177 -12.995 569 2HG PRO 72 2HG PRO 72 21.369 10.478 -13.095 570 1HD PRO 72 1HD PRO 72 21.040 8.643 -15.126 571 2HD PRO 72 2HD PRO 72 22.671 9.270 -14.734 572 H ALA 73 H ALA 73 22.190 6.315 -10.052 573 HA ALA 73 HA ALA 73 20.412 4.006 -10.289 574 1HB ALA 73 1HB ALA 73 22.013 4.365 -8.306 575 2HB ALA 73 2HB ALA 73 20.973 5.722 -7.739 576 3HB ALA 73 3HB ALA 73 20.355 4.075 -7.751 577 H SER 74 H SER 74 18.516 3.687 -8.995 578 HA SER 74 HA SER 74 17.235 5.896 -7.836 579 1HB SER 74 1HB SER 74 14.944 6.034 -9.004 580 2HB SER 74 2HB SER 74 16.249 6.485 -10.089 581 HG SER 74 HG SER 74 15.016 3.932 -9.916 582 H LYS 75 H LYS 75 15.882 5.514 -6.270 583 HA LYS 75 HA LYS 75 15.522 2.698 -5.317 584 1HB LYS 75 2HB LYS 75 14.227 4.833 -3.718 585 2HB LYS 75 1HB LYS 75 15.020 3.364 -3.274 586 1HG LYS 75 1HG LYS 75 17.281 4.385 -3.753 587 2HG LYS 75 2HG LYS 75 16.484 5.898 -4.190 588 1HD LYS 75 1HD LYS 75 15.509 6.044 -1.827 589 2HD LYS 75 2HD LYS 75 16.371 4.566 -1.422 590 1HE LYS 75 1HE LYS 75 17.686 6.373 -0.558 591 2HE LYS 75 2HE LYS 75 18.589 5.679 -1.902 592 1HZ LYS 75 1HZ LYS 75 18.627 8.055 -1.995 593 2HZ LYS 75 2HZ LYS 75 17.805 7.503 -3.296 594 H VAL 76 H VAL 76 13.607 1.385 -5.817 595 HA VAL 76 HA VAL 76 11.322 2.715 -6.975 596 HB VAL 76 HB VAL 76 13.189 0.406 -7.239 597 1HG1 VAL 76 3HG2 VAL 76 10.350 -0.246 -7.667 598 2HG1 VAL 76 1HG2 VAL 76 11.849 -1.180 -8.187 599 3HG1 VAL 76 2HG2 VAL 76 11.495 -0.937 -6.468 600 1HG2 VAL 76 2HG1 VAL 76 13.064 2.224 -8.856 601 2HG2 VAL 76 3HG1 VAL 76 12.758 0.626 -9.567 602 3HG2 VAL 76 1HG1 VAL 76 11.380 1.741 -9.257 603 HA PRO 77 HA PRO 77 9.507 1.443 -2.933 604 1HB PRO 77 1HB PRO 77 7.076 2.813 -3.120 605 2HB PRO 77 2HB PRO 77 8.618 3.674 -3.013 606 1HG PRO 77 1HG PRO 77 7.012 3.026 -5.532 607 2HG PRO 77 2HG PRO 77 7.696 4.588 -5.062 608 1HD PRO 77 1HD PRO 77 8.987 2.674 -6.827 609 2HD PRO 77 2HD PRO 77 9.922 3.853 -5.874 610 H ALA 78 H ALA 78 8.579 -0.065 -2.215 611 HA ALA 78 HA ALA 78 6.505 -1.729 -3.735 612 1HB ALA 78 2HB ALA 78 8.974 -2.469 -3.887 613 2HB ALA 78 3HB ALA 78 8.948 -2.744 -2.132 614 3HB ALA 78 1HB ALA 78 7.878 -3.687 -3.194 615 H PHE 79 H PHE 79 5.554 -3.299 -2.346 616 HA PHE 79 HA PHE 79 4.858 -2.518 0.569 617 1HB PHE 79 2HB PHE 79 3.503 -1.051 -0.283 618 2HB PHE 79 1HB PHE 79 2.980 -2.107 -1.637 619 HD1 PHE 79 HD2 PHE 79 2.497 -1.459 2.009 620 HD2 PHE 79 HD1 PHE 79 1.234 -3.821 -1.355 621 HE1 PHE 79 HE2 PHE 79 0.598 -2.319 3.310 622 HE2 PHE 79 HE1 PHE 79 -0.609 -4.738 -0.013 623 HZ PHE 79 HZ PHE 79 -0.904 -4.031 2.327 624 H LYS 80 H LYS 80 4.865 -4.339 1.344 625 HA LYS 80 HA LYS 80 4.295 -7.202 0.154 626 1HB LYS 80 2HB LYS 80 5.509 -6.439 2.839 627 2HB LYS 80 1HB LYS 80 4.996 -8.061 2.375 628 1HG LYS 80 1HG LYS 80 6.611 -8.040 0.439 629 2HG LYS 80 2HG LYS 80 7.175 -6.439 0.915 630 1HD LYS 80 1HD LYS 80 7.955 -7.322 3.116 631 2HD LYS 80 2HD LYS 80 7.339 -8.925 2.753 632 1HE LYS 80 1HE LYS 80 9.553 -7.491 1.122 633 2HE LYS 80 2HE LYS 80 9.859 -8.604 2.451 634 1HZ LYS 80 1HZ LYS 80 10.005 -9.692 0.322 635 2HZ LYS 80 2HZ LYS 80 8.470 -9.293 -0.074 636 HA PRO 81 HA PRO 81 0.323 -6.657 2.357 637 1HB PRO 81 1HB PRO 81 -0.844 -9.078 1.784 638 2HB PRO 81 2HB PRO 81 -0.478 -7.899 0.518 639 1HG PRO 81 1HG PRO 81 1.195 -10.343 1.316 640 2HG PRO 81 2HG PRO 81 0.620 -9.907 -0.314 641 1HD PRO 81 1HD PRO 81 3.161 -9.221 0.667 642 2HD PRO 81 2HD PRO 81 2.302 -8.229 -0.556 643 H GLY 82 H GLY 82 2.652 -7.147 3.938 644 1HA GLY 82 1HA GLY 82 3.713 -8.380 5.722 645 2HA GLY 82 2HA GLY 82 2.139 -8.003 6.395 646 H LYS 83 H LYS 83 2.149 -10.319 3.903 647 HA LYS 83 HA LYS 83 1.557 -12.655 3.831 648 1HB LYS 83 2HB LYS 83 3.079 -12.673 6.428 649 2HB LYS 83 1HB LYS 83 1.795 -13.822 6.435 650 1HG LYS 83 1HG LYS 83 2.705 -14.824 4.254 651 2HG LYS 83 2HG LYS 83 3.997 -13.619 4.260 652 1HD LYS 83 1HD LYS 83 4.827 -14.522 6.479 653 2HD LYS 83 2HD LYS 83 3.536 -15.729 6.470 654 1HE LYS 83 1HE LYS 83 4.472 -16.715 4.318 655 2HE LYS 83 2HE LYS 83 5.763 -15.505 4.325 656 1HZ LYS 83 1HZ LYS 83 6.508 -17.554 5.285 657 2HZ LYS 83 2HZ LYS 83 6.533 -16.385 6.427 658 H ALA 84 H ALA 84 0.641 -11.131 6.655 659 HA ALA 84 HA ALA 84 -1.764 -12.412 7.587 660 1HB ALA 84 2HB ALA 84 -0.271 -10.804 8.812 661 2HB ALA 84 3HB ALA 84 -0.686 -9.505 7.664 662 3HB ALA 84 1HB ALA 84 -1.941 -10.148 8.755 663 H LEU 85 H LEU 85 -1.449 -9.494 5.397 664 HA LEU 85 HA LEU 85 -4.334 -9.280 4.915 665 1HB LEU 85 2HB LEU 85 -2.902 -7.302 4.706 666 2HB LEU 85 1HB LEU 85 -1.939 -8.076 3.465 667 HG LEU 85 HG LEU 85 -4.052 -8.391 2.179 668 1HD1 LEU 85 2HD1 LEU 85 -5.806 -7.872 3.775 669 2HD1 LEU 85 3HD1 LEU 85 -5.213 -6.206 3.956 670 3HD1 LEU 85 1HD1 LEU 85 -5.925 -6.746 2.414 671 1HD2 LEU 85 3HD2 LEU 85 -2.920 -5.521 2.617 672 2HD2 LEU 85 1HD2 LEU 85 -2.307 -6.723 1.463 673 3HD2 LEU 85 2HD2 LEU 85 -3.890 -5.966 1.194 674 H LYS 86 H LYS 86 -1.614 -10.920 3.295 675 HA LYS 86 HA LYS 86 -3.151 -11.955 1.040 676 1HB LYS 86 1HB LYS 86 -0.570 -11.969 1.318 677 2HB LYS 86 2HB LYS 86 -0.757 -13.458 2.232 678 1HG LYS 86 1HG LYS 86 -1.863 -14.536 0.238 679 2HG LYS 86 2HG LYS 86 -1.778 -13.008 -0.646 680 1HD LYS 86 1HD LYS 86 0.753 -13.062 -0.494 681 2HD LYS 86 2HD LYS 86 0.664 -14.601 0.373 682 1HE LYS 86 1HE LYS 86 -0.480 -15.667 -1.638 683 2HE LYS 86 2HE LYS 86 -0.397 -14.124 -2.502 684 1HZ LYS 86 1HZ LYS 86 2.025 -14.217 -2.302 685 2HZ LYS 86 2HZ LYS 86 1.951 -15.640 -1.501 686 H ASP 87 H ASP 87 -3.223 -12.986 4.409 687 HA ASP 87 HA ASP 87 -4.780 -15.466 3.895 688 1HB ASP 87 1HB ASP 87 -3.167 -14.294 6.025 689 2HB ASP 87 2HB ASP 87 -4.764 -14.193 6.616 690 HD1 ASP 87 HD2 ASP 87 -2.890 -17.761 6.050 691 H ALA 88 H ALA 88 -5.429 -12.096 4.991 692 HA ALA 88 HA ALA 88 -8.282 -12.151 5.494 693 1HB ALA 88 1HB ALA 88 -6.764 -10.034 5.757 694 2HB ALA 88 2HB ALA 88 -6.705 -9.904 4.002 695 3HB ALA 88 3HB ALA 88 -8.238 -9.695 4.797 696 H VAL 89 H VAL 89 -6.519 -11.528 2.459 697 HA VAL 89 HA VAL 89 -8.899 -11.262 0.781 698 HB VAL 89 HB VAL 89 -6.580 -9.890 1.252 699 1HG1 VAL 89 2HG2 VAL 89 -5.226 -12.058 0.712 700 2HG1 VAL 89 3HG2 VAL 89 -5.477 -11.642 -0.985 701 3HG1 VAL 89 1HG2 VAL 89 -4.674 -10.490 0.130 702 1HG2 VAL 89 1HG1 VAL 89 -7.607 -10.239 -1.518 703 2HG2 VAL 89 2HG1 VAL 89 -8.199 -9.157 -0.194 704 3HG2 VAL 89 3HG1 VAL 89 -6.548 -8.934 -0.829 705 H LYS 90 H LYS 90 -7.286 -14.066 1.664 706 HA LYS 90 HA LYS 90 -6.735 -15.388 -0.810 707 1HB LYS 90 1HB LYS 90 -6.055 -15.845 1.730 708 2HB LYS 90 2HB LYS 90 -7.505 -16.807 1.825 709 1HG LYS 90 1HG LYS 90 -6.601 -18.382 0.113 710 2HG LYS 90 2HG LYS 90 -5.319 -17.254 -0.302 711 1HD LYS 90 1HD LYS 90 -4.250 -18.879 1.009 712 2HD LYS 90 2HD LYS 90 -4.328 -17.474 2.040 713 1HE LYS 90 1HE LYS 90 -6.346 -19.832 2.217 714 2HE LYS 90 2HE LYS 90 -4.817 -19.807 3.088 715 1HZ LYS 90 1HZ LYS 90 -5.500 -17.843 4.259 716 2HZ LYS 90 2HZ LYS 90 -6.588 -19.045 4.472 717 1H MET 1 1H MET 91 9.820 0.470 9.808 718 2H MET 1 2H MET 91 10.886 -0.204 10.919 719 HA MET 1 HA MET 91 9.677 0.809 12.407 720 1HB MET 1 1HB MET 91 7.379 0.821 10.341 721 2HB MET 1 2HB MET 91 7.208 1.432 11.957 722 1HG MET 1 1HG MET 91 9.351 2.943 11.391 723 2HG MET 1 2HG MET 91 8.941 2.582 9.711 724 1HE MET 1 2HE MET 91 7.899 4.392 8.534 725 2HE MET 1 1HE MET 91 6.215 3.784 8.659 726 3HE MET 1 3HE MET 91 6.582 5.453 9.099 727 H ASN 2 H ASN 92 6.786 -0.903 11.660 728 HA ASN 2 HA ASN 92 6.927 -3.400 12.118 729 1HB ASN 2 1HB ASN 92 6.839 -4.380 14.267 730 2HB ASN 2 2HB ASN 92 8.302 -3.473 14.118 731 1HD2 ASN 2 1HD2 ASN 92 5.704 -2.454 17.101 732 2HD2 ASN 2 2HD2 ASN 92 5.203 -3.498 15.675 733 H LYS 3 H LYS 93 5.338 -0.769 13.457 734 HA LYS 3 HA LYS 93 2.939 -0.470 12.500 735 1HB LYS 3 1HB LYS 93 2.331 -2.981 12.737 736 2HB LYS 3 2HB LYS 93 2.234 -2.759 14.465 737 1HG LYS 3 1HG LYS 93 0.277 -1.202 14.126 738 2HG LYS 3 2HG LYS 93 0.579 -1.154 12.388 739 1HD LYS 3 1HD LYS 93 0.096 -3.654 12.249 740 2HD LYS 3 2HD LYS 93 -0.310 -3.649 13.969 741 1HE LYS 3 1HE LYS 93 -2.184 -1.988 13.520 742 2HE LYS 3 2HE LYS 93 -1.746 -1.950 11.805 743 1HZ LYS 3 1HZ LYS 93 -2.251 -4.294 11.651 744 2HZ LYS 3 2HZ LYS 93 -3.547 -3.454 12.185 745 H THR 4 H THR 94 4.627 -0.801 15.579 746 HA THR 4 HA THR 94 2.972 1.197 16.909 747 HB THR 4 HB THR 94 5.286 -0.711 17.666 748 HG1 THR 4 HG1 THR 94 2.489 -0.831 18.252 749 1HG2 THR 4 3HG2 THR 94 3.465 1.103 19.265 750 2HG2 THR 4 1HG2 THR 94 4.506 -0.224 19.978 751 3HG2 THR 4 2HG2 THR 94 5.260 1.165 19.095 752 H GLU 5 H GLU 95 6.056 0.811 15.329 753 HA GLU 5 HA GLU 95 7.210 3.406 16.384 754 1HB GLU 5 1HB GLU 95 8.087 2.173 13.749 755 2HB GLU 5 2HB GLU 95 8.913 3.370 14.701 756 1HG GLU 5 1HG GLU 95 8.592 0.383 15.336 757 2HG GLU 5 2HG GLU 95 10.033 1.169 14.753 758 HE2 GLU 5 HE2 GLU 95 9.124 1.130 18.659 759 H LEU 6 H LEU 96 4.703 2.325 14.139 760 HA LEU 6 HA LEU 96 4.510 4.785 12.601 761 1HB LEU 6 2HB LEU 96 3.537 1.942 12.657 762 2HB LEU 6 1HB LEU 96 2.135 2.882 12.890 763 HG LEU 6 HG LEU 96 2.164 3.027 10.681 764 1HD1 LEU 6 2HD1 LEU 96 2.709 5.381 10.842 765 2HD1 LEU 6 3HD1 LEU 96 4.414 5.028 10.464 766 3HD1 LEU 6 1HD1 LEU 96 3.164 4.691 9.265 767 1HD2 LEU 6 2HD2 LEU 96 3.868 1.186 10.454 768 2HD2 LEU 6 3HD2 LEU 96 3.982 2.300 9.079 769 3HD2 LEU 6 1HD2 LEU 96 5.162 2.389 10.412 770 H ILE 7 H ILE 97 3.010 3.304 15.496 771 HA ILE 7 HA ILE 97 0.855 5.260 15.877 772 HB ILE 7 HB ILE 97 2.263 3.503 17.953 773 1HG1 ILE 7 1HG1 ILE 97 -0.399 3.061 16.456 774 2HG1 ILE 7 2HG1 ILE 97 1.069 2.404 15.876 775 1HG2 ILE 7 2HG2 ILE 97 0.938 5.407 19.049 776 2HG2 ILE 7 3HG2 ILE 97 -0.495 4.841 18.217 777 3HG2 ILE 7 1HG2 ILE 97 0.277 3.806 19.418 778 1HD1 ILE 7 3HD1 ILE 97 1.427 1.225 18.162 779 2HD1 ILE 7 1HD1 ILE 97 -0.262 1.560 18.413 780 3HD1 ILE 7 2HD1 ILE 97 0.241 0.593 16.983 781 H ASN 8 H ASN 98 4.119 5.082 17.212 782 HA ASN 8 HA ASN 98 4.071 7.853 18.334 783 1HB ASN 8 1HB ASN 98 6.577 6.244 17.428 784 2HB ASN 8 2HB ASN 98 6.620 7.703 18.390 785 1HD2 ASN 8 2HD2 ASN 98 6.340 4.257 20.406 786 2HD2 ASN 8 1HD2 ASN 98 6.705 4.401 18.612 787 H ALA 9 H ALA 99 4.215 6.889 15.051 788 HA ALA 9 HA ALA 99 5.566 9.364 13.989 789 1HB ALA 9 2HB ALA 99 5.196 7.078 12.550 790 2HB ALA 9 3HB ALA 99 3.504 7.546 12.458 791 3HB ALA 9 1HB ALA 99 4.657 8.604 11.743 792 H VAL 10 H VAL 100 2.247 8.137 14.442 793 HA VAL 10 HA VAL 100 0.991 10.374 13.242 794 HB VAL 10 HB VAL 100 -0.662 8.587 14.974 795 1HG1 VAL 10 3HG2 VAL 100 -1.430 10.521 13.344 796 2HG1 VAL 10 1HG2 VAL 100 -1.173 9.276 12.091 797 3HG1 VAL 10 2HG2 VAL 100 -2.317 8.955 13.417 798 1HG2 VAL 10 1HG1 VAL 100 0.848 7.702 12.489 799 2HG2 VAL 10 2HG1 VAL 100 0.697 6.971 14.121 800 3HG2 VAL 10 3HG1 VAL 100 -0.703 6.912 13.001 801 H ALA 11 H ALA 101 1.226 9.216 16.365 802 HA ALA 11 HA ALA 101 0.057 11.526 17.499 803 1HB ALA 11 2HB ALA 101 0.126 9.329 18.737 804 2HB ALA 11 3HB ALA 101 1.896 9.455 18.908 805 3HB ALA 11 1HB ALA 101 0.818 10.594 19.782 806 H GLU 12 H GLU 102 3.370 11.047 16.477 807 HA GLU 12 HA GLU 102 4.363 13.488 17.919 808 1HB GLU 12 1HB GLU 102 5.946 11.620 17.450 809 2HB GLU 12 2HB GLU 102 5.737 11.847 15.711 810 1HG GLU 12 1HG GLU 102 6.742 14.184 15.944 811 2HG GLU 12 2HG GLU 102 6.928 13.926 17.677 812 HE1 GLU 12 HE2 GLU 102 9.688 11.851 17.423 813 H THR 13 H THR 103 3.533 12.665 14.467 814 HA THR 13 HA THR 103 3.713 15.483 13.687 815 HB THR 13 HB THR 103 2.507 14.837 11.538 816 HG1 THR 13 HG1 THR 103 1.063 13.513 12.644 817 1HG2 THR 13 2HG2 THR 103 4.511 12.613 12.197 818 2HG2 THR 13 3HG2 THR 103 3.827 13.004 10.610 819 3HG2 THR 13 1HG2 THR 103 4.883 14.182 11.429 820 H SER 14 H SER 104 1.378 14.235 15.330 821 HA SER 14 HA SER 104 -0.692 16.401 14.531 822 1HB SER 14 1HB SER 104 -1.503 13.513 15.230 823 2HB SER 14 2HB SER 104 -2.595 14.827 14.813 824 HG SER 14 HG SER 104 -0.551 13.760 13.162 825 H GLY 15 H GLY 105 0.473 14.471 17.307 826 1HA GLY 15 1HA GLY 105 0.078 14.747 19.630 827 2HA GLY 15 2HA GLY 105 -0.515 16.375 19.308 828 H LEU 16 H LEU 106 -1.663 13.155 18.410 829 HA LEU 16 HA LEU 106 -4.383 13.492 19.671 830 1HB LEU 16 1HB LEU 106 -5.118 11.616 18.391 831 2HB LEU 16 2HB LEU 106 -4.742 13.079 17.506 832 HG LEU 16 HG LEU 106 -2.779 12.288 16.664 833 1HD1 LEU 16 2HD1 LEU 106 -1.875 11.016 18.655 834 2HD1 LEU 16 3HD1 LEU 106 -3.004 9.703 18.199 835 3HD1 LEU 16 1HD1 LEU 106 -1.635 10.218 17.105 836 1HD2 LEU 16 3HD2 LEU 106 -4.190 11.783 15.108 837 2HD2 LEU 16 1HD2 LEU 106 -2.700 10.815 15.154 838 3HD2 LEU 16 2HD2 LEU 106 -4.196 10.081 15.686 839 H SER 17 H SER 107 -3.754 10.587 19.745 840 HA SER 17 HA SER 107 -2.411 10.360 22.490 841 1HB SER 17 1HB SER 107 -5.006 8.848 21.931 842 2HB SER 17 2HB SER 107 -4.000 8.731 23.357 843 HG SER 17 HG SER 107 -4.353 10.942 23.745 844 H LYS 18 H LYS 108 -1.673 8.250 22.991 845 HA LYS 18 HA LYS 108 -0.341 6.738 20.764 846 1HB LYS 18 1HB LYS 108 0.607 6.977 23.187 847 2HB LYS 18 2HB LYS 108 -0.666 5.906 23.722 848 1HG LYS 18 1HG LYS 108 1.130 4.442 23.510 849 2HG LYS 18 2HG LYS 108 0.286 4.154 21.999 850 1HD LYS 18 1HD LYS 108 1.937 5.887 20.922 851 2HD LYS 18 2HD LYS 108 2.820 5.894 22.426 852 1HE LYS 18 1HE LYS 108 2.295 3.330 20.751 853 2HE LYS 18 2HE LYS 108 3.714 4.347 20.563 854 1HZ LYS 18 1HZ LYS 108 4.179 2.510 21.995 855 2HZ LYS 18 2HZ LYS 108 4.330 3.903 22.839 856 H LYS 19 H LYS 109 -3.022 6.106 22.968 857 HA LYS 19 HA LYS 109 -4.117 3.694 21.688 858 1HB LYS 19 2HB LYS 109 -4.679 4.477 24.022 859 2HB LYS 19 1HB LYS 109 -5.586 5.839 23.351 860 1HG LYS 19 1HG LYS 109 -7.160 4.159 22.226 861 2HG LYS 19 2HG LYS 109 -6.200 2.851 22.894 862 1HD LYS 19 1HD LYS 109 -8.064 2.991 24.297 863 2HD LYS 19 2HD LYS 109 -6.785 3.686 25.264 864 1HE LYS 19 1HE LYS 109 -8.855 5.361 23.655 865 2HE LYS 19 2HE LYS 109 -9.120 4.824 25.309 866 1HZ LYS 19 1HZ LYS 109 -8.300 7.044 25.283 867 2HZ LYS 19 2HZ LYS 109 -7.213 6.076 26.027 868 H ASP 20 H ASP 110 -4.715 7.238 21.016 869 HA ASP 20 HA ASP 110 -6.825 6.610 18.957 870 1HB ASP 20 1HB ASP 110 -5.338 9.218 19.637 871 2HB ASP 20 2HB ASP 110 -6.331 9.116 18.212 872 HD2 ASP 20 HD2 ASP 110 -8.088 10.120 21.473 873 H ALA 21 H ALA 111 -3.342 7.065 18.848 874 HA ALA 21 HA ALA 111 -3.164 7.015 15.875 875 1HB ALA 21 1HB ALA 111 -1.068 6.963 18.123 876 2HB ALA 21 2HB ALA 111 -0.660 6.826 16.382 877 3HB ALA 21 3HB ALA 111 -1.484 8.226 16.995 878 H THR 22 H THR 112 -2.787 4.481 18.446 879 HA THR 22 HA THR 112 -2.237 2.234 16.746 880 HB THR 22 HB THR 112 -4.059 2.127 19.244 881 HG1 THR 22 HG1 THR 112 -2.232 3.375 19.697 882 1HG2 THR 22 2HG2 THR 112 -1.955 0.226 18.041 883 2HG2 THR 22 3HG2 THR 112 -2.749 -0.008 19.623 884 3HG2 THR 22 1HG2 THR 112 -3.714 -0.032 18.103 885 H LYS 23 H LYS 113 -5.322 3.525 17.729 886 HA LYS 23 HA LYS 113 -7.084 1.778 16.140 887 1HB LYS 23 2HB LYS 113 -7.256 4.733 17.180 888 2HB LYS 23 1HB LYS 113 -8.599 4.045 16.359 889 1HG LYS 23 1HG LYS 113 -8.906 2.252 18.098 890 2HG LYS 23 2HG LYS 113 -7.477 2.812 18.966 891 1HD LYS 23 1HD LYS 113 -8.568 5.050 19.365 892 2HD LYS 23 2HD LYS 113 -9.998 4.519 18.476 893 1HE LYS 23 1HE LYS 113 -10.411 2.694 20.170 894 2HE LYS 23 2HE LYS 113 -8.958 3.170 21.060 895 1HZ LYS 23 1HZ LYS 113 -11.337 4.880 20.584 896 2HZ LYS 23 2HZ LYS 113 -10.963 4.128 21.987 897 H ALA 24 H ALA 114 -5.914 5.007 15.515 898 HA ALA 24 HA ALA 114 -7.143 5.412 12.972 899 1HB ALA 24 3HB ALA 114 -4.684 6.706 14.189 900 2HB ALA 24 1HB ALA 114 -5.584 7.329 12.764 901 3HB ALA 24 2HB ALA 114 -6.406 7.202 14.345 902 H VAL 25 H VAL 115 -3.905 4.061 13.578 903 HA VAL 25 HA VAL 115 -3.258 3.445 10.686 904 HB VAL 25 HB VAL 115 -2.534 2.588 13.667 905 1HG1 VAL 25 2HG2 VAL 115 -1.374 1.056 11.277 906 2HG1 VAL 25 3HG2 VAL 115 -0.797 0.973 12.981 907 3HG1 VAL 25 1HG2 VAL 115 -2.409 0.415 12.565 908 1HG2 VAL 25 1HG1 VAL 115 -1.501 4.658 12.755 909 2HG2 VAL 25 2HG1 VAL 115 -0.303 3.441 13.213 910 3HG2 VAL 25 3HG1 VAL 115 -0.687 3.707 11.479 911 H ASP 26 H ASP 116 -4.607 1.344 13.343 912 HA ASP 26 HA ASP 116 -5.718 -0.592 11.327 913 1HB ASP 26 1HB ASP 116 -4.901 -1.037 13.770 914 2HB ASP 26 2HB ASP 116 -6.429 -0.341 14.306 915 HD2 ASP 26 HD2 ASP 116 -8.136 -3.293 13.865 916 H ALA 27 H ALA 117 -6.579 2.145 11.467 917 HA ALA 27 HA ALA 117 -9.585 1.988 11.001 918 1HB ALA 27 2HB ALA 117 -8.835 3.809 12.533 919 2HB ALA 27 3HB ALA 117 -7.871 4.454 11.193 920 3HB ALA 27 1HB ALA 117 -9.601 4.316 11.024 921 H VAL 28 H VAL 118 -6.687 3.350 9.533 922 HA VAL 28 HA VAL 118 -7.642 3.589 6.753 923 HB VAL 28 HB VAL 118 -4.689 3.103 7.667 924 1HG1 VAL 28 1HG2 VAL 118 -6.023 3.914 5.104 925 2HG1 VAL 28 2HG2 VAL 118 -4.543 4.787 5.523 926 3HG1 VAL 28 3HG2 VAL 118 -4.487 3.025 5.479 927 1HG2 VAL 28 2HG1 VAL 118 -6.190 5.697 7.672 928 2HG2 VAL 28 3HG1 VAL 118 -5.142 4.893 8.896 929 3HG2 VAL 28 1HG1 VAL 118 -4.383 5.576 7.471 930 H PHE 29 H PHE 119 -5.474 1.417 8.304 931 HA PHE 29 HA PHE 119 -5.406 -0.734 6.276 932 1HB PHE 29 2HB PHE 119 -4.242 -0.907 9.047 933 2HB PHE 29 1HB PHE 119 -3.881 -1.948 7.669 934 HD1 PHE 29 HD2 PHE 119 -3.463 -0.349 5.336 935 HD2 PHE 29 HD1 PHE 119 -2.422 0.637 9.383 936 HE1 PHE 29 HE2 PHE 119 -2.029 1.438 4.518 937 HE2 PHE 29 HE1 PHE 119 -1.003 2.461 8.554 938 HZ PHE 29 HZ PHE 119 -0.927 2.918 6.086 939 H ASP 30 H ASP 120 -7.720 -0.288 8.767 940 HA ASP 30 HA ASP 120 -8.796 -3.068 8.370 941 1HB ASP 30 1HB ASP 120 -9.019 -1.447 10.471 942 2HB ASP 30 2HB ASP 120 -10.353 -0.715 9.638 943 HD2 ASP 30 HD2 ASP 120 -12.588 -3.300 10.112 944 H SER 31 H SER 121 -9.207 0.030 7.108 945 HA SER 31 HA SER 121 -11.819 -0.474 5.621 946 1HB SER 31 2HB SER 121 -10.119 2.074 5.685 947 2HB SER 31 1HB SER 121 -11.591 1.859 4.711 948 HG SER 31 HG SER 121 -11.394 1.504 7.514 949 H ILE 32 H ILE 122 -8.253 -0.050 4.687 950 HA ILE 32 HA ILE 122 -8.656 -0.743 1.922 951 HB ILE 32 HB ILE 122 -6.314 -1.922 3.356 952 1HG1 ILE 32 1HG1 ILE 122 -6.129 -0.174 4.559 953 2HG1 ILE 32 2HG1 ILE 122 -4.769 -0.464 3.448 954 1HG2 ILE 32 2HG2 ILE 122 -6.899 -1.815 0.776 955 2HG2 ILE 32 3HG2 ILE 122 -6.112 -0.215 0.904 956 3HG2 ILE 32 1HG2 ILE 122 -5.210 -1.701 1.306 957 1HD1 ILE 32 1HD1 ILE 122 -5.387 1.736 2.324 958 2HD1 ILE 32 2HD1 ILE 122 -6.428 2.024 3.790 959 3HD1 ILE 32 3HD1 ILE 122 -4.696 1.707 3.938 960 H THR 33 H THR 123 -8.082 -2.810 4.798 961 HA THR 33 HA THR 123 -8.136 -5.389 3.385 962 HB THR 33 HB THR 123 -9.179 -6.576 5.284 963 HG1 THR 33 HG1 THR 123 -8.985 -4.087 6.623 964 1HG2 THR 33 3HG2 THR 123 -6.691 -5.051 6.140 965 2HG2 THR 33 1HG2 THR 123 -7.422 -6.406 7.028 966 3HG2 THR 33 2HG2 THR 123 -6.817 -6.674 5.398 967 H GLU 34 H GLU 124 -10.820 -3.406 4.367 968 HA GLU 34 HA GLU 124 -12.864 -5.430 3.456 969 1HB GLU 34 1HB GLU 124 -13.349 -3.836 5.436 970 2HB GLU 34 2HB GLU 124 -13.361 -2.487 4.306 971 1HG GLU 34 1HG GLU 124 -15.346 -3.561 3.097 972 2HG GLU 34 2HG GLU 124 -15.282 -4.918 4.216 973 HE1 GLU 34 HE2 GLU 124 -16.887 -1.364 5.251 974 H ALA 35 H ALA 125 -11.061 -2.794 2.015 975 HA ALA 35 HA ALA 125 -12.768 -2.778 -0.416 976 1HB ALA 35 1HB ALA 125 -11.159 -0.708 0.000 977 2HB ALA 35 2HB ALA 125 -9.804 -1.826 -0.220 978 3HB ALA 35 3HB ALA 125 -10.857 -1.466 -1.567 979 H LEU 36 H LEU 126 -9.379 -4.115 0.200 980 HA LEU 36 HA LEU 126 -9.275 -5.602 -2.279 981 1HB LEU 36 2HB LEU 126 -7.894 -5.941 0.341 982 2HB LEU 36 1HB LEU 126 -7.264 -6.464 -1.214 983 HG LEU 36 HG LEU 126 -7.738 -3.501 -0.538 984 1HD1 LEU 36 3HD1 LEU 126 -5.446 -4.272 0.087 985 2HD1 LEU 36 1HD1 LEU 126 -5.172 -4.273 -1.731 986 3HD1 LEU 36 2HD1 LEU 126 -5.712 -2.789 -0.877 987 1HD2 LEU 36 2HD2 LEU 126 -7.541 -4.152 -3.261 988 2HD2 LEU 36 3HD2 LEU 126 -8.747 -3.240 -2.344 989 3HD2 LEU 36 1HD2 LEU 126 -7.154 -2.561 -2.561 990 NH1 ARG 37 NH2 ARG 127 -11.172 -11.335 6.655 991 NH2 ARG 37 NH1 ARG 127 -12.335 -13.208 6.106 992 H ARG 37 H ARG 127 -10.296 -6.644 1.050 993 HA ARG 37 HA ARG 127 -10.501 -9.344 0.213 994 1HB ARG 37 1HB ARG 127 -10.340 -8.644 2.611 995 2HB ARG 37 2HB ARG 127 -11.966 -7.953 2.535 996 1HG ARG 37 1HG ARG 127 -12.905 -10.292 2.136 997 2HG ARG 37 2HG ARG 127 -11.265 -10.930 2.249 998 1HD ARG 37 1HD ARG 127 -11.132 -9.714 4.569 999 2HD ARG 37 2HD ARG 127 -12.863 -9.389 4.398 1000 1HH1 ARG 37 2HH2 ARG 127 -10.893 -10.382 6.395 1001 2HH1 ARG 37 1HH2 ARG 127 -10.908 -11.842 7.507 1002 1HH2 ARG 37 1HH1 ARG 127 -12.941 -13.687 5.432 1003 2HH2 ARG 37 2HH1 ARG 127 -11.989 -13.583 6.997 1004 H LYS 38 H LYS 128 -12.712 -6.557 -0.245 1005 HA LYS 38 HA LYS 128 -15.090 -8.406 -0.671 1006 1HB LYS 38 1HB LYS 128 -15.211 -6.431 0.968 1007 2HB LYS 38 2HB LYS 128 -15.137 -5.359 -0.433 1008 1HG LYS 38 1HG LYS 128 -17.344 -6.253 -1.231 1009 2HG LYS 38 2HG LYS 128 -17.317 -7.486 0.023 1010 1HD LYS 38 1HD LYS 128 -18.814 -5.746 0.742 1011 2HD LYS 38 2HD LYS 128 -17.415 -5.718 1.807 1012 1HE LYS 38 1HE LYS 128 -16.485 -3.717 0.495 1013 2HE LYS 38 2HE LYS 128 -17.910 -3.762 -0.552 1014 1HZ LYS 38 1HZ LYS 128 -18.116 -2.165 1.238 1015 2HZ LYS 38 2HZ LYS 128 -17.914 -3.314 2.383 1016 H GLY 39 H GLY 129 -12.687 -7.491 -2.635 1017 1HA GLY 39 1HA GLY 129 -12.484 -7.204 -5.019 1018 2HA GLY 39 2HA GLY 129 -14.205 -7.501 -5.186 1019 H ASP 40 H ASP 130 -12.526 -4.993 -3.383 1020 HA ASP 40 HA ASP 130 -13.560 -2.723 -5.157 1021 1HB ASP 40 1HB ASP 130 -13.756 -2.971 -2.157 1022 2HB ASP 40 2HB ASP 130 -13.891 -1.428 -2.974 1023 HD1 ASP 40 HD2 ASP 130 -17.049 -2.030 -4.272 1024 H LYS 41 H LYS 131 -12.491 -0.963 -5.444 1025 HA LYS 41 HA LYS 131 -9.489 -1.099 -4.993 1026 1HB LYS 41 2HB LYS 131 -11.043 1.025 -6.560 1027 2HB LYS 41 1HB LYS 131 -9.291 0.835 -6.513 1028 1HG LYS 41 1HG LYS 131 -9.578 -1.465 -7.601 1029 2HG LYS 41 2HG LYS 131 -11.281 -1.129 -7.820 1030 1HD LYS 41 1HD LYS 131 -9.027 0.677 -8.963 1031 2HD LYS 41 2HD LYS 131 -9.687 -0.706 -9.801 1032 1HE LYS 41 1HE LYS 131 -10.833 1.106 -10.768 1033 2HE LYS 41 2HE LYS 131 -12.029 0.360 -9.714 1034 1HZ LYS 41 1HZ LYS 131 -11.508 2.098 -8.062 1035 2HZ LYS 41 2HZ LYS 131 -10.414 2.774 -9.071 1036 H VAL 42 H VAL 132 -8.432 0.310 -3.535 1037 HA VAL 42 HA VAL 132 -9.812 2.108 -1.818 1038 HB VAL 42 HB VAL 132 -6.886 1.433 -2.296 1039 1HG1 VAL 42 1HG2 VAL 132 -8.472 2.142 0.197 1040 2HG1 VAL 42 2HG2 VAL 132 -6.734 1.677 0.166 1041 3HG1 VAL 42 3HG2 VAL 132 -7.253 3.189 -0.607 1042 1HG2 VAL 42 3HG1 VAL 132 -8.476 -0.746 -1.796 1043 2HG2 VAL 42 1HG1 VAL 132 -7.028 -0.487 -0.891 1044 3HG2 VAL 42 2HG1 VAL 132 -8.563 -0.065 -0.155 1045 H GLN 43 H GLN 133 -7.419 3.750 -2.042 1046 HA GLN 43 HA GLN 133 -6.484 5.050 -3.690 1047 1HB GLN 43 1HB GLN 133 -9.042 6.110 -4.697 1048 2HB GLN 43 2HB GLN 133 -7.579 7.091 -4.868 1049 1HG GLN 43 1HG GLN 133 -6.350 5.391 -5.981 1050 2HG GLN 43 2HG GLN 133 -7.529 4.155 -5.692 1051 1HE2 GLN 43 2HE2 GLN 133 -9.401 4.946 -8.653 1052 2HE2 GLN 43 1HE2 GLN 133 -9.191 3.905 -7.160 1053 H LEU 44 H LEU 134 -5.159 6.570 -3.508 1054 HA LEU 44 HA LEU 134 -5.470 8.597 -1.258 1055 1HB LEU 44 2HB LEU 134 -2.843 7.061 -1.750 1056 2HB LEU 44 1HB LEU 134 -3.225 8.194 -0.464 1057 HG LEU 44 HG LEU 134 -5.113 6.286 0.062 1058 1HD1 LEU 44 1HD1 LEU 134 -4.422 4.768 -1.864 1059 2HD1 LEU 44 2HD1 LEU 134 -2.824 4.578 -1.116 1060 3HD1 LEU 44 3HD1 LEU 134 -4.290 3.999 -0.281 1061 1HD2 LEU 44 2HD2 LEU 134 -3.354 7.104 1.682 1062 2HD2 LEU 44 3HD2 LEU 134 -3.552 5.344 1.786 1063 3HD2 LEU 44 1HD2 LEU 134 -2.149 6.033 0.933 1064 H ILE 45 H ILE 135 -5.228 10.580 -2.285 1065 HA ILE 45 HA ILE 135 -3.857 10.779 -4.908 1066 HB ILE 45 HB ILE 135 -5.969 11.945 -4.349 1067 1HG1 ILE 45 1HG1 ILE 135 -4.704 12.406 -6.415 1068 2HG1 ILE 45 2HG1 ILE 135 -5.792 13.652 -5.862 1069 1HG2 ILE 45 3HG2 ILE 135 -5.459 12.892 -2.166 1070 2HG2 ILE 45 1HG2 ILE 135 -4.211 13.955 -2.862 1071 3HG2 ILE 45 2HG2 ILE 135 -5.933 14.185 -3.301 1072 1HD1 ILE 45 3HD1 ILE 135 -3.828 15.044 -5.041 1073 2HD1 ILE 45 1HD1 ILE 135 -2.717 13.816 -5.700 1074 3HD1 ILE 45 2HD1 ILE 135 -3.797 14.704 -6.784 1075 H GLY 46 H GLY 136 -2.065 11.912 -5.312 1076 1HA GLY 46 1HA GLY 136 0.287 12.342 -5.069 1077 2HA GLY 46 2HA GLY 136 -0.106 12.972 -3.493 1078 H PHE 47 H PHE 137 -0.858 9.651 -3.473 1079 HA PHE 47 HA PHE 137 1.904 8.704 -2.715 1080 1HB PHE 47 2HB PHE 137 0.412 9.707 -0.829 1081 2HB PHE 47 1HB PHE 137 -0.669 8.352 -1.005 1082 HD1 PHE 47 HD2 PHE 137 2.833 9.305 -0.015 1083 HD2 PHE 47 HD1 PHE 137 0.010 6.062 -0.271 1084 HE1 PHE 47 HE2 PHE 137 4.426 7.775 1.101 1085 HE2 PHE 47 HE1 PHE 137 1.657 4.567 0.783 1086 HZ PHE 47 HZ PHE 137 3.928 5.417 1.314 1087 H GLY 48 H GLY 138 -1.450 7.588 -3.596 1088 1HA GLY 48 1HA GLY 138 -0.414 5.112 -4.643 1089 2HA GLY 48 2HA GLY 138 -0.991 4.779 -3.028 1090 H ASN 49 H ASN 139 -1.746 3.410 -5.092 1091 HA ASN 49 HA ASN 139 -4.758 3.715 -4.938 1092 1HB ASN 49 1HB ASN 139 -4.235 4.850 -7.065 1093 2HB ASN 49 2HB ASN 139 -3.238 3.524 -7.618 1094 1HD2 ASN 49 1HD2 ASN 139 -6.302 2.978 -9.502 1095 2HD2 ASN 49 2HD2 ASN 139 -4.769 3.984 -9.454 1096 H PHE 50 H PHE 140 -4.907 1.935 -3.666 1097 HA PHE 50 HA PHE 140 -3.396 -0.606 -4.316 1098 1HB PHE 50 2HB PHE 140 -5.574 -0.165 -2.255 1099 2HB PHE 50 1HB PHE 140 -4.851 -1.690 -2.471 1100 HD1 PHE 50 HD2 PHE 140 -4.479 1.730 -1.281 1101 HD2 PHE 50 HD1 PHE 140 -3.167 -2.324 -0.982 1102 HE1 PHE 50 HE2 PHE 140 -3.301 2.254 0.873 1103 HE2 PHE 50 HE1 PHE 140 -2.029 -1.784 1.153 1104 HZ PHE 50 HZ PHE 140 -2.031 0.545 1.958 1105 H GLU 51 H GLU 141 -4.373 -2.460 -4.952 1106 HA GLU 51 HA GLU 141 -7.142 -2.867 -4.985 1107 1HB GLU 51 1HB GLU 141 -7.790 -2.933 -7.437 1108 2HB GLU 51 2HB GLU 141 -7.285 -1.321 -7.035 1109 1HG GLU 51 1HG GLU 141 -5.521 -3.385 -8.511 1110 2HG GLU 51 2HG GLU 141 -6.521 -2.184 -9.300 1111 HE1 GLU 51 HE2 GLU 141 -4.462 0.537 -8.652 1112 H VAL 52 H VAL 142 -7.999 -4.921 -5.962 1113 HA VAL 52 HA VAL 142 -5.960 -6.928 -5.346 1114 HB VAL 52 HB VAL 142 -8.644 -6.269 -4.562 1115 1HG1 VAL 52 1HG2 VAL 142 -8.854 -8.578 -6.508 1116 2HG1 VAL 52 2HG2 VAL 142 -10.056 -8.102 -5.253 1117 3HG1 VAL 52 3HG2 VAL 142 -9.626 -6.986 -6.592 1118 1HG2 VAL 52 1HG1 VAL 142 -7.049 -8.798 -4.116 1119 2HG2 VAL 52 2HG1 VAL 142 -7.120 -7.308 -3.148 1120 3HG2 VAL 52 3HG1 VAL 142 -8.548 -8.336 -3.289 1121 NH1 ARG 53 NH2 ARG 143 -5.111 -4.598 -11.230 1122 NH2 ARG 53 NH1 ARG 143 -3.088 -4.240 -10.256 1123 H ARG 53 H ARG 143 -5.821 -8.923 -6.600 1124 HA ARG 53 HA ARG 143 -6.531 -8.628 -9.580 1125 1HB ARG 53 1HB ARG 143 -3.940 -8.175 -8.674 1126 2HB ARG 53 2HB ARG 143 -3.874 -9.903 -8.872 1127 1HG ARG 53 1HG ARG 143 -3.073 -9.075 -10.893 1128 2HG ARG 53 2HG ARG 143 -4.682 -9.658 -11.264 1129 1HD ARG 53 1HD ARG 143 -4.375 -7.527 -12.424 1130 2HD ARG 53 2HD ARG 143 -5.570 -7.264 -11.156 1131 1HH1 ARG 53 2HH2 ARG 143 -5.773 -5.274 -11.623 1132 2HH1 ARG 53 1HH2 ARG 143 -5.241 -3.583 -11.151 1133 1HH2 ARG 53 1HH1 ARG 143 -2.207 -4.639 -9.911 1134 2HH2 ARG 53 2HH1 ARG 143 -3.359 -3.250 -10.247 1135 H GLU 54 H GLU 144 -8.166 -10.062 -9.586 1136 HA GLU 54 HA GLU 144 -8.136 -12.653 -8.217 1137 1HB GLU 54 1HB GLU 144 -10.168 -11.377 -8.704 1138 2HB GLU 54 2HB GLU 144 -10.012 -11.633 -10.427 1139 1HG GLU 54 1HG GLU 144 -10.207 -13.994 -8.438 1140 2HG GLU 54 2HG GLU 144 -11.638 -13.104 -8.929 1141 HE2 GLU 54 HE2 GLU 144 -11.460 -16.062 -10.945 1142 NH1 ARG 55 NH2 ARG 145 -0.796 -18.680 -7.930 1143 NH2 ARG 55 NH1 ARG 145 -0.241 -19.614 -9.927 1144 H ARG 55 H ARG 145 -6.884 -14.279 -8.704 1145 HA ARG 55 HA ARG 145 -5.633 -14.735 -11.321 1146 1HB ARG 55 1HB ARG 145 -4.640 -15.175 -9.030 1147 2HB ARG 55 2HB ARG 145 -5.711 -16.547 -8.831 1148 1HG ARG 55 1HG ARG 145 -4.597 -17.718 -10.746 1149 2HG ARG 55 2HG ARG 145 -3.591 -16.294 -11.050 1150 1HD ARG 55 1HD ARG 145 -2.572 -16.527 -8.738 1151 2HD ARG 55 2HD ARG 145 -3.607 -17.931 -8.420 1152 1HH1 ARG 55 2HH2 ARG 145 -1.438 -18.074 -7.407 1153 2HH1 ARG 55 1HH2 ARG 145 0.024 -19.173 -7.559 1154 1HH2 ARG 55 1HH1 ARG 145 -0.458 -19.724 -10.924 1155 2HH2 ARG 55 2HH1 ARG 145 0.539 -20.043 -9.417 1156 H ALA 56 H ALA 146 -5.709 -16.895 -12.444 1157 HA ALA 56 HA ALA 146 -8.453 -17.227 -13.449 1158 1HB ALA 56 3HB ALA 146 -6.532 -17.095 -14.962 1159 2HB ALA 56 1HB ALA 146 -5.872 -18.627 -14.334 1160 3HB ALA 56 2HB ALA 146 -7.418 -18.609 -15.215 1161 H ALA 57 H ALA 147 -9.594 -18.216 -11.678 1162 HA ALA 57 HA ALA 147 -9.354 -21.137 -11.190 1163 1HB ALA 57 2HB ALA 147 -11.762 -19.228 -10.769 1164 2HB ALA 57 3HB ALA 147 -11.713 -20.930 -10.256 1165 3HB ALA 57 1HB ALA 147 -10.640 -19.789 -9.542 1166 NH1 ARG 58 NH2 ARG 148 -7.914 -22.854 -17.795 1167 NH2 ARG 58 NH1 ARG 148 -9.103 -24.506 -18.809 1168 H ARG 58 H ARG 148 -10.660 -22.873 -11.784 1169 HA ARG 58 HA ARG 148 -11.224 -22.642 -14.682 1170 1HB ARG 58 2HB ARG 148 -11.225 -25.222 -13.071 1171 2HB ARG 58 1HB ARG 148 -11.338 -25.103 -14.814 1172 1HG ARG 58 1HG ARG 148 -8.912 -24.377 -13.080 1173 2HG ARG 58 2HG ARG 148 -9.089 -25.794 -14.083 1174 1HD ARG 58 1HD ARG 148 -8.894 -22.885 -15.112 1175 2HD ARG 58 2HD ARG 148 -7.577 -24.055 -15.069 1176 1HH1 ARG 58 2HH2 ARG 148 -7.600 -22.430 -16.915 1177 2HH1 ARG 58 1HH2 ARG 148 -7.696 -22.532 -18.745 1178 1HH2 ARG 58 1HH1 ARG 148 -9.693 -25.339 -18.705 1179 2HH2 ARG 58 2HH1 ARG 148 -8.803 -24.071 -19.688 1180 H LYS 59 H LYS 149 -13.264 -24.609 -14.915 1181 HA LYS 59 HA LYS 149 -15.652 -23.364 -13.442 1182 1HB LYS 59 1HB LYS 149 -15.389 -23.551 -16.514 1183 2HB LYS 59 2HB LYS 149 -16.946 -23.441 -15.718 1184 1HG LYS 59 1HG LYS 149 -16.225 -21.295 -14.563 1185 2HG LYS 59 2HG LYS 149 -14.712 -21.344 -15.472 1186 1HD LYS 59 1HD LYS 149 -16.011 -21.267 -17.643 1187 2HD LYS 59 2HD LYS 149 -17.528 -21.227 -16.733 1188 1HE LYS 59 1HE LYS 149 -16.821 -19.044 -15.638 1189 2HE LYS 59 2HE LYS 149 -15.300 -19.079 -16.543 1190 1HZ LYS 59 1HZ LYS 149 -16.915 -17.706 -17.629 1191 2HZ LYS 59 2HZ LYS 149 -16.553 -18.976 -18.592 1192 H GLY 60 H GLY 150 -17.058 -24.694 -12.767 1193 1HA GLY 60 1HA GLY 150 -17.538 -27.445 -14.021 1194 2HA GLY 60 2HA GLY 150 -17.132 -27.360 -12.299 1195 NH1 ARG 61 NH2 ARG 151 -26.880 -27.559 -15.194 1196 NH2 ARG 61 NH1 ARG 151 -28.101 -26.382 -13.679 1197 H ARG 61 H ARG 151 -19.085 -27.836 -11.397 1198 HA ARG 61 HA ARG 151 -21.197 -25.824 -11.303 1199 1HB ARG 61 1HB ARG 151 -21.791 -26.892 -13.545 1200 2HB ARG 61 2HB ARG 151 -22.096 -28.413 -12.725 1201 1HG ARG 61 1HG ARG 151 -23.962 -27.290 -11.410 1202 2HG ARG 61 2HG ARG 151 -23.563 -25.744 -12.166 1203 1HD ARG 61 1HD ARG 151 -24.122 -26.713 -14.445 1204 2HD ARG 61 2HD ARG 151 -24.523 -28.264 -13.681 1205 1HH1 ARG 61 2HH2 ARG 151 -25.965 -27.939 -15.459 1206 2HH1 ARG 61 1HH2 ARG 151 -27.758 -27.649 -15.718 1207 1HH2 ARG 61 1HH1 ARG 151 -28.118 -25.865 -12.793 1208 2HH2 ARG 61 2HH1 ARG 151 -28.894 -26.552 -14.308 1209 H ASN 62 H ASN 152 -22.432 -26.073 -9.535 1210 HA ASN 62 HA ASN 152 -21.582 -27.976 -7.459 1211 1HB ASN 62 1HB ASN 152 -22.289 -25.561 -7.078 1212 2HB ASN 62 2HB ASN 152 -23.954 -26.024 -7.390 1213 1HD2 ASN 62 2HD2 ASN 152 -22.517 -26.646 -3.674 1214 2HD2 ASN 62 1HD2 ASN 152 -21.519 -25.871 -5.005 1215 HA PRO 63 HA PRO 153 -24.625 -31.163 -8.835 1216 1HB PRO 63 1HB PRO 153 -24.277 -33.097 -6.874 1217 2HB PRO 63 2HB PRO 153 -23.100 -32.732 -8.144 1218 1HG PRO 63 1HG PRO 153 -23.110 -31.692 -5.265 1219 2HG PRO 63 2HG PRO 153 -21.755 -32.430 -6.154 1220 1HD PRO 63 1HD PRO 153 -22.043 -29.689 -5.938 1221 2HD PRO 63 2HD PRO 153 -21.365 -30.422 -7.425 1222 H GLN 64 H GLN 154 -25.098 -29.708 -5.614 1223 HA GLN 64 HA GLN 154 -27.826 -30.986 -5.261 1224 1HB GLN 64 1HB GLN 154 -26.409 -28.913 -3.479 1225 2HB GLN 64 2HB GLN 154 -27.911 -29.720 -3.107 1226 1HG GLN 64 1HG GLN 154 -25.156 -31.101 -3.381 1227 2HG GLN 64 2HG GLN 154 -25.870 -30.461 -1.920 1228 1HE2 GLN 64 2HE2 GLN 154 -27.110 -34.154 -3.224 1229 2HE2 GLN 64 1HE2 GLN 154 -25.899 -33.128 -4.143 1230 H THR 65 H THR 155 -26.689 -27.717 -4.872 1231 HA THR 65 HA THR 155 -29.061 -26.321 -5.558 1232 HB THR 65 HB THR 155 -27.782 -24.243 -5.679 1233 HG1 THR 65 HG1 THR 155 -25.496 -25.895 -5.740 1234 1HG2 THR 65 1HG2 THR 155 -28.069 -25.277 -3.370 1235 2HG2 THR 65 2HG2 THR 155 -26.478 -26.055 -3.547 1236 3HG2 THR 65 3HG2 THR 155 -26.590 -24.283 -3.513 1237 H GLY 66 H GLY 156 -26.561 -27.154 -7.936 1238 1HA GLY 66 1HA GLY 156 -26.687 -27.095 -10.346 1239 2HA GLY 66 2HA GLY 156 -28.353 -26.549 -10.262 1240 H GLU 67 H GLU 157 -25.416 -25.095 -8.827 1241 HA GLU 67 HA GLU 157 -25.831 -22.521 -10.416 1242 1HB GLU 67 2HB GLU 157 -26.177 -22.554 -7.863 1243 2HB GLU 67 1HB GLU 157 -24.462 -22.936 -7.671 1244 1HG GLU 67 1HG GLU 157 -23.880 -20.750 -8.861 1245 2HG GLU 67 2HG GLU 157 -25.598 -20.399 -9.031 1246 HE1 GLU 67 HE2 GLU 157 -23.676 -19.999 -5.489 1247 H GLU 68 H GLU 158 -24.141 -21.785 -11.515 1248 HA GLU 68 HA GLU 158 -22.033 -23.595 -12.321 1249 1HB GLU 68 1HB GLU 158 -22.979 -22.007 -13.900 1250 2HB GLU 68 2HB GLU 158 -22.530 -20.620 -12.927 1251 1HG GLU 68 1HG GLU 158 -21.136 -20.773 -14.924 1252 2HG GLU 68 2HG GLU 158 -20.166 -20.863 -13.464 1253 HE1 GLU 68 HE2 GLU 158 -20.592 -24.201 -15.767 1254 H MET 69 H MET 159 -20.223 -24.041 -11.393 1255 HA MET 69 HA MET 159 -19.152 -22.445 -9.063 1256 1HB MET 69 1HB MET 159 -19.676 -24.889 -8.894 1257 2HB MET 69 2HB MET 159 -18.463 -25.243 -10.129 1258 1HG MET 69 1HG MET 159 -16.646 -24.489 -8.559 1259 2HG MET 69 2HG MET 159 -17.871 -24.051 -7.354 1260 1HE MET 69 1HE MET 159 -16.454 -26.745 -9.689 1261 2HE MET 69 3HE MET 159 -16.395 -28.208 -8.665 1262 3HE MET 69 2HE MET 159 -17.876 -27.813 -9.586 1263 H GLU 70 H GLU 160 -17.096 -21.796 -8.860 1264 HA GLU 70 HA GLU 160 -15.252 -21.667 -11.249 1265 1HB GLU 70 2HB GLU 160 -16.492 -19.535 -9.833 1266 2HB GLU 70 1HB GLU 160 -15.009 -19.693 -8.965 1267 1HG GLU 70 1HG GLU 160 -13.904 -19.532 -11.433 1268 2HG GLU 70 2HG GLU 160 -15.535 -19.246 -12.016 1269 HE1 GLU 70 HE2 GLU 160 -13.523 -16.436 -9.864 1270 H ILE 71 H ILE 161 -13.545 -22.998 -10.927 1271 HA ILE 71 HA ILE 161 -13.017 -24.243 -8.351 1272 HB ILE 71 HB ILE 161 -11.839 -24.764 -11.069 1273 1HG1 ILE 71 1HG1 ILE 161 -14.319 -26.078 -9.830 1274 2HG1 ILE 71 2HG1 ILE 161 -14.370 -24.939 -11.156 1275 1HG2 ILE 71 2HG2 ILE 161 -10.928 -25.809 -8.691 1276 2HG2 ILE 71 3HG2 ILE 161 -12.257 -26.921 -8.981 1277 3HG2 ILE 71 1HG2 ILE 161 -10.976 -26.723 -10.228 1278 1HD1 ILE 71 2HD1 ILE 161 -13.047 -27.707 -11.354 1279 2HD1 ILE 71 3HD1 ILE 161 -14.617 -27.214 -12.020 1280 3HD1 ILE 71 1HD1 ILE 161 -13.126 -26.492 -12.660 1281 HA PRO 72 HA PRO 162 -8.915 -22.551 -7.397 1282 1HB PRO 72 1HB PRO 162 -6.847 -21.838 -9.187 1283 2HB PRO 72 2HB PRO 162 -7.072 -23.324 -8.264 1284 1HG PRO 72 1HG PRO 162 -7.906 -22.713 -11.119 1285 2HG PRO 72 2HG PRO 162 -7.256 -24.219 -10.453 1286 1HD PRO 72 1HD PRO 162 -9.924 -24.004 -10.915 1287 2HD PRO 72 2HD PRO 162 -9.303 -24.840 -9.480 1288 H ALA 73 H ALA 163 -8.106 -20.212 -9.283 1289 HA ALA 73 HA ALA 163 -7.414 -18.000 -8.817 1290 1HB ALA 73 2HB ALA 163 -9.761 -17.820 -9.483 1291 2HB ALA 73 3HB ALA 163 -10.293 -17.979 -7.764 1292 3HB ALA 73 1HB ALA 163 -9.373 -16.551 -8.312 1293 H SER 74 H SER 164 -7.336 -16.216 -7.606 1294 HA SER 74 HA SER 164 -8.270 -15.986 -5.058 1295 1HB SER 74 1HB SER 164 -6.301 -17.414 -4.186 1296 2HB SER 74 2HB SER 164 -5.147 -16.260 -4.868 1297 HG SER 74 HG SER 164 -6.057 -14.689 -3.466 1298 H LYS 75 H LYS 165 -8.194 -13.923 -4.256 1299 HA LYS 75 HA LYS 165 -7.532 -11.775 -6.289 1300 1HB LYS 75 2HB LYS 165 -8.587 -10.784 -3.709 1301 2HB LYS 75 1HB LYS 165 -8.825 -10.289 -5.360 1302 1HG LYS 75 1HG LYS 165 -10.438 -12.188 -5.730 1303 2HG LYS 75 2HG LYS 165 -10.166 -12.738 -4.073 1304 1HD LYS 75 1HD LYS 165 -11.034 -10.511 -3.198 1305 2HD LYS 75 2HD LYS 165 -11.375 -10.012 -4.859 1306 1HE LYS 75 1HE LYS 165 -12.968 -11.969 -5.132 1307 2HE LYS 75 2HE LYS 165 -12.616 -12.493 -3.479 1308 1HZ LYS 75 1HZ LYS 165 -14.613 -11.212 -3.544 1309 2HZ LYS 75 2HZ LYS 165 -13.495 -10.403 -2.668 1310 H VAL 76 H VAL 166 -5.424 -10.850 -6.269 1311 HA VAL 76 HA VAL 166 -3.792 -11.229 -3.903 1312 HB VAL 76 HB VAL 166 -3.812 -11.686 -6.751 1313 1HG1 VAL 76 3HG2 VAL 166 -2.852 -9.511 -7.096 1314 2HG1 VAL 76 1HG2 VAL 166 -1.481 -9.955 -6.054 1315 3HG1 VAL 76 2HG2 VAL 166 -1.836 -10.865 -7.605 1316 1HG2 VAL 76 1HG1 VAL 166 -3.165 -13.261 -5.118 1317 2HG2 VAL 76 2HG1 VAL 166 -1.943 -13.017 -6.392 1318 3HG2 VAL 76 3HG1 VAL 166 -1.684 -12.295 -4.753 1319 HA PRO 77 HA PRO 167 -4.359 -6.693 -3.551 1320 1HB PRO 77 1HB PRO 167 -3.325 -6.334 -0.987 1321 2HB PRO 77 2HB PRO 167 -4.815 -7.257 -1.262 1322 1HG PRO 77 1HG PRO 167 -1.973 -8.357 -0.939 1323 2HG PRO 77 2HG PRO 167 -3.419 -8.869 -0.067 1324 1HD PRO 77 1HD PRO 167 -2.419 -10.164 -2.443 1325 2HD PRO 77 2HD PRO 167 -4.165 -10.166 -2.077 1326 H ALA 78 H ALA 168 -3.421 -5.198 -4.240 1327 HA ALA 78 HA ALA 168 -0.373 -4.919 -4.397 1328 1HB ALA 78 3HB ALA 168 -1.651 -5.728 -6.471 1329 2HB ALA 78 1HB ALA 168 -2.559 -4.198 -6.473 1330 3HB ALA 78 2HB ALA 168 -0.796 -4.187 -6.721 1331 H PHE 79 H PHE 169 0.225 -2.773 -4.930 1332 HA PHE 79 HA PHE 169 -1.327 -0.406 -3.708 1333 1HB PHE 79 2HB PHE 169 -0.522 -0.974 -1.771 1334 2HB PHE 79 1HB PHE 169 1.070 -1.466 -2.427 1335 HD1 PHE 79 HD2 PHE 169 -0.986 1.537 -1.523 1336 HD2 PHE 79 HD1 PHE 169 2.877 0.130 -2.791 1337 HE1 PHE 79 HE2 PHE 169 -0.045 3.785 -1.202 1338 HE2 PHE 79 HE1 PHE 169 3.785 2.395 -2.524 1339 HZ PHE 79 HZ PHE 169 2.328 4.230 -1.773 1340 H LYS 80 H LYS 170 -0.984 0.920 -5.176 1341 HA LYS 80 HA LYS 170 1.307 1.203 -7.315 1342 1HB LYS 80 2HB LYS 170 -1.304 2.715 -7.021 1343 2HB LYS 80 1HB LYS 170 -0.076 3.101 -8.192 1344 1HG LYS 80 1HG LYS 170 -1.617 0.427 -8.085 1345 2HG LYS 80 2HG LYS 170 -2.037 1.801 -9.092 1346 1HD LYS 80 1HD LYS 170 0.171 1.611 -10.307 1347 2HD LYS 80 2HD LYS 170 0.608 0.225 -9.300 1348 1HE LYS 80 1HE LYS 170 -1.415 -1.052 -10.164 1349 2HE LYS 80 2HE LYS 170 -1.852 0.329 -11.181 1350 1HZ LYS 80 1HZ LYS 170 -0.622 -1.285 -12.423 1351 2HZ LYS 80 2HZ LYS 170 0.248 0.097 -12.337 1352 HA PRO 81 HA PRO 171 2.828 4.527 -4.561 1353 1HB PRO 81 1HB PRO 171 4.980 5.387 -6.055 1354 2HB PRO 81 2HB PRO 171 4.934 3.762 -5.360 1355 1HG PRO 81 1HG PRO 171 4.234 4.575 -8.231 1356 2HG PRO 81 2HG PRO 171 5.369 3.305 -7.709 1357 1HD PRO 81 1HD PRO 171 2.686 2.807 -8.368 1358 2HD PRO 81 2HD PRO 171 3.586 1.801 -7.188 1359 H GLY 82 H GLY 172 0.470 5.043 -6.121 1360 1HA GLY 82 1HA GLY 172 -0.719 6.518 -7.636 1361 2HA GLY 82 2HA GLY 172 -0.117 7.619 -6.412 1362 H LYS 83 H LYS 173 2.247 6.307 -8.477 1363 HA LYS 83 HA LYS 173 3.733 7.269 -10.096 1364 1HB LYS 83 2HB LYS 173 1.271 8.786 -10.823 1365 2HB LYS 83 1HB LYS 173 2.647 9.783 -11.035 1366 1HG LYS 83 1HG LYS 173 2.313 6.958 -12.270 1367 2HG LYS 83 2HG LYS 173 1.942 8.464 -13.101 1368 1HD LYS 83 1HD LYS 173 4.345 9.194 -12.948 1369 2HD LYS 83 2HD LYS 173 4.761 7.718 -12.076 1370 1HE LYS 83 1HE LYS 173 4.035 6.322 -14.073 1371 2HE LYS 83 2HE LYS 173 3.645 7.805 -14.960 1372 1HZ LYS 83 1HZ LYS 173 6.328 7.119 -13.887 1373 2HZ LYS 83 2HZ LYS 173 5.969 8.481 -14.716 1374 H ALA 84 H ALA 174 2.220 9.504 -8.151 1375 HA ALA 84 HA ALA 174 4.040 11.732 -7.832 1376 1HB ALA 84 2HB ALA 174 1.602 11.635 -7.266 1377 2HB ALA 84 3HB ALA 174 1.912 10.396 -6.021 1378 3HB ALA 84 1HB ALA 174 2.542 12.051 -5.794 1379 H LEU 85 H LEU 175 3.644 8.780 -5.684 1380 HA LEU 85 HA LEU 175 5.902 9.454 -3.946 1381 1HB LEU 85 2HB LEU 175 4.124 7.948 -3.112 1382 2HB LEU 85 1HB LEU 175 4.420 6.830 -4.428 1383 HG LEU 85 HG LEU 175 6.792 6.728 -3.619 1384 1HD1 LEU 85 1HD1 LEU 175 6.851 8.584 -1.982 1385 2HD1 LEU 85 2HD1 LEU 175 5.616 7.770 -0.998 1386 3HD1 LEU 85 3HD1 LEU 175 7.242 7.056 -1.167 1387 1HD2 LEU 85 1HD2 LEU 175 5.074 4.838 -3.369 1388 2HD2 LEU 85 2HD2 LEU 175 6.251 4.821 -2.063 1389 3HD2 LEU 85 3HD2 LEU 175 4.616 5.476 -1.777 1390 H LYS 86 H LYS 176 5.512 7.642 -6.957 1391 HA LYS 86 HA LYS 176 8.254 6.659 -7.196 1392 1HB LYS 86 1HB LYS 176 6.140 6.053 -8.681 1393 2HB LYS 86 2HB LYS 176 6.638 7.400 -9.687 1394 1HG LYS 86 1HG LYS 176 8.944 6.265 -9.912 1395 2HG LYS 86 2HG LYS 176 8.300 4.886 -9.032 1396 1HD LYS 86 1HD LYS 176 7.225 5.996 -11.712 1397 2HD LYS 86 2HD LYS 176 8.311 4.623 -11.537 1398 1HE LYS 86 1HE LYS 176 6.515 3.356 -10.241 1399 2HE LYS 86 2HE LYS 176 5.409 4.720 -10.461 1400 1HZ LYS 86 1HZ LYS 176 5.086 3.014 -12.116 1401 2HZ LYS 86 2HZ LYS 176 6.631 3.124 -12.638 1402 H ASP 87 H ASP 177 7.067 9.941 -7.626 1403 HA ASP 87 HA ASP 177 9.611 10.937 -8.852 1404 1HB ASP 87 1HB ASP 177 6.830 11.773 -8.680 1405 2HB ASP 87 2HB ASP 177 7.631 12.835 -7.603 1406 HD1 ASP 87 HD2 ASP 177 9.230 14.099 -8.396 1407 H ALA 88 H ALA 178 7.973 10.977 -5.632 1408 HA ALA 88 HA ALA 178 9.820 12.497 -4.003 1409 1HB ALA 88 3HB ALA 178 7.598 11.415 -3.152 1410 2HB ALA 88 1HB ALA 178 8.388 9.839 -3.200 1411 3HB ALA 88 2HB ALA 178 8.990 11.038 -2.089 1412 H VAL 89 H VAL 179 9.836 9.026 -4.828 1413 HA VAL 89 HA VAL 179 12.226 8.367 -3.274 1414 HB VAL 89 HB VAL 179 9.682 7.438 -3.548 1415 1HG1 VAL 89 3HG2 VAL 179 9.993 7.283 -6.124 1416 2HG1 VAL 89 1HG2 VAL 179 10.898 5.797 -5.815 1417 3HG1 VAL 89 2HG2 VAL 179 9.203 5.967 -5.250 1418 1HG2 VAL 89 1HG1 VAL 179 11.217 6.480 -2.137 1419 2HG2 VAL 89 2HG1 VAL 179 10.212 5.294 -3.007 1420 3HG2 VAL 89 3HG1 VAL 179 11.944 5.518 -3.493 1421 H LYS 90 H LYS 180 11.917 9.457 -6.457 1422 HA LYS 90 HA LYS 180 13.502 7.663 -8.022 1423 1HB LYS 90 1HB LYS 180 11.818 9.695 -8.535 1424 2HB LYS 90 2HB LYS 180 13.231 10.710 -8.506 1425 1HG LYS 90 1HG LYS 180 14.167 9.499 -10.471 1426 2HG LYS 90 2HG LYS 180 12.942 8.231 -10.327 1427 1HD LYS 90 1HD LYS 180 11.101 9.961 -10.726 1428 2HD LYS 90 2HD LYS 180 12.329 11.202 -10.900 1429 1HE LYS 90 1HE LYS 180 11.570 10.581 -13.089 1430 2HE LYS 90 2HE LYS 180 13.246 10.040 -12.935 1431 1HZ LYS 90 1HZ LYS 180 12.421 7.797 -12.527 1432 2HZ LYS 90 2HZ LYS 180 11.891 8.363 -13.966 Start of MODEL 9 Raw file had 1432 H/Q atoms Start of MODEL 9 1 1H MET 1 1H MET 1 -12.818 6.355 -1.046 2 2H MET 1 2H MET 1 -12.920 7.333 -2.351 3 HA MET 1 HA MET 1 -12.708 8.614 -0.413 4 1HB MET 1 1HB MET 1 -10.130 6.995 0.106 5 2HB MET 1 2HB MET 1 -10.519 8.480 0.925 6 1HG MET 1 1HG MET 1 -11.337 7.063 2.507 7 2HG MET 1 2HG MET 1 -12.822 7.257 1.586 8 1HE MET 1 3HE MET 1 -9.589 4.997 2.157 9 2HE MET 1 2HE MET 1 -10.830 4.709 3.391 10 3HE MET 1 1HE MET 1 -10.417 3.414 2.238 11 H ASN 2 H ASN 2 -9.494 9.221 -0.654 12 HA ASN 2 HA ASN 2 -8.779 10.384 -2.882 13 1HB ASN 2 1HB ASN 2 -9.286 12.643 -3.313 14 2HB ASN 2 2HB ASN 2 -10.752 11.728 -3.272 15 1HD2 ASN 2 1HD2 ASN 2 -10.385 14.840 -0.673 16 2HD2 ASN 2 2HD2 ASN 2 -8.951 14.142 -1.584 17 H LYS 3 H LYS 3 -9.086 11.188 0.396 18 HA LYS 3 HA LYS 3 -6.843 11.063 1.734 19 1HB LYS 3 1HB LYS 3 -5.374 12.087 -0.042 20 2HB LYS 3 2HB LYS 3 -6.183 13.627 0.121 21 1HG LYS 3 1HG LYS 3 -5.268 13.970 2.352 22 2HG LYS 3 2HG LYS 3 -4.859 12.281 2.570 23 1HD LYS 3 1HD LYS 3 -3.435 14.081 0.509 24 2HD LYS 3 2HD LYS 3 -2.941 13.942 2.193 25 1HE LYS 3 1HE LYS 3 -2.649 11.412 1.901 26 2HE LYS 3 2HE LYS 3 -3.024 11.597 0.184 27 1HZ LYS 3 1HZ LYS 3 -0.662 11.594 0.604 28 2HZ LYS 3 2HZ LYS 3 -0.764 12.870 1.621 29 H THR 4 H THR 4 -9.520 13.460 0.954 30 HA THR 4 HA THR 4 -9.433 14.485 3.659 31 HB THR 4 HB THR 4 -11.135 14.893 1.105 32 HG1 THR 4 HG1 THR 4 -8.967 15.672 1.022 33 1HG2 THR 4 3HG2 THR 4 -11.050 16.306 3.787 34 2HG2 THR 4 1HG2 THR 4 -11.881 16.931 2.286 35 3HG2 THR 4 2HG2 THR 4 -12.415 15.386 3.055 36 H GLU 5 H GLU 5 -11.159 12.111 1.691 37 HA GLU 5 HA GLU 5 -13.342 11.590 3.679 38 1HB GLU 5 1HB GLU 5 -12.352 9.681 1.526 39 2HB GLU 5 2HB GLU 5 -13.851 9.534 2.417 40 1HG GLU 5 1HG GLU 5 -13.138 11.612 0.269 41 2HG GLU 5 2HG GLU 5 -14.189 10.238 0.072 42 HE2 GLU 5 HE2 GLU 5 -15.522 13.669 1.704 43 H LEU 6 H LEU 6 -10.017 11.000 3.445 44 HA LEU 6 HA LEU 6 -9.598 8.546 5.012 45 1HB LEU 6 2HB LEU 6 -8.162 10.411 3.217 46 2HB LEU 6 1HB LEU 6 -7.432 10.675 4.768 47 HG LEU 6 HG LEU 6 -7.146 8.126 4.773 48 1HD1 LEU 6 2HD1 LEU 6 -8.136 8.243 1.899 49 2HD1 LEU 6 3HD1 LEU 6 -7.258 6.847 2.594 50 3HD1 LEU 6 1HD1 LEU 6 -8.839 7.318 3.236 51 1HD2 LEU 6 1HD2 LEU 6 -5.314 9.697 4.188 52 2HD2 LEU 6 2HD2 LEU 6 -5.137 8.070 3.526 53 3HD2 LEU 6 3HD2 LEU 6 -5.657 9.409 2.467 54 H ILE 7 H ILE 7 -9.393 12.117 5.443 55 HA ILE 7 HA ILE 7 -8.726 12.218 8.253 56 HB ILE 7 HB ILE 7 -10.364 14.310 6.680 57 1HG1 ILE 7 1HG1 ILE 7 -7.315 14.262 6.978 58 2HG1 ILE 7 2HG1 ILE 7 -8.097 13.609 5.592 59 1HG2 ILE 7 2HG2 ILE 7 -10.342 14.753 9.175 60 2HG2 ILE 7 3HG2 ILE 7 -8.576 14.746 9.136 61 3HG2 ILE 7 1HG2 ILE 7 -9.475 16.007 8.280 62 1HD1 ILE 7 3HD1 ILE 7 -9.210 15.890 5.160 63 2HD1 ILE 7 1HD1 ILE 7 -8.012 16.546 6.274 64 3HD1 ILE 7 2HD1 ILE 7 -7.473 15.670 4.817 65 H ASN 8 H ASN 8 -11.913 12.387 6.663 66 HA ASN 8 HA ASN 8 -13.423 12.336 9.206 67 1HB ASN 8 1HB ASN 8 -14.443 11.489 6.388 68 2HB ASN 8 2HB ASN 8 -15.468 11.777 7.774 69 1HD2 ASN 8 2HD2 ASN 8 -14.543 14.975 5.498 70 2HD2 ASN 8 1HD2 ASN 8 -14.081 13.253 5.069 71 H ALA 9 H ALA 9 -11.905 9.718 7.534 72 HA ALA 9 HA ALA 9 -13.513 7.516 8.800 73 1HB ALA 9 2HB ALA 9 -11.892 7.099 6.729 74 2HB ALA 9 3HB ALA 9 -10.535 7.479 7.797 75 3HB ALA 9 1HB ALA 9 -11.489 6.079 8.164 76 H VAL 10 H VAL 10 -10.421 9.244 9.436 77 HA VAL 10 HA VAL 10 -9.733 7.635 11.663 78 HB VAL 10 HB VAL 10 -8.398 10.279 11.444 79 1HG1 VAL 10 3HG2 VAL 10 -7.835 8.193 12.956 80 2HG1 VAL 10 1HG2 VAL 10 -7.078 7.580 11.461 81 3HG1 VAL 10 2HG2 VAL 10 -6.536 9.136 12.142 82 1HG2 VAL 10 1HG1 VAL 10 -8.358 8.151 9.263 83 2HG2 VAL 10 2HG1 VAL 10 -8.627 9.922 9.203 84 3HG2 VAL 10 3HG1 VAL 10 -6.972 9.294 9.507 85 H ALA 11 H ALA 11 -10.819 10.768 11.363 86 HA ALA 11 HA ALA 11 -11.160 11.058 14.155 87 1HB ALA 11 2HB ALA 11 -10.912 13.072 12.658 88 2HB ALA 11 3HB ALA 11 -12.501 12.744 11.920 89 3HB ALA 11 1HB ALA 11 -12.389 13.271 13.631 90 H GLU 12 H GLU 12 -13.320 9.559 11.893 91 HA GLU 12 HA GLU 12 -15.619 9.556 13.826 92 1HB GLU 12 1HB GLU 12 -16.073 9.546 11.349 93 2HB GLU 12 2HB GLU 12 -15.273 7.991 11.200 94 1HG GLU 12 1HG GLU 12 -17.658 7.637 11.148 95 2HG GLU 12 2HG GLU 12 -17.063 6.924 12.633 96 HE2 GLU 12 HE2 GLU 12 -18.949 8.915 14.711 97 H THR 13 H THR 13 -13.194 7.119 12.653 98 HA THR 13 HA THR 13 -14.077 5.172 14.653 99 HB THR 13 HB THR 13 -11.968 3.849 14.067 100 HG1 THR 13 HG1 THR 13 -11.410 6.174 12.572 101 1HG2 THR 13 2HG2 THR 13 -13.209 4.931 11.477 102 2HG2 THR 13 3HG2 THR 13 -12.126 3.536 11.641 103 3HG2 THR 13 1HG2 THR 13 -13.742 3.490 12.388 104 H SER 14 H SER 14 -12.292 7.664 15.239 105 HA SER 14 HA SER 14 -11.120 6.479 17.852 106 1HB SER 14 1HB SER 14 -9.306 6.661 16.089 107 2HB SER 14 2HB SER 14 -9.517 8.413 16.070 108 HG SER 14 HG SER 14 -7.876 7.724 17.457 109 H GLY 15 H GLY 15 -12.494 9.442 16.415 110 1HA GLY 15 1HA GLY 15 -13.188 11.463 17.449 111 2HA GLY 15 2HA GLY 15 -13.188 10.620 18.996 112 H LEU 16 H LEU 16 -10.705 11.548 16.684 113 HA LEU 16 HA LEU 16 -9.050 13.101 18.676 114 1HB LEU 16 1HB LEU 16 -7.232 12.967 17.124 115 2HB LEU 16 2HB LEU 16 -7.725 11.473 17.890 116 HG LEU 16 HG LEU 16 -8.757 10.641 16.027 117 1HD1 LEU 16 2HD1 LEU 16 -9.849 12.737 15.106 118 2HD1 LEU 16 3HD1 LEU 16 -8.227 13.155 14.467 119 3HD1 LEU 16 1HD1 LEU 16 -9.128 11.683 13.887 120 1HD2 LEU 16 2HD2 LEU 16 -6.754 9.842 15.867 121 2HD2 LEU 16 3HD2 LEU 16 -7.670 9.967 14.345 122 3HD2 LEU 16 1HD2 LEU 16 -6.368 11.099 14.641 123 H SER 17 H SER 17 -8.510 14.312 16.027 124 HA SER 17 HA SER 17 -10.684 16.466 15.908 125 1HB SER 17 1HB SER 17 -7.754 17.299 15.753 126 2HB SER 17 2HB SER 17 -9.170 18.314 15.626 127 HG SER 17 HG SER 17 -8.464 16.782 17.899 128 H LYS 18 H LYS 18 -10.772 17.571 13.886 129 HA LYS 18 HA LYS 18 -10.275 15.840 11.465 130 1HB LYS 18 1HB LYS 18 -11.272 18.746 11.559 131 2HB LYS 18 2HB LYS 18 -11.116 17.790 10.099 132 1HG LYS 18 1HG LYS 18 -12.975 17.076 12.453 133 2HG LYS 18 2HG LYS 18 -13.464 17.955 11.017 134 1HD LYS 18 1HD LYS 18 -13.001 15.988 9.551 135 2HD LYS 18 2HD LYS 18 -12.310 15.099 10.895 136 1HE LYS 18 1HE LYS 18 -14.513 14.218 10.561 137 2HE LYS 18 2HE LYS 18 -14.527 15.080 12.096 138 1HZ LYS 18 1HZ LYS 18 -15.606 16.940 10.990 139 2HZ LYS 18 2HZ LYS 18 -16.477 15.568 10.811 140 H LYS 19 H LYS 19 -8.853 18.799 12.786 141 HA LYS 19 HA LYS 19 -6.561 18.953 10.938 142 1HB LYS 19 2HB LYS 19 -7.345 20.837 12.428 143 2HB LYS 19 1HB LYS 19 -6.760 19.970 13.854 144 1HG LYS 19 1HG LYS 19 -4.405 20.087 12.921 145 2HG LYS 19 2HG LYS 19 -5.011 20.915 11.484 146 1HD LYS 19 1HD LYS 19 -5.858 22.810 12.943 147 2HD LYS 19 2HD LYS 19 -5.253 21.974 14.378 148 1HE LYS 19 1HE LYS 19 -2.885 22.109 13.468 149 2HE LYS 19 2HE LYS 19 -3.484 22.934 12.021 150 1HZ LYS 19 1HZ LYS 19 -3.704 23.930 14.808 151 2HZ LYS 19 2HZ LYS 19 -2.656 24.470 13.676 152 H ASP 20 H ASP 20 -7.029 17.055 14.027 153 HA ASP 20 HA ASP 20 -4.188 16.053 13.954 154 1HB ASP 20 1HB ASP 20 -6.608 15.299 15.689 155 2HB ASP 20 2HB ASP 20 -5.247 14.217 15.620 156 HD2 ASP 20 HD2 ASP 20 -4.990 17.597 17.723 157 H ALA 21 H ALA 21 -7.211 14.929 12.572 158 HA ALA 21 HA ALA 21 -6.183 12.251 11.765 159 1HB ALA 21 2HB ALA 21 -8.757 13.807 11.109 160 2HB ALA 21 3HB ALA 21 -8.351 12.215 10.398 161 3HB ALA 21 1HB ALA 21 -8.525 12.400 12.116 162 H THR 22 H THR 22 -6.508 15.438 10.077 163 HA THR 22 HA THR 22 -5.410 14.643 7.523 164 HB THR 22 HB THR 22 -4.951 17.403 8.845 165 HG1 THR 22 HG1 THR 22 -7.094 16.796 9.190 166 1HG2 THR 22 3HG2 THR 22 -5.611 16.468 5.988 167 2HG2 THR 22 1HG2 THR 22 -5.489 18.177 6.500 168 3HG2 THR 22 2HG2 THR 22 -4.044 17.104 6.555 169 H LYS 23 H LYS 23 -3.803 15.921 10.343 170 HA LYS 23 HA LYS 23 -1.016 15.712 9.458 171 1HB LYS 23 2HB LYS 23 -2.413 15.400 12.239 172 2HB LYS 23 1HB LYS 23 -0.688 15.338 12.127 173 1HG LYS 23 1HG LYS 23 -0.533 17.681 11.255 174 2HG LYS 23 2HG LYS 23 -2.291 17.827 11.247 175 1HD LYS 23 1HD LYS 23 -2.357 17.474 13.742 176 2HD LYS 23 2HD LYS 23 -0.602 17.280 13.779 177 1HE LYS 23 1HE LYS 23 -0.294 19.644 12.952 178 2HE LYS 23 2HE LYS 23 -2.047 19.850 12.835 179 1HZ LYS 23 1HZ LYS 23 -2.189 19.429 15.229 180 2HZ LYS 23 2HZ LYS 23 -0.568 19.244 15.337 181 H ALA 24 H ALA 24 -2.891 13.505 11.424 182 HA ALA 24 HA ALA 24 -1.020 11.412 11.808 183 1HB ALA 24 2HB ALA 24 -2.966 11.691 13.135 184 2HB ALA 24 3HB ALA 24 -4.051 11.343 11.748 185 3HB ALA 24 1HB ALA 24 -2.998 10.054 12.431 186 H VAL 25 H VAL 25 -3.294 11.725 9.115 187 HA VAL 25 HA VAL 25 -2.473 9.303 7.584 188 HB VAL 25 HB VAL 25 -3.826 12.130 7.187 189 1HG1 VAL 25 1HG2 VAL 25 -3.111 10.389 4.767 190 2HG1 VAL 25 2HG2 VAL 25 -4.245 11.788 4.775 191 3HG1 VAL 25 3HG2 VAL 25 -2.540 12.029 5.115 192 1HG2 VAL 25 3HG1 VAL 25 -5.196 10.278 8.083 193 2HG2 VAL 25 1HG1 VAL 25 -5.810 10.895 6.545 194 3HG2 VAL 25 2HG1 VAL 25 -4.928 9.329 6.595 195 H ASP 26 H ASP 26 -1.439 12.751 7.217 196 HA ASP 26 HA ASP 26 1.121 11.909 5.823 197 1HB ASP 26 1HB ASP 26 0.184 14.622 6.942 198 2HB ASP 26 2HB ASP 26 1.679 14.395 6.044 199 HD2 ASP 26 HD2 ASP 26 -1.788 14.783 4.107 200 H ALA 27 H ALA 27 0.525 11.189 8.551 201 HA ALA 27 HA ALA 27 3.236 11.532 9.891 202 1HB ALA 27 1HB ALA 27 0.950 12.199 11.146 203 2HB ALA 27 2HB ALA 27 0.858 10.459 11.386 204 3HB ALA 27 3HB ALA 27 2.216 11.414 12.004 205 H VAL 28 H VAL 28 0.800 9.084 9.212 206 HA VAL 28 HA VAL 28 2.537 6.670 9.504 207 HB VAL 28 HB VAL 28 -0.038 7.186 7.803 208 1HG1 VAL 28 2HG2 VAL 28 1.327 4.523 8.533 209 2HG1 VAL 28 3HG2 VAL 28 -0.342 4.684 7.930 210 3HG1 VAL 28 1HG2 VAL 28 0.981 5.201 6.895 211 1HG2 VAL 28 3HG1 VAL 28 -0.421 7.404 10.210 212 2HG2 VAL 28 1HG1 VAL 28 -1.290 6.058 9.414 213 3HG2 VAL 28 2HG1 VAL 28 0.191 5.719 10.426 214 H PHE 29 H PHE 29 1.202 8.434 6.905 215 HA PHE 29 HA PHE 29 2.982 7.377 4.706 216 1HB PHE 29 2HB PHE 29 0.943 9.651 4.460 217 2HB PHE 29 1HB PHE 29 1.636 8.785 3.119 218 HD1 PHE 29 HD2 PHE 29 1.433 5.910 3.740 219 HD2 PHE 29 HD1 PHE 29 -1.317 9.078 4.674 220 HE1 PHE 29 HE2 PHE 29 -0.291 4.259 4.279 221 HE2 PHE 29 HE1 PHE 29 -3.004 7.426 5.291 222 HZ PHE 29 HZ PHE 29 -2.448 5.016 5.198 223 H ASP 30 H ASP 30 3.936 9.432 6.924 224 HA ASP 30 HA ASP 30 5.891 10.727 4.992 225 1HB ASP 30 1HB ASP 30 4.609 12.033 6.920 226 2HB ASP 30 2HB ASP 30 5.709 11.283 8.046 227 HD1 ASP 30 HD2 ASP 30 8.464 13.203 7.243 228 H SER 31 H SER 31 5.895 8.814 7.925 229 HA SER 31 HA SER 31 8.820 8.155 7.836 230 1HB SER 31 1HB SER 31 6.622 6.588 9.273 231 2HB SER 31 2HB SER 31 8.359 6.377 9.502 232 HG SER 31 HG SER 31 7.475 7.738 11.063 233 H ILE 32 H ILE 32 5.901 6.457 6.335 234 HA ILE 32 HA ILE 32 7.267 4.184 5.340 235 HB ILE 32 HB ILE 32 4.836 5.552 4.233 236 1HG1 ILE 32 1HG1 ILE 32 5.214 3.452 6.410 237 2HG1 ILE 32 2HG1 ILE 32 4.773 5.096 6.664 238 1HG2 ILE 32 3HG2 ILE 32 6.110 2.751 3.891 239 2HG2 ILE 32 1HG2 ILE 32 4.437 3.097 3.436 240 3HG2 ILE 32 2HG2 ILE 32 5.801 3.940 2.650 241 1HD1 ILE 32 1HD1 ILE 32 2.719 4.997 5.535 242 2HD1 ILE 32 2HD1 ILE 32 2.949 3.252 5.160 243 3HD1 ILE 32 3HD1 ILE 32 2.827 3.796 6.872 244 H THR 33 H THR 33 6.512 7.268 3.691 245 HA THR 33 HA THR 33 8.015 6.497 1.272 246 HB THR 33 HB THR 33 6.398 8.146 0.906 247 HG1 THR 33 HG1 THR 33 7.431 10.052 0.330 248 1HG2 THR 33 3HG2 THR 33 5.883 8.822 3.227 249 2HG2 THR 33 1HG2 THR 33 7.320 9.825 3.305 250 3HG2 THR 33 2HG2 THR 33 5.953 10.246 2.200 251 H GLU 34 H GLU 34 9.060 7.949 4.283 252 HA GLU 34 HA GLU 34 11.889 8.363 3.353 253 1HB GLU 34 1HB GLU 34 10.849 9.679 5.311 254 2HB GLU 34 2HB GLU 34 10.783 8.185 6.240 255 1HG GLU 34 1HG GLU 34 13.349 8.023 6.052 256 2HG GLU 34 2HG GLU 34 13.350 9.541 5.161 257 HE1 GLU 34 HE2 GLU 34 12.809 9.405 9.166 258 H ALA 35 H ALA 35 10.024 5.697 4.941 259 HA ALA 35 HA ALA 35 12.296 3.895 5.214 260 1HB ALA 35 2HB ALA 35 9.763 3.364 6.203 261 2HB ALA 35 3HB ALA 35 9.315 3.023 4.560 262 3HB ALA 35 1HB ALA 35 10.475 2.008 5.329 263 H LEU 36 H LEU 36 9.893 4.162 2.577 264 HA LEU 36 HA LEU 36 10.999 2.149 0.783 265 1HB LEU 36 2HB LEU 36 9.268 4.433 0.038 266 2HB LEU 36 1HB LEU 36 9.380 2.859 -0.717 267 HG LEU 36 HG LEU 36 7.907 3.486 1.857 268 1HD1 LEU 36 1HD2 LEU 36 6.586 3.276 -0.138 269 2HD1 LEU 36 2HD2 LEU 36 7.147 1.549 -0.313 270 3HD1 LEU 36 3HD2 LEU 36 6.187 2.065 1.110 271 1HD2 LEU 36 1HD1 LEU 36 8.902 0.645 1.250 272 2HD2 LEU 36 2HD1 LEU 36 9.329 1.616 2.681 273 3HD2 LEU 36 3HD1 LEU 36 7.679 1.084 2.494 274 NH1 ARG 37 NH2 ARG 37 11.170 11.865 -0.185 275 NH2 ARG 37 NH1 ARG 37 12.828 12.374 -1.653 276 H ARG 37 H ARG 37 11.360 5.761 0.840 277 HA ARG 37 HA ARG 37 13.021 5.689 -1.458 278 1HB ARG 37 1HB ARG 37 13.512 7.913 -1.362 279 2HB ARG 37 2HB ARG 37 11.906 7.784 -0.688 280 1HG ARG 37 1HG ARG 37 13.254 7.762 1.663 281 2HG ARG 37 2HG ARG 37 14.583 8.403 0.716 282 1HD ARG 37 1HD ARG 37 11.783 9.567 1.020 283 2HD ARG 37 2HD ARG 37 13.250 10.110 1.867 284 1HH1 ARG 37 2HH2 ARG 37 10.850 11.269 0.586 285 2HH1 ARG 37 1HH2 ARG 37 10.648 12.628 -0.630 286 1HH2 ARG 37 1HH1 ARG 37 13.771 12.170 -2.003 287 2HH2 ARG 37 2HH1 ARG 37 12.190 13.101 -1.994 288 H LYS 38 H LYS 38 13.704 5.024 1.939 289 HA LYS 38 HA LYS 38 16.691 5.370 1.616 290 1HB LYS 38 1HB LYS 38 15.469 6.489 3.500 291 2HB LYS 38 2HB LYS 38 15.077 4.905 4.164 292 1HG LYS 38 1HG LYS 38 17.499 4.491 4.634 293 2HG LYS 38 2HG LYS 38 17.946 5.938 3.739 294 1HD LYS 38 1HD LYS 38 18.084 6.453 6.084 295 2HD LYS 38 2HD LYS 38 16.746 7.379 5.415 296 1HE LYS 38 1HE LYS 38 15.100 5.675 6.382 297 2HE LYS 38 2HE LYS 38 16.458 4.747 7.035 298 1HZ LYS 38 1HZ LYS 38 17.064 6.657 8.373 299 2HZ LYS 38 2HZ LYS 38 15.530 6.187 8.688 300 H GLY 39 H GLY 39 14.680 2.871 0.927 301 1HA GLY 39 1HA GLY 39 15.081 0.521 0.645 302 2HA GLY 39 2HA GLY 39 16.702 0.721 1.271 303 H ASP 40 H ASP 40 13.693 1.482 2.928 304 HA ASP 40 HA ASP 40 14.075 -0.772 4.965 305 1HB ASP 40 1HB ASP 40 12.787 1.887 5.509 306 2HB ASP 40 2HB ASP 40 12.942 0.572 6.633 307 HD1 ASP 40 HD2 ASP 40 16.043 3.003 5.826 308 H LYS 41 H LYS 41 12.631 -2.221 5.295 309 HA LYS 41 HA LYS 41 10.064 -2.226 3.718 310 1HB LYS 41 2HB LYS 41 10.883 -4.373 5.709 311 2HB LYS 41 1HB LYS 41 9.635 -4.484 4.481 312 1HG LYS 41 1HG LYS 41 11.521 -4.200 2.703 313 2HG LYS 41 2HG LYS 41 12.678 -4.391 4.013 314 1HD LYS 41 1HD LYS 41 11.683 -6.671 4.565 315 2HD LYS 41 2HD LYS 41 10.498 -6.450 3.287 316 1HE LYS 41 1HE LYS 41 12.181 -7.885 2.371 317 2HE LYS 41 2HE LYS 41 12.371 -6.334 1.558 318 1HZ LYS 41 1HZ LYS 41 14.013 -7.287 3.848 319 2HZ LYS 41 2HZ LYS 41 14.204 -5.844 3.104 320 H VAL 42 H VAL 42 8.199 -1.470 4.581 321 HA VAL 42 HA VAL 42 7.910 -0.784 7.423 322 HB VAL 42 HB VAL 42 6.604 -0.191 4.693 323 1HG1 VAL 42 3HG2 VAL 42 4.854 -0.101 6.383 324 2HG1 VAL 42 1HG2 VAL 42 5.873 1.100 7.307 325 3HG1 VAL 42 2HG2 VAL 42 5.292 1.461 5.618 326 1HG2 VAL 42 1HG1 VAL 42 8.153 1.475 6.736 327 2HG2 VAL 42 2HG1 VAL 42 8.657 0.931 5.073 328 3HG2 VAL 42 3HG1 VAL 42 7.372 2.122 5.290 329 H GLN 43 H GLN 43 6.944 -1.931 8.523 330 HA GLN 43 HA GLN 43 5.337 -4.407 7.625 331 1HB GLN 43 1HB GLN 43 7.199 -4.411 9.935 332 2HB GLN 43 2HB GLN 43 5.981 -5.654 9.667 333 1HG GLN 43 1HG GLN 43 6.956 -6.254 7.498 334 2HG GLN 43 2HG GLN 43 8.026 -4.858 7.517 335 1HE2 GLN 43 2HE2 GLN 43 10.512 -7.167 8.625 336 2HE2 GLN 43 1HE2 GLN 43 9.867 -6.072 7.305 337 H LEU 44 H LEU 44 3.360 -4.838 8.027 338 HA LEU 44 HA LEU 44 1.965 -3.388 10.316 339 1HB LEU 44 2HB LEU 44 0.441 -3.875 7.726 340 2HB LEU 44 1HB LEU 44 -0.065 -3.017 9.175 341 HG LEU 44 HG LEU 44 1.448 -2.184 6.737 342 1HD1 LEU 44 1HD1 LEU 44 -0.996 -1.611 7.195 343 2HD1 LEU 44 2HD1 LEU 44 -0.495 -0.640 8.596 344 3HD1 LEU 44 3HD1 LEU 44 -0.015 -0.153 6.954 345 1HD2 LEU 44 1HD2 LEU 44 2.319 -0.934 9.340 346 2HD2 LEU 44 2HD2 LEU 44 3.253 -1.345 7.884 347 3HD2 LEU 44 3HD2 LEU 44 2.204 0.060 7.859 348 H ILE 45 H ILE 45 1.330 -5.028 11.674 349 HA ILE 45 HA ILE 45 1.048 -7.796 10.745 350 HB ILE 45 HB ILE 45 2.012 -7.153 12.961 351 1HG1 ILE 45 1HG1 ILE 45 1.067 -9.055 14.292 352 2HG1 ILE 45 2HG1 ILE 45 -0.199 -9.284 13.101 353 1HG2 ILE 45 1HG2 ILE 45 0.285 -5.508 13.681 354 2HG2 ILE 45 2HG2 ILE 45 -0.902 -6.821 13.876 355 3HG2 ILE 45 3HG2 ILE 45 0.559 -6.769 14.908 356 1HD1 ILE 45 1HD1 ILE 45 2.841 -9.553 12.546 357 2HD1 ILE 45 2HD1 ILE 45 1.713 -10.899 12.833 358 3HD1 ILE 45 3HD1 ILE 45 1.546 -9.908 11.371 359 H GLY 46 H GLY 46 -0.752 -9.123 10.851 360 1HA GLY 46 1HA GLY 46 -2.902 -9.742 10.010 361 2HA GLY 46 2HA GLY 46 -3.538 -8.465 11.025 362 H PHE 47 H PHE 47 -1.481 -7.402 8.459 363 HA PHE 47 HA PHE 47 -3.627 -7.094 6.364 364 1HB PHE 47 2HB PHE 47 -3.214 -5.102 8.067 365 2HB PHE 47 1HB PHE 47 -1.682 -4.844 7.299 366 HD1 PHE 47 HD2 PHE 47 -1.993 -4.918 4.451 367 HD2 PHE 47 HD1 PHE 47 -4.886 -3.589 7.336 368 HE1 PHE 47 HE2 PHE 47 -3.095 -3.554 2.728 369 HE2 PHE 47 HE1 PHE 47 -5.910 -2.163 5.605 370 HZ PHE 47 HZ PHE 47 -5.074 -2.186 3.327 371 H GLY 48 H GLY 48 -0.213 -5.824 6.492 372 1HA GLY 48 1HA GLY 48 1.117 -8.289 5.919 373 2HA GLY 48 2HA GLY 48 0.714 -7.463 4.406 374 H ASN 49 H ASN 49 1.935 -5.906 3.703 375 HA ASN 49 HA ASN 49 4.154 -4.662 5.279 376 1HB ASN 49 1HB ASN 49 4.810 -7.122 5.228 377 2HB ASN 49 2HB ASN 49 4.840 -7.060 3.476 378 1HD2 ASN 49 1HD2 ASN 49 8.411 -6.786 4.108 379 2HD2 ASN 49 2HD2 ASN 49 7.013 -7.875 3.632 380 H PHE 50 H PHE 50 4.823 -2.874 4.166 381 HA PHE 50 HA PHE 50 4.833 -2.832 1.108 382 1HB PHE 50 2HB PHE 50 5.698 -0.605 2.976 383 2HB PHE 50 1HB PHE 50 5.838 -0.470 1.290 384 HD1 PHE 50 HD1 PHE 50 3.666 -0.469 4.253 385 HD2 PHE 50 HD2 PHE 50 4.060 0.603 0.107 386 HE1 PHE 50 HE1 PHE 50 1.935 1.275 4.521 387 HE2 PHE 50 HE2 PHE 50 2.328 2.332 0.411 388 HZ PHE 50 HZ PHE 50 1.248 2.587 2.595 389 H GLU 51 H GLU 51 6.690 -2.743 0.011 390 HA GLU 51 HA GLU 51 9.276 -2.317 1.321 391 1HB GLU 51 1HB GLU 51 10.408 -4.492 0.744 392 2HB GLU 51 2HB GLU 51 9.132 -4.720 1.922 393 1HG GLU 51 1HG GLU 51 7.605 -5.638 0.125 394 2HG GLU 51 2HG GLU 51 8.853 -5.374 -1.090 395 HE1 GLU 51 HE2 GLU 51 10.823 -8.072 -0.187 396 H VAL 52 H VAL 52 11.068 -1.819 -0.067 397 HA VAL 52 HA VAL 52 10.121 -1.107 -2.762 398 HB VAL 52 HB VAL 52 11.417 0.180 -0.520 399 1HG1 VAL 52 1HG2 VAL 52 13.548 -0.468 -2.578 400 2HG1 VAL 52 2HG2 VAL 52 13.616 0.863 -1.372 401 3HG1 VAL 52 3HG2 VAL 52 13.506 -0.857 -0.858 402 1HG2 VAL 52 3HG1 VAL 52 11.159 1.128 -3.389 403 2HG2 VAL 52 1HG1 VAL 52 9.959 1.236 -2.065 404 3HG2 VAL 52 2HG1 VAL 52 11.473 2.107 -1.949 405 NH1 ARG 53 NH2 ARG 53 14.217 -4.643 -10.813 406 NH2 ARG 53 NH1 ARG 53 14.640 -6.865 -10.588 407 H ARG 53 H ARG 53 11.478 -1.445 -4.573 408 HA ARG 53 HA ARG 53 13.177 -4.014 -4.451 409 1HB ARG 53 1HB ARG 53 10.866 -4.345 -5.393 410 2HB ARG 53 2HB ARG 53 11.182 -3.205 -6.659 411 1HG ARG 53 1HG ARG 53 12.990 -5.673 -6.247 412 2HG ARG 53 2HG ARG 53 11.438 -5.807 -7.059 413 1HD ARG 53 1HD ARG 53 12.107 -4.215 -8.841 414 2HD ARG 53 2HD ARG 53 13.655 -3.902 -8.048 415 1HH1 ARG 53 2HH2 ARG 53 13.798 -3.797 -10.411 416 2HH1 ARG 53 1HH2 ARG 53 14.706 -4.720 -11.712 417 1HH2 ARG 53 1HH1 ARG 53 14.548 -7.712 -10.017 418 2HH2 ARG 53 2HH1 ARG 53 15.100 -6.786 -11.502 419 H GLU 54 H GLU 54 15.158 -3.026 -4.402 420 HA GLU 54 HA GLU 54 15.986 -0.754 -6.012 421 1HB GLU 54 1HB GLU 54 17.229 -1.692 -4.003 422 2HB GLU 54 2HB GLU 54 17.837 -3.003 -5.011 423 1HG GLU 54 1HG GLU 54 18.973 -1.277 -6.514 424 2HG GLU 54 2HG GLU 54 18.312 0.022 -5.529 425 HE1 GLU 54 HE2 GLU 54 20.535 -0.363 -2.900 426 NH1 ARG 55 NH2 ARG 55 22.015 -0.453 -8.302 427 NH2 ARG 55 NH1 ARG 55 23.081 0.618 -9.999 428 H ARG 55 H ARG 55 16.842 -0.578 -8.039 429 HA ARG 55 HA ARG 55 15.714 -2.274 -10.042 430 1HB ARG 55 1HB ARG 55 16.441 -0.688 -11.538 431 2HB ARG 55 2HB ARG 55 16.416 0.231 -10.090 432 1HG ARG 55 1HG ARG 55 18.659 -0.464 -11.902 433 2HG ARG 55 2HG ARG 55 18.365 0.983 -11.040 434 1HD ARG 55 1HD ARG 55 19.298 -0.171 -8.888 435 2HD ARG 55 2HD ARG 55 19.710 -1.572 -9.859 436 1HH1 ARG 55 2HH2 ARG 55 21.145 -0.872 -7.955 437 2HH1 ARG 55 1HH2 ARG 55 22.911 -0.395 -7.805 438 1HH2 ARG 55 1HH1 ARG 55 23.029 1.014 -10.944 439 2HH2 ARG 55 2HH1 ARG 55 23.903 0.601 -9.384 440 H ALA 56 H ALA 56 17.096 -2.864 -12.130 441 HA ALA 56 HA ALA 56 19.512 -4.599 -11.362 442 1HB ALA 56 2HB ALA 56 17.486 -6.000 -11.920 443 2HB ALA 56 3HB ALA 56 17.370 -5.206 -13.513 444 3HB ALA 56 1HB ALA 56 18.781 -6.217 -13.115 445 H ALA 57 H ALA 57 19.812 -1.844 -11.993 446 HA ALA 57 HA ALA 57 20.614 -0.349 -13.562 447 1HB ALA 57 3HB ALA 57 22.463 -1.173 -12.152 448 2HB ALA 57 1HB ALA 57 22.895 -2.376 -13.386 449 3HB ALA 57 2HB ALA 57 23.033 -0.622 -13.735 450 NH1 ARG 58 NH2 ARG 58 13.264 0.536 -18.429 451 NH2 ARG 58 NH1 ARG 58 13.775 -1.151 -19.865 452 H ARG 58 H ARG 58 19.772 0.208 -15.276 453 HA ARG 58 HA ARG 58 19.739 -1.652 -17.525 454 1HB ARG 58 2HB ARG 58 18.466 1.113 -17.647 455 2HB ARG 58 1HB ARG 58 18.102 -0.280 -18.654 456 1HG ARG 58 1HG ARG 58 17.241 -1.443 -16.480 457 2HG ARG 58 2HG ARG 58 17.469 0.107 -15.680 458 1HD ARG 58 1HD ARG 58 15.152 0.011 -16.240 459 2HD ARG 58 2HD ARG 58 15.872 1.210 -17.318 460 1HH1 ARG 58 2HH2 ARG 58 13.553 1.106 -17.626 461 2HH1 ARG 58 1HH2 ARG 58 12.383 0.611 -18.951 462 1HH2 ARG 58 1HH1 ARG 58 14.449 -1.866 -20.159 463 2HH2 ARG 58 2HH1 ARG 58 12.860 -0.958 -20.288 464 H LYS 59 H LYS 59 19.753 0.066 -19.765 465 HA LYS 59 HA LYS 59 22.441 1.461 -19.822 466 1HB LYS 59 1HB LYS 59 22.874 -0.946 -20.489 467 2HB LYS 59 2HB LYS 59 21.800 -0.757 -21.873 468 1HG LYS 59 1HG LYS 59 23.292 1.012 -22.821 469 2HG LYS 59 2HG LYS 59 24.298 0.998 -21.369 470 1HD LYS 59 1HD LYS 59 24.900 -1.432 -21.836 471 2HD LYS 59 2HD LYS 59 23.945 -1.364 -23.323 472 1HE LYS 59 1HE LYS 59 25.440 0.495 -24.195 473 2HE LYS 59 2HE LYS 59 26.391 0.445 -22.707 474 1HZ LYS 59 1HZ LYS 59 26.046 -1.841 -24.570 475 2HZ LYS 59 2HZ LYS 59 26.950 -1.861 -23.208 476 H GLY 60 H GLY 60 22.228 3.357 -20.848 477 1HA GLY 60 1HA GLY 60 19.521 3.949 -22.246 478 2HA GLY 60 2HA GLY 60 20.451 5.140 -21.361 479 NH1 ARG 61 NH2 ARG 61 22.151 8.906 -27.203 480 NH2 ARG 61 NH1 ARG 61 20.309 7.731 -26.577 481 H ARG 61 H ARG 61 22.711 5.328 -22.020 482 HA ARG 61 HA ARG 61 23.137 5.943 -24.930 483 1HB ARG 61 1HB ARG 61 24.917 6.416 -22.646 484 2HB ARG 61 2HB ARG 61 25.110 6.969 -24.284 485 1HG ARG 61 1HG ARG 61 22.839 7.884 -22.443 486 2HG ARG 61 2HG ARG 61 24.364 8.690 -22.692 487 1HD ARG 61 1HD ARG 61 22.862 9.881 -24.072 488 2HD ARG 61 2HD ARG 61 23.861 8.937 -25.171 489 1HH1 ARG 61 2HH2 ARG 61 23.031 9.350 -26.919 490 2HH1 ARG 61 1HH2 ARG 61 21.758 8.869 -28.150 491 1HH2 ARG 61 1HH1 ARG 61 19.781 7.283 -25.819 492 2HH2 ARG 61 2HH1 ARG 61 20.044 7.777 -27.567 493 H ASN 62 H ASN 62 24.344 4.864 -26.454 494 HA ASN 62 HA ASN 62 25.041 2.008 -25.816 495 1HB ASN 62 1HB ASN 62 22.804 3.091 -27.681 496 2HB ASN 62 2HB ASN 62 23.621 1.647 -28.096 497 1HD2 ASN 62 2HD2 ASN 62 20.636 1.121 -25.550 498 2HD2 ASN 62 1HD2 ASN 62 20.899 2.563 -26.653 499 HA PRO 63 HA PRO 63 28.323 2.511 -28.976 500 1HB PRO 63 1HB PRO 63 27.360 -0.185 -30.064 501 2HB PRO 63 2HB PRO 63 29.014 0.347 -29.705 502 1HG PRO 63 1HG PRO 63 27.680 -1.282 -27.970 503 2HG PRO 63 2HG PRO 63 28.692 0.033 -27.340 504 1HD PRO 63 1HD PRO 63 25.647 -0.045 -27.575 505 2HD PRO 63 2HD PRO 63 26.683 0.640 -26.285 506 H GLN 64 H GLN 64 25.124 1.543 -30.164 507 HA GLN 64 HA GLN 64 25.332 2.135 -32.997 508 1HB GLN 64 1HB GLN 64 23.379 0.968 -31.626 509 2HB GLN 64 2HB GLN 64 22.884 2.552 -31.130 510 1HG GLN 64 1HG GLN 64 21.447 2.080 -32.854 511 2HG GLN 64 2HG GLN 64 22.575 3.190 -33.612 512 1HE2 GLN 64 2HE2 GLN 64 23.620 0.782 -36.084 513 2HE2 GLN 64 1HE2 GLN 64 23.771 2.475 -35.390 514 H THR 65 H THR 65 23.982 4.133 -30.431 515 HA THR 65 HA THR 65 23.499 6.509 -31.954 516 HB THR 65 HB THR 65 22.825 7.518 -29.841 517 HG1 THR 65 HG1 THR 65 23.169 6.433 -27.911 518 1HG2 THR 65 3HG2 THR 65 21.301 5.679 -30.820 519 2HG2 THR 65 1HG2 THR 65 22.066 4.517 -29.727 520 3HG2 THR 65 2HG2 THR 65 21.141 5.865 -29.046 521 H GLY 66 H GLY 66 26.366 5.767 -30.009 522 1HA GLY 66 1HA GLY 66 28.446 7.108 -31.029 523 2HA GLY 66 2HA GLY 66 27.541 8.559 -30.619 524 H GLU 67 H GLU 67 26.456 7.899 -28.160 525 HA GLU 67 HA GLU 67 28.929 7.948 -26.359 526 1HB GLU 67 2HB GLU 67 27.447 10.063 -26.581 527 2HB GLU 67 1HB GLU 67 26.111 9.163 -25.870 528 1HG GLU 67 1HG GLU 67 27.486 8.822 -23.755 529 2HG GLU 67 2HG GLU 67 28.838 9.676 -24.496 530 HE1 GLU 67 HE2 GLU 67 25.560 11.637 -23.134 531 H GLU 68 H GLU 68 28.544 6.756 -24.309 532 HA GLU 68 HA GLU 68 26.155 5.088 -24.137 533 1HB GLU 68 1HB GLU 68 27.135 2.823 -24.149 534 2HB GLU 68 2HB GLU 68 27.448 3.648 -25.658 535 1HG GLU 68 1HG GLU 68 29.833 4.145 -24.885 536 2HG GLU 68 2HG GLU 68 29.527 3.220 -23.417 537 HE1 GLU 68 HE2 GLU 68 29.511 0.099 -24.975 538 H MET 69 H MET 69 25.503 4.373 -22.103 539 HA MET 69 HA MET 69 27.406 4.096 -19.894 540 1HB MET 69 1HB MET 69 26.787 5.907 -18.433 541 2HB MET 69 2HB MET 69 27.382 6.566 -19.925 542 1HG MET 69 1HG MET 69 25.605 7.992 -19.351 543 2HG MET 69 2HG MET 69 24.868 6.993 -20.593 544 1HE MET 69 2HE MET 69 22.835 5.951 -20.429 545 2HE MET 69 1HE MET 69 22.159 5.125 -19.018 546 3HE MET 69 3HE MET 69 21.809 6.856 -19.284 547 H GLU 70 H GLU 70 26.466 3.400 -18.014 548 HA GLU 70 HA GLU 70 23.945 1.829 -18.321 549 1HB GLU 70 2HB GLU 70 24.500 0.663 -16.313 550 2HB GLU 70 1HB GLU 70 25.897 0.714 -17.380 551 1HG GLU 70 1HG GLU 70 26.837 0.981 -15.259 552 2HG GLU 70 2HG GLU 70 26.851 2.614 -15.883 553 HE1 GLU 70 HE2 GLU 70 24.355 1.528 -12.833 554 H ILE 71 H ILE 71 22.002 2.145 -17.172 555 HA ILE 71 HA ILE 71 21.523 4.819 -16.018 556 HB ILE 71 HB ILE 71 19.696 2.376 -16.366 557 1HG1 ILE 71 1HG1 ILE 71 20.508 3.344 -18.581 558 2HG1 ILE 71 2HG1 ILE 71 18.789 3.204 -18.349 559 1HG2 ILE 71 3HG2 ILE 71 19.045 5.253 -15.630 560 2HG2 ILE 71 1HG2 ILE 71 17.834 4.010 -16.096 561 3HG2 ILE 71 2HG2 ILE 71 18.827 3.793 -14.616 562 1HD1 ILE 71 3HD1 ILE 71 20.241 5.870 -17.918 563 2HD1 ILE 71 1HD1 ILE 71 19.494 5.362 -19.463 564 3HD1 ILE 71 2HD1 ILE 71 18.486 5.595 -18.023 565 HA PRO 72 HA PRO 72 22.559 2.795 -11.932 566 1HB PRO 72 1HB PRO 72 22.771 5.050 -10.333 567 2HB PRO 72 2HB PRO 72 23.913 4.701 -11.635 568 1HG PRO 72 1HG PRO 72 21.474 6.560 -11.755 569 2HG PRO 72 2HG PRO 72 23.153 6.939 -12.214 570 1HD PRO 72 1HD PRO 72 21.246 6.130 -14.072 571 2HD PRO 72 2HD PRO 72 22.977 5.716 -14.263 572 H ALA 73 H ALA 73 21.540 3.649 -9.447 573 HA ALA 73 HA ALA 73 19.338 1.955 -9.437 574 1HB ALA 73 1HB ALA 73 20.539 2.219 -7.329 575 2HB ALA 73 2HB ALA 73 19.620 3.764 -7.038 576 3HB ALA 73 3HB ALA 73 18.786 2.215 -7.162 577 H SER 74 H SER 74 17.394 1.830 -9.214 578 HA SER 74 HA SER 74 15.956 4.122 -8.091 579 1HB SER 74 1HB SER 74 13.966 4.230 -9.687 580 2HB SER 74 2HB SER 74 15.475 4.675 -10.479 581 HG SER 74 HG SER 74 14.242 3.235 -11.706 582 H LYS 75 H LYS 75 14.915 3.503 -6.448 583 HA LYS 75 HA LYS 75 14.182 0.655 -5.898 584 1HB LYS 75 2HB LYS 75 13.233 2.834 -4.064 585 2HB LYS 75 1HB LYS 75 13.520 1.155 -3.806 586 1HG LYS 75 1HG LYS 75 15.322 2.012 -2.676 587 2HG LYS 75 2HG LYS 75 16.077 1.655 -4.221 588 1HD LYS 75 1HD LYS 75 15.770 4.134 -4.866 589 2HD LYS 75 2HD LYS 75 15.023 4.420 -3.294 590 1HE LYS 75 1HE LYS 75 17.172 3.712 -2.140 591 2HE LYS 75 2HE LYS 75 17.918 3.394 -3.715 592 1HZ LYS 75 1HZ LYS 75 17.574 5.730 -4.281 593 2HZ LYS 75 2HZ LYS 75 16.869 6.029 -2.837 594 H VAL 76 H VAL 76 12.059 -0.292 -6.449 595 HA VAL 76 HA VAL 76 10.016 1.415 -7.509 596 HB VAL 76 HB VAL 76 11.382 -1.279 -7.694 597 1HG1 VAL 76 3HG2 VAL 76 8.601 -1.019 -8.525 598 2HG1 VAL 76 1HG2 VAL 76 9.831 -2.321 -8.979 599 3HG1 VAL 76 2HG2 VAL 76 9.352 -2.096 -7.281 600 1HG2 VAL 76 2HG1 VAL 76 12.054 0.570 -9.199 601 2HG2 VAL 76 3HG1 VAL 76 11.431 -0.849 -10.057 602 3HG2 VAL 76 1HG1 VAL 76 10.392 0.606 -9.866 603 HA PRO 77 HA PRO 77 8.031 0.281 -3.478 604 1HB PRO 77 1HB PRO 77 5.888 2.073 -3.553 605 2HB PRO 77 2HB PRO 77 7.563 2.627 -3.417 606 1HG PRO 77 1HG PRO 77 5.857 2.435 -5.949 607 2HG PRO 77 2HG PRO 77 6.816 3.814 -5.397 608 1HD PRO 77 1HD PRO 77 7.753 1.827 -7.285 609 2HD PRO 77 2HD PRO 77 8.882 2.742 -6.249 610 H ALA 78 H ALA 78 6.820 -0.965 -2.761 611 HA ALA 78 HA ALA 78 4.371 -2.129 -4.163 612 1HB ALA 78 2HB ALA 78 6.534 -3.429 -4.610 613 2HB ALA 78 3HB ALA 78 6.696 -3.704 -2.860 614 3HB ALA 78 1HB ALA 78 5.299 -4.378 -3.735 615 H PHE 79 H PHE 79 3.202 -3.469 -2.643 616 HA PHE 79 HA PHE 79 3.092 -2.300 0.235 617 1HB PHE 79 2HB PHE 79 1.346 -1.265 0.166 618 2HB PHE 79 1HB PHE 79 1.606 -1.037 -1.542 619 HD1 PHE 79 HD1 PHE 79 0.680 -3.260 -3.059 620 HD2 PHE 79 HD2 PHE 79 -0.936 -1.920 0.691 621 HE1 PHE 79 HE1 PHE 79 -1.406 -4.459 -3.518 622 HE2 PHE 79 HE2 PHE 79 -3.018 -3.145 0.222 623 HZ PHE 79 HZ PHE 79 -3.259 -4.399 -1.884 624 H LYS 80 H LYS 80 2.181 -3.483 1.557 625 HA LYS 80 HA LYS 80 1.674 -6.039 2.142 626 1HB LYS 80 2HB LYS 80 -0.393 -3.922 3.016 627 2HB LYS 80 1HB LYS 80 0.572 -4.658 4.163 628 1HG LYS 80 1HG LYS 80 2.143 -2.838 4.136 629 2HG LYS 80 2HG LYS 80 1.540 -2.159 2.631 630 1HD LYS 80 1HD LYS 80 -0.166 -2.438 5.152 631 2HD LYS 80 2HD LYS 80 0.796 -1.011 4.816 632 1HE LYS 80 1HE LYS 80 -1.453 -1.992 2.940 633 2HE LYS 80 2HE LYS 80 -1.734 -0.915 4.298 634 1HZ LYS 80 1HZ LYS 80 -0.198 0.657 3.275 635 2HZ LYS 80 2HZ LYS 80 0.050 -0.348 2.010 636 HA PRO 81 HA PRO 81 -2.250 -7.528 1.298 637 1HB PRO 81 1HB PRO 81 -0.908 -9.451 -0.677 638 2HB PRO 81 2HB PRO 81 -2.570 -8.822 -0.738 639 1HG PRO 81 1HG PRO 81 -0.603 -7.760 -2.350 640 2HG PRO 81 2HG PRO 81 -1.817 -6.687 -1.580 641 1HD PRO 81 1HD PRO 81 1.052 -7.209 -0.709 642 2HD PRO 81 2HD PRO 81 0.139 -5.659 -0.879 643 H GLY 82 H GLY 82 0.179 -8.051 2.912 644 1HA GLY 82 1HA GLY 82 1.714 -10.393 2.827 645 2HA GLY 82 2HA GLY 82 1.374 -9.484 4.247 646 H LYS 83 H LYS 83 -0.468 -11.128 2.485 647 HA LYS 83 HA LYS 83 -1.432 -13.510 2.357 648 1HB LYS 83 2HB LYS 83 0.376 -13.881 4.754 649 2HB LYS 83 1HB LYS 83 -1.108 -14.757 4.889 650 1HG LYS 83 1HG LYS 83 -0.652 -15.851 2.620 651 2HG LYS 83 2HG LYS 83 0.837 -14.912 2.481 652 1HD LYS 83 1HD LYS 83 1.733 -16.034 4.590 653 2HD LYS 83 2HD LYS 83 0.234 -16.941 4.726 654 1HE LYS 83 1HE LYS 83 1.838 -18.443 3.760 655 2HE LYS 83 2HE LYS 83 0.698 -18.053 2.475 656 1HZ LYS 83 1HZ LYS 83 2.310 -16.469 1.601 657 2HZ LYS 83 2HZ LYS 83 2.944 -17.974 1.683 658 H ALA 84 H ALA 84 -1.579 -11.916 5.410 659 HA ALA 84 HA ALA 84 -4.175 -12.643 6.427 660 1HB ALA 84 2HB ALA 84 -2.294 -11.546 7.664 661 2HB ALA 84 3HB ALA 84 -2.438 -10.097 6.637 662 3HB ALA 84 1HB ALA 84 -3.771 -10.521 7.740 663 H LEU 85 H LEU 85 -3.213 -9.763 4.311 664 HA LEU 85 HA LEU 85 -6.039 -8.818 4.250 665 1HB LEU 85 2HB LEU 85 -4.211 -7.150 4.039 666 2HB LEU 85 1HB LEU 85 -3.577 -8.021 2.667 667 HG LEU 85 HG LEU 85 -5.966 -7.680 1.677 668 1HD1 LEU 85 2HD1 LEU 85 -7.088 -6.746 3.669 669 2HD1 LEU 85 3HD1 LEU 85 -5.958 -5.371 3.695 670 3HD1 LEU 85 1HD1 LEU 85 -7.128 -5.550 2.358 671 1HD2 LEU 85 3HD2 LEU 85 -3.867 -5.436 1.747 672 2HD2 LEU 85 1HD2 LEU 85 -4.119 -6.668 0.501 673 3HD2 LEU 85 2HD2 LEU 85 -5.301 -5.366 0.693 674 H LYS 86 H LYS 86 -3.849 -10.776 2.188 675 HA LYS 86 HA LYS 86 -5.667 -11.164 -0.026 676 1HB LYS 86 1HB LYS 86 -3.142 -11.629 0.014 677 2HB LYS 86 2HB LYS 86 -3.481 -13.105 0.894 678 1HG LYS 86 1HG LYS 86 -3.131 -13.622 -1.411 679 2HG LYS 86 2HG LYS 86 -4.820 -13.963 -1.045 680 1HD LYS 86 1HD LYS 86 -5.509 -11.799 -2.151 681 2HD LYS 86 2HD LYS 86 -3.834 -11.382 -2.466 682 1HE LYS 86 1HE LYS 86 -5.276 -13.875 -3.623 683 2HE LYS 86 2HE LYS 86 -5.168 -12.318 -4.441 684 1HZ LYS 86 1HZ LYS 86 -3.473 -13.842 -5.189 685 2HZ LYS 86 2HZ LYS 86 -2.856 -14.012 -3.684 686 H ASP 87 H ASP 87 -5.745 -12.615 3.209 687 HA ASP 87 HA ASP 87 -7.704 -14.726 2.529 688 1HB ASP 87 1HB ASP 87 -5.852 -14.035 4.679 689 2HB ASP 87 2HB ASP 87 -7.391 -13.774 5.365 690 HD1 ASP 87 HD2 ASP 87 -8.310 -17.150 5.429 691 H ALA 88 H ALA 88 -7.800 -11.435 4.024 692 HA ALA 88 HA ALA 88 -10.632 -11.160 4.598 693 1HB ALA 88 1HB ALA 88 -8.897 -9.291 5.094 694 2HB ALA 88 2HB ALA 88 -8.770 -8.966 3.364 695 3HB ALA 88 3HB ALA 88 -10.289 -8.665 4.165 696 H VAL 89 H VAL 89 -8.841 -10.397 1.615 697 HA VAL 89 HA VAL 89 -11.198 -9.619 0.078 698 HB VAL 89 HB VAL 89 -8.717 -8.623 0.626 699 1HG1 VAL 89 2HG2 VAL 89 -7.675 -10.837 -0.269 700 2HG1 VAL 89 3HG2 VAL 89 -7.906 -10.159 -1.878 701 3HG1 VAL 89 1HG2 VAL 89 -6.925 -9.282 -0.656 702 1HG2 VAL 89 2HG1 VAL 89 -10.306 -7.525 -0.652 703 2HG2 VAL 89 3HG1 VAL 89 -8.644 -7.381 -1.291 704 3HG2 VAL 89 1HG1 VAL 89 -9.834 -8.463 -2.125 705 H LYS 90 H LYS 90 -9.917 -12.715 0.451 706 HA LYS 90 HA LYS 90 -9.629 -13.696 -2.216 707 1HB LYS 90 1HB LYS 90 -9.067 -14.678 0.252 708 2HB LYS 90 2HB LYS 90 -10.594 -15.488 0.097 709 1HG LYS 90 1HG LYS 90 -9.771 -16.751 -1.886 710 2HG LYS 90 2HG LYS 90 -8.376 -15.690 -2.039 711 1HD LYS 90 1HD LYS 90 -7.543 -17.695 -1.060 712 2HD LYS 90 2HD LYS 90 -7.478 -16.455 0.182 713 1HE LYS 90 1HE LYS 90 -9.621 -17.398 1.218 714 2HE LYS 90 2HE LYS 90 -9.668 -18.643 -0.039 715 1HZ LYS 90 1HZ LYS 90 -8.646 -19.460 1.957 716 2HZ LYS 90 2HZ LYS 90 -7.545 -19.462 0.748 717 1H MET 1 1H MET 91 9.014 -1.409 9.203 718 2H MET 1 2H MET 91 10.183 -2.030 10.240 719 HA MET 1 HA MET 91 9.165 -1.074 11.865 720 1HB MET 1 1HB MET 91 6.786 -0.673 9.937 721 2HB MET 1 2HB MET 91 6.801 -0.116 11.581 722 1HG MET 1 1HG MET 91 9.097 1.138 10.865 723 2HG MET 1 2HG MET 91 8.420 0.946 9.236 724 1HE MET 1 1HE MET 91 6.915 2.822 8.305 725 2HE MET 1 3HE MET 91 6.433 4.222 9.292 726 3HE MET 1 2HE MET 91 8.168 3.816 9.109 727 H ASN 2 H ASN 92 6.042 -2.274 11.218 728 HA ASN 2 HA ASN 92 5.702 -4.739 11.694 729 1HB ASN 2 1HB ASN 92 5.595 -5.681 13.886 730 2HB ASN 2 2HB ASN 92 7.190 -5.087 13.568 731 1HD2 ASN 2 1HD2 ASN 92 7.210 -2.912 16.448 732 2HD2 ASN 2 2HD2 ASN 92 8.061 -3.401 14.898 733 H LYS 3 H LYS 93 4.728 -1.859 12.996 734 HA LYS 3 HA LYS 93 2.370 -0.981 12.427 735 1HB LYS 3 1HB LYS 93 1.416 -3.423 12.356 736 2HB LYS 3 2HB LYS 93 1.276 -3.348 14.091 737 1HG LYS 3 1HG LYS 93 -0.382 -1.422 13.798 738 2HG LYS 3 2HG LYS 93 -0.017 -1.371 12.072 739 1HD LYS 3 1HD LYS 93 -0.845 -3.841 11.920 740 2HD LYS 3 2HD LYS 93 -1.382 -3.674 13.582 741 1HE LYS 3 1HE LYS 93 -3.316 -3.312 12.234 742 2HE LYS 3 2HE LYS 93 -2.878 -1.717 12.841 743 1HZ LYS 3 1HZ LYS 93 -3.435 -1.702 10.495 744 2HZ LYS 3 2HZ LYS 93 -2.273 -2.795 10.137 745 H THR 4 H THR 94 4.255 -1.957 15.366 746 HA THR 4 HA THR 94 2.999 0.056 16.982 747 HB THR 4 HB THR 94 5.354 -1.918 17.243 748 HG1 THR 4 HG1 THR 94 3.852 -3.053 18.533 749 1HG2 THR 4 3HG2 THR 94 3.834 -0.187 19.221 750 2HG2 THR 4 1HG2 THR 94 5.001 -1.517 19.660 751 3HG2 THR 4 2HG2 THR 94 5.566 -0.064 18.747 752 H GLU 5 H GLU 95 5.882 -0.377 14.901 753 HA GLU 5 HA GLU 95 7.241 2.100 15.891 754 1HB GLU 5 1HB GLU 95 7.838 0.930 13.156 755 2HB GLU 5 2HB GLU 95 8.832 1.979 14.119 756 1HG GLU 5 1HG GLU 95 8.255 -1.000 14.604 757 2HG GLU 5 2HG GLU 95 9.731 -0.321 13.972 758 HE1 GLU 5 HE2 GLU 95 11.025 0.725 17.025 759 H LEU 6 H LEU 96 4.537 1.377 14.073 760 HA LEU 6 HA LEU 96 4.251 3.623 12.182 761 1HB LEU 6 2HB LEU 96 3.085 0.947 12.823 762 2HB LEU 6 1HB LEU 96 1.822 2.059 13.223 763 HG LEU 6 HG LEU 96 2.257 2.988 10.862 764 1HD1 LEU 6 2HD1 LEU 96 4.524 2.223 10.392 765 2HD1 LEU 6 3HD1 LEU 96 4.005 0.522 10.439 766 3HD1 LEU 6 1HD1 LEU 96 3.434 1.625 9.145 767 1HD2 LEU 6 2HD2 LEU 96 0.346 1.554 11.340 768 2HD2 LEU 6 3HD2 LEU 96 0.903 1.356 9.678 769 3HD2 LEU 6 1HD2 LEU 96 1.272 0.120 10.916 770 H ILE 7 H ILE 97 2.946 2.557 15.318 771 HA ILE 7 HA ILE 97 1.314 4.828 15.966 772 HB ILE 7 HB ILE 97 2.799 3.053 18.026 773 1HG1 ILE 7 1HG1 ILE 97 0.185 2.356 16.583 774 2HG1 ILE 7 2HG1 ILE 97 1.705 1.600 16.331 775 1HG2 ILE 7 2HG2 ILE 97 1.530 5.046 18.955 776 2HG2 ILE 7 3HG2 ILE 97 0.058 4.421 18.193 777 3HG2 ILE 7 1HG2 ILE 97 0.850 3.504 19.495 778 1HD1 ILE 7 3HD1 ILE 97 1.809 0.713 18.669 779 2HD1 ILE 7 1HD1 ILE 97 0.210 1.376 18.987 780 3HD1 ILE 7 2HD1 ILE 97 0.406 0.133 17.732 781 H ASN 8 H ASN 98 4.658 4.109 16.923 782 HA ASN 8 HA ASN 98 5.041 6.757 18.223 783 1HB ASN 8 1HB ASN 98 7.226 4.765 17.253 784 2HB ASN 8 2HB ASN 98 7.544 6.180 18.230 785 1HD2 ASN 8 2HD2 ASN 98 6.425 2.824 20.189 786 2HD2 ASN 8 1HD2 ASN 98 6.715 2.889 18.379 787 H ALA 9 H ALA 99 5.044 5.987 14.859 788 HA ALA 9 HA ALA 99 6.691 8.375 14.024 789 1HB ALA 9 2HB ALA 99 6.158 6.371 12.355 790 2HB ALA 9 3HB ALA 99 4.449 6.829 12.455 791 3HB ALA 9 1HB ALA 99 5.561 7.970 11.757 792 H VAL 10 H VAL 100 3.181 7.510 14.367 793 HA VAL 10 HA VAL 100 2.315 9.970 13.328 794 HB VAL 10 HB VAL 100 0.520 8.295 15.102 795 1HG1 VAL 10 3HG2 VAL 100 -0.154 10.446 13.650 796 2HG1 VAL 10 1HG2 VAL 100 -0.356 9.183 12.393 797 3HG1 VAL 10 2HG2 VAL 100 -1.243 9.047 13.918 798 1HG2 VAL 10 1HG1 VAL 100 1.732 7.471 12.461 799 2HG2 VAL 10 2HG1 VAL 100 1.573 6.643 14.043 800 3HG2 VAL 10 3HG1 VAL 100 0.119 6.819 13.015 801 H ALA 11 H ALA 101 2.366 8.653 16.461 802 HA ALA 11 HA ALA 101 1.547 11.052 17.663 803 1HB ALA 11 2HB ALA 101 1.314 8.796 18.803 804 2HB ALA 11 3HB ALA 101 3.084 8.681 18.964 805 3HB ALA 11 1HB ALA 101 2.168 9.903 19.906 806 H GLU 12 H GLU 102 4.758 10.194 16.652 807 HA GLU 12 HA GLU 102 5.982 12.440 18.230 808 1HB GLU 12 1HB GLU 102 7.360 10.376 17.744 809 2HB GLU 12 2HB GLU 102 7.244 10.705 16.023 810 1HG GLU 12 1HG GLU 102 9.424 11.400 16.784 811 2HG GLU 12 2HG GLU 102 8.550 12.849 16.334 812 HE2 GLU 12 HE2 GLU 102 8.621 14.263 19.480 813 H THR 13 H THR 103 5.103 11.842 14.752 814 HA THR 13 HA THR 103 5.574 14.798 14.298 815 HB THR 13 HB THR 103 6.461 12.839 12.906 816 HG1 THR 13 HG1 THR 103 5.397 15.173 11.714 817 1HG2 THR 13 3HG2 THR 103 4.397 11.780 12.134 818 2HG2 THR 13 1HG2 THR 103 3.921 13.282 11.294 819 3HG2 THR 13 2HG2 THR 103 5.376 12.384 10.780 820 H SER 14 H SER 104 3.206 13.581 15.468 821 HA SER 14 HA SER 104 1.307 15.803 14.453 822 1HB SER 14 1HB SER 104 0.517 13.550 13.583 823 2HB SER 14 2HB SER 104 0.240 13.027 15.249 824 HG SER 14 HG SER 104 -0.917 15.288 14.003 825 H GLY 15 H GLY 105 2.282 13.944 17.375 826 1HA GLY 15 1HA GLY 105 1.922 14.411 19.661 827 2HA GLY 15 2HA GLY 105 1.507 16.062 19.211 828 H LEU 16 H LEU 106 0.119 12.867 18.878 829 HA LEU 16 HA LEU 106 -2.498 13.611 20.210 830 1HB LEU 16 1HB LEU 106 -3.548 11.883 18.904 831 2HB LEU 16 2HB LEU 106 -3.036 13.319 18.041 832 HG LEU 16 HG LEU 106 -1.219 12.320 17.083 833 1HD1 LEU 16 2HD1 LEU 106 -0.410 10.847 18.992 834 2HD1 LEU 16 3HD1 LEU 106 -1.730 9.729 18.521 835 3HD1 LEU 16 1HD1 LEU 106 -0.343 10.104 17.396 836 1HD2 LEU 16 2HD2 LEU 106 -2.770 12.045 15.607 837 2HD2 LEU 16 3HD2 LEU 106 -1.390 10.916 15.533 838 3HD2 LEU 16 1HD2 LEU 106 -2.931 10.329 16.133 839 H SER 17 H SER 107 -2.316 10.666 20.152 840 HA SER 17 HA SER 107 -0.861 10.100 22.787 841 1HB SER 17 1HB SER 107 -3.642 8.930 22.359 842 2HB SER 17 2HB SER 107 -2.577 8.715 23.726 843 HG SER 17 HG SER 107 -2.693 10.957 24.120 844 H LYS 18 H LYS 108 -0.318 7.874 23.089 845 HA LYS 18 HA LYS 108 0.470 6.429 20.558 846 1HB LYS 18 1HB LYS 108 1.015 5.831 23.516 847 2HB LYS 18 2HB LYS 108 1.083 4.523 22.361 848 1HG LYS 18 1HG LYS 108 3.309 5.323 22.621 849 2HG LYS 18 2HG LYS 108 2.784 5.654 20.980 850 1HD LYS 18 1HD LYS 108 2.363 8.087 21.638 851 2HD LYS 18 2HD LYS 108 2.947 7.728 23.266 852 1HE LYS 18 1HE LYS 108 5.210 7.083 22.303 853 2HE LYS 18 2HE LYS 108 4.608 7.389 20.667 854 1HZ LYS 18 1HZ LYS 108 4.253 9.689 21.253 855 2HZ LYS 18 2HZ LYS 108 5.813 9.265 21.497 856 H LYS 19 H LYS 109 -2.030 5.997 23.057 857 HA LYS 19 HA LYS 109 -3.318 3.744 21.636 858 1HB LYS 19 2HB LYS 109 -3.763 4.302 24.080 859 2HB LYS 19 1HB LYS 109 -4.613 5.767 23.590 860 1HG LYS 19 1HG LYS 109 -6.247 4.096 24.123 861 2HG LYS 19 2HG LYS 109 -6.333 4.340 22.387 862 1HD LYS 19 1HD LYS 109 -5.006 2.202 22.015 863 2HD LYS 19 2HD LYS 109 -4.809 2.025 23.751 864 1HE LYS 19 1HE LYS 109 -6.549 0.503 23.123 865 2HE LYS 19 2HE LYS 109 -7.341 1.800 24.013 866 1HZ LYS 19 1HZ LYS 109 -7.254 1.496 21.057 867 2HZ LYS 19 2HZ LYS 109 -8.537 1.178 22.019 868 H ASP 20 H ASP 110 -3.631 7.372 21.291 869 HA ASP 20 HA ASP 110 -5.847 7.047 19.282 870 1HB ASP 20 1HB ASP 110 -4.130 9.466 20.175 871 2HB ASP 20 2HB ASP 110 -5.117 9.607 18.753 872 HD1 ASP 20 HD2 ASP 110 -7.240 9.330 18.865 873 H ALA 21 H ALA 111 -2.373 7.115 19.004 874 HA ALA 21 HA ALA 111 -2.332 7.460 16.037 875 1HB ALA 21 1HB ALA 111 -0.212 6.695 18.148 876 2HB ALA 21 2HB ALA 111 0.119 6.636 16.395 877 3HB ALA 21 3HB ALA 111 -0.339 8.130 17.153 878 H THR 22 H THR 112 -2.280 4.585 18.221 879 HA THR 22 HA THR 112 -2.021 2.785 15.925 880 HB THR 22 HB THR 112 -1.333 2.440 18.127 881 HG1 THR 22 HG1 THR 112 -1.326 0.993 16.283 882 1HG2 THR 22 1HG2 THR 112 -2.814 2.292 19.803 883 2HG2 THR 22 2HG2 THR 112 -3.611 0.832 19.038 884 3HG2 THR 22 3HG2 THR 112 -1.919 0.784 19.582 885 H LYS 23 H LYS 113 -4.693 3.872 17.741 886 HA LYS 23 HA LYS 113 -6.983 2.561 16.498 887 1HB LYS 23 2HB LYS 113 -5.963 5.214 17.784 888 2HB LYS 23 1HB LYS 113 -7.618 5.292 17.176 889 1HG LYS 23 1HG LYS 113 -6.939 3.128 19.251 890 2HG LYS 23 2HG LYS 113 -7.320 4.778 19.699 891 1HD LYS 23 1HD LYS 113 -9.323 3.523 19.934 892 2HD LYS 23 2HD LYS 113 -9.551 4.675 18.628 893 1HE LYS 23 1HE LYS 113 -9.274 2.848 16.917 894 2HE LYS 23 2HE LYS 113 -8.898 1.675 18.191 895 1HZ LYS 23 1HZ LYS 113 -11.201 1.591 17.470 896 2HZ LYS 23 2HZ LYS 113 -11.458 3.150 17.891 897 H ALA 24 H ALA 114 -5.189 5.533 15.750 898 HA ALA 24 HA ALA 114 -6.704 6.275 13.386 899 1HB ALA 24 3HB ALA 114 -4.006 7.133 14.497 900 2HB ALA 24 1HB ALA 114 -4.843 7.940 13.134 901 3HB ALA 24 2HB ALA 114 -5.618 7.884 14.741 902 H VAL 25 H VAL 115 -3.620 4.433 13.681 903 HA VAL 25 HA VAL 115 -3.279 3.822 10.806 904 HB VAL 25 HB VAL 115 -2.580 2.750 13.691 905 1HG1 VAL 25 2HG2 VAL 115 -1.943 1.036 11.238 906 2HG1 VAL 25 3HG2 VAL 115 -1.281 0.817 12.894 907 3HG1 VAL 25 1HG2 VAL 115 -2.996 0.617 12.592 908 1HG2 VAL 25 1HG1 VAL 115 -1.222 4.591 12.761 909 2HG2 VAL 25 2HG1 VAL 115 -0.262 3.144 13.079 910 3HG2 VAL 25 3HG1 VAL 115 -0.719 3.565 11.394 911 H ASP 26 H ASP 116 -4.932 1.909 13.425 912 HA ASP 26 HA ASP 116 -6.492 0.341 11.357 913 1HB ASP 26 1HB ASP 116 -6.765 0.530 14.437 914 2HB ASP 26 2HB ASP 116 -7.732 -0.553 13.446 915 HD2 ASP 26 HD2 ASP 116 -4.089 -1.637 14.581 916 H ALA 27 H ALA 117 -6.773 3.112 11.613 917 HA ALA 27 HA ALA 117 -9.780 3.506 11.290 918 1HB ALA 27 2HB ALA 117 -8.670 5.079 12.904 919 2HB ALA 27 3HB ALA 117 -7.675 5.651 11.553 920 3HB ALA 27 1HB ALA 117 -9.418 5.781 11.463 921 H VAL 28 H VAL 118 -6.722 4.427 9.812 922 HA VAL 28 HA VAL 118 -7.701 5.066 7.089 923 HB VAL 28 HB VAL 118 -4.858 4.162 8.017 924 1HG1 VAL 28 3HG2 VAL 118 -5.901 5.510 5.473 925 2HG1 VAL 28 1HG2 VAL 118 -4.218 5.675 6.008 926 3HG1 VAL 28 2HG2 VAL 118 -4.841 4.052 5.665 927 1HG2 VAL 28 3HG1 VAL 118 -5.622 6.219 9.186 928 2HG2 VAL 28 1HG1 VAL 118 -4.142 6.323 8.194 929 3HG2 VAL 28 2HG1 VAL 118 -5.712 7.019 7.585 930 H PHE 29 H PHE 119 -5.823 2.491 8.419 931 HA PHE 29 HA PHE 119 -6.153 0.540 6.154 932 1HB PHE 29 2HB PHE 119 -5.028 -0.172 8.894 933 2HB PHE 29 1HB PHE 119 -4.834 -1.082 7.402 934 HD1 PHE 29 HD2 PHE 119 -3.911 0.421 5.264 935 HD2 PHE 29 HD1 PHE 119 -3.119 1.119 9.427 936 HE1 PHE 29 HE2 PHE 119 -2.242 2.124 4.671 937 HE2 PHE 29 HE1 PHE 119 -1.466 2.825 8.829 938 HZ PHE 29 HZ PHE 119 -1.146 3.424 6.463 939 H ASP 30 H ASP 120 -8.187 1.058 9.012 940 HA ASP 30 HA ASP 120 -9.727 -1.455 8.558 941 1HB ASP 30 1HB ASP 120 -9.697 0.003 10.689 942 2HB ASP 30 2HB ASP 120 -10.740 1.148 9.881 943 HD1 ASP 30 HD2 ASP 120 -12.146 -2.388 11.246 944 H SER 31 H SER 121 -9.900 1.857 7.572 945 HA SER 31 HA SER 121 -12.347 1.625 5.858 946 1HB SER 31 2HB SER 121 -10.382 3.970 5.996 947 2HB SER 31 1HB SER 121 -11.918 3.938 5.092 948 HG SER 31 HG SER 121 -11.622 3.494 7.871 949 H ILE 32 H ILE 122 -8.781 1.175 5.056 950 HA ILE 32 HA ILE 122 -9.236 0.992 2.153 951 HB ILE 32 HB ILE 122 -7.105 -0.325 3.963 952 1HG1 ILE 32 1HG1 ILE 122 -5.332 0.705 2.833 953 2HG1 ILE 32 2HG1 ILE 122 -6.380 1.666 1.791 954 1HG2 ILE 32 2HG2 ILE 122 -7.785 -0.380 0.957 955 2HG2 ILE 32 3HG2 ILE 122 -6.118 -0.786 1.404 956 3HG2 ILE 32 1HG2 ILE 122 -7.488 -1.758 1.988 957 1HD1 ILE 32 2HD1 ILE 122 -5.667 2.117 4.741 958 2HD1 ILE 32 3HD1 ILE 122 -5.116 3.030 3.357 959 3HD1 ILE 32 1HD1 ILE 122 -6.818 3.165 3.841 960 H THR 33 H THR 123 -9.126 -1.333 4.992 961 HA THR 33 HA THR 123 -9.806 -3.586 3.234 962 HB THR 33 HB THR 123 -10.168 -5.029 5.071 963 HG1 THR 33 HG1 THR 123 -9.799 -2.733 6.708 964 1HG2 THR 33 1HG2 THR 123 -7.804 -4.206 4.300 965 2HG2 THR 33 2HG2 THR 123 -7.753 -3.342 5.830 966 3HG2 THR 33 3HG2 THR 123 -7.900 -5.119 5.838 967 H GLU 34 H GLU 124 -11.852 -1.219 4.315 968 HA GLU 34 HA GLU 124 -14.273 -2.951 3.730 969 1HB GLU 34 1HB GLU 124 -14.383 -1.314 5.829 970 2HB GLU 34 2HB GLU 124 -14.393 0.000 4.675 971 1HG GLU 34 1HG GLU 124 -16.672 -0.386 5.332 972 2HG GLU 34 2HG GLU 124 -16.567 -0.949 3.679 973 HE2 GLU 34 HE2 GLU 124 -17.456 -3.419 6.733 974 H ALA 35 H ALA 125 -12.104 -0.651 2.276 975 HA ALA 35 HA ALA 125 -13.845 -0.345 -0.107 976 1HB ALA 35 2HB ALA 125 -11.836 1.390 0.392 977 2HB ALA 35 3HB ALA 125 -10.743 0.038 0.099 978 3HB ALA 35 1HB ALA 125 -11.695 0.648 -1.214 979 H LEU 36 H LEU 126 -10.670 -2.142 0.324 980 HA LEU 36 HA LEU 126 -10.990 -3.610 -2.108 981 1HB LEU 36 2HB LEU 126 -9.384 -4.244 0.327 982 2HB LEU 36 1HB LEU 126 -9.020 -4.751 -1.322 983 HG LEU 36 HG LEU 126 -9.012 -1.806 -0.444 984 1HD1 LEU 36 3HD1 LEU 126 -6.789 -2.944 -0.145 985 2HD1 LEU 36 1HD1 LEU 126 -6.722 -2.820 -1.975 986 3HD1 LEU 36 2HD1 LEU 126 -6.951 -1.351 -0.958 987 1HD2 LEU 36 2HD2 LEU 126 -9.158 -2.324 -3.203 988 2HD2 LEU 36 3HD2 LEU 126 -10.143 -1.303 -2.145 989 3HD2 LEU 36 1HD2 LEU 126 -8.493 -0.842 -2.483 990 NH1 ARG 37 NH2 ARG 127 -16.173 -9.108 5.039 991 NH2 ARG 37 NH1 ARG 127 -15.139 -10.962 5.852 992 H ARG 37 H ARG 127 -11.881 -4.541 1.303 993 HA ARG 37 HA ARG 127 -12.440 -7.218 0.413 994 1HB ARG 37 1HB ARG 127 -11.969 -6.502 2.829 995 2HB ARG 37 2HB ARG 127 -13.632 -5.861 2.883 996 1HG ARG 37 1HG ARG 127 -14.504 -8.213 2.518 997 2HG ARG 37 2HG ARG 127 -12.827 -8.781 2.541 998 1HD ARG 37 1HD ARG 127 -12.534 -7.604 4.811 999 2HD ARG 37 2HD ARG 127 -14.234 -7.171 4.779 1000 1HH1 ARG 37 2HH2 ARG 127 -16.075 -8.178 4.616 1001 2HH1 ARG 37 1HH2 ARG 127 -17.049 -9.586 5.277 1002 1HH2 ARG 37 1HH1 ARG 127 -14.257 -11.446 6.051 1003 2HH2 ARG 37 2HH1 ARG 127 -16.086 -11.312 6.034 1004 H LYS 38 H LYS 128 -14.321 -4.139 0.222 1005 HA LYS 38 HA LYS 128 -16.908 -5.715 0.035 1006 1HB LYS 38 1HB LYS 128 -16.655 -3.716 1.680 1007 2HB LYS 38 2HB LYS 128 -16.713 -2.684 0.252 1008 1HG LYS 38 1HG LYS 128 -19.041 -3.593 -0.260 1009 2HG LYS 38 2HG LYS 128 -18.899 -4.678 1.112 1010 1HD LYS 38 1HD LYS 128 -20.259 -2.820 1.784 1011 2HD LYS 38 2HD LYS 128 -18.752 -2.714 2.680 1012 1HE LYS 38 1HE LYS 128 -17.932 -0.903 1.072 1013 2HE LYS 38 2HE LYS 128 -19.441 -1.041 0.158 1014 1HZ LYS 38 1HZ LYS 128 -20.648 -0.365 2.130 1015 2HZ LYS 38 2HZ LYS 128 -19.537 0.760 1.714 1016 H GLY 39 H GLY 129 -14.618 -4.957 -2.147 1017 1HA GLY 39 1HA GLY 129 -14.632 -4.604 -4.540 1018 2HA GLY 39 2HA GLY 129 -16.383 -4.690 -4.532 1019 H ASP 40 H ASP 130 -14.243 -2.496 -2.825 1020 HA ASP 40 HA ASP 130 -15.088 -0.033 -4.417 1021 1HB ASP 40 1HB ASP 130 -15.366 -0.550 -1.438 1022 2HB ASP 40 2HB ASP 130 -15.135 1.090 -2.016 1023 HD2 ASP 40 HD2 ASP 130 -18.628 -0.840 -2.363 1024 H LYS 41 H LYS 131 -13.973 1.824 -4.228 1025 HA LYS 41 HA LYS 131 -10.973 1.296 -4.362 1026 1HB LYS 41 2HB LYS 131 -12.449 3.794 -5.356 1027 2HB LYS 41 1HB LYS 131 -10.761 3.369 -5.650 1028 1HG LYS 41 1HG LYS 131 -11.590 1.336 -6.999 1029 2HG LYS 41 2HG LYS 131 -13.234 1.939 -6.797 1030 1HD LYS 41 1HD LYS 131 -12.519 4.150 -7.881 1031 2HD LYS 41 2HD LYS 131 -10.908 3.469 -8.134 1032 1HE LYS 41 1HE LYS 131 -11.968 1.605 -9.553 1033 2HE LYS 41 2HE LYS 131 -13.544 2.380 -9.340 1034 1HZ LYS 41 1HZ LYS 131 -12.676 4.354 -10.414 1035 2HZ LYS 41 2HZ LYS 131 -12.537 3.050 -11.390 1036 H VAL 42 H VAL 132 -9.528 2.365 -2.956 1037 HA VAL 42 HA VAL 132 -10.342 4.116 -0.866 1038 HB VAL 42 HB VAL 132 -7.634 3.165 -1.935 1039 1HG1 VAL 42 3HG2 VAL 132 -7.696 4.750 0.089 1040 2HG1 VAL 42 1HG2 VAL 132 -8.589 3.464 0.944 1041 3HG1 VAL 42 2HG2 VAL 132 -6.940 3.149 0.337 1042 1HG2 VAL 42 3HG1 VAL 132 -9.141 1.083 -1.570 1043 2HG2 VAL 42 1HG1 VAL 132 -7.818 1.182 -0.394 1044 3HG2 VAL 42 2HG1 VAL 132 -9.453 1.676 0.080 1045 H GLN 43 H GLN 133 -7.844 5.513 -1.280 1046 HA GLN 43 HA GLN 133 -6.938 6.750 -2.938 1047 1HB GLN 43 1HB GLN 133 -9.379 8.230 -3.666 1048 2HB GLN 43 2HB GLN 133 -7.794 8.948 -3.978 1049 1HG GLN 43 1HG GLN 133 -6.998 7.164 -5.269 1050 2HG GLN 43 2HG GLN 133 -8.276 6.074 -4.853 1051 1HE2 GLN 43 1HE2 GLN 133 -10.354 7.175 -7.570 1052 2HE2 GLN 43 2HE2 GLN 133 -10.032 6.000 -6.200 1053 H LEU 44 H LEU 134 -5.366 7.918 -2.766 1054 HA LEU 44 HA LEU 134 -5.125 10.027 -0.598 1055 1HB LEU 44 2HB LEU 134 -2.927 7.957 -1.232 1056 2HB LEU 44 1HB LEU 134 -2.928 9.193 0.013 1057 HG LEU 44 HG LEU 134 -5.109 7.791 0.823 1058 1HD1 LEU 44 1HD1 LEU 134 -5.086 6.063 -1.002 1059 2HD1 LEU 44 2HD1 LEU 134 -3.457 5.557 -0.512 1060 3HD1 LEU 44 3HD1 LEU 134 -4.849 5.353 0.589 1061 1HD2 LEU 44 2HD2 LEU 134 -3.028 8.212 2.199 1062 2HD2 LEU 44 3HD2 LEU 134 -3.582 6.539 2.410 1063 3HD2 LEU 44 1HD2 LEU 134 -2.184 6.889 1.363 1064 H ILE 45 H ILE 135 -4.562 11.878 -1.741 1065 HA ILE 45 HA ILE 135 -3.622 11.587 -4.490 1066 HB ILE 45 HB ILE 135 -5.497 13.103 -3.743 1067 1HG1 ILE 45 1HG1 ILE 135 -3.480 14.579 -5.521 1068 2HG1 ILE 45 2HG1 ILE 135 -4.423 13.200 -6.059 1069 1HG2 ILE 45 3HG2 ILE 135 -4.347 14.170 -1.806 1070 2HG2 ILE 45 1HG2 ILE 135 -3.271 15.056 -2.916 1071 3HG2 ILE 45 2HG2 ILE 135 -5.030 15.381 -2.907 1072 1HD1 ILE 45 3HD1 ILE 135 -6.578 14.454 -5.604 1073 2HD1 ILE 45 1HD1 ILE 135 -5.624 15.885 -5.128 1074 3HD1 ILE 45 2HD1 ILE 135 -5.531 15.268 -6.792 1075 H GLY 46 H GLY 136 -1.918 12.139 -2.077 1076 1HA GLY 46 1HA GLY 136 0.594 12.946 -3.747 1077 2HA GLY 46 2HA GLY 136 0.488 13.418 -2.066 1078 H PHE 47 H PHE 137 -0.746 10.206 -2.724 1079 HA PHE 47 HA PHE 137 1.889 8.847 -2.168 1080 1HB PHE 47 2HB PHE 137 0.531 9.781 -0.099 1081 2HB PHE 47 1HB PHE 137 -0.639 8.542 -0.401 1082 HD1 PHE 47 HD2 PHE 137 2.945 9.182 0.536 1083 HD2 PHE 47 HD1 PHE 137 -0.066 6.140 0.092 1084 HE1 PHE 47 HE2 PHE 137 4.445 7.517 1.557 1085 HE2 PHE 47 HE1 PHE 137 1.482 4.485 1.037 1086 HZ PHE 47 HZ PHE 137 3.776 5.162 1.687 1087 H GLY 48 H GLY 138 -1.602 8.276 -3.008 1088 1HA GLY 48 1HA GLY 138 -1.060 6.032 -4.556 1089 2HA GLY 48 2HA GLY 138 -1.309 5.319 -2.974 1090 H ASN 49 H ASN 139 -2.577 4.754 -5.331 1091 HA ASN 49 HA ASN 139 -5.514 5.321 -4.610 1092 1HB ASN 49 1HB ASN 139 -5.042 6.644 -6.592 1093 2HB ASN 49 2HB ASN 139 -4.249 5.321 -7.407 1094 1HD2 ASN 49 2HD2 ASN 139 -7.501 5.440 -9.068 1095 2HD2 ASN 49 1HD2 ASN 139 -5.883 6.300 -8.982 1096 H PHE 50 H PHE 140 -5.810 3.475 -3.520 1097 HA PHE 50 HA PHE 140 -4.835 0.819 -4.588 1098 1HB PHE 50 2HB PHE 140 -6.686 1.259 -2.207 1099 2HB PHE 50 1HB PHE 140 -6.098 -0.267 -2.655 1100 HD1 PHE 50 HD2 PHE 140 -5.200 3.074 -1.400 1101 HD2 PHE 50 HD1 PHE 140 -4.516 -1.143 -1.214 1102 HE1 PHE 50 HE2 PHE 140 -3.867 3.359 0.705 1103 HE2 PHE 50 HE1 PHE 140 -3.236 -0.818 0.897 1104 HZ PHE 50 HZ PHE 140 -2.866 1.466 1.717 1105 H GLU 51 H GLU 141 -6.166 -0.763 -5.224 1106 HA GLU 51 HA GLU 141 -8.925 -0.816 -4.784 1107 1HB GLU 51 1HB GLU 141 -10.015 -0.513 -7.104 1108 2HB GLU 51 2HB GLU 141 -9.285 0.962 -6.533 1109 1HG GLU 51 1HG GLU 141 -7.206 0.438 -7.997 1110 2HG GLU 51 2HG GLU 141 -8.089 -0.933 -8.656 1111 HE2 GLU 51 HE2 GLU 141 -9.737 -0.589 -9.911 1112 H VAL 52 H VAL 142 -10.239 -2.639 -5.697 1113 HA VAL 52 HA VAL 142 -8.403 -4.910 -5.739 1114 HB VAL 52 HB VAL 142 -10.753 -4.070 -4.331 1115 1HG1 VAL 52 1HG2 VAL 142 -11.670 -6.091 -6.387 1116 2HG1 VAL 52 2HG2 VAL 142 -12.503 -5.651 -4.853 1117 3HG1 VAL 52 3HG2 VAL 142 -12.232 -4.427 -6.138 1118 1HG2 VAL 52 1HG1 VAL 142 -9.486 -6.812 -4.495 1119 2HG2 VAL 52 2HG1 VAL 142 -9.107 -5.457 -3.399 1120 3HG2 VAL 52 3HG1 VAL 142 -10.673 -6.264 -3.300 1121 NH1 ARG 53 NH2 ARG 143 -9.029 -2.324 -11.773 1122 NH2 ARG 53 NH1 ARG 143 -6.882 -1.939 -11.133 1123 H ARG 53 H ARG 143 -8.803 -6.763 -7.147 1124 HA ARG 53 HA ARG 143 -9.994 -6.034 -9.883 1125 1HB ARG 53 1HB ARG 143 -7.282 -5.950 -9.540 1126 2HB ARG 53 2HB ARG 143 -7.426 -7.670 -9.733 1127 1HG ARG 53 1HG ARG 143 -6.941 -6.805 -11.896 1128 2HG ARG 53 2HG ARG 143 -8.606 -7.342 -11.953 1129 1HD ARG 53 1HD ARG 143 -8.398 -5.224 -13.163 1130 2HD ARG 53 2HD ARG 143 -9.423 -4.976 -11.758 1131 1HH1 ARG 53 2HH2 ARG 143 -9.732 -3.008 -12.074 1132 2HH1 ARG 53 1HH2 ARG 143 -9.167 -1.315 -11.646 1133 1HH2 ARG 53 1HH1 ARG 143 -5.950 -2.325 -10.946 1134 2HH2 ARG 53 2HH1 ARG 143 -7.169 -0.958 -11.050 1135 H GLU 54 H GLU 144 -11.799 -7.193 -9.684 1136 HA GLU 54 HA GLU 144 -11.900 -9.921 -8.545 1137 1HB GLU 54 1HB GLU 144 -13.757 -8.211 -8.419 1138 2HB GLU 54 2HB GLU 144 -14.101 -8.479 -10.126 1139 1HG GLU 54 1HG GLU 144 -14.580 -10.938 -9.604 1140 2HG GLU 54 2HG GLU 144 -14.173 -10.648 -7.915 1141 HE1 GLU 54 HE2 GLU 144 -16.333 -10.073 -10.417 1142 NH1 ARG 55 NH2 ARG 145 -9.449 -14.652 -15.893 1143 NH2 ARG 55 NH1 ARG 145 -8.478 -16.698 -15.736 1144 H ARG 55 H ARG 145 -11.268 -11.675 -9.506 1145 HA ARG 55 HA ARG 145 -10.624 -11.875 -12.380 1146 1HB ARG 55 1HB ARG 145 -9.264 -12.878 -10.557 1147 2HB ARG 55 2HB ARG 145 -10.595 -13.895 -10.053 1148 1HG ARG 55 1HG ARG 145 -8.995 -15.257 -11.168 1149 2HG ARG 55 2HG ARG 145 -10.463 -15.223 -12.121 1150 1HD ARG 55 1HD ARG 145 -9.303 -13.407 -13.621 1151 2HD ARG 55 2HD ARG 145 -7.828 -13.718 -12.716 1152 1HH1 ARG 55 2HH2 ARG 145 -9.694 -13.772 -15.426 1153 2HH1 ARG 55 1HH2 ARG 145 -9.651 -14.909 -16.866 1154 1HH2 ARG 55 1HH1 ARG 145 -7.980 -17.381 -15.154 1155 2HH2 ARG 55 2HH1 ARG 145 -8.748 -16.809 -16.720 1156 H ALA 56 H ALA 146 -11.397 -13.404 -13.888 1157 HA ALA 56 HA ALA 146 -14.222 -14.560 -13.466 1158 1HB ALA 56 1HB ALA 146 -13.056 -13.286 -16.031 1159 2HB ALA 56 2HB ALA 146 -14.652 -14.063 -15.873 1160 3HB ALA 56 3HB ALA 146 -14.299 -12.571 -14.972 1161 H ALA 57 H ALA 147 -12.678 -16.253 -12.609 1162 HA ALA 57 HA ALA 147 -11.128 -17.867 -14.449 1163 1HB ALA 57 1HB ALA 147 -10.531 -17.556 -12.165 1164 2HB ALA 57 2HB ALA 147 -11.889 -18.571 -11.662 1165 3HB ALA 57 3HB ALA 147 -10.569 -19.251 -12.644 1166 NH1 ARG 58 NH2 ARG 148 -8.392 -19.204 -19.057 1167 NH2 ARG 58 NH1 ARG 148 -6.459 -19.072 -17.867 1168 H ARG 58 H ARG 148 -11.574 -20.457 -13.739 1169 HA ARG 58 HA ARG 148 -12.623 -21.007 -16.484 1170 1HB ARG 58 2HB ARG 148 -11.139 -22.924 -14.608 1171 2HB ARG 58 1HB ARG 148 -11.227 -23.036 -16.355 1172 1HG ARG 58 1HG ARG 148 -9.656 -20.957 -14.727 1173 2HG ARG 58 2HG ARG 148 -9.017 -22.404 -15.477 1174 1HD ARG 58 1HD ARG 148 -9.693 -21.514 -17.784 1175 2HD ARG 58 2HD ARG 148 -10.298 -20.035 -17.013 1176 1HH1 ARG 58 2HH2 ARG 148 -9.352 -19.562 -19.110 1177 2HH1 ARG 58 1HH2 ARG 148 -7.910 -18.629 -19.757 1178 1HH2 ARG 58 1HH1 ARG 148 -5.944 -19.327 -17.017 1179 2HH2 ARG 58 2HH1 ARG 148 -6.113 -18.507 -18.650 1180 H LYS 59 H LYS 149 -13.091 -23.632 -16.512 1181 HA LYS 59 HA LYS 149 -15.260 -24.438 -14.591 1182 1HB LYS 59 1HB LYS 149 -15.908 -24.213 -17.601 1183 2HB LYS 59 2HB LYS 149 -16.813 -25.198 -16.458 1184 1HG LYS 59 1HG LYS 149 -17.294 -23.119 -15.066 1185 2HG LYS 59 2HG LYS 149 -16.513 -22.139 -16.306 1186 1HD LYS 59 1HD LYS 149 -18.195 -22.944 -18.011 1187 2HD LYS 59 2HD LYS 149 -18.962 -23.957 -16.782 1188 1HE LYS 59 1HE LYS 149 -19.497 -21.882 -15.402 1189 2HE LYS 59 2HE LYS 149 -18.744 -20.869 -16.643 1190 1HZ LYS 59 1HZ LYS 149 -20.373 -21.665 -18.229 1191 2HZ LYS 59 2HZ LYS 149 -21.101 -20.966 -16.943 1192 H GLY 60 H GLY 150 -14.176 -26.223 -13.883 1193 1HA GLY 60 1HA GLY 150 -13.692 -28.489 -15.692 1194 2HA GLY 60 2HA GLY 150 -12.165 -27.657 -15.418 1195 NH1 ARG 61 NH2 ARG 151 -10.546 -36.101 -11.717 1196 NH2 ARG 61 NH1 ARG 151 -10.802 -36.248 -9.463 1197 H ARG 61 H ARG 151 -11.151 -27.942 -13.460 1198 HA ARG 61 HA ARG 151 -12.514 -29.377 -11.187 1199 1HB ARG 61 1HB ARG 151 -11.735 -31.111 -12.942 1200 2HB ARG 61 2HB ARG 151 -10.073 -30.660 -12.588 1201 1HG ARG 61 1HG ARG 151 -10.367 -31.466 -10.216 1202 2HG ARG 61 2HG ARG 151 -12.083 -31.763 -10.516 1203 1HD ARG 61 1HD ARG 151 -11.472 -33.467 -12.302 1204 2HD ARG 61 2HD ARG 151 -9.752 -33.200 -11.957 1205 1HH1 ARG 61 2HH2 ARG 151 -10.490 -35.495 -12.543 1206 2HH1 ARG 61 1HH2 ARG 151 -10.481 -37.125 -11.700 1207 1HH2 ARG 61 1HH1 ARG 151 -10.940 -35.759 -8.571 1208 2HH2 ARG 61 2HH1 ARG 151 -10.719 -37.261 -9.601 1209 H ASN 62 H ASN 152 -11.471 -29.341 -9.276 1210 HA ASN 62 HA ASN 152 -9.653 -27.064 -8.792 1211 1HB ASN 62 1HB ASN 152 -11.622 -27.837 -7.299 1212 2HB ASN 62 2HB ASN 152 -10.621 -29.172 -6.771 1213 1HD2 ASN 62 2HD2 ASN 152 -10.061 -25.594 -4.993 1214 2HD2 ASN 62 1HD2 ASN 152 -11.311 -25.855 -6.311 1215 HA PRO 63 HA PRO 153 -5.897 -29.737 -9.137 1216 1HB PRO 63 1HB PRO 153 -3.924 -27.987 -8.255 1217 2HB PRO 63 2HB PRO 153 -4.756 -27.863 -9.811 1218 1HG PRO 63 1HG PRO 153 -5.407 -26.352 -7.230 1219 2HG PRO 63 2HG PRO 153 -5.200 -25.679 -8.865 1220 1HD PRO 63 1HD PRO 153 -7.695 -26.231 -7.823 1221 2HD PRO 63 2HD PRO 153 -7.370 -26.461 -9.568 1222 H GLN 64 H GLN 154 -6.750 -28.457 -5.915 1223 HA GLN 64 HA GLN 154 -4.763 -30.298 -4.525 1224 1HB GLN 64 1HB GLN 154 -6.720 -28.279 -3.274 1225 2HB GLN 64 2HB GLN 154 -5.503 -29.194 -2.420 1226 1HG GLN 64 1HG GLN 154 -4.951 -27.016 -4.547 1227 2HG GLN 64 2HG GLN 154 -5.070 -26.796 -2.817 1228 1HE2 GLN 64 2HE2 GLN 154 -1.545 -28.257 -4.356 1229 2HE2 GLN 64 1HE2 GLN 154 -3.020 -27.921 -5.395 1230 H THR 65 H THR 155 -8.070 -29.419 -3.838 1231 HA THR 65 HA THR 155 -8.928 -31.854 -2.669 1232 HB THR 65 HB THR 155 -11.234 -31.097 -2.759 1233 HG1 THR 65 HG1 THR 155 -11.770 -29.257 -3.916 1234 1HG2 THR 65 1HG2 THR 155 -9.690 -29.858 -1.157 1235 2HG2 THR 65 2HG2 THR 155 -9.436 -28.613 -2.403 1236 3HG2 THR 65 3HG2 THR 155 -11.060 -28.859 -1.725 1237 H GLY 66 H GLY 156 -9.339 -31.135 -6.129 1238 1HA GLY 66 1HA GLY 156 -9.723 -32.702 -7.921 1239 2HA GLY 66 2HA GLY 156 -9.792 -34.028 -6.780 1240 H GLU 67 H GLU 157 -11.795 -31.064 -6.743 1241 HA GLU 67 HA GLU 157 -14.317 -32.717 -7.220 1242 1HB GLU 67 2HB GLU 157 -14.018 -31.398 -5.042 1243 2HB GLU 67 1HB GLU 157 -14.021 -29.906 -5.989 1244 1HG GLU 67 1HG GLU 157 -16.220 -30.214 -5.022 1245 2HG GLU 67 2HG GLU 157 -16.361 -30.368 -6.762 1246 HE1 GLU 67 HE2 GLU 157 -17.009 -33.524 -4.281 1247 H GLU 68 H GLU 158 -15.515 -32.260 -8.930 1248 HA GLU 68 HA GLU 158 -14.374 -30.455 -11.058 1249 1HB GLU 68 1HB GLU 158 -16.634 -32.526 -11.262 1250 2HB GLU 68 2HB GLU 158 -16.175 -31.450 -12.577 1251 1HG GLU 68 1HG GLU 158 -13.820 -32.357 -12.558 1252 2HG GLU 68 2HG GLU 158 -14.243 -33.460 -11.254 1253 HE1 GLU 68 HE2 GLU 158 -15.362 -34.150 -15.072 1254 H MET 69 H MET 159 -15.034 -28.388 -11.174 1255 HA MET 69 HA MET 159 -17.806 -27.531 -10.968 1256 1HB MET 69 1HB MET 159 -17.982 -26.399 -8.910 1257 2HB MET 69 2HB MET 159 -17.338 -27.951 -8.473 1258 1HG MET 69 1HG MET 159 -15.826 -25.263 -8.525 1259 2HG MET 69 2HG MET 159 -16.321 -26.192 -7.122 1260 1HE MET 69 1HE MET 159 -13.658 -25.127 -9.256 1261 2HE MET 69 3HE MET 159 -12.290 -26.184 -8.836 1262 3HE MET 69 2HE MET 159 -13.316 -26.588 -10.231 1263 H GLU 70 H GLU 160 -17.833 -24.983 -10.675 1264 HA GLU 70 HA GLU 160 -15.961 -23.846 -12.723 1265 1HB GLU 70 2HB GLU 160 -17.303 -21.923 -12.839 1266 2HB GLU 70 1HB GLU 160 -18.357 -23.332 -12.893 1267 1HG GLU 70 1HG GLU 160 -19.017 -22.926 -10.474 1268 2HG GLU 70 2HG GLU 160 -17.948 -21.527 -10.416 1269 HE1 GLU 70 HE2 GLU 160 -20.734 -22.864 -11.743 1270 H ILE 71 H ILE 161 -14.305 -22.163 -12.309 1271 HA ILE 71 HA ILE 161 -13.268 -22.301 -9.519 1272 HB ILE 71 HB ILE 161 -12.020 -21.741 -12.293 1273 1HG1 ILE 71 1HG1 ILE 161 -10.407 -23.597 -11.556 1274 2HG1 ILE 71 2HG1 ILE 161 -11.484 -23.976 -10.223 1275 1HG2 ILE 71 2HG2 ILE 161 -11.107 -20.183 -10.601 1276 2HG2 ILE 71 3HG2 ILE 161 -10.680 -21.543 -9.572 1277 3HG2 ILE 71 1HG2 ILE 161 -9.929 -21.328 -11.222 1278 1HD1 ILE 71 3HD1 ILE 161 -12.252 -24.183 -13.217 1279 2HD1 ILE 71 1HD1 ILE 161 -11.639 -25.521 -12.217 1280 3HD1 ILE 71 2HD1 ILE 161 -13.199 -24.778 -11.842 1281 HA PRO 72 HA PRO 162 -13.703 -17.554 -11.347 1282 1HB PRO 72 1HB PRO 162 -16.708 -17.848 -10.806 1283 2HB PRO 72 2HB PRO 162 -15.904 -16.523 -11.695 1284 1HG PRO 72 1HG PRO 162 -16.633 -18.703 -13.146 1285 2HG PRO 72 2HG PRO 162 -14.980 -18.050 -13.361 1286 1HD PRO 72 1HD PRO 162 -15.856 -20.476 -11.840 1287 2HD PRO 72 2HD PRO 162 -14.333 -20.202 -12.759 1288 H ALA 73 H ALA 163 -14.040 -15.591 -10.618 1289 HA ALA 73 HA ALA 163 -12.918 -14.155 -9.483 1290 1HB ALA 73 2HB ALA 163 -15.213 -13.595 -9.133 1291 2HB ALA 73 3HB ALA 163 -15.207 -14.463 -7.532 1292 3HB ALA 73 1HB ALA 163 -14.194 -13.019 -7.797 1293 H SER 74 H SER 164 -11.704 -13.501 -8.356 1294 HA SER 74 HA SER 164 -11.811 -13.665 -5.511 1295 1HB SER 74 1HB SER 164 -9.042 -14.631 -6.618 1296 2HB SER 74 2HB SER 164 -9.251 -14.053 -4.961 1297 HG SER 74 HG SER 164 -10.813 -15.670 -4.650 1298 H LYS 75 H LYS 165 -11.669 -11.648 -4.897 1299 HA LYS 75 HA LYS 165 -10.815 -9.464 -6.712 1300 1HB LYS 75 2HB LYS 165 -11.258 -8.653 -3.901 1301 2HB LYS 75 1HB LYS 165 -11.684 -7.922 -5.419 1302 1HG LYS 75 1HG LYS 165 -13.591 -9.539 -5.707 1303 2HG LYS 75 2HG LYS 165 -13.155 -10.316 -4.182 1304 1HD LYS 75 1HD LYS 165 -13.562 -8.119 -2.960 1305 2HD LYS 75 2HD LYS 165 -14.083 -7.393 -4.486 1306 1HE LYS 75 1HE LYS 165 -15.936 -9.123 -4.683 1307 2HE LYS 75 2HE LYS 165 -15.410 -9.864 -3.165 1308 1HZ LYS 75 1HZ LYS 165 -15.901 -7.806 -2.026 1309 2HZ LYS 75 2HZ LYS 165 -17.223 -8.376 -2.799 1310 H VAL 76 H VAL 166 -8.630 -8.754 -7.013 1311 HA VAL 76 HA VAL 166 -6.639 -9.679 -5.112 1312 HB VAL 76 HB VAL 166 -7.303 -9.571 -7.962 1313 1HG1 VAL 76 3HG2 VAL 166 -5.984 -7.670 -8.192 1314 2HG1 VAL 76 1HG2 VAL 166 -4.599 -8.494 -7.417 1315 3HG1 VAL 76 2HG2 VAL 166 -5.308 -9.087 -9.004 1316 1HG2 VAL 76 3HG1 VAL 166 -6.815 -11.588 -6.741 1317 2HG2 VAL 76 1HG1 VAL 166 -5.808 -11.361 -8.187 1318 3HG2 VAL 76 2HG1 VAL 166 -5.106 -11.055 -6.555 1319 HA PRO 77 HA PRO 167 -6.630 -5.171 -4.147 1320 1HB PRO 77 1HB PRO 167 -5.259 -5.271 -1.731 1321 2HB PRO 77 2HB PRO 167 -6.841 -6.029 -1.909 1322 1HG PRO 77 1HG PRO 167 -4.100 -7.395 -2.140 1323 2HG PRO 77 2HG PRO 167 -5.462 -7.892 -1.131 1324 1HD PRO 77 1HD PRO 167 -4.988 -8.942 -3.776 1325 2HD PRO 77 2HD PRO 167 -6.643 -8.826 -3.119 1326 H ALA 78 H ALA 168 -5.610 -3.685 -4.784 1327 HA ALA 78 HA ALA 168 -2.612 -3.771 -5.418 1328 1HB ALA 78 3HB ALA 168 -4.313 -4.170 -7.313 1329 2HB ALA 78 1HB ALA 168 -4.896 -2.509 -7.063 1330 3HB ALA 78 2HB ALA 168 -3.214 -2.796 -7.569 1331 H PHE 79 H PHE 169 -1.787 -1.668 -5.816 1332 HA PHE 79 HA PHE 169 -2.718 0.734 -4.084 1333 1HB PHE 79 2HB PHE 169 -1.801 -0.324 -2.402 1334 2HB PHE 79 1HB PHE 169 -0.355 -0.827 -3.362 1335 HD1 PHE 79 HD2 PHE 169 -1.926 2.158 -1.726 1336 HD2 PHE 79 HD1 PHE 169 1.597 0.549 -3.581 1337 HE1 PHE 79 HE2 PHE 169 -0.636 4.118 -0.991 1338 HE2 PHE 79 HE1 PHE 169 2.863 2.535 -2.891 1339 HZ PHE 79 HZ PHE 169 1.753 4.331 -1.621 1340 H LYS 80 H LYS 170 -2.302 2.113 -5.552 1341 HA LYS 80 HA LYS 170 -0.021 2.291 -7.726 1342 1HB LYS 80 2HB LYS 170 -2.387 4.128 -7.259 1343 2HB LYS 80 1HB LYS 170 -1.064 4.423 -8.388 1344 1HG LYS 80 1HG LYS 170 -1.619 2.281 -9.617 1345 2HG LYS 80 2HG LYS 170 -2.966 1.995 -8.515 1346 1HD LYS 80 1HD LYS 170 -4.034 4.167 -9.268 1347 2HD LYS 80 2HD LYS 170 -2.698 4.430 -10.393 1348 1HE LYS 80 1HE LYS 170 -3.304 2.272 -11.600 1349 2HE LYS 80 2HE LYS 170 -4.622 1.996 -10.450 1350 1HZ LYS 80 1HZ LYS 170 -5.607 4.098 -11.174 1351 2HZ LYS 80 2HZ LYS 170 -4.393 4.354 -12.239 1352 HA PRO 81 HA PRO 171 2.135 4.799 -4.594 1353 1HB PRO 81 1HB PRO 171 4.388 5.460 -6.019 1354 2HB PRO 81 2HB PRO 171 4.046 3.788 -5.569 1355 1HG PRO 81 1HG PRO 171 3.456 5.132 -8.266 1356 2HG PRO 81 2HG PRO 171 4.357 3.620 -7.982 1357 1HD PRO 81 1HD PRO 171 1.631 3.696 -8.599 1358 2HD PRO 81 2HD PRO 171 2.334 2.399 -7.578 1359 H GLY 82 H GLY 172 -0.094 5.951 -5.973 1360 1HA GLY 82 1HA GLY 172 -1.052 7.848 -7.107 1361 2HA GLY 82 2HA GLY 172 -0.244 8.601 -5.747 1362 H LYS 83 H LYS 173 1.783 7.317 -8.150 1363 HA LYS 83 HA LYS 173 3.365 8.330 -9.694 1364 1HB LYS 83 2HB LYS 173 1.155 10.335 -9.940 1365 2HB LYS 83 1HB LYS 173 2.688 11.092 -10.072 1366 1HG LYS 83 1HG LYS 173 2.064 10.588 -12.284 1367 2HG LYS 83 2HG LYS 173 3.321 9.422 -11.953 1368 1HD LYS 83 1HD LYS 173 0.299 8.766 -11.729 1369 2HD LYS 83 2HD LYS 173 1.173 8.704 -13.251 1370 1HE LYS 83 1HE LYS 173 2.758 6.954 -12.306 1371 2HE LYS 83 2HE LYS 173 1.837 6.943 -10.799 1372 1HZ LYS 83 1HZ LYS 173 -0.131 6.310 -12.069 1373 2HZ LYS 83 2HZ LYS 173 0.719 6.305 -13.465 1374 H ALA 84 H ALA 174 2.321 10.361 -7.261 1375 HA ALA 84 HA ALA 174 4.508 12.167 -6.677 1376 1HB ALA 84 2HB ALA 174 2.110 12.371 -5.985 1377 2HB ALA 84 3HB ALA 174 2.239 10.891 -4.997 1378 3HB ALA 84 1HB ALA 174 3.153 12.349 -4.522 1379 H LEU 85 H LEU 175 3.655 8.994 -5.017 1380 HA LEU 85 HA LEU 175 6.096 8.959 -3.399 1381 1HB LEU 85 2HB LEU 175 4.077 7.736 -2.649 1382 2HB LEU 85 1HB LEU 175 4.088 6.758 -4.105 1383 HG LEU 85 HG LEU 175 6.454 6.120 -3.478 1384 1HD1 LEU 85 1HD1 LEU 175 6.860 7.695 -1.583 1385 2HD1 LEU 85 2HD1 LEU 175 5.569 6.896 -0.651 1386 3HD1 LEU 85 3HD1 LEU 175 7.063 6.012 -1.058 1387 1HD2 LEU 85 2HD2 LEU 175 4.517 4.502 -3.424 1388 2HD2 LEU 85 3HD2 LEU 175 5.638 4.140 -2.105 1389 3HD2 LEU 85 1HD2 LEU 175 4.115 5.006 -1.767 1390 H LYS 86 H LYS 176 5.144 7.720 -6.586 1391 HA LYS 86 HA LYS 176 7.578 6.237 -7.189 1392 1HB LYS 86 1HB LYS 176 5.340 6.301 -8.569 1393 2HB LYS 86 2HB LYS 176 6.025 7.683 -9.398 1394 1HG LYS 86 1HG LYS 176 8.019 6.256 -10.067 1395 2HG LYS 86 2HG LYS 176 7.312 4.884 -9.213 1396 1HD LYS 86 1HD LYS 176 5.289 4.972 -10.726 1397 2HD LYS 86 2HD LYS 176 5.977 6.361 -11.577 1398 1HE LYS 86 1HE LYS 176 7.966 4.951 -12.291 1399 2HE LYS 86 2HE LYS 176 7.293 3.558 -11.429 1400 1HZ LYS 86 1HZ LYS 176 5.949 4.986 -13.658 1401 2HZ LYS 86 2HZ LYS 176 5.339 3.693 -12.866 1402 H ASP 87 H ASP 177 7.088 9.748 -7.123 1403 HA ASP 87 HA ASP 177 9.740 10.313 -8.382 1404 1HB ASP 87 1HB ASP 177 7.245 11.720 -7.953 1405 2HB ASP 87 2HB ASP 177 8.280 12.420 -6.777 1406 HD1 ASP 87 HD2 ASP 177 10.329 14.037 -9.128 1407 H ALA 88 H ALA 178 8.340 10.264 -5.074 1408 HA ALA 88 HA ALA 178 10.586 11.130 -3.458 1409 1HB ALA 88 3HB ALA 178 8.245 10.484 -2.530 1410 2HB ALA 88 1HB ALA 178 8.617 8.785 -2.840 1411 3HB ALA 88 2HB ALA 178 9.566 9.651 -1.657 1412 H VAL 89 H VAL 179 9.813 7.884 -4.783 1413 HA VAL 89 HA VAL 179 11.989 6.522 -3.379 1414 HB VAL 89 HB VAL 179 9.303 6.196 -3.635 1415 1HG1 VAL 89 2HG2 VAL 179 9.487 6.246 -6.212 1416 2HG1 VAL 89 3HG2 VAL 179 10.098 4.589 -6.106 1417 3HG1 VAL 89 1HG2 VAL 179 8.487 5.012 -5.440 1418 1HG2 VAL 89 1HG1 VAL 179 10.658 4.814 -2.380 1419 2HG2 VAL 89 2HG1 VAL 179 9.389 3.956 -3.293 1420 3HG2 VAL 89 3HG1 VAL 179 11.112 3.854 -3.853 1421 H LYS 90 H LYS 180 11.708 7.921 -6.496 1422 HA LYS 90 HA LYS 180 13.259 6.036 -8.119 1423 1HB LYS 90 1HB LYS 180 12.047 8.803 -8.367 1424 2HB LYS 90 2HB LYS 180 13.515 8.641 -9.282 1425 1HG LYS 90 1HG LYS 180 12.646 6.676 -10.523 1426 2HG LYS 90 2HG LYS 180 11.193 6.644 -9.528 1427 1HD LYS 90 1HD LYS 180 10.622 9.008 -10.346 1428 2HD LYS 90 2HD LYS 180 12.035 8.952 -11.405 1429 1HE LYS 90 1HE LYS 180 11.049 6.934 -12.601 1430 2HE LYS 90 2HE LYS 180 9.645 6.985 -11.524 1431 1HZ LYS 90 1HZ LYS 180 9.172 8.091 -13.572 1432 2HZ LYS 90 2HZ LYS 180 9.124 9.181 -12.355 Start of MODEL 10 Raw file had 1432 H/Q atoms Start of MODEL 10 1 1H MET 1 1H MET 1 -11.565 6.118 -1.788 2 2H MET 1 2H MET 1 -12.922 6.923 -2.214 3 HA MET 1 HA MET 1 -12.981 8.121 -0.167 4 1HB MET 1 1HB MET 1 -10.409 6.571 0.531 5 2HB MET 1 2HB MET 1 -10.989 7.963 1.405 6 1HG MET 1 1HG MET 1 -13.240 6.662 1.760 7 2HG MET 1 2HG MET 1 -12.371 5.223 1.219 8 1HE MET 1 2HE MET 1 -10.846 3.813 2.671 9 2HE MET 1 1HE MET 1 -9.519 5.023 2.681 10 3HE MET 1 3HE MET 1 -10.084 4.319 4.201 11 H ASN 2 H ASN 2 -9.751 8.869 -0.140 12 HA ASN 2 HA ASN 2 -9.002 10.089 -2.352 13 1HB ASN 2 1HB ASN 2 -9.578 12.316 -2.769 14 2HB ASN 2 2HB ASN 2 -11.031 11.379 -2.771 15 1HD2 ASN 2 1HD2 ASN 2 -10.762 14.467 -0.136 16 2HD2 ASN 2 2HD2 ASN 2 -9.302 13.807 -1.034 17 H LYS 3 H LYS 3 -9.485 10.842 0.925 18 HA LYS 3 HA LYS 3 -7.243 10.731 2.279 19 1HB LYS 3 1HB LYS 3 -5.906 12.138 0.551 20 2HB LYS 3 2HB LYS 3 -6.797 13.545 1.071 21 1HG LYS 3 1HG LYS 3 -5.800 13.244 3.403 22 2HG LYS 3 2HG LYS 3 -5.081 11.713 2.904 23 1HD LYS 3 1HD LYS 3 -3.671 12.961 1.189 24 2HD LYS 3 2HD LYS 3 -4.354 14.485 1.774 25 1HE LYS 3 1HE LYS 3 -3.408 13.993 4.099 26 2HE LYS 3 2HE LYS 3 -2.718 12.483 3.483 27 1HZ LYS 3 1HZ LYS 3 -2.062 15.190 2.463 28 2HZ LYS 3 2HZ LYS 3 -1.433 13.795 1.890 29 H THR 4 H THR 4 -9.987 12.900 1.581 30 HA THR 4 HA THR 4 -10.067 14.018 4.260 31 HB THR 4 HB THR 4 -11.545 14.415 1.585 32 HG1 THR 4 HG1 THR 4 -10.472 16.424 1.694 33 1HG2 THR 4 3HG2 THR 4 -11.793 15.754 4.282 34 2HG2 THR 4 1HG2 THR 4 -12.439 16.426 2.707 35 3HG2 THR 4 2HG2 THR 4 -13.040 14.847 3.350 36 H GLU 5 H GLU 5 -11.611 11.642 2.230 37 HA GLU 5 HA GLU 5 -13.981 11.093 4.004 38 1HB GLU 5 1HB GLU 5 -12.749 9.199 1.940 39 2HB GLU 5 2HB GLU 5 -14.299 9.008 2.724 40 1HG GLU 5 1HG GLU 5 -13.518 11.098 0.618 41 2HG GLU 5 2HG GLU 5 -14.507 9.688 0.357 42 HE1 GLU 5 HE2 GLU 5 -17.426 11.001 1.731 43 H LEU 6 H LEU 6 -10.481 10.506 3.985 44 HA LEU 6 HA LEU 6 -10.487 8.170 5.700 45 1HB LEU 6 2HB LEU 6 -8.687 9.754 3.942 46 2HB LEU 6 1HB LEU 6 -8.101 10.131 5.506 47 HG LEU 6 HG LEU 6 -7.051 8.151 5.364 48 1HD1 LEU 6 2HD1 LEU 6 -8.586 6.994 6.802 49 2HD1 LEU 6 3HD1 LEU 6 -9.422 6.304 5.390 50 3HD1 LEU 6 1HD1 LEU 6 -7.734 5.881 5.707 51 1HD2 LEU 6 1HD2 LEU 6 -7.225 8.258 2.863 52 2HD2 LEU 6 2HD2 LEU 6 -7.093 6.569 3.385 53 3HD2 LEU 6 3HD2 LEU 6 -8.678 7.244 2.915 54 H ILE 7 H ILE 7 -10.133 11.709 5.958 55 HA ILE 7 HA ILE 7 -9.386 11.906 8.740 56 HB ILE 7 HB ILE 7 -11.125 13.942 7.209 57 1HG1 ILE 7 1HG1 ILE 7 -8.064 13.710 7.272 58 2HG1 ILE 7 2HG1 ILE 7 -9.040 13.275 5.941 59 1HG2 ILE 7 2HG2 ILE 7 -10.904 14.341 9.708 60 2HG2 ILE 7 3HG2 ILE 7 -9.142 14.333 9.536 61 3HG2 ILE 7 1HG2 ILE 7 -10.112 15.605 8.751 62 1HD1 ILE 7 3HD1 ILE 7 -9.943 15.585 5.662 63 2HD1 ILE 7 1HD1 ILE 7 -8.798 16.141 6.884 64 3HD1 ILE 7 2HD1 ILE 7 -8.190 15.381 5.384 65 H ASN 8 H ASN 8 -12.619 12.000 7.220 66 HA ASN 8 HA ASN 8 -14.020 11.815 9.859 67 1HB ASN 8 1HB ASN 8 -15.152 11.111 7.035 68 2HB ASN 8 2HB ASN 8 -16.120 11.242 8.482 69 1HD2 ASN 8 2HD2 ASN 8 -15.247 14.688 6.485 70 2HD2 ASN 8 1HD2 ASN 8 -14.542 13.069 5.985 71 H ALA 9 H ALA 9 -12.325 9.403 8.224 72 HA ALA 9 HA ALA 9 -13.815 7.076 9.433 73 1HB ALA 9 2HB ALA 9 -12.086 6.821 7.313 74 2HB ALA 9 3HB ALA 9 -10.802 7.164 8.458 75 3HB ALA 9 1HB ALA 9 -11.713 5.755 8.734 76 H VAL 10 H VAL 10 -10.856 9.014 10.069 77 HA VAL 10 HA VAL 10 -10.020 7.308 12.146 78 HB VAL 10 HB VAL 10 -8.834 10.076 11.854 79 1HG1 VAL 10 3HG2 VAL 10 -8.051 8.134 13.470 80 2HG1 VAL 10 1HG2 VAL 10 -7.163 7.599 11.999 81 3HG1 VAL 10 2HG2 VAL 10 -6.902 9.231 12.632 82 1HG2 VAL 10 1HG1 VAL 10 -8.682 7.870 9.819 83 2HG2 VAL 10 2HG1 VAL 10 -8.990 9.649 9.704 84 3HG2 VAL 10 3HG1 VAL 10 -7.328 9.068 10.038 85 H ALA 11 H ALA 11 -11.176 10.483 11.933 86 HA ALA 11 HA ALA 11 -11.309 10.851 14.758 87 1HB ALA 11 2HB ALA 11 -11.387 12.827 13.088 88 2HB ALA 11 3HB ALA 11 -12.890 12.207 12.385 89 3HB ALA 11 1HB ALA 11 -12.902 12.905 14.019 90 H GLU 12 H GLU 12 -13.649 9.264 12.497 91 HA GLU 12 HA GLU 12 -15.874 9.316 14.505 92 1HB GLU 12 1HB GLU 12 -16.414 9.300 12.053 93 2HB GLU 12 2HB GLU 12 -15.649 7.724 11.891 94 1HG GLU 12 1HG GLU 12 -18.036 7.411 11.936 95 2HG GLU 12 2HG GLU 12 -17.398 6.712 13.410 96 HE2 GLU 12 HE2 GLU 12 -19.099 8.830 15.540 97 H THR 13 H THR 13 -13.468 6.864 13.278 98 HA THR 13 HA THR 13 -14.304 5.143 15.633 99 HB THR 13 HB THR 13 -14.095 4.446 13.177 100 HG1 THR 13 HG1 THR 13 -14.712 3.192 14.970 101 1HG2 THR 13 2HG2 THR 13 -11.266 3.700 13.989 102 2HG2 THR 13 3HG2 THR 13 -12.177 3.041 12.602 103 3HG2 THR 13 1HG2 THR 13 -11.786 4.765 12.653 104 H SER 14 H SER 14 -12.492 7.412 15.713 105 HA SER 14 HA SER 14 -10.904 6.283 18.113 106 1HB SER 14 1HB SER 14 -9.584 8.345 16.251 107 2HB SER 14 2HB SER 14 -8.853 7.486 17.595 108 HG SER 14 HG SER 14 -8.350 6.591 15.592 109 H GLY 15 H GLY 15 -12.631 9.127 16.918 110 1HA GLY 15 1HA GLY 15 -13.507 10.969 18.213 111 2HA GLY 15 2HA GLY 15 -12.668 10.388 19.660 112 H LEU 16 H LEU 16 -11.629 11.444 16.447 113 HA LEU 16 HA LEU 16 -9.845 13.501 17.674 114 1HB LEU 16 1HB LEU 16 -10.017 12.524 14.762 115 2HB LEU 16 2HB LEU 16 -8.697 13.378 15.466 116 HG LEU 16 HG LEU 16 -9.527 10.527 16.322 117 1HD1 LEU 16 3HD2 LEU 16 -8.582 10.487 14.010 118 2HD1 LEU 16 1HD2 LEU 16 -7.072 11.242 14.607 119 3HD1 LEU 16 2HD2 LEU 16 -7.582 9.648 15.200 120 1HD2 LEU 16 1HD1 LEU 16 -7.100 12.280 16.831 121 2HD2 LEU 16 2HD1 LEU 16 -8.397 11.847 18.019 122 3HD2 LEU 16 3HD1 LEU 16 -7.311 10.556 17.379 123 H SER 17 H SER 17 -9.462 15.134 16.573 124 HA SER 17 HA SER 17 -11.667 17.000 15.536 125 1HB SER 17 1HB SER 17 -8.716 17.719 15.575 126 2HB SER 17 2HB SER 17 -10.080 18.793 15.302 127 HG SER 17 HG SER 17 -9.573 17.340 17.683 128 H LYS 18 H LYS 18 -11.575 17.883 13.454 129 HA LYS 18 HA LYS 18 -10.883 15.993 11.251 130 1HB LYS 18 1HB LYS 18 -11.601 18.956 10.838 131 2HB LYS 18 2HB LYS 18 -11.590 17.708 9.613 132 1HG LYS 18 1HG LYS 18 -13.603 17.962 11.936 133 2HG LYS 18 2HG LYS 18 -13.838 18.431 10.274 134 1HD LYS 18 1HD LYS 18 -15.012 16.475 10.333 135 2HD LYS 18 2HD LYS 18 -13.514 15.924 9.599 136 1HE LYS 18 1HE LYS 18 -12.782 14.875 11.741 137 2HE LYS 18 2HE LYS 18 -14.079 15.669 12.642 138 1HZ LYS 18 1HZ LYS 18 -14.640 13.416 12.171 139 2HZ LYS 18 2HZ LYS 18 -15.686 14.400 11.390 140 H LYS 19 H LYS 19 -9.427 18.986 12.487 141 HA LYS 19 HA LYS 19 -7.046 18.804 10.732 142 1HB LYS 19 2HB LYS 19 -7.368 20.218 13.452 143 2HB LYS 19 1HB LYS 19 -5.910 20.332 12.472 144 1HG LYS 19 1HG LYS 19 -8.699 21.331 11.614 145 2HG LYS 19 2HG LYS 19 -7.421 22.317 12.305 146 1HD LYS 19 1HD LYS 19 -5.913 21.774 10.341 147 2HD LYS 19 2HD LYS 19 -7.207 20.810 9.620 148 1HE LYS 19 1HE LYS 19 -8.697 22.865 9.522 149 2HE LYS 19 2HE LYS 19 -7.403 23.838 10.237 150 1HZ LYS 19 1HZ LYS 19 -7.250 22.380 7.656 151 2HZ LYS 19 2HZ LYS 19 -7.458 23.991 7.834 152 H ASP 20 H ASP 20 -7.784 17.321 14.017 153 HA ASP 20 HA ASP 20 -4.943 16.324 14.132 154 1HB ASP 20 1HB ASP 20 -7.351 15.589 15.927 155 2HB ASP 20 2HB ASP 20 -5.750 14.890 16.119 156 HD1 ASP 20 HD2 ASP 20 -4.159 17.692 17.386 157 H ALA 21 H ALA 21 -7.997 14.809 13.144 158 HA ALA 21 HA ALA 21 -6.808 12.171 12.565 159 1HB ALA 21 2HB ALA 21 -9.410 13.653 11.767 160 2HB ALA 21 3HB ALA 21 -9.032 12.042 11.145 161 3HB ALA 21 1HB ALA 21 -9.181 12.305 12.876 162 H THR 22 H THR 22 -7.012 15.130 10.520 163 HA THR 22 HA THR 22 -5.990 13.593 8.214 164 HB THR 22 HB THR 22 -7.379 15.528 8.215 165 HG1 THR 22 HG1 THR 22 -6.369 14.313 6.451 166 1HG2 THR 22 1HG2 THR 22 -6.558 17.509 8.908 167 2HG2 THR 22 2HG2 THR 22 -5.271 17.480 7.609 168 3HG2 THR 22 3HG2 THR 22 -6.998 17.526 7.196 169 H LYS 23 H LYS 23 -4.593 15.718 10.488 170 HA LYS 23 HA LYS 23 -1.793 15.817 9.667 171 1HB LYS 23 2HB LYS 23 -3.700 15.758 12.142 172 2HB LYS 23 1HB LYS 23 -1.984 15.725 12.543 173 1HG LYS 23 1HG LYS 23 -1.518 17.873 11.281 174 2HG LYS 23 2HG LYS 23 -3.243 18.062 10.983 175 1HD LYS 23 1HD LYS 23 -3.633 18.057 13.521 176 2HD LYS 23 2HD LYS 23 -1.891 17.929 13.764 177 1HE LYS 23 1HE LYS 23 -1.564 20.149 12.566 178 2HE LYS 23 2HE LYS 23 -3.311 20.261 12.295 179 1HZ LYS 23 1HZ LYS 23 -2.013 20.119 14.960 180 2HZ LYS 23 2HZ LYS 23 -3.624 20.227 14.705 181 H ALA 24 H ALA 24 -3.656 13.563 11.633 182 HA ALA 24 HA ALA 24 -1.491 11.765 12.350 183 1HB ALA 24 3HB ALA 24 -4.511 11.491 12.382 184 2HB ALA 24 1HB ALA 24 -3.354 10.350 13.158 185 3HB ALA 24 2HB ALA 24 -3.412 12.055 13.686 186 H VAL 25 H VAL 25 -3.984 11.469 9.721 187 HA VAL 25 HA VAL 25 -2.871 9.061 8.344 188 HB VAL 25 HB VAL 25 -4.474 11.741 7.746 189 1HG1 VAL 25 1HG2 VAL 25 -3.723 9.833 5.464 190 2HG1 VAL 25 2HG2 VAL 25 -4.888 11.199 5.370 191 3HG1 VAL 25 3HG2 VAL 25 -3.187 11.508 5.650 192 1HG2 VAL 25 3HG1 VAL 25 -5.700 9.810 8.765 193 2HG2 VAL 25 1HG1 VAL 25 -6.394 10.425 7.262 194 3HG2 VAL 25 2HG1 VAL 25 -5.468 8.896 7.242 195 H ASP 26 H ASP 26 -2.243 12.586 7.726 196 HA ASP 26 HA ASP 26 0.180 12.092 6.135 197 1HB ASP 26 1HB ASP 26 -1.223 14.243 6.202 198 2HB ASP 26 2HB ASP 26 -0.506 14.634 7.753 199 HD2 ASP 26 HD2 ASP 26 1.414 15.393 7.797 200 H ALA 27 H ALA 27 -0.216 11.717 9.482 201 HA ALA 27 HA ALA 27 2.608 12.072 10.324 202 1HB ALA 27 1HB ALA 27 0.475 12.418 11.831 203 2HB ALA 27 2HB ALA 27 0.518 10.671 11.975 204 3HB ALA 27 3HB ALA 27 1.880 11.693 12.482 205 H VAL 28 H VAL 28 0.486 9.363 9.658 206 HA VAL 28 HA VAL 28 2.469 7.188 9.886 207 HB VAL 28 HB VAL 28 -0.006 7.218 7.980 208 1HG1 VAL 28 2HG2 VAL 28 1.969 5.171 8.774 209 2HG1 VAL 28 3HG2 VAL 28 0.304 4.646 9.087 210 3HG1 VAL 28 1HG2 VAL 28 0.712 5.227 7.479 211 1HG2 VAL 28 2HG1 VAL 28 -0.054 6.631 10.921 212 2HG2 VAL 28 3HG1 VAL 28 -1.031 7.768 9.914 213 3HG2 VAL 28 1HG1 VAL 28 -1.274 6.030 9.715 214 H PHE 29 H PHE 29 0.976 8.739 7.222 215 HA PHE 29 HA PHE 29 2.639 7.788 5.031 216 1HB PHE 29 2HB PHE 29 0.604 9.989 4.830 217 2HB PHE 29 1HB PHE 29 1.325 9.118 3.479 218 HD1 PHE 29 HD2 PHE 29 1.320 6.304 4.001 219 HD2 PHE 29 HD1 PHE 29 -1.623 9.197 5.166 220 HE1 PHE 29 HE2 PHE 29 -0.235 4.496 4.515 221 HE2 PHE 29 HE1 PHE 29 -3.177 7.370 5.720 222 HZ PHE 29 HZ PHE 29 -2.420 5.011 5.470 223 H ASP 30 H ASP 30 3.330 10.447 7.064 224 HA ASP 30 HA ASP 30 5.393 11.477 5.142 225 1HB ASP 30 1HB ASP 30 4.355 12.899 7.012 226 2HB ASP 30 2HB ASP 30 5.339 12.055 8.172 227 HD2 ASP 30 HD2 ASP 30 7.782 14.393 7.838 228 H SER 31 H SER 31 5.292 9.415 7.848 229 HA SER 31 HA SER 31 8.256 9.024 8.217 230 1HB SER 31 1HB SER 31 6.185 7.102 9.344 231 2HB SER 31 2HB SER 31 7.849 7.360 9.874 232 HG SER 31 HG SER 31 5.782 9.285 10.014 233 H ILE 32 H ILE 32 5.627 7.125 6.548 234 HA ILE 32 HA ILE 32 7.244 4.958 5.622 235 HB ILE 32 HB ILE 32 5.260 6.219 3.794 236 1HG1 ILE 32 1HG1 ILE 32 4.089 6.551 5.602 237 2HG1 ILE 32 2HG1 ILE 32 3.372 5.649 4.245 238 1HG2 ILE 32 3HG2 ILE 32 6.697 3.939 3.629 239 2HG2 ILE 32 1HG2 ILE 32 5.223 3.282 4.389 240 3HG2 ILE 32 2HG2 ILE 32 5.150 4.121 2.801 241 1HD1 ILE 32 3HD1 ILE 32 3.104 3.657 5.710 242 2HD1 ILE 32 1HD1 ILE 32 3.591 4.719 7.109 243 3HD1 ILE 32 2HD1 ILE 32 2.208 5.112 6.087 244 H THR 33 H THR 33 6.446 8.109 4.062 245 HA THR 33 HA THR 33 8.293 7.684 1.792 246 HB THR 33 HB THR 33 6.606 9.234 1.461 247 HG1 THR 33 HG1 THR 33 8.494 9.314 0.269 248 1HG2 THR 33 1HG2 THR 33 8.047 11.253 3.285 249 2HG2 THR 33 2HG2 THR 33 6.698 11.638 2.176 250 3HG2 THR 33 3HG2 THR 33 6.436 10.532 3.538 251 H GLU 34 H GLU 34 9.049 8.595 4.985 252 HA GLU 34 HA GLU 34 11.918 9.273 4.268 253 1HB GLU 34 1HB GLU 34 10.455 9.121 7.006 254 2HB GLU 34 2HB GLU 34 12.192 9.001 6.924 255 1HG GLU 34 1HG GLU 34 11.882 11.252 7.394 256 2HG GLU 34 2HG GLU 34 12.310 11.243 5.697 257 HE1 GLU 34 HE2 GLU 34 8.698 12.493 7.024 258 H ALA 35 H ALA 35 9.950 6.430 5.252 259 HA ALA 35 HA ALA 35 12.347 4.749 5.570 260 1HB ALA 35 3HB ALA 35 9.986 3.942 6.504 261 2HB ALA 35 1HB ALA 35 9.477 3.770 4.820 262 3HB ALA 35 2HB ALA 35 10.732 2.734 5.454 263 H LEU 36 H LEU 36 9.920 4.914 2.806 264 HA LEU 36 HA LEU 36 11.569 3.336 0.993 265 1HB LEU 36 2HB LEU 36 9.467 5.381 0.475 266 2HB LEU 36 1HB LEU 36 10.014 4.223 -0.676 267 HG LEU 36 HG LEU 36 8.595 3.911 1.411 268 1HD1 LEU 36 1HD2 LEU 36 10.452 1.618 1.516 269 2HD1 LEU 36 2HD2 LEU 36 9.515 2.406 2.814 270 3HD1 LEU 36 3HD2 LEU 36 8.809 1.114 1.882 271 1HD2 LEU 36 2HD1 LEU 36 6.813 3.740 0.547 272 2HD2 LEU 36 3HD1 LEU 36 7.142 1.988 0.437 273 3HD2 LEU 36 1HD1 LEU 36 7.111 2.721 2.018 274 NH1 ARG 37 NH2 ARG 37 12.875 14.398 0.256 275 NH2 ARG 37 NH1 ARG 37 14.311 14.622 -1.494 276 H ARG 37 H ARG 37 11.362 6.963 1.421 277 HA ARG 37 HA ARG 37 13.050 7.342 -0.818 278 1HB ARG 37 1HB ARG 37 11.713 9.203 0.175 279 2HB ARG 37 2HB ARG 37 12.821 9.267 1.556 280 1HG ARG 37 1HG ARG 37 14.693 9.879 -0.168 281 2HG ARG 37 2HG ARG 37 13.416 9.955 -1.382 282 1HD ARG 37 1HD ARG 37 12.207 11.640 0.219 283 2HD ARG 37 2HD ARG 37 13.676 11.613 1.213 284 1HH1 ARG 37 2HH2 ARG 37 12.406 13.766 0.914 285 2HH1 ARG 37 1HH2 ARG 37 12.782 15.419 0.211 286 1HH2 ARG 37 1HH1 ARG 37 14.934 14.165 -2.168 287 2HH2 ARG 37 2HH1 ARG 37 14.117 15.627 -1.417 288 H LYS 38 H LYS 38 13.879 6.358 2.519 289 HA LYS 38 HA LYS 38 16.808 7.151 2.130 290 1HB LYS 38 1HB LYS 38 15.369 6.332 4.712 291 2HB LYS 38 2HB LYS 38 17.084 6.637 4.584 292 1HG LYS 38 1HG LYS 38 16.754 9.008 3.976 293 2HG LYS 38 2HG LYS 38 15.013 8.799 3.925 294 1HD LYS 38 1HD LYS 38 15.523 9.867 6.018 295 2HD LYS 38 2HD LYS 38 14.931 8.259 6.353 296 1HE LYS 38 1HE LYS 38 16.742 8.695 7.887 297 2HE LYS 38 2HE LYS 38 17.312 7.455 6.778 298 1HZ LYS 38 1HZ LYS 38 18.470 9.222 5.536 299 2HZ LYS 38 2HZ LYS 38 17.935 10.357 6.583 300 H GLY 39 H GLY 39 15.145 4.549 1.183 301 1HA GLY 39 1HA GLY 39 15.766 2.262 0.746 302 2HA GLY 39 2HA GLY 39 17.376 2.593 1.362 303 H ASP 40 H ASP 40 14.241 2.873 2.945 304 HA ASP 40 HA ASP 40 14.858 0.667 4.972 305 1HB ASP 40 1HB ASP 40 13.951 3.498 5.516 306 2HB ASP 40 2HB ASP 40 13.689 2.210 6.672 307 HD2 ASP 40 HD2 ASP 40 17.281 3.909 6.161 308 H LYS 41 H LYS 41 13.409 -0.527 5.799 309 HA LYS 41 HA LYS 41 10.780 -0.790 4.308 310 1HB LYS 41 2HB LYS 41 11.810 -2.671 6.506 311 2HB LYS 41 1HB LYS 41 10.450 -2.935 5.411 312 1HG LYS 41 1HG LYS 41 12.226 -2.863 3.473 313 2HG LYS 41 2HG LYS 41 13.447 -2.953 4.732 314 1HD LYS 41 1HD LYS 41 12.426 -5.121 5.584 315 2HD LYS 41 2HD LYS 41 11.156 -4.993 4.377 316 1HE LYS 41 1HE LYS 41 12.721 -6.597 3.535 317 2HE LYS 41 2HE LYS 41 12.873 -5.167 2.516 318 1HZ LYS 41 1HZ LYS 41 15.013 -6.051 3.104 319 2HZ LYS 41 2HZ LYS 41 14.861 -4.558 3.752 320 H VAL 42 H VAL 42 8.781 -0.277 5.315 321 HA VAL 42 HA VAL 42 8.609 0.932 7.874 322 HB VAL 42 HB VAL 42 6.587 0.006 5.795 323 1HG1 VAL 42 1HG2 VAL 42 6.636 2.357 7.707 324 2HG1 VAL 42 2HG2 VAL 42 5.405 2.111 6.418 325 3HG1 VAL 42 3HG2 VAL 42 5.515 0.949 7.766 326 1HG2 VAL 42 2HG1 VAL 42 8.488 1.624 4.752 327 2HG2 VAL 42 3HG1 VAL 42 6.828 2.079 4.609 328 3HG2 VAL 42 1HG1 VAL 42 7.803 2.873 5.835 329 H GLN 43 H GLN 43 6.068 -0.478 8.083 330 HA GLN 43 HA GLN 43 5.514 -2.641 8.312 331 1HB GLN 43 1HB GLN 43 7.605 -3.355 10.238 332 2HB GLN 43 2HB GLN 43 6.079 -4.243 10.317 333 1HG GLN 43 1HG GLN 43 6.141 -4.842 7.990 334 2HG GLN 43 2HG GLN 43 7.531 -3.858 7.653 335 1HE2 GLN 43 2HE2 GLN 43 9.846 -6.428 8.682 336 2HE2 GLN 43 1HE2 GLN 43 9.567 -4.762 7.968 337 H LEU 44 H LEU 44 3.827 -3.570 8.931 338 HA LEU 44 HA LEU 44 2.192 -2.354 11.189 339 1HB LEU 44 2HB LEU 44 0.944 -2.870 8.413 340 2HB LEU 44 1HB LEU 44 0.240 -2.069 9.808 341 HG LEU 44 HG LEU 44 2.328 -0.357 9.329 342 1HD1 LEU 44 2HD1 LEU 44 3.203 -1.659 7.321 343 2HD1 LEU 44 3HD1 LEU 44 1.667 -1.365 6.482 344 3HD1 LEU 44 1HD1 LEU 44 2.733 -0.004 6.925 345 1HD2 LEU 44 2HD2 LEU 44 -0.117 0.273 9.416 346 2HD2 LEU 44 3HD2 LEU 44 0.765 1.140 8.144 347 3HD2 LEU 44 1HD2 LEU 44 -0.301 -0.216 7.716 348 H ILE 45 H ILE 45 1.934 -4.245 12.431 349 HA ILE 45 HA ILE 45 1.988 -6.899 11.168 350 HB ILE 45 HB ILE 45 3.022 -6.470 13.374 351 1HG1 ILE 45 1HG1 ILE 45 2.375 -8.633 14.475 352 2HG1 ILE 45 2HG1 ILE 45 1.048 -8.830 13.345 353 1HG2 ILE 45 1HG2 ILE 45 1.252 -5.140 14.448 354 2HG2 ILE 45 2HG2 ILE 45 0.157 -6.548 14.477 355 3HG2 ILE 45 3HG2 ILE 45 1.663 -6.556 15.444 356 1HD1 ILE 45 3HD1 ILE 45 4.048 -8.691 12.564 357 2HD1 ILE 45 1HD1 ILE 45 3.085 -10.179 12.729 358 3HD1 ILE 45 2HD1 ILE 45 2.704 -9.024 11.437 359 H GLY 46 H GLY 46 0.385 -8.420 11.131 360 1HA GLY 46 1HA GLY 46 -1.728 -9.185 10.285 361 2HA GLY 46 2HA GLY 46 -2.444 -8.092 11.446 362 H PHE 47 H PHE 47 -0.660 -6.425 8.997 363 HA PHE 47 HA PHE 47 -2.876 -6.176 7.009 364 1HB PHE 47 2HB PHE 47 -3.047 -4.623 9.049 365 2HB PHE 47 1HB PHE 47 -1.536 -3.874 8.630 366 HD1 PHE 47 HD2 PHE 47 -4.860 -4.693 6.914 367 HD2 PHE 47 HD1 PHE 47 -1.498 -2.020 7.142 368 HE1 PHE 47 HE2 PHE 47 -5.669 -3.455 4.937 369 HE2 PHE 47 HE1 PHE 47 -2.377 -0.771 5.217 370 HZ PHE 47 HZ PHE 47 -4.476 -1.523 4.118 371 H GLY 48 H GLY 48 0.618 -5.417 7.687 372 1HA GLY 48 1HA GLY 48 1.277 -5.543 4.929 373 2HA GLY 48 2HA GLY 48 1.014 -3.836 5.242 374 H ASN 49 H ASN 49 3.107 -4.747 4.104 375 HA ASN 49 HA ASN 49 5.342 -3.783 5.920 376 1HB ASN 49 1HB ASN 49 5.486 -6.246 6.144 377 2HB ASN 49 2HB ASN 49 5.454 -6.473 4.410 378 1HD2 ASN 49 1HD2 ASN 49 8.990 -6.918 5.119 379 2HD2 ASN 49 2HD2 ASN 49 7.362 -7.765 5.133 380 H PHE 50 H PHE 50 5.606 -1.949 4.787 381 HA PHE 50 HA PHE 50 5.617 -1.889 1.770 382 1HB PHE 50 2HB PHE 50 6.382 0.257 3.766 383 2HB PHE 50 1HB PHE 50 6.530 0.560 2.106 384 HD1 PHE 50 HD2 PHE 50 4.268 0.051 4.898 385 HD2 PHE 50 HD1 PHE 50 4.782 1.664 0.977 386 HE1 PHE 50 HE2 PHE 50 2.102 1.299 5.121 387 HE2 PHE 50 HE1 PHE 50 2.660 2.933 1.237 388 HZ PHE 50 HZ PHE 50 1.307 2.616 3.274 389 H GLU 51 H GLU 51 7.399 -1.527 0.548 390 HA GLU 51 HA GLU 51 9.875 -0.728 1.598 391 1HB GLU 51 1HB GLU 51 11.399 -2.744 1.313 392 2HB GLU 51 2HB GLU 51 10.176 -3.115 2.492 393 1HG GLU 51 1HG GLU 51 10.116 -4.090 -0.440 394 2HG GLU 51 2HG GLU 51 10.768 -4.993 0.910 395 HE2 GLU 51 HE2 GLU 51 6.852 -4.997 0.165 396 H VAL 52 H VAL 52 11.743 -0.478 0.155 397 HA VAL 52 HA VAL 52 10.669 0.217 -2.475 398 HB VAL 52 HB VAL 52 12.193 1.437 -0.347 399 1HG1 VAL 52 1HG2 VAL 52 14.142 0.707 -2.544 400 2HG1 VAL 52 2HG2 VAL 52 14.349 1.989 -1.294 401 3HG1 VAL 52 3HG2 VAL 52 14.183 0.263 -0.829 402 1HG2 VAL 52 3HG1 VAL 52 11.812 2.388 -3.194 403 2HG2 VAL 52 1HG1 VAL 52 10.714 2.568 -1.806 404 3HG2 VAL 52 2HG1 VAL 52 12.299 3.343 -1.773 405 NH1 ARG 53 NH2 ARG 53 8.386 -3.891 -6.296 406 NH2 ARG 53 NH1 ARG 53 8.262 -5.661 -4.880 407 H ARG 53 H ARG 53 11.907 -0.179 -4.397 408 HA ARG 53 HA ARG 53 13.528 -2.804 -4.374 409 1HB ARG 53 1HB ARG 53 11.008 -2.951 -5.058 410 2HB ARG 53 2HB ARG 53 11.445 -2.053 -6.493 411 1HG ARG 53 1HG ARG 53 13.017 -3.814 -7.217 412 2HG ARG 53 2HG ARG 53 12.781 -4.721 -5.728 413 1HD ARG 53 1HD ARG 53 10.557 -4.138 -7.814 414 2HD ARG 53 2HD ARG 53 11.506 -5.604 -7.741 415 1HH1 ARG 53 2HH2 ARG 53 8.936 -3.379 -6.995 416 2HH1 ARG 53 1HH2 ARG 53 7.451 -3.648 -5.951 417 1HH2 ARG 53 1HH1 ARG 53 8.713 -6.498 -4.494 418 2HH2 ARG 53 2HH1 ARG 53 7.336 -5.293 -4.634 419 H GLU 54 H GLU 54 15.482 -1.803 -4.581 420 HA GLU 54 HA GLU 54 16.062 0.401 -6.430 421 1HB GLU 54 1HB GLU 54 17.406 -0.113 -4.360 422 2HB GLU 54 2HB GLU 54 18.046 -1.548 -5.135 423 1HG GLU 54 1HG GLU 54 19.728 0.152 -5.318 424 2HG GLU 54 2HG GLU 54 19.105 -0.075 -6.939 425 HE2 GLU 54 HE2 GLU 54 18.799 3.439 -5.006 426 NH1 ARG 55 NH2 ARG 55 12.915 2.168 -12.761 427 NH2 ARG 55 NH1 ARG 55 14.543 3.489 -13.633 428 H ARG 55 H ARG 55 16.126 0.297 -8.548 429 HA ARG 55 HA ARG 55 16.037 -2.289 -10.032 430 1HB ARG 55 1HB ARG 55 14.574 -0.394 -10.643 431 2HB ARG 55 2HB ARG 55 15.958 0.626 -11.007 432 1HG ARG 55 1HG ARG 55 16.601 -0.817 -12.927 433 2HG ARG 55 2HG ARG 55 15.361 -1.990 -12.495 434 1HD ARG 55 1HD ARG 55 14.563 -0.721 -14.371 435 2HD ARG 55 2HD ARG 55 13.555 -0.347 -12.988 436 1HH1 ARG 55 2HH2 ARG 55 12.596 1.218 -12.541 437 2HH1 ARG 55 1HH2 ARG 55 12.410 3.043 -12.581 438 1HH2 ARG 55 1HH1 ARG 55 15.464 3.551 -14.080 439 2HH2 ARG 55 2HH1 ARG 55 13.923 4.270 -13.391 440 H ALA 56 H ALA 56 17.600 -3.141 -11.253 441 HA ALA 56 HA ALA 56 20.462 -2.259 -10.803 442 1HB ALA 56 3HB ALA 56 19.352 -4.769 -12.210 443 2HB ALA 56 1HB ALA 56 21.068 -4.418 -11.900 444 3HB ALA 56 2HB ALA 56 19.956 -4.660 -10.538 445 H ALA 57 H ALA 57 20.586 -0.395 -12.042 446 HA ALA 57 HA ALA 57 19.847 0.310 -14.506 447 1HB ALA 57 3HB ALA 57 21.381 1.714 -13.065 448 2HB ALA 57 1HB ALA 57 22.774 0.719 -13.552 449 3HB ALA 57 2HB ALA 57 21.937 1.731 -14.748 450 NH1 ARG 58 NH2 ARG 58 18.841 -6.241 -14.808 451 NH2 ARG 58 NH1 ARG 58 16.770 -5.721 -14.028 452 H ARG 58 H ARG 58 19.768 -0.130 -16.449 453 HA ARG 58 HA ARG 58 21.193 -2.562 -17.309 454 1HB ARG 58 2HB ARG 58 18.877 -1.188 -18.762 455 2HB ARG 58 1HB ARG 58 19.467 -2.802 -19.102 456 1HG ARG 58 1HG ARG 58 18.062 -1.919 -16.515 457 2HG ARG 58 2HG ARG 58 17.310 -2.732 -17.875 458 1HD ARG 58 1HD ARG 58 18.708 -4.782 -17.529 459 2HD ARG 58 2HD ARG 58 19.617 -3.974 -16.240 460 1HH1 ARG 58 2HH2 ARG 58 19.593 -6.028 -15.473 461 2HH1 ARG 58 1HH2 ARG 58 18.838 -6.984 -14.101 462 1HH2 ARG 58 1HH1 ARG 58 15.945 -5.114 -14.092 463 2HH2 ARG 58 2HH1 ARG 58 16.910 -6.500 -13.375 464 H LYS 59 H LYS 59 21.080 -2.346 -20.063 465 HA LYS 59 HA LYS 59 22.617 0.050 -20.990 466 1HB LYS 59 1HB LYS 59 24.457 -1.044 -22.038 467 2HB LYS 59 2HB LYS 59 24.528 -1.253 -20.314 468 1HG LYS 59 1HG LYS 59 23.777 -3.414 -22.380 469 2HG LYS 59 2HG LYS 59 25.329 -3.223 -21.609 470 1HD LYS 59 1HD LYS 59 22.720 -4.084 -20.226 471 2HD LYS 59 2HD LYS 59 24.063 -5.113 -20.680 472 1HE LYS 59 1HE LYS 59 25.586 -3.914 -19.045 473 2HE LYS 59 2HE LYS 59 24.252 -2.853 -18.571 474 1HZ LYS 59 1HZ LYS 59 23.014 -4.821 -17.869 475 2HZ LYS 59 2HZ LYS 59 24.247 -5.805 -18.296 476 H GLY 60 H GLY 60 21.636 0.638 -22.834 477 1HA GLY 60 1HA GLY 60 19.605 -1.359 -24.091 478 2HA GLY 60 2HA GLY 60 19.357 0.374 -24.074 479 NH1 ARG 61 NH2 ARG 61 17.507 1.066 -27.079 480 NH2 ARG 61 NH1 ARG 61 18.355 -0.556 -28.427 481 H ARG 61 H ARG 61 21.099 1.645 -24.910 482 HA ARG 61 HA ARG 61 22.402 0.897 -27.556 483 1HB ARG 61 1HB ARG 61 22.076 3.412 -25.983 484 2HB ARG 61 2HB ARG 61 23.181 3.255 -27.289 485 1HG ARG 61 1HG ARG 61 21.264 4.313 -28.074 486 2HG ARG 61 2HG ARG 61 21.618 2.869 -28.983 487 1HD ARG 61 1HD ARG 61 19.449 2.946 -26.787 488 2HD ARG 61 2HD ARG 61 19.133 3.491 -28.431 489 1HH1 ARG 61 2HH2 ARG 61 17.604 2.016 -26.703 490 2HH1 ARG 61 1HH2 ARG 61 16.761 0.395 -26.867 491 1HH2 ARG 61 1HH1 ARG 61 19.093 -0.845 -29.078 492 2HH2 ARG 61 2HH1 ARG 61 17.549 -1.115 -28.124 493 H ASN 62 H ASN 62 24.405 0.078 -27.818 494 HA ASN 62 HA ASN 62 25.777 -0.901 -25.283 495 1HB ASN 62 1HB ASN 62 24.827 -2.414 -27.804 496 2HB ASN 62 2HB ASN 62 26.153 -2.975 -26.840 497 1HD2 ASN 62 2HD2 ASN 62 23.401 -4.868 -25.387 498 2HD2 ASN 62 1HD2 ASN 62 24.545 -4.814 -26.821 499 HA PRO 63 HA PRO 63 29.541 0.707 -27.410 500 1HB PRO 63 1HB PRO 63 30.887 -1.610 -25.921 501 2HB PRO 63 2HB PRO 63 31.431 0.073 -26.089 502 1HG PRO 63 1HG PRO 63 30.204 -0.708 -23.796 503 2HG PRO 63 2HG PRO 63 29.760 0.858 -24.517 504 1HD PRO 63 1HD PRO 63 28.213 -1.785 -24.668 505 2HD PRO 63 2HD PRO 63 27.611 -0.117 -24.410 506 H GLN 64 H GLN 64 28.861 -2.762 -27.588 507 HA GLN 64 HA GLN 64 30.623 -3.591 -29.743 508 1HB GLN 64 1HB GLN 64 29.071 -5.036 -28.148 509 2HB GLN 64 2HB GLN 64 27.734 -4.565 -29.145 510 1HG GLN 64 1HG GLN 64 28.256 -6.670 -29.911 511 2HG GLN 64 2HG GLN 64 28.905 -5.637 -31.171 512 1HE2 GLN 64 2HE2 GLN 64 32.281 -6.812 -30.711 513 2HE2 GLN 64 1HE2 GLN 64 31.119 -5.712 -31.608 514 H THR 65 H THR 65 27.221 -2.739 -29.897 515 HA THR 65 HA THR 65 26.847 -2.846 -32.712 516 HB THR 65 HB THR 65 24.603 -1.965 -32.270 517 HG1 THR 65 HG1 THR 65 25.213 -0.323 -30.849 518 1HG2 THR 65 1HG2 THR 65 25.117 -4.373 -31.500 519 2HG2 THR 65 2HG2 THR 65 25.439 -3.751 -29.876 520 3HG2 THR 65 3HG2 THR 65 23.811 -3.596 -30.553 521 H GLY 66 H GLY 66 27.824 0.034 -30.917 522 1HA GLY 66 1HA GLY 66 29.004 1.715 -32.575 523 2HA GLY 66 2HA GLY 66 27.493 1.748 -33.468 524 H GLU 67 H GLU 67 25.611 1.817 -31.323 525 HA GLU 67 HA GLU 67 26.041 4.696 -30.389 526 1HB GLU 67 2HB GLU 67 24.145 4.151 -32.102 527 2HB GLU 67 1HB GLU 67 23.338 3.257 -30.816 528 1HG GLU 67 1HG GLU 67 23.241 5.343 -29.398 529 2HG GLU 67 2HG GLU 67 24.144 6.237 -30.617 530 HE1 GLU 67 HE2 GLU 67 20.227 5.329 -31.153 531 H GLU 68 H GLU 68 25.887 4.903 -28.171 532 HA GLU 68 HA GLU 68 24.952 2.566 -26.577 533 1HB GLU 68 1HB GLU 68 26.938 2.305 -25.181 534 2HB GLU 68 2HB GLU 68 27.318 2.059 -26.860 535 1HG GLU 68 1HG GLU 68 28.011 4.671 -25.378 536 2HG GLU 68 2HG GLU 68 29.061 3.271 -25.449 537 HE2 GLU 68 HE2 GLU 68 28.934 5.823 -28.484 538 H MET 69 H MET 69 23.970 2.833 -24.609 539 HA MET 69 HA MET 69 24.609 5.117 -22.925 540 1HB MET 69 1HB MET 69 22.938 6.548 -23.008 541 2HB MET 69 2HB MET 69 22.786 6.066 -24.666 542 1HG MET 69 1HG MET 69 20.979 4.947 -22.397 543 2HG MET 69 2HG MET 69 20.636 6.419 -23.284 544 1HE MET 69 2HE MET 69 18.734 3.691 -23.114 545 2HE MET 69 1HE MET 69 18.892 2.616 -24.532 546 3HE MET 69 3HE MET 69 20.143 2.601 -23.269 547 H GLU 70 H GLU 70 24.332 4.566 -20.944 548 HA GLU 70 HA GLU 70 23.105 1.966 -20.141 549 1HB GLU 70 2HB GLU 70 24.051 2.173 -18.003 550 2HB GLU 70 1HB GLU 70 25.281 2.607 -19.177 551 1HG GLU 70 1HG GLU 70 25.654 4.138 -17.459 552 2HG GLU 70 2HG GLU 70 24.758 5.112 -18.607 553 HE2 GLU 70 HE2 GLU 70 22.517 6.029 -16.188 554 H ILE 71 H ILE 71 21.152 1.689 -19.119 555 HA ILE 71 HA ILE 71 19.282 4.009 -18.988 556 HB ILE 71 HB ILE 71 18.910 0.969 -18.704 557 1HG1 ILE 71 1HG1 ILE 71 18.172 2.801 -21.088 558 2HG1 ILE 71 2HG1 ILE 71 19.628 1.829 -21.059 559 1HG2 ILE 71 2HG2 ILE 71 17.142 2.268 -17.528 560 2HG2 ILE 71 3HG2 ILE 71 16.813 3.179 -19.040 561 3HG2 ILE 71 1HG2 ILE 71 16.502 1.414 -18.951 562 1HD1 ILE 71 3HD1 ILE 71 16.796 0.635 -21.020 563 2HD1 ILE 71 1HD1 ILE 71 17.902 0.723 -22.396 564 3HD1 ILE 71 2HD1 ILE 71 18.328 -0.289 -20.995 565 HA PRO 72 HA PRO 72 20.797 4.085 -14.613 566 1HB PRO 72 1HB PRO 72 19.432 6.317 -13.636 567 2HB PRO 72 2HB PRO 72 20.810 6.373 -14.744 568 1HG PRO 72 1HG PRO 72 17.837 6.499 -15.469 569 2HG PRO 72 2HG PRO 72 19.137 7.599 -15.994 570 1HD PRO 72 1HD PRO 72 18.287 5.520 -17.584 571 2HD PRO 72 2HD PRO 72 20.019 5.977 -17.548 572 H ALA 73 H ALA 73 20.160 3.929 -12.426 573 HA ALA 73 HA ALA 73 18.011 1.941 -11.911 574 1HB ALA 73 1HB ALA 73 20.195 1.988 -10.556 575 2HB ALA 73 2HB ALA 73 19.698 3.566 -9.846 576 3HB ALA 73 3HB ALA 73 18.771 2.110 -9.510 577 H SER 74 H SER 74 16.584 2.115 -10.175 578 HA SER 74 HA SER 74 16.194 4.495 -8.764 579 1HB SER 74 1HB SER 74 13.802 3.940 -10.721 580 2HB SER 74 2HB SER 74 13.564 4.927 -9.286 581 HG SER 74 HG SER 74 15.404 5.450 -11.362 582 H LYS 75 H LYS 75 15.036 4.347 -6.903 583 HA LYS 75 HA LYS 75 14.295 1.625 -5.896 584 1HB LYS 75 2HB LYS 75 13.494 3.830 -4.100 585 2HB LYS 75 1HB LYS 75 14.263 2.295 -3.837 586 1HG LYS 75 1HG LYS 75 16.479 3.302 -4.529 587 2HG LYS 75 2HG LYS 75 15.665 4.832 -4.866 588 1HD LYS 75 1HD LYS 75 14.896 4.890 -2.388 589 2HD LYS 75 2HD LYS 75 15.866 3.451 -2.122 590 1HE LYS 75 1HE LYS 75 17.192 5.288 -1.358 591 2HE LYS 75 2HE LYS 75 17.956 4.732 -2.847 592 1HZ LYS 75 1HZ LYS 75 16.110 7.055 -2.620 593 2HZ LYS 75 2HZ LYS 75 16.812 6.558 -4.010 594 H VAL 76 H VAL 76 12.088 0.684 -6.162 595 HA VAL 76 HA VAL 76 9.940 2.477 -6.865 596 HB VAL 76 HB VAL 76 11.337 -0.029 -7.602 597 1HG1 VAL 76 3HG2 VAL 76 8.389 -0.185 -7.650 598 2HG1 VAL 76 1HG2 VAL 76 9.621 -1.281 -8.468 599 3HG1 VAL 76 2HG2 VAL 76 9.544 -1.177 -6.705 600 1HG2 VAL 76 2HG1 VAL 76 11.278 1.957 -9.023 601 2HG2 VAL 76 3HG1 VAL 76 10.623 0.507 -9.814 602 3HG2 VAL 76 1HG1 VAL 76 9.501 1.770 -9.196 603 HA PRO 77 HA PRO 77 8.565 1.180 -2.642 604 1HB PRO 77 1HB PRO 77 6.618 3.124 -2.240 605 2HB PRO 77 2HB PRO 77 8.344 3.525 -2.317 606 1HG PRO 77 1HG PRO 77 6.307 3.680 -4.593 607 2HG PRO 77 2HG PRO 77 7.390 4.956 -4.041 608 1HD PRO 77 1HD PRO 77 7.977 3.164 -6.215 609 2HD PRO 77 2HD PRO 77 9.312 3.789 -5.203 610 H ALA 78 H ALA 78 7.457 -0.232 -2.062 611 HA ALA 78 HA ALA 78 4.837 -1.130 -3.379 612 1HB ALA 78 2HB ALA 78 6.992 -2.406 -3.898 613 2HB ALA 78 3HB ALA 78 7.194 -2.748 -2.165 614 3HB ALA 78 1HB ALA 78 5.796 -3.412 -3.046 615 H PHE 79 H PHE 79 3.713 -2.630 -2.002 616 HA PHE 79 HA PHE 79 3.648 -2.140 1.030 617 1HB PHE 79 2HB PHE 79 2.368 -0.417 0.673 618 2HB PHE 79 1HB PHE 79 1.534 -1.164 -0.709 619 HD1 PHE 79 HD2 PHE 79 1.675 -1.151 3.034 620 HD2 PHE 79 HD1 PHE 79 -0.420 -2.604 -0.433 621 HE1 PHE 79 HE2 PHE 79 -0.131 -2.008 4.466 622 HE2 PHE 79 HE1 PHE 79 -2.180 -3.510 1.018 623 HZ PHE 79 HZ PHE 79 -2.025 -3.253 3.461 624 H LYS 80 H LYS 80 3.448 -4.022 1.646 625 HA LYS 80 HA LYS 80 2.454 -6.627 0.214 626 1HB LYS 80 2HB LYS 80 3.790 -6.266 2.905 627 2HB LYS 80 1HB LYS 80 3.184 -7.786 2.314 628 1HG LYS 80 1HG LYS 80 5.397 -6.202 0.833 629 2HG LYS 80 2HG LYS 80 5.713 -7.278 2.165 630 1HD LYS 80 1HD LYS 80 6.208 -8.565 0.317 631 2HD LYS 80 2HD LYS 80 4.674 -9.216 0.872 632 1HE LYS 80 1HE LYS 80 3.466 -8.060 -1.007 633 2HE LYS 80 2HE LYS 80 4.941 -7.197 -1.472 634 1HZ LYS 80 1HZ LYS 80 4.505 -9.139 -2.832 635 2HZ LYS 80 2HZ LYS 80 4.544 -10.138 -1.538 636 HA PRO 81 HA PRO 81 -1.378 -5.968 2.626 637 1HB PRO 81 1HB PRO 81 -2.805 -8.162 1.766 638 2HB PRO 81 2HB PRO 81 -2.386 -6.843 0.666 639 1HG PRO 81 1HG PRO 81 -0.913 -9.511 1.004 640 2HG PRO 81 2HG PRO 81 -1.520 -8.791 -0.509 641 1HD PRO 81 1HD PRO 81 1.108 -8.487 0.396 642 2HD PRO 81 2HD PRO 81 0.294 -7.231 -0.591 643 H GLY 82 H GLY 82 0.961 -6.952 3.945 644 1HA GLY 82 1HA GLY 82 1.949 -8.504 5.488 645 2HA GLY 82 2HA GLY 82 0.477 -8.050 6.320 646 H LYS 83 H LYS 83 0.096 -10.018 3.570 647 HA LYS 83 HA LYS 83 -0.710 -12.281 3.263 648 1HB LYS 83 2HB LYS 83 0.898 -12.727 5.760 649 2HB LYS 83 1HB LYS 83 -0.494 -13.738 5.725 650 1HG LYS 83 1HG LYS 83 0.208 -14.582 3.399 651 2HG LYS 83 2HG LYS 83 1.627 -13.530 3.472 652 1HD LYS 83 1HD LYS 83 2.430 -14.760 5.539 653 2HD LYS 83 2HD LYS 83 1.009 -15.809 5.466 654 1HE LYS 83 1HE LYS 83 1.745 -16.646 3.177 655 2HE LYS 83 2HE LYS 83 3.168 -15.597 3.252 656 1HZ LYS 83 1HZ LYS 83 3.903 -16.791 5.210 657 2HZ LYS 83 2HZ LYS 83 3.703 -17.810 3.948 658 H ALA 84 H ALA 84 -1.369 -10.983 6.265 659 HA ALA 84 HA ALA 84 -3.867 -12.144 7.153 660 1HB ALA 84 2HB ALA 84 -2.160 -10.910 8.510 661 2HB ALA 84 3HB ALA 84 -2.450 -9.424 7.570 662 3HB ALA 84 1HB ALA 84 -3.736 -10.061 8.631 663 H LEU 85 H LEU 85 -3.314 -8.945 5.404 664 HA LEU 85 HA LEU 85 -6.183 -8.471 4.990 665 1HB LEU 85 2HB LEU 85 -4.642 -6.541 4.924 666 2HB LEU 85 1HB LEU 85 -3.746 -7.260 3.607 667 HG LEU 85 HG LEU 85 -5.888 -7.362 2.344 668 1HD1 LEU 85 2HD1 LEU 85 -7.495 -6.722 4.271 669 2HD1 LEU 85 3HD1 LEU 85 -6.994 -5.038 3.967 670 3HD1 LEU 85 1HD1 LEU 85 -7.779 -5.973 2.689 671 1HD2 LEU 85 1HD2 LEU 85 -4.069 -5.759 1.726 672 2HD2 LEU 85 2HD2 LEU 85 -5.634 -4.978 1.448 673 3HD2 LEU 85 3HD2 LEU 85 -4.672 -4.563 2.890 674 H LYS 86 H LYS 86 -3.627 -10.106 3.153 675 HA LYS 86 HA LYS 86 -5.231 -10.775 0.811 676 1HB LYS 86 1HB LYS 86 -2.644 -11.015 1.094 677 2HB LYS 86 2HB LYS 86 -2.966 -12.604 1.763 678 1HG LYS 86 1HG LYS 86 -4.139 -13.255 -0.379 679 2HG LYS 86 2HG LYS 86 -3.892 -11.623 -1.012 680 1HD LYS 86 1HD LYS 86 -1.383 -11.939 -0.851 681 2HD LYS 86 2HD LYS 86 -1.631 -13.576 -0.232 682 1HE LYS 86 1HE LYS 86 -2.815 -14.216 -2.391 683 2HE LYS 86 2HE LYS 86 -2.577 -12.574 -3.010 684 1HZ LYS 86 1HZ LYS 86 -0.419 -14.468 -2.257 685 2HZ LYS 86 2HZ LYS 86 -0.891 -14.116 -3.782 686 H ASP 87 H ASP 87 -5.399 -12.182 4.007 687 HA ASP 87 HA ASP 87 -7.156 -14.446 3.183 688 1HB ASP 87 1HB ASP 87 -5.426 -13.776 5.413 689 2HB ASP 87 2HB ASP 87 -6.999 -13.568 6.057 690 HD1 ASP 87 HD2 ASP 87 -7.774 -16.976 6.052 691 H ALA 88 H ALA 88 -7.508 -11.231 4.764 692 HA ALA 88 HA ALA 88 -10.344 -11.090 5.312 693 1HB ALA 88 1HB ALA 88 -8.583 -9.219 5.820 694 2HB ALA 88 2HB ALA 88 -8.567 -8.821 4.103 695 3HB ALA 88 3HB ALA 88 -10.043 -8.584 5.001 696 H VAL 89 H VAL 89 -8.571 -10.331 2.316 697 HA VAL 89 HA VAL 89 -10.919 -9.502 0.783 698 HB VAL 89 HB VAL 89 -8.441 -8.533 1.365 699 1HG1 VAL 89 2HG2 VAL 89 -7.353 -10.739 0.543 700 2HG1 VAL 89 3HG2 VAL 89 -7.618 -10.141 -1.098 701 3HG1 VAL 89 1HG2 VAL 89 -6.649 -9.190 0.076 702 1HG2 VAL 89 1HG1 VAL 89 -9.511 -8.372 -1.403 703 2HG2 VAL 89 2HG1 VAL 89 -9.943 -7.408 0.065 704 3HG2 VAL 89 3HG1 VAL 89 -8.282 -7.327 -0.572 705 H LYS 90 H LYS 90 -9.490 -12.570 1.133 706 HA LYS 90 HA LYS 90 -9.271 -13.529 -1.568 707 1HB LYS 90 1HB LYS 90 -8.419 -14.383 0.859 708 2HB LYS 90 2HB LYS 90 -9.873 -15.331 0.870 709 1HG LYS 90 1HG LYS 90 -9.099 -16.619 -1.104 710 2HG LYS 90 2HG LYS 90 -7.852 -15.429 -1.457 711 1HD LYS 90 1HD LYS 90 -6.709 -17.272 -0.460 712 2HD LYS 90 2HD LYS 90 -6.660 -15.952 0.697 713 1HE LYS 90 1HE LYS 90 -8.571 -17.039 2.005 714 2HE LYS 90 2HE LYS 90 -8.604 -18.366 0.834 715 1HZ LYS 90 1HZ LYS 90 -7.303 -18.937 2.747 716 2HZ LYS 90 2HZ LYS 90 -6.331 -18.896 1.434 717 1H MET 1 1H MET 91 10.018 0.856 10.101 718 2H MET 1 2H MET 91 10.789 -0.369 10.957 719 HA MET 1 HA MET 91 9.501 0.462 12.520 720 1HB MET 1 1HB MET 91 7.238 0.914 10.472 721 2HB MET 1 2HB MET 91 7.165 1.277 12.180 722 1HG MET 1 1HG MET 91 7.657 3.374 11.438 723 2HG MET 1 2HG MET 91 9.316 2.830 11.699 724 1HE MET 1 2HE MET 91 6.745 4.209 9.307 725 2HE MET 1 1HE MET 91 8.192 5.237 9.534 726 3HE MET 1 3HE MET 91 7.808 4.567 7.921 727 H ASN 2 H ASN 92 6.484 -0.747 12.006 728 HA ASN 2 HA ASN 92 6.572 -3.414 12.192 729 1HB ASN 2 1HB ASN 92 6.667 -4.360 14.385 730 2HB ASN 2 2HB ASN 92 8.154 -3.571 13.995 731 1HD2 ASN 2 1HD2 ASN 92 6.214 -2.367 17.327 732 2HD2 ASN 2 2HD2 ASN 92 5.504 -3.534 16.100 733 H LYS 3 H LYS 93 5.201 -0.793 13.938 734 HA LYS 3 HA LYS 93 2.690 -0.431 13.197 735 1HB LYS 3 1HB LYS 93 2.069 -2.905 13.348 736 2HB LYS 3 2HB LYS 93 2.185 -2.820 15.088 737 1HG LYS 3 1HG LYS 93 0.256 -1.142 15.067 738 2HG LYS 3 2HG LYS 93 0.310 -1.092 13.303 739 1HD LYS 3 1HD LYS 93 -0.265 -3.568 13.245 740 2HD LYS 3 2HD LYS 93 -0.394 -3.561 15.010 741 1HE LYS 3 1HE LYS 93 -2.271 -1.862 14.865 742 2HE LYS 3 2HE LYS 93 -2.127 -1.842 13.100 743 1HZ LYS 3 1HZ LYS 93 -2.759 -4.245 14.726 744 2HZ LYS 3 2HZ LYS 93 -2.628 -4.222 13.096 745 H THR 4 H THR 94 4.646 -0.984 16.124 746 HA THR 4 HA THR 94 3.085 0.845 17.771 747 HB THR 4 HB THR 94 5.499 -1.050 18.125 748 HG1 THR 4 HG1 THR 94 3.995 -2.210 19.401 749 1HG2 THR 4 3HG2 THR 94 3.998 0.672 20.091 750 2HG2 THR 4 1HG2 THR 94 5.137 -0.693 20.527 751 3HG2 THR 4 2HG2 THR 94 5.736 0.746 19.615 752 H GLU 5 H GLU 95 6.149 0.606 15.863 753 HA GLU 5 HA GLU 95 7.336 3.133 16.839 754 1HB GLU 5 1HB GLU 95 8.730 1.237 16.145 755 2HB GLU 5 2HB GLU 95 7.792 0.974 14.677 756 1HG GLU 5 1HG GLU 95 9.774 1.887 14.050 757 2HG GLU 5 2HG GLU 95 8.484 3.065 13.757 758 HE1 GLU 5 HE2 GLU 95 11.563 3.824 16.321 759 H LEU 6 H LEU 96 4.732 2.050 14.888 760 HA LEU 6 HA LEU 96 4.330 4.356 13.065 761 1HB LEU 6 2HB LEU 96 3.213 1.749 13.331 762 2HB LEU 6 1HB LEU 96 1.935 2.718 14.015 763 HG LEU 6 HG LEU 96 3.068 3.097 11.243 764 1HD1 LEU 6 2HD1 LEU 96 0.401 1.926 12.166 765 2HD1 LEU 6 3HD1 LEU 96 0.850 2.266 10.478 766 3HD1 LEU 6 1HD1 LEU 96 1.739 1.041 11.406 767 1HD2 LEU 6 1HD2 LEU 96 1.201 4.853 12.836 768 2HD2 LEU 6 2HD2 LEU 96 2.442 5.287 11.653 769 3HD2 LEU 6 3HD2 LEU 96 0.884 4.622 11.120 770 H ILE 7 H ILE 97 3.047 3.254 16.241 771 HA ILE 7 HA ILE 97 1.229 5.436 16.799 772 HB ILE 7 HB ILE 97 2.753 3.702 18.841 773 1HG1 ILE 7 1HG1 ILE 97 -0.032 3.142 17.677 774 2HG1 ILE 7 2HG1 ILE 97 1.388 2.410 17.033 775 1HG2 ILE 7 2HG2 ILE 97 1.612 5.693 19.927 776 2HG2 ILE 7 3HG2 ILE 97 0.080 5.165 19.221 777 3HG2 ILE 7 1HG2 ILE 97 0.889 4.163 20.435 778 1HD1 ILE 7 3HD1 ILE 97 1.932 1.446 19.364 779 2HD1 ILE 7 1HD1 ILE 97 0.264 1.819 19.772 780 3HD1 ILE 7 2HD1 ILE 97 0.612 0.735 18.396 781 H ASN 8 H ASN 98 4.610 4.982 17.819 782 HA ASN 8 HA ASN 98 4.824 7.698 18.995 783 1HB ASN 8 1HB ASN 98 7.109 5.796 18.079 784 2HB ASN 8 2HB ASN 98 7.375 7.294 18.940 785 1HD2 ASN 8 2HD2 ASN 98 6.425 4.040 21.167 786 2HD2 ASN 8 1HD2 ASN 98 6.597 3.980 19.341 787 H ALA 9 H ALA 99 4.893 6.781 15.679 788 HA ALA 9 HA ALA 99 6.348 9.225 14.678 789 1HB ALA 9 2HB ALA 99 5.879 7.088 13.117 790 2HB ALA 9 3HB ALA 99 4.163 7.497 13.204 791 3HB ALA 9 1HB ALA 99 5.223 8.633 12.449 792 H VAL 10 H VAL 100 2.942 8.198 15.201 793 HA VAL 10 HA VAL 100 1.864 10.508 14.013 794 HB VAL 10 HB VAL 100 0.168 8.850 15.882 795 1HG1 VAL 10 3HG2 VAL 100 -0.584 10.833 14.236 796 2HG1 VAL 10 1HG2 VAL 100 -0.678 9.467 13.081 797 3HG1 VAL 10 2HG2 VAL 100 -1.600 9.397 14.590 798 1HG2 VAL 10 1HG1 VAL 100 1.453 7.871 13.321 799 2HG2 VAL 10 2HG1 VAL 100 1.361 7.174 14.969 800 3HG2 VAL 10 3HG1 VAL 100 -0.108 7.168 13.945 801 H ALA 11 H ALA 101 2.042 9.367 17.197 802 HA ALA 11 HA ALA 101 1.116 11.803 18.278 803 1HB ALA 11 2HB ALA 101 1.027 9.597 19.557 804 2HB ALA 11 3HB ALA 101 2.803 9.593 19.693 805 3HB ALA 11 1HB ALA 101 1.832 10.817 20.576 806 H GLU 12 H GLU 102 4.338 11.035 17.244 807 HA GLU 12 HA GLU 102 5.529 13.401 18.658 808 1HB GLU 12 1HB GLU 102 6.972 11.421 18.222 809 2HB GLU 12 2HB GLU 102 6.708 11.560 16.482 810 1HG GLU 12 1HG GLU 102 7.921 13.756 16.448 811 2HG GLU 12 2HG GLU 102 8.122 13.706 18.198 812 HE1 GLU 12 HE2 GLU 102 10.710 11.401 18.177 813 H THR 13 H THR 103 4.591 12.609 15.238 814 HA THR 13 HA THR 103 4.931 15.547 14.632 815 HB THR 13 HB THR 103 5.876 13.541 13.322 816 HG1 THR 13 HG1 THR 103 4.744 15.803 12.049 817 1HG2 THR 13 2HG2 THR 103 3.908 12.369 12.604 818 2HG2 THR 13 3HG2 THR 103 3.289 13.816 11.757 819 3HG2 THR 13 1HG2 THR 103 4.787 13.011 11.205 820 H SER 14 H SER 104 2.613 14.261 15.866 821 HA SER 14 HA SER 104 0.651 16.404 14.798 822 1HB SER 14 1HB SER 104 -0.395 13.638 15.651 823 2HB SER 14 2HB SER 104 -1.341 14.998 15.064 824 HG SER 14 HG SER 104 0.708 13.668 13.628 825 H GLY 15 H GLY 105 1.771 14.728 17.753 826 1HA GLY 15 1HA GLY 105 1.400 15.239 20.025 827 2HA GLY 15 2HA GLY 105 0.889 16.846 19.521 828 H LEU 16 H LEU 106 -0.359 13.577 19.290 829 HA LEU 16 HA LEU 106 -2.986 14.243 20.645 830 1HB LEU 16 1HB LEU 106 -3.958 12.390 19.479 831 2HB LEU 16 2HB LEU 106 -3.525 13.784 18.510 832 HG LEU 16 HG LEU 106 -1.675 12.798 17.586 833 1HD1 LEU 16 2HD1 LEU 106 -0.768 11.512 19.579 834 2HD1 LEU 16 3HD1 LEU 106 -2.039 10.301 19.213 835 3HD1 LEU 16 1HD1 LEU 106 -0.691 10.652 18.039 836 1HD2 LEU 16 2HD2 LEU 106 -3.258 12.350 16.183 837 2HD2 LEU 16 3HD2 LEU 106 -1.835 11.271 16.152 838 3HD2 LEU 16 1HD2 LEU 106 -3.336 10.676 16.844 839 H SER 17 H SER 107 -2.635 11.320 20.784 840 HA SER 17 HA SER 107 -1.123 11.013 23.430 841 1HB SER 17 1HB SER 107 -3.854 9.695 23.102 842 2HB SER 17 2HB SER 107 -2.769 9.587 24.468 843 HG SER 17 HG SER 107 -3.976 11.965 23.519 844 H LYS 18 H LYS 108 -0.487 8.824 23.875 845 HA LYS 18 HA LYS 108 0.395 7.263 21.454 846 1HB LYS 18 1HB LYS 108 0.693 6.539 24.429 847 2HB LYS 18 2HB LYS 108 1.125 5.465 23.106 848 1HG LYS 18 1HG LYS 108 2.693 7.292 22.175 849 2HG LYS 18 2HG LYS 108 2.348 8.238 23.613 850 1HD LYS 18 1HD LYS 108 4.433 7.160 24.000 851 2HD LYS 18 2HD LYS 108 3.279 6.359 25.061 852 1HE LYS 18 1HE LYS 108 3.138 4.403 23.444 853 2HE LYS 18 2HE LYS 108 4.205 5.241 22.314 854 1HZ LYS 18 1HZ LYS 108 5.375 3.643 23.676 855 2HZ LYS 18 2HZ LYS 108 4.916 4.378 25.062 856 H LYS 19 H LYS 109 -2.057 6.836 23.984 857 HA LYS 19 HA LYS 109 -3.405 4.502 22.772 858 1HB LYS 19 2HB LYS 109 -4.565 6.694 24.592 859 2HB LYS 19 1HB LYS 109 -5.480 5.280 24.091 860 1HG LYS 19 1HG LYS 109 -2.924 5.262 25.803 861 2HG LYS 19 2HG LYS 109 -4.559 5.083 26.395 862 1HD LYS 19 1HD LYS 109 -3.093 3.076 24.567 863 2HD LYS 19 2HD LYS 109 -3.304 2.937 26.305 864 1HE LYS 19 1HE LYS 109 -5.831 2.818 26.007 865 2HE LYS 19 2HE LYS 109 -5.621 2.918 24.252 866 1HZ LYS 19 1HZ LYS 109 -4.488 0.789 25.979 867 2HZ LYS 19 2HZ LYS 109 -4.289 0.888 24.360 868 H ASP 20 H ASP 110 -3.756 8.068 22.111 869 HA ASP 20 HA ASP 110 -6.041 7.571 20.204 870 1HB ASP 20 1HB ASP 110 -4.336 10.069 20.786 871 2HB ASP 20 2HB ASP 110 -5.399 10.034 19.403 872 HD1 ASP 20 HD2 ASP 110 -8.402 10.106 21.123 873 H ALA 21 H ALA 111 -2.556 7.683 19.871 874 HA ALA 21 HA ALA 111 -2.543 7.704 16.892 875 1HB ALA 21 1HB ALA 111 -0.358 7.304 19.025 876 2HB ALA 21 2HB ALA 111 -0.057 7.150 17.268 877 3HB ALA 21 3HB ALA 111 -0.635 8.645 17.942 878 H THR 22 H THR 112 -2.292 5.092 19.389 879 HA THR 22 HA THR 112 -2.048 2.839 17.603 880 HB THR 22 HB THR 112 -3.648 2.806 20.252 881 HG1 THR 22 HG1 THR 112 -1.756 3.974 20.588 882 1HG2 THR 22 2HG2 THR 112 -1.695 0.853 18.896 883 2HG2 THR 22 3HG2 THR 112 -2.409 0.619 20.517 884 3HG2 THR 22 1HG2 THR 112 -3.458 0.644 19.055 885 H LYS 23 H LYS 113 -4.914 4.350 18.895 886 HA LYS 23 HA LYS 113 -6.981 2.780 17.506 887 1HB LYS 23 2HB LYS 113 -6.808 5.749 18.473 888 2HB LYS 23 1HB LYS 113 -8.284 5.109 17.842 889 1HG LYS 23 1HG LYS 113 -8.495 3.421 19.676 890 2HG LYS 23 2HG LYS 113 -6.942 3.911 20.344 891 1HD LYS 23 1HD LYS 113 -7.873 6.278 20.678 892 2HD LYS 23 2HD LYS 113 -9.443 5.710 20.104 893 1HE LYS 23 1HE LYS 113 -9.523 4.034 22.025 894 2HE LYS 23 2HE LYS 113 -7.944 4.608 22.586 895 1HZ LYS 23 1HZ LYS 113 -8.891 6.795 22.914 896 2HZ LYS 23 2HZ LYS 113 -9.710 5.674 23.777 897 H ALA 24 H ALA 114 -5.658 5.916 16.742 898 HA ALA 24 HA ALA 114 -6.969 6.427 14.267 899 1HB ALA 24 2HB ALA 114 -5.946 8.141 15.586 900 2HB ALA 24 3HB ALA 114 -4.307 7.485 15.286 901 3HB ALA 24 1HB ALA 114 -5.264 8.191 13.943 902 H VAL 25 H VAL 115 -3.891 4.734 14.714 903 HA VAL 25 HA VAL 115 -3.325 4.080 11.871 904 HB VAL 25 HB VAL 115 -2.743 3.072 14.794 905 1HG1 VAL 25 2HG2 VAL 115 -1.969 1.373 12.331 906 2HG1 VAL 25 3HG2 VAL 115 -1.292 1.163 13.980 907 3HG1 VAL 25 1HG2 VAL 115 -3.000 0.875 13.674 908 1HG2 VAL 25 1HG1 VAL 115 -1.411 4.919 13.918 909 2HG2 VAL 25 2HG1 VAL 115 -0.404 3.494 14.225 910 3HG2 VAL 25 3HG1 VAL 115 -0.887 3.919 12.542 911 H ASP 26 H ASP 116 -5.016 2.136 14.402 912 HA ASP 26 HA ASP 116 -6.409 0.488 12.260 913 1HB ASP 26 1HB ASP 116 -6.810 0.645 15.324 914 2HB ASP 26 2HB ASP 116 -7.684 -0.478 14.291 915 HD2 ASP 26 HD2 ASP 116 -3.989 -1.339 15.501 916 H ALA 27 H ALA 117 -6.838 3.254 12.527 917 HA ALA 27 HA ALA 117 -9.833 3.467 12.041 918 1HB ALA 27 2HB ALA 117 -8.464 4.963 13.844 919 2HB ALA 27 3HB ALA 117 -8.179 5.921 12.406 920 3HB ALA 27 1HB ALA 117 -9.818 5.567 12.987 921 H VAL 28 H VAL 118 -6.747 4.555 10.749 922 HA VAL 28 HA VAL 118 -7.644 5.243 8.000 923 HB VAL 28 HB VAL 118 -4.823 4.383 9.037 924 1HG1 VAL 28 1HG2 VAL 118 -5.523 5.916 6.454 925 2HG1 VAL 28 2HG2 VAL 118 -3.891 5.584 7.104 926 3HG1 VAL 28 3HG2 VAL 118 -4.890 4.239 6.566 927 1HG2 VAL 28 3HG1 VAL 118 -5.575 6.386 10.153 928 2HG2 VAL 28 1HG1 VAL 118 -4.209 6.688 9.049 929 3HG2 VAL 28 2HG1 VAL 118 -5.911 7.153 8.569 930 H PHE 29 H PHE 119 -5.786 2.698 9.365 931 HA PHE 29 HA PHE 119 -5.973 0.797 7.061 932 1HB PHE 29 2HB PHE 119 -4.855 0.105 9.811 933 2HB PHE 29 1HB PHE 119 -4.571 -0.786 8.323 934 HD1 PHE 29 HD2 PHE 119 -3.793 0.937 6.221 935 HD2 PHE 29 HD1 PHE 119 -2.999 1.478 10.406 936 HE1 PHE 29 HE2 PHE 119 -2.142 2.654 5.684 937 HE2 PHE 29 HE1 PHE 119 -1.419 3.273 9.866 938 HZ PHE 29 HZ PHE 119 -1.056 3.903 7.496 939 H ASP 30 H ASP 120 -8.120 1.169 9.778 940 HA ASP 30 HA ASP 120 -9.515 -1.420 9.268 941 1HB ASP 30 1HB ASP 120 -9.640 0.031 11.404 942 2HB ASP 30 2HB ASP 120 -10.708 1.125 10.560 943 HD2 ASP 30 HD2 ASP 120 -13.514 -0.844 10.774 944 H SER 31 H SER 121 -9.831 1.894 8.290 945 HA SER 31 HA SER 121 -12.187 1.497 6.468 946 1HB SER 31 2HB SER 121 -10.442 3.980 6.840 947 2HB SER 31 1HB SER 121 -11.808 3.875 5.703 948 HG SER 31 HG SER 121 -12.430 4.639 7.732 949 H ILE 32 H ILE 122 -8.610 1.193 5.836 950 HA ILE 32 HA ILE 122 -8.957 1.050 2.905 951 HB ILE 32 HB ILE 122 -6.846 -0.183 4.777 952 1HG1 ILE 32 1HG1 ILE 122 -5.068 0.885 3.792 953 2HG1 ILE 32 2HG1 ILE 122 -6.055 1.815 2.660 954 1HG2 ILE 32 2HG2 ILE 122 -7.472 -0.305 1.773 955 2HG2 ILE 32 3HG2 ILE 122 -5.771 -0.540 2.190 956 3HG2 ILE 32 1HG2 ILE 122 -7.036 -1.635 2.809 957 1HD1 ILE 32 2HD1 ILE 122 -5.562 2.345 5.641 958 2HD1 ILE 32 3HD1 ILE 122 -4.904 3.219 4.287 959 3HD1 ILE 32 1HD1 ILE 122 -6.636 3.368 4.633 960 H THR 33 H THR 123 -8.785 -1.276 5.726 961 HA THR 33 HA THR 123 -9.158 -3.639 4.102 962 HB THR 33 HB THR 123 -9.709 -4.920 6.018 963 HG1 THR 33 HG1 THR 123 -11.035 -3.417 7.078 964 1HG2 THR 33 3HG2 THR 123 -7.399 -2.951 6.253 965 2HG2 THR 33 1HG2 THR 123 -7.695 -4.019 7.626 966 3HG2 THR 33 2HG2 THR 123 -7.352 -4.687 6.011 967 H GLU 34 H GLU 124 -11.514 -1.463 5.178 968 HA GLU 34 HA GLU 124 -13.859 -3.210 4.443 969 1HB GLU 34 1HB GLU 124 -14.050 -1.614 6.459 970 2HB GLU 34 2HB GLU 124 -13.907 -0.249 5.355 971 1HG GLU 34 1HG GLU 124 -16.052 -0.990 4.197 972 2HG GLU 34 2HG GLU 124 -16.152 -2.389 5.262 973 HE1 GLU 34 HE2 GLU 124 -17.213 -0.616 8.060 974 H ALA 35 H ALA 125 -11.742 -0.738 2.993 975 HA ALA 35 HA ALA 125 -13.463 -0.484 0.605 976 1HB ALA 35 2HB ALA 125 -11.532 1.307 1.139 977 2HB ALA 35 3HB ALA 125 -10.387 0.002 0.818 978 3HB ALA 35 1HB ALA 125 -11.368 0.602 -0.485 979 H LEU 36 H LEU 126 -10.245 -2.269 1.089 980 HA LEU 36 HA LEU 126 -10.544 -3.644 -1.439 981 1HB LEU 36 2HB LEU 126 -9.013 -4.290 1.034 982 2HB LEU 36 1HB LEU 126 -8.711 -5.025 -0.515 983 HG LEU 36 HG LEU 126 -8.247 -2.656 0.299 984 1HD1 LEU 36 3HD2 LEU 126 -9.344 -2.185 -2.406 985 2HD1 LEU 36 1HD2 LEU 126 -9.302 -1.129 -0.974 986 3HD1 LEU 36 2HD2 LEU 126 -7.949 -1.168 -2.071 987 1HD2 LEU 36 3HD1 LEU 126 -6.285 -2.906 0.545 988 2HD2 LEU 36 1HD1 LEU 126 -6.102 -2.383 -1.155 989 3HD2 LEU 36 2HD1 LEU 126 -6.851 -1.274 -0.024 990 NH1 ARG 37 NH2 ARG 127 -13.178 -4.730 7.723 991 NH2 ARG 37 NH1 ARG 127 -15.403 -4.276 7.746 992 H ARG 37 H ARG 127 -11.585 -4.632 1.887 993 HA ARG 37 HA ARG 127 -12.071 -7.287 0.923 994 1HB ARG 37 1HB ARG 127 -12.933 -8.013 2.958 995 2HB ARG 37 2HB ARG 127 -11.745 -6.815 3.391 996 1HG ARG 37 1HG ARG 127 -13.895 -5.161 3.483 997 2HG ARG 37 2HG ARG 127 -14.825 -6.649 3.520 998 1HD ARG 37 1HD ARG 127 -13.606 -7.397 5.550 999 2HD ARG 37 2HD ARG 127 -12.571 -5.949 5.469 1000 1HH1 ARG 37 2HH2 ARG 127 -12.396 -5.205 7.258 1001 2HH1 ARG 37 1HH2 ARG 127 -13.132 -4.158 8.573 1002 1HH2 ARG 37 1HH1 ARG 127 -16.320 -4.401 7.304 1003 2HH2 ARG 37 2HH1 ARG 127 -15.198 -3.737 8.595 1004 H LYS 38 H LYS 128 -13.971 -4.269 0.728 1005 HA LYS 38 HA LYS 128 -16.548 -5.837 0.469 1006 1HB LYS 38 1HB LYS 128 -16.311 -3.915 2.152 1007 2HB LYS 38 2HB LYS 128 -16.311 -2.812 0.775 1008 1HG LYS 38 1HG LYS 128 -18.646 -3.542 0.196 1009 2HG LYS 38 2HG LYS 128 -18.573 -4.801 1.418 1010 1HD LYS 38 1HD LYS 128 -19.870 -2.988 2.339 1011 2HD LYS 38 2HD LYS 128 -18.372 -3.091 3.233 1012 1HE LYS 38 1HE LYS 128 -18.849 -0.749 2.927 1013 2HE LYS 38 2HE LYS 128 -17.452 -1.095 1.917 1014 1HZ LYS 38 1HZ LYS 128 -19.101 0.257 0.796 1015 2HZ LYS 38 2HZ LYS 128 -20.268 -0.870 0.992 1016 H GLY 39 H GLY 129 -14.265 -5.145 -1.699 1017 1HA GLY 39 1HA GLY 129 -14.225 -4.753 -4.082 1018 2HA GLY 39 2HA GLY 129 -15.980 -4.779 -4.106 1019 H ASP 40 H ASP 130 -13.743 -2.710 -2.339 1020 HA ASP 40 HA ASP 130 -14.578 -0.167 -3.812 1021 1HB ASP 40 1HB ASP 130 -14.854 -0.807 -0.866 1022 2HB ASP 40 2HB ASP 130 -14.597 0.855 -1.370 1023 HD1 ASP 40 HD2 ASP 130 -16.057 1.787 -2.611 1024 H LYS 41 H LYS 131 -13.413 1.581 -3.737 1025 HA LYS 41 HA LYS 131 -10.406 1.071 -3.611 1026 1HB LYS 41 2HB LYS 131 -11.793 3.470 -4.935 1027 2HB LYS 41 1HB LYS 131 -10.090 3.015 -5.041 1028 1HG LYS 41 1HG LYS 131 -10.953 0.797 -6.179 1029 2HG LYS 41 2HG LYS 131 -12.506 1.606 -6.316 1030 1HD LYS 41 1HD LYS 131 -11.433 3.486 -7.619 1031 2HD LYS 41 2HD LYS 131 -9.852 2.714 -7.446 1032 1HE LYS 41 1HE LYS 131 -10.703 0.680 -8.721 1033 2HE LYS 41 2HE LYS 131 -12.277 1.468 -8.917 1034 1HZ LYS 41 1HZ LYS 131 -10.922 1.806 -10.842 1035 2HZ LYS 41 2HZ LYS 131 -11.185 3.251 -10.124 1036 H VAL 42 H VAL 132 -9.085 2.290 -2.189 1037 HA VAL 42 HA VAL 132 -10.142 4.038 -0.208 1038 HB VAL 42 HB VAL 132 -7.307 3.270 -1.060 1039 1HG1 VAL 42 3HG2 VAL 132 -7.674 4.850 0.954 1040 2HG1 VAL 42 1HG2 VAL 132 -8.468 3.462 1.753 1041 3HG1 VAL 42 2HG2 VAL 132 -6.762 3.334 1.239 1042 1HG2 VAL 42 3HG1 VAL 132 -8.666 1.079 -0.805 1043 2HG2 VAL 42 1HG1 VAL 132 -7.455 1.291 0.474 1044 3HG2 VAL 42 2HG1 VAL 132 -9.162 1.657 0.809 1045 H GLN 43 H GLN 133 -7.690 5.548 -0.491 1046 HA GLN 43 HA GLN 133 -6.712 6.708 -2.154 1047 1HB GLN 43 1HB GLN 133 -9.126 8.064 -3.127 1048 2HB GLN 43 2HB GLN 133 -7.560 8.866 -3.315 1049 1HG GLN 43 1HG GLN 133 -6.589 6.932 -4.403 1050 2HG GLN 43 2HG GLN 133 -8.007 5.962 -4.192 1051 1HE2 GLN 43 2HE2 GLN 133 -9.016 6.987 -7.482 1052 2HE2 GLN 43 1HE2 GLN 133 -8.646 5.653 -6.281 1053 H LEU 44 H LEU 134 -5.309 8.300 -2.188 1054 HA LEU 44 HA LEU 134 -5.175 10.088 0.258 1055 1HB LEU 44 2HB LEU 134 -2.981 8.036 -0.424 1056 2HB LEU 44 1HB LEU 134 -2.758 9.346 0.713 1057 HG LEU 44 HG LEU 134 -4.920 7.195 1.123 1058 1HD1 LEU 44 1HD1 LEU 134 -2.741 6.025 0.883 1059 2HD1 LEU 44 2HD1 LEU 134 -2.006 7.080 2.114 1060 3HD1 LEU 44 3HD1 LEU 134 -3.318 5.956 2.557 1061 1HD2 LEU 44 2HD2 LEU 134 -5.161 9.274 2.528 1062 2HD2 LEU 44 3HD2 LEU 134 -4.722 7.881 3.537 1063 3HD2 LEU 44 1HD2 LEU 134 -3.492 9.096 3.110 1064 H ILE 45 H ILE 135 -4.774 12.023 -0.760 1065 HA ILE 45 HA ILE 135 -3.552 12.098 -3.452 1066 HB ILE 45 HB ILE 135 -5.472 13.555 -2.830 1067 1HG1 ILE 45 1HG1 ILE 135 -4.706 15.621 -4.039 1068 2HG1 ILE 45 2HG1 ILE 135 -3.048 15.051 -3.994 1069 1HG2 ILE 45 3HG2 ILE 135 -4.716 14.323 -0.600 1070 2HG2 ILE 45 1HG2 ILE 135 -3.393 15.259 -1.343 1071 3HG2 ILE 45 2HG2 ILE 135 -5.097 15.700 -1.664 1072 1HD1 ILE 45 2HD1 ILE 135 -5.396 13.594 -5.406 1073 2HD1 ILE 45 3HD1 ILE 135 -4.185 14.627 -6.202 1074 3HD1 ILE 45 1HD1 ILE 135 -3.684 13.091 -5.468 1075 H GLY 46 H GLY 136 -1.690 13.119 -4.026 1076 1HA GLY 46 1HA GLY 136 0.693 13.332 -3.975 1077 2HA GLY 46 2HA GLY 136 0.490 13.981 -2.369 1078 H PHE 47 H PHE 137 -0.531 10.725 -2.317 1079 HA PHE 47 HA PHE 137 2.194 9.549 -1.807 1080 1HB PHE 47 2HB PHE 137 1.013 10.646 0.200 1081 2HB PHE 47 1HB PHE 137 -0.254 9.455 0.117 1082 HD1 PHE 47 HD2 PHE 137 3.424 9.863 0.814 1083 HD2 PHE 47 HD1 PHE 137 0.140 7.075 0.717 1084 HE1 PHE 47 HE2 PHE 137 4.882 8.056 1.664 1085 HE2 PHE 47 HE1 PHE 137 1.640 5.299 1.501 1086 HZ PHE 47 HZ PHE 137 4.040 5.782 1.852 1087 H GLY 48 H GLY 138 -1.325 8.665 -2.339 1088 1HA GLY 48 1HA GLY 138 -0.502 6.066 -3.350 1089 2HA GLY 48 2HA GLY 138 -1.043 5.874 -1.703 1090 H ASN 49 H ASN 139 -2.026 4.883 -4.336 1091 HA ASN 49 HA ASN 139 -4.998 5.460 -3.801 1092 1HB ASN 49 1HB ASN 139 -3.784 5.120 -6.609 1093 2HB ASN 49 2HB ASN 139 -5.487 5.201 -6.225 1094 1HD2 ASN 49 1HD2 ASN 139 -4.736 8.529 -7.516 1095 2HD2 ASN 49 2HD2 ASN 139 -4.843 6.786 -8.076 1096 H PHE 50 H PHE 140 -5.405 3.616 -2.677 1097 HA PHE 50 HA PHE 140 -4.332 0.940 -3.610 1098 1HB PHE 50 2HB PHE 140 -6.311 1.425 -1.359 1099 2HB PHE 50 1HB PHE 140 -5.718 -0.114 -1.723 1100 HD1 PHE 50 HD2 PHE 140 -4.951 3.218 -0.463 1101 HD2 PHE 50 HD1 PHE 140 -4.133 -0.961 -0.245 1102 HE1 PHE 50 HE2 PHE 140 -3.651 3.585 1.639 1103 HE2 PHE 50 HE1 PHE 140 -2.854 -0.586 1.858 1104 HZ PHE 50 HZ PHE 140 -2.600 1.705 2.707 1105 H GLU 51 H GLU 141 -5.602 -0.692 -4.289 1106 HA GLU 51 HA GLU 141 -8.393 -0.736 -4.099 1107 1HB GLU 51 1HB GLU 141 -9.197 -0.538 -6.526 1108 2HB GLU 51 2HB GLU 141 -8.536 0.975 -5.983 1109 1HG GLU 51 1HG GLU 141 -6.995 -1.034 -7.763 1110 2HG GLU 51 2HG GLU 141 -7.985 0.273 -8.377 1111 HE2 GLU 51 HE2 GLU 141 -4.248 0.950 -7.198 1112 H VAL 52 H VAL 142 -9.592 -2.579 -5.073 1113 HA VAL 52 HA VAL 142 -7.760 -4.868 -4.949 1114 HB VAL 52 HB VAL 142 -10.176 -4.031 -3.683 1115 1HG1 VAL 52 1HG2 VAL 142 -11.008 -6.015 -5.814 1116 2HG1 VAL 52 2HG2 VAL 142 -11.924 -5.562 -4.330 1117 3HG1 VAL 52 3HG2 VAL 142 -11.552 -4.342 -5.591 1118 1HG2 VAL 52 1HG1 VAL 142 -8.956 -6.795 -3.819 1119 2HG2 VAL 52 2HG1 VAL 142 -8.605 -5.466 -2.684 1120 3HG2 VAL 52 3HG1 VAL 142 -10.193 -6.237 -2.682 1121 NH1 ARG 53 NH2 ARG 143 -3.879 -10.581 -10.884 1122 NH2 ARG 53 NH1 ARG 143 -5.555 -11.849 -10.018 1123 H ARG 53 H ARG 143 -8.081 -6.703 -6.346 1124 HA ARG 53 HA ARG 143 -8.896 -5.977 -9.235 1125 1HB ARG 53 1HB ARG 143 -6.350 -6.011 -8.802 1126 2HB ARG 53 2HB ARG 143 -6.508 -7.689 -8.381 1127 1HG ARG 53 1HG ARG 143 -7.766 -7.702 -10.904 1128 2HG ARG 53 2HG ARG 143 -6.678 -6.346 -11.080 1129 1HD ARG 53 1HD ARG 143 -5.481 -8.247 -11.911 1130 2HD ARG 53 2HD ARG 143 -4.733 -7.895 -10.348 1131 1HH1 ARG 53 2HH2 ARG 143 -3.571 -9.656 -11.204 1132 2HH1 ARG 53 1HH2 ARG 143 -3.323 -11.443 -10.870 1133 1HH2 ARG 53 1HH1 ARG 143 -6.522 -11.893 -9.677 1134 2HH2 ARG 53 2HH1 ARG 143 -4.884 -12.623 -10.066 1135 H GLU 54 H GLU 144 -10.889 -6.936 -9.048 1136 HA GLU 54 HA GLU 144 -11.328 -9.634 -7.931 1137 1HB GLU 54 1HB GLU 144 -13.610 -9.516 -8.644 1138 2HB GLU 54 2HB GLU 144 -13.106 -8.093 -7.760 1139 1HG GLU 54 1HG GLU 144 -12.953 -6.797 -9.964 1140 2HG GLU 54 2HG GLU 144 -13.524 -8.225 -10.824 1141 HE1 GLU 54 HE2 GLU 144 -16.825 -7.941 -9.848 1142 NH1 ARG 55 NH2 ARG 145 -9.218 -15.517 -14.547 1143 NH2 ARG 55 NH1 ARG 145 -9.832 -13.556 -15.515 1144 H ARG 55 H ARG 145 -10.875 -11.500 -8.804 1145 HA ARG 55 HA ARG 145 -9.953 -11.707 -11.673 1146 1HB ARG 55 1HB ARG 145 -8.589 -12.708 -9.842 1147 2HB ARG 55 2HB ARG 145 -9.927 -13.724 -9.352 1148 1HG ARG 55 1HG ARG 145 -8.394 -15.087 -10.511 1149 2HG ARG 55 2HG ARG 145 -9.808 -14.991 -11.529 1150 1HD ARG 55 1HD ARG 145 -7.287 -13.243 -11.972 1151 2HD ARG 55 2HD ARG 145 -7.407 -14.863 -12.610 1152 1HH1 ARG 55 2HH2 ARG 145 -8.759 -15.986 -13.758 1153 2HH1 ARG 55 1HH2 ARG 145 -9.656 -15.965 -15.359 1154 1HH2 ARG 55 1HH1 ARG 145 -9.843 -12.531 -15.468 1155 2HH2 ARG 55 2HH1 ARG 145 -10.225 -14.141 -16.260 1156 H ALA 56 H ALA 146 -11.409 -12.207 -13.192 1157 HA ALA 56 HA ALA 146 -14.194 -12.934 -12.606 1158 1HB ALA 56 3HB ALA 146 -13.613 -11.543 -14.564 1159 2HB ALA 56 1HB ALA 146 -12.747 -12.901 -15.327 1160 3HB ALA 56 2HB ALA 146 -14.505 -12.989 -15.069 1161 H ALA 57 H ALA 147 -14.402 -14.888 -11.645 1162 HA ALA 57 HA ALA 147 -13.277 -17.316 -12.037 1163 1HB ALA 57 1HB ALA 147 -15.114 -16.849 -10.345 1164 2HB ALA 57 2HB ALA 147 -16.337 -16.964 -11.630 1165 3HB ALA 57 3HB ALA 147 -15.397 -18.397 -11.160 1166 NH1 ARG 58 NH2 ARG 148 -12.214 -14.985 -18.471 1167 NH2 ARG 58 NH1 ARG 148 -14.218 -15.000 -17.397 1168 H ARG 58 H ARG 148 -12.933 -18.825 -13.228 1169 HA ARG 58 HA ARG 148 -14.149 -18.809 -15.925 1170 1HB ARG 58 2HB ARG 148 -11.654 -20.340 -15.042 1171 2HB ARG 58 1HB ARG 148 -12.137 -20.101 -16.706 1172 1HG ARG 58 1HG ARG 148 -11.249 -17.821 -14.829 1173 2HG ARG 58 2HG ARG 148 -10.196 -18.747 -15.861 1174 1HD ARG 58 1HD ARG 148 -10.607 -16.701 -17.011 1175 2HD ARG 58 2HD ARG 148 -11.425 -17.966 -17.930 1176 1HH1 ARG 58 2HH2 ARG 148 -11.300 -15.434 -18.601 1177 2HH1 ARG 58 1HH2 ARG 148 -12.561 -14.147 -18.949 1178 1HH2 ARG 58 1HH1 ARG 148 -14.833 -15.456 -16.713 1179 2HH2 ARG 58 2HH1 ARG 148 -14.428 -14.160 -17.948 1180 H LYS 59 H LYS 149 -13.587 -21.372 -16.815 1181 HA LYS 59 HA LYS 149 -14.779 -23.442 -15.069 1182 1HB LYS 59 1HB LYS 149 -16.879 -22.377 -15.995 1183 2HB LYS 59 2HB LYS 149 -16.378 -22.805 -17.627 1184 1HG LYS 59 1HG LYS 149 -16.418 -25.254 -16.999 1185 2HG LYS 59 2HG LYS 149 -16.806 -24.838 -15.329 1186 1HD LYS 59 1HD LYS 149 -18.973 -23.786 -16.074 1187 2HD LYS 59 2HD LYS 149 -18.596 -24.176 -17.757 1188 1HE LYS 59 1HE LYS 149 -18.601 -26.644 -17.209 1189 2HE LYS 59 2HE LYS 149 -18.920 -26.285 -15.506 1190 1HZ LYS 59 1HZ LYS 149 -20.694 -25.611 -17.788 1191 2HZ LYS 59 2HZ LYS 149 -20.918 -26.835 -16.728 1192 H GLY 60 H GLY 150 -13.222 -24.843 -15.327 1193 1HA GLY 60 1HA GLY 150 -11.865 -25.242 -18.083 1194 2HA GLY 60 2HA GLY 150 -10.973 -25.208 -16.582 1195 NH1 ARG 61 NH2 ARG 151 -12.177 -33.278 -20.440 1196 NH2 ARG 61 NH1 ARG 151 -13.782 -32.348 -21.753 1197 H ARG 61 H ARG 151 -10.418 -27.169 -15.965 1198 HA ARG 61 HA ARG 151 -12.316 -29.516 -16.097 1199 1HB ARG 61 1HB ARG 151 -9.594 -29.438 -17.565 1200 2HB ARG 61 2HB ARG 151 -10.250 -30.959 -17.026 1201 1HG ARG 61 1HG ARG 151 -11.712 -29.101 -18.992 1202 2HG ARG 61 2HG ARG 151 -10.681 -30.456 -19.426 1203 1HD ARG 61 1HD ARG 151 -12.220 -32.028 -18.083 1204 2HD ARG 61 2HD ARG 151 -13.289 -30.672 -17.793 1205 1HH1 ARG 61 2HH2 ARG 151 -11.625 -33.220 -19.577 1206 2HH1 ARG 61 1HH2 ARG 151 -12.119 -34.007 -21.159 1207 1HH2 ARG 61 1HH1 ARG 151 -14.455 -31.586 -21.894 1208 2HH2 ARG 61 2HH1 ARG 151 -13.613 -33.142 -22.381 1209 H ASN 62 H ASN 152 -11.947 -31.101 -14.716 1210 HA ASN 62 HA ASN 152 -10.450 -30.433 -12.255 1211 1HB ASN 62 1HB ASN 152 -12.769 -31.469 -12.364 1212 2HB ASN 62 2HB ASN 152 -12.044 -32.976 -12.908 1213 1HD2 ASN 62 2HD2 ASN 152 -12.052 -32.235 -8.946 1214 2HD2 ASN 62 1HD2 ASN 152 -12.807 -31.091 -10.166 1215 HA PRO 63 HA PRO 153 -6.589 -32.560 -13.645 1216 1HB PRO 63 1HB PRO 153 -6.089 -32.805 -10.635 1217 2HB PRO 63 2HB PRO 153 -4.963 -32.318 -11.919 1218 1HG PRO 63 1HG PRO 153 -6.153 -30.413 -10.391 1219 2HG PRO 63 2HG PRO 153 -6.025 -30.154 -12.147 1220 1HD PRO 63 1HD PRO 153 -8.485 -31.056 -10.558 1221 2HD PRO 63 2HD PRO 153 -8.360 -29.894 -11.915 1222 H GLN 64 H GLN 154 -8.289 -34.251 -10.949 1223 HA GLN 64 HA GLN 154 -7.078 -36.892 -11.646 1224 1HB GLN 64 1HB GLN 154 -9.000 -37.751 -9.960 1225 2HB GLN 64 2HB GLN 154 -7.458 -37.135 -9.437 1226 1HG GLN 64 1HG GLN 154 -8.512 -34.906 -8.889 1227 2HG GLN 64 2HG GLN 154 -10.062 -35.516 -9.472 1228 1HE2 GLN 64 2HE2 GLN 154 -10.751 -37.275 -6.408 1229 2HE2 GLN 64 1HE2 GLN 154 -11.283 -36.841 -8.110 1230 H THR 65 H THR 155 -10.393 -35.651 -11.727 1231 HA THR 65 HA THR 155 -11.326 -38.101 -13.146 1232 HB THR 65 HB THR 155 -13.575 -37.278 -12.590 1233 HG1 THR 65 HG1 THR 155 -12.238 -35.021 -11.554 1234 1HG2 THR 65 1HG2 THR 155 -12.151 -38.479 -10.777 1235 2HG2 THR 65 2HG2 THR 155 -11.682 -36.897 -10.162 1236 3HG2 THR 65 3HG2 THR 155 -13.383 -37.372 -10.089 1237 H GLY 66 H GLY 156 -10.817 -34.812 -14.266 1238 1HA GLY 66 1HA GLY 156 -11.042 -33.936 -16.484 1239 2HA GLY 66 2HA GLY 156 -11.462 -35.532 -17.066 1240 H GLU 67 H GLU 157 -13.304 -33.753 -14.567 1241 HA GLU 67 HA GLU 157 -15.681 -33.476 -16.457 1242 1HB GLU 67 2HB GLU 157 -15.881 -34.887 -14.321 1243 2HB GLU 67 1HB GLU 157 -15.588 -33.437 -13.363 1244 1HG GLU 67 1HG GLU 157 -17.968 -33.865 -13.390 1245 2HG GLU 67 2HG GLU 157 -17.686 -32.387 -14.287 1246 HE1 GLU 67 HE2 GLU 157 -18.290 -35.719 -14.491 1247 H GLU 68 H GLU 158 -16.515 -31.459 -16.741 1248 HA GLU 68 HA GLU 158 -14.683 -29.238 -16.434 1249 1HB GLU 68 1HB GLU 158 -17.627 -29.106 -17.333 1250 2HB GLU 68 2HB GLU 158 -16.520 -27.737 -17.355 1251 1HG GLU 68 1HG GLU 158 -14.978 -28.953 -18.933 1252 2HG GLU 68 2HG GLU 158 -16.080 -30.327 -18.966 1253 HE1 GLU 68 HE2 GLU 158 -18.415 -28.862 -21.047 1254 H MET 69 H MET 159 -14.277 -28.137 -14.734 1255 HA MET 69 HA MET 159 -16.359 -27.701 -12.528 1256 1HB MET 69 1HB MET 159 -14.628 -27.920 -10.863 1257 2HB MET 69 2HB MET 159 -14.640 -29.329 -11.891 1258 1HG MET 69 1HG MET 159 -12.336 -28.953 -11.604 1259 2HG MET 69 2HG MET 159 -12.599 -28.170 -13.172 1260 1HE MET 69 2HE MET 159 -10.089 -27.591 -11.922 1261 2HE MET 69 1HE MET 159 -10.550 -26.336 -13.117 1262 3HE MET 69 3HE MET 159 -9.929 -25.863 -11.507 1263 H GLU 70 H GLU 160 -16.568 -25.770 -11.655 1264 HA GLU 70 HA GLU 160 -15.571 -23.391 -13.078 1265 1HB GLU 70 2HB GLU 160 -16.916 -21.995 -11.776 1266 2HB GLU 70 1HB GLU 160 -17.851 -23.404 -12.236 1267 1HG GLU 70 1HG GLU 160 -18.561 -23.011 -10.050 1268 2HG GLU 70 2HG GLU 160 -17.426 -24.327 -9.826 1269 HE1 GLU 70 HE2 GLU 160 -16.444 -20.529 -8.630 1270 H ILE 71 H ILE 161 -13.851 -22.126 -12.673 1271 HA ILE 71 HA ILE 161 -12.032 -22.722 -10.361 1272 HB ILE 71 HB ILE 161 -11.728 -21.146 -12.993 1273 1HG1 ILE 71 1HG1 ILE 161 -10.309 -23.766 -12.182 1274 2HG1 ILE 71 2HG1 ILE 161 -11.849 -23.825 -13.005 1275 1HG2 ILE 71 2HG2 ILE 161 -10.276 -20.171 -11.250 1276 2HG2 ILE 71 3HG2 ILE 161 -9.621 -21.788 -10.853 1277 3HG2 ILE 71 1HG2 ILE 161 -9.301 -21.047 -12.452 1278 1HD1 ILE 71 1HD1 ILE 161 -9.326 -22.566 -14.222 1279 2HD1 ILE 71 2HD1 ILE 161 -10.044 -24.144 -14.611 1280 3HD1 ILE 71 3HD1 ILE 161 -10.936 -22.657 -15.000 1281 HA PRO 72 HA PRO 162 -14.571 -19.175 -8.760 1282 1HB PRO 72 1HB PRO 162 -13.773 -19.153 -6.089 1283 2HB PRO 72 2HB PRO 162 -14.848 -20.358 -6.813 1284 1HG PRO 72 1HG PRO 162 -11.829 -20.598 -6.358 1285 2HG PRO 72 2HG PRO 162 -13.098 -21.762 -5.899 1286 1HD PRO 72 1HD PRO 162 -11.640 -22.057 -8.218 1287 2HD PRO 72 2HD PRO 162 -13.371 -22.512 -8.171 1288 H ALA 73 H ALA 163 -14.437 -17.085 -7.954 1289 HA ALA 73 HA ALA 163 -12.163 -15.476 -8.958 1290 1HB ALA 73 2HB ALA 163 -14.576 -14.587 -8.944 1291 2HB ALA 73 3HB ALA 163 -14.536 -14.560 -7.143 1292 3HB ALA 73 1HB ALA 163 -13.481 -13.503 -8.073 1293 H SER 74 H SER 164 -11.267 -13.780 -7.792 1294 HA SER 74 HA SER 164 -11.593 -13.534 -5.023 1295 1HB SER 74 1HB SER 164 -8.676 -14.495 -5.680 1296 2HB SER 74 2HB SER 164 -9.069 -13.688 -4.161 1297 HG SER 74 HG SER 164 -10.572 -15.325 -3.731 1298 H LYS 75 H LYS 165 -11.154 -11.601 -4.233 1299 HA LYS 75 HA LYS 165 -10.217 -9.417 -6.091 1300 1HB LYS 75 2HB LYS 165 -10.803 -8.591 -3.312 1301 2HB LYS 75 1HB LYS 165 -11.088 -7.846 -4.857 1302 1HG LYS 75 1HG LYS 165 -13.069 -9.394 -5.235 1303 2HG LYS 75 2HG LYS 165 -12.764 -10.122 -3.654 1304 1HD LYS 75 1HD LYS 165 -13.076 -7.773 -2.593 1305 2HD LYS 75 2HD LYS 165 -13.516 -7.188 -4.191 1306 1HE LYS 75 1HE LYS 165 -15.586 -7.572 -3.060 1307 2HE LYS 75 2HE LYS 165 -15.459 -8.859 -4.256 1308 1HZ LYS 75 1HZ LYS 165 -14.835 -9.091 -1.357 1309 2HZ LYS 75 2HZ LYS 165 -16.184 -9.648 -2.093 1310 H VAL 76 H VAL 166 -7.933 -8.797 -6.181 1311 HA VAL 76 HA VAL 166 -6.187 -9.717 -4.079 1312 HB VAL 76 HB VAL 166 -6.545 -9.445 -7.041 1313 1HG1 VAL 76 1HG2 VAL 166 -3.849 -8.984 -5.976 1314 2HG1 VAL 76 2HG2 VAL 166 -4.355 -9.424 -7.693 1315 3HG1 VAL 76 3HG2 VAL 166 -4.892 -7.898 -6.965 1316 1HG2 VAL 76 3HG1 VAL 166 -6.690 -11.607 -5.895 1317 2HG2 VAL 76 1HG1 VAL 166 -5.406 -11.552 -7.116 1318 3HG2 VAL 76 2HG1 VAL 166 -4.983 -11.439 -5.373 1319 HA PRO 77 HA PRO 167 -6.090 -5.175 -3.218 1320 1HB PRO 77 1HB PRO 167 -4.747 -5.254 -0.781 1321 2HB PRO 77 2HB PRO 167 -6.368 -5.946 -0.964 1322 1HG PRO 77 1HG PRO 167 -3.686 -7.423 -1.087 1323 2HG PRO 77 2HG PRO 167 -5.101 -7.842 -0.113 1324 1HD PRO 77 1HD PRO 167 -4.528 -8.960 -2.718 1325 2HD PRO 77 2HD PRO 167 -6.209 -8.804 -2.139 1326 H ALA 78 H ALA 168 -5.026 -3.678 -3.729 1327 HA ALA 78 HA ALA 168 -1.994 -3.752 -4.164 1328 1HB ALA 78 3HB ALA 168 -3.526 -4.184 -6.203 1329 2HB ALA 78 1HB ALA 168 -4.164 -2.535 -6.005 1330 3HB ALA 78 2HB ALA 168 -2.442 -2.781 -6.372 1331 H PHE 79 H PHE 169 -1.148 -1.706 -4.512 1332 HA PHE 79 HA PHE 169 -2.266 0.764 -3.015 1333 1HB PHE 79 2HB PHE 169 -1.410 -0.124 -1.210 1334 2HB PHE 79 1HB PHE 169 0.046 -0.740 -2.065 1335 HD1 PHE 79 HD2 PHE 169 -1.519 2.370 -0.673 1336 HD2 PHE 79 HD1 PHE 169 2.019 0.679 -2.434 1337 HE1 PHE 79 HE2 PHE 169 -0.274 4.434 -0.181 1338 HE2 PHE 79 HE1 PHE 169 3.223 2.778 -2.017 1339 HZ PHE 79 HZ PHE 169 2.074 4.672 -0.938 1340 H LYS 80 H LYS 170 -1.850 2.062 -4.519 1341 HA LYS 80 HA LYS 170 0.429 2.142 -6.682 1342 1HB LYS 80 2HB LYS 170 -2.021 3.910 -6.392 1343 2HB LYS 80 1HB LYS 170 -0.708 4.200 -7.520 1344 1HG LYS 80 1HG LYS 170 -1.137 2.043 -8.688 1345 2HG LYS 80 2HG LYS 170 -2.415 1.627 -7.544 1346 1HD LYS 80 1HD LYS 170 -3.784 3.574 -8.266 1347 2HD LYS 80 2HD LYS 170 -2.502 4.125 -9.353 1348 1HE LYS 80 1HE LYS 170 -2.729 2.005 -10.717 1349 2HE LYS 80 2HE LYS 170 -3.974 1.408 -9.609 1350 1HZ LYS 80 1HZ LYS 170 -4.908 2.448 -11.568 1351 2HZ LYS 80 2HZ LYS 170 -4.160 3.868 -11.258 1352 HA PRO 81 HA PRO 171 2.285 5.123 -3.733 1353 1HB PRO 81 1HB PRO 171 4.545 5.795 -5.144 1354 2HB PRO 81 2HB PRO 171 4.251 4.154 -4.551 1355 1HG PRO 81 1HG PRO 171 3.738 5.240 -7.378 1356 2HG PRO 81 2HG PRO 171 4.698 3.806 -6.927 1357 1HD PRO 81 1HD PRO 171 1.991 3.686 -7.655 1358 2HD PRO 81 2HD PRO 171 2.735 2.509 -6.525 1359 H GLY 82 H GLY 172 -0.008 6.041 -5.136 1360 1HA GLY 82 1HA GLY 172 -1.080 7.753 -6.434 1361 2HA GLY 82 2HA GLY 172 -0.218 8.714 -5.249 1362 H LYS 83 H LYS 173 1.789 7.177 -7.541 1363 HA LYS 83 HA LYS 173 3.229 7.990 -9.259 1364 1HB LYS 83 2HB LYS 173 0.907 9.802 -9.763 1365 2HB LYS 83 1HB LYS 173 2.376 10.620 -10.099 1366 1HG LYS 83 1HG LYS 173 1.579 7.871 -11.293 1367 2HG LYS 83 2HG LYS 173 1.310 9.419 -12.084 1368 1HD LYS 83 1HD LYS 173 3.785 9.862 -12.169 1369 2HD LYS 83 2HD LYS 173 4.108 8.335 -11.346 1370 1HE LYS 83 1HE LYS 173 3.026 7.063 -13.266 1371 2HE LYS 83 2HE LYS 173 2.727 8.593 -14.104 1372 1HZ LYS 83 1HZ LYS 173 5.403 7.580 -13.312 1373 2HZ LYS 83 2HZ LYS 173 5.127 8.990 -14.092 1374 H ALA 84 H ALA 174 2.156 10.363 -7.192 1375 HA ALA 84 HA ALA 174 4.240 12.357 -7.009 1376 1HB ALA 84 2HB ALA 174 1.861 12.518 -6.224 1377 2HB ALA 84 3HB ALA 174 2.141 11.225 -5.030 1378 3HB ALA 84 1HB ALA 174 2.967 12.794 -4.837 1379 H LEU 85 H LEU 175 3.692 9.416 -4.860 1380 HA LEU 85 HA LEU 175 6.149 9.834 -3.342 1381 1HB LEU 85 2HB LEU 175 4.255 8.536 -2.392 1382 2HB LEU 85 1HB LEU 175 4.385 7.359 -3.681 1383 HG LEU 85 HG LEU 175 6.782 7.063 -2.996 1384 1HD1 LEU 85 2HD1 LEU 175 5.856 8.446 -0.431 1385 2HD1 LEU 85 3HD1 LEU 175 7.343 7.458 -0.528 1386 3HD1 LEU 85 1HD1 LEU 175 7.187 8.938 -1.491 1387 1HD2 LEU 85 3HD2 LEU 175 5.040 5.301 -2.571 1388 2HD2 LEU 85 1HD2 LEU 175 6.150 5.338 -1.190 1389 3HD2 LEU 85 2HD2 LEU 175 4.542 6.101 -1.065 1390 H LYS 86 H LYS 176 5.335 8.033 -6.291 1391 HA LYS 86 HA LYS 176 7.935 6.797 -6.736 1392 1HB LYS 86 1HB LYS 176 5.717 6.311 -8.008 1393 2HB LYS 86 2HB LYS 176 6.131 7.658 -9.056 1394 1HG LYS 86 1HG LYS 176 8.305 6.496 -9.653 1395 2HG LYS 86 2HG LYS 176 7.890 5.173 -8.557 1396 1HD LYS 86 1HD LYS 176 5.806 4.701 -9.930 1397 2HD LYS 86 2HD LYS 176 6.242 6.014 -11.031 1398 1HE LYS 86 1HE LYS 176 8.413 4.804 -11.604 1399 2HE LYS 86 2HE LYS 176 7.964 3.489 -10.507 1400 1HZ LYS 86 1HZ LYS 176 5.975 3.129 -11.862 1401 2HZ LYS 86 2HZ LYS 176 6.389 4.344 -12.874 1402 H ASP 87 H ASP 177 7.021 10.180 -7.095 1403 HA ASP 87 HA ASP 177 9.494 10.975 -8.539 1404 1HB ASP 87 1HB ASP 177 6.842 12.040 -8.042 1405 2HB ASP 87 2HB ASP 177 7.848 13.008 -7.054 1406 HD1 ASP 87 HD2 ASP 177 9.446 14.626 -9.717 1407 H ALA 88 H ALA 178 8.252 11.094 -5.144 1408 HA ALA 88 HA ALA 178 10.445 12.392 -3.759 1409 1HB ALA 88 3HB ALA 178 8.284 11.532 -2.572 1410 2HB ALA 88 1HB ALA 178 8.875 9.879 -2.759 1411 3HB ALA 88 2HB ALA 178 9.769 10.980 -1.746 1412 H VAL 89 H VAL 179 9.976 8.946 -4.555 1413 HA VAL 89 HA VAL 179 12.512 8.054 -3.395 1414 HB VAL 89 HB VAL 179 9.881 7.401 -3.215 1415 1HG1 VAL 89 2HG2 VAL 179 9.785 7.200 -5.827 1416 2HG1 VAL 89 3HG2 VAL 179 10.483 5.596 -5.594 1417 3HG1 VAL 89 1HG2 VAL 179 8.933 6.047 -4.808 1418 1HG2 VAL 89 3HG1 VAL 179 11.938 5.270 -3.492 1419 2HG2 VAL 89 1HG1 VAL 179 11.514 6.280 -2.057 1420 3HG2 VAL 89 2HG1 VAL 179 10.287 5.184 -2.750 1421 H LYS 90 H LYS 180 11.902 9.139 -6.536 1422 HA LYS 90 HA LYS 180 12.946 7.073 -8.215 1423 1HB LYS 90 1HB LYS 180 11.607 9.387 -8.642 1424 2HB LYS 90 2HB LYS 180 13.181 10.074 -8.898 1425 1HG LYS 90 1HG LYS 180 13.561 8.582 -10.852 1426 2HG LYS 90 2HG LYS 180 12.198 7.566 -10.402 1427 1HD LYS 90 1HD LYS 180 11.422 8.890 -12.223 1428 2HD LYS 90 2HD LYS 180 10.586 9.462 -10.788 1429 1HE LYS 90 1HE LYS 180 12.211 11.441 -10.652 1430 2HE LYS 90 2HE LYS 180 13.025 10.854 -12.110 1431 1HZ LYS 90 1HZ LYS 180 11.389 12.550 -12.589 1432 2HZ LYS 90 2HZ LYS 180 10.182 11.684 -11.909 Start of MODEL 11 Raw file had 1432 H/Q atoms Start of MODEL 11 1 1H MET 1 1H MET 1 -10.299 4.910 -2.769 2 2H MET 1 2H MET 1 -8.847 5.403 -3.335 3 HA MET 1 HA MET 1 -10.990 7.171 -2.342 4 1HB MET 1 1HB MET 1 -8.445 6.077 -0.976 5 2HB MET 1 2HB MET 1 -9.171 7.566 -0.467 6 1HG MET 1 1HG MET 1 -10.358 6.316 0.980 7 2HG MET 1 2HG MET 1 -11.452 6.022 -0.357 8 1HE MET 1 2HE MET 1 -10.330 4.400 2.474 9 2HE MET 1 1HE MET 1 -9.618 2.807 2.071 10 3HE MET 1 3HE MET 1 -8.610 4.263 2.024 11 H ASN 2 H ASN 2 -7.776 8.182 -1.944 12 HA ASN 2 HA ASN 2 -6.785 9.328 -4.059 13 1HB ASN 2 1HB ASN 2 -7.396 11.655 -4.545 14 2HB ASN 2 2HB ASN 2 -8.562 10.449 -4.986 15 1HD2 ASN 2 1HD2 ASN 2 -11.142 12.392 -3.487 16 2HD2 ASN 2 2HD2 ASN 2 -10.571 11.233 -4.795 17 H LYS 3 H LYS 3 -7.727 10.237 -0.975 18 HA LYS 3 HA LYS 3 -5.666 10.235 0.672 19 1HB LYS 3 1HB LYS 3 -4.139 11.575 -0.915 20 2HB LYS 3 2HB LYS 3 -5.092 12.997 -0.570 21 1HG LYS 3 1HG LYS 3 -4.406 12.708 1.924 22 2HG LYS 3 2HG LYS 3 -3.573 11.228 1.483 23 1HD LYS 3 1HD LYS 3 -1.857 12.809 1.691 24 2HD LYS 3 2HD LYS 3 -2.031 12.595 -0.046 25 1HE LYS 3 1HE LYS 3 -3.427 14.765 -0.121 26 2HE LYS 3 2HE LYS 3 -3.203 14.941 1.624 27 1HZ LYS 3 1HZ LYS 3 -1.037 14.893 -0.404 28 2HZ LYS 3 2HZ LYS 3 -1.609 16.222 0.357 29 H THR 4 H THR 4 -8.238 12.387 -0.456 30 HA THR 4 HA THR 4 -8.739 13.517 2.187 31 HB THR 4 HB THR 4 -9.689 13.988 -0.715 32 HG1 THR 4 HG1 THR 4 -8.111 15.577 1.060 33 1HG2 THR 4 3HG2 THR 4 -10.356 15.351 1.888 34 2HG2 THR 4 1HG2 THR 4 -10.672 16.047 0.220 35 3HG2 THR 4 2HG2 THR 4 -11.449 14.496 0.734 36 H GLU 5 H GLU 5 -9.910 11.175 -0.073 37 HA GLU 5 HA GLU 5 -12.586 10.700 1.269 38 1HB GLU 5 1HB GLU 5 -11.004 8.751 -0.489 39 2HB GLU 5 2HB GLU 5 -12.656 8.529 0.039 40 1HG GLU 5 1HG GLU 5 -11.614 10.637 -1.934 41 2HG GLU 5 2HG GLU 5 -12.394 9.140 -2.375 42 HE1 GLU 5 HE2 GLU 5 -15.638 10.195 -1.723 43 H LEU 6 H LEU 6 -9.142 10.060 1.790 44 HA LEU 6 HA LEU 6 -9.478 7.897 3.702 45 1HB LEU 6 2HB LEU 6 -7.347 9.276 2.158 46 2HB LEU 6 1HB LEU 6 -7.003 9.696 3.792 47 HG LEU 6 HG LEU 6 -5.934 7.647 3.443 48 1HD1 LEU 6 2HD1 LEU 6 -7.140 7.217 5.519 49 2HD1 LEU 6 3HD1 LEU 6 -8.386 6.317 4.611 50 3HD1 LEU 6 1HD1 LEU 6 -6.733 5.732 4.631 51 1HD2 LEU 6 1HD2 LEU 6 -6.709 7.175 1.169 52 2HD2 LEU 6 2HD2 LEU 6 -6.632 5.672 2.107 53 3HD2 LEU 6 3HD2 LEU 6 -8.203 6.470 1.816 54 H ILE 7 H ILE 7 -9.133 11.475 3.767 55 HA ILE 7 HA ILE 7 -8.808 11.779 6.646 56 HB ILE 7 HB ILE 7 -10.066 13.763 4.677 57 1HG1 ILE 7 1HG1 ILE 7 -7.185 13.677 5.757 58 2HG1 ILE 7 2HG1 ILE 7 -7.580 12.848 4.314 59 1HG2 ILE 7 2HG2 ILE 7 -10.577 14.373 7.109 60 2HG2 ILE 7 3HG2 ILE 7 -8.843 14.359 7.438 61 3HG2 ILE 7 1HG2 ILE 7 -9.518 15.556 6.324 62 1HD1 ILE 7 1HD1 ILE 7 -8.558 15.100 3.393 63 2HD1 ILE 7 2HD1 ILE 7 -7.520 15.814 4.604 64 3HD1 ILE 7 3HD1 ILE 7 -6.807 14.723 3.370 65 H ASN 8 H ASN 8 -11.724 11.792 4.629 66 HA ASN 8 HA ASN 8 -13.573 11.655 7.002 67 1HB ASN 8 1HB ASN 8 -14.132 10.874 4.036 68 2HB ASN 8 2HB ASN 8 -15.357 10.931 5.279 69 1HD2 ASN 8 2HD2 ASN 8 -14.375 14.442 3.479 70 2HD2 ASN 8 1HD2 ASN 8 -13.543 12.859 3.068 71 H ALA 9 H ALA 9 -11.509 9.257 5.812 72 HA ALA 9 HA ALA 9 -13.165 6.889 6.691 73 1HB ALA 9 2HB ALA 9 -11.071 6.672 4.952 74 2HB ALA 9 3HB ALA 9 -10.032 7.010 6.329 75 3HB ALA 9 1HB ALA 9 -10.979 5.581 6.389 76 H VAL 10 H VAL 10 -10.384 8.831 7.869 77 HA VAL 10 HA VAL 10 -9.985 7.266 10.175 78 HB VAL 10 HB VAL 10 -8.930 10.108 9.923 79 1HG1 VAL 10 3HG2 VAL 10 -8.367 8.317 11.868 80 2HG1 VAL 10 1HG2 VAL 10 -7.070 7.916 10.699 81 3HG1 VAL 10 2HG2 VAL 10 -7.233 9.578 11.275 82 1HG2 VAL 10 1HG1 VAL 10 -8.196 7.745 8.210 83 2HG2 VAL 10 2HG1 VAL 10 -8.552 9.472 7.854 84 3HG2 VAL 10 3HG1 VAL 10 -6.978 9.053 8.584 85 H ALA 11 H ALA 11 -11.164 10.414 9.560 86 HA ALA 11 HA ALA 11 -11.994 10.795 12.234 87 1HB ALA 11 2HB ALA 11 -11.545 12.714 10.615 88 2HB ALA 11 3HB ALA 11 -12.981 12.261 9.663 89 3HB ALA 11 1HB ALA 11 -13.168 12.922 11.321 90 H GLU 12 H GLU 12 -13.681 9.132 9.647 91 HA GLU 12 HA GLU 12 -16.273 9.138 11.179 92 1HB GLU 12 1HB GLU 12 -16.363 9.029 8.662 93 2HB GLU 12 2HB GLU 12 -15.506 7.494 8.698 94 1HG GLU 12 1HG GLU 12 -17.827 7.025 8.324 95 2HG GLU 12 2HG GLU 12 -17.450 6.433 9.928 96 HE2 GLU 12 HE2 GLU 12 -18.253 7.420 11.612 97 H THR 13 H THR 13 -13.600 6.749 10.510 98 HA THR 13 HA THR 13 -14.871 5.009 12.632 99 HB THR 13 HB THR 13 -14.049 4.298 10.319 100 HG1 THR 13 HG1 THR 13 -13.796 2.215 11.164 101 1HG2 THR 13 1HG2 THR 13 -11.622 4.898 10.540 102 2HG2 THR 13 2HG2 THR 13 -11.469 3.648 11.797 103 3HG2 THR 13 3HG2 THR 13 -11.916 3.192 10.128 104 H SER 14 H SER 14 -13.185 7.350 13.083 105 HA SER 14 HA SER 14 -12.155 6.315 15.812 106 1HB SER 14 1HB SER 14 -10.512 8.345 14.173 107 2HB SER 14 2HB SER 14 -10.136 7.751 15.774 108 HG SER 14 HG SER 14 -9.052 6.616 14.181 109 H GLY 15 H GLY 15 -13.482 9.211 14.151 110 1HA GLY 15 1HA GLY 15 -14.466 11.156 15.063 111 2HA GLY 15 2HA GLY 15 -14.606 10.313 16.601 112 H LEU 16 H LEU 16 -12.031 11.607 14.602 113 HA LEU 16 HA LEU 16 -10.881 13.358 16.789 114 1HB LEU 16 1HB LEU 16 -8.792 13.305 15.611 115 2HB LEU 16 2HB LEU 16 -9.295 11.825 16.403 116 HG LEU 16 HG LEU 16 -9.889 10.770 14.482 117 1HD1 LEU 16 2HD1 LEU 16 -10.976 12.680 13.179 118 2HD1 LEU 16 3HD1 LEU 16 -9.307 13.177 12.775 119 3HD1 LEU 16 1HD1 LEU 16 -9.981 11.582 12.217 120 1HD2 LEU 16 3HD2 LEU 16 -7.785 10.245 14.755 121 2HD2 LEU 16 1HD2 LEU 16 -8.488 10.067 13.131 122 3HD2 LEU 16 2HD2 LEU 16 -7.374 11.386 13.422 123 H SER 17 H SER 17 -9.914 14.418 14.215 124 HA SER 17 HA SER 17 -12.125 16.430 13.532 125 1HB SER 17 1HB SER 17 -9.255 17.401 13.862 126 2HB SER 17 2HB SER 17 -10.659 18.335 13.401 127 HG SER 17 HG SER 17 -11.605 17.799 15.423 128 H LYS 18 H LYS 18 -11.889 17.397 11.464 129 HA LYS 18 HA LYS 18 -10.881 15.546 9.304 130 1HB LYS 18 1HB LYS 18 -12.430 18.180 9.212 131 2HB LYS 18 2HB LYS 18 -11.464 17.735 7.827 132 1HG LYS 18 1HG LYS 18 -13.696 16.959 7.429 133 2HG LYS 18 2HG LYS 18 -12.609 15.586 7.538 134 1HD LYS 18 1HD LYS 18 -13.420 15.174 9.931 135 2HD LYS 18 2HD LYS 18 -14.555 16.516 9.750 136 1HE LYS 18 1HE LYS 18 -15.674 15.286 7.820 137 2HE LYS 18 2HE LYS 18 -14.498 13.971 7.976 138 1HZ LYS 18 1HZ LYS 18 -16.562 13.489 9.105 139 2HZ LYS 18 2HZ LYS 18 -16.436 14.810 10.059 140 H LYS 19 H LYS 19 -9.854 18.677 10.636 141 HA LYS 19 HA LYS 19 -7.290 18.836 9.196 142 1HB LYS 19 2HB LYS 19 -8.377 20.750 10.481 143 2HB LYS 19 1HB LYS 19 -7.929 19.963 11.998 144 1HG LYS 19 1HG LYS 19 -5.450 20.126 11.228 145 2HG LYS 19 2HG LYS 19 -6.012 20.955 9.787 146 1HD LYS 19 1HD LYS 19 -5.258 22.658 11.252 147 2HD LYS 19 2HD LYS 19 -7.014 22.787 11.266 148 1HE LYS 19 1HE LYS 19 -7.069 21.535 13.500 149 2HE LYS 19 2HE LYS 19 -5.307 21.380 13.449 150 1HZ LYS 19 1HZ LYS 19 -6.826 23.929 13.530 151 2HZ LYS 19 2HZ LYS 19 -6.036 23.244 14.787 152 H ASP 20 H ASP 20 -8.210 17.083 12.269 153 HA ASP 20 HA ASP 20 -5.367 16.243 12.779 154 1HB ASP 20 1HB ASP 20 -8.045 15.421 14.050 155 2HB ASP 20 2HB ASP 20 -6.622 14.468 14.368 156 HD1 ASP 20 HD2 ASP 20 -4.962 16.740 16.350 157 H ALA 21 H ALA 21 -8.033 14.830 11.013 158 HA ALA 21 HA ALA 21 -6.714 12.208 10.524 159 1HB ALA 21 2HB ALA 21 -9.248 13.587 9.428 160 2HB ALA 21 3HB ALA 21 -8.667 12.005 8.833 161 3HB ALA 21 1HB ALA 21 -9.092 12.226 10.510 162 H THR 22 H THR 22 -6.919 15.294 8.641 163 HA THR 22 HA THR 22 -5.411 14.445 6.322 164 HB THR 22 HB THR 22 -5.316 17.272 7.582 165 HG1 THR 22 HG1 THR 22 -7.380 16.190 5.998 166 1HG2 THR 22 2HG2 THR 22 -5.329 16.198 4.696 167 2HG2 THR 22 3HG2 THR 22 -5.465 17.927 5.127 168 3HG2 THR 22 1HG2 THR 22 -3.977 17.000 5.532 169 H LYS 23 H LYS 23 -4.300 15.908 9.305 170 HA LYS 23 HA LYS 23 -1.413 15.796 8.753 171 1HB LYS 23 2HB LYS 23 -3.122 15.648 11.378 172 2HB LYS 23 1HB LYS 23 -1.399 15.653 11.463 173 1HG LYS 23 1HG LYS 23 -1.343 17.918 10.211 174 2HG LYS 23 2HG LYS 23 -3.090 17.989 10.356 175 1HD LYS 23 1HD LYS 23 -1.078 17.861 12.702 176 2HD LYS 23 2HD LYS 23 -1.835 19.321 12.082 177 1HE LYS 23 1HE LYS 23 -4.133 18.396 12.732 178 2HE LYS 23 2HE LYS 23 -3.331 16.978 13.430 179 1HZ LYS 23 1HZ LYS 23 -3.813 18.663 15.071 180 2HZ LYS 23 2HZ LYS 23 -2.923 19.786 14.284 181 H ALA 24 H ALA 24 -3.398 13.629 10.650 182 HA ALA 24 HA ALA 24 -1.408 11.715 11.355 183 1HB ALA 24 2HB ALA 24 -3.482 12.027 12.510 184 2HB ALA 24 3HB ALA 24 -4.423 11.436 11.098 185 3HB ALA 24 1HB ALA 24 -3.333 10.320 12.005 186 H VAL 25 H VAL 25 -3.474 11.650 8.467 187 HA VAL 25 HA VAL 25 -2.325 9.169 7.256 188 HB VAL 25 HB VAL 25 -3.805 11.834 6.461 189 1HG1 VAL 25 3HG2 VAL 25 -2.740 9.895 4.317 190 2HG1 VAL 25 1HG2 VAL 25 -3.947 11.200 4.038 191 3HG1 VAL 25 2HG2 VAL 25 -2.307 11.597 4.521 192 1HG2 VAL 25 3HG1 VAL 25 -5.146 9.963 7.383 193 2HG2 VAL 25 1HG1 VAL 25 -5.642 10.415 5.748 194 3HG2 VAL 25 2HG1 VAL 25 -4.678 8.921 6.010 195 H ASP 26 H ASP 26 -1.526 12.652 6.670 196 HA ASP 26 HA ASP 26 1.206 11.897 5.587 197 1HB ASP 26 1HB ASP 26 -0.033 14.625 6.306 198 2HB ASP 26 2HB ASP 26 1.543 14.425 5.549 199 HD2 ASP 26 HD2 ASP 26 -1.762 14.388 3.330 200 H ALA 27 H ALA 27 0.454 11.364 8.257 201 HA ALA 27 HA ALA 27 2.976 12.071 9.797 202 1HB ALA 27 2HB ALA 27 0.573 12.533 10.808 203 2HB ALA 27 3HB ALA 27 0.565 10.795 11.078 204 3HB ALA 27 1HB ALA 27 1.795 11.852 11.804 205 H VAL 28 H VAL 28 0.856 9.351 9.057 206 HA VAL 28 HA VAL 28 2.733 7.118 9.684 207 HB VAL 28 HB VAL 28 0.242 7.264 7.806 208 1HG1 VAL 28 1HG2 VAL 28 1.577 4.722 8.945 209 2HG1 VAL 28 2HG2 VAL 28 0.045 4.817 8.051 210 3HG1 VAL 28 3HG2 VAL 28 1.537 5.256 7.229 211 1HG2 VAL 28 3HG1 VAL 28 -0.273 7.684 10.159 212 2HG2 VAL 28 1HG1 VAL 28 -0.997 6.185 9.493 213 3HG2 VAL 28 2HG1 VAL 28 0.471 6.094 10.579 214 H PHE 29 H PHE 29 1.450 8.457 6.810 215 HA PHE 29 HA PHE 29 3.397 7.375 4.813 216 1HB PHE 29 2HB PHE 29 1.401 9.551 4.230 217 2HB PHE 29 1HB PHE 29 2.276 8.572 3.054 218 HD1 PHE 29 HD2 PHE 29 2.177 5.823 3.723 219 HD2 PHE 29 HD1 PHE 29 -0.844 8.771 4.518 220 HE1 PHE 29 HE2 PHE 29 0.635 4.055 4.374 221 HE2 PHE 29 HE1 PHE 29 -2.366 6.994 5.239 222 HZ PHE 29 HZ PHE 29 -1.549 4.637 5.278 223 H ASP 30 H ASP 30 3.697 10.181 6.769 224 HA ASP 30 HA ASP 30 5.989 11.269 5.196 225 1HB ASP 30 1HB ASP 30 4.360 12.481 6.901 226 2HB ASP 30 2HB ASP 30 5.404 11.912 8.163 227 HD2 ASP 30 HD2 ASP 30 7.975 14.120 7.582 228 H SER 31 H SER 31 5.526 9.135 7.826 229 HA SER 31 HA SER 31 8.473 8.946 8.613 230 1HB SER 31 1HB SER 31 6.170 7.404 9.846 231 2HB SER 31 2HB SER 31 7.853 7.354 10.379 232 HG SER 31 HG SER 31 6.230 9.677 10.271 233 H ILE 32 H ILE 32 6.015 6.840 6.852 234 HA ILE 32 HA ILE 32 7.938 4.764 6.129 235 HB ILE 32 HB ILE 32 6.080 5.707 4.080 236 1HG1 ILE 32 1HG1 ILE 32 4.633 6.096 5.647 237 2HG1 ILE 32 2HG1 ILE 32 4.174 4.926 4.382 238 1HG2 ILE 32 3HG2 ILE 32 7.665 3.605 4.212 239 2HG2 ILE 32 1HG2 ILE 32 6.278 2.849 5.001 240 3HG2 ILE 32 2HG2 ILE 32 6.131 3.511 3.334 241 1HD1 ILE 32 2HD1 ILE 32 4.235 3.196 6.393 242 2HD1 ILE 32 3HD1 ILE 32 3.978 4.709 7.359 243 3HD1 ILE 32 1HD1 ILE 32 2.883 4.270 6.046 244 H THR 33 H THR 33 7.071 7.875 4.535 245 HA THR 33 HA THR 33 9.128 7.567 2.472 246 HB THR 33 HB THR 33 9.508 10.097 2.253 247 HG1 THR 33 HG1 THR 33 8.230 11.488 3.464 248 1HG2 THR 33 2HG2 THR 33 7.638 9.389 0.872 249 2HG2 THR 33 3HG2 THR 33 6.518 9.662 2.244 250 3HG2 THR 33 1HG2 THR 33 7.424 11.012 1.526 251 H GLU 34 H GLU 34 9.505 8.795 5.715 252 HA GLU 34 HA GLU 34 12.409 9.444 5.317 253 1HB GLU 34 1HB GLU 34 10.975 10.676 7.079 254 2HB GLU 34 2HB GLU 34 10.865 9.184 7.991 255 1HG GLU 34 1HG GLU 34 12.529 10.590 9.031 256 2HG GLU 34 2HG GLU 34 13.376 9.214 8.356 257 HE2 GLU 34 HE2 GLU 34 15.264 11.053 6.117 258 H ALA 35 H ALA 35 10.582 6.591 6.480 259 HA ALA 35 HA ALA 35 13.013 5.065 7.067 260 1HB ALA 35 1HB ALA 35 10.146 4.089 6.185 261 2HB ALA 35 2HB ALA 35 11.358 2.958 6.716 262 3HB ALA 35 3HB ALA 35 10.661 4.113 7.849 263 H LEU 36 H LEU 36 10.981 5.087 4.121 264 HA LEU 36 HA LEU 36 12.610 3.273 2.546 265 1HB LEU 36 2HB LEU 36 10.751 5.394 1.503 266 2HB LEU 36 1HB LEU 36 11.184 3.872 0.737 267 HG LEU 36 HG LEU 36 9.020 4.371 2.696 268 1HD1 LEU 36 1HD2 LEU 36 8.462 3.500 0.522 269 2HD1 LEU 36 2HD2 LEU 36 9.366 1.974 0.872 270 3HD1 LEU 36 3HD2 LEU 36 7.913 2.435 1.806 271 1HD2 LEU 36 1HD1 LEU 36 10.758 1.851 3.125 272 2HD2 LEU 36 2HD1 LEU 36 10.192 3.022 4.342 273 3HD2 LEU 36 3HD1 LEU 36 9.045 1.937 3.650 274 NH1 ARG 37 NH2 ARG 37 13.390 13.135 -0.483 275 NH2 ARG 37 NH1 ARG 37 15.196 14.390 0.085 276 H ARG 37 H ARG 37 12.470 6.896 2.609 277 HA ARG 37 HA ARG 37 14.432 7.196 0.551 278 1HB ARG 37 1HB ARG 37 12.778 8.953 1.281 279 2HB ARG 37 2HB ARG 37 13.570 9.029 2.863 280 1HG ARG 37 1HG ARG 37 15.652 9.979 1.678 281 2HG ARG 37 2HG ARG 37 14.684 10.049 0.196 282 1HD ARG 37 1HD ARG 37 12.909 11.394 1.505 283 2HD ARG 37 2HD ARG 37 13.952 11.322 2.913 284 1HH1 ARG 37 2HH2 ARG 37 12.803 12.319 -0.276 285 2HH1 ARG 37 1HH2 ARG 37 13.263 13.805 -1.250 286 1HH2 ARG 37 1HH1 ARG 37 15.985 14.536 0.724 287 2HH2 ARG 37 2HH1 ARG 37 14.944 14.970 -0.723 288 H LYS 38 H LYS 38 14.731 6.447 4.041 289 HA LYS 38 HA LYS 38 17.652 7.285 4.011 290 1HB LYS 38 1HB LYS 38 16.088 8.377 5.699 291 2HB LYS 38 2HB LYS 38 15.942 6.812 6.486 292 1HG LYS 38 1HG LYS 38 18.399 6.865 7.043 293 2HG LYS 38 2HG LYS 38 18.591 8.330 6.092 294 1HD LYS 38 1HD LYS 38 18.530 8.934 8.426 295 2HD LYS 38 2HD LYS 38 17.089 9.586 7.657 296 1HE LYS 38 1HE LYS 38 15.704 7.681 8.629 297 2HE LYS 38 2HE LYS 38 17.160 6.990 9.359 298 1HZ LYS 38 1HZ LYS 38 17.402 8.985 10.676 299 2HZ LYS 38 2HZ LYS 38 15.935 8.310 10.924 300 H GLY 39 H GLY 39 16.288 4.618 3.067 301 1HA GLY 39 1HA GLY 39 16.918 2.309 3.012 302 2HA GLY 39 2HA GLY 39 18.394 2.735 3.845 303 H ASP 40 H ASP 40 15.079 3.033 5.025 304 HA ASP 40 HA ASP 40 15.521 0.886 7.160 305 1HB ASP 40 1HB ASP 40 13.690 3.208 7.598 306 2HB ASP 40 2HB ASP 40 14.160 1.984 8.723 307 HD2 ASP 40 HD2 ASP 40 16.408 5.229 8.188 308 H LYS 41 H LYS 41 14.150 -0.644 7.557 309 HA LYS 41 HA LYS 41 11.820 -1.051 5.667 310 1HB LYS 41 2HB LYS 41 12.597 -2.955 7.909 311 2HB LYS 41 1HB LYS 41 11.441 -3.247 6.617 312 1HG LYS 41 1HG LYS 41 13.438 -3.013 4.958 313 2HG LYS 41 2HG LYS 41 14.498 -3.063 6.367 314 1HD LYS 41 1HD LYS 41 13.519 -5.295 7.042 315 2HD LYS 41 2HD LYS 41 12.413 -5.237 5.664 316 1HE LYS 41 1HE LYS 41 14.392 -5.220 4.073 317 2HE LYS 41 2HE LYS 41 15.497 -5.314 5.458 318 1HZ LYS 41 1HZ LYS 41 15.091 -7.476 4.538 319 2HZ LYS 41 2HZ LYS 41 14.498 -7.420 6.060 320 H VAL 42 H VAL 42 9.812 -0.408 6.281 321 HA VAL 42 HA VAL 42 9.092 0.407 8.995 322 HB VAL 42 HB VAL 42 7.735 0.207 6.230 323 1HG1 VAL 42 1HG2 VAL 42 6.943 1.719 8.665 324 2HG1 VAL 42 2HG2 VAL 42 6.207 1.945 7.011 325 3HG1 VAL 42 3HG2 VAL 42 6.060 0.350 7.827 326 1HG2 VAL 42 3HG1 VAL 42 8.827 2.705 7.677 327 2HG2 VAL 42 1HG1 VAL 42 9.543 1.911 6.198 328 3HG2 VAL 42 2HG1 VAL 42 7.992 2.695 6.140 329 H GLN 43 H GLN 43 7.321 -0.447 9.826 330 HA GLN 43 HA GLN 43 6.344 -3.201 9.144 331 1HB GLN 43 1HB GLN 43 7.920 -3.117 11.683 332 2HB GLN 43 2HB GLN 43 6.865 -4.433 11.162 333 1HG GLN 43 1HG GLN 43 8.355 -4.543 9.039 334 2HG GLN 43 2HG GLN 43 9.396 -3.347 9.799 335 1HE2 GLN 43 2HE2 GLN 43 11.177 -6.423 10.480 336 2HE2 GLN 43 1HE2 GLN 43 10.797 -5.244 9.135 337 H LEU 44 H LEU 44 4.453 -3.780 9.555 338 HA LEU 44 HA LEU 44 2.730 -2.434 11.660 339 1HB LEU 44 2HB LEU 44 1.725 -2.803 8.779 340 2HB LEU 44 1HB LEU 44 0.730 -2.328 10.116 341 HG LEU 44 HG LEU 44 3.114 -0.543 9.409 342 1HD1 LEU 44 1HD1 LEU 44 2.097 -1.006 7.191 343 2HD1 LEU 44 2HD1 LEU 44 0.484 -0.560 7.801 344 3HD1 LEU 44 3HD1 LEU 44 1.776 0.664 7.693 345 1HD2 LEU 44 2HD2 LEU 44 0.240 0.066 10.401 346 2HD2 LEU 44 3HD2 LEU 44 1.704 0.038 11.411 347 3HD2 LEU 44 1HD2 LEU 44 1.524 1.267 10.142 348 H ILE 45 H ILE 45 1.958 -4.197 12.793 349 HA ILE 45 HA ILE 45 2.171 -6.915 11.643 350 HB ILE 45 HB ILE 45 2.839 -6.389 13.972 351 1HG1 ILE 45 1HG1 ILE 45 0.840 -8.717 13.807 352 2HG1 ILE 45 2HG1 ILE 45 2.416 -8.732 13.034 353 1HG2 ILE 45 1HG2 ILE 45 0.885 -5.002 14.664 354 2HG2 ILE 45 2HG2 ILE 45 -0.175 -6.435 14.606 355 3HG2 ILE 45 3HG2 ILE 45 1.158 -6.346 15.796 356 1HD1 ILE 45 3HD1 ILE 45 3.561 -8.452 15.274 357 2HD1 ILE 45 1HD1 ILE 45 1.968 -8.519 16.077 358 3HD1 ILE 45 2HD1 ILE 45 2.567 -9.925 15.171 359 H GLY 46 H GLY 46 0.563 -8.403 11.416 360 1HA GLY 46 1HA GLY 46 -1.415 -9.190 10.324 361 2HA GLY 46 2HA GLY 46 -2.269 -8.073 11.362 362 H PHE 47 H PHE 47 -0.234 -6.404 9.126 363 HA PHE 47 HA PHE 47 -2.272 -6.219 6.933 364 1HB PHE 47 2HB PHE 47 -2.489 -4.553 8.982 365 2HB PHE 47 1HB PHE 47 -1.045 -3.776 8.406 366 HD1 PHE 47 HD2 PHE 47 -4.629 -4.477 7.672 367 HD2 PHE 47 HD1 PHE 47 -1.087 -2.582 6.126 368 HE1 PHE 47 HE2 PHE 47 -5.926 -3.496 5.842 369 HE2 PHE 47 HE1 PHE 47 -2.404 -1.694 4.241 370 HZ PHE 47 HZ PHE 47 -4.813 -2.193 4.069 371 H GLY 48 H GLY 48 1.120 -5.301 7.944 372 1HA GLY 48 1HA GLY 48 2.306 -5.976 5.598 373 2HA GLY 48 2HA GLY 48 1.751 -4.357 5.165 374 H ASN 49 H ASN 49 4.269 -5.387 4.995 375 HA ASN 49 HA ASN 49 5.858 -3.567 6.902 376 1HB ASN 49 1HB ASN 49 6.754 -6.336 5.902 377 2HB ASN 49 2HB ASN 49 7.751 -5.206 6.795 378 1HD2 ASN 49 2HD2 ASN 49 6.574 -7.727 9.253 379 2HD2 ASN 49 1HD2 ASN 49 7.561 -7.681 7.707 380 H PHE 50 H PHE 50 6.579 -1.960 5.674 381 HA PHE 50 HA PHE 50 6.996 -2.274 2.712 382 1HB PHE 50 2HB PHE 50 7.581 0.268 4.299 383 2HB PHE 50 1HB PHE 50 7.671 0.180 2.654 384 HD1 PHE 50 HD2 PHE 50 5.382 -0.090 5.558 385 HD2 PHE 50 HD1 PHE 50 5.828 1.032 1.441 386 HE1 PHE 50 HE2 PHE 50 3.167 1.032 5.613 387 HE2 PHE 50 HE1 PHE 50 3.595 2.127 1.516 388 HZ PHE 50 HZ PHE 50 2.264 1.959 3.579 389 H GLU 51 H GLU 51 8.922 -2.008 1.685 390 HA GLU 51 HA GLU 51 11.392 -1.452 3.193 391 1HB GLU 51 1HB GLU 51 12.614 -3.558 2.935 392 2HB GLU 51 2HB GLU 51 11.125 -3.863 3.776 393 1HG GLU 51 1HG GLU 51 11.227 -5.711 2.403 394 2HG GLU 51 2HG GLU 51 10.141 -4.703 1.469 395 HE2 GLU 51 HE2 GLU 51 12.197 -4.715 -1.291 396 H VAL 52 H VAL 52 13.310 -0.996 1.976 397 HA VAL 52 HA VAL 52 12.648 -0.126 -0.772 398 HB VAL 52 HB VAL 52 13.945 0.962 1.584 399 1HG1 VAL 52 1HG2 VAL 52 16.117 0.008 -0.302 400 2HG1 VAL 52 2HG2 VAL 52 16.285 1.315 0.917 401 3HG1 VAL 52 3HG2 VAL 52 15.867 -0.370 1.396 402 1HG2 VAL 52 3HG1 VAL 52 13.800 1.912 -1.280 403 2HG2 VAL 52 1HG1 VAL 52 12.881 2.398 0.159 404 3HG2 VAL 52 2HG1 VAL 52 14.599 2.809 0.027 405 NH1 ARG 53 NH2 ARG 53 12.149 -7.340 -4.858 406 NH2 ARG 53 NH1 ARG 53 13.759 -8.932 -5.049 407 H ARG 53 H ARG 53 14.185 -0.698 -2.578 408 HA ARG 53 HA ARG 53 15.557 -3.420 -2.139 409 1HB ARG 53 1HB ARG 53 13.114 -3.023 -3.493 410 2HB ARG 53 2HB ARG 53 14.192 -2.414 -4.638 411 1HG ARG 53 1HG ARG 53 13.882 -4.675 -5.280 412 2HG ARG 53 2HG ARG 53 15.517 -4.641 -4.627 413 1HD ARG 53 1HD ARG 53 14.659 -5.574 -2.427 414 2HD ARG 53 2HD ARG 53 13.009 -5.549 -3.024 415 1HH1 ARG 53 2HH2 ARG 53 11.885 -6.414 -4.504 416 2HH1 ARG 53 1HH2 ARG 53 11.554 -7.987 -5.387 417 1HH2 ARG 53 1HH1 ARG 53 14.721 -9.223 -4.841 418 2HH2 ARG 53 2HH1 ARG 53 13.053 -9.468 -5.565 419 H GLU 54 H GLU 54 17.710 -2.614 -2.081 420 HA GLU 54 HA GLU 54 18.742 -0.669 -4.044 421 1HB GLU 54 1HB GLU 54 21.005 -1.168 -3.349 422 2HB GLU 54 2HB GLU 54 19.916 -0.767 -2.037 423 1HG GLU 54 1HG GLU 54 19.758 -3.211 -1.401 424 2HG GLU 54 2HG GLU 54 20.869 -3.625 -2.705 425 HE1 GLU 54 HE2 GLU 54 23.732 -2.524 -1.109 426 NH1 ARG 55 NH2 ARG 55 13.484 -5.749 -8.027 427 NH2 ARG 55 NH1 ARG 55 13.322 -6.152 -10.258 428 H ARG 55 H ARG 55 18.268 -1.140 -6.054 429 HA ARG 55 HA ARG 55 18.440 -3.822 -7.225 430 1HB ARG 55 1HB ARG 55 16.742 -1.719 -7.573 431 2HB ARG 55 2HB ARG 55 17.877 -1.242 -8.799 432 1HG ARG 55 1HG ARG 55 16.157 -2.416 -9.880 433 2HG ARG 55 2HG ARG 55 17.490 -3.563 -9.910 434 1HD ARG 55 1HD ARG 55 16.441 -4.809 -7.955 435 2HD ARG 55 2HD ARG 55 15.188 -3.563 -7.829 436 1HH1 ARG 55 1HH2 ARG 55 12.653 -6.343 -7.937 437 2HH1 ARG 55 2HH2 ARG 55 13.991 -5.283 -7.267 438 1HH2 ARG 55 1HH1 ARG 55 13.704 -5.998 -11.198 439 2HH2 ARG 55 2HH1 ARG 55 12.502 -6.718 -10.012 440 H ALA 56 H ALA 56 19.511 -4.483 -9.085 441 HA ALA 56 HA ALA 56 22.196 -3.106 -9.703 442 1HB ALA 56 3HB ALA 56 21.415 -6.067 -10.039 443 2HB ALA 56 1HB ALA 56 22.985 -5.334 -10.444 444 3HB ALA 56 2HB ALA 56 22.442 -5.377 -8.756 445 H ALA 57 H ALA 57 21.434 -1.650 -11.201 446 HA ALA 57 HA ALA 57 20.348 -0.700 -12.977 447 1HB ALA 57 2HB ALA 57 22.614 -1.379 -13.647 448 2HB ALA 57 3HB ALA 57 21.990 -2.915 -14.303 449 3HB ALA 57 1HB ALA 57 21.525 -1.355 -15.052 450 NH1 ARG 58 NH2 ARG 58 12.173 -0.150 -10.189 451 NH2 ARG 58 NH1 ARG 58 11.966 -2.383 -10.560 452 H ARG 58 H ARG 58 18.720 -0.259 -14.059 453 HA ARG 58 HA ARG 58 16.838 -2.515 -14.579 454 1HB ARG 58 2HB ARG 58 15.683 0.265 -14.224 455 2HB ARG 58 1HB ARG 58 14.907 -1.298 -14.039 456 1HG ARG 58 1HG ARG 58 16.481 -1.557 -11.914 457 2HG ARG 58 2HG ARG 58 16.827 0.147 -12.142 458 1HD ARG 58 1HD ARG 58 15.117 0.150 -10.517 459 2HD ARG 58 2HD ARG 58 14.284 0.632 -11.999 460 1HH1 ARG 58 2HH2 ARG 58 12.742 0.696 -10.301 461 2HH1 ARG 58 1HH2 ARG 58 11.257 -0.219 -9.730 462 1HH2 ARG 58 1HH1 ARG 58 12.374 -3.240 -10.951 463 2HH2 ARG 58 2HH1 ARG 58 11.065 -2.297 -10.077 464 H LYS 59 H LYS 59 15.019 -1.152 -16.222 465 HA LYS 59 HA LYS 59 16.466 0.169 -18.472 466 1HB LYS 59 1HB LYS 59 15.962 -1.334 -20.286 467 2HB LYS 59 2HB LYS 59 16.961 -2.095 -19.099 468 1HG LYS 59 1HG LYS 59 15.584 -3.847 -19.665 469 2HG LYS 59 2HG LYS 59 14.855 -3.301 -18.178 470 1HD LYS 59 1HD LYS 59 13.103 -3.866 -19.665 471 2HD LYS 59 2HD LYS 59 13.013 -2.135 -19.534 472 1HE LYS 59 1HE LYS 59 14.394 -3.597 -21.900 473 2HE LYS 59 2HE LYS 59 12.675 -3.222 -21.870 474 1HZ LYS 59 1HZ LYS 59 14.844 -1.215 -21.739 475 2HZ LYS 59 2HZ LYS 59 13.936 -1.566 -23.052 476 H GLY 60 H GLY 60 15.187 1.489 -19.649 477 1HA GLY 60 1HA GLY 60 12.146 1.425 -19.270 478 2HA GLY 60 2HA GLY 60 13.008 2.861 -18.721 479 NH1 ARG 61 NH2 ARG 61 16.028 -0.687 -27.717 480 NH2 ARG 61 NH1 ARG 61 14.948 0.223 -29.498 481 H ARG 61 H ARG 61 11.391 1.651 -21.276 482 HA ARG 61 HA ARG 61 12.853 3.435 -23.257 483 1HB ARG 61 1HB ARG 61 13.857 1.316 -23.403 484 2HB ARG 61 2HB ARG 61 12.332 0.450 -23.558 485 1HG ARG 61 1HG ARG 61 11.987 1.371 -25.843 486 2HG ARG 61 2HG ARG 61 13.351 2.475 -25.656 487 1HD ARG 61 1HD ARG 61 14.938 0.520 -25.494 488 2HD ARG 61 2HD ARG 61 13.586 -0.610 -25.697 489 1HH1 ARG 61 2HH2 ARG 61 16.053 -0.831 -26.702 490 2HH1 ARG 61 1HH2 ARG 61 16.710 -1.029 -28.403 491 1HH2 ARG 61 1HH1 ARG 61 14.152 0.771 -29.843 492 2HH2 ARG 61 2HH1 ARG 61 15.706 -0.181 -30.060 493 H ASN 62 H ASN 62 11.935 3.985 -25.030 494 HA ASN 62 HA ASN 62 9.759 5.517 -24.653 495 1HB ASN 62 1HB ASN 62 10.046 6.107 -27.069 496 2HB ASN 62 2HB ASN 62 11.507 6.064 -26.111 497 1HD2 ASN 62 2HD2 ASN 62 11.777 2.954 -28.686 498 2HD2 ASN 62 1HD2 ASN 62 10.387 3.017 -27.484 499 HA PRO 63 HA PRO 63 5.988 3.739 -26.541 500 1HB PRO 63 1HB PRO 63 4.458 6.063 -26.849 501 2HB PRO 63 2HB PRO 63 4.666 5.176 -25.328 502 1HG PRO 63 1HG PRO 63 6.207 7.640 -26.276 503 2HG PRO 63 2HG PRO 63 5.490 7.347 -24.674 504 1HD PRO 63 1HD PRO 63 8.166 6.937 -25.148 505 2HD PRO 63 2HD PRO 63 7.281 5.867 -24.034 506 H GLN 64 H GLN 64 7.324 6.734 -28.049 507 HA GLN 64 HA GLN 64 7.440 5.386 -30.717 508 1HB GLN 64 1HB GLN 64 7.049 8.435 -30.518 509 2HB GLN 64 2HB GLN 64 7.287 7.481 -31.956 510 1HG GLN 64 1HG GLN 64 4.809 7.413 -30.112 511 2HG GLN 64 2HG GLN 64 5.008 8.392 -31.556 512 1HE2 GLN 64 2HE2 GLN 64 4.161 5.662 -33.785 513 2HE2 GLN 64 1HE2 GLN 64 4.728 7.398 -33.603 514 H THR 65 H THR 65 8.633 8.571 -29.671 515 HA THR 65 HA THR 65 11.117 7.366 -28.466 516 HB THR 65 HB THR 65 12.447 8.876 -29.341 517 HG1 THR 65 HG1 THR 65 11.743 10.635 -30.679 518 1HG2 THR 65 2HG2 THR 65 11.528 7.145 -31.052 519 2HG2 THR 65 3HG2 THR 65 10.338 8.344 -31.582 520 3HG2 THR 65 1HG2 THR 65 12.063 8.653 -31.904 521 H GLY 66 H GLY 66 9.100 7.840 -26.663 522 1HA GLY 66 1HA GLY 66 9.449 10.589 -25.403 523 2HA GLY 66 2HA GLY 66 8.537 9.256 -24.734 524 H GLU 67 H GLU 67 11.391 7.722 -25.401 525 HA GLU 67 HA GLU 67 12.993 8.534 -22.938 526 1HB GLU 67 2HB GLU 67 10.672 7.167 -22.558 527 2HB GLU 67 1HB GLU 67 11.563 5.837 -23.198 528 1HG GLU 67 1HG GLU 67 11.617 5.691 -20.776 529 2HG GLU 67 2HG GLU 67 13.246 6.070 -21.290 530 HE1 GLU 67 HE2 GLU 67 10.316 7.374 -20.141 531 H GLU 68 H GLU 68 13.768 5.746 -22.960 532 HA GLU 68 HA GLU 68 14.736 4.042 -24.300 533 1HB GLU 68 1HB GLU 68 14.368 5.101 -26.479 534 2HB GLU 68 2HB GLU 68 15.890 5.974 -26.339 535 1HG GLU 68 1HG GLU 68 17.153 3.795 -26.264 536 2HG GLU 68 2HG GLU 68 15.646 2.891 -26.273 537 HE2 GLU 68 HE2 GLU 68 17.273 4.190 -29.661 538 H MET 69 H MET 69 15.856 3.688 -22.363 539 HA MET 69 HA MET 69 18.742 4.043 -22.500 540 1HB MET 69 1HB MET 69 19.315 5.492 -20.707 541 2HB MET 69 2HB MET 69 18.244 6.394 -21.736 542 1HG MET 69 1HG MET 69 17.552 5.190 -18.985 543 2HG MET 69 2HG MET 69 17.807 6.891 -19.368 544 1HE MET 69 3HE MET 69 15.279 4.092 -18.985 545 2HE MET 69 2HE MET 69 15.029 5.522 -17.946 546 3HE MET 69 1HE MET 69 13.797 5.050 -19.153 547 H GLU 70 H GLU 70 19.847 2.736 -21.170 548 HA GLU 70 HA GLU 70 18.445 0.844 -19.336 549 1HB GLU 70 2HB GLU 70 20.515 -0.311 -19.060 550 2HB GLU 70 1HB GLU 70 20.177 -0.041 -20.775 551 1HG GLU 70 1HG GLU 70 21.897 1.862 -20.763 552 2HG GLU 70 2HG GLU 70 22.269 1.488 -19.084 553 HE1 GLU 70 HE2 GLU 70 24.080 -1.381 -19.737 554 H ILE 71 H ILE 71 18.086 1.279 -17.198 555 HA ILE 71 HA ILE 71 18.936 3.882 -16.101 556 HB ILE 71 HB ILE 71 17.115 1.638 -15.029 557 1HG1 ILE 71 1HG1 ILE 71 16.203 4.221 -16.462 558 2HG1 ILE 71 2HG1 ILE 71 16.280 2.670 -17.264 559 1HG2 ILE 71 2HG2 ILE 71 17.837 3.214 -13.238 560 2HG2 ILE 71 3HG2 ILE 71 17.187 4.584 -14.190 561 3HG2 ILE 71 1HG2 ILE 71 16.103 3.312 -13.546 562 1HD1 ILE 71 3HD1 ILE 71 14.558 1.697 -15.717 563 2HD1 ILE 71 1HD1 ILE 71 14.376 3.289 -14.931 564 3HD1 ILE 71 2HD1 ILE 71 13.973 3.095 -16.642 565 HA PRO 72 HA PRO 72 22.087 1.734 -13.328 566 1HB PRO 72 1HB PRO 72 22.776 3.818 -11.678 567 2HB PRO 72 2HB PRO 72 23.180 3.805 -13.397 568 1HG PRO 72 1HG PRO 72 20.808 5.214 -12.060 569 2HG PRO 72 2HG PRO 72 22.004 5.919 -13.177 570 1HD PRO 72 1HD PRO 72 19.541 4.998 -14.045 571 2HD PRO 72 2HD PRO 72 20.989 4.870 -15.085 572 H ALA 73 H ALA 73 22.220 2.155 -10.535 573 HA ALA 73 HA ALA 73 20.024 0.456 -9.552 574 1HB ALA 73 1HB ALA 73 22.217 0.562 -8.239 575 2HB ALA 73 2HB ALA 73 21.781 2.229 -7.699 576 3HB ALA 73 3HB ALA 73 20.794 0.851 -7.229 577 H SER 74 H SER 74 18.551 0.874 -7.987 578 HA SER 74 HA SER 74 18.315 3.476 -6.826 579 1HB SER 74 1HB SER 74 15.834 2.392 -8.462 580 2HB SER 74 2HB SER 74 15.618 3.620 -7.226 581 HG SER 74 HG SER 74 15.858 4.512 -9.276 582 H LYS 75 H LYS 75 17.020 3.514 -4.885 583 HA LYS 75 HA LYS 75 16.702 0.748 -3.634 584 1HB LYS 75 2HB LYS 75 16.026 3.126 -2.001 585 2HB LYS 75 1HB LYS 75 16.517 1.508 -1.590 586 1HG LYS 75 1HG LYS 75 18.876 2.026 -2.459 587 2HG LYS 75 2HG LYS 75 18.362 3.706 -2.665 588 1HD LYS 75 1HD LYS 75 17.736 3.752 -0.165 589 2HD LYS 75 2HD LYS 75 18.385 2.114 -0.017 590 1HE LYS 75 1HE LYS 75 20.669 2.938 -0.743 591 2HE LYS 75 2HE LYS 75 20.028 4.579 -0.917 592 1HZ LYS 75 1HZ LYS 75 19.491 4.583 1.429 593 2HZ LYS 75 2HZ LYS 75 21.084 4.299 1.199 594 H VAL 76 H VAL 76 14.947 -0.084 -4.357 595 HA VAL 76 HA VAL 76 12.703 1.467 -5.227 596 HB VAL 76 HB VAL 76 12.024 0.094 -6.613 597 1HG1 VAL 76 2HG2 VAL 76 14.354 0.995 -6.949 598 2HG1 VAL 76 3HG2 VAL 76 14.948 -0.609 -6.463 599 3HG1 VAL 76 1HG2 VAL 76 14.011 -0.455 -7.979 600 1HG2 VAL 76 2HG1 VAL 76 12.037 -2.208 -5.333 601 2HG2 VAL 76 3HG1 VAL 76 11.863 -1.992 -7.098 602 3HG2 VAL 76 1HG1 VAL 76 13.419 -2.444 -6.469 603 HA PRO 77 HA PRO 77 10.487 0.584 -1.466 604 1HB PRO 77 1HB PRO 77 8.452 2.496 -1.659 605 2HB PRO 77 2HB PRO 77 10.158 2.938 -1.455 606 1HG PRO 77 1HG PRO 77 8.588 2.746 -4.082 607 2HG PRO 77 2HG PRO 77 9.522 4.138 -3.491 608 1HD PRO 77 1HD PRO 77 10.570 2.229 -5.266 609 2HD PRO 77 2HD PRO 77 11.621 2.986 -4.042 610 H ALA 78 H ALA 78 9.401 -0.873 -0.995 611 HA ALA 78 HA ALA 78 6.999 -1.970 -2.549 612 1HB ALA 78 2HB ALA 78 9.271 -3.147 -2.670 613 2HB ALA 78 3HB ALA 78 9.246 -3.351 -0.905 614 3HB ALA 78 1HB ALA 78 8.025 -4.166 -1.915 615 H PHE 79 H PHE 79 5.782 -3.476 -1.193 616 HA PHE 79 HA PHE 79 5.201 -2.716 1.747 617 1HB PHE 79 2HB PHE 79 3.979 -1.103 0.876 618 2HB PHE 79 1HB PHE 79 3.240 -2.184 -0.361 619 HD1 PHE 79 HD1 PHE 79 1.474 -3.808 0.205 620 HD2 PHE 79 HD2 PHE 79 3.102 -1.239 3.225 621 HE1 PHE 79 HE1 PHE 79 -0.429 -4.315 1.666 622 HE2 PHE 79 HE2 PHE 79 1.154 -1.702 4.666 623 HZ PHE 79 HZ PHE 79 -0.591 -3.284 3.881 624 H LYS 80 H LYS 80 4.962 -4.627 2.492 625 HA LYS 80 HA LYS 80 4.233 -7.346 1.096 626 1HB LYS 80 2HB LYS 80 5.064 -6.811 3.982 627 2HB LYS 80 1HB LYS 80 4.543 -8.363 3.316 628 1HG LYS 80 1HG LYS 80 6.515 -8.235 1.660 629 2HG LYS 80 2HG LYS 80 7.059 -6.786 2.504 630 1HD LYS 80 1HD LYS 80 7.095 -8.220 4.700 631 2HD LYS 80 2HD LYS 80 6.729 -9.609 3.698 632 1HE LYS 80 1HE LYS 80 9.095 -9.674 4.036 633 2HE LYS 80 2HE LYS 80 8.890 -9.168 2.360 634 1HZ LYS 80 1HZ LYS 80 10.529 -7.835 3.464 635 2HZ LYS 80 2HZ LYS 80 9.264 -6.878 3.070 636 HA PRO 81 HA PRO 81 0.044 -6.373 2.781 637 1HB PRO 81 1HB PRO 81 -1.367 -8.441 1.678 638 2HB PRO 81 2HB PRO 81 -0.722 -7.115 0.707 639 1HG PRO 81 1HG PRO 81 0.525 -9.880 1.112 640 2HG PRO 81 2HG PRO 81 0.209 -9.051 -0.431 641 1HD PRO 81 1HD PRO 81 2.679 -9.007 0.871 642 2HD PRO 81 2HD PRO 81 2.126 -7.636 -0.144 643 H GLY 82 H GLY 82 2.002 -7.334 4.547 644 1HA GLY 82 1HA GLY 82 2.636 -8.783 6.303 645 2HA GLY 82 2HA GLY 82 1.009 -8.364 6.783 646 H LYS 83 H LYS 83 1.178 -10.443 4.119 647 HA LYS 83 HA LYS 83 0.480 -12.723 3.771 648 1HB LYS 83 2HB LYS 83 1.726 -13.064 6.480 649 2HB LYS 83 1HB LYS 83 0.368 -14.102 6.287 650 1HG LYS 83 1HG LYS 83 2.312 -15.345 5.601 651 2HG LYS 83 2HG LYS 83 1.382 -15.041 4.141 652 1HD LYS 83 1HD LYS 83 2.969 -13.127 3.545 653 2HD LYS 83 2HD LYS 83 3.841 -13.400 5.045 654 1HE LYS 83 1HE LYS 83 5.141 -14.431 3.304 655 2HE LYS 83 2HE LYS 83 4.465 -15.746 4.262 656 1HZ LYS 83 1HZ LYS 83 3.444 -14.772 1.645 657 2HZ LYS 83 2HZ LYS 83 4.292 -16.146 1.897 658 H ALA 84 H ALA 84 -0.637 -11.381 6.624 659 HA ALA 84 HA ALA 84 -3.266 -12.526 7.093 660 1HB ALA 84 2HB ALA 84 -1.806 -11.300 8.716 661 2HB ALA 84 3HB ALA 84 -1.907 -9.816 7.731 662 3HB ALA 84 1HB ALA 84 -3.369 -10.429 8.550 663 H LEU 85 H LEU 85 -2.383 -9.300 5.486 664 HA LEU 85 HA LEU 85 -5.131 -8.812 4.607 665 1HB LEU 85 2HB LEU 85 -3.531 -6.955 4.959 666 2HB LEU 85 1HB LEU 85 -2.466 -7.583 3.719 667 HG LEU 85 HG LEU 85 -4.457 -7.517 2.159 668 1HD1 LEU 85 2HD1 LEU 85 -6.292 -6.997 3.772 669 2HD1 LEU 85 3HD1 LEU 85 -5.527 -5.447 4.172 670 3HD1 LEU 85 1HD1 LEU 85 -6.191 -5.726 2.540 671 1HD2 LEU 85 1HD2 LEU 85 -2.471 -6.022 1.891 672 2HD2 LEU 85 2HD2 LEU 85 -3.937 -5.126 1.464 673 3HD2 LEU 85 3HD2 LEU 85 -3.146 -4.850 3.043 674 H LYS 86 H LYS 86 -2.286 -10.413 3.216 675 HA LYS 86 HA LYS 86 -3.336 -10.938 0.550 676 1HB LYS 86 1HB LYS 86 -0.916 -11.461 1.546 677 2HB LYS 86 2HB LYS 86 -1.581 -13.020 1.969 678 1HG LYS 86 1HG LYS 86 -2.232 -13.345 -0.492 679 2HG LYS 86 2HG LYS 86 -1.447 -11.820 -0.873 680 1HD LYS 86 1HD LYS 86 -0.069 -14.300 0.359 681 2HD LYS 86 2HD LYS 86 -0.066 -13.873 -1.347 682 1HE LYS 86 1HE LYS 86 1.166 -11.696 -0.795 683 2HE LYS 86 2HE LYS 86 1.231 -12.190 0.904 684 1HZ LYS 86 1HZ LYS 86 3.238 -12.775 -0.220 685 2HZ LYS 86 2HZ LYS 86 2.476 -14.140 0.261 686 H ASP 87 H ASP 87 -4.248 -12.448 3.635 687 HA ASP 87 HA ASP 87 -5.878 -14.580 2.320 688 1HB ASP 87 1HB ASP 87 -4.580 -14.245 4.859 689 2HB ASP 87 2HB ASP 87 -6.224 -13.907 5.249 690 HD2 ASP 87 HD2 ASP 87 -7.661 -15.493 5.028 691 H ALA 88 H ALA 88 -6.436 -11.427 3.933 692 HA ALA 88 HA ALA 88 -9.353 -11.313 3.849 693 1HB ALA 88 1HB ALA 88 -7.835 -9.500 4.922 694 2HB ALA 88 2HB ALA 88 -7.350 -8.989 3.296 695 3HB ALA 88 3HB ALA 88 -9.022 -8.796 3.788 696 H VAL 89 H VAL 89 -6.896 -10.623 1.283 697 HA VAL 89 HA VAL 89 -8.876 -9.432 -0.530 698 HB VAL 89 HB VAL 89 -6.541 -8.606 0.602 699 1HG1 VAL 89 2HG2 VAL 89 -5.300 -10.705 -0.224 700 2HG1 VAL 89 3HG2 VAL 89 -5.322 -9.974 -1.839 701 3HG1 VAL 89 1HG2 VAL 89 -4.538 -9.123 -0.458 702 1HG2 VAL 89 1HG1 VAL 89 -7.136 -8.174 -2.278 703 2HG2 VAL 89 2HG1 VAL 89 -7.818 -7.349 -0.812 704 3HG2 VAL 89 3HG1 VAL 89 -6.065 -7.216 -1.157 705 H LYS 90 H LYS 90 -7.498 -12.558 -0.206 706 HA LYS 90 HA LYS 90 -6.973 -13.223 -2.944 707 1HB LYS 90 1HB LYS 90 -6.588 -15.400 -2.210 708 2HB LYS 90 2HB LYS 90 -6.089 -14.340 -0.926 709 1HG LYS 90 1HG LYS 90 -8.243 -14.876 0.333 710 2HG LYS 90 2HG LYS 90 -8.676 -16.021 -0.931 711 1HD LYS 90 1HD LYS 90 -6.614 -17.384 -0.468 712 2HD LYS 90 2HD LYS 90 -6.061 -16.192 0.693 713 1HE LYS 90 1HE LYS 90 -6.968 -17.988 1.990 714 2HE LYS 90 2HE LYS 90 -8.099 -16.648 2.156 715 1HZ LYS 90 1HZ LYS 90 -8.416 -18.994 0.355 716 2HZ LYS 90 2HZ LYS 90 -9.199 -18.758 1.770 717 1H MET 1 1H MET 91 9.697 0.056 10.879 718 2H MET 1 2H MET 91 10.800 -0.382 12.070 719 HA MET 1 HA MET 91 9.543 0.571 13.516 720 1HB MET 1 1HB MET 91 7.383 0.673 11.309 721 2HB MET 1 2HB MET 91 7.145 1.323 12.900 722 1HG MET 1 1HG MET 91 9.404 2.698 12.450 723 2HG MET 1 2HG MET 91 9.075 2.335 10.753 724 1HE MET 1 2HE MET 91 8.116 4.134 9.455 725 2HE MET 1 1HE MET 91 6.413 3.569 9.560 726 3HE MET 1 3HE MET 91 6.806 5.241 9.934 727 H ASN 2 H ASN 92 6.595 -0.949 12.680 728 HA ASN 2 HA ASN 92 6.507 -3.437 13.235 729 1HB ASN 2 1HB ASN 92 6.275 -4.335 15.402 730 2HB ASN 2 2HB ASN 92 7.815 -3.542 15.279 731 1HD2 ASN 2 1HD2 ASN 92 7.215 -1.589 18.220 732 2HD2 ASN 2 2HD2 ASN 92 8.382 -2.139 16.915 733 H LYS 3 H LYS 93 5.067 -0.657 14.436 734 HA LYS 3 HA LYS 93 2.691 -0.235 13.414 735 1HB LYS 3 1HB LYS 93 1.929 -2.675 13.687 736 2HB LYS 3 2HB LYS 93 1.851 -2.437 15.417 737 1HG LYS 3 1HG LYS 93 -0.014 -0.763 15.057 738 2HG LYS 3 2HG LYS 93 0.252 -0.811 13.311 739 1HD LYS 3 1HD LYS 93 -0.316 -3.294 13.308 740 2HD LYS 3 2HD LYS 93 -0.663 -3.198 15.039 741 1HE LYS 3 1HE LYS 93 -2.512 -1.540 14.582 742 2HE LYS 3 2HE LYS 93 -2.149 -1.587 12.849 743 1HZ LYS 3 1HZ LYS 93 -3.950 -3.070 13.434 744 2HZ LYS 3 2HZ LYS 93 -3.028 -3.889 14.506 745 H THR 4 H THR 94 4.296 -0.621 16.534 746 HA THR 4 HA THR 94 2.738 1.469 17.832 747 HB THR 4 HB THR 94 4.962 -0.534 18.621 748 HG1 THR 4 HG1 THR 94 2.925 -1.509 18.185 749 1HG2 THR 4 3HG2 THR 94 3.216 1.386 20.182 750 2HG2 THR 4 1HG2 THR 94 4.200 0.030 20.919 751 3HG2 THR 4 2HG2 THR 94 5.011 1.373 20.018 752 H GLU 5 H GLU 95 5.802 0.910 16.271 753 HA GLU 5 HA GLU 95 7.140 3.419 17.314 754 1HB GLU 5 1HB GLU 95 7.955 1.996 14.750 755 2HB GLU 5 2HB GLU 95 8.852 3.206 15.623 756 1HG GLU 5 1HG GLU 95 8.346 0.297 16.461 757 2HG GLU 5 2HG GLU 95 9.831 0.947 15.824 758 HE2 GLU 5 HE2 GLU 95 8.920 1.288 19.722 759 H LEU 6 H LEU 96 4.611 2.447 15.036 760 HA LEU 6 HA LEU 96 4.674 4.840 13.392 761 1HB LEU 6 2HB LEU 96 3.414 2.120 13.543 762 2HB LEU 6 1HB LEU 96 2.105 3.211 13.681 763 HG LEU 6 HG LEU 96 2.244 3.210 11.461 764 1HD1 LEU 6 2HD1 LEU 96 2.929 5.526 11.515 765 2HD1 LEU 6 3HD1 LEU 96 4.632 5.052 11.285 766 3HD1 LEU 6 1HD1 LEU 96 3.460 4.722 10.019 767 1HD2 LEU 6 2HD2 LEU 96 3.822 1.245 11.407 768 2HD2 LEU 6 3HD2 LEU 96 4.070 2.276 9.986 769 3HD2 LEU 6 1HD2 LEU 96 5.198 2.356 11.363 770 H ILE 7 H ILE 97 2.962 3.649 16.310 771 HA ILE 7 HA ILE 97 1.015 5.824 16.497 772 HB ILE 7 HB ILE 97 2.193 4.116 18.764 773 1HG1 ILE 7 1HG1 ILE 97 -0.460 3.732 17.253 774 2HG1 ILE 7 2HG1 ILE 97 0.966 2.958 16.701 775 1HG2 ILE 7 2HG2 ILE 97 1.005 6.189 19.657 776 2HG2 ILE 7 3HG2 ILE 97 -0.433 5.716 18.749 777 3HG2 ILE 7 1HG2 ILE 97 0.145 4.701 20.079 778 1HD1 ILE 7 1HD1 ILE 97 1.240 1.925 19.081 779 2HD1 ILE 7 2HD1 ILE 97 -0.466 2.282 19.234 780 3HD1 ILE 7 3HD1 ILE 97 0.100 1.253 17.877 781 H ASN 8 H ASN 98 4.219 5.425 17.979 782 HA ASN 8 HA ASN 98 4.349 8.284 18.896 783 1HB ASN 8 1HB ASN 98 6.678 6.271 18.454 784 2HB ASN 8 2HB ASN 98 6.866 7.847 19.187 785 1HD2 ASN 8 2HD2 ASN 98 5.638 4.827 21.600 786 2HD2 ASN 8 1HD2 ASN 98 6.029 4.595 19.821 787 H ALA 9 H ALA 99 4.531 7.073 15.739 788 HA ALA 9 HA ALA 99 6.286 9.253 14.601 789 1HB ALA 9 2HB ALA 99 5.797 6.949 13.259 790 2HB ALA 9 3HB ALA 99 4.135 7.505 13.094 791 3HB ALA 9 1HB ALA 99 5.346 8.442 12.348 792 H VAL 10 H VAL 100 2.801 8.458 14.846 793 HA VAL 10 HA VAL 100 1.956 10.712 13.381 794 HB VAL 10 HB VAL 100 0.036 9.251 15.212 795 1HG1 VAL 10 3HG2 VAL 100 -0.499 11.164 13.402 796 2HG1 VAL 10 1HG2 VAL 100 -0.590 9.724 12.335 797 3HG1 VAL 10 2HG2 VAL 100 -1.603 9.799 13.781 798 1HG2 VAL 10 1HG1 VAL 100 1.491 8.064 12.845 799 2HG2 VAL 10 2HG1 VAL 100 1.131 7.464 14.501 800 3HG2 VAL 10 3HG1 VAL 100 -0.184 7.512 13.291 801 H ALA 11 H ALA 101 1.800 9.769 16.649 802 HA ALA 11 HA ALA 101 0.843 12.291 17.495 803 1HB ALA 11 2HB ALA 101 0.565 10.156 18.865 804 2HB ALA 11 3HB ALA 101 2.317 10.119 19.182 805 3HB ALA 11 1HB ALA 101 1.297 11.413 19.895 806 H GLU 12 H GLU 102 4.152 11.341 16.853 807 HA GLU 12 HA GLU 102 5.244 13.780 18.233 808 1HB GLU 12 1HB GLU 102 6.681 11.717 18.119 809 2HB GLU 12 2HB GLU 102 6.680 11.807 16.363 810 1HG GLU 12 1HG GLU 102 8.792 12.637 17.153 811 2HG GLU 12 2HG GLU 102 7.934 13.998 16.463 812 HE2 GLU 12 HE2 GLU 102 7.796 15.815 19.392 813 H THR 13 H THR 103 4.660 12.738 14.790 814 HA THR 13 HA THR 103 5.192 15.610 14.012 815 HB THR 13 HB THR 103 6.122 13.496 12.909 816 HG1 THR 13 HG1 THR 103 6.440 15.655 12.296 817 1HG2 THR 13 3HG2 THR 103 3.988 12.402 12.199 818 2HG2 THR 13 1HG2 THR 103 3.681 13.774 11.108 819 3HG2 THR 13 2HG2 THR 103 5.105 12.724 10.852 820 H SER 14 H SER 104 2.714 14.524 15.140 821 HA SER 14 HA SER 104 0.918 16.634 13.753 822 1HB SER 14 1HB SER 104 -0.308 13.997 14.760 823 2HB SER 14 2HB SER 104 -1.113 15.298 13.899 824 HG SER 14 HG SER 104 1.022 13.716 12.912 825 H GLY 15 H GLY 105 1.609 15.071 16.908 826 1HA GLY 15 1HA GLY 105 1.041 15.749 19.096 827 2HA GLY 15 2HA GLY 105 0.642 17.340 18.458 828 H LEU 16 H LEU 106 -0.691 14.094 18.231 829 HA LEU 16 HA LEU 106 -3.418 14.905 19.266 830 1HB LEU 16 1HB LEU 106 -4.325 13.004 18.121 831 2HB LEU 16 2HB LEU 106 -3.758 14.327 17.123 832 HG LEU 16 HG LEU 106 -1.869 13.260 16.443 833 1HD1 LEU 16 2HD1 LEU 106 -1.173 12.080 18.590 834 2HD1 LEU 16 3HD1 LEU 106 -2.416 10.862 18.172 835 3HD1 LEU 16 1HD1 LEU 106 -0.958 11.135 17.114 836 1HD2 LEU 16 2HD2 LEU 106 -3.323 12.728 14.921 837 2HD2 LEU 16 3HD2 LEU 106 -1.904 11.666 15.095 838 3HD2 LEU 16 1HD2 LEU 106 -3.458 11.092 15.666 839 H SER 17 H SER 107 -3.177 11.985 19.601 840 HA SER 17 HA SER 107 -1.996 11.802 22.425 841 1HB SER 17 1HB SER 107 -4.692 10.509 21.832 842 2HB SER 17 2HB SER 107 -3.790 10.474 23.330 843 HG SER 17 HG SER 107 -4.809 12.804 22.088 844 H LYS 18 H LYS 108 -1.475 9.634 23.076 845 HA LYS 18 HA LYS 108 -0.331 7.904 20.880 846 1HB LYS 18 1HB LYS 108 -0.440 7.372 23.910 847 2HB LYS 18 2HB LYS 108 0.140 6.212 22.723 848 1HG LYS 18 1HG LYS 108 1.859 7.953 21.905 849 2HG LYS 18 2HG LYS 108 1.343 8.996 23.221 850 1HD LYS 18 1HD LYS 108 3.329 7.922 23.963 851 2HD LYS 18 2HD LYS 108 2.024 7.197 24.895 852 1HE LYS 18 1HE LYS 108 2.075 5.150 23.389 853 2HE LYS 18 2HE LYS 108 3.308 5.909 22.376 854 1HZ LYS 18 1HZ LYS 108 3.605 5.202 25.242 855 2HZ LYS 18 2HZ LYS 108 4.245 4.384 23.980 856 H LYS 19 H LYS 109 -3.108 7.688 23.092 857 HA LYS 19 HA LYS 109 -4.330 5.300 21.851 858 1HB LYS 19 2HB LYS 109 -5.662 7.609 23.393 859 2HB LYS 19 1HB LYS 109 -6.543 6.187 22.814 860 1HG LYS 19 1HG LYS 109 -5.046 4.688 24.191 861 2HG LYS 19 2HG LYS 109 -4.197 6.106 24.812 862 1HD LYS 19 1HD LYS 109 -6.364 6.982 25.788 863 2HD LYS 19 2HD LYS 109 -7.216 5.563 25.167 864 1HE LYS 19 1HE LYS 109 -5.744 4.054 26.595 865 2HE LYS 19 2HE LYS 109 -4.895 5.476 27.219 866 1HZ LYS 19 1HZ LYS 109 -6.976 6.271 28.136 867 2HZ LYS 19 2HZ LYS 109 -6.612 4.786 28.715 868 H ASP 20 H ASP 110 -4.546 8.840 20.969 869 HA ASP 20 HA ASP 110 -6.583 8.285 18.822 870 1HB ASP 20 1HB ASP 110 -4.879 10.768 19.467 871 2HB ASP 20 2HB ASP 110 -5.789 10.684 17.982 872 HD1 ASP 20 HD2 ASP 110 -8.949 10.954 19.348 873 H ALA 21 H ALA 111 -3.078 8.324 18.899 874 HA ALA 21 HA ALA 111 -2.703 8.161 15.952 875 1HB ALA 21 1HB ALA 111 -0.834 7.806 18.374 876 2HB ALA 21 2HB ALA 111 -0.305 7.593 16.675 877 3HB ALA 21 3HB ALA 111 -0.936 9.120 17.230 878 H THR 22 H THR 112 -2.808 5.688 18.596 879 HA THR 22 HA THR 112 -2.417 3.324 16.974 880 HB THR 22 HB THR 112 -4.283 3.496 19.439 881 HG1 THR 22 HG1 THR 112 -2.375 4.605 19.896 882 1HG2 THR 22 2HG2 THR 112 -2.322 1.382 18.365 883 2HG2 THR 22 3HG2 THR 112 -3.158 1.280 19.942 884 3HG2 THR 22 1HG2 THR 112 -4.099 1.267 18.408 885 H LYS 23 H LYS 113 -5.348 4.990 17.851 886 HA LYS 23 HA LYS 113 -7.276 3.388 16.316 887 1HB LYS 23 2HB LYS 113 -7.099 6.388 17.214 888 2HB LYS 23 1HB LYS 113 -8.499 5.858 16.373 889 1HG LYS 23 1HG LYS 113 -9.236 4.327 18.128 890 2HG LYS 23 2HG LYS 113 -7.695 4.402 18.961 891 1HD LYS 23 1HD LYS 113 -9.383 5.640 20.195 892 2HD LYS 23 2HD LYS 113 -8.068 6.697 19.716 893 1HE LYS 23 1HE LYS 113 -9.451 7.687 17.885 894 2HE LYS 23 2HE LYS 113 -10.783 6.571 18.238 895 1HZ LYS 23 1HZ LYS 113 -11.127 8.702 19.262 896 2HZ LYS 23 2HZ LYS 113 -10.968 7.564 20.425 897 H ALA 24 H ALA 114 -5.745 6.431 15.508 898 HA ALA 24 HA ALA 114 -6.883 6.820 12.916 899 1HB ALA 24 2HB ALA 114 -5.994 8.562 14.253 900 2HB ALA 24 3HB ALA 114 -4.330 7.899 14.131 901 3HB ALA 24 1HB ALA 114 -5.172 8.547 12.670 902 H VAL 25 H VAL 115 -3.800 5.169 13.698 903 HA VAL 25 HA VAL 115 -3.065 4.325 10.916 904 HB VAL 25 HB VAL 115 -2.654 3.525 13.950 905 1HG1 VAL 25 2HG2 VAL 115 -1.626 1.713 11.680 906 2HG1 VAL 25 3HG2 VAL 115 -1.120 1.617 13.402 907 3HG1 VAL 25 1HG2 VAL 115 -2.779 1.274 12.945 908 1HG2 VAL 25 1HG1 VAL 115 -1.267 5.355 13.025 909 2HG2 VAL 25 2HG1 VAL 115 -0.307 3.994 13.616 910 3HG2 VAL 25 3HG1 VAL 115 -0.530 4.224 11.851 911 H ASP 26 H ASP 116 -4.865 2.538 13.533 912 HA ASP 26 HA ASP 116 -6.098 0.652 11.527 913 1HB ASP 26 1HB ASP 116 -6.796 1.265 14.484 914 2HB ASP 26 2HB ASP 116 -7.563 -0.016 13.562 915 HD1 ASP 26 HD2 ASP 116 -4.890 -2.220 13.566 916 H ALA 27 H ALA 117 -6.570 3.527 11.493 917 HA ALA 27 HA ALA 117 -9.497 3.573 10.710 918 1HB ALA 27 3HB ALA 117 -8.462 5.298 12.582 919 2HB ALA 27 1HB ALA 117 -7.961 6.138 11.140 920 3HB ALA 27 2HB ALA 117 -9.680 5.823 11.482 921 H VAL 28 H VAL 118 -6.261 4.519 9.690 922 HA VAL 28 HA VAL 118 -6.953 5.029 6.851 923 HB VAL 28 HB VAL 118 -4.207 3.867 7.778 924 1HG1 VAL 28 1HG2 VAL 118 -5.189 4.352 5.222 925 2HG1 VAL 28 2HG2 VAL 118 -4.277 5.834 5.546 926 3HG1 VAL 28 3HG2 VAL 118 -3.499 4.224 5.743 927 1HG2 VAL 28 3HG1 VAL 118 -4.822 6.776 7.727 928 2HG2 VAL 28 1HG1 VAL 118 -4.263 5.699 9.095 929 3HG2 VAL 28 2HG1 VAL 118 -3.185 5.983 7.715 930 H PHE 29 H PHE 119 -5.230 2.416 8.419 931 HA PHE 29 HA PHE 119 -5.291 0.445 6.280 932 1HB PHE 29 2HB PHE 119 -4.497 0.077 9.188 933 2HB PHE 29 1HB PHE 119 -4.132 -1.050 7.893 934 HD1 PHE 29 HD1 PHE 119 -3.123 0.294 5.620 935 HD2 PHE 29 HD2 PHE 119 -2.563 1.390 9.728 936 HE1 PHE 29 HE1 PHE 119 -1.221 1.686 4.978 937 HE2 PHE 29 HE2 PHE 119 -0.659 2.803 9.079 938 HZ PHE 29 HZ PHE 119 -0.053 3.009 6.665 939 H ASP 30 H ASP 120 -7.665 0.938 8.864 940 HA ASP 30 HA ASP 120 -8.870 -1.776 8.438 941 1HB ASP 30 1HB ASP 120 -9.022 -0.306 10.593 942 2HB ASP 30 2HB ASP 120 -10.282 0.612 9.802 943 HD2 ASP 30 HD2 ASP 120 -12.757 -1.758 10.150 944 H SER 31 H SER 121 -9.606 1.464 7.465 945 HA SER 31 HA SER 121 -11.973 0.799 5.730 946 1HB SER 31 2HB SER 121 -10.193 3.316 5.683 947 2HB SER 31 1HB SER 121 -11.678 3.108 4.735 948 HG SER 31 HG SER 121 -12.042 4.166 6.694 949 H ILE 32 H ILE 122 -8.362 0.951 4.987 950 HA ILE 32 HA ILE 122 -8.456 0.603 2.247 951 HB ILE 32 HB ILE 122 -6.439 -0.643 4.132 952 1HG1 ILE 32 1HG1 ILE 122 -7.014 2.244 3.559 953 2HG1 ILE 32 2HG1 ILE 122 -6.614 1.284 4.952 954 1HG2 ILE 32 2HG2 ILE 122 -6.683 -0.822 1.367 955 2HG2 ILE 32 3HG2 ILE 122 -5.661 0.586 1.513 956 3HG2 ILE 32 1HG2 ILE 122 -5.198 -0.988 2.249 957 1HD1 ILE 32 3HD1 ILE 122 -4.241 1.022 3.851 958 2HD1 ILE 32 1HD1 ILE 122 -4.727 2.593 3.078 959 3HD1 ILE 32 2HD1 ILE 122 -4.696 2.381 4.867 960 H THR 33 H THR 123 -8.220 -1.892 4.814 961 HA THR 33 HA THR 123 -8.259 -4.225 3.016 962 HB THR 33 HB THR 123 -7.470 -4.638 5.079 963 HG1 THR 33 HG1 THR 123 -8.679 -6.403 5.759 964 1HG2 THR 33 2HG2 THR 123 -8.684 -2.962 6.487 965 2HG2 THR 33 3HG2 THR 123 -10.177 -3.892 6.372 966 3HG2 THR 33 1HG2 THR 123 -8.753 -4.546 7.266 967 H GLU 34 H GLU 124 -10.930 -2.280 4.116 968 HA GLU 34 HA GLU 124 -12.980 -4.093 2.814 969 1HB GLU 34 1HB GLU 124 -13.057 -1.239 4.078 970 2HB GLU 34 2HB GLU 124 -14.433 -1.836 3.194 971 1HG GLU 34 1HG GLU 124 -13.264 -3.138 5.739 972 2HG GLU 34 2HG GLU 124 -14.673 -2.099 5.665 973 HE2 GLU 34 HE2 GLU 124 -14.927 -6.001 4.791 974 H ALA 35 H ALA 125 -11.031 -1.274 1.817 975 HA ALA 35 HA ALA 125 -12.397 -1.035 -0.800 976 1HB ALA 35 2HB ALA 125 -10.725 0.904 0.064 977 2HB ALA 35 3HB ALA 125 -9.452 -0.298 -0.040 978 3HB ALA 35 1HB ALA 125 -10.208 0.269 -1.502 979 H LEU 36 H LEU 126 -9.151 -2.573 0.128 980 HA LEU 36 HA LEU 126 -8.660 -3.646 -2.409 981 1HB LEU 36 2HB LEU 126 -7.770 -4.661 0.258 982 2HB LEU 36 1HB LEU 126 -6.960 -4.937 -1.285 983 HG LEU 36 HG LEU 126 -7.366 -2.083 -0.215 984 1HD1 LEU 36 1HD1 LEU 126 -4.771 -3.410 -0.508 985 2HD1 LEU 36 2HD1 LEU 126 -5.063 -1.662 -0.199 986 3HD1 LEU 36 3HD1 LEU 126 -5.533 -2.875 1.023 987 1HD2 LEU 36 2HD2 LEU 126 -6.538 -2.516 -2.835 988 2HD2 LEU 36 3HD2 LEU 126 -7.884 -1.615 -2.164 989 3HD2 LEU 36 1HD2 LEU 126 -6.266 -1.031 -1.911 990 NH1 ARG 37 NH2 ARG 127 -16.234 -7.631 2.715 991 NH2 ARG 37 NH1 ARG 127 -16.488 -9.734 3.538 992 H ARG 37 H ARG 127 -10.342 -5.105 0.423 993 HA ARG 37 HA ARG 127 -10.522 -7.758 -0.626 994 1HB ARG 37 1HB ARG 127 -10.860 -7.285 1.772 995 2HB ARG 37 2HB ARG 127 -12.199 -6.181 1.388 996 1HG ARG 37 1HG ARG 127 -13.599 -8.202 0.700 997 2HG ARG 37 2HG ARG 127 -12.309 -9.239 1.327 998 1HD ARG 37 1HD ARG 127 -12.472 -8.051 3.565 999 2HD ARG 37 2HD ARG 127 -13.678 -6.954 2.928 1000 1HH1 ARG 37 2HH2 ARG 127 -15.589 -6.891 2.417 1001 2HH1 ARG 37 1HH2 ARG 127 -17.259 -7.593 2.709 1002 1HH2 ARG 37 1HH1 ARG 127 -16.042 -10.597 3.869 1003 2HH2 ARG 37 2HH1 ARG 127 -17.495 -9.549 3.474 1004 H LYS 38 H LYS 128 -12.436 -4.758 -1.162 1005 HA LYS 38 HA LYS 128 -14.635 -6.367 -2.538 1006 1HB LYS 38 1HB LYS 128 -14.844 -3.542 -1.388 1007 2HB LYS 38 2HB LYS 128 -16.089 -4.328 -2.336 1008 1HG LYS 38 1HG LYS 128 -16.278 -6.183 -0.656 1009 2HG LYS 38 2HG LYS 128 -15.087 -5.407 0.373 1010 1HD LYS 38 1HD LYS 128 -17.775 -4.127 -0.460 1011 2HD LYS 38 2HD LYS 128 -17.520 -5.053 1.015 1012 1HE LYS 38 1HE LYS 128 -15.782 -3.388 1.801 1013 2HE LYS 38 2HE LYS 128 -16.036 -2.422 0.340 1014 1HZ LYS 38 1HZ LYS 128 -17.305 -1.609 2.209 1015 2HZ LYS 38 2HZ LYS 128 -18.085 -3.033 2.395 1016 H GLY 39 H GLY 129 -11.954 -5.626 -3.732 1017 1HA GLY 39 1HA GLY 129 -11.177 -5.022 -5.883 1018 2HA GLY 39 2HA GLY 129 -12.835 -5.097 -6.457 1019 H ASP 40 H ASP 130 -11.161 -3.026 -4.191 1020 HA ASP 40 HA ASP 130 -11.774 -0.455 -5.802 1021 1HB ASP 40 1HB ASP 130 -12.058 -0.487 -2.831 1022 2HB ASP 40 2HB ASP 130 -12.301 0.842 -3.920 1023 HD2 ASP 40 HD2 ASP 130 -15.250 -1.666 -3.088 1024 H LYS 41 H LYS 131 -9.959 0.446 -6.448 1025 HA LYS 41 HA LYS 131 -7.393 -0.041 -4.966 1026 1HB LYS 41 2HB LYS 131 -7.758 1.991 -7.192 1027 2HB LYS 41 1HB LYS 131 -6.234 1.541 -6.435 1028 1HG LYS 41 1HG LYS 131 -6.572 -0.859 -7.255 1029 2HG LYS 41 2HG LYS 131 -7.979 -0.308 -8.170 1030 1HD LYS 41 1HD LYS 131 -6.517 1.333 -9.429 1031 2HD LYS 41 2HD LYS 131 -5.117 0.834 -8.471 1032 1HE LYS 41 1HE LYS 131 -5.338 -1.528 -9.374 1033 2HE LYS 41 2HE LYS 131 -6.720 -1.014 -10.360 1034 1HZ LYS 41 1HZ LYS 131 -3.953 0.045 -10.552 1035 2HZ LYS 41 2HZ LYS 131 -4.649 -1.007 -11.592 1036 H VAL 42 H VAL 132 -6.677 1.171 -3.309 1037 HA VAL 42 HA VAL 132 -8.145 3.424 -2.214 1038 HB VAL 42 HB VAL 132 -5.657 1.732 -1.475 1039 1HG1 VAL 42 1HG2 VAL 132 -7.326 3.585 0.225 1040 2HG1 VAL 42 2HG2 VAL 132 -6.052 2.484 0.836 1041 3HG1 VAL 42 3HG2 VAL 132 -5.589 3.820 -0.261 1042 1HG2 VAL 42 3HG1 VAL 132 -7.998 0.581 -1.520 1043 2HG2 VAL 42 1HG1 VAL 132 -6.824 0.360 -0.265 1044 3HG2 VAL 42 2HG1 VAL 132 -8.218 1.456 0.036 1045 H GLN 43 H GLN 133 -7.080 5.167 -1.956 1046 HA GLN 43 HA GLN 133 -4.649 5.891 -3.630 1047 1HB GLN 43 1HB GLN 133 -7.145 7.227 -4.545 1048 2HB GLN 43 2HB GLN 133 -5.501 7.698 -4.981 1049 1HG GLN 43 1HG GLN 133 -5.171 5.292 -5.837 1050 2HG GLN 43 2HG GLN 133 -6.874 4.997 -5.497 1051 1HE2 GLN 43 2HE2 GLN 133 -6.824 5.729 -9.091 1052 2HE2 GLN 43 1HE2 GLN 133 -6.332 4.420 -7.904 1053 H LEU 44 H LEU 134 -3.384 7.384 -3.301 1054 HA LEU 44 HA LEU 134 -3.703 9.361 -1.024 1055 1HB LEU 44 2HB LEU 134 -1.413 7.299 -1.157 1056 2HB LEU 44 1HB LEU 134 -1.454 8.651 -0.040 1057 HG LEU 44 HG LEU 134 -3.542 6.380 -0.013 1058 1HD1 LEU 44 1HD1 LEU 134 -1.312 5.375 0.330 1059 2HD1 LEU 44 2HD1 LEU 134 -0.935 6.551 1.613 1060 3HD1 LEU 44 3HD1 LEU 134 -2.235 5.353 1.842 1061 1HD2 LEU 44 1HD2 LEU 134 -2.801 8.472 2.144 1062 2HD2 LEU 44 2HD2 LEU 134 -4.310 8.427 1.195 1063 3HD2 LEU 44 3HD2 LEU 134 -3.950 7.128 2.348 1064 H ILE 45 H ILE 135 -3.068 11.210 -2.111 1065 HA ILE 45 HA ILE 135 -1.487 11.031 -4.594 1066 HB ILE 45 HB ILE 135 -3.449 12.540 -4.366 1067 1HG1 ILE 45 1HG1 ILE 135 -2.508 14.486 -5.650 1068 2HG1 ILE 45 2HG1 ILE 135 -0.878 13.916 -5.345 1069 1HG2 ILE 45 3HG2 ILE 135 -2.964 13.511 -2.133 1070 2HG2 ILE 45 1HG2 ILE 135 -1.565 14.391 -2.798 1071 3HG2 ILE 45 2HG2 ILE 135 -3.219 14.776 -3.361 1072 1HD1 ILE 45 2HD1 ILE 135 -3.053 12.344 -6.903 1073 2HD1 ILE 45 3HD1 ILE 135 -1.734 13.293 -7.630 1074 3HD1 ILE 45 1HD1 ILE 135 -1.355 11.829 -6.701 1075 H GLY 46 H GLY 136 0.436 12.010 -5.029 1076 1HA GLY 46 1HA GLY 136 2.785 12.269 -4.710 1077 2HA GLY 46 2HA GLY 136 2.397 13.039 -3.193 1078 H PHE 47 H PHE 137 1.385 9.806 -3.019 1079 HA PHE 47 HA PHE 137 4.004 8.599 -2.198 1080 1HB PHE 47 2HB PHE 137 2.743 9.973 -0.386 1081 2HB PHE 47 1HB PHE 137 1.449 8.816 -0.411 1082 HD1 PHE 47 HD1 PHE 137 5.139 9.128 0.265 1083 HD2 PHE 47 HD2 PHE 137 1.697 6.569 0.597 1084 HE1 PHE 47 HE1 PHE 137 6.498 7.396 1.398 1085 HE2 PHE 47 HE2 PHE 137 3.092 4.853 1.671 1086 HZ PHE 47 HZ PHE 137 5.509 5.284 2.028 1087 H GLY 48 H GLY 138 0.478 7.853 -2.788 1088 1HA GLY 48 1HA GLY 138 1.235 4.882 -2.927 1089 2HA GLY 48 2HA GLY 138 0.166 5.401 -1.703 1090 H ASN 49 H ASN 139 0.411 4.692 -5.114 1091 HA ASN 49 HA ASN 139 -2.657 4.861 -5.347 1092 1HB ASN 49 1HB ASN 139 -0.610 4.411 -7.591 1093 2HB ASN 49 2HB ASN 139 -2.335 4.178 -7.758 1094 1HD2 ASN 49 1HD2 ASN 139 -3.020 7.737 -7.892 1095 2HD2 ASN 49 2HD2 ASN 139 -3.726 6.073 -7.575 1096 H PHE 50 H PHE 140 -3.327 3.248 -4.137 1097 HA PHE 50 HA PHE 140 -1.635 0.832 -3.673 1098 1HB PHE 50 2HB PHE 140 -2.188 2.741 -2.006 1099 2HB PHE 50 1HB PHE 140 -3.799 2.180 -1.927 1100 HD1 PHE 50 HD2 PHE 140 -0.318 1.136 -1.525 1101 HD2 PHE 50 HD1 PHE 140 -4.278 0.436 -0.226 1102 HE1 PHE 50 HE2 PHE 140 0.540 0.828 0.902 1103 HE2 PHE 50 HE1 PHE 140 -3.416 0.059 2.125 1104 HZ PHE 50 HZ PHE 140 -1.081 0.412 2.585 1105 H GLU 51 H GLU 141 -2.681 -0.744 -5.201 1106 HA GLU 51 HA GLU 141 -3.216 -2.750 -4.291 1107 1HB GLU 51 1HB GLU 141 -4.271 -1.619 -2.063 1108 2HB GLU 51 2HB GLU 141 -4.203 -3.373 -2.432 1109 1HG GLU 51 1HG GLU 141 -1.708 -3.091 -2.660 1110 2HG GLU 51 2HG GLU 141 -1.844 -1.377 -2.459 1111 HE2 GLU 51 HE2 GLU 141 -0.322 -2.207 0.422 1112 H VAL 52 H VAL 142 -4.620 -4.631 -5.310 1113 HA VAL 52 HA VAL 142 -5.053 -5.482 -6.110 1114 HB VAL 52 HB VAL 142 -7.615 -4.136 -5.737 1115 1HG1 VAL 52 3HG2 VAL 142 -7.806 -5.930 -7.364 1116 2HG1 VAL 52 1HG2 VAL 142 -6.832 -6.992 -6.264 1117 3HG1 VAL 52 2HG2 VAL 142 -8.476 -6.406 -5.735 1118 1HG2 VAL 52 1HG1 VAL 142 -5.993 -6.291 -4.143 1119 2HG2 VAL 52 2HG1 VAL 142 -6.234 -4.629 -3.602 1120 3HG2 VAL 52 3HG1 VAL 142 -7.607 -5.720 -3.719 1121 NH1 ARG 53 NH2 ARG 143 -0.083 -4.940 -11.847 1122 NH2 ARG 53 NH1 ARG 143 -0.626 -3.256 -10.420 1123 H ARG 53 H ARG 143 -4.963 -7.064 -7.472 1124 HA ARG 53 HA ARG 143 -5.218 -6.279 -10.405 1125 1HB ARG 53 1HB ARG 143 -2.723 -6.507 -9.253 1126 2HB ARG 53 2HB ARG 143 -3.010 -8.202 -9.478 1127 1HG ARG 53 1HG ARG 143 -1.807 -7.432 -11.393 1128 2HG ARG 53 2HG ARG 143 -3.427 -7.798 -11.955 1129 1HD ARG 53 1HD ARG 143 -2.515 -5.712 -13.001 1130 2HD ARG 53 2HD ARG 143 -4.006 -5.421 -12.144 1131 1HH1 ARG 53 2HH2 ARG 143 -0.408 -5.725 -12.422 1132 2HH1 ARG 53 1HH2 ARG 143 0.885 -4.618 -11.737 1133 1HH2 ARG 53 1HH1 ARG 143 -1.361 -2.756 -9.907 1134 2HH2 ARG 53 2HH1 ARG 143 0.379 -3.048 -10.411 1135 H GLU 54 H GLU 144 -7.118 -7.249 -10.640 1136 HA GLU 54 HA GLU 144 -7.848 -9.812 -9.334 1137 1HB GLU 54 1HB GLU 144 -10.026 -9.655 -10.219 1138 2HB GLU 54 2HB GLU 144 -9.560 -8.156 -9.472 1139 1HG GLU 54 1HG GLU 144 -9.714 -8.641 -12.527 1140 2HG GLU 54 2HG GLU 144 -10.978 -7.938 -11.545 1141 HE2 GLU 54 HE2 GLU 144 -7.988 -5.696 -12.906 1142 NH1 ARG 55 NH2 ARG 145 -6.348 -18.458 -11.224 1143 NH2 ARG 55 NH1 ARG 145 -6.334 -18.243 -8.960 1144 H ARG 55 H ARG 145 -7.540 -11.792 -10.016 1145 HA ARG 55 HA ARG 145 -6.489 -12.342 -12.793 1146 1HB ARG 55 1HB ARG 145 -5.390 -13.328 -10.800 1147 2HB ARG 55 2HB ARG 145 -6.860 -14.189 -10.367 1148 1HG ARG 55 1HG ARG 145 -6.719 -15.591 -12.417 1149 2HG ARG 55 2HG ARG 145 -5.385 -14.624 -13.030 1150 1HD ARG 55 1HD ARG 145 -4.462 -16.689 -12.152 1151 2HD ARG 55 2HD ARG 145 -3.911 -15.357 -11.160 1152 1HH1 ARG 55 2HH2 ARG 145 -6.068 -18.068 -12.131 1153 2HH1 ARG 55 1HH2 ARG 145 -6.871 -19.326 -11.064 1154 1HH2 ARG 55 1HH1 ARG 145 -6.047 -17.692 -8.143 1155 2HH2 ARG 55 2HH1 ARG 145 -6.857 -19.125 -8.954 1156 H ALA 56 H ALA 146 -7.587 -13.472 -14.316 1157 HA ALA 56 HA ALA 146 -10.554 -13.303 -14.229 1158 1HB ALA 56 3HB ALA 146 -9.338 -12.639 -16.261 1159 2HB ALA 56 1HB ALA 146 -8.717 -14.294 -16.490 1160 3HB ALA 56 2HB ALA 146 -10.460 -13.963 -16.621 1161 H ALA 57 H ALA 147 -11.399 -14.855 -12.874 1162 HA ALA 57 HA ALA 147 -10.982 -17.645 -12.857 1163 1HB ALA 57 1HB ALA 147 -12.519 -16.466 -11.225 1164 2HB ALA 57 2HB ALA 147 -13.735 -16.252 -12.503 1165 3HB ALA 57 3HB ALA 147 -13.315 -17.881 -11.927 1166 NH1 ARG 58 NH2 ARG 148 -6.244 -22.571 -17.667 1167 NH2 ARG 58 NH1 ARG 148 -6.791 -23.593 -15.712 1168 H ARG 58 H ARG 148 -11.009 -19.147 -14.162 1169 HA ARG 58 HA ARG 148 -12.097 -18.710 -16.806 1170 1HB ARG 58 2HB ARG 148 -10.642 -21.261 -15.989 1171 2HB ARG 58 1HB ARG 148 -10.842 -20.640 -17.619 1172 1HG ARG 58 1HG ARG 148 -9.390 -18.652 -17.012 1173 2HG ARG 58 2HG ARG 148 -9.120 -19.337 -15.416 1174 1HD ARG 58 1HD ARG 148 -8.351 -20.715 -18.073 1175 2HD ARG 58 2HD ARG 148 -7.249 -19.771 -17.066 1176 1HH1 ARG 58 2HH2 ARG 148 -6.388 -21.772 -18.295 1177 2HH1 ARG 58 1HH2 ARG 148 -5.610 -23.364 -17.817 1178 1HH2 ARG 58 1HH1 ARG 148 -7.351 -23.579 -14.853 1179 2HH2 ARG 58 2HH1 ARG 148 -6.118 -24.314 -15.995 1180 H LYS 59 H LYS 149 -12.759 -21.195 -17.840 1181 HA LYS 59 HA LYS 149 -14.989 -22.418 -16.228 1182 1HB LYS 59 1HB LYS 149 -16.150 -20.531 -17.372 1183 2HB LYS 59 2HB LYS 149 -15.576 -21.071 -18.935 1184 1HG LYS 59 1HG LYS 149 -17.918 -21.696 -18.650 1185 2HG LYS 59 2HG LYS 149 -16.935 -23.131 -18.812 1186 1HD LYS 59 1HD LYS 149 -18.621 -23.579 -17.136 1187 2HD LYS 59 2HD LYS 149 -17.063 -23.563 -16.349 1188 1HE LYS 59 1HE LYS 149 -18.582 -22.435 -14.867 1189 2HE LYS 59 2HE LYS 149 -17.526 -21.183 -15.513 1190 1HZ LYS 59 1HZ LYS 149 -20.263 -21.796 -16.497 1191 2HZ LYS 59 2HZ LYS 149 -19.293 -20.631 -17.109 1192 H GLY 60 H GLY 150 -14.525 -24.499 -16.348 1193 1HA GLY 60 1HA GLY 150 -14.051 -25.879 -18.995 1194 2HA GLY 60 2HA GLY 150 -12.658 -25.872 -17.912 1195 NH1 ARG 61 NH2 ARG 151 -16.584 -34.099 -19.814 1196 NH2 ARG 61 NH1 ARG 151 -17.937 -32.697 -20.986 1197 H ARG 61 H ARG 151 -12.571 -27.664 -16.728 1198 HA ARG 61 HA ARG 151 -15.047 -28.959 -15.537 1199 1HB ARG 61 1HB ARG 151 -13.060 -30.459 -17.386 1200 2HB ARG 61 2HB ARG 151 -14.117 -31.282 -16.255 1201 1HG ARG 61 1HG ARG 151 -16.144 -30.253 -17.365 1202 2HG ARG 61 2HG ARG 151 -15.086 -29.571 -18.607 1203 1HD ARG 61 1HD ARG 151 -14.292 -31.931 -19.187 1204 2HD ARG 61 2HD ARG 151 -15.358 -32.576 -17.925 1205 1HH1 ARG 61 2HH2 ARG 151 -15.812 -34.198 -19.146 1206 2HH1 ARG 61 1HH2 ARG 151 -17.110 -34.858 -20.262 1207 1HH2 ARG 61 1HH1 ARG 151 -18.197 -31.731 -21.213 1208 2HH2 ARG 61 2HH1 ARG 151 -18.369 -33.553 -21.353 1209 H ASN 62 H ASN 152 -14.619 -30.524 -13.974 1210 HA ASN 62 HA ASN 152 -12.436 -29.837 -12.100 1211 1HB ASN 62 1HB ASN 152 -14.832 -30.457 -11.464 1212 2HB ASN 62 2HB ASN 152 -14.510 -32.107 -11.963 1213 1HD2 ASN 62 2HD2 ASN 152 -13.313 -30.994 -8.267 1214 2HD2 ASN 62 1HD2 ASN 152 -14.063 -29.797 -9.438 1215 HA PRO 63 HA PRO 153 -9.509 -32.852 -13.939 1216 1HB PRO 63 1HB PRO 153 -7.611 -33.116 -11.905 1217 2HB PRO 63 2HB PRO 153 -7.789 -31.710 -12.964 1218 1HG PRO 63 1HG PRO 153 -8.928 -32.076 -10.148 1219 2HG PRO 63 2HG PRO 153 -8.017 -30.686 -10.786 1220 1HD PRO 63 1HD PRO 153 -10.761 -30.660 -10.653 1221 2HD PRO 63 2HD PRO 153 -9.928 -29.880 -12.031 1222 H GLN 64 H GLN 154 -11.083 -33.843 -10.901 1223 HA GLN 64 HA GLN 154 -10.211 -36.742 -11.298 1224 1HB GLN 64 1HB GLN 154 -11.803 -35.530 -8.963 1225 2HB GLN 64 2HB GLN 154 -11.226 -37.175 -9.075 1226 1HG GLN 64 1HG GLN 154 -9.428 -34.667 -8.892 1227 2HG GLN 64 2HG GLN 154 -10.038 -35.620 -7.553 1228 1HE2 GLN 64 2HE2 GLN 154 -7.494 -38.172 -7.965 1229 2HE2 GLN 64 1HE2 GLN 154 -8.975 -37.581 -7.056 1230 H THR 65 H THR 155 -13.167 -35.246 -10.197 1231 HA THR 65 HA THR 155 -14.998 -37.143 -11.249 1232 HB THR 65 HB THR 155 -16.848 -35.661 -10.709 1233 HG1 THR 65 HG1 THR 155 -16.453 -33.554 -10.076 1234 1HG2 THR 65 1HG2 THR 155 -15.610 -36.688 -8.742 1235 2HG2 THR 65 2HG2 THR 155 -14.627 -35.208 -8.617 1236 3HG2 THR 65 3HG2 THR 155 -16.381 -35.126 -8.346 1237 H GLY 66 H GLY 156 -14.102 -34.168 -12.995 1238 1HA GLY 66 1HA GLY 156 -14.391 -33.687 -15.345 1239 2HA GLY 66 2HA GLY 156 -15.164 -35.239 -15.589 1240 H GLU 67 H GLU 157 -16.127 -32.679 -13.300 1241 HA GLU 67 HA GLU 157 -18.867 -32.437 -14.630 1242 1HB GLU 67 2HB GLU 157 -18.620 -33.172 -12.163 1243 2HB GLU 67 1HB GLU 157 -18.032 -31.557 -11.785 1244 1HG GLU 67 1HG GLU 157 -20.794 -32.228 -13.006 1245 2HG GLU 67 2HG GLU 157 -20.485 -32.050 -11.291 1246 HE1 GLU 67 HE2 GLU 157 -19.215 -30.034 -10.856 1247 H GLU 68 H GLU 158 -19.403 -30.513 -15.437 1248 HA GLU 68 HA GLU 158 -17.295 -28.628 -16.117 1249 1HB GLU 68 1HB GLU 158 -20.323 -28.256 -16.613 1250 2HB GLU 68 2HB GLU 158 -19.063 -27.213 -17.229 1251 1HG GLU 68 1HG GLU 158 -19.514 -28.538 -19.070 1252 2HG GLU 68 2HG GLU 158 -18.034 -29.245 -18.463 1253 HE2 GLU 68 HE2 GLU 158 -19.449 -32.341 -17.827 1254 H MET 69 H MET 159 -16.510 -27.047 -14.923 1255 HA MET 69 HA MET 159 -18.204 -25.406 -13.060 1256 1HB MET 69 1HB MET 159 -17.074 -25.968 -10.996 1257 2HB MET 69 2HB MET 159 -17.694 -27.432 -11.706 1258 1HG MET 69 1HG MET 159 -15.585 -28.121 -10.923 1259 2HG MET 69 2HG MET 159 -15.210 -27.811 -12.623 1260 1HE MET 69 3HE MET 159 -12.533 -27.557 -11.870 1261 2HE MET 69 2HE MET 159 -13.042 -26.427 -13.165 1262 3HE MET 69 1HE MET 159 -12.026 -25.847 -11.813 1263 H GLU 70 H GLU 160 -17.188 -23.604 -12.197 1264 HA GLU 70 HA GLU 160 -15.194 -22.364 -14.005 1265 1HB GLU 70 2HB GLU 160 -15.557 -20.281 -12.887 1266 2HB GLU 70 1HB GLU 160 -17.095 -21.040 -13.250 1267 1HG GLU 70 1HG GLU 160 -17.490 -20.122 -11.162 1268 2HG GLU 70 2HG GLU 160 -17.184 -21.794 -10.747 1269 HE2 GLU 70 HE2 GLU 160 -14.781 -20.898 -8.486 1270 H ILE 71 H ILE 161 -13.030 -21.953 -13.684 1271 HA ILE 71 HA ILE 161 -11.625 -23.173 -11.372 1272 HB ILE 71 HB ILE 161 -10.639 -21.693 -13.887 1273 1HG1 ILE 71 1HG1 ILE 161 -9.677 -23.991 -14.523 1274 2HG1 ILE 71 2HG1 ILE 161 -10.620 -24.726 -13.243 1275 1HG2 ILE 71 2HG2 ILE 161 -9.028 -21.430 -12.058 1276 2HG2 ILE 71 3HG2 ILE 161 -9.040 -23.191 -11.749 1277 3HG2 ILE 71 1HG2 ILE 161 -8.387 -22.535 -13.287 1278 1HD1 ILE 71 1HD1 ILE 161 -11.804 -23.239 -15.686 1279 2HD1 ILE 71 2HD1 ILE 161 -11.565 -24.996 -15.567 1280 3HD1 ILE 71 3HD1 ILE 161 -12.724 -24.198 -14.497 1281 HA PRO 72 HA PRO 162 -12.504 -19.090 -9.402 1282 1HB PRO 72 1HB PRO 162 -10.427 -20.005 -7.325 1283 2HB PRO 72 2HB PRO 162 -12.033 -19.301 -7.050 1284 1HG PRO 72 1HG PRO 162 -11.681 -21.984 -6.812 1285 2HG PRO 72 2HG PRO 162 -13.135 -21.372 -7.638 1286 1HD PRO 72 1HD PRO 162 -10.577 -22.480 -8.913 1287 2HD PRO 72 2HD PRO 162 -12.287 -22.781 -9.333 1288 H ALA 73 H ALA 163 -11.707 -17.128 -8.752 1289 HA ALA 73 HA ALA 163 -9.240 -16.119 -10.185 1290 1HB ALA 73 2HB ALA 163 -11.429 -14.751 -10.168 1291 2HB ALA 73 3HB ALA 163 -11.319 -14.639 -8.374 1292 3HB ALA 73 1HB ALA 163 -10.120 -13.859 -9.388 1293 H SER 74 H SER 164 -8.165 -14.345 -9.000 1294 HA SER 74 HA SER 164 -8.364 -14.222 -6.220 1295 1HB SER 74 1HB SER 164 -6.650 -16.125 -6.129 1296 2HB SER 74 2HB SER 164 -5.464 -15.093 -6.958 1297 HG SER 74 HG SER 164 -5.237 -15.112 -4.703 1298 H LYS 75 H LYS 165 -7.898 -12.377 -5.452 1299 HA LYS 75 HA LYS 165 -7.019 -10.192 -7.392 1300 1HB LYS 75 2HB LYS 165 -8.235 -9.308 -4.810 1301 2HB LYS 75 1HB LYS 165 -8.269 -8.605 -6.432 1302 1HG LYS 75 1HG LYS 165 -9.979 -10.277 -7.156 1303 2HG LYS 75 2HG LYS 165 -10.007 -10.951 -5.521 1304 1HD LYS 75 1HD LYS 165 -10.677 -8.702 -4.589 1305 2HD LYS 75 2HD LYS 165 -10.663 -7.998 -6.197 1306 1HE LYS 75 1HE LYS 165 -12.526 -10.310 -5.309 1307 2HE LYS 75 2HE LYS 165 -12.964 -8.602 -5.294 1308 1HZ LYS 75 1HZ LYS 165 -12.657 -8.512 -7.676 1309 2HZ LYS 75 2HZ LYS 165 -13.766 -9.642 -7.269 1310 H VAL 76 H VAL 166 -4.884 -9.294 -7.106 1311 HA VAL 76 HA VAL 166 -3.503 -9.880 -4.685 1312 HB VAL 76 HB VAL 166 -3.376 -9.822 -7.714 1313 1HG1 VAL 76 1HG2 VAL 166 -0.902 -9.376 -6.252 1314 2HG1 VAL 76 2HG2 VAL 166 -1.117 -9.990 -7.978 1315 3HG1 VAL 76 3HG2 VAL 166 -1.728 -8.387 -7.522 1316 1HG2 VAL 76 3HG1 VAL 166 -3.823 -11.940 -6.521 1317 2HG2 VAL 76 1HG1 VAL 166 -2.353 -11.993 -7.502 1318 3HG2 VAL 76 2HG1 VAL 166 -2.229 -11.809 -5.715 1319 HA PRO 77 HA PRO 167 -3.254 -5.319 -4.294 1320 1HB PRO 77 1HB PRO 167 -2.420 -5.200 -1.651 1321 2HB PRO 77 2HB PRO 167 -4.003 -5.862 -2.086 1322 1HG PRO 77 1HG PRO 167 -1.406 -7.412 -1.543 1323 2HG PRO 77 2HG PRO 167 -2.998 -7.687 -0.811 1324 1HD PRO 77 1HD PRO 167 -2.059 -9.093 -3.149 1325 2HD PRO 77 2HD PRO 167 -3.802 -8.790 -2.877 1326 H ALA 78 H ALA 168 -2.086 -3.963 -4.820 1327 HA ALA 78 HA ALA 168 0.991 -4.171 -4.727 1328 1HB ALA 78 3HB ALA 168 0.067 -4.676 -6.924 1329 2HB ALA 78 1HB ALA 168 -0.846 -3.120 -6.938 1330 3HB ALA 78 2HB ALA 168 0.958 -3.111 -6.939 1331 H PHE 79 H PHE 169 1.896 -2.457 -4.376 1332 HA PHE 79 HA PHE 169 0.586 0.104 -3.112 1333 1HB PHE 79 2HB PHE 169 1.581 -0.610 -1.327 1334 2HB PHE 79 1HB PHE 169 3.021 -1.210 -2.222 1335 HD1 PHE 79 HD1 PHE 169 1.382 2.263 -1.696 1336 HD2 PHE 79 HD2 PHE 169 4.975 -0.109 -1.756 1337 HE1 PHE 79 HE1 PHE 169 2.677 4.200 -1.031 1338 HE2 PHE 79 HE2 PHE 169 6.279 1.888 -1.160 1339 HZ PHE 79 HZ PHE 169 5.133 4.052 -0.799 1340 H LYS 80 H LYS 170 1.003 1.479 -4.712 1341 HA LYS 80 HA LYS 170 3.479 1.605 -6.641 1342 1HB LYS 80 2HB LYS 170 0.775 2.886 -7.050 1343 2HB LYS 80 1HB LYS 170 2.206 3.407 -7.886 1344 1HG LYS 80 1HG LYS 170 2.551 1.165 -8.878 1345 2HG LYS 80 2HG LYS 170 1.241 0.463 -7.950 1346 1HD LYS 80 1HD LYS 170 0.809 2.733 -9.992 1347 2HD LYS 80 2HD LYS 170 0.828 1.048 -10.459 1348 1HE LYS 80 1HE LYS 170 -1.180 2.244 -8.440 1349 2HE LYS 80 2HE LYS 170 -1.492 2.005 -10.152 1350 1HZ LYS 80 1HZ LYS 170 -1.196 -0.366 -9.853 1351 2HZ LYS 80 2HZ LYS 170 -2.383 0.211 -8.889 1352 HA PRO 81 HA PRO 171 4.663 4.715 -3.580 1353 1HB PRO 81 1HB PRO 171 7.082 5.490 -4.662 1354 2HB PRO 81 2HB PRO 171 6.774 3.884 -3.998 1355 1HG PRO 81 1HG PRO 171 6.607 4.730 -6.945 1356 2HG PRO 81 2HG PRO 171 7.630 3.436 -6.258 1357 1HD PRO 81 1HD PRO 171 5.149 2.938 -7.337 1358 2HD PRO 81 2HD PRO 171 5.706 2.020 -5.899 1359 H GLY 82 H GLY 172 2.608 5.558 -5.323 1360 1HA GLY 82 1HA GLY 172 1.653 7.287 -6.658 1361 2HA GLY 82 2HA GLY 172 2.369 8.282 -5.410 1362 H LYS 83 H LYS 173 4.632 6.708 -7.448 1363 HA LYS 83 HA LYS 173 6.183 7.480 -9.101 1364 1HB LYS 83 2HB LYS 173 3.900 9.328 -9.785 1365 2HB LYS 83 1HB LYS 173 5.430 10.036 -10.088 1366 1HG LYS 83 1HG LYS 173 4.628 8.922 -12.128 1367 2HG LYS 83 2HG LYS 173 6.060 8.081 -11.572 1368 1HD LYS 83 1HD LYS 173 4.461 6.441 -12.341 1369 2HD LYS 83 2HD LYS 173 4.656 6.236 -10.608 1370 1HE LYS 83 1HE LYS 173 2.456 7.503 -10.231 1371 2HE LYS 83 2HE LYS 173 2.279 7.682 -11.982 1372 1HZ LYS 83 1HZ LYS 173 2.406 5.113 -10.497 1373 2HZ LYS 83 2HZ LYS 173 1.052 5.803 -11.102 1374 H ALA 84 H ALA 174 4.958 9.905 -7.168 1375 HA ALA 84 HA ALA 174 7.076 11.868 -6.860 1376 1HB ALA 84 3HB ALA 174 4.736 10.863 -5.116 1377 2HB ALA 84 1HB ALA 174 5.589 12.405 -4.839 1378 3HB ALA 84 2HB ALA 174 4.650 12.146 -6.351 1379 H LEU 85 H LEU 175 6.188 9.031 -4.635 1380 HA LEU 85 HA LEU 175 8.564 9.434 -2.948 1381 1HB LEU 85 2HB LEU 175 6.643 8.245 -1.973 1382 2HB LEU 85 1HB LEU 175 6.686 7.046 -3.228 1383 HG LEU 85 HG LEU 175 9.072 6.626 -2.562 1384 1HD1 LEU 85 3HD1 LEU 175 9.305 8.608 -0.898 1385 2HD1 LEU 85 1HD1 LEU 175 8.462 7.549 0.259 1386 3HD1 LEU 85 2HD1 LEU 175 10.004 7.041 -0.440 1387 1HD2 LEU 85 3HD2 LEU 175 7.140 5.019 -2.136 1388 2HD2 LEU 85 1HD2 LEU 175 8.509 4.859 -1.036 1389 3HD2 LEU 85 2HD2 LEU 175 7.012 5.664 -0.491 1390 H LYS 86 H LYS 176 7.853 7.578 -5.868 1391 HA LYS 86 HA LYS 176 10.381 6.140 -6.096 1392 1HB LYS 86 1HB LYS 176 8.210 5.954 -7.631 1393 2HB LYS 86 2HB LYS 176 8.983 7.163 -8.622 1394 1HG LYS 86 1HG LYS 176 10.973 5.649 -8.947 1395 2HG LYS 86 2HG LYS 176 10.262 4.476 -7.844 1396 1HD LYS 86 1HD LYS 176 9.858 3.677 -10.064 1397 2HD LYS 86 2HD LYS 176 8.304 4.152 -9.390 1398 1HE LYS 86 1HE LYS 176 8.400 6.330 -10.722 1399 2HE LYS 86 2HE LYS 176 9.981 5.862 -11.365 1400 1HZ LYS 86 1HZ LYS 176 7.429 4.401 -11.766 1401 2HZ LYS 86 2HZ LYS 176 8.186 5.337 -12.872 1402 H ASP 87 H ASP 177 9.767 9.574 -6.621 1403 HA ASP 87 HA ASP 177 12.467 10.071 -7.813 1404 1HB ASP 87 1HB ASP 177 9.902 11.367 -7.908 1405 2HB ASP 87 2HB ASP 177 10.757 12.337 -6.771 1406 HD2 ASP 87 HD2 ASP 177 12.892 13.723 -9.169 1407 H ALA 88 H ALA 178 10.821 10.475 -4.663 1408 HA ALA 88 HA ALA 178 12.927 11.759 -3.111 1409 1HB ALA 88 3HB ALA 178 10.545 11.201 -2.220 1410 2HB ALA 88 1HB ALA 178 10.992 9.491 -2.186 1411 3HB ALA 88 2HB ALA 178 11.823 10.605 -1.124 1412 H VAL 89 H VAL 179 12.447 8.289 -3.997 1413 HA VAL 89 HA VAL 179 14.528 7.332 -2.154 1414 HB VAL 89 HB VAL 179 11.861 6.837 -2.541 1415 1HG1 VAL 89 2HG2 VAL 179 12.244 6.376 -5.043 1416 2HG1 VAL 89 3HG2 VAL 179 12.942 4.826 -4.575 1417 3HG1 VAL 89 1HG2 VAL 179 11.254 5.238 -4.120 1418 1HG2 VAL 89 3HG1 VAL 179 13.850 4.686 -2.051 1419 2HG2 VAL 89 1HG1 VAL 179 13.103 5.863 -0.906 1420 3HG2 VAL 89 2HG1 VAL 179 12.057 4.679 -1.743 1421 H LYS 90 H LYS 180 14.446 8.083 -5.507 1422 HA LYS 90 HA LYS 180 15.854 5.859 -6.622 1423 1HB LYS 90 1HB LYS 180 15.937 7.070 -8.620 1424 2HB LYS 90 2HB LYS 180 14.448 7.482 -7.820 1425 1HG LYS 90 1HG LYS 180 15.481 9.690 -7.068 1426 2HG LYS 90 2HG LYS 180 16.937 9.297 -7.973 1427 1HD LYS 90 1HD LYS 180 15.645 9.231 -10.124 1428 2HD LYS 90 2HD LYS 180 14.137 9.446 -9.255 1429 1HE LYS 90 1HE LYS 180 14.654 11.589 -10.186 1430 2HE LYS 90 2HE LYS 180 14.912 11.740 -8.451 1431 1HZ LYS 90 1HZ LYS 180 16.677 12.747 -9.745 1432 2HZ LYS 90 2HZ LYS 180 17.020 11.344 -10.509 Start of MODEL 12 Raw file had 1432 H/Q atoms Start of MODEL 12 1 1H MET 1 1H MET 1 -11.914 5.443 -1.671 2 2H MET 1 2H MET 1 -12.200 6.598 -2.792 3 HA MET 1 HA MET 1 -12.458 7.517 -0.650 4 1HB MET 1 1HB MET 1 -9.557 6.607 -0.148 5 2HB MET 1 2HB MET 1 -10.425 7.706 0.882 6 1HG MET 1 1HG MET 1 -12.120 5.899 1.417 7 2HG MET 1 2HG MET 1 -11.183 4.765 0.412 8 1HE MET 1 3HE MET 1 -11.639 3.992 3.394 9 2HE MET 1 2HE MET 1 -10.503 3.060 2.375 10 3HE MET 1 1HE MET 1 -9.992 3.616 3.989 11 H ASN 2 H ASN 2 -9.242 8.499 -0.896 12 HA ASN 2 HA ASN 2 -8.594 9.904 -2.891 13 1HB ASN 2 1HB ASN 2 -9.223 12.152 -3.212 14 2HB ASN 2 2HB ASN 2 -10.622 11.139 -3.303 15 1HD2 ASN 2 1HD2 ASN 2 -10.538 14.107 -0.507 16 2HD2 ASN 2 2HD2 ASN 2 -9.043 13.520 -1.398 17 H LYS 3 H LYS 3 -9.054 10.330 0.372 18 HA LYS 3 HA LYS 3 -6.942 10.219 1.838 19 1HB LYS 3 1HB LYS 3 -5.489 11.439 0.128 20 2HB LYS 3 2HB LYS 3 -6.235 12.951 0.596 21 1HG LYS 3 1HG LYS 3 -5.208 12.688 2.899 22 2HG LYS 3 2HG LYS 3 -4.711 11.037 2.511 23 1HD LYS 3 1HD LYS 3 -3.218 11.950 0.653 24 2HD LYS 3 2HD LYS 3 -3.647 13.592 1.148 25 1HE LYS 3 1HE LYS 3 -2.632 13.193 3.422 26 2HE LYS 3 2HE LYS 3 -2.251 11.520 2.976 27 1HZ LYS 3 1HZ LYS 3 -0.370 12.987 2.705 28 2HZ LYS 3 2HZ LYS 3 -1.178 13.955 1.666 29 H THR 4 H THR 4 -9.657 12.318 1.150 30 HA THR 4 HA THR 4 -9.794 13.387 3.864 31 HB THR 4 HB THR 4 -11.228 13.806 1.157 32 HG1 THR 4 HG1 THR 4 -9.488 15.475 2.688 33 1HG2 THR 4 3HG2 THR 4 -11.578 15.154 3.830 34 2HG2 THR 4 1HG2 THR 4 -12.192 15.791 2.231 35 3HG2 THR 4 2HG2 THR 4 -12.777 14.209 2.872 36 H GLU 5 H GLU 5 -11.263 11.004 1.703 37 HA GLU 5 HA GLU 5 -13.592 10.358 3.507 38 1HB GLU 5 1HB GLU 5 -12.444 8.408 1.481 39 2HB GLU 5 2HB GLU 5 -14.016 8.379 2.227 40 1HG GLU 5 1HG GLU 5 -13.019 10.333 0.071 41 2HG GLU 5 2HG GLU 5 -14.116 9.000 -0.171 42 HE1 GLU 5 HE2 GLU 5 -16.947 10.591 1.083 43 H LEU 6 H LEU 6 -10.246 9.932 3.377 44 HA LEU 6 HA LEU 6 -9.815 7.621 5.180 45 1HB LEU 6 2HB LEU 6 -8.162 9.259 3.503 46 2HB LEU 6 1HB LEU 6 -7.728 9.853 5.076 47 HG LEU 6 HG LEU 6 -7.546 6.975 4.193 48 1HD1 LEU 6 2HD1 LEU 6 -5.848 8.562 3.260 49 2HD1 LEU 6 3HD1 LEU 6 -5.318 8.921 4.893 50 3HD1 LEU 6 1HD1 LEU 6 -5.142 7.270 4.270 51 1HD2 LEU 6 2HD2 LEU 6 -7.255 8.135 6.987 52 2HD2 LEU 6 3HD2 LEU 6 -8.026 6.628 6.473 53 3HD2 LEU 6 1HD2 LEU 6 -6.258 6.768 6.489 54 H ILE 7 H ILE 7 -9.810 11.216 5.509 55 HA ILE 7 HA ILE 7 -9.244 11.393 8.328 56 HB ILE 7 HB ILE 7 -10.903 13.387 6.673 57 1HG1 ILE 7 1HG1 ILE 7 -7.870 13.440 7.162 58 2HG1 ILE 7 2HG1 ILE 7 -8.543 12.760 5.732 59 1HG2 ILE 7 2HG2 ILE 7 -11.036 13.856 9.167 60 2HG2 ILE 7 3HG2 ILE 7 -9.273 13.935 9.218 61 3HG2 ILE 7 1HG2 ILE 7 -10.186 15.138 8.299 62 1HD1 ILE 7 3HD1 ILE 7 -9.711 14.971 5.192 63 2HD1 ILE 7 1HD1 ILE 7 -8.679 15.698 6.415 64 3HD1 ILE 7 2HD1 ILE 7 -7.940 14.866 5.014 65 H ASN 8 H ASN 8 -12.371 11.358 6.666 66 HA ASN 8 HA ASN 8 -13.907 11.269 9.215 67 1HB ASN 8 1HB ASN 8 -14.890 10.362 6.396 68 2HB ASN 8 2HB ASN 8 -15.929 10.605 7.779 69 1HD2 ASN 8 2HD2 ASN 8 -15.041 13.862 5.526 70 2HD2 ASN 8 1HD2 ASN 8 -14.400 12.186 5.144 71 H ALA 9 H ALA 9 -12.241 8.726 7.624 72 HA ALA 9 HA ALA 9 -13.761 6.454 8.887 73 1HB ALA 9 1HB ALA 9 -12.061 6.184 6.806 74 2HB ALA 9 2HB ALA 9 -10.760 6.560 7.937 75 3HB ALA 9 3HB ALA 9 -11.679 5.119 8.219 76 H VAL 10 H VAL 10 -10.795 8.371 9.575 77 HA VAL 10 HA VAL 10 -9.993 6.719 11.719 78 HB VAL 10 HB VAL 10 -8.933 9.545 11.427 79 1HG1 VAL 10 3HG2 VAL 10 -8.110 7.625 13.117 80 2HG1 VAL 10 1HG2 VAL 10 -7.120 7.183 11.692 81 3HG1 VAL 10 2HG2 VAL 10 -7.003 8.817 12.356 82 1HG2 VAL 10 1HG1 VAL 10 -8.597 7.279 9.458 83 2HG2 VAL 10 2HG1 VAL 10 -9.021 9.012 9.268 84 3HG2 VAL 10 3HG1 VAL 10 -7.327 8.575 9.648 85 H ALA 11 H ALA 11 -11.235 9.890 11.466 86 HA ALA 11 HA ALA 11 -11.586 10.116 14.260 87 1HB ALA 11 2HB ALA 11 -11.463 12.133 12.705 88 2HB ALA 11 3HB ALA 11 -13.036 11.689 11.996 89 3HB ALA 11 1HB ALA 11 -12.941 12.264 13.694 90 H GLU 12 H GLU 12 -13.657 8.523 11.992 91 HA GLU 12 HA GLU 12 -15.948 8.383 13.928 92 1HB GLU 12 1HB GLU 12 -16.420 8.367 11.477 93 2HB GLU 12 2HB GLU 12 -15.462 6.902 11.263 94 1HG GLU 12 1HG GLU 12 -17.106 5.610 12.672 95 2HG GLU 12 2HG GLU 12 -18.040 7.075 12.960 96 HE1 GLU 12 HE2 GLU 12 -19.572 7.117 9.858 97 H THR 13 H THR 13 -13.429 6.061 12.718 98 HA THR 13 HA THR 13 -14.197 4.260 15.018 99 HB THR 13 HB THR 13 -13.931 3.638 12.545 100 HG1 THR 13 HG1 THR 13 -12.928 2.011 14.632 101 1HG2 THR 13 1HG2 THR 13 -11.592 4.170 12.122 102 2HG2 THR 13 2HG2 THR 13 -11.079 2.994 13.365 103 3HG2 THR 13 3HG2 THR 13 -11.926 2.442 11.891 104 H SER 14 H SER 14 -12.443 6.579 15.156 105 HA SER 14 HA SER 14 -10.776 5.434 17.499 106 1HB SER 14 1HB SER 14 -9.239 5.984 15.553 107 2HB SER 14 2HB SER 14 -9.693 7.686 15.698 108 HG SER 14 HG SER 14 -7.822 7.191 16.825 109 H GLY 15 H GLY 15 -12.705 8.270 16.419 110 1HA GLY 15 1HA GLY 15 -13.554 10.093 17.652 111 2HA GLY 15 2HA GLY 15 -13.312 9.143 19.116 112 H LEU 16 H LEU 16 -11.266 10.701 16.734 113 HA LEU 16 HA LEU 16 -9.801 12.408 18.763 114 1HB LEU 16 1HB LEU 16 -7.953 12.479 17.239 115 2HB LEU 16 2HB LEU 16 -8.269 10.940 18.016 116 HG LEU 16 HG LEU 16 -9.181 9.977 16.147 117 1HD1 LEU 16 2HD1 LEU 16 -10.484 11.922 15.178 118 2HD1 LEU 16 3HD1 LEU 16 -8.906 12.515 14.566 119 3HD1 LEU 16 1HD1 LEU 16 -9.624 10.948 13.981 120 1HD2 LEU 16 3HD2 LEU 16 -7.091 9.441 16.043 121 2HD2 LEU 16 1HD2 LEU 16 -7.998 9.418 14.507 122 3HD2 LEU 16 2HD2 LEU 16 -6.851 10.715 14.792 123 H SER 17 H SER 17 -9.378 13.615 16.104 124 HA SER 17 HA SER 17 -11.774 15.502 15.901 125 1HB SER 17 1HB SER 17 -8.965 16.681 15.810 126 2HB SER 17 2HB SER 17 -10.491 17.514 15.642 127 HG SER 17 HG SER 17 -9.651 16.105 17.949 128 H LYS 18 H LYS 18 -11.944 16.548 13.858 129 HA LYS 18 HA LYS 18 -11.156 14.882 11.471 130 1HB LYS 18 1HB LYS 18 -12.465 17.662 11.488 131 2HB LYS 18 2HB LYS 18 -12.180 16.691 10.057 132 1HG LYS 18 1HG LYS 18 -14.006 15.854 12.396 133 2HG LYS 18 2HG LYS 18 -14.553 16.642 10.930 134 1HD LYS 18 1HD LYS 18 -13.915 14.702 9.522 135 2HD LYS 18 2HD LYS 18 -13.102 13.926 10.868 136 1HE LYS 18 1HE LYS 18 -15.210 12.799 10.583 137 2HE LYS 18 2HE LYS 18 -15.271 13.665 12.114 138 1HZ LYS 18 1HZ LYS 18 -17.299 13.935 10.899 139 2HZ LYS 18 2HZ LYS 18 -16.573 15.393 11.030 140 H LYS 19 H LYS 19 -10.128 17.991 12.817 141 HA LYS 19 HA LYS 19 -7.823 18.431 11.037 142 1HB LYS 19 2HB LYS 19 -8.861 20.191 12.515 143 2HB LYS 19 1HB LYS 19 -8.220 19.384 13.952 144 1HG LYS 19 1HG LYS 19 -5.869 19.783 13.092 145 2HG LYS 19 2HG LYS 19 -6.524 20.544 11.639 146 1HD LYS 19 1HD LYS 19 -7.620 22.324 13.069 147 2HD LYS 19 2HD LYS 19 -6.979 21.551 14.525 148 1HE LYS 19 1HE LYS 19 -4.608 21.948 13.697 149 2HE LYS 19 2HE LYS 19 -5.243 22.715 12.234 150 1HZ LYS 19 1HZ LYS 19 -4.671 24.349 13.864 151 2HZ LYS 19 2HZ LYS 19 -6.286 24.393 13.615 152 H ASP 20 H ASP 20 -8.145 16.471 14.108 153 HA ASP 20 HA ASP 20 -5.200 15.817 14.119 154 1HB ASP 20 1HB ASP 20 -7.566 14.785 15.787 155 2HB ASP 20 2HB ASP 20 -6.074 13.885 15.772 156 HD2 ASP 20 HD2 ASP 20 -6.288 17.383 17.732 157 H ALA 21 H ALA 21 -8.040 14.338 12.684 158 HA ALA 21 HA ALA 21 -6.682 11.811 11.885 159 1HB ALA 21 2HB ALA 21 -9.427 13.030 11.213 160 2HB ALA 21 3HB ALA 21 -8.813 11.530 10.459 161 3HB ALA 21 1HB ALA 21 -9.022 11.633 12.182 162 H THR 22 H THR 22 -7.328 14.957 10.204 163 HA THR 22 HA THR 22 -6.120 14.335 7.665 164 HB THR 22 HB THR 22 -5.926 17.083 9.064 165 HG1 THR 22 HG1 THR 22 -8.175 15.990 7.762 166 1HG2 THR 22 3HG2 THR 22 -6.403 16.173 6.161 167 2HG2 THR 22 1HG2 THR 22 -6.470 17.868 6.717 168 3HG2 THR 22 2HG2 THR 22 -4.928 16.943 6.797 169 H LYS 23 H LYS 23 -4.639 15.678 10.531 170 HA LYS 23 HA LYS 23 -1.833 15.722 9.652 171 1HB LYS 23 2HB LYS 23 -3.220 15.295 12.426 172 2HB LYS 23 1HB LYS 23 -1.501 15.436 12.322 173 1HG LYS 23 1HG LYS 23 -1.634 17.775 11.408 174 2HG LYS 23 2HG LYS 23 -3.395 17.693 11.383 175 1HD LYS 23 1HD LYS 23 -3.434 17.376 13.888 176 2HD LYS 23 2HD LYS 23 -1.670 17.451 13.928 177 1HE LYS 23 1HE LYS 23 -1.718 19.812 13.038 178 2HE LYS 23 2HE LYS 23 -3.483 19.750 12.926 179 1HZ LYS 23 1HZ LYS 23 -2.724 20.813 14.949 180 2HZ LYS 23 2HZ LYS 23 -1.896 19.485 15.420 181 H ALA 24 H ALA 24 -3.498 13.379 11.633 182 HA ALA 24 HA ALA 24 -1.441 11.469 11.949 183 1HB ALA 24 3HB ALA 24 -4.466 11.119 11.967 184 2HB ALA 24 1HB ALA 24 -3.303 9.921 12.619 185 3HB ALA 24 2HB ALA 24 -3.388 11.554 13.338 186 H VAL 25 H VAL 25 -3.714 11.606 9.314 187 HA VAL 25 HA VAL 25 -2.717 9.213 7.774 188 HB VAL 25 HB VAL 25 -4.349 11.917 7.403 189 1HG1 VAL 25 1HG2 VAL 25 -3.483 10.227 5.009 190 2HG1 VAL 25 2HG2 VAL 25 -4.834 11.418 5.009 191 3HG1 VAL 25 3HG2 VAL 25 -3.182 11.937 5.324 192 1HG2 VAL 25 2HG1 VAL 25 -5.121 8.978 7.077 193 2HG2 VAL 25 3HG1 VAL 25 -5.546 10.048 8.418 194 3HG2 VAL 25 1HG1 VAL 25 -6.215 10.390 6.816 195 H ASP 26 H ASP 26 -2.046 12.770 7.366 196 HA ASP 26 HA ASP 26 0.537 12.097 5.928 197 1HB ASP 26 1HB ASP 26 -1.033 14.136 5.513 198 2HB ASP 26 2HB ASP 26 -0.379 14.829 7.000 199 HD2 ASP 26 HD2 ASP 26 2.364 16.127 5.385 200 H ALA 27 H ALA 27 0.075 11.415 8.627 201 HA ALA 27 HA ALA 27 2.767 11.956 9.922 202 1HB ALA 27 2HB ALA 27 0.691 12.422 11.322 203 2HB ALA 27 3HB ALA 27 0.324 10.694 11.162 204 3HB ALA 27 1HB ALA 27 1.818 11.201 11.917 205 H VAL 28 H VAL 28 0.543 9.285 9.321 206 HA VAL 28 HA VAL 28 2.515 7.075 9.426 207 HB VAL 28 HB VAL 28 -0.169 7.214 7.821 208 1HG1 VAL 28 2HG2 VAL 28 1.734 4.932 8.531 209 2HG1 VAL 28 3HG2 VAL 28 0.011 4.611 8.176 210 3HG1 VAL 28 1HG2 VAL 28 1.007 5.393 6.940 211 1HG2 VAL 28 3HG1 VAL 28 -0.568 7.465 10.163 212 2HG2 VAL 28 1HG1 VAL 28 -1.186 5.928 9.470 213 3HG2 VAL 28 2HG1 VAL 28 0.337 5.935 10.480 214 H PHE 29 H PHE 29 0.807 8.539 6.804 215 HA PHE 29 HA PHE 29 2.474 7.516 4.585 216 1HB PHE 29 2HB PHE 29 0.383 9.700 4.314 217 2HB PHE 29 1HB PHE 29 1.086 8.766 3.000 218 HD1 PHE 29 HD2 PHE 29 0.996 6.026 3.409 219 HD2 PHE 29 HD1 PHE 29 -1.742 8.903 5.038 220 HE1 PHE 29 HE2 PHE 29 -0.508 4.212 4.095 221 HE2 PHE 29 HE1 PHE 29 -3.203 7.093 5.777 222 HZ PHE 29 HZ PHE 29 -2.544 4.741 5.384 223 H ASP 30 H ASP 30 3.006 10.371 6.533 224 HA ASP 30 HA ASP 30 4.904 11.468 4.471 225 1HB ASP 30 1HB ASP 30 3.516 12.779 6.328 226 2HB ASP 30 2HB ASP 30 4.791 12.349 7.431 227 HD2 ASP 30 HD2 ASP 30 3.839 14.210 4.862 228 H SER 31 H SER 31 5.019 9.583 7.291 229 HA SER 31 HA SER 31 8.049 9.441 7.510 230 1HB SER 31 1HB SER 31 6.044 7.668 8.963 231 2HB SER 31 2HB SER 31 7.780 7.750 9.270 232 HG SER 31 HG SER 31 7.551 9.947 9.782 233 H ILE 32 H ILE 32 5.438 7.201 6.070 234 HA ILE 32 HA ILE 32 7.130 5.190 5.234 235 HB ILE 32 HB ILE 32 4.756 6.116 3.575 236 1HG1 ILE 32 1HG1 ILE 32 4.832 5.185 6.398 237 2HG1 ILE 32 2HG1 ILE 32 3.882 6.351 5.523 238 1HG2 ILE 32 3HG2 ILE 32 6.410 4.118 2.969 239 2HG2 ILE 32 1HG2 ILE 32 5.723 3.324 4.377 240 3HG2 ILE 32 2HG2 ILE 32 4.683 3.707 2.987 241 1HD1 ILE 32 3HD1 ILE 32 3.352 3.417 5.189 242 2HD1 ILE 32 1HD1 ILE 32 2.822 4.357 6.603 243 3HD1 ILE 32 2HD1 ILE 32 2.256 4.863 4.969 244 H THR 33 H THR 33 6.096 8.074 3.459 245 HA THR 33 HA THR 33 7.887 7.671 1.114 246 HB THR 33 HB THR 33 6.107 9.114 0.885 247 HG1 THR 33 HG1 THR 33 8.510 10.569 0.677 248 1HG2 THR 33 2HG2 THR 33 6.035 10.172 3.162 249 2HG2 THR 33 3HG2 THR 33 7.419 11.186 2.758 250 3HG2 THR 33 1HG2 THR 33 5.856 11.381 1.881 251 H GLU 34 H GLU 34 8.568 8.940 4.276 252 HA GLU 34 HA GLU 34 11.405 9.711 3.568 253 1HB GLU 34 1HB GLU 34 9.957 9.480 6.292 254 2HB GLU 34 2HB GLU 34 11.668 9.815 6.169 255 1HG GLU 34 1HG GLU 34 11.286 11.946 4.969 256 2HG GLU 34 2HG GLU 34 9.559 11.640 4.854 257 HE1 GLU 34 HE2 GLU 34 11.217 13.006 8.262 258 H ALA 35 H ALA 35 9.643 6.783 4.775 259 HA ALA 35 HA ALA 35 12.133 5.333 5.305 260 1HB ALA 35 3HB ALA 35 9.830 4.419 6.222 261 2HB ALA 35 1HB ALA 35 9.361 4.077 4.554 262 3HB ALA 35 2HB ALA 35 10.679 3.189 5.282 263 H LEU 36 H LEU 36 9.807 5.103 2.450 264 HA LEU 36 HA LEU 36 11.620 3.503 0.794 265 1HB LEU 36 2HB LEU 36 9.440 5.401 0.096 266 2HB LEU 36 1HB LEU 36 10.073 4.211 -0.968 267 HG LEU 36 HG LEU 36 8.593 3.945 1.088 268 1HD1 LEU 36 1HD2 LEU 36 10.565 1.782 1.436 269 2HD1 LEU 36 2HD2 LEU 36 9.506 2.591 2.624 270 3HD1 LEU 36 3HD2 LEU 36 8.939 1.194 1.746 271 1HD2 LEU 36 2HD1 LEU 36 6.855 3.632 0.199 272 2HD2 LEU 36 3HD1 LEU 36 7.288 1.902 0.157 273 3HD2 LEU 36 1HD1 LEU 36 7.153 2.681 1.714 274 NH1 ARG 37 NH2 ARG 37 12.275 14.551 0.390 275 NH2 ARG 37 NH1 ARG 37 13.926 15.032 -1.097 276 H ARG 37 H ARG 37 11.200 7.095 0.998 277 HA ARG 37 HA ARG 37 12.976 7.506 -1.144 278 1HB ARG 37 1HB ARG 37 11.499 9.316 -0.328 279 2HB ARG 37 2HB ARG 37 12.393 9.388 1.202 280 1HG ARG 37 1HG ARG 37 14.433 10.234 -0.161 281 2HG ARG 37 2HG ARG 37 13.369 10.300 -1.568 282 1HD ARG 37 1HD ARG 37 11.764 11.753 -0.112 283 2HD ARG 37 2HD ARG 37 13.015 11.739 1.146 284 1HH1 ARG 37 2HH2 ARG 37 11.752 13.828 0.898 285 2HH1 ARG 37 1HH2 ARG 37 12.136 15.565 0.448 286 1HH2 ARG 37 1HH1 ARG 37 14.660 14.681 -1.723 287 2HH2 ARG 37 2HH1 ARG 37 13.672 16.013 -0.938 288 H LYS 38 H LYS 38 13.700 6.737 2.233 289 HA LYS 38 HA LYS 38 16.625 7.524 1.817 290 1HB LYS 38 1HB LYS 38 15.150 7.409 4.488 291 2HB LYS 38 2HB LYS 38 16.882 7.580 4.319 292 1HG LYS 38 1HG LYS 38 16.637 9.696 3.031 293 2HG LYS 38 2HG LYS 38 14.888 9.622 3.158 294 1HD LYS 38 1HD LYS 38 16.786 9.757 5.595 295 2HD LYS 38 2HD LYS 38 16.102 11.168 4.796 296 1HE LYS 38 1HE LYS 38 13.759 10.369 5.307 297 2HE LYS 38 2HE LYS 38 14.412 8.953 6.144 298 1HZ LYS 38 1HZ LYS 38 15.553 10.471 7.668 299 2HZ LYS 38 2HZ LYS 38 14.934 11.774 6.900 300 H GLY 39 H GLY 39 15.222 4.948 1.017 301 1HA GLY 39 1HA GLY 39 15.818 2.645 0.905 302 2HA GLY 39 2HA GLY 39 17.371 3.066 1.592 303 H ASP 40 H ASP 40 14.135 3.281 2.998 304 HA ASP 40 HA ASP 40 14.844 1.239 5.168 305 1HB ASP 40 1HB ASP 40 13.004 3.527 5.721 306 2HB ASP 40 2HB ASP 40 13.647 2.367 6.828 307 HD2 ASP 40 HD2 ASP 40 15.651 5.689 5.962 308 H LYS 41 H LYS 41 13.596 -0.324 5.675 309 HA LYS 41 HA LYS 41 11.038 -0.815 4.127 310 1HB LYS 41 2HB LYS 41 12.162 -2.646 6.303 311 2HB LYS 41 1HB LYS 41 10.868 -3.003 5.160 312 1HG LYS 41 1HG LYS 41 12.645 -2.725 3.270 313 2HG LYS 41 2HG LYS 41 13.863 -2.698 4.538 314 1HD LYS 41 1HD LYS 41 13.107 -4.988 5.328 315 2HD LYS 41 2HD LYS 41 11.831 -4.981 4.119 316 1HE LYS 41 1HE LYS 41 13.579 -6.359 3.228 317 2HE LYS 41 2HE LYS 41 13.567 -4.888 2.260 318 1HZ LYS 41 1HZ LYS 41 15.441 -5.466 4.496 319 2HZ LYS 41 2HZ LYS 41 15.443 -4.088 3.618 320 H VAL 42 H VAL 42 9.033 -0.365 5.044 321 HA VAL 42 HA VAL 42 8.685 0.827 7.589 322 HB VAL 42 HB VAL 42 6.819 -0.135 5.378 323 1HG1 VAL 42 1HG2 VAL 42 5.613 0.828 7.332 324 2HG1 VAL 42 2HG2 VAL 42 6.644 2.284 7.208 325 3HG1 VAL 42 3HG2 VAL 42 5.492 1.875 5.901 326 1HG2 VAL 42 2HG1 VAL 42 8.800 1.513 4.527 327 2HG2 VAL 42 3HG1 VAL 42 7.156 1.943 4.154 328 3HG2 VAL 42 1HG1 VAL 42 7.972 2.746 5.504 329 H GLN 43 H GLN 43 6.161 -0.654 7.578 330 HA GLN 43 HA GLN 43 5.629 -2.772 7.616 331 1HB GLN 43 1HB GLN 43 7.677 -3.680 9.559 332 2HB GLN 43 2HB GLN 43 6.173 -4.571 9.583 333 1HG GLN 43 1HG GLN 43 6.311 -5.032 7.217 334 2HG GLN 43 2HG GLN 43 7.603 -3.894 6.944 335 1HE2 GLN 43 1HE2 GLN 43 10.089 -6.415 7.435 336 2HE2 GLN 43 2HE2 GLN 43 9.545 -4.826 6.706 337 H LEU 44 H LEU 44 4.025 -4.108 8.373 338 HA LEU 44 HA LEU 44 2.129 -2.699 10.306 339 1HB LEU 44 2HB LEU 44 1.529 -3.294 7.345 340 2HB LEU 44 1HB LEU 44 0.270 -2.943 8.514 341 HG LEU 44 HG LEU 44 2.546 -0.945 8.014 342 1HD1 LEU 44 1HD1 LEU 44 1.561 -1.390 5.787 343 2HD1 LEU 44 2HD1 LEU 44 -0.077 -1.066 6.416 344 3HD1 LEU 44 3HD1 LEU 44 1.138 0.231 6.367 345 1HD2 LEU 44 2HD2 LEU 44 1.076 -0.612 10.062 346 2HD2 LEU 44 3HD2 LEU 44 0.900 0.698 8.874 347 3HD2 LEU 44 1HD2 LEU 44 -0.352 -0.566 9.013 348 H ILE 45 H ILE 45 1.524 -4.351 11.658 349 HA ILE 45 HA ILE 45 1.857 -7.163 10.833 350 HB ILE 45 HB ILE 45 2.422 -6.305 13.113 351 1HG1 ILE 45 1HG1 ILE 45 0.603 -8.781 13.116 352 2HG1 ILE 45 2HG1 ILE 45 2.232 -8.753 12.465 353 1HG2 ILE 45 1HG2 ILE 45 0.256 -5.018 13.499 354 2HG2 ILE 45 2HG2 ILE 45 -0.583 -6.569 13.716 355 3HG2 ILE 45 3HG2 ILE 45 0.716 -6.084 14.852 356 1HD1 ILE 45 2HD1 ILE 45 3.168 -8.139 14.736 357 2HD1 ILE 45 3HD1 ILE 45 1.524 -8.245 15.423 358 3HD1 ILE 45 1HD1 ILE 45 2.295 -9.689 14.731 359 H GLY 46 H GLY 46 0.332 -8.682 10.649 360 1HA GLY 46 1HA GLY 46 -1.538 -9.589 9.428 361 2HA GLY 46 2HA GLY 46 -2.479 -8.601 10.521 362 H PHE 47 H PHE 47 -0.530 -6.821 8.254 363 HA PHE 47 HA PHE 47 -2.739 -6.516 6.218 364 1HB PHE 47 2HB PHE 47 -2.798 -4.966 8.319 365 2HB PHE 47 1HB PHE 47 -1.348 -4.196 7.748 366 HD1 PHE 47 HD1 PHE 47 -1.367 -2.843 5.595 367 HD2 PHE 47 HD2 PHE 47 -4.989 -4.614 7.107 368 HE1 PHE 47 HE1 PHE 47 -2.665 -1.724 3.831 369 HE2 PHE 47 HE2 PHE 47 -6.261 -3.398 5.379 370 HZ PHE 47 HZ PHE 47 -5.093 -2.158 3.637 371 H GLY 48 H GLY 48 0.784 -5.794 6.865 372 1HA GLY 48 1HA GLY 48 1.385 -5.814 4.071 373 2HA GLY 48 2HA GLY 48 1.141 -4.138 4.488 374 H ASN 49 H ASN 49 3.363 -5.172 3.320 375 HA ASN 49 HA ASN 49 5.477 -4.232 5.309 376 1HB ASN 49 1HB ASN 49 6.009 -6.624 3.435 377 2HB ASN 49 2HB ASN 49 7.168 -5.814 4.456 378 1HD2 ASN 49 1HD2 ASN 49 6.607 -8.861 6.292 379 2HD2 ASN 49 2HD2 ASN 49 7.494 -8.150 4.853 380 H PHE 50 H PHE 50 5.746 -2.255 4.332 381 HA PHE 50 HA PHE 50 5.936 -2.024 1.318 382 1HB PHE 50 2HB PHE 50 6.491 0.133 3.376 383 2HB PHE 50 1HB PHE 50 6.695 0.407 1.698 384 HD1 PHE 50 HD1 PHE 50 4.363 -0.048 4.447 385 HD2 PHE 50 HD2 PHE 50 4.957 1.384 0.464 386 HE1 PHE 50 HE1 PHE 50 2.153 1.130 4.527 387 HE2 PHE 50 HE2 PHE 50 2.770 2.550 0.569 388 HZ PHE 50 HZ PHE 50 1.336 2.234 2.532 389 H GLU 51 H GLU 51 7.751 -1.549 0.247 390 HA GLU 51 HA GLU 51 10.122 -0.615 1.433 391 1HB GLU 51 1HB GLU 51 11.752 -2.575 1.133 392 2HB GLU 51 2HB GLU 51 10.529 -3.005 2.289 393 1HG GLU 51 1HG GLU 51 10.475 -3.902 -0.672 394 2HG GLU 51 2HG GLU 51 11.215 -4.825 0.620 395 HE1 GLU 51 HE2 GLU 51 8.224 -5.863 2.100 396 H VAL 52 H VAL 52 12.057 -0.316 0.018 397 HA VAL 52 HA VAL 52 11.033 0.296 -2.672 398 HB VAL 52 HB VAL 52 12.321 1.679 -0.503 399 1HG1 VAL 52 1HG2 VAL 52 14.462 1.078 -2.557 400 2HG1 VAL 52 2HG2 VAL 52 14.484 2.381 -1.311 401 3HG1 VAL 52 3HG2 VAL 52 14.429 0.651 -0.839 402 1HG2 VAL 52 1HG1 VAL 52 10.855 2.640 -2.105 403 2HG2 VAL 52 2HG1 VAL 52 12.347 3.563 -1.946 404 3HG2 VAL 52 3HG1 VAL 52 12.091 2.558 -3.386 405 NH1 ARG 53 NH2 ARG 53 10.754 -5.155 -9.834 406 NH2 ARG 53 NH1 ARG 53 11.445 -3.251 -10.869 407 H ARG 53 H ARG 53 12.397 -0.018 -4.530 408 HA ARG 53 HA ARG 53 14.274 -2.468 -4.352 409 1HB ARG 53 1HB ARG 53 11.907 -2.984 -5.284 410 2HB ARG 53 2HB ARG 53 12.318 -1.960 -6.643 411 1HG ARG 53 1HG ARG 53 14.388 -3.478 -7.067 412 2HG ARG 53 2HG ARG 53 13.772 -4.527 -5.801 413 1HD ARG 53 1HD ARG 53 13.044 -5.500 -7.868 414 2HD ARG 53 2HD ARG 53 11.593 -4.803 -7.138 415 1HH1 ARG 53 2HH2 ARG 53 10.830 -5.772 -9.019 416 2HH1 ARG 53 1HH2 ARG 53 10.152 -5.289 -10.654 417 1HH2 ARG 53 1HH1 ARG 53 12.045 -2.419 -10.844 418 2HH2 ARG 53 2HH1 ARG 53 10.794 -3.519 -11.616 419 H GLU 54 H GLU 54 16.153 -1.336 -4.452 420 HA GLU 54 HA GLU 54 16.612 0.921 -6.297 421 1HB GLU 54 1HB GLU 54 17.750 0.643 -4.081 422 2HB GLU 54 2HB GLU 54 18.743 -0.649 -4.754 423 1HG GLU 54 1HG GLU 54 19.706 0.968 -6.441 424 2HG GLU 54 2HG GLU 54 18.616 2.237 -5.893 425 HE1 GLU 54 HE2 GLU 54 20.360 3.014 -3.006 426 NH1 ARG 55 NH2 ARG 55 18.986 1.886 -14.596 427 NH2 ARG 55 NH1 ARG 55 18.022 1.287 -16.566 428 H ARG 55 H ARG 55 16.872 0.788 -8.351 429 HA ARG 55 HA ARG 55 17.236 -1.673 -9.904 430 1HB ARG 55 1HB ARG 55 15.891 0.309 -10.617 431 2HB ARG 55 2HB ARG 55 17.341 1.299 -10.671 432 1HG ARG 55 1HG ARG 55 18.226 -0.136 -12.574 433 2HG ARG 55 2HG ARG 55 16.706 -1.038 -12.571 434 1HD ARG 55 1HD ARG 55 15.424 1.030 -13.073 435 2HD ARG 55 2HD ARG 55 16.835 2.050 -12.845 436 1HH1 ARG 55 2HH2 ARG 55 18.905 1.940 -13.575 437 2HH1 ARG 55 1HH2 ARG 55 19.785 2.183 -15.166 438 1HH2 ARG 55 1HH1 ARG 55 17.208 0.890 -17.049 439 2HH2 ARG 55 2HH1 ARG 55 18.887 1.629 -16.998 440 H ALA 56 H ALA 56 18.921 -2.264 -11.222 441 HA ALA 56 HA ALA 56 21.692 -1.716 -10.146 442 1HB ALA 56 2HB ALA 56 21.044 -4.068 -10.534 443 2HB ALA 56 3HB ALA 56 20.774 -3.755 -12.268 444 3HB ALA 56 1HB ALA 56 22.408 -3.617 -11.576 445 H ALA 57 H ALA 57 22.091 0.367 -10.890 446 HA ALA 57 HA ALA 57 21.986 1.546 -13.317 447 1HB ALA 57 3HB ALA 57 23.054 2.608 -11.276 448 2HB ALA 57 1HB ALA 57 24.529 1.646 -11.528 449 3HB ALA 57 2HB ALA 57 24.065 2.892 -12.704 450 NH1 ARG 58 NH2 ARG 58 17.741 -1.975 -19.213 451 NH2 ARG 58 NH1 ARG 58 16.972 -2.719 -17.206 452 H ARG 58 H ARG 58 22.449 1.423 -15.238 453 HA ARG 58 HA ARG 58 24.091 -0.862 -16.090 454 1HB ARG 58 2HB ARG 58 22.307 0.770 -17.955 455 2HB ARG 58 1HB ARG 58 22.933 -0.852 -18.228 456 1HG ARG 58 1HG ARG 58 21.539 -1.589 -16.166 457 2HG ARG 58 2HG ARG 58 20.782 0.008 -16.227 458 1HD ARG 58 1HD ARG 58 19.979 -0.415 -18.564 459 2HD ARG 58 2HD ARG 58 20.769 -2.004 -18.580 460 1HH1 ARG 58 1HH2 ARG 58 16.822 -2.247 -19.580 461 2HH1 ARG 58 2HH2 ARG 58 18.514 -1.557 -19.741 462 1HH2 ARG 58 1HH1 ARG 58 17.156 -2.868 -16.208 463 2HH2 ARG 58 2HH1 ARG 58 16.106 -2.939 -17.711 464 H LYS 59 H LYS 59 24.795 -0.353 -18.653 465 HA LYS 59 HA LYS 59 26.230 2.176 -19.065 466 1HB LYS 59 1HB LYS 59 27.901 0.991 -17.535 467 2HB LYS 59 2HB LYS 59 28.097 -0.265 -18.754 468 1HG LYS 59 1HG LYS 59 28.868 1.489 -20.404 469 2HG LYS 59 2HG LYS 59 28.623 2.754 -19.202 470 1HD LYS 59 1HD LYS 59 30.388 1.679 -17.721 471 2HD LYS 59 2HD LYS 59 30.586 0.395 -18.906 472 1HE LYS 59 1HE LYS 59 32.414 1.922 -19.246 473 2HE LYS 59 2HE LYS 59 31.354 2.092 -20.642 474 1HZ LYS 59 1HZ LYS 59 30.456 4.107 -19.663 475 2HZ LYS 59 2HZ LYS 59 32.079 4.217 -19.821 476 H GLY 60 H GLY 60 25.461 2.435 -21.025 477 1HA GLY 60 1HA GLY 60 26.009 0.837 -23.390 478 2HA GLY 60 2HA GLY 60 24.473 0.229 -22.763 479 NH1 ARG 61 NH2 ARG 61 27.341 10.393 -25.515 480 NH2 ARG 61 NH1 ARG 61 25.402 11.432 -26.089 481 H ARG 61 H ARG 61 25.939 2.740 -24.513 482 HA ARG 61 HA ARG 61 24.286 4.758 -23.953 483 1HB ARG 61 1HB ARG 61 26.272 5.405 -24.744 484 2HB ARG 61 2HB ARG 61 25.870 4.925 -26.386 485 1HG ARG 61 1HG ARG 61 24.271 6.726 -26.629 486 2HG ARG 61 2HG ARG 61 24.185 7.011 -24.895 487 1HD ARG 61 1HD ARG 61 26.602 7.791 -24.894 488 2HD ARG 61 2HD ARG 61 26.661 7.566 -26.651 489 1HH1 ARG 61 2HH2 ARG 61 27.831 9.507 -25.351 490 2HH1 ARG 61 1HH2 ARG 61 27.734 11.338 -25.435 491 1HH2 ARG 61 1HH1 ARG 61 24.416 11.342 -26.360 492 2HH2 ARG 61 2HH1 ARG 61 25.928 12.305 -25.967 493 H ASN 62 H ASN 62 24.460 3.768 -26.864 494 HA ASN 62 HA ASN 62 21.853 4.557 -28.079 495 1HB ASN 62 1HB ASN 62 24.603 4.125 -28.986 496 2HB ASN 62 2HB ASN 62 23.609 3.043 -29.904 497 1HD2 ASN 62 2HD2 ASN 62 23.274 5.877 -32.093 498 2HD2 ASN 62 1HD2 ASN 62 23.901 4.175 -31.816 499 HA PRO 63 HA PRO 63 19.184 1.283 -28.798 500 1HB PRO 63 1HB PRO 63 20.498 -0.420 -30.978 501 2HB PRO 63 2HB PRO 63 18.768 -0.022 -30.798 502 1HG PRO 63 1HG PRO 63 20.262 1.543 -32.441 503 2HG PRO 63 2HG PRO 63 19.174 2.349 -31.277 504 1HD PRO 63 1HD PRO 63 22.182 1.903 -31.046 505 2HD PRO 63 2HD PRO 63 21.209 3.383 -30.717 506 H GLN 64 H GLN 64 22.153 -0.424 -28.626 507 HA GLN 64 HA GLN 64 21.199 -1.802 -26.181 508 1HB GLN 64 1HB GLN 64 22.991 -3.664 -26.573 509 2HB GLN 64 2HB GLN 64 21.319 -3.923 -26.991 510 1HG GLN 64 1HG GLN 64 21.806 -3.540 -29.430 511 2HG GLN 64 2HG GLN 64 23.486 -3.150 -29.053 512 1HE2 GLN 64 2HE2 GLN 64 24.467 -6.607 -28.792 513 2HE2 GLN 64 1HE2 GLN 64 24.935 -4.841 -28.618 514 H THR 65 H THR 65 24.371 -1.992 -27.789 515 HA THR 65 HA THR 65 25.256 0.497 -26.377 516 HB THR 65 HB THR 65 27.165 -0.530 -25.677 517 HG1 THR 65 HG1 THR 65 27.729 -2.680 -26.210 518 1HG2 THR 65 2HG2 THR 65 24.996 -1.322 -24.462 519 2HG2 THR 65 3HG2 THR 65 25.038 -2.780 -25.451 520 3HG2 THR 65 1HG2 THR 65 26.359 -2.502 -24.285 521 H GLY 66 H GLY 66 24.381 0.968 -28.909 522 1HA GLY 66 1HA GLY 66 26.464 0.870 -30.983 523 2HA GLY 66 2HA GLY 66 25.357 2.210 -30.834 524 H GLU 67 H GLU 67 26.388 2.744 -28.050 525 HA GLU 67 HA GLU 67 29.282 3.556 -28.172 526 1HB GLU 67 1HB GLU 67 27.646 5.203 -29.103 527 2HB GLU 67 2HB GLU 67 26.950 5.608 -28.437 528 1HG GLU 67 1HG GLU 67 29.902 6.113 -27.525 529 2HG GLU 67 2HG GLU 67 29.702 5.874 -29.253 530 HE1 GLU 67 HE2 GLU 67 28.128 7.182 -30.244 531 H GLU 68 H GLU 68 29.162 4.952 -25.697 532 HA GLU 68 HA GLU 68 27.250 3.555 -23.876 533 1HB GLU 68 1HB GLU 68 30.328 3.166 -23.330 534 2HB GLU 68 2HB GLU 68 29.065 2.772 -22.183 535 1HG GLU 68 1HG GLU 68 28.166 1.026 -23.837 536 2HG GLU 68 2HG GLU 68 29.593 1.312 -24.828 537 HE1 GLU 68 HE2 GLU 68 31.843 -0.167 -22.593 538 H MET 69 H MET 69 26.613 4.479 -22.353 539 HA MET 69 HA MET 69 28.176 6.472 -20.705 540 1HB MET 69 1HB MET 69 26.361 8.144 -20.605 541 2HB MET 69 2HB MET 69 27.041 7.975 -22.207 542 1HG MET 69 1HG MET 69 24.717 8.195 -22.609 543 2HG MET 69 2HG MET 69 25.026 6.463 -22.795 544 1HE MET 69 2HE MET 69 22.472 6.500 -22.868 545 2HE MET 69 1HE MET 69 22.905 5.002 -21.995 546 3HE MET 69 3HE MET 69 21.564 6.024 -21.406 547 H GLU 70 H GLU 70 27.729 6.302 -18.670 548 HA GLU 70 HA GLU 70 26.371 3.924 -17.638 549 1HB GLU 70 2HB GLU 70 27.059 4.495 -15.412 550 2HB GLU 70 1HB GLU 70 28.392 4.577 -16.564 551 1HG GLU 70 1HG GLU 70 28.194 7.131 -16.552 552 2HG GLU 70 2HG GLU 70 26.914 7.012 -15.349 553 HE1 GLU 70 HE2 GLU 70 28.981 6.213 -12.689 554 H ILE 71 H ILE 71 24.266 3.636 -17.266 555 HA ILE 71 HA ILE 71 22.385 5.907 -17.071 556 HB ILE 71 HB ILE 71 21.954 2.847 -17.240 557 1HG1 ILE 71 1HG1 ILE 71 21.737 5.021 -19.431 558 2HG1 ILE 71 2HG1 ILE 71 23.112 3.951 -19.299 559 1HG2 ILE 71 2HG2 ILE 71 20.008 4.061 -16.254 560 2HG2 ILE 71 3HG2 ILE 71 19.980 5.173 -17.654 561 3HG2 ILE 71 1HG2 ILE 71 19.630 3.429 -17.868 562 1HD1 ILE 71 3HD1 ILE 71 20.285 2.975 -19.981 563 2HD1 ILE 71 1HD1 ILE 71 21.642 3.206 -21.092 564 3HD1 ILE 71 2HD1 ILE 71 21.751 1.955 -19.839 565 HA PRO 72 HA PRO 72 22.910 5.318 -12.493 566 1HB PRO 72 1HB PRO 72 21.324 7.405 -11.544 567 2HB PRO 72 2HB PRO 72 22.911 7.614 -12.296 568 1HG PRO 72 1HG PRO 72 20.170 7.883 -13.632 569 2HG PRO 72 2HG PRO 72 21.533 9.028 -13.698 570 1HD PRO 72 1HD PRO 72 21.070 7.197 -15.711 571 2HD PRO 72 2HD PRO 72 22.744 7.649 -15.261 572 H ALA 73 H ALA 73 21.782 4.715 -10.623 573 HA ALA 73 HA ALA 73 19.626 2.753 -10.957 574 1HB ALA 73 1HB ALA 73 21.297 2.700 -8.997 575 2HB ALA 73 2HB ALA 73 20.515 4.174 -8.322 576 3HB ALA 73 3HB ALA 73 19.617 2.663 -8.431 577 H SER 74 H SER 74 17.735 2.704 -9.688 578 HA SER 74 HA SER 74 16.855 5.039 -8.351 579 1HB SER 74 1HB SER 74 14.998 4.290 -10.773 580 2HB SER 74 2HB SER 74 14.442 5.325 -9.458 581 HG SER 74 HG SER 74 16.139 6.752 -9.929 582 H LYS 75 H LYS 75 15.520 4.759 -6.761 583 HA LYS 75 HA LYS 75 14.801 2.007 -5.878 584 1HB LYS 75 2HB LYS 75 13.740 4.187 -4.170 585 2HB LYS 75 1HB LYS 75 14.530 2.687 -3.816 586 1HG LYS 75 1HG LYS 75 16.773 3.713 -4.311 587 2HG LYS 75 2HG LYS 75 15.974 5.224 -4.757 588 1HD LYS 75 1HD LYS 75 15.008 5.383 -2.383 589 2HD LYS 75 2HD LYS 75 15.914 3.935 -1.968 590 1HE LYS 75 1HE LYS 75 17.205 5.780 -1.158 591 2HE LYS 75 2HE LYS 75 18.094 5.125 -2.532 592 1HZ LYS 75 1HZ LYS 75 17.195 6.917 -3.896 593 2HZ LYS 75 2HZ LYS 75 18.020 7.507 -2.614 594 H VAL 76 H VAL 76 12.688 0.931 -6.274 595 HA VAL 76 HA VAL 76 10.533 2.557 -7.309 596 HB VAL 76 HB VAL 76 12.101 0.098 -7.737 597 1HG1 VAL 76 3HG2 VAL 76 9.171 -0.313 -7.843 598 2HG1 VAL 76 1HG2 VAL 76 10.496 -1.369 -8.549 599 3HG1 VAL 76 2HG2 VAL 76 10.380 -1.127 -6.802 600 1HG2 VAL 76 2HG1 VAL 76 11.940 1.932 -9.339 601 2HG2 VAL 76 3HG1 VAL 76 11.476 0.352 -10.007 602 3HG2 VAL 76 1HG1 VAL 76 10.201 1.546 -9.575 603 HA PRO 77 HA PRO 77 8.938 1.513 -3.104 604 1HB PRO 77 1HB PRO 77 6.879 3.392 -2.977 605 2HB PRO 77 2HB PRO 77 8.587 3.848 -2.926 606 1HG PRO 77 1HG PRO 77 6.709 3.939 -5.335 607 2HG PRO 77 2HG PRO 77 7.876 5.166 -4.805 608 1HD PRO 77 1HD PRO 77 8.411 3.167 -6.831 609 2HD PRO 77 2HD PRO 77 9.700 3.975 -5.913 610 H ALA 78 H ALA 78 7.828 0.076 -2.457 611 HA ALA 78 HA ALA 78 5.372 -1.030 -3.924 612 1HB ALA 78 2HB ALA 78 7.647 -2.108 -4.439 613 2HB ALA 78 3HB ALA 78 7.810 -2.534 -2.723 614 3HB ALA 78 1HB ALA 78 6.497 -3.240 -3.687 615 H PHE 79 H PHE 79 4.316 -2.660 -2.700 616 HA PHE 79 HA PHE 79 4.090 -2.368 0.359 617 1HB PHE 79 2HB PHE 79 2.749 -0.696 -0.023 618 2HB PHE 79 1HB PHE 79 1.975 -1.481 -1.424 619 HD1 PHE 79 HD2 PHE 79 0.194 -3.207 -1.133 620 HD2 PHE 79 HD1 PHE 79 1.971 -1.295 2.285 621 HE1 PHE 79 HE2 PHE 79 -1.550 -4.153 0.308 622 HE2 PHE 79 HE1 PHE 79 0.173 -2.191 3.703 623 HZ PHE 79 HZ PHE 79 -1.545 -3.688 2.724 624 H LYS 80 H LYS 80 3.924 -4.327 0.883 625 HA LYS 80 HA LYS 80 2.946 -6.862 -0.701 626 1HB LYS 80 2HB LYS 80 4.498 -6.585 1.900 627 2HB LYS 80 1HB LYS 80 3.731 -8.077 1.378 628 1HG LYS 80 1HG LYS 80 5.070 -8.087 -0.734 629 2HG LYS 80 2HG LYS 80 5.874 -6.586 -0.272 630 1HD LYS 80 1HD LYS 80 6.974 -7.666 1.663 631 2HD LYS 80 2HD LYS 80 5.988 -9.110 1.486 632 1HE LYS 80 1HE LYS 80 8.152 -9.662 0.628 633 2HE LYS 80 2HE LYS 80 7.062 -9.596 -0.756 634 1HZ LYS 80 1HZ LYS 80 8.924 -7.429 0.062 635 2HZ LYS 80 2HZ LYS 80 7.927 -7.367 -1.232 636 HA PRO 81 HA PRO 81 -0.798 -6.350 1.856 637 1HB PRO 81 1HB PRO 81 -2.202 -8.577 1.025 638 2HB PRO 81 2HB PRO 81 -1.819 -7.262 -0.094 639 1HG PRO 81 1HG PRO 81 -0.310 -9.909 0.265 640 2HG PRO 81 2HG PRO 81 -0.935 -9.215 -1.252 641 1HD PRO 81 1HD PRO 81 1.700 -8.854 -0.372 642 2HD PRO 81 2HD PRO 81 0.852 -7.640 -1.383 643 H GLY 82 H GLY 82 1.565 -7.318 3.174 644 1HA GLY 82 1HA GLY 82 2.568 -8.933 4.673 645 2HA GLY 82 2HA GLY 82 1.065 -8.542 5.490 646 H LYS 83 H LYS 83 0.687 -10.357 2.634 647 HA LYS 83 HA LYS 83 -0.166 -12.581 2.212 648 1HB LYS 83 2HB LYS 83 1.543 -13.205 4.612 649 2HB LYS 83 1HB LYS 83 0.155 -14.216 4.532 650 1HG LYS 83 1HG LYS 83 1.936 -15.370 3.384 651 2HG LYS 83 2HG LYS 83 0.795 -14.882 2.138 652 1HD LYS 83 1HD LYS 83 2.324 -12.867 1.605 653 2HD LYS 83 2HD LYS 83 3.427 -13.424 2.852 654 1HE LYS 83 1HE LYS 83 4.355 -14.156 0.764 655 2HE LYS 83 2HE LYS 83 3.762 -15.612 1.560 656 1HZ LYS 83 1HZ LYS 83 1.779 -15.492 0.154 657 2HZ LYS 83 2HZ LYS 83 2.290 -14.103 -0.540 658 H ALA 84 H ALA 84 -0.706 -11.520 5.322 659 HA ALA 84 HA ALA 84 -3.158 -12.729 6.237 660 1HB ALA 84 2HB ALA 84 -1.423 -11.503 7.576 661 2HB ALA 84 3HB ALA 84 -1.782 -9.991 6.702 662 3HB ALA 84 1HB ALA 84 -3.016 -10.698 7.779 663 H LEU 85 H LEU 85 -2.702 -9.511 4.534 664 HA LEU 85 HA LEU 85 -5.566 -8.934 4.381 665 1HB LEU 85 2HB LEU 85 -3.929 -7.078 4.240 666 2HB LEU 85 1HB LEU 85 -3.185 -7.814 2.830 667 HG LEU 85 HG LEU 85 -5.489 -7.731 1.773 668 1HD1 LEU 85 3HD1 LEU 85 -6.870 -7.085 3.745 669 2HD1 LEU 85 1HD1 LEU 85 -5.972 -5.553 3.870 670 3HD1 LEU 85 2HD1 LEU 85 -7.023 -5.867 2.461 671 1HD2 LEU 85 3HD2 LEU 85 -3.519 -6.254 1.072 672 2HD2 LEU 85 1HD2 LEU 85 -5.040 -5.376 0.891 673 3HD2 LEU 85 2HD2 LEU 85 -3.981 -5.042 2.286 674 H LYS 86 H LYS 86 -3.226 -10.612 2.308 675 HA LYS 86 HA LYS 86 -5.016 -11.144 0.063 676 1HB LYS 86 1HB LYS 86 -2.415 -11.476 0.164 677 2HB LYS 86 2HB LYS 86 -2.773 -13.091 0.758 678 1HG LYS 86 1HG LYS 86 -4.122 -13.552 -1.326 679 2HG LYS 86 2HG LYS 86 -3.860 -11.896 -1.873 680 1HD LYS 86 1HD LYS 86 -1.358 -12.312 -1.909 681 2HD LYS 86 2HD LYS 86 -1.620 -13.984 -1.439 682 1HE LYS 86 1HE LYS 86 -2.724 -12.676 -4.029 683 2HE LYS 86 2HE LYS 86 -1.227 -13.599 -3.931 684 1HZ LYS 86 1HZ LYS 86 -3.906 -14.696 -3.294 685 2HZ LYS 86 2HZ LYS 86 -2.504 -15.534 -3.234 686 H ASP 87 H ASP 87 -5.071 -12.562 3.256 687 HA ASP 87 HA ASP 87 -7.029 -14.680 2.427 688 1HB ASP 87 1HB ASP 87 -5.057 -14.373 4.519 689 2HB ASP 87 2HB ASP 87 -6.527 -14.032 5.343 690 HD2 ASP 87 HD2 ASP 87 -7.635 -17.339 5.282 691 H ALA 88 H ALA 88 -7.048 -11.517 4.146 692 HA ALA 88 HA ALA 88 -9.851 -11.323 4.915 693 1HB ALA 88 1HB ALA 88 -8.105 -9.450 5.376 694 2HB ALA 88 2HB ALA 88 -8.105 -9.060 3.649 695 3HB ALA 88 3HB ALA 88 -9.567 -8.808 4.570 696 H VAL 89 H VAL 89 -8.243 -10.705 1.743 697 HA VAL 89 HA VAL 89 -10.586 -9.433 0.554 698 HB VAL 89 HB VAL 89 -8.027 -8.760 0.931 699 1HG1 VAL 89 2HG2 VAL 89 -7.207 -11.060 0.003 700 2HG1 VAL 89 3HG2 VAL 89 -7.513 -10.376 -1.610 701 3HG1 VAL 89 1HG2 VAL 89 -6.414 -9.555 -0.461 702 1HG2 VAL 89 3HG1 VAL 89 -9.415 -7.451 -0.323 703 2HG2 VAL 89 1HG1 VAL 89 -7.774 -7.576 -0.992 704 3HG2 VAL 89 2HG1 VAL 89 -9.122 -8.461 -1.813 705 H LYS 90 H LYS 90 -9.283 -12.625 0.508 706 HA LYS 90 HA LYS 90 -9.800 -13.346 -2.237 707 1HB LYS 90 1HB LYS 90 -9.023 -15.442 -1.719 708 2HB LYS 90 2HB LYS 90 -8.150 -14.361 -0.669 709 1HG LYS 90 1HG LYS 90 -9.679 -15.043 1.260 710 2HG LYS 90 2HG LYS 90 -10.485 -16.187 0.194 711 1HD LYS 90 1HD LYS 90 -8.316 -17.426 -0.175 712 2HD LYS 90 2HD LYS 90 -7.464 -16.245 0.802 713 1HE LYS 90 1HE LYS 90 -7.797 -18.142 2.226 714 2HE LYS 90 2HE LYS 90 -8.882 -16.893 2.828 715 1HZ LYS 90 1HZ LYS 90 -9.928 -19.065 2.696 716 2HZ LYS 90 2HZ LYS 90 -9.648 -19.180 1.089 717 1H MET 1 1H MET 91 7.237 3.447 11.022 718 2H MET 1 2H MET 91 6.036 2.383 10.517 719 HA MET 1 HA MET 91 7.459 1.295 9.396 720 1HB MET 1 1HB MET 91 9.524 3.059 10.793 721 2HB MET 1 2HB MET 91 9.928 1.868 9.550 722 1HG MET 1 1HG MET 91 9.959 4.035 8.574 723 2HG MET 1 2HG MET 91 8.589 3.176 7.883 724 1HE MET 1 2HE MET 91 6.763 4.574 7.350 725 2HE MET 1 1HE MET 91 5.937 3.771 8.713 726 3HE MET 1 3HE MET 91 5.766 5.532 8.478 727 H ASN 2 H ASN 92 6.508 -0.135 10.828 728 HA ASN 2 HA ASN 92 7.476 -2.526 11.187 729 1HB ASN 2 1HB ASN 92 8.202 -3.306 13.238 730 2HB ASN 2 2HB ASN 92 9.277 -2.114 12.563 731 1HD2 ASN 2 1HD2 ASN 92 9.417 -0.481 15.740 732 2HD2 ASN 2 2HD2 ASN 92 10.207 -0.904 14.134 733 H LYS 3 H LYS 93 5.693 -0.198 12.763 734 HA LYS 3 HA LYS 93 3.227 -0.279 12.457 735 1HB LYS 3 1HB LYS 93 3.099 -2.808 12.271 736 2HB LYS 3 2HB LYS 93 3.289 -2.970 13.994 737 1HG LYS 3 1HG LYS 93 1.007 -1.225 12.812 738 2HG LYS 3 2HG LYS 93 0.869 -2.964 12.719 739 1HD LYS 3 1HD LYS 93 1.010 -3.195 15.200 740 2HD LYS 3 2HD LYS 93 1.234 -1.458 15.386 741 1HE LYS 3 1HE LYS 93 -1.040 -1.040 14.320 742 2HE LYS 3 2HE LYS 93 -1.278 -2.787 14.164 743 1HZ LYS 3 1HZ LYS 93 -2.317 -1.900 16.138 744 2HZ LYS 3 2HZ LYS 93 -0.907 -1.295 16.703 745 H THR 4 H THR 94 5.342 -0.943 15.322 746 HA THR 4 HA THR 94 3.721 0.766 17.002 747 HB THR 4 HB THR 94 6.405 -0.740 17.259 748 HG1 THR 4 HG1 THR 94 4.590 -2.140 16.979 749 1HG2 THR 4 3HG2 THR 94 4.484 0.525 19.245 750 2HG2 THR 4 1HG2 THR 94 5.907 -0.532 19.683 751 3HG2 THR 4 2HG2 THR 94 6.162 1.050 18.844 752 H GLU 5 H GLU 95 6.640 0.903 14.866 753 HA GLU 5 HA GLU 95 7.671 3.469 15.977 754 1HB GLU 5 1HB GLU 95 9.281 1.877 15.183 755 2HB GLU 5 2HB GLU 95 8.299 1.404 13.804 756 1HG GLU 5 1HG GLU 95 10.010 2.448 12.888 757 2HG GLU 5 2HG GLU 95 8.635 3.532 12.723 758 HE1 GLU 5 HE2 GLU 95 11.588 2.956 14.257 759 H LEU 6 H LEU 96 5.116 2.319 14.142 760 HA LEU 6 HA LEU 96 4.565 4.556 12.225 761 1HB LEU 6 2HB LEU 96 3.675 1.779 12.777 762 2HB LEU 6 1HB LEU 96 2.286 2.745 13.059 763 HG LEU 6 HG LEU 96 3.584 3.453 10.486 764 1HD1 LEU 6 2HD1 LEU 96 4.513 1.196 10.553 765 2HD1 LEU 6 3HD1 LEU 96 2.848 0.571 10.571 766 3HD1 LEU 6 1HD1 LEU 96 3.427 1.522 9.185 767 1HD2 LEU 6 1HD2 LEU 96 0.832 2.340 11.117 768 2HD2 LEU 6 2HD2 LEU 96 1.305 4.053 10.934 769 3HD2 LEU 6 3HD2 LEU 96 1.352 2.963 9.534 770 H ILE 7 H ILE 97 3.354 3.293 15.347 771 HA ILE 7 HA ILE 97 1.437 5.342 16.051 772 HB ILE 7 HB ILE 97 3.111 3.619 17.977 773 1HG1 ILE 7 1HG1 ILE 97 0.380 2.919 16.753 774 2HG1 ILE 7 2HG1 ILE 97 1.859 2.297 16.142 775 1HG2 ILE 7 2HG2 ILE 97 1.861 5.463 19.156 776 2HG2 ILE 7 3HG2 ILE 97 0.359 4.845 18.486 777 3HG2 ILE 7 1HG2 ILE 97 1.288 3.854 19.619 778 1HD1 ILE 7 3HD1 ILE 97 2.399 1.300 18.453 779 2HD1 ILE 7 1HD1 ILE 97 0.702 1.544 18.811 780 3HD1 ILE 7 2HD1 ILE 97 1.163 0.529 17.416 781 H ASN 8 H ASN 98 4.862 5.011 16.990 782 HA ASN 8 HA ASN 98 4.969 7.620 18.365 783 1HB ASN 8 1HB ASN 98 7.331 5.950 17.238 784 2HB ASN 8 2HB ASN 98 7.516 7.357 18.262 785 1HD2 ASN 8 2HD2 ASN 98 6.958 3.846 20.145 786 2HD2 ASN 8 1HD2 ASN 98 7.255 4.014 18.341 787 H ALA 9 H ALA 99 5.106 6.932 14.948 788 HA ALA 9 HA ALA 99 6.310 9.563 14.143 789 1HB ALA 9 2HB ALA 99 5.959 7.511 12.468 790 2HB ALA 9 3HB ALA 99 4.219 7.805 12.596 791 3HB ALA 9 1HB ALA 99 5.205 9.057 11.904 792 H VAL 10 H VAL 100 2.999 8.224 14.619 793 HA VAL 10 HA VAL 100 1.681 10.541 13.685 794 HB VAL 10 HB VAL 100 0.114 8.695 15.407 795 1HG1 VAL 10 3HG2 VAL 100 -0.706 10.664 13.884 796 2HG1 VAL 10 1HG2 VAL 100 -0.464 9.483 12.567 797 3HG1 VAL 10 2HG2 VAL 100 -1.585 9.093 13.893 798 1HG2 VAL 10 1HG1 VAL 100 1.527 7.866 12.840 799 2HG2 VAL 10 2HG1 VAL 100 1.474 7.113 14.464 800 3HG2 VAL 10 3HG1 VAL 100 0.017 7.042 13.417 801 H ALA 11 H ALA 101 2.086 9.251 16.730 802 HA ALA 11 HA ALA 101 1.018 11.518 18.006 803 1HB ALA 11 2HB ALA 101 1.100 9.281 19.166 804 2HB ALA 11 3HB ALA 101 2.878 9.355 19.241 805 3HB ALA 11 1HB ALA 101 1.883 10.477 20.224 806 H GLU 12 H GLU 102 4.231 11.108 16.799 807 HA GLU 12 HA GLU 102 5.307 13.471 18.305 808 1HB GLU 12 1HB GLU 102 6.828 11.589 17.635 809 2HB GLU 12 2HB GLU 102 6.528 11.930 15.931 810 1HG GLU 12 1HG GLU 102 7.592 14.229 16.244 811 2HG GLU 12 2HG GLU 102 7.862 13.870 17.948 812 HE1 GLU 12 HE2 GLU 102 9.179 12.233 18.465 813 H THR 13 H THR 103 4.250 12.812 14.895 814 HA THR 13 HA THR 103 4.450 15.647 14.191 815 HB THR 13 HB THR 103 3.191 15.038 12.050 816 HG1 THR 13 HG1 THR 103 1.793 13.663 13.140 817 1HG2 THR 13 1HG2 THR 103 5.262 12.849 12.629 818 2HG2 THR 13 2HG2 THR 103 4.539 13.250 11.060 819 3HG2 THR 13 3HG2 THR 103 5.580 14.439 11.881 820 H SER 14 H SER 104 2.140 14.340 15.835 821 HA SER 14 HA SER 104 0.082 16.560 15.163 822 1HB SER 14 1HB SER 104 -0.627 14.332 14.173 823 2HB SER 14 2HB SER 104 -0.728 13.658 15.796 824 HG SER 14 HG SER 104 -2.703 14.425 15.034 825 H GLY 15 H GLY 105 1.447 14.647 17.845 826 1HA GLY 15 1HA GLY 105 1.165 14.871 20.189 827 2HA GLY 15 2HA GLY 105 0.561 16.505 19.918 828 H LEU 16 H LEU 106 -0.650 13.313 19.046 829 HA LEU 16 HA LEU 106 -3.290 13.636 20.474 830 1HB LEU 16 1HB LEU 106 -4.109 11.798 19.187 831 2HB LEU 16 2HB LEU 106 -3.761 13.273 18.311 832 HG LEU 16 HG LEU 106 -1.847 12.473 17.357 833 1HD1 LEU 16 2HD1 LEU 106 -0.872 11.142 19.268 834 2HD1 LEU 16 3HD1 LEU 106 -2.072 9.874 18.853 835 3HD1 LEU 16 1HD1 LEU 106 -0.743 10.346 17.700 836 1HD2 LEU 16 1HD2 LEU 106 -3.332 12.024 15.853 837 2HD2 LEU 16 2HD2 LEU 106 -1.861 11.024 15.812 838 3HD2 LEU 16 3HD2 LEU 106 -3.347 10.312 16.400 839 H SER 17 H SER 107 -2.690 10.731 20.470 840 HA SER 17 HA SER 107 -1.113 10.439 23.074 841 1HB SER 17 1HB SER 107 -3.733 8.909 22.750 842 2HB SER 17 2HB SER 107 -2.603 8.832 24.079 843 HG SER 17 HG SER 107 -4.326 10.203 24.538 844 H LYS 18 H LYS 108 -0.283 8.312 23.397 845 HA LYS 18 HA LYS 108 0.708 6.934 20.911 846 1HB LYS 18 1HB LYS 108 2.060 7.154 23.095 847 2HB LYS 18 2HB LYS 108 1.016 5.932 23.812 848 1HG LYS 18 1HG LYS 108 1.738 4.278 22.056 849 2HG LYS 18 2HG LYS 108 2.653 5.540 21.221 850 1HD LYS 18 1HD LYS 108 4.173 5.822 23.165 851 2HD LYS 18 2HD LYS 108 3.283 4.590 24.073 852 1HE LYS 18 1HE LYS 108 3.880 2.851 22.326 853 2HE LYS 18 2HE LYS 108 4.720 4.078 21.370 854 1HZ LYS 18 1HZ LYS 108 6.227 2.805 22.736 855 2HZ LYS 18 2HZ LYS 108 5.451 3.218 24.114 856 H LYS 19 H LYS 109 -1.657 6.185 23.439 857 HA LYS 19 HA LYS 109 -2.840 3.797 22.183 858 1HB LYS 19 2HB LYS 109 -3.198 4.519 24.598 859 2HB LYS 19 1HB LYS 109 -4.222 5.843 24.033 860 1HG LYS 19 1HG LYS 109 -5.770 4.054 22.967 861 2HG LYS 19 2HG LYS 109 -4.701 2.823 23.613 862 1HD LYS 19 1HD LYS 109 -6.466 2.869 25.128 863 2HD LYS 19 2HD LYS 109 -5.213 3.723 25.996 864 1HE LYS 19 1HE LYS 109 -7.518 5.106 24.428 865 2HE LYS 19 2HE LYS 109 -7.626 4.657 26.125 866 1HZ LYS 19 1HZ LYS 109 -5.638 6.551 25.020 867 2HZ LYS 19 2HZ LYS 109 -5.743 6.111 26.591 868 H ASP 20 H ASP 110 -3.533 7.360 21.706 869 HA ASP 20 HA ASP 110 -5.817 6.805 19.827 870 1HB ASP 20 1HB ASP 110 -4.287 9.382 20.496 871 2HB ASP 20 2HB ASP 110 -5.381 9.335 19.139 872 HD1 ASP 20 HD2 ASP 110 -8.332 9.136 20.916 873 H ALA 21 H ALA 111 -2.354 7.199 19.406 874 HA ALA 21 HA ALA 111 -2.429 7.329 16.434 875 1HB ALA 21 1HB ALA 111 -0.154 7.015 18.481 876 2HB ALA 21 2HB ALA 111 0.096 6.950 16.711 877 3HB ALA 21 3HB ALA 111 -0.571 8.370 17.460 878 H THR 22 H THR 112 -1.892 4.645 18.813 879 HA THR 22 HA THR 112 -1.579 2.470 16.966 880 HB THR 22 HB THR 112 -3.153 2.264 19.616 881 HG1 THR 22 HG1 THR 112 -1.324 3.496 19.996 882 1HG2 THR 22 2HG2 THR 112 -1.150 0.445 18.147 883 2HG2 THR 22 3HG2 THR 112 -1.798 0.125 19.780 884 3HG2 THR 22 1HG2 THR 112 -2.895 0.157 18.353 885 H LYS 23 H LYS 113 -4.500 3.780 18.332 886 HA LYS 23 HA LYS 113 -6.483 2.206 16.846 887 1HB LYS 23 2HB LYS 113 -6.482 5.127 17.955 888 2HB LYS 23 1HB LYS 113 -7.911 4.456 17.247 889 1HG LYS 23 1HG LYS 113 -8.056 2.656 19.010 890 2HG LYS 23 2HG LYS 113 -6.585 3.263 19.769 891 1HD LYS 23 1HD LYS 113 -7.709 5.504 20.162 892 2HD LYS 23 2HD LYS 113 -9.184 4.897 19.406 893 1HE LYS 23 1HE LYS 113 -9.385 3.118 21.205 894 2HE LYS 23 2HE LYS 113 -7.895 3.706 21.959 895 1HZ LYS 23 1HZ LYS 113 -9.808 4.636 23.023 896 2HZ LYS 23 2HZ LYS 113 -8.953 5.837 22.316 897 H ALA 24 H ALA 114 -5.322 5.441 16.220 898 HA ALA 24 HA ALA 114 -6.714 6.004 13.814 899 1HB ALA 24 2HB ALA 114 -5.649 7.640 15.176 900 2HB ALA 24 3HB ALA 114 -4.017 6.992 14.781 901 3HB ALA 24 1HB ALA 114 -5.025 7.768 13.504 902 H VAL 25 H VAL 115 -3.582 4.396 14.087 903 HA VAL 25 HA VAL 115 -3.053 3.924 11.147 904 HB VAL 25 HB VAL 115 -2.292 2.757 13.998 905 1HG1 VAL 25 2HG2 VAL 115 -1.379 1.450 11.372 906 2HG1 VAL 25 3HG2 VAL 115 -0.645 1.144 12.989 907 3HG1 VAL 25 1HG2 VAL 115 -2.314 0.708 12.673 908 1HG2 VAL 25 3HG1 VAL 115 -0.621 4.179 11.872 909 2HG2 VAL 25 1HG1 VAL 115 -1.141 4.818 13.434 910 3HG2 VAL 25 2HG1 VAL 115 0.033 3.495 13.403 911 H ASP 26 H ASP 116 -4.410 1.698 13.704 912 HA ASP 26 HA ASP 116 -5.533 -0.107 11.654 913 1HB ASP 26 1HB ASP 116 -6.944 -1.182 13.244 914 2HB ASP 26 2HB ASP 116 -5.274 -1.027 13.784 915 HD1 ASP 26 HD2 ASP 116 -8.264 0.853 15.787 916 H ALA 27 H ALA 117 -6.819 2.735 12.929 917 HA ALA 27 HA ALA 117 -9.442 2.771 11.681 918 1HB ALA 27 2HB ALA 117 -8.279 4.454 13.529 919 2HB ALA 27 3HB ALA 117 -7.924 5.361 12.072 920 3HB ALA 27 1HB ALA 117 -9.588 4.984 12.536 921 H VAL 28 H VAL 118 -6.397 3.695 10.312 922 HA VAL 28 HA VAL 118 -7.508 4.475 7.645 923 HB VAL 28 HB VAL 118 -4.609 3.417 8.138 924 1HG1 VAL 28 1HG2 VAL 118 -6.090 4.503 5.810 925 2HG1 VAL 28 2HG2 VAL 118 -4.556 5.326 6.097 926 3HG1 VAL 28 3HG2 VAL 118 -4.559 3.558 5.941 927 1HG2 VAL 28 3HG1 VAL 118 -5.515 6.244 8.478 928 2HG2 VAL 28 1HG1 VAL 118 -4.610 5.124 9.582 929 3HG2 VAL 28 2HG1 VAL 118 -3.818 5.708 8.113 930 H PHE 29 H PHE 119 -5.591 1.875 8.786 931 HA PHE 29 HA PHE 119 -5.924 0.013 6.523 932 1HB PHE 29 2HB PHE 119 -4.574 -0.448 9.239 933 2HB PHE 29 1HB PHE 119 -4.290 -1.432 7.832 934 HD1 PHE 29 HD2 PHE 119 -3.665 0.210 5.556 935 HD2 PHE 29 HD1 PHE 119 -2.753 0.956 9.684 936 HE1 PHE 29 HE2 PHE 119 -1.903 1.789 4.888 937 HE2 PHE 29 HE1 PHE 119 -1.055 2.592 9.011 938 HZ PHE 29 HZ PHE 119 -0.623 3.008 6.625 939 H ASP 30 H ASP 120 -8.165 0.470 8.962 940 HA ASP 30 HA ASP 120 -9.234 -2.340 8.520 941 1HB ASP 30 1HB ASP 120 -9.434 -1.158 10.831 942 2HB ASP 30 2HB ASP 120 -10.651 -0.124 10.135 943 HD1 ASP 30 HD2 ASP 120 -9.761 -3.400 10.596 944 H SER 31 H SER 121 -10.053 0.948 7.912 945 HA SER 31 HA SER 121 -12.478 0.486 6.212 946 1HB SER 31 2HB SER 121 -10.679 2.976 6.366 947 2HB SER 31 1HB SER 121 -12.197 2.871 5.447 948 HG SER 31 HG SER 121 -11.888 2.407 8.229 949 H ILE 32 H ILE 122 -8.885 0.655 5.282 950 HA ILE 32 HA ILE 122 -9.244 0.379 2.511 951 HB ILE 32 HB ILE 122 -6.938 -0.534 4.195 952 1HG1 ILE 32 1HG1 ILE 122 -7.742 2.161 3.047 953 2HG1 ILE 32 2HG1 ILE 122 -7.614 1.695 4.717 954 1HG2 ILE 32 2HG2 ILE 122 -7.347 0.122 1.181 955 2HG2 ILE 32 3HG2 ILE 122 -5.752 -0.078 1.904 956 3HG2 ILE 32 1HG2 ILE 122 -6.931 -1.423 1.858 957 1HD1 ILE 32 1HD1 ILE 122 -5.101 1.771 3.107 958 2HD1 ILE 32 2HD1 ILE 122 -5.809 3.147 4.015 959 3HD1 ILE 32 3HD1 ILE 122 -5.372 1.646 4.887 960 H THR 33 H THR 123 -8.522 -2.142 4.890 961 HA THR 33 HA THR 123 -8.875 -4.348 2.971 962 HB THR 33 HB THR 123 -7.667 -4.864 4.949 963 HG1 THR 33 HG1 THR 123 -10.177 -6.031 5.412 964 1HG2 THR 33 2HG2 THR 123 -8.554 -3.024 6.431 965 2HG2 THR 33 3HG2 THR 123 -9.952 -4.005 6.813 966 3HG2 THR 33 1HG2 THR 123 -8.286 -4.521 7.300 967 H GLU 34 H GLU 124 -11.282 -2.642 4.887 968 HA GLU 34 HA GLU 124 -13.549 -4.424 4.026 969 1HB GLU 34 1HB GLU 124 -13.536 -1.559 5.204 970 2HB GLU 34 2HB GLU 124 -15.011 -2.407 4.760 971 1HG GLU 34 1HG GLU 124 -14.602 -4.196 6.439 972 2HG GLU 34 2HG GLU 124 -13.046 -3.503 6.871 973 HE2 GLU 34 HE2 GLU 124 -16.381 -2.151 8.530 974 H ALA 35 H ALA 125 -11.934 -1.529 2.739 975 HA ALA 35 HA ALA 125 -13.747 -1.193 0.457 976 1HB ALA 35 2HB ALA 125 -11.745 0.636 1.139 977 2HB ALA 35 3HB ALA 125 -10.644 -0.509 0.455 978 3HB ALA 35 1HB ALA 125 -11.792 0.239 -0.582 979 H LEU 36 H LEU 126 -10.551 -2.797 0.681 980 HA LEU 36 HA LEU 126 -10.448 -3.911 -2.005 981 1HB LEU 36 2HB LEU 126 -9.019 -4.910 0.396 982 2HB LEU 36 1HB LEU 126 -8.514 -4.979 -1.277 983 HG LEU 36 HG LEU 126 -8.395 -2.541 0.520 984 1HD1 LEU 36 3HD2 LEU 126 -6.360 -3.789 0.174 985 2HD1 LEU 36 1HD2 LEU 126 -6.445 -3.420 -1.607 986 3HD1 LEU 36 2HD2 LEU 126 -6.270 -2.106 -0.399 987 1HD2 LEU 36 2HD1 LEU 126 -8.462 -2.256 -2.539 988 2HD2 LEU 36 3HD1 LEU 126 -9.639 -1.556 -1.401 989 3HD2 LEU 36 1HD1 LEU 126 -7.998 -0.971 -1.365 990 NH1 ARG 37 NH2 ARG 127 -11.957 -8.527 6.492 991 NH2 ARG 37 NH1 ARG 127 -12.765 -10.587 5.976 992 H ARG 37 H ARG 127 -11.498 -5.393 1.141 993 HA ARG 37 HA ARG 127 -11.955 -7.894 -0.131 994 1HB ARG 37 1HB ARG 127 -12.818 -8.866 1.733 995 2HB ARG 37 2HB ARG 127 -11.658 -7.708 2.330 996 1HG ARG 37 1HG ARG 127 -13.872 -6.143 2.574 997 2HG ARG 37 2HG ARG 127 -14.736 -7.666 2.477 998 1HD ARG 37 1HD ARG 127 -12.559 -6.880 4.463 999 2HD ARG 37 2HD ARG 127 -14.313 -6.886 4.769 1000 1HH1 ARG 37 2HH2 ARG 127 -11.938 -7.525 6.271 1001 2HH1 ARG 37 1HH2 ARG 127 -11.447 -9.000 7.246 1002 1HH2 ARG 37 1HH1 ARG 127 -13.360 -11.158 5.365 1003 2HH2 ARG 37 2HH1 ARG 127 -12.200 -10.916 6.766 1004 H LYS 38 H LYS 128 -13.876 -4.926 0.028 1005 HA LYS 38 HA LYS 128 -16.444 -6.333 -0.703 1006 1HB LYS 38 1HB LYS 128 -16.380 -4.688 1.188 1007 2HB LYS 38 2HB LYS 128 -16.027 -3.402 0.036 1008 1HG LYS 38 1HG LYS 128 -18.294 -3.713 -1.002 1009 2HG LYS 38 2HG LYS 128 -18.560 -5.157 -0.034 1010 1HD LYS 38 1HD LYS 128 -19.808 -3.387 0.984 1011 2HD LYS 38 2HD LYS 128 -18.487 -3.777 2.077 1012 1HE LYS 38 1HE LYS 128 -17.200 -1.732 1.213 1013 2HE LYS 38 2HE LYS 128 -18.548 -1.361 0.129 1014 1HZ LYS 38 1HZ LYS 128 -19.973 -1.096 2.044 1015 2HZ LYS 38 2HZ LYS 128 -18.680 -0.100 2.150 1016 H GLY 39 H GLY 129 -13.865 -5.230 -2.495 1017 1HA GLY 39 1HA GLY 129 -13.667 -4.725 -4.842 1018 2HA GLY 39 2HA GLY 129 -15.406 -4.792 -5.017 1019 H ASP 40 H ASP 130 -13.596 -2.708 -2.833 1020 HA ASP 40 HA ASP 130 -14.352 -0.173 -4.373 1021 1HB ASP 40 1HB ASP 130 -14.008 -0.355 -1.402 1022 2HB ASP 40 2HB ASP 130 -14.389 1.074 -2.309 1023 HD2 ASP 40 HD2 ASP 130 -17.742 0.451 -2.609 1024 H LYS 41 H LYS 131 -12.949 1.221 -4.995 1025 HA LYS 41 HA LYS 131 -10.012 0.669 -4.594 1026 1HB LYS 41 2HB LYS 131 -11.140 3.013 -6.166 1027 2HB LYS 41 1HB LYS 131 -9.488 2.415 -6.183 1028 1HG LYS 41 1HG LYS 131 -10.400 0.203 -7.181 1029 2HG LYS 41 2HG LYS 131 -11.963 0.995 -7.351 1030 1HD LYS 41 1HD LYS 131 -10.934 2.784 -8.798 1031 2HD LYS 41 2HD LYS 131 -9.338 2.052 -8.595 1032 1HE LYS 41 1HE LYS 131 -10.167 -0.076 -9.716 1033 2HE LYS 41 2HE LYS 131 -11.760 0.667 -9.940 1034 1HZ LYS 41 1HZ LYS 131 -10.431 0.890 -11.904 1035 2HZ LYS 41 2HZ LYS 131 -10.730 2.375 -11.291 1036 H VAL 42 H VAL 132 -8.882 1.661 -3.010 1037 HA VAL 42 HA VAL 132 -9.860 3.969 -1.491 1038 HB VAL 42 HB VAL 132 -7.647 1.821 -1.373 1039 1HG1 VAL 42 3HG2 VAL 132 -6.823 3.762 -0.184 1040 2HG1 VAL 42 1HG2 VAL 132 -8.326 3.698 0.868 1041 3HG1 VAL 42 2HG2 VAL 132 -7.154 2.315 0.826 1042 1HG2 VAL 42 1HG1 VAL 132 -10.176 2.335 0.275 1043 2HG2 VAL 42 2HG1 VAL 132 -9.801 0.970 -0.875 1044 3HG2 VAL 42 3HG1 VAL 132 -8.972 1.112 0.663 1045 H GLN 43 H GLN 133 -8.848 5.673 -1.458 1046 HA GLN 43 HA GLN 133 -6.621 6.375 -3.431 1047 1HB GLN 43 1HB GLN 133 -9.216 7.847 -3.582 1048 2HB GLN 43 2HB GLN 133 -7.702 8.401 -4.300 1049 1HG GLN 43 1HG GLN 133 -7.591 6.247 -5.606 1050 2HG GLN 43 2HG GLN 133 -9.112 5.729 -4.885 1051 1HE2 GLN 43 2HE2 GLN 133 -10.263 6.979 -8.090 1052 2HE2 GLN 43 1HE2 GLN 133 -9.526 5.526 -7.249 1053 H LEU 44 H LEU 134 -5.203 7.816 -3.157 1054 HA LEU 44 HA LEU 134 -5.067 9.411 -0.570 1055 1HB LEU 44 2HB LEU 134 -2.744 7.617 -1.481 1056 2HB LEU 44 1HB LEU 134 -2.774 8.624 -0.045 1057 HG LEU 44 HG LEU 134 -4.511 6.110 -0.500 1058 1HD1 LEU 44 1HD1 LEU 134 -2.094 5.517 -0.427 1059 2HD1 LEU 44 2HD1 LEU 134 -1.894 6.399 1.112 1060 3HD1 LEU 44 3HD1 LEU 134 -2.917 4.949 1.036 1061 1HD2 LEU 44 2HD2 LEU 134 -5.484 7.698 1.209 1062 2HD2 LEU 44 3HD2 LEU 134 -4.926 6.190 1.957 1063 3HD2 LEU 44 1HD2 LEU 134 -3.945 7.675 2.102 1064 H ILE 45 H ILE 135 -4.648 11.465 -1.386 1065 HA ILE 45 HA ILE 135 -3.482 11.792 -4.079 1066 HB ILE 45 HB ILE 135 -5.353 13.220 -3.269 1067 1HG1 ILE 45 1HG1 ILE 135 -4.566 15.385 -4.275 1068 2HG1 ILE 45 2HG1 ILE 135 -2.921 14.778 -4.331 1069 1HG2 ILE 45 3HG2 ILE 135 -4.517 13.732 -0.991 1070 2HG2 ILE 45 1HG2 ILE 135 -3.203 14.725 -1.673 1071 3HG2 ILE 45 2HG2 ILE 135 -4.910 15.218 -1.893 1072 1HD1 ILE 45 1HD1 ILE 135 -5.333 13.524 -5.827 1073 2HD1 ILE 45 2HD1 ILE 135 -4.119 14.613 -6.541 1074 3HD1 ILE 45 3HD1 ILE 135 -3.634 12.999 -5.985 1075 H GLY 46 H GLY 136 -1.627 12.802 -4.609 1076 1HA GLY 46 1HA GLY 136 0.772 12.822 -4.660 1077 2HA GLY 46 2HA GLY 136 0.632 13.523 -3.068 1078 H PHE 47 H PHE 137 -0.479 10.260 -3.069 1079 HA PHE 47 HA PHE 137 2.216 9.088 -2.362 1080 1HB PHE 47 2HB PHE 137 0.835 10.139 -0.449 1081 2HB PHE 47 1HB PHE 137 -0.383 8.913 -0.664 1082 HD1 PHE 47 HD2 PHE 137 3.159 9.468 0.438 1083 HD2 PHE 47 HD1 PHE 137 0.083 6.510 -0.116 1084 HE1 PHE 47 HE2 PHE 137 4.597 7.730 1.442 1085 HE2 PHE 47 HE1 PHE 137 1.551 4.808 0.867 1086 HZ PHE 47 HZ PHE 137 3.873 5.408 1.479 1087 H GLY 48 H GLY 138 -1.214 8.194 -3.247 1088 1HA GLY 48 1HA GLY 138 -0.384 5.620 -4.221 1089 2HA GLY 48 2HA GLY 138 -0.938 5.386 -2.590 1090 H ASN 49 H ASN 139 -1.969 4.075 -4.704 1091 HA ASN 49 HA ASN 139 -4.883 4.702 -4.226 1092 1HB ASN 49 1HB ASN 139 -4.427 5.939 -6.299 1093 2HB ASN 49 2HB ASN 139 -3.728 4.534 -7.071 1094 1HD2 ASN 49 1HD2 ASN 139 -7.120 4.801 -8.486 1095 2HD2 ASN 49 2HD2 ASN 139 -5.505 5.672 -8.502 1096 H PHE 50 H PHE 140 -5.160 2.860 -3.059 1097 HA PHE 50 HA PHE 140 -4.139 0.202 -4.014 1098 1HB PHE 50 2HB PHE 140 -6.222 0.540 -1.820 1099 2HB PHE 50 1HB PHE 140 -5.504 -0.931 -2.247 1100 HD1 PHE 50 HD2 PHE 140 -4.884 2.470 -0.840 1101 HD2 PHE 50 HD1 PHE 140 -3.786 -1.685 -0.823 1102 HE1 PHE 50 HE2 PHE 140 -3.560 2.806 1.236 1103 HE2 PHE 50 HE1 PHE 140 -2.494 -1.305 1.257 1104 HZ PHE 50 HZ PHE 140 -2.233 0.968 2.108 1105 H GLU 51 H GLU 141 -5.329 -1.287 -5.066 1106 HA GLU 51 HA GLU 141 -8.214 -1.071 -5.317 1107 1HB GLU 51 1HB GLU 141 -8.428 -0.755 -7.830 1108 2HB GLU 51 2HB GLU 141 -7.846 0.665 -6.983 1109 1HG GLU 51 1HG GLU 141 -5.465 0.134 -7.752 1110 2HG GLU 51 2HG GLU 141 -6.085 -1.245 -8.657 1111 HE2 GLU 51 HE2 GLU 141 -7.340 0.616 -11.270 1112 H VAL 52 H VAL 142 -9.193 -2.969 -5.749 1113 HA VAL 52 HA VAL 142 -7.363 -5.232 -5.631 1114 HB VAL 52 HB VAL 142 -9.677 -4.254 -4.276 1115 1HG1 VAL 52 1HG2 VAL 142 -10.702 -6.409 -6.154 1116 2HG1 VAL 52 2HG2 VAL 142 -11.490 -5.812 -4.651 1117 3HG1 VAL 52 3HG2 VAL 142 -11.211 -4.717 -6.041 1118 1HG2 VAL 52 2HG1 VAL 142 -8.013 -5.636 -3.317 1119 2HG2 VAL 52 3HG1 VAL 142 -9.630 -6.222 -3.001 1120 3HG2 VAL 52 1HG1 VAL 142 -8.634 -7.079 -4.181 1121 NH1 ARG 53 NH2 ARG 143 -5.670 -11.707 -11.753 1122 NH2 ARG 53 NH1 ARG 143 -5.216 -11.262 -13.935 1123 H ARG 53 H ARG 143 -7.817 -7.244 -6.771 1124 HA ARG 53 HA ARG 143 -8.612 -6.763 -9.718 1125 1HB ARG 53 1HB ARG 143 -6.126 -6.913 -9.313 1126 2HB ARG 53 2HB ARG 143 -6.337 -8.510 -8.641 1127 1HG ARG 53 1HG ARG 143 -7.339 -9.286 -10.868 1128 2HG ARG 53 2HG ARG 143 -7.021 -7.683 -11.534 1129 1HD ARG 53 1HD ARG 143 -4.558 -7.975 -11.134 1130 2HD ARG 53 2HD ARG 143 -4.819 -9.521 -10.342 1131 1HH1 ARG 53 2HH2 ARG 143 -5.766 -11.345 -10.798 1132 2HH1 ARG 53 1HH2 ARG 143 -5.804 -12.678 -12.058 1133 1HH2 ARG 53 1HH1 ARG 143 -4.964 -10.565 -14.645 1134 2HH2 ARG 53 2HH1 ARG 143 -5.380 -12.263 -14.088 1135 H GLU 54 H GLU 144 -10.676 -7.491 -9.481 1136 HA GLU 54 HA GLU 144 -11.464 -9.940 -8.090 1137 1HB GLU 54 1HB GLU 144 -12.919 -7.912 -8.569 1138 2HB GLU 54 2HB GLU 144 -13.067 -8.444 -10.242 1139 1HG GLU 54 1HG GLU 144 -14.123 -10.623 -9.408 1140 2HG GLU 54 2HG GLU 144 -13.905 -10.075 -7.749 1141 HE1 GLU 54 HE2 GLU 144 -16.849 -8.595 -10.091 1142 NH1 ARG 55 NH2 ARG 145 -10.425 -19.571 -8.579 1143 NH2 ARG 55 NH1 ARG 145 -9.608 -20.274 -10.581 1144 H ARG 55 H ARG 145 -11.464 -11.986 -8.702 1145 HA ARG 55 HA ARG 145 -10.238 -12.865 -11.265 1146 1HB ARG 55 1HB ARG 145 -9.868 -14.012 -9.042 1147 2HB ARG 55 2HB ARG 145 -11.551 -14.521 -9.040 1148 1HG ARG 55 1HG ARG 145 -11.072 -15.829 -11.220 1149 2HG ARG 55 2HG ARG 145 -9.367 -15.417 -11.010 1150 1HD ARG 55 1HD ARG 145 -9.397 -16.593 -8.747 1151 2HD ARG 55 2HD ARG 145 -11.126 -16.931 -8.961 1152 1HH1 ARG 55 2HH2 ARG 145 -10.693 -18.780 -7.983 1153 2HH1 ARG 55 1HH2 ARG 145 -10.478 -20.568 -8.339 1154 1HH2 ARG 55 1HH1 ARG 145 -9.252 -20.022 -11.509 1155 2HH2 ARG 55 2HH1 ARG 145 -9.716 -21.220 -10.200 1156 H ALA 56 H ALA 146 -11.204 -13.983 -12.917 1157 HA ALA 56 HA ALA 146 -13.960 -13.154 -13.609 1158 1HB ALA 56 3HB ALA 146 -12.158 -13.128 -15.293 1159 2HB ALA 56 1HB ALA 146 -12.012 -14.903 -15.221 1160 3HB ALA 56 2HB ALA 146 -13.511 -14.145 -15.812 1161 H ALA 57 H ALA 147 -15.223 -14.296 -12.086 1162 HA ALA 57 HA ALA 147 -15.926 -16.893 -11.708 1163 1HB ALA 57 1HB ALA 147 -17.184 -14.853 -10.871 1164 2HB ALA 57 2HB ALA 147 -17.932 -14.652 -12.475 1165 3HB ALA 57 3HB ALA 147 -18.307 -16.082 -11.495 1166 NH1 ARG 58 NH2 ARG 148 -14.078 -15.397 -20.284 1167 NH2 ARG 58 NH1 ARG 148 -12.444 -14.478 -18.998 1168 H ARG 58 H ARG 148 -15.273 -18.286 -13.278 1169 HA ARG 58 HA ARG 148 -17.530 -19.373 -14.712 1170 1HB ARG 58 2HB ARG 148 -16.112 -19.390 -17.071 1171 2HB ARG 58 1HB ARG 148 -17.263 -18.084 -16.739 1172 1HG ARG 58 1HG ARG 148 -15.395 -16.628 -15.789 1173 2HG ARG 58 2HG ARG 148 -14.267 -17.890 -16.112 1174 1HD ARG 58 1HD ARG 148 -14.830 -17.741 -18.640 1175 2HD ARG 58 2HD ARG 148 -15.936 -16.400 -18.284 1176 1HH1 ARG 58 2HH2 ARG 148 -14.882 -16.033 -20.337 1177 2HH1 ARG 58 1HH2 ARG 148 -13.687 -14.836 -21.049 1178 1HH2 ARG 58 1HH1 ARG 148 -11.999 -14.412 -18.076 1179 2HH2 ARG 58 2HH1 ARG 148 -12.165 -13.980 -19.851 1180 H LYS 59 H LYS 149 -16.958 -21.370 -14.915 1181 HA LYS 59 HA LYS 149 -16.284 -23.306 -15.476 1182 1HB LYS 59 1HB LYS 149 -15.033 -21.939 -17.233 1183 2HB LYS 59 2HB LYS 149 -13.554 -22.417 -16.432 1184 1HG LYS 59 1HG LYS 149 -13.969 -23.779 -18.392 1185 2HG LYS 59 2HG LYS 149 -14.007 -24.818 -16.989 1186 1HD LYS 59 1HD LYS 149 -16.546 -24.824 -17.056 1187 2HD LYS 59 2HD LYS 149 -16.506 -23.739 -18.453 1188 1HE LYS 59 1HE LYS 149 -15.251 -25.512 -19.780 1189 2HE LYS 59 2HE LYS 149 -15.262 -26.575 -18.364 1190 1HZ LYS 59 1HZ LYS 149 -17.694 -26.527 -18.429 1191 2HZ LYS 59 2HZ LYS 149 -17.682 -25.555 -19.744 1192 H GLY 60 H GLY 150 -14.708 -25.201 -14.814 1193 1HA GLY 60 1HA GLY 150 -12.118 -25.222 -13.683 1194 2HA GLY 60 2HA GLY 150 -13.221 -24.898 -12.383 1195 NH1 ARG 61 NH2 ARG 151 -13.311 -33.229 -15.676 1196 NH2 ARG 61 NH1 ARG 151 -12.203 -32.017 -17.248 1197 H ARG 61 H ARG 151 -12.551 -26.851 -11.498 1198 HA ARG 61 HA ARG 151 -14.212 -29.132 -12.319 1199 1HB ARG 61 1HB ARG 151 -12.050 -29.363 -13.721 1200 2HB ARG 61 2HB ARG 151 -11.158 -29.624 -12.229 1201 1HG ARG 61 1HG ARG 151 -12.539 -31.707 -11.787 1202 2HG ARG 61 2HG ARG 151 -13.511 -31.403 -13.215 1203 1HD ARG 61 1HD ARG 151 -10.473 -31.970 -13.233 1204 2HD ARG 61 2HD ARG 151 -11.700 -33.198 -13.448 1205 1HH1 ARG 61 2HH2 ARG 151 -13.398 -33.489 -14.687 1206 2HH1 ARG 61 1HH2 ARG 151 -13.889 -33.566 -16.454 1207 1HH2 ARG 61 1HH1 ARG 151 -11.452 -31.352 -17.460 1208 2HH2 ARG 61 2HH1 ARG 151 -12.860 -32.437 -17.915 1209 H ASN 62 H ASN 152 -14.733 -30.494 -10.788 1210 HA ASN 62 HA ASN 152 -14.272 -29.716 -7.973 1211 1HB ASN 62 1HB ASN 152 -16.484 -30.482 -8.960 1212 2HB ASN 62 2HB ASN 152 -15.834 -32.105 -9.125 1213 1HD2 ASN 62 2HD2 ASN 152 -17.295 -31.032 -5.515 1214 2HD2 ASN 62 1HD2 ASN 152 -17.220 -29.849 -6.917 1215 HA PRO 63 HA PRO 153 -10.722 -32.609 -7.489 1216 1HB PRO 63 1HB PRO 153 -10.319 -32.520 -4.743 1217 2HB PRO 63 2HB PRO 153 -9.955 -31.193 -5.854 1218 1HG PRO 63 1HG PRO 153 -12.473 -31.553 -4.150 1219 2HG PRO 63 2HG PRO 153 -11.448 -30.104 -4.291 1220 1HD PRO 63 1HD PRO 153 -13.774 -30.391 -5.753 1221 2HD PRO 63 2HD PRO 153 -12.358 -29.547 -6.450 1222 H GLN 64 H GLN 154 -13.740 -33.481 -5.775 1223 HA GLN 64 HA GLN 154 -12.698 -36.248 -5.076 1224 1HB GLN 64 1HB GLN 154 -15.498 -35.062 -4.600 1225 2HB GLN 64 2HB GLN 154 -14.934 -36.612 -4.030 1226 1HG GLN 64 1HG GLN 154 -13.829 -33.863 -3.142 1227 2HG GLN 64 2HG GLN 154 -15.113 -34.776 -2.387 1228 1HE2 GLN 64 2HE2 GLN 154 -11.234 -35.842 -1.556 1229 2HE2 GLN 64 1HE2 GLN 154 -11.674 -34.486 -2.711 1230 H THR 65 H THR 155 -15.703 -35.139 -6.443 1231 HA THR 65 HA THR 155 -16.304 -37.376 -8.080 1232 HB THR 65 HB THR 155 -18.063 -36.098 -9.177 1233 HG1 THR 65 HG1 THR 155 -16.823 -33.822 -8.057 1234 1HG2 THR 65 3HG2 THR 155 -18.453 -36.694 -6.738 1235 2HG2 THR 65 1HG2 THR 155 -17.826 -35.096 -6.269 1236 3HG2 THR 65 2HG2 THR 155 -19.310 -35.206 -7.238 1237 H GLY 66 H GLY 156 -14.489 -34.552 -9.260 1238 1HA GLY 66 1HA GLY 156 -13.162 -34.335 -11.258 1239 2HA GLY 66 2HA GLY 156 -13.469 -36.017 -11.652 1240 H GLU 67 H GLU 157 -15.825 -33.386 -11.115 1241 HA GLU 67 HA GLU 157 -16.808 -33.584 -14.003 1242 1HB GLU 67 2HB GLU 157 -18.275 -34.450 -12.055 1243 2HB GLU 67 1HB GLU 157 -18.395 -32.791 -11.462 1244 1HG GLU 67 1HG GLU 157 -19.452 -32.103 -13.678 1245 2HG GLU 67 2HG GLU 157 -19.315 -33.759 -14.259 1246 HE1 GLU 67 HE2 GLU 157 -21.989 -34.987 -12.443 1247 H GLU 68 H GLU 158 -17.024 -31.722 -15.086 1248 HA GLU 68 HA GLU 158 -15.480 -29.429 -14.243 1249 1HB GLU 68 1HB GLU 158 -17.344 -29.631 -16.681 1250 2HB GLU 68 2HB GLU 158 -16.303 -28.251 -16.350 1251 1HG GLU 68 1HG GLU 158 -14.263 -29.767 -16.375 1252 2HG GLU 68 2HG GLU 158 -15.294 -31.129 -16.796 1253 HE2 GLU 68 HE2 GLU 158 -13.943 -28.704 -19.596 1254 H MET 69 H MET 159 -15.985 -27.891 -12.972 1255 HA MET 69 HA MET 159 -18.851 -27.229 -12.204 1256 1HB MET 69 1HB MET 159 -17.888 -26.401 -10.112 1257 2HB MET 69 2HB MET 159 -17.300 -28.009 -10.419 1258 1HG MET 69 1HG MET 159 -15.096 -27.310 -10.526 1259 2HG MET 69 2HG MET 159 -15.457 -25.913 -11.524 1260 1HE MET 69 2HE MET 159 -13.245 -25.168 -10.115 1261 2HE MET 69 1HE MET 159 -14.359 -23.953 -10.739 1262 3HE MET 69 3HE MET 159 -13.676 -23.729 -9.130 1263 H GLU 70 H GLU 160 -18.275 -24.819 -11.087 1264 HA GLU 70 HA GLU 160 -17.701 -22.840 -13.256 1265 1HB GLU 70 2HB GLU 160 -19.675 -21.594 -12.745 1266 2HB GLU 70 1HB GLU 160 -20.162 -23.316 -12.809 1267 1HG GLU 70 1HG GLU 160 -20.261 -23.407 -10.306 1268 2HG GLU 70 2HG GLU 160 -19.779 -21.719 -10.203 1269 HE1 GLU 70 HE2 GLU 160 -23.530 -22.767 -11.268 1270 H ILE 71 H ILE 161 -16.518 -21.094 -12.596 1271 HA ILE 71 HA ILE 161 -14.939 -21.395 -10.141 1272 HB ILE 71 HB ILE 161 -14.558 -19.816 -12.720 1273 1HG1 ILE 71 1HG1 ILE 161 -12.386 -21.330 -11.129 1274 2HG1 ILE 71 2HG1 ILE 161 -13.669 -22.308 -11.728 1275 1HG2 ILE 71 3HG2 ILE 161 -13.167 -19.184 -10.127 1276 2HG2 ILE 71 1HG2 ILE 161 -12.654 -18.677 -11.798 1277 3HG2 ILE 71 2HG2 ILE 161 -14.220 -18.139 -11.110 1278 1HD1 ILE 71 2HD1 ILE 161 -11.990 -20.638 -13.620 1279 2HD1 ILE 71 3HD1 ILE 161 -11.907 -22.425 -13.307 1280 3HD1 ILE 71 1HD1 ILE 161 -13.311 -21.718 -14.019 1281 HA PRO 72 HA PRO 162 -17.316 -16.687 -9.555 1282 1HB PRO 72 1HB PRO 162 -17.651 -18.611 -7.231 1283 2HB PRO 72 2HB PRO 162 -18.457 -17.024 -7.453 1284 1HG PRO 72 1HG PRO 162 -19.496 -19.330 -8.604 1285 2HG PRO 72 2HG PRO 162 -19.595 -17.736 -9.446 1286 1HD PRO 72 1HD PRO 162 -18.166 -20.092 -10.242 1287 2HD PRO 72 2HD PRO 162 -18.259 -18.586 -11.174 1288 H ALA 73 H ALA 163 -16.858 -15.067 -8.203 1289 HA ALA 73 HA ALA 163 -14.228 -14.243 -8.777 1290 1HB ALA 73 2HB ALA 163 -16.086 -12.595 -8.308 1291 2HB ALA 73 3HB ALA 163 -15.980 -12.984 -6.548 1292 3HB ALA 73 1HB ALA 163 -14.635 -12.208 -7.374 1293 H SER 74 H SER 164 -12.620 -13.540 -7.726 1294 HA SER 74 HA SER 164 -12.546 -13.485 -4.845 1295 1HB SER 74 1HB SER 164 -10.271 -15.231 -6.123 1296 2HB SER 74 2HB SER 164 -10.224 -14.652 -4.454 1297 HG SER 74 HG SER 164 -12.210 -16.318 -5.591 1298 H LYS 75 H LYS 165 -11.816 -11.604 -4.343 1299 HA LYS 75 HA LYS 165 -10.327 -9.890 -6.278 1300 1HB LYS 75 2HB LYS 165 -10.876 -8.912 -3.488 1301 2HB LYS 75 1HB LYS 165 -10.534 -8.066 -4.944 1302 1HG LYS 75 1HG LYS 165 -12.787 -7.642 -4.768 1303 2HG LYS 75 2HG LYS 165 -12.814 -8.994 -5.882 1304 1HD LYS 75 1HD LYS 165 -13.399 -10.540 -3.937 1305 2HD LYS 75 2HD LYS 165 -13.259 -9.180 -2.821 1306 1HE LYS 75 1HE LYS 165 -15.164 -7.996 -4.006 1307 2HE LYS 75 2HE LYS 165 -15.289 -9.335 -5.158 1308 1HZ LYS 75 1HZ LYS 165 -16.877 -9.505 -3.352 1309 2HZ LYS 75 2HZ LYS 165 -15.694 -9.536 -2.225 1310 H VAL 76 H VAL 166 -7.997 -9.476 -6.331 1311 HA VAL 76 HA VAL 166 -6.346 -10.541 -4.239 1312 HB VAL 76 HB VAL 166 -6.673 -10.168 -7.236 1313 1HG1 VAL 76 1HG2 VAL 166 -3.965 -10.126 -6.114 1314 2HG1 VAL 76 2HG2 VAL 166 -4.502 -10.406 -7.856 1315 3HG1 VAL 76 3HG2 VAL 166 -4.842 -8.855 -7.051 1316 1HG2 VAL 76 3HG1 VAL 166 -7.130 -12.330 -6.168 1317 2HG2 VAL 76 1HG1 VAL 166 -5.833 -12.400 -7.376 1318 3HG2 VAL 76 2HG1 VAL 166 -5.423 -12.411 -5.622 1319 HA PRO 77 HA PRO 167 -5.730 -6.019 -3.548 1320 1HB PRO 77 1HB PRO 167 -4.144 -6.136 -1.267 1321 2HB PRO 77 2HB PRO 167 -5.787 -6.779 -1.265 1322 1HG PRO 77 1HG PRO 167 -3.176 -8.309 -1.577 1323 2HG PRO 77 2HG PRO 167 -4.568 -8.729 -0.575 1324 1HD PRO 77 1HD PRO 167 -4.000 -9.701 -3.305 1325 2HD PRO 77 2HD PRO 167 -5.570 -9.841 -2.495 1326 H ALA 78 H ALA 168 -4.641 -4.496 -3.989 1327 HA ALA 78 HA ALA 168 -1.637 -4.554 -4.493 1328 1HB ALA 78 2HB ALA 168 -2.953 -5.214 -6.556 1329 2HB ALA 78 3HB ALA 168 -3.864 -3.694 -6.460 1330 3HB ALA 78 1HB ALA 168 -2.111 -3.655 -6.787 1331 H PHE 79 H PHE 169 -0.848 -2.536 -4.908 1332 HA PHE 79 HA PHE 169 -2.119 -0.030 -3.597 1333 1HB PHE 79 2HB PHE 169 -1.246 -0.762 -1.746 1334 2HB PHE 79 1HB PHE 169 0.268 -1.307 -2.533 1335 HD1 PHE 79 HD1 PHE 169 -1.564 1.715 -1.304 1336 HD2 PHE 79 HD2 PHE 169 2.115 0.283 -3.004 1337 HE1 PHE 79 HE1 PHE 169 -0.494 3.883 -0.847 1338 HE2 PHE 79 HE2 PHE 169 3.152 2.467 -2.587 1339 HZ PHE 79 HZ PHE 169 1.846 4.281 -1.552 1340 H LYS 80 H LYS 170 -1.700 1.352 -5.024 1341 HA LYS 80 HA LYS 170 0.532 1.458 -7.228 1342 1HB LYS 80 2HB LYS 170 -1.972 3.156 -6.840 1343 2HB LYS 80 1HB LYS 170 -0.704 3.540 -7.971 1344 1HG LYS 80 1HG LYS 170 -1.098 1.461 -9.270 1345 2HG LYS 80 2HG LYS 170 -2.209 0.851 -8.055 1346 1HD LYS 80 1HD LYS 170 -3.517 1.614 -9.900 1347 2HD LYS 80 2HD LYS 170 -3.847 2.659 -8.530 1348 1HE LYS 80 1HE LYS 170 -2.331 4.449 -9.528 1349 2HE LYS 80 2HE LYS 170 -1.956 3.375 -10.885 1350 1HZ LYS 80 1HZ LYS 170 -3.689 4.902 -11.461 1351 2HZ LYS 80 2HZ LYS 170 -4.291 3.383 -11.482 1352 HA PRO 81 HA PRO 171 2.307 4.553 -4.292 1353 1HB PRO 81 1HB PRO 171 4.626 5.150 -5.664 1354 2HB PRO 81 2HB PRO 171 4.369 3.565 -4.924 1355 1HG PRO 81 1HG PRO 171 3.977 4.360 -7.856 1356 2HG PRO 81 2HG PRO 171 4.891 2.973 -7.214 1357 1HD PRO 81 1HD PRO 171 2.228 2.803 -8.090 1358 2HD PRO 81 2HD PRO 171 2.897 1.717 -6.830 1359 H GLY 82 H GLY 172 0.096 5.376 -5.894 1360 1HA GLY 82 1HA GLY 172 -0.858 6.902 -7.503 1361 2HA GLY 82 2HA GLY 172 -0.162 7.950 -6.285 1362 H LYS 83 H LYS 173 2.118 6.368 -8.261 1363 HA LYS 83 HA LYS 173 3.763 7.166 -9.806 1364 1HB LYS 83 2HB LYS 173 1.455 8.888 -10.695 1365 2HB LYS 83 1HB LYS 173 2.968 9.692 -10.892 1366 1HG LYS 83 1HG LYS 173 3.833 7.655 -12.232 1367 2HG LYS 83 2HG LYS 173 2.273 6.883 -11.995 1368 1HD LYS 83 1HD LYS 173 2.241 7.797 -14.214 1369 2HD LYS 83 2HD LYS 173 1.129 8.742 -13.251 1370 1HE LYS 83 1HE LYS 173 2.328 10.272 -14.694 1371 2HE LYS 83 2HE LYS 173 2.880 10.598 -13.056 1372 1HZ LYS 83 1HZ LYS 173 4.846 9.210 -13.546 1373 2HZ LYS 83 2HZ LYS 173 4.319 8.951 -15.071 1374 H ALA 84 H ALA 174 2.338 9.590 -8.030 1375 HA ALA 84 HA ALA 174 4.275 11.681 -7.662 1376 1HB ALA 84 2HB ALA 174 1.810 11.711 -7.133 1377 2HB ALA 84 3HB ALA 174 2.048 10.481 -5.865 1378 3HB ALA 84 1HB ALA 174 2.758 12.104 -5.661 1379 H LEU 85 H LEU 175 3.686 8.744 -5.550 1380 HA LEU 85 HA LEU 175 5.863 9.361 -3.720 1381 1HB LEU 85 2HB LEU 175 4.008 7.908 -2.963 1382 2HB LEU 85 1HB LEU 175 4.375 6.746 -4.227 1383 HG LEU 85 HG LEU 175 6.684 6.641 -3.269 1384 1HD1 LEU 85 2HD1 LEU 175 5.408 8.027 -0.868 1385 2HD1 LEU 85 3HD1 LEU 175 6.936 7.104 -0.775 1386 3HD1 LEU 85 1HD1 LEU 175 6.830 8.553 -1.790 1387 1HD2 LEU 85 3HD2 LEU 175 4.964 4.781 -2.931 1388 2HD2 LEU 85 1HD2 LEU 175 5.943 4.930 -1.459 1389 3HD2 LEU 85 2HD2 LEU 175 4.304 5.620 -1.513 1390 H LYS 86 H LYS 176 5.626 7.270 -6.647 1391 HA LYS 86 HA LYS 176 8.427 6.390 -6.649 1392 1HB LYS 86 1HB LYS 176 6.701 5.260 -8.003 1393 2HB LYS 86 2HB LYS 176 6.431 6.696 -8.979 1394 1HG LYS 86 1HG LYS 176 8.715 6.541 -9.935 1395 2HG LYS 86 2HG LYS 176 9.104 5.167 -8.895 1396 1HD LYS 86 1HD LYS 176 7.439 3.733 -10.032 1397 2HD LYS 86 2HD LYS 176 6.749 5.106 -10.883 1398 1HE LYS 86 1HE LYS 176 8.077 3.844 -12.466 1399 2HE LYS 86 2HE LYS 176 8.833 5.414 -12.233 1400 1HZ LYS 86 1HZ LYS 176 10.413 4.335 -10.709 1401 2HZ LYS 86 2HZ LYS 176 9.702 2.882 -10.942 1402 H ASP 87 H ASP 177 7.092 9.565 -7.506 1403 HA ASP 87 HA ASP 177 9.627 10.534 -8.708 1404 1HB ASP 87 1HB ASP 177 6.820 11.319 -8.581 1405 2HB ASP 87 2HB ASP 177 7.607 12.470 -7.601 1406 HD1 ASP 87 HD2 ASP 177 8.204 12.272 -11.620 1407 H ALA 88 H ALA 178 7.959 10.777 -5.533 1408 HA ALA 88 HA ALA 178 9.674 12.428 -3.935 1409 1HB ALA 88 3HB ALA 178 7.522 11.132 -3.099 1410 2HB ALA 88 1HB ALA 178 8.489 9.681 -3.023 1411 3HB ALA 88 2HB ALA 178 8.949 10.969 -1.986 1412 H VAL 89 H VAL 179 9.843 8.976 -4.471 1413 HA VAL 89 HA VAL 179 12.335 8.638 -2.867 1414 HB VAL 89 HB VAL 179 11.696 6.461 -2.558 1415 1HG1 VAL 89 2HG2 VAL 179 9.486 7.752 -2.159 1416 2HG1 VAL 89 3HG2 VAL 179 8.974 6.994 -3.693 1417 3HG1 VAL 89 1HG2 VAL 179 9.433 5.954 -2.368 1418 1HG2 VAL 89 1HG1 VAL 179 12.051 5.660 -4.858 1419 2HG2 VAL 89 2HG1 VAL 179 10.569 4.960 -4.134 1420 3HG2 VAL 89 3HG1 VAL 179 10.445 6.314 -5.311 1421 H LYS 90 H LYS 180 11.679 8.921 -6.177 1422 HA LYS 90 HA LYS 180 12.760 6.934 -7.225 1423 1HB LYS 90 1HB LYS 180 11.864 9.350 -8.290 1424 2HB LYS 90 2HB LYS 180 13.496 9.514 -8.832 1425 1HG LYS 90 1HG LYS 180 13.324 7.382 -10.143 1426 2HG LYS 90 2HG LYS 180 11.746 7.040 -9.431 1427 1HD LYS 90 1HD LYS 180 10.869 9.242 -10.445 1428 2HD LYS 90 2HD LYS 180 12.421 9.423 -11.274 1429 1HE LYS 90 1HE LYS 180 12.017 7.188 -12.445 1430 2HE LYS 90 2HE LYS 180 10.468 7.043 -11.598 1431 1HZ LYS 90 1HZ LYS 180 9.757 9.103 -12.663 1432 2HZ LYS 90 2HZ LYS 180 11.185 9.252 -13.444 Start of MODEL 13 Raw file had 1432 H/Q atoms Start of MODEL 13 1 1H MET 1 1H MET 1 -12.632 6.104 -1.818 2 2H MET 1 2H MET 1 -11.322 6.690 -2.601 3 HA MET 1 HA MET 1 -12.987 8.191 -0.687 4 1HB MET 1 1HB MET 1 -10.211 6.911 -0.297 5 2HB MET 1 2HB MET 1 -10.903 8.081 0.786 6 1HG MET 1 1HG MET 1 -12.926 6.450 1.115 7 2HG MET 1 2HG MET 1 -11.938 5.241 0.264 8 1HE MET 1 2HE MET 1 -11.007 3.527 1.882 9 2HE MET 1 1HE MET 1 -10.618 3.847 3.590 10 3HE MET 1 3HE MET 1 -12.311 3.987 3.023 11 H ASN 2 H ASN 2 -9.671 8.924 -0.974 12 HA ASN 2 HA ASN 2 -9.028 10.411 -2.925 13 1HB ASN 2 1HB ASN 2 -9.542 12.708 -3.076 14 2HB ASN 2 2HB ASN 2 -10.970 11.751 -3.191 15 1HD2 ASN 2 1HD2 ASN 2 -10.735 14.553 -0.253 16 2HD2 ASN 2 2HD2 ASN 2 -9.288 13.963 -1.218 17 H LYS 3 H LYS 3 -9.222 10.611 0.348 18 HA LYS 3 HA LYS 3 -7.080 10.395 1.752 19 1HB LYS 3 1HB LYS 3 -5.653 11.530 -0.122 20 2HB LYS 3 2HB LYS 3 -6.169 13.071 0.500 21 1HG LYS 3 1HG LYS 3 -4.980 12.550 2.677 22 2HG LYS 3 2HG LYS 3 -4.751 10.874 2.174 23 1HD LYS 3 1HD LYS 3 -3.311 11.669 0.227 24 2HD LYS 3 2HD LYS 3 -3.441 13.322 0.840 25 1HE LYS 3 1HE LYS 3 -2.315 12.618 2.997 26 2HE LYS 3 2HE LYS 3 -2.240 10.943 2.423 27 1HZ LYS 3 1HZ LYS 3 -0.872 11.704 0.569 28 2HZ LYS 3 2HZ LYS 3 -0.937 13.251 1.092 29 H THR 4 H THR 4 -9.698 12.838 1.174 30 HA THR 4 HA THR 4 -9.533 13.727 3.920 31 HB THR 4 HB THR 4 -11.342 14.207 1.468 32 HG1 THR 4 HG1 THR 4 -10.191 16.171 1.363 33 1HG2 THR 4 3HG2 THR 4 -11.077 15.608 4.141 34 2HG2 THR 4 1HG2 THR 4 -11.975 16.260 2.693 35 3HG2 THR 4 2HG2 THR 4 -12.500 14.722 3.480 36 H GLU 5 H GLU 5 -11.240 11.380 1.957 37 HA GLU 5 HA GLU 5 -13.442 10.877 3.944 38 1HB GLU 5 1HB GLU 5 -12.657 8.862 1.809 39 2HB GLU 5 2HB GLU 5 -14.150 8.958 2.699 40 1HG GLU 5 1HG GLU 5 -13.194 10.830 0.452 41 2HG GLU 5 2HG GLU 5 -14.434 9.608 0.331 42 HE1 GLU 5 HE2 GLU 5 -16.953 11.453 1.875 43 H LEU 6 H LEU 6 -10.199 10.286 3.570 44 HA LEU 6 HA LEU 6 -9.651 7.854 5.184 45 1HB LEU 6 2HB LEU 6 -8.236 9.907 3.481 46 2HB LEU 6 1HB LEU 6 -7.448 9.908 4.974 47 HG LEU 6 HG LEU 6 -7.566 7.188 4.475 48 1HD1 LEU 6 2HD1 LEU 6 -9.034 7.430 2.493 49 2HD1 LEU 6 3HD1 LEU 6 -7.735 8.261 1.633 50 3HD1 LEU 6 1HD1 LEU 6 -7.529 6.558 2.140 51 1HD2 LEU 6 1HD2 LEU 6 -5.506 8.359 4.819 52 2HD2 LEU 6 2HD2 LEU 6 -5.366 7.205 3.508 53 3HD2 LEU 6 3HD2 LEU 6 -5.512 8.959 3.146 54 H ILE 7 H ILE 7 -9.443 11.426 5.571 55 HA ILE 7 HA ILE 7 -8.571 11.524 8.313 56 HB ILE 7 HB ILE 7 -10.265 13.641 6.860 57 1HG1 ILE 7 1HG1 ILE 7 -7.198 13.461 6.990 58 2HG1 ILE 7 2HG1 ILE 7 -8.093 12.876 5.644 59 1HG2 ILE 7 2HG2 ILE 7 -10.053 14.056 9.358 60 2HG2 ILE 7 3HG2 ILE 7 -8.303 14.063 9.176 61 3HG2 ILE 7 1HG2 ILE 7 -9.274 15.313 8.385 62 1HD1 ILE 7 3HD1 ILE 7 -9.125 15.197 5.303 63 2HD1 ILE 7 1HD1 ILE 7 -7.871 15.789 6.383 64 3HD1 ILE 7 2HD1 ILE 7 -7.410 14.933 4.882 65 H ASN 8 H ASN 8 -11.858 11.731 6.978 66 HA ASN 8 HA ASN 8 -13.139 11.693 9.665 67 1HB ASN 8 1HB ASN 8 -14.438 11.006 6.926 68 2HB ASN 8 2HB ASN 8 -15.328 11.183 8.421 69 1HD2 ASN 8 2HD2 ASN 8 -14.538 14.571 6.367 70 2HD2 ASN 8 1HD2 ASN 8 -14.130 12.892 5.749 71 H ALA 9 H ALA 9 -11.804 9.061 7.862 72 HA ALA 9 HA ALA 9 -13.325 6.892 9.289 73 1HB ALA 9 2HB ALA 9 -11.885 6.442 7.098 74 2HB ALA 9 3HB ALA 9 -10.440 6.794 8.056 75 3HB ALA 9 1HB ALA 9 -11.399 5.419 8.508 76 H VAL 10 H VAL 10 -10.153 8.585 9.634 77 HA VAL 10 HA VAL 10 -9.287 6.982 11.782 78 HB VAL 10 HB VAL 10 -7.989 9.643 11.410 79 1HG1 VAL 10 3HG2 VAL 10 -7.227 7.673 12.954 80 2HG1 VAL 10 1HG2 VAL 10 -6.680 6.936 11.425 81 3HG1 VAL 10 2HG2 VAL 10 -6.022 8.516 11.918 82 1HG2 VAL 10 1HG1 VAL 10 -8.133 7.453 9.304 83 2HG2 VAL 10 2HG1 VAL 10 -8.389 9.224 9.213 84 3HG2 VAL 10 3HG1 VAL 10 -6.723 8.585 9.397 85 H ALA 11 H ALA 11 -10.379 10.114 11.594 86 HA ALA 11 HA ALA 11 -10.472 10.438 14.386 87 1HB ALA 11 2HB ALA 11 -10.386 12.434 12.838 88 2HB ALA 11 3HB ALA 11 -12.028 12.079 12.251 89 3HB ALA 11 1HB ALA 11 -11.771 12.643 13.933 90 H GLU 12 H GLU 12 -12.824 8.897 12.363 91 HA GLU 12 HA GLU 12 -14.922 8.880 14.507 92 1HB GLU 12 1HB GLU 12 -15.603 8.825 12.081 93 2HB GLU 12 2HB GLU 12 -14.808 7.273 11.887 94 1HG GLU 12 1HG GLU 12 -17.193 6.911 12.080 95 2HG GLU 12 2HG GLU 12 -16.442 6.221 13.504 96 HE2 GLU 12 HE2 GLU 12 -18.092 8.245 15.747 97 H THR 13 H THR 13 -12.610 6.452 13.123 98 HA THR 13 HA THR 13 -13.218 4.497 15.187 99 HB THR 13 HB THR 13 -11.087 3.274 14.456 100 HG1 THR 13 HG1 THR 13 -9.949 5.213 14.218 101 1HG2 THR 13 2HG2 THR 13 -12.565 4.260 11.958 102 2HG2 THR 13 3HG2 THR 13 -11.427 2.905 12.072 103 3HG2 THR 13 1HG2 THR 13 -12.982 2.823 12.935 104 H SER 14 H SER 14 -11.418 7.029 15.584 105 HA SER 14 HA SER 14 -9.971 5.895 18.085 106 1HB SER 14 1HB SER 14 -8.364 6.189 16.146 107 2HB SER 14 2HB SER 14 -8.678 7.921 16.161 108 HG SER 14 HG SER 14 -7.701 6.371 18.330 109 H GLY 15 H GLY 15 -11.594 8.806 16.812 110 1HA GLY 15 1HA GLY 15 -12.287 10.785 17.927 111 2HA GLY 15 2HA GLY 15 -12.104 9.943 19.465 112 H LEU 16 H LEU 16 -9.832 10.889 16.948 113 HA LEU 16 HA LEU 16 -8.078 12.527 18.775 114 1HB LEU 16 1HB LEU 16 -6.389 12.428 17.085 115 2HB LEU 16 2HB LEU 16 -6.783 10.924 17.889 116 HG LEU 16 HG LEU 16 -7.930 10.060 16.116 117 1HD1 LEU 16 2HD1 LEU 16 -9.147 12.115 15.280 118 2HD1 LEU 16 3HD1 LEU 16 -7.590 12.583 14.523 119 3HD1 LEU 16 1HD1 LEU 16 -8.489 11.088 14.005 120 1HD2 LEU 16 3HD2 LEU 16 -5.934 9.297 15.784 121 2HD2 LEU 16 1HD2 LEU 16 -6.971 9.407 14.342 122 3HD2 LEU 16 2HD2 LEU 16 -5.673 10.563 14.535 123 H SER 17 H SER 17 -7.810 13.726 16.077 124 HA SER 17 HA SER 17 -10.052 15.806 16.115 125 1HB SER 17 1HB SER 17 -7.175 16.741 15.724 126 2HB SER 17 2HB SER 17 -8.632 17.704 15.709 127 HG SER 17 HG SER 17 -7.561 17.790 17.700 128 H LYS 18 H LYS 18 -10.339 16.874 14.096 129 HA LYS 18 HA LYS 18 -9.974 15.137 11.664 130 1HB LYS 18 1HB LYS 18 -12.008 16.685 12.122 131 2HB LYS 18 2HB LYS 18 -10.986 18.051 11.690 132 1HG LYS 18 1HG LYS 18 -10.634 17.055 9.401 133 2HG LYS 18 2HG LYS 18 -11.531 15.607 9.877 134 1HD LYS 18 1HD LYS 18 -13.596 16.933 10.246 135 2HD LYS 18 2HD LYS 18 -12.775 18.419 9.781 136 1HE LYS 18 1HE LYS 18 -13.182 15.952 7.942 137 2HE LYS 18 2HE LYS 18 -14.224 17.372 7.960 138 1HZ LYS 18 1HZ LYS 18 -12.363 18.726 7.259 139 2HZ LYS 18 2HZ LYS 18 -12.648 17.519 6.193 140 H LYS 19 H LYS 19 -8.528 18.174 12.818 141 HA LYS 19 HA LYS 19 -6.403 18.313 10.786 142 1HB LYS 19 2HB LYS 19 -7.097 20.245 12.255 143 2HB LYS 19 1HB LYS 19 -6.383 19.449 13.657 144 1HG LYS 19 1HG LYS 19 -4.881 21.158 12.882 145 2HG LYS 19 2HG LYS 19 -4.108 19.612 12.579 146 1HD LYS 19 1HD LYS 19 -4.750 19.759 10.134 147 2HD LYS 19 2HD LYS 19 -5.607 21.274 10.443 148 1HE LYS 19 1HE LYS 19 -3.420 22.361 11.158 149 2HE LYS 19 2HE LYS 19 -2.566 20.840 10.855 150 1HZ LYS 19 1HZ LYS 19 -4.045 22.429 8.832 151 2HZ LYS 19 2HZ LYS 19 -2.420 22.365 9.000 152 H ASP 20 H ASP 20 -6.584 16.483 13.937 153 HA ASP 20 HA ASP 20 -3.720 15.573 13.730 154 1HB ASP 20 1HB ASP 20 -6.035 14.683 15.543 155 2HB ASP 20 2HB ASP 20 -4.570 13.743 15.466 156 HD1 ASP 20 HD2 ASP 20 -2.499 15.948 17.112 157 H ALA 21 H ALA 21 -6.796 14.309 12.574 158 HA ALA 21 HA ALA 21 -5.749 11.664 11.711 159 1HB ALA 21 2HB ALA 21 -8.390 13.163 11.209 160 2HB ALA 21 3HB ALA 21 -7.993 11.601 10.433 161 3HB ALA 21 1HB ALA 21 -8.072 11.733 12.162 162 H THR 22 H THR 22 -6.282 14.815 10.006 163 HA THR 22 HA THR 22 -5.314 14.076 7.403 164 HB THR 22 HB THR 22 -4.748 16.805 8.747 165 HG1 THR 22 HG1 THR 22 -7.207 15.937 7.686 166 1HG2 THR 22 3HG2 THR 22 -5.580 15.946 5.910 167 2HG2 THR 22 1HG2 THR 22 -5.429 17.640 6.455 168 3HG2 THR 22 2HG2 THR 22 -3.984 16.568 6.400 169 H LYS 23 H LYS 23 -3.515 15.289 10.122 170 HA LYS 23 HA LYS 23 -0.799 15.033 9.003 171 1HB LYS 23 2HB LYS 23 -1.976 14.820 11.906 172 2HB LYS 23 1HB LYS 23 -0.271 14.761 11.670 173 1HG LYS 23 1HG LYS 23 -0.237 17.101 10.698 174 2HG LYS 23 2HG LYS 23 -1.989 17.205 10.875 175 1HD LYS 23 1HD LYS 23 -1.741 16.860 13.388 176 2HD LYS 23 2HD LYS 23 0.015 16.815 13.194 177 1HE LYS 23 1HE LYS 23 -0.019 19.182 12.277 178 2HE LYS 23 2HE LYS 23 -1.780 19.222 12.443 179 1HZ LYS 23 1HZ LYS 23 -1.498 18.853 14.832 180 2HZ LYS 23 2HZ LYS 23 0.130 18.826 14.679 181 H ALA 24 H ALA 24 -2.523 12.903 11.171 182 HA ALA 24 HA ALA 24 -0.591 10.835 11.374 183 1HB ALA 24 2HB ALA 24 -2.379 11.151 12.905 184 2HB ALA 24 3HB ALA 24 -3.607 10.725 11.652 185 3HB ALA 24 1HB ALA 24 -2.459 9.481 12.263 186 H VAL 25 H VAL 25 -3.075 11.108 8.925 187 HA VAL 25 HA VAL 25 -2.426 8.576 7.384 188 HB VAL 25 HB VAL 25 -3.806 11.409 7.016 189 1HG1 VAL 25 1HG2 VAL 25 -3.353 9.431 4.702 190 2HG1 VAL 25 2HG2 VAL 25 -4.549 10.780 4.661 191 3HG1 VAL 25 3HG2 VAL 25 -2.834 11.105 4.804 192 1HG2 VAL 25 3HG1 VAL 25 -5.107 9.739 8.246 193 2HG2 VAL 25 1HG1 VAL 25 -5.899 10.154 6.719 194 3HG2 VAL 25 2HG1 VAL 25 -5.013 8.600 6.895 195 H ASP 26 H ASP 26 -1.579 12.068 6.784 196 HA ASP 26 HA ASP 26 0.491 11.470 4.832 197 1HB ASP 26 1HB ASP 26 -0.549 13.778 5.294 198 2HB ASP 26 2HB ASP 26 0.455 13.915 6.726 199 HD1 ASP 26 HD2 ASP 26 1.944 14.342 2.974 200 H ALA 27 H ALA 27 0.700 11.457 8.303 201 HA ALA 27 HA ALA 27 3.506 11.011 8.836 202 1HB ALA 27 3HB ALA 27 0.934 10.018 10.154 203 2HB ALA 27 1HB ALA 27 2.503 9.949 10.873 204 3HB ALA 27 2HB ALA 27 1.738 11.528 10.586 205 H VAL 28 H VAL 28 0.968 8.678 8.116 206 HA VAL 28 HA VAL 28 2.695 6.288 8.174 207 HB VAL 28 HB VAL 28 0.221 6.489 6.288 208 1HG1 VAL 28 2HG2 VAL 28 2.093 4.415 7.002 209 2HG1 VAL 28 3HG2 VAL 28 0.511 3.959 7.651 210 3HG1 VAL 28 1HG2 VAL 28 0.670 4.403 5.915 211 1HG2 VAL 28 2HG1 VAL 28 0.008 5.871 9.212 212 2HG2 VAL 28 3HG1 VAL 28 -0.780 7.167 8.200 213 3HG2 VAL 28 1HG1 VAL 28 -1.197 5.470 7.919 214 H PHE 29 H PHE 29 1.237 7.987 5.584 215 HA PHE 29 HA PHE 29 2.880 6.985 3.341 216 1HB PHE 29 2HB PHE 29 0.800 9.247 3.400 217 2HB PHE 29 1HB PHE 29 1.297 8.413 1.954 218 HD1 PHE 29 HD1 PHE 29 1.172 5.573 2.346 219 HD2 PHE 29 HD2 PHE 29 -1.412 8.624 3.916 220 HE1 PHE 29 HE1 PHE 29 -0.575 3.894 2.741 221 HE2 PHE 29 HE2 PHE 29 -3.141 6.927 4.341 222 HZ PHE 29 HZ PHE 29 -2.699 4.559 3.799 223 H ASP 30 H ASP 30 3.911 9.190 5.560 224 HA ASP 30 HA ASP 30 5.796 10.462 3.563 225 1HB ASP 30 1HB ASP 30 4.816 11.835 5.535 226 2HB ASP 30 2HB ASP 30 5.835 10.927 6.621 227 HD2 ASP 30 HD2 ASP 30 8.674 12.722 5.954 228 H SER 31 H SER 31 5.881 8.461 6.409 229 HA SER 31 HA SER 31 8.773 7.704 6.307 230 1HB SER 31 1HB SER 31 6.549 6.018 7.553 231 2HB SER 31 2HB SER 31 8.282 5.863 7.855 232 HG SER 31 HG SER 31 8.288 8.000 8.651 233 H ILE 32 H ILE 32 5.803 6.122 4.741 234 HA ILE 32 HA ILE 32 7.101 3.936 3.642 235 HB ILE 32 HB ILE 32 4.705 5.423 2.533 236 1HG1 ILE 32 1HG1 ILE 32 5.032 3.306 4.693 237 2HG1 ILE 32 2HG1 ILE 32 4.561 4.949 4.903 238 1HG2 ILE 32 1HG2 ILE 32 6.292 3.111 1.619 239 2HG2 ILE 32 2HG2 ILE 32 4.799 2.448 2.240 240 3HG2 ILE 32 3HG2 ILE 32 4.805 3.682 0.928 241 1HD1 ILE 32 3HD1 ILE 32 2.732 3.201 3.316 242 2HD1 ILE 32 1HD1 ILE 32 2.710 3.360 5.110 243 3HD1 ILE 32 2HD1 ILE 32 2.470 4.810 4.095 244 H THR 33 H THR 33 6.374 7.099 2.148 245 HA THR 33 HA THR 33 7.933 6.683 -0.344 246 HB THR 33 HB THR 33 6.348 8.269 -0.552 247 HG1 THR 33 HG1 THR 33 8.288 8.903 -1.453 248 1HG2 THR 33 3HG2 THR 33 6.001 8.822 1.921 249 2HG2 THR 33 1HG2 THR 33 7.378 9.909 1.852 250 3HG2 THR 33 2HG2 THR 33 5.887 10.237 0.887 251 H GLU 34 H GLU 34 8.958 7.634 2.896 252 HA GLU 34 HA GLU 34 11.792 8.136 2.023 253 1HB GLU 34 1HB GLU 34 10.610 7.643 4.837 254 2HB GLU 34 2HB GLU 34 12.322 7.896 4.541 255 1HG GLU 34 1HG GLU 34 11.944 10.180 3.674 256 2HG GLU 34 2HG GLU 34 10.204 10.005 3.784 257 HE2 GLU 34 HE2 GLU 34 12.394 10.988 6.975 258 H ALA 35 H ALA 35 9.896 5.249 3.141 259 HA ALA 35 HA ALA 35 12.253 3.499 3.078 260 1HB ALA 35 3HB ALA 35 9.838 2.769 4.132 261 2HB ALA 35 1HB ALA 35 9.291 2.668 2.467 262 3HB ALA 35 2HB ALA 35 10.502 1.560 3.021 263 H LEU 36 H LEU 36 9.575 3.879 0.618 264 HA LEU 36 HA LEU 36 10.853 2.336 -1.390 265 1HB LEU 36 2HB LEU 36 8.874 4.569 -1.676 266 2HB LEU 36 1HB LEU 36 9.025 3.225 -2.766 267 HG LEU 36 HG LEU 36 8.125 2.820 0.137 268 1HD1 LEU 36 2HD1 LEU 36 6.200 3.265 -1.398 269 2HD1 LEU 36 3HD1 LEU 36 6.595 1.589 -2.038 270 3HD1 LEU 36 1HD1 LEU 36 6.218 1.845 -0.298 271 1HD2 LEU 36 3HD2 LEU 36 9.107 0.668 -1.329 272 2HD2 LEU 36 1HD2 LEU 36 9.499 1.258 0.296 273 3HD2 LEU 36 2HD2 LEU 36 7.949 0.499 0.020 274 NH1 ARG 37 NH2 ARG 37 12.126 12.527 0.898 275 NH2 ARG 37 NH1 ARG 37 13.719 12.053 2.450 276 H ARG 37 H ARG 37 11.093 5.859 -0.784 277 HA ARG 37 HA ARG 37 12.452 6.260 -3.289 278 1HB ARG 37 1HB ARG 37 13.007 8.479 -2.824 279 2HB ARG 37 2HB ARG 37 11.444 8.234 -2.088 280 1HG ARG 37 1HG ARG 37 12.825 7.863 0.169 281 2HG ARG 37 2HG ARG 37 14.212 8.467 -0.724 282 1HD ARG 37 1HD ARG 37 12.958 10.572 -1.269 283 2HD ARG 37 2HD ARG 37 11.583 9.973 -0.292 284 1HH1 ARG 37 2HH2 ARG 37 11.616 12.222 0.062 285 2HH1 ARG 37 1HH2 ARG 37 12.003 13.409 1.406 286 1HH2 ARG 37 1HH1 ARG 37 14.421 11.391 2.799 287 2HH2 ARG 37 2HH1 ARG 37 13.485 12.968 2.850 288 H LYS 38 H LYS 38 13.522 5.146 -0.084 289 HA LYS 38 HA LYS 38 16.403 5.728 -0.715 290 1HB LYS 38 1HB LYS 38 15.337 6.354 1.502 291 2HB LYS 38 2HB LYS 38 15.207 4.643 1.892 292 1HG LYS 38 1HG LYS 38 17.709 4.456 1.923 293 2HG LYS 38 2HG LYS 38 17.865 6.064 1.234 294 1HD LYS 38 1HD LYS 38 18.359 6.309 3.560 295 2HD LYS 38 2HD LYS 38 16.811 7.072 3.290 296 1HE LYS 38 1HE LYS 38 16.595 5.910 5.368 297 2HE LYS 38 2HE LYS 38 15.652 4.953 4.231 298 1HZ LYS 38 1HZ LYS 38 18.438 4.364 5.092 299 2HZ LYS 38 2HZ LYS 38 17.588 3.461 4.027 300 H GLY 39 H GLY 39 14.389 3.202 -1.580 301 1HA GLY 39 1HA GLY 39 14.804 0.948 -2.241 302 2HA GLY 39 2HA GLY 39 16.515 1.142 -1.870 303 H ASP 40 H ASP 40 13.666 1.540 0.124 304 HA ASP 40 HA ASP 40 14.434 -0.721 2.041 305 1HB ASP 40 1HB ASP 40 13.787 2.154 2.717 306 2HB ASP 40 2HB ASP 40 13.533 0.877 3.885 307 HD1 ASP 40 HD2 ASP 40 17.237 2.108 2.854 308 H LYS 41 H LYS 41 13.058 -1.828 3.112 309 HA LYS 41 HA LYS 41 10.304 -2.061 1.909 310 1HB LYS 41 2HB LYS 41 11.424 -3.792 4.177 311 2HB LYS 41 1HB LYS 41 9.962 -4.080 3.233 312 1HG LYS 41 1HG LYS 41 11.603 -4.245 1.154 313 2HG LYS 41 2HG LYS 41 12.886 -4.382 2.337 314 1HD LYS 41 1HD LYS 41 10.415 -6.230 2.124 315 2HD LYS 41 2HD LYS 41 12.007 -6.587 1.468 316 1HE LYS 41 1HE LYS 41 13.003 -6.608 3.793 317 2HE LYS 41 2HE LYS 41 11.423 -6.216 4.486 318 1HZ LYS 41 1HZ LYS 41 12.009 -8.640 2.881 319 2HZ LYS 41 2HZ LYS 41 10.555 -8.270 3.530 320 H VAL 42 H VAL 42 8.430 -1.366 2.967 321 HA VAL 42 HA VAL 42 8.405 0.040 5.467 322 HB VAL 42 HB VAL 42 6.346 -0.985 3.400 323 1HG1 VAL 42 3HG2 VAL 42 5.275 0.059 5.413 324 2HG1 VAL 42 1HG2 VAL 42 6.295 1.515 5.135 325 3HG1 VAL 42 2HG2 VAL 42 5.067 1.018 3.930 326 1HG2 VAL 42 2HG1 VAL 42 8.202 0.545 2.318 327 2HG2 VAL 42 3HG1 VAL 42 6.565 1.158 2.226 328 3HG2 VAL 42 1HG1 VAL 42 7.654 1.821 3.440 329 H GLN 43 H GLN 43 5.855 -1.309 5.836 330 HA GLN 43 HA GLN 43 5.265 -3.463 6.127 331 1HB GLN 43 1HB GLN 43 7.406 -4.248 7.938 332 2HB GLN 43 2HB GLN 43 5.844 -5.087 8.027 333 1HG GLN 43 1HG GLN 43 5.853 -5.641 5.709 334 2HG GLN 43 2HG GLN 43 7.272 -4.704 5.356 335 1HE2 GLN 43 2HE2 GLN 43 9.543 -7.303 6.430 336 2HE2 GLN 43 1HE2 GLN 43 9.326 -5.559 5.905 337 H LEU 44 H LEU 44 3.626 -4.358 6.936 338 HA LEU 44 HA LEU 44 2.147 -3.073 9.235 339 1HB LEU 44 2HB LEU 44 0.939 -3.228 6.410 340 2HB LEU 44 1HB LEU 44 0.050 -2.772 7.856 341 HG LEU 44 HG LEU 44 2.410 -1.145 6.719 342 1HD1 LEU 44 1HD1 LEU 44 0.636 -1.276 5.003 343 2HD1 LEU 44 2HD1 LEU 44 -0.589 -0.735 6.176 344 3HD1 LEU 44 3HD1 LEU 44 0.729 0.359 5.680 345 1HD2 LEU 44 2HD2 LEU 44 1.922 -0.627 9.128 346 2HD2 LEU 44 3HD2 LEU 44 1.476 0.734 8.082 347 3HD2 LEU 44 1HD2 LEU 44 0.209 -0.333 8.737 348 H ILE 45 H ILE 45 1.939 -5.043 10.316 349 HA ILE 45 HA ILE 45 2.090 -7.509 8.821 350 HB ILE 45 HB ILE 45 3.266 -7.034 10.979 351 1HG1 ILE 45 1HG1 ILE 45 1.829 -9.741 11.081 352 2HG1 ILE 45 2HG1 ILE 45 3.098 -9.362 9.928 353 1HG2 ILE 45 1HG2 ILE 45 1.339 -6.130 12.270 354 2HG2 ILE 45 2HG2 ILE 45 0.605 -7.751 12.342 355 3HG2 ILE 45 3HG2 ILE 45 2.163 -7.425 13.158 356 1HD1 ILE 45 2HD1 ILE 45 4.736 -8.937 11.803 357 2HD1 ILE 45 3HD1 ILE 45 3.477 -9.375 12.990 358 3HD1 ILE 45 1HD1 ILE 45 4.065 -10.585 11.830 359 H GLY 46 H GLY 46 -0.466 -6.156 9.640 360 1HA GLY 46 1HA GLY 46 -2.294 -8.616 9.061 361 2HA GLY 46 2HA GLY 46 -2.898 -7.270 9.996 362 H PHE 47 H PHE 47 -0.932 -6.174 7.353 363 HA PHE 47 HA PHE 47 -3.243 -5.973 5.425 364 1HB PHE 47 2HB PHE 47 -3.092 -4.157 7.304 365 2HB PHE 47 1HB PHE 47 -1.654 -3.556 6.542 366 HD1 PHE 47 HD2 PHE 47 -5.340 -4.150 5.983 367 HD2 PHE 47 HD1 PHE 47 -1.789 -2.280 4.420 368 HE1 PHE 47 HE2 PHE 47 -6.652 -3.085 4.178 369 HE2 PHE 47 HE1 PHE 47 -3.126 -1.286 2.613 370 HZ PHE 47 HZ PHE 47 -5.546 -1.817 2.440 371 H GLY 48 H GLY 48 0.338 -5.347 5.740 372 1HA GLY 48 1HA GLY 48 0.821 -5.972 3.084 373 2HA GLY 48 2HA GLY 48 0.525 -4.251 2.983 374 H ASN 49 H ASN 49 2.660 -5.792 2.181 375 HA ASN 49 HA ASN 49 5.011 -4.493 3.690 376 1HB ASN 49 1HB ASN 49 5.074 -6.941 4.015 377 2HB ASN 49 2HB ASN 49 4.931 -7.241 2.305 378 1HD2 ASN 49 1HD2 ASN 49 8.496 -7.762 2.838 379 2HD2 ASN 49 2HD2 ASN 49 6.850 -8.558 2.990 380 H PHE 50 H PHE 50 5.157 -2.704 2.469 381 HA PHE 50 HA PHE 50 5.032 -2.779 -0.547 382 1HB PHE 50 2HB PHE 50 5.841 -0.488 1.287 383 2HB PHE 50 1HB PHE 50 5.758 -0.301 -0.410 384 HD1 PHE 50 HD1 PHE 50 3.829 -0.862 2.694 385 HD2 PHE 50 HD2 PHE 50 3.946 0.884 -1.212 386 HE1 PHE 50 HE1 PHE 50 1.781 0.486 3.211 387 HE2 PHE 50 HE2 PHE 50 1.927 2.227 -0.643 388 HZ PHE 50 HZ PHE 50 0.744 1.773 1.445 389 H GLU 51 H GLU 51 6.776 -2.313 -1.860 390 HA GLU 51 HA GLU 51 9.244 -1.314 -0.909 391 1HB GLU 51 1HB GLU 51 10.941 -3.201 -1.091 392 2HB GLU 51 2HB GLU 51 9.752 -3.539 0.118 393 1HG GLU 51 1HG GLU 51 10.096 -5.607 -0.913 394 2HG GLU 51 2HG GLU 51 8.524 -5.099 -1.493 395 HE2 GLU 51 HE2 GLU 51 9.423 -5.412 -4.781 396 H VAL 52 H VAL 52 11.042 -0.648 -2.559 397 HA VAL 52 HA VAL 52 10.038 -0.721 -5.144 398 HB VAL 52 HB VAL 52 11.810 0.711 -3.123 399 1HG1 VAL 52 1HG2 VAL 52 12.466 0.844 -6.039 400 2HG1 VAL 52 2HG2 VAL 52 12.986 1.976 -4.704 401 3HG1 VAL 52 3HG2 VAL 52 13.494 0.251 -4.667 402 1HG2 VAL 52 1HG1 VAL 52 9.479 1.378 -3.802 403 2HG2 VAL 52 2HG1 VAL 52 10.709 2.604 -4.133 404 3HG2 VAL 52 3HG1 VAL 52 10.050 1.647 -5.475 405 NH1 ARG 53 NH2 ARG 53 10.477 -9.854 -7.222 406 NH2 ARG 53 NH1 ARG 53 12.613 -10.528 -7.608 407 H ARG 53 H ARG 53 10.807 -1.646 -6.770 408 HA ARG 53 HA ARG 53 13.201 -3.564 -6.556 409 1HB ARG 53 1HB ARG 53 10.684 -4.613 -6.534 410 2HB ARG 53 2HB ARG 53 10.783 -4.372 -8.269 411 1HG ARG 53 1HG ARG 53 12.721 -5.735 -8.513 412 2HG ARG 53 2HG ARG 53 13.023 -5.776 -6.773 413 1HD ARG 53 1HD ARG 53 10.847 -7.084 -6.440 414 2HD ARG 53 2HD ARG 53 10.578 -7.062 -8.194 415 1HH1 ARG 53 2HH2 ARG 53 9.823 -9.070 -7.112 416 2HH1 ARG 53 1HH2 ARG 53 10.252 -10.853 -7.168 417 1HH2 ARG 53 1HH1 ARG 53 13.588 -10.263 -7.791 418 2HH2 ARG 53 2HH1 ARG 53 12.240 -11.480 -7.527 419 H GLU 54 H GLU 54 13.063 -0.998 -7.711 420 HA GLU 54 HA GLU 54 14.506 -1.352 -10.038 421 1HB GLU 54 1HB GLU 54 12.457 -2.070 -11.130 422 2HB GLU 54 2HB GLU 54 12.028 -0.411 -11.161 423 1HG GLU 54 1HG GLU 54 14.064 0.041 -12.640 424 2HG GLU 54 2HG GLU 54 14.519 -1.656 -12.496 425 HE2 GLU 54 HE2 GLU 54 13.006 -1.252 -15.698 426 NH1 ARG 55 NH2 ARG 55 19.551 6.810 -9.622 427 NH2 ARG 55 NH1 ARG 55 18.756 6.447 -7.523 428 H ARG 55 H ARG 55 15.280 0.054 -11.360 429 HA ARG 55 HA ARG 55 15.971 2.021 -11.777 430 1HB ARG 55 1HB ARG 55 14.638 2.952 -10.359 431 2HB ARG 55 2HB ARG 55 15.760 3.153 -9.098 432 1HG ARG 55 1HG ARG 55 15.888 4.318 -12.014 433 2HG ARG 55 2HG ARG 55 15.191 5.189 -10.680 434 1HD ARG 55 1HD ARG 55 18.183 4.573 -11.091 435 2HD ARG 55 2HD ARG 55 17.368 6.115 -11.282 436 1HH1 ARG 55 2HH2 ARG 55 19.441 6.643 -10.629 437 2HH1 ARG 55 1HH2 ARG 55 20.286 7.361 -9.167 438 1HH2 ARG 55 1HH1 ARG 55 18.046 6.006 -6.928 439 2HH2 ARG 55 2HH1 ARG 55 19.547 7.023 -7.213 440 H ALA 56 H ALA 56 17.426 0.976 -12.927 441 HA ALA 56 HA ALA 56 20.282 1.621 -12.042 442 1HB ALA 56 2HB ALA 56 19.913 -0.832 -12.537 443 2HB ALA 56 3HB ALA 56 19.404 -0.415 -14.196 444 3HB ALA 56 1HB ALA 56 21.073 -0.100 -13.661 445 H ALA 57 H ALA 57 18.288 3.399 -13.199 446 HA ALA 57 HA ALA 57 19.446 4.406 -15.718 447 1HB ALA 57 1HB ALA 57 17.545 5.868 -13.788 448 2HB ALA 57 2HB ALA 57 17.990 6.425 -15.420 449 3HB ALA 57 3HB ALA 57 17.087 4.924 -15.228 450 NH1 ARG 58 NH2 ARG 58 21.733 3.999 -10.021 451 NH2 ARG 58 NH1 ARG 58 22.386 1.826 -10.118 452 H ARG 58 H ARG 58 21.319 4.946 -15.951 453 HA ARG 58 HA ARG 58 22.383 7.123 -14.212 454 1HB ARG 58 2HB ARG 58 24.425 5.386 -15.620 455 2HB ARG 58 1HB ARG 58 24.639 6.319 -14.164 456 1HG ARG 58 1HG ARG 58 23.007 3.699 -14.354 457 2HG ARG 58 2HG ARG 58 24.706 3.771 -13.959 458 1HD ARG 58 1HD ARG 58 24.215 5.116 -11.873 459 2HD ARG 58 2HD ARG 58 22.502 5.177 -12.305 460 1HH1 ARG 58 2HH2 ARG 58 21.794 4.940 -10.426 461 2HH1 ARG 58 1HH2 ARG 58 21.182 3.717 -9.203 462 1HH2 ARG 58 1HH1 ARG 58 22.940 1.107 -10.595 463 2HH2 ARG 58 2HH1 ARG 58 21.788 1.695 -9.295 464 H LYS 59 H LYS 59 24.460 8.199 -15.497 465 HA LYS 59 HA LYS 59 23.656 8.768 -18.337 466 1HB LYS 59 1HB LYS 59 23.240 11.171 -18.107 467 2HB LYS 59 2HB LYS 59 22.032 10.166 -17.347 468 1HG LYS 59 1HG LYS 59 22.981 10.671 -15.066 469 2HG LYS 59 2HG LYS 59 24.241 11.664 -15.791 470 1HD LYS 59 1HD LYS 59 22.473 13.192 -16.773 471 2HD LYS 59 2HD LYS 59 21.212 12.201 -16.028 472 1HE LYS 59 1HE LYS 59 22.165 12.720 -13.725 473 2HE LYS 59 2HE LYS 59 23.429 13.709 -14.471 474 1HZ LYS 59 1HZ LYS 59 21.610 15.059 -13.735 475 2HZ LYS 59 2HZ LYS 59 21.729 15.156 -15.363 476 H GLY 60 H GLY 60 25.913 7.747 -18.495 477 1HA GLY 60 1HA GLY 60 27.425 8.804 -20.047 478 2HA GLY 60 2HA GLY 60 27.707 10.118 -18.943 479 NH1 ARG 61 NH2 ARG 61 35.366 3.919 -20.635 480 NH2 ARG 61 NH1 ARG 61 35.426 1.794 -19.829 481 H ARG 61 H ARG 61 28.972 7.314 -20.113 482 HA ARG 61 HA ARG 61 30.395 6.171 -18.042 483 1HB ARG 61 1HB ARG 61 30.147 5.314 -20.386 484 2HB ARG 61 2HB ARG 61 31.459 6.371 -20.899 485 1HG ARG 61 1HG ARG 61 32.987 5.196 -19.212 486 2HG ARG 61 2HG ARG 61 31.640 4.160 -18.739 487 1HD ARG 61 1HD ARG 61 31.501 3.246 -21.090 488 2HD ARG 61 2HD ARG 61 32.820 4.290 -21.605 489 1HH1 ARG 61 2HH2 ARG 61 34.792 4.703 -20.963 490 2HH1 ARG 61 1HH2 ARG 61 36.390 3.891 -20.569 491 1HH2 ARG 61 1HH1 ARG 61 34.903 0.960 -19.542 492 2HH2 ARG 61 2HH1 ARG 61 36.445 1.915 -19.818 493 H ASN 62 H ASN 62 31.647 7.022 -16.620 494 HA ASN 62 HA ASN 62 33.862 9.023 -17.341 495 1HB ASN 62 1HB ASN 62 31.810 9.906 -16.050 496 2HB ASN 62 2HB ASN 62 32.287 8.892 -14.709 497 1HD2 ASN 62 2HD2 ASN 62 34.126 12.449 -15.085 498 2HD2 ASN 62 1HD2 ASN 62 32.707 11.899 -16.117 499 HA PRO 63 HA PRO 63 36.195 5.284 -15.762 500 1HB PRO 63 1HB PRO 63 38.509 7.203 -16.349 501 2HB PRO 63 2HB PRO 63 38.399 5.458 -16.665 502 1HG PRO 63 1HG PRO 63 37.964 7.201 -18.698 503 2HG PRO 63 2HG PRO 63 36.875 5.803 -18.522 504 1HD PRO 63 1HD PRO 63 36.356 8.706 -17.680 505 2HD PRO 63 2HD PRO 63 35.258 7.543 -18.484 506 H GLN 64 H GLN 64 36.720 8.565 -14.466 507 HA GLN 64 HA GLN 64 38.287 7.756 -12.090 508 1HB GLN 64 1HB GLN 64 38.281 10.097 -13.136 509 2HB GLN 64 2HB GLN 64 36.633 10.335 -12.592 510 1HG GLN 64 1HG GLN 64 37.308 10.179 -10.207 511 2HG GLN 64 2HG GLN 64 38.940 9.745 -10.677 512 1HE2 GLN 64 2HE2 GLN 64 37.848 13.718 -10.801 513 2HE2 GLN 64 1HE2 GLN 64 36.623 12.382 -10.513 514 H THR 65 H THR 65 35.184 9.229 -12.157 515 HA THR 65 HA THR 65 34.288 8.541 -9.581 516 HB THR 65 HB THR 65 32.147 9.568 -10.201 517 HG1 THR 65 HG1 THR 65 33.071 9.383 -12.853 518 1HG2 THR 65 2HG2 THR 65 34.217 11.118 -9.975 519 2HG2 THR 65 3HG2 THR 65 34.420 11.035 -11.727 520 3HG2 THR 65 1HG2 THR 65 32.957 11.778 -11.066 521 H GLY 66 H GLY 66 33.402 6.728 -12.503 522 1HA GLY 66 1HA GLY 66 32.692 4.363 -12.425 523 2HA GLY 66 2HA GLY 66 32.167 4.532 -10.768 524 H GLU 67 H GLU 67 31.139 6.965 -13.150 525 HA GLU 67 HA GLU 67 28.261 6.012 -12.971 526 1HB GLU 67 2HB GLU 67 28.829 8.445 -12.517 527 2HB GLU 67 1HB GLU 67 29.464 8.608 -14.160 528 1HG GLU 67 1HG GLU 67 27.139 8.027 -15.072 529 2HG GLU 67 2HG GLU 67 26.544 7.891 -13.422 530 HE1 GLU 67 HE2 GLU 67 27.551 11.523 -14.990 531 H GLU 68 H GLU 68 27.305 5.284 -14.801 532 HA GLU 68 HA GLU 68 29.059 4.705 -17.234 533 1HB GLU 68 1HB GLU 68 26.635 3.190 -16.067 534 2HB GLU 68 2HB GLU 68 27.293 2.815 -17.627 535 1HG GLU 68 1HG GLU 68 28.840 2.575 -14.979 536 2HG GLU 68 2HG GLU 68 28.118 1.263 -15.891 537 HE2 GLU 68 HE2 GLU 68 31.718 2.733 -16.858 538 H MET 69 H MET 69 28.039 4.825 -19.314 539 HA MET 69 HA MET 69 26.833 6.967 -20.337 540 1HB MET 69 1HB MET 69 26.774 6.080 -22.371 541 2HB MET 69 2HB MET 69 28.056 5.253 -21.562 542 1HG MET 69 1HG MET 69 25.437 3.723 -21.493 543 2HG MET 69 2HG MET 69 26.012 4.113 -23.105 544 1HE MET 69 3HE MET 69 26.483 2.346 -19.861 545 2HE MET 69 2HE MET 69 27.794 1.165 -20.109 546 3HE MET 69 1HE MET 69 28.184 2.861 -19.699 547 H GLU 70 H GLU 70 24.670 6.350 -22.134 548 HA GLU 70 HA GLU 70 22.474 7.309 -20.411 549 1HB GLU 70 2HB GLU 70 23.260 7.749 -23.041 550 2HB GLU 70 1HB GLU 70 22.005 6.619 -23.332 551 1HG GLU 70 1HG GLU 70 21.899 9.269 -21.673 552 2HG GLU 70 2HG GLU 70 21.438 9.132 -23.362 553 HE2 GLU 70 HE2 GLU 70 18.921 8.028 -20.409 554 H ILE 71 H ILE 71 22.093 5.585 -19.000 555 HA ILE 71 HA ILE 71 21.173 2.977 -20.028 556 HB ILE 71 HB ILE 71 21.277 3.352 -17.038 557 1HG1 ILE 71 1HG1 ILE 71 23.096 4.924 -17.517 558 2HG1 ILE 71 2HG1 ILE 71 23.533 3.530 -16.571 559 1HG2 ILE 71 2HG2 ILE 71 21.098 1.129 -18.164 560 2HG2 ILE 71 3HG2 ILE 71 22.678 1.408 -18.950 561 3HG2 ILE 71 1HG2 ILE 71 22.593 1.262 -17.178 562 1HD1 ILE 71 3HD1 ILE 71 24.199 3.854 -19.545 563 2HD1 ILE 71 1HD1 ILE 71 25.146 4.230 -18.123 564 3HD1 ILE 71 2HD1 ILE 71 24.808 2.561 -18.441 565 HA PRO 72 HA PRO 72 16.914 4.389 -18.852 566 1HB PRO 72 1HB PRO 72 15.395 2.733 -20.415 567 2HB PRO 72 2HB PRO 72 16.419 4.013 -21.084 568 1HG PRO 72 1HG PRO 72 17.061 1.023 -20.894 569 2HG PRO 72 2HG PRO 72 17.255 2.093 -22.301 570 1HD PRO 72 1HD PRO 72 19.347 1.462 -20.528 571 2HD PRO 72 2HD PRO 72 19.288 2.984 -21.464 572 H ALA 73 H ALA 73 16.007 3.966 -16.971 573 HA ALA 73 HA ALA 73 14.930 1.212 -16.221 574 1HB ALA 73 1HB ALA 73 17.239 1.684 -15.127 575 2HB ALA 73 2HB ALA 73 16.450 3.050 -14.270 576 3HB ALA 73 3HB ALA 73 15.880 1.403 -14.002 577 H SER 74 H SER 74 13.728 1.349 -14.231 578 HA SER 74 HA SER 74 13.134 3.701 -13.028 579 1HB SER 74 1HB SER 74 10.541 4.082 -13.357 580 2HB SER 74 2HB SER 74 11.561 4.564 -14.702 581 HG SER 74 HG SER 74 10.195 2.090 -14.445 582 H LYS 75 H LYS 75 12.902 3.214 -11.061 583 HA LYS 75 HA LYS 75 12.388 0.987 -9.418 584 1HB LYS 75 2HB LYS 75 11.203 3.073 -7.915 585 2HB LYS 75 1HB LYS 75 12.847 2.606 -7.876 586 1HG LYS 75 1HG LYS 75 12.373 4.998 -8.181 587 2HG LYS 75 2HG LYS 75 13.564 4.306 -9.227 588 1HD LYS 75 1HD LYS 75 12.559 4.834 -11.104 589 2HD LYS 75 2HD LYS 75 11.034 4.156 -10.604 590 1HE LYS 75 1HE LYS 75 9.910 6.008 -10.020 591 2HE LYS 75 2HE LYS 75 11.301 7.060 -9.970 592 1HZ LYS 75 1HZ LYS 75 10.220 5.752 -12.373 593 2HZ LYS 75 2HZ LYS 75 10.055 7.327 -11.970 594 H VAL 76 H VAL 76 10.884 -0.083 -8.538 595 HA VAL 76 HA VAL 76 8.194 0.445 -9.310 596 HB VAL 76 HB VAL 76 10.635 -1.428 -9.487 597 1HG1 VAL 76 3HG2 VAL 76 7.842 -2.512 -9.066 598 2HG1 VAL 76 1HG2 VAL 76 9.243 -3.461 -9.795 599 3HG1 VAL 76 2HG2 VAL 76 9.359 -2.809 -8.139 600 1HG2 VAL 76 2HG1 VAL 76 9.787 -0.341 -11.495 601 2HG2 VAL 76 3HG1 VAL 76 10.064 -2.062 -11.586 602 3HG2 VAL 76 1HG1 VAL 76 8.383 -1.430 -11.501 603 HA PRO 77 HA PRO 77 7.684 0.145 -4.786 604 1HB PRO 77 1HB PRO 77 5.769 2.213 -4.510 605 2HB PRO 77 2HB PRO 77 7.491 2.528 -4.714 606 1HG PRO 77 1HG PRO 77 5.293 2.558 -6.849 607 2HG PRO 77 2HG PRO 77 6.581 3.757 -6.628 608 1HD PRO 77 1HD PRO 77 6.691 1.524 -8.490 609 2HD PRO 77 2HD PRO 77 8.194 2.265 -7.844 610 H ALA 78 H ALA 78 6.937 -1.594 -4.652 611 HA ALA 78 HA ALA 78 4.293 -2.644 -5.530 612 1HB ALA 78 2HB ALA 78 6.556 -3.845 -5.593 613 2HB ALA 78 3HB ALA 78 6.625 -3.774 -3.813 614 3HB ALA 78 1HB ALA 78 5.353 -4.727 -4.616 615 H PHE 79 H PHE 79 3.136 -3.867 -3.957 616 HA PHE 79 HA PHE 79 2.891 -2.974 -1.048 617 1HB PHE 79 2HB PHE 79 1.734 -1.216 -1.701 618 2HB PHE 79 1HB PHE 79 0.890 -2.122 -3.006 619 HD1 PHE 79 HD2 PHE 79 1.063 -1.800 0.751 620 HD2 PHE 79 HD1 PHE 79 -1.214 -3.258 -2.596 621 HE1 PHE 79 HE2 PHE 79 -0.725 -2.530 2.267 622 HE2 PHE 79 HE1 PHE 79 -2.962 -4.039 -1.058 623 HZ PHE 79 HZ PHE 79 -2.700 -3.726 1.374 624 H LYS 80 H LYS 80 2.906 -4.864 -0.529 625 HA LYS 80 HA LYS 80 1.597 -7.499 -1.662 626 1HB LYS 80 2HB LYS 80 3.375 -7.077 0.756 627 2HB LYS 80 1HB LYS 80 2.528 -8.576 0.387 628 1HG LYS 80 1HG LYS 80 3.731 -8.814 -1.779 629 2HG LYS 80 2HG LYS 80 4.514 -7.258 -1.565 630 1HD LYS 80 1HD LYS 80 6.099 -9.001 -1.081 631 2HD LYS 80 2HD LYS 80 5.805 -8.073 0.376 632 1HE LYS 80 1HE LYS 80 4.288 -9.922 1.255 633 2HE LYS 80 2HE LYS 80 4.530 -10.835 -0.243 634 1HZ LYS 80 1HZ LYS 80 5.988 -11.596 1.484 635 2HZ LYS 80 2HZ LYS 80 6.876 -10.973 0.262 636 HA PRO 81 HA PRO 81 -1.895 -6.537 1.085 637 1HB PRO 81 1HB PRO 81 -3.458 -8.746 0.607 638 2HB PRO 81 2HB PRO 81 -3.113 -7.566 -0.657 639 1HG PRO 81 1HG PRO 81 -1.677 -10.237 -0.186 640 2HG PRO 81 2HG PRO 81 -2.428 -9.663 -1.699 641 1HD PRO 81 1HD PRO 81 0.286 -9.346 -1.115 642 2HD PRO 81 2HD PRO 81 -0.609 -8.167 -2.128 643 H GLY 82 H GLY 82 0.532 -7.471 2.287 644 1HA GLY 82 1HA GLY 82 1.606 -8.931 3.884 645 2HA GLY 82 2HA GLY 82 0.228 -8.334 4.788 646 H LYS 83 H LYS 83 -0.473 -10.497 2.259 647 HA LYS 83 HA LYS 83 -1.413 -12.728 2.204 648 1HB LYS 83 2HB LYS 83 0.365 -13.078 4.601 649 2HB LYS 83 1HB LYS 83 -1.079 -14.003 4.750 650 1HG LYS 83 1HG LYS 83 -0.612 -15.058 2.451 651 2HG LYS 83 2HG LYS 83 0.864 -14.095 2.336 652 1HD LYS 83 1HD LYS 83 1.757 -15.235 4.440 653 2HD LYS 83 2HD LYS 83 0.270 -16.164 4.548 654 1HE LYS 83 1HE LYS 83 1.897 -17.634 3.578 655 2HE LYS 83 2HE LYS 83 0.772 -17.235 2.283 656 1HZ LYS 83 1HZ LYS 83 3.454 -16.026 2.714 657 2HZ LYS 83 2HZ LYS 83 3.073 -17.138 1.579 658 H ALA 84 H ALA 84 -1.757 -11.173 5.143 659 HA ALA 84 HA ALA 84 -4.232 -12.111 6.303 660 1HB ALA 84 2HB ALA 84 -2.375 -10.852 7.416 661 2HB ALA 84 3HB ALA 84 -2.677 -9.433 6.377 662 3HB ALA 84 1HB ALA 84 -3.906 -9.925 7.575 663 H LEU 85 H LEU 85 -3.664 -9.129 4.238 664 HA LEU 85 HA LEU 85 -6.514 -8.460 4.047 665 1HB LEU 85 2HB LEU 85 -4.833 -6.674 3.762 666 2HB LEU 85 1HB LEU 85 -4.090 -7.536 2.433 667 HG LEU 85 HG LEU 85 -6.355 -7.500 1.332 668 1HD1 LEU 85 2HD1 LEU 85 -7.786 -6.709 3.186 669 2HD1 LEU 85 3HD1 LEU 85 -6.915 -5.160 3.200 670 3HD1 LEU 85 1HD1 LEU 85 -7.912 -5.616 1.793 671 1HD2 LEU 85 1HD2 LEU 85 -4.361 -6.112 0.547 672 2HD2 LEU 85 2HD2 LEU 85 -5.874 -5.256 0.247 673 3HD2 LEU 85 3HD2 LEU 85 -4.849 -4.795 1.632 674 H LYS 86 H LYS 86 -4.220 -10.409 2.176 675 HA LYS 86 HA LYS 86 -5.981 -11.053 -0.055 676 1HB LYS 86 1HB LYS 86 -3.414 -11.623 0.195 677 2HB LYS 86 2HB LYS 86 -3.953 -13.117 0.935 678 1HG LYS 86 1HG LYS 86 -5.327 -13.605 -1.164 679 2HG LYS 86 2HG LYS 86 -4.730 -12.106 -1.876 680 1HD LYS 86 1HD LYS 86 -2.354 -12.968 -1.700 681 2HD LYS 86 2HD LYS 86 -2.951 -14.467 -0.976 682 1HE LYS 86 1HE LYS 86 -4.287 -14.957 -3.088 683 2HE LYS 86 2HE LYS 86 -3.684 -13.459 -3.815 684 1HZ LYS 86 1HZ LYS 86 -2.385 -15.328 -4.511 685 2HZ LYS 86 2HZ LYS 86 -1.442 -14.317 -3.639 686 H ASP 87 H ASP 87 -6.085 -12.289 3.264 687 HA ASP 87 HA ASP 87 -8.100 -14.396 2.594 688 1HB ASP 87 1HB ASP 87 -6.202 -13.870 4.721 689 2HB ASP 87 2HB ASP 87 -7.704 -13.453 5.436 690 HD1 ASP 87 HD2 ASP 87 -6.741 -17.274 4.372 691 H ALA 88 H ALA 88 -8.086 -11.114 4.048 692 HA ALA 88 HA ALA 88 -10.882 -10.732 4.713 693 1HB ALA 88 1HB ALA 88 -8.962 -9.001 5.103 694 2HB ALA 88 2HB ALA 88 -8.969 -8.662 3.371 695 3HB ALA 88 3HB ALA 88 -10.393 -8.276 4.307 696 H VAL 89 H VAL 89 -9.186 -10.332 1.579 697 HA VAL 89 HA VAL 89 -11.496 -9.193 0.187 698 HB VAL 89 HB VAL 89 -8.881 -8.511 0.584 699 1HG1 VAL 89 2HG2 VAL 89 -8.098 -10.802 -0.326 700 2HG1 VAL 89 3HG2 VAL 89 -8.469 -10.177 -1.938 701 3HG1 VAL 89 1HG2 VAL 89 -7.291 -9.332 -0.885 702 1HG2 VAL 89 2HG1 VAL 89 -10.411 -7.236 -0.584 703 2HG2 VAL 89 3HG1 VAL 89 -8.786 -7.277 -1.316 704 3HG2 VAL 89 1HG1 VAL 89 -10.134 -8.212 -2.084 705 H LYS 90 H LYS 90 -10.277 -12.374 0.520 706 HA LYS 90 HA LYS 90 -10.802 -13.462 -2.153 707 1HB LYS 90 1HB LYS 90 -9.996 -14.460 0.595 708 2HB LYS 90 2HB LYS 90 -10.947 -15.618 -0.286 709 1HG LYS 90 1HG LYS 90 -9.389 -15.588 -2.215 710 2HG LYS 90 2HG LYS 90 -8.453 -14.286 -1.487 711 1HD LYS 90 1HD LYS 90 -7.951 -15.809 0.515 712 2HD LYS 90 2HD LYS 90 -8.817 -17.116 -0.299 713 1HE LYS 90 1HE LYS 90 -7.168 -16.996 -2.233 714 2HE LYS 90 2HE LYS 90 -6.316 -15.674 -1.421 715 1HZ LYS 90 1HZ LYS 90 -6.669 -18.400 -0.307 716 2HZ LYS 90 2HZ LYS 90 -5.885 -17.175 0.439 717 1H MET 1 1H MET 91 10.249 -0.752 7.701 718 2H MET 1 2H MET 91 11.143 -1.761 8.707 719 HA MET 1 HA MET 91 9.895 -0.991 10.276 720 1HB MET 1 1HB MET 91 7.800 -0.257 8.138 721 2HB MET 1 2HB MET 91 7.586 0.043 9.841 722 1HG MET 1 1HG MET 91 9.849 1.366 9.788 723 2HG MET 1 2HG MET 91 9.719 1.316 8.027 724 1HE MET 1 2HE MET 91 8.125 2.822 6.616 725 2HE MET 1 1HE MET 91 6.700 1.897 7.203 726 3HE MET 1 3HE MET 91 6.695 3.673 7.266 727 H ASN 2 H ASN 92 6.774 -1.928 9.752 728 HA ASN 2 HA ASN 92 6.547 -4.553 9.891 729 1HB ASN 2 1HB ASN 92 6.627 -5.693 11.924 730 2HB ASN 2 2HB ASN 92 8.182 -4.950 11.680 731 1HD2 ASN 2 1HD2 ASN 92 8.090 -3.190 14.799 732 2HD2 ASN 2 2HD2 ASN 92 8.978 -3.497 13.223 733 H LYS 3 H LYS 93 5.562 -1.869 11.725 734 HA LYS 3 HA LYS 93 3.051 -1.220 11.236 735 1HB LYS 3 1HB LYS 93 2.097 -3.548 11.328 736 2HB LYS 3 2HB LYS 93 2.525 -3.693 13.014 737 1HG LYS 3 1HG LYS 93 0.864 -2.061 13.675 738 2HG LYS 3 2HG LYS 93 0.722 -1.382 12.067 739 1HD LYS 3 1HD LYS 93 -0.193 -4.261 12.671 740 2HD LYS 3 2HD LYS 93 -1.210 -2.863 13.001 741 1HE LYS 3 1HE LYS 93 -1.102 -2.145 10.578 742 2HE LYS 3 2HE LYS 93 -0.091 -3.542 10.206 743 1HZ LYS 3 1HZ LYS 93 -2.861 -3.639 11.248 744 2HZ LYS 3 2HZ LYS 93 -2.399 -3.940 9.709 745 H THR 4 H THR 94 5.308 -2.007 13.841 746 HA THR 4 HA THR 94 4.113 -0.128 15.741 747 HB THR 4 HB THR 94 6.210 -2.404 15.795 748 HG1 THR 4 HG1 THR 94 3.639 -2.107 17.006 749 1HG2 THR 4 3HG2 THR 94 5.207 -0.504 17.914 750 2HG2 THR 4 1HG2 THR 94 6.093 -2.074 18.246 751 3HG2 THR 4 2HG2 THR 94 6.886 -0.749 17.302 752 H GLU 5 H GLU 95 6.813 -0.638 13.613 753 HA GLU 5 HA GLU 95 8.422 1.746 14.557 754 1HB GLU 5 1HB GLU 95 8.508 0.440 11.787 755 2HB GLU 5 2HB GLU 95 9.615 1.661 12.377 756 1HG GLU 5 1HG GLU 95 9.385 -1.252 13.311 757 2HG GLU 5 2HG GLU 95 10.641 -0.573 12.314 758 HE2 GLU 5 HE2 GLU 95 10.761 -0.236 16.319 759 H LEU 6 H LEU 96 5.472 1.062 12.742 760 HA LEU 6 HA LEU 96 5.208 3.691 11.499 761 1HB LEU 6 2HB LEU 96 3.972 1.045 11.335 762 2HB LEU 6 1HB LEU 96 2.750 1.986 12.143 763 HG LEU 6 HG LEU 96 2.578 2.085 9.713 764 1HD1 LEU 6 2HD1 LEU 96 2.045 4.254 11.065 765 2HD1 LEU 6 3HD1 LEU 96 3.482 4.934 10.285 766 3HD1 LEU 6 1HD1 LEU 96 2.113 4.381 9.309 767 1HD2 LEU 6 2HD2 LEU 96 4.863 1.646 8.961 768 2HD2 LEU 6 3HD2 LEU 96 4.074 2.948 8.042 769 3HD2 LEU 6 1HD2 LEU 96 5.280 3.349 9.283 770 H ILE 7 H ILE 97 4.076 2.079 14.530 771 HA ILE 7 HA ILE 97 2.311 4.226 15.377 772 HB ILE 7 HB ILE 97 3.861 2.265 17.172 773 1HG1 ILE 7 1HG1 ILE 97 0.948 2.051 16.238 774 2HG1 ILE 7 2HG1 ILE 97 2.184 1.380 15.270 775 1HG2 ILE 7 2HG2 ILE 97 2.880 4.249 18.479 776 2HG2 ILE 7 3HG2 ILE 97 1.294 3.842 17.824 777 3HG2 ILE 7 1HG2 ILE 97 2.111 2.711 18.913 778 1HD1 ILE 7 1HD1 ILE 97 2.967 0.039 17.391 779 2HD1 ILE 7 2HD1 ILE 97 1.327 0.349 17.943 780 3HD1 ILE 7 3HD1 ILE 97 1.592 -0.481 16.374 781 H ASN 8 H ASN 98 5.744 3.635 16.109 782 HA ASN 8 HA ASN 98 6.163 6.362 17.292 783 1HB ASN 8 1HB ASN 98 8.272 4.379 16.140 784 2HB ASN 8 2HB ASN 98 8.676 5.864 16.965 785 1HD2 ASN 8 2HD2 ASN 98 7.801 2.629 19.279 786 2HD2 ASN 8 1HD2 ASN 98 7.662 2.582 17.450 787 H ALA 9 H ALA 99 5.686 5.506 14.025 788 HA ALA 9 HA ALA 99 7.258 7.767 12.803 789 1HB ALA 9 2HB ALA 99 6.437 5.606 11.370 790 2HB ALA 9 3HB ALA 99 4.804 6.218 11.567 791 3HB ALA 9 1HB ALA 99 5.908 7.187 10.683 792 H VAL 10 H VAL 100 3.881 6.985 13.662 793 HA VAL 10 HA VAL 100 2.819 9.432 12.685 794 HB VAL 10 HB VAL 100 1.139 7.829 14.578 795 1HG1 VAL 10 3HG2 VAL 100 0.431 9.909 13.207 796 2HG1 VAL 10 1HG2 VAL 100 0.509 8.818 11.798 797 3HG1 VAL 10 2HG2 VAL 100 -0.608 8.438 13.138 798 1HG2 VAL 10 1HG1 VAL 100 2.242 6.818 11.931 799 2HG2 VAL 10 2HG1 VAL 100 2.051 6.049 13.542 800 3HG2 VAL 10 3HG1 VAL 100 0.610 6.302 12.511 801 H ALA 11 H ALA 101 3.294 8.112 15.715 802 HA ALA 11 HA ALA 101 2.602 10.495 17.072 803 1HB ALA 11 2HB ALA 101 2.583 8.246 18.234 804 2HB ALA 11 3HB ALA 101 4.361 8.164 18.144 805 3HB ALA 11 1HB ALA 101 3.565 9.379 19.196 806 H GLU 12 H GLU 102 5.662 9.652 15.598 807 HA GLU 12 HA GLU 102 7.100 11.943 16.914 808 1HB GLU 12 1HB GLU 102 8.415 9.919 16.226 809 2HB GLU 12 2HB GLU 102 7.995 10.203 14.544 810 1HG GLU 12 1HG GLU 102 10.262 10.959 14.903 811 2HG GLU 12 2HG GLU 102 9.286 12.378 14.587 812 HE1 GLU 12 HE2 GLU 102 11.050 11.746 18.186 813 H THR 13 H THR 103 5.788 11.264 13.597 814 HA THR 13 HA THR 103 6.103 14.030 12.759 815 HB THR 13 HB THR 103 4.455 13.424 10.842 816 HG1 THR 13 HG1 THR 103 3.634 11.345 10.938 817 1HG2 THR 13 2HG2 THR 103 6.511 11.188 11.236 818 2HG2 THR 13 3HG2 THR 103 5.538 11.495 9.786 819 3HG2 THR 13 1HG2 THR 103 6.732 12.705 10.313 820 H SER 14 H SER 104 3.927 13.128 14.796 821 HA SER 14 HA SER 104 2.116 15.585 14.290 822 1HB SER 14 1HB SER 104 0.998 13.523 13.320 823 2HB SER 14 2HB SER 104 0.923 12.816 14.935 824 HG SER 14 HG SER 104 -0.963 13.903 14.352 825 H GLY 15 H GLY 105 3.297 13.354 16.823 826 1HA GLY 15 1HA GLY 105 3.270 13.576 19.186 827 2HA GLY 15 2HA GLY 105 2.898 15.286 18.989 828 H LEU 16 H LEU 106 1.244 12.258 18.312 829 HA LEU 16 HA LEU 106 -1.223 12.944 19.911 830 1HB LEU 16 1HB LEU 106 -2.367 11.229 18.694 831 2HB LEU 16 2HB LEU 106 -1.904 12.658 17.793 832 HG LEU 16 HG LEU 106 -0.196 11.630 16.674 833 1HD1 LEU 16 2HD1 LEU 106 0.801 10.202 18.535 834 2HD1 LEU 16 3HD1 LEU 106 -0.535 9.063 18.188 835 3HD1 LEU 16 1HD1 LEU 106 0.733 9.445 16.939 836 1HD2 LEU 16 2HD2 LEU 106 -1.890 11.336 15.370 837 2HD2 LEU 16 3HD2 LEU 106 -0.563 10.159 15.191 838 3HD2 LEU 16 1HD2 LEU 106 -2.047 9.648 15.972 839 H SER 17 H SER 107 -1.066 9.993 19.846 840 HA SER 17 HA SER 107 0.555 9.429 22.384 841 1HB SER 17 1HB SER 107 -2.249 8.265 22.116 842 2HB SER 17 2HB SER 107 -1.110 8.044 23.422 843 HG SER 17 HG SER 107 -1.190 10.294 23.813 844 H LYS 18 H LYS 108 1.104 7.208 22.663 845 HA LYS 18 HA LYS 108 1.770 5.744 20.113 846 1HB LYS 18 1HB LYS 108 2.401 5.177 23.051 847 2HB LYS 18 2HB LYS 108 2.371 3.834 21.937 848 1HG LYS 18 1HG LYS 108 4.641 4.610 22.108 849 2HG LYS 18 2HG LYS 108 4.058 4.819 20.466 850 1HD LYS 18 1HD LYS 108 3.693 7.309 20.951 851 2HD LYS 18 2HD LYS 108 4.363 7.063 22.568 852 1HE LYS 18 1HE LYS 108 6.554 6.285 21.509 853 2HE LYS 18 2HE LYS 108 5.849 6.516 19.901 854 1HZ LYS 18 1HZ LYS 108 5.546 8.864 20.435 855 2HZ LYS 18 2HZ LYS 108 6.194 8.660 21.922 856 H LYS 19 H LYS 109 -0.589 5.301 22.728 857 HA LYS 19 HA LYS 109 -2.081 3.106 21.415 858 1HB LYS 19 2HB LYS 109 -3.056 5.211 23.441 859 2HB LYS 19 1HB LYS 109 -4.059 3.879 22.889 860 1HG LYS 19 1HG LYS 109 -1.433 3.617 24.467 861 2HG LYS 19 2HG LYS 109 -3.046 3.481 25.126 862 1HD LYS 19 1HD LYS 109 -1.780 1.533 23.095 863 2HD LYS 19 2HD LYS 109 -1.916 1.285 24.828 864 1HE LYS 19 1HE LYS 109 -4.462 1.331 24.646 865 2HE LYS 19 2HE LYS 109 -4.320 1.522 22.892 866 1HZ LYS 19 1HZ LYS 109 -4.637 -0.761 23.475 867 2HZ LYS 19 2HZ LYS 109 -3.165 -0.583 22.785 868 H ASP 20 H ASP 110 -2.287 6.719 20.999 869 HA ASP 20 HA ASP 110 -4.677 6.442 19.175 870 1HB ASP 20 1HB ASP 110 -2.870 8.824 19.913 871 2HB ASP 20 2HB ASP 110 -3.900 8.942 18.516 872 HD2 ASP 20 HD2 ASP 110 -5.467 9.248 22.169 873 H ALA 21 H ALA 111 -1.203 6.446 18.688 874 HA ALA 21 HA ALA 111 -1.307 6.688 15.723 875 1HB ALA 21 1HB ALA 111 0.931 5.969 17.717 876 2HB ALA 21 2HB ALA 111 1.155 6.006 15.940 877 3HB ALA 21 3HB ALA 111 0.691 7.437 16.809 878 H THR 22 H THR 112 -1.125 3.889 18.010 879 HA THR 22 HA THR 112 -1.023 1.777 16.032 880 HB THR 22 HB THR 112 -2.455 1.594 18.769 881 HG1 THR 22 HG1 THR 112 -0.443 1.131 19.632 882 1HG2 THR 22 2HG2 THR 112 -0.719 -0.332 17.108 883 2HG2 THR 22 3HG2 THR 112 -1.307 -0.668 18.762 884 3HG2 THR 22 1HG2 THR 112 -2.472 -0.471 17.402 885 H LYS 23 H LYS 113 -3.760 3.279 17.595 886 HA LYS 23 HA LYS 113 -5.933 1.919 16.155 887 1HB LYS 23 2HB LYS 113 -5.597 4.784 17.375 888 2HB LYS 23 1HB LYS 113 -7.116 4.301 16.713 889 1HG LYS 23 1HG LYS 113 -7.368 2.422 18.376 890 2HG LYS 23 2HG LYS 113 -5.787 2.788 19.059 891 1HD LYS 23 1HD LYS 113 -6.622 5.120 19.706 892 2HD LYS 23 2HD LYS 113 -8.189 4.714 19.028 893 1HE LYS 23 1HE LYS 113 -8.404 4.438 21.397 894 2HE LYS 23 2HE LYS 113 -8.433 2.814 20.716 895 1HZ LYS 23 1HZ LYS 113 -6.114 2.559 21.349 896 2HZ LYS 23 2HZ LYS 113 -7.031 2.932 22.649 897 H ALA 24 H ALA 114 -4.493 5.047 15.566 898 HA ALA 24 HA ALA 114 -5.939 5.781 13.242 899 1HB ALA 24 2HB ALA 114 -4.775 7.330 14.628 900 2HB ALA 24 3HB ALA 114 -3.180 6.625 14.190 901 3HB ALA 24 1HB ALA 114 -4.162 7.497 12.958 902 H VAL 25 H VAL 115 -2.940 3.949 13.323 903 HA VAL 25 HA VAL 115 -2.715 3.520 10.368 904 HB VAL 25 HB VAL 115 -1.775 2.290 13.138 905 1HG1 VAL 25 2HG2 VAL 115 -1.203 0.853 10.473 906 2HG1 VAL 25 3HG2 VAL 115 -0.418 0.514 12.056 907 3HG1 VAL 25 1HG2 VAL 115 -2.135 0.219 11.837 908 1HG2 VAL 25 1HG1 VAL 115 -0.561 4.244 12.294 909 2HG2 VAL 25 2HG1 VAL 115 0.473 2.821 12.442 910 3HG2 VAL 25 3HG1 VAL 115 -0.093 3.349 10.819 911 H ASP 26 H ASP 116 -4.055 1.382 12.958 912 HA ASP 26 HA ASP 116 -5.680 -0.172 10.922 913 1HB ASP 26 1HB ASP 116 -5.702 -0.191 14.010 914 2HB ASP 26 2HB ASP 116 -6.660 -1.283 13.021 915 HD2 ASP 26 HD2 ASP 116 -3.646 -0.563 14.195 916 H ALA 27 H ALA 117 -6.130 2.601 11.459 917 HA ALA 27 HA ALA 117 -9.156 2.845 11.420 918 1HB ALA 27 3HB ALA 117 -6.985 4.932 11.689 919 2HB ALA 27 1HB ALA 117 -8.708 5.184 11.755 920 3HB ALA 27 2HB ALA 117 -7.929 4.300 13.059 921 H VAL 28 H VAL 118 -6.289 3.984 9.681 922 HA VAL 28 HA VAL 118 -7.579 4.732 7.106 923 HB VAL 28 HB VAL 118 -4.664 3.829 7.806 924 1HG1 VAL 28 1HG2 VAL 118 -5.706 5.120 5.216 925 2HG1 VAL 28 2HG2 VAL 118 -3.980 4.969 5.672 926 3HG1 VAL 28 3HG2 VAL 118 -4.926 3.499 5.424 927 1HG2 VAL 28 1HG1 VAL 118 -5.332 5.912 8.823 928 2HG2 VAL 28 2HG1 VAL 118 -4.042 6.089 7.577 929 3HG2 VAL 28 3HG1 VAL 118 -5.772 6.544 7.177 930 H PHE 29 H PHE 119 -5.569 2.143 8.080 931 HA PHE 29 HA PHE 119 -6.051 0.292 5.821 932 1HB PHE 29 2HB PHE 119 -4.669 -0.401 8.446 933 2HB PHE 29 1HB PHE 119 -4.569 -1.335 6.966 934 HD1 PHE 29 HD1 PHE 119 -4.048 0.405 4.749 935 HD2 PHE 29 HD2 PHE 119 -2.643 0.794 8.787 936 HE1 PHE 29 HE1 PHE 119 -2.455 2.112 4.026 937 HE2 PHE 29 HE2 PHE 119 -1.111 2.558 8.078 938 HZ PHE 29 HZ PHE 119 -1.115 3.295 5.694 939 H ASP 30 H ASP 120 -7.967 0.675 8.664 940 HA ASP 30 HA ASP 120 -9.309 -1.973 8.210 941 1HB ASP 30 1HB ASP 120 -9.100 -0.630 10.478 942 2HB ASP 30 2HB ASP 120 -10.443 0.335 9.932 943 HD1 ASP 30 HD2 ASP 120 -12.879 -2.069 10.408 944 H SER 31 H SER 121 -9.845 1.311 7.479 945 HA SER 31 HA SER 121 -12.575 1.002 6.200 946 1HB SER 31 2HB SER 121 -10.679 3.419 6.152 947 2HB SER 31 1HB SER 121 -12.294 3.376 5.411 948 HG SER 31 HG SER 121 -11.697 2.859 8.135 949 H ILE 32 H ILE 122 -9.108 1.181 4.833 950 HA ILE 32 HA ILE 122 -9.751 0.862 2.130 951 HB ILE 32 HB ILE 122 -7.328 -0.381 3.400 952 1HG1 ILE 32 1HG1 ILE 122 -8.171 2.471 3.476 953 2HG1 ILE 32 2HG1 ILE 122 -7.254 1.421 4.536 954 1HG2 ILE 32 3HG2 ILE 122 -8.109 -0.416 0.798 955 2HG2 ILE 32 1HG2 ILE 122 -7.481 1.205 0.793 956 3HG2 ILE 32 2HG2 ILE 122 -6.404 -0.127 1.209 957 1HD1 ILE 32 2HD1 ILE 122 -6.078 2.680 2.079 958 2HD1 ILE 32 3HD1 ILE 122 -6.163 3.420 3.695 959 3HD1 ILE 32 1HD1 ILE 122 -5.232 1.890 3.495 960 H THR 33 H THR 123 -8.923 -1.650 4.511 961 HA THR 33 HA THR 123 -9.533 -3.876 2.646 962 HB THR 33 HB THR 123 -8.237 -4.348 4.670 963 HG1 THR 33 HG1 THR 123 -9.456 -6.025 3.817 964 1HG2 THR 33 2HG2 THR 123 -9.448 -2.768 6.223 965 2HG2 THR 33 3HG2 THR 123 -10.707 -3.969 6.454 966 3HG2 THR 33 1HG2 THR 123 -9.008 -4.311 6.962 967 H GLU 34 H GLU 124 -11.727 -1.992 4.611 968 HA GLU 34 HA GLU 124 -14.136 -3.658 3.959 969 1HB GLU 34 1HB GLU 124 -14.048 -2.192 6.012 970 2HB GLU 34 2HB GLU 124 -13.905 -0.753 5.007 971 1HG GLU 34 1HG GLU 124 -16.202 -1.136 4.077 972 2HG GLU 34 2HG GLU 124 -16.338 -2.658 4.952 973 HE1 GLU 34 HE2 GLU 124 -16.749 0.922 6.811 974 H ALA 35 H ALA 125 -12.521 -0.852 2.464 975 HA ALA 35 HA ALA 125 -14.422 -0.619 0.243 976 1HB ALA 35 1HB ALA 125 -12.462 1.221 0.767 977 2HB ALA 35 2HB ALA 125 -11.328 0.038 0.160 978 3HB ALA 35 3HB ALA 125 -12.481 0.725 -0.929 979 H LEU 36 H LEU 126 -11.250 -2.324 0.448 980 HA LEU 36 HA LEU 126 -11.265 -3.526 -2.190 981 1HB LEU 36 2HB LEU 126 -9.841 -4.571 0.186 982 2HB LEU 36 1HB LEU 126 -9.416 -4.728 -1.501 983 HG LEU 36 HG LEU 126 -9.198 -2.153 0.108 984 1HD1 LEU 36 3HD2 LEU 126 -7.238 -3.499 0.158 985 2HD1 LEU 36 1HD2 LEU 126 -7.159 -3.487 -1.662 986 3HD1 LEU 36 2HD2 LEU 126 -6.964 -1.971 -0.719 987 1HD2 LEU 36 3HD1 LEU 126 -10.275 -1.424 -2.022 988 2HD2 LEU 36 1HD1 LEU 126 -8.630 -0.843 -1.881 989 3HD2 LEU 36 2HD1 LEU 126 -8.987 -2.250 -2.946 990 NH1 ARG 37 NH2 ARG 127 -13.775 -5.476 6.600 991 NH2 ARG 37 NH1 ARG 127 -15.939 -4.848 6.881 992 H ARG 37 H ARG 127 -12.335 -4.866 0.995 993 HA ARG 37 HA ARG 127 -12.956 -7.380 -0.234 994 1HB ARG 37 1HB ARG 127 -13.966 -8.212 1.721 995 2HB ARG 37 2HB ARG 127 -12.621 -7.223 2.244 996 1HG ARG 37 1HG ARG 127 -14.351 -5.330 2.698 997 2HG ARG 37 2HG ARG 127 -15.629 -6.475 2.330 998 1HD ARG 37 1HD ARG 127 -14.974 -7.971 4.121 999 2HD ARG 37 2HD ARG 127 -13.540 -6.991 4.494 1000 1HH1 ARG 37 2HH2 ARG 127 -13.088 -5.988 6.035 1001 2HH1 ARG 37 1HH2 ARG 127 -13.594 -4.957 7.466 1002 1HH2 ARG 37 1HH1 ARG 127 -16.904 -4.874 6.531 1003 2HH2 ARG 37 2HH1 ARG 127 -15.604 -4.370 7.725 1004 H LYS 38 H LYS 128 -14.714 -4.331 -0.023 1005 HA LYS 38 HA LYS 128 -17.377 -5.643 -0.651 1006 1HB LYS 38 1HB LYS 128 -16.767 -2.750 0.134 1007 2HB LYS 38 2HB LYS 128 -18.345 -3.283 -0.392 1008 1HG LYS 38 1HG LYS 128 -18.584 -4.867 1.492 1009 2HG LYS 38 2HG LYS 128 -16.953 -4.518 2.041 1010 1HD LYS 38 1HD LYS 128 -18.422 -3.293 3.461 1011 2HD LYS 38 2HD LYS 128 -17.553 -2.124 2.473 1012 1HE LYS 38 1HE LYS 128 -19.581 -1.837 0.986 1013 2HE LYS 38 2HE LYS 128 -20.453 -3.064 1.920 1014 1HZ LYS 38 1HZ LYS 128 -19.426 -0.481 2.962 1015 2HZ LYS 38 2HZ LYS 128 -20.986 -0.822 2.613 1016 H GLY 39 H GLY 129 -14.850 -4.632 -2.545 1017 1HA GLY 39 1HA GLY 129 -14.728 -4.111 -4.894 1018 2HA GLY 39 2HA GLY 129 -16.471 -4.170 -5.004 1019 H ASP 40 H ASP 130 -14.590 -2.055 -2.899 1020 HA ASP 40 HA ASP 130 -15.434 0.446 -4.436 1021 1HB ASP 40 1HB ASP 130 -14.771 0.412 -1.511 1022 2HB ASP 40 2HB ASP 130 -15.340 1.755 -2.447 1023 HD1 ASP 40 HD2 ASP 130 -18.667 0.724 -2.624 1024 H LYS 41 H LYS 131 -14.087 1.910 -5.127 1025 HA LYS 41 HA LYS 131 -11.129 1.338 -4.987 1026 1HB LYS 41 2HB LYS 131 -12.349 3.739 -6.379 1027 2HB LYS 41 1HB LYS 131 -10.702 3.133 -6.526 1028 1HG LYS 41 1HG LYS 131 -11.756 0.964 -7.546 1029 2HG LYS 41 2HG LYS 131 -13.268 1.864 -7.645 1030 1HD LYS 41 1HD LYS 131 -12.124 3.640 -9.044 1031 2HD LYS 41 2HD LYS 131 -10.595 2.761 -8.916 1032 1HE LYS 41 1HE LYS 131 -11.633 0.769 -10.100 1033 2HE LYS 41 2HE LYS 131 -13.160 1.657 -10.247 1034 1HZ LYS 41 1HZ LYS 131 -11.799 1.810 -12.231 1035 2HZ LYS 41 2HZ LYS 131 -10.555 2.480 -11.409 1036 H VAL 42 H VAL 132 -9.960 2.230 -3.376 1037 HA VAL 42 HA VAL 132 -10.710 4.540 -1.812 1038 HB VAL 42 HB VAL 132 -8.280 2.643 -1.954 1039 1HG1 VAL 42 1HG2 VAL 132 -9.368 4.267 0.344 1040 2HG1 VAL 42 2HG2 VAL 132 -8.011 3.096 0.430 1041 3HG1 VAL 42 3HG2 VAL 132 -7.813 4.545 -0.587 1042 1HG2 VAL 42 3HG1 VAL 132 -10.796 2.497 -0.218 1043 2HG2 VAL 42 1HG1 VAL 132 -10.306 1.308 -1.494 1044 3HG2 VAL 42 2HG1 VAL 132 -9.385 1.439 0.003 1045 H GLN 43 H GLN 133 -9.351 6.112 -1.660 1046 HA GLN 43 HA GLN 133 -7.398 6.822 -3.855 1047 1HB GLN 43 1HB GLN 133 -9.843 8.564 -3.774 1048 2HB GLN 43 2HB GLN 133 -8.355 8.932 -4.639 1049 1HG GLN 43 1HG GLN 133 -8.663 6.728 -5.895 1050 2HG GLN 43 2HG GLN 133 -10.189 6.497 -5.049 1051 1HE2 GLN 43 2HE2 GLN 133 -11.344 7.793 -8.223 1052 2HE2 GLN 43 1HE2 GLN 133 -10.715 6.280 -7.407 1053 H LEU 44 H LEU 134 -5.898 8.257 -3.711 1054 HA LEU 44 HA LEU 134 -5.450 9.680 -1.067 1055 1HB LEU 44 2HB LEU 134 -3.314 7.899 -2.355 1056 2HB LEU 44 1HB LEU 134 -3.080 8.892 -0.926 1057 HG LEU 44 HG LEU 134 -4.939 6.440 -1.100 1058 1HD1 LEU 44 2HD1 LEU 134 -2.073 6.673 0.034 1059 2HD1 LEU 44 3HD1 LEU 134 -3.119 5.246 0.168 1060 3HD1 LEU 44 1HD1 LEU 134 -2.563 5.780 -1.429 1061 1HD2 LEU 44 2HD2 LEU 134 -5.559 8.078 0.739 1062 2HD2 LEU 44 3HD2 LEU 134 -4.974 6.524 1.369 1063 3HD2 LEU 44 1HD2 LEU 134 -3.911 7.957 1.393 1064 H ILE 45 H ILE 135 -4.875 11.763 -1.654 1065 HA ILE 45 HA ILE 135 -3.978 12.311 -4.442 1066 HB ILE 45 HB ILE 135 -5.708 13.736 -3.323 1067 1HG1 ILE 45 1HG1 ILE 135 -4.874 15.953 -4.190 1068 2HG1 ILE 45 2HG1 ILE 135 -3.291 15.252 -4.475 1069 1HG2 ILE 45 3HG2 ILE 135 -4.615 13.977 -1.095 1070 2HG2 ILE 45 1HG2 ILE 135 -3.343 14.992 -1.819 1071 3HG2 ILE 45 2HG2 ILE 135 -5.042 15.555 -1.809 1072 1HD1 ILE 45 3HD1 ILE 135 -5.927 14.317 -5.819 1073 2HD1 ILE 45 1HD1 ILE 135 -4.705 15.382 -6.554 1074 3HD1 ILE 45 2HD1 ILE 135 -4.299 13.690 -6.200 1075 H GLY 46 H GLY 136 -2.117 13.235 -5.013 1076 1HA GLY 46 1HA GLY 136 0.270 13.124 -5.244 1077 2HA GLY 46 2HA GLY 136 0.284 13.696 -3.594 1078 H PHE 47 H PHE 137 -1.008 10.472 -3.849 1079 HA PHE 47 HA PHE 137 1.665 9.114 -3.507 1080 1HB PHE 47 2HB PHE 137 0.485 10.117 -1.369 1081 2HB PHE 47 1HB PHE 137 -0.720 8.876 -1.533 1082 HD1 PHE 47 HD2 PHE 137 2.852 9.560 -0.723 1083 HD2 PHE 47 HD1 PHE 137 -0.060 6.425 -1.189 1084 HE1 PHE 47 HE2 PHE 137 4.414 7.925 0.242 1085 HE2 PHE 47 HE1 PHE 137 1.551 4.807 -0.274 1086 HZ PHE 47 HZ PHE 137 3.826 5.547 0.341 1087 H GLY 48 H GLY 138 -1.899 8.506 -4.054 1088 1HA GLY 48 1HA GLY 138 -1.428 6.075 -5.443 1089 2HA GLY 48 2HA GLY 138 -1.644 5.599 -3.773 1090 H ASN 49 H ASN 139 -3.070 4.405 -5.346 1091 HA ASN 49 HA ASN 139 -5.876 5.180 -4.625 1092 1HB ASN 49 1HB ASN 139 -5.704 6.412 -6.709 1093 2HB ASN 49 2HB ASN 139 -4.990 5.073 -7.565 1094 1HD2 ASN 49 1HD2 ASN 139 -8.446 5.255 -8.803 1095 2HD2 ASN 49 2HD2 ASN 139 -6.881 6.212 -8.838 1096 H PHE 50 H PHE 140 -6.213 3.350 -3.503 1097 HA PHE 50 HA PHE 140 -5.246 0.672 -4.481 1098 1HB PHE 50 2HB PHE 140 -7.103 1.083 -2.086 1099 2HB PHE 50 1HB PHE 140 -6.493 -0.403 -2.543 1100 HD1 PHE 50 HD2 PHE 140 -5.727 2.935 -1.209 1101 HD2 PHE 50 HD1 PHE 140 -4.506 -1.169 -1.487 1102 HE1 PHE 50 HE2 PHE 140 -4.075 3.286 0.618 1103 HE2 PHE 50 HE1 PHE 140 -2.842 -0.772 0.316 1104 HZ PHE 50 HZ PHE 140 -2.558 1.495 1.202 1105 H GLU 51 H GLU 141 -6.539 -0.893 -5.263 1106 HA GLU 51 HA GLU 141 -9.425 -0.782 -5.151 1107 1HB GLU 51 1HB GLU 141 -10.069 -0.542 -7.541 1108 2HB GLU 51 2HB GLU 141 -9.286 0.916 -7.007 1109 1HG GLU 51 1HG GLU 141 -7.909 -1.265 -8.724 1110 2HG GLU 51 2HG GLU 141 -8.744 0.133 -9.368 1111 HE2 GLU 51 HE2 GLU 141 -4.997 0.444 -8.036 1112 H VAL 52 H VAL 142 -10.591 -2.647 -5.916 1113 HA VAL 52 HA VAL 142 -8.770 -4.958 -5.966 1114 HB VAL 52 HB VAL 142 -11.001 -4.015 -4.407 1115 1HG1 VAL 52 1HG2 VAL 142 -12.071 -6.096 -6.329 1116 2HG1 VAL 52 2HG2 VAL 142 -12.789 -5.635 -4.745 1117 3HG1 VAL 52 3HG2 VAL 142 -12.617 -4.433 -6.069 1118 1HG2 VAL 52 1HG1 VAL 142 -9.765 -6.775 -4.541 1119 2HG2 VAL 52 2HG1 VAL 142 -9.245 -5.357 -3.588 1120 3HG2 VAL 52 3HG1 VAL 142 -10.786 -6.124 -3.252 1121 NH1 ARG 53 NH2 ARG 143 -11.137 -8.274 -13.819 1122 NH2 ARG 53 NH1 ARG 143 -9.817 -8.433 -15.662 1123 H ARG 53 H ARG 143 -9.232 -6.760 -7.246 1124 HA ARG 53 HA ARG 143 -10.404 -6.116 -10.022 1125 1HB ARG 53 1HB ARG 143 -7.884 -6.138 -9.990 1126 2HB ARG 53 2HB ARG 143 -7.898 -7.762 -9.382 1127 1HG ARG 53 1HG ARG 143 -7.475 -7.930 -11.717 1128 2HG ARG 53 2HG ARG 143 -9.095 -8.566 -11.467 1129 1HD ARG 53 1HD ARG 143 -10.061 -6.309 -12.270 1130 2HD ARG 53 2HD ARG 143 -8.421 -5.737 -12.525 1131 1HH1 ARG 53 2HH2 ARG 143 -11.253 -7.910 -12.866 1132 2HH1 ARG 53 1HH2 ARG 143 -11.809 -8.843 -14.345 1133 1HH2 ARG 53 1HH1 ARG 143 -8.930 -8.193 -16.117 1134 2HH2 ARG 53 2HH1 ARG 143 -10.581 -8.991 -16.059 1135 H GLU 54 H GLU 144 -12.325 -6.990 -9.720 1136 HA GLU 54 HA GLU 144 -12.935 -9.450 -8.303 1137 1HB GLU 54 1HB GLU 144 -15.188 -9.283 -9.001 1138 2HB GLU 54 2HB GLU 144 -14.613 -7.713 -8.524 1139 1HG GLU 54 1HG GLU 144 -15.082 -8.626 -11.443 1140 2HG GLU 54 2HG GLU 144 -16.201 -7.708 -10.464 1141 HE2 GLU 54 HE2 GLU 144 -13.225 -5.892 -12.400 1142 NH1 ARG 55 NH2 ARG 145 -11.306 -18.776 -9.142 1143 NH2 ARG 55 NH1 ARG 145 -13.522 -18.504 -9.551 1144 H ARG 55 H ARG 145 -12.873 -11.514 -8.837 1145 HA ARG 55 HA ARG 145 -12.041 -12.319 -11.655 1146 1HB ARG 55 1HB ARG 145 -10.704 -13.075 -9.567 1147 2HB ARG 55 2HB ARG 145 -12.074 -14.070 -9.132 1148 1HG ARG 55 1HG ARG 145 -11.574 -14.831 -11.855 1149 2HG ARG 55 2HG ARG 145 -9.989 -14.384 -11.286 1150 1HD ARG 55 1HD ARG 145 -10.164 -16.727 -10.902 1151 2HD ARG 55 2HD ARG 145 -10.315 -16.010 -9.291 1152 1HH1 ARG 55 2HH2 ARG 145 -10.363 -18.376 -9.192 1153 2HH1 ARG 55 1HH2 ARG 145 -11.564 -19.699 -8.775 1154 1HH2 ARG 55 1HH1 ARG 145 -14.271 -17.902 -9.911 1155 2HH2 ARG 55 2HH1 ARG 145 -13.626 -19.445 -9.156 1156 H ALA 56 H ALA 146 -13.332 -13.577 -12.882 1157 HA ALA 56 HA ALA 146 -16.238 -13.699 -12.285 1158 1HB ALA 56 3HB ALA 146 -15.442 -13.202 -14.575 1159 2HB ALA 56 1HB ALA 146 -14.683 -14.809 -14.708 1160 3HB ALA 56 2HB ALA 146 -16.451 -14.660 -14.575 1161 H ALA 57 H ALA 147 -16.906 -15.203 -10.875 1162 HA ALA 57 HA ALA 147 -16.045 -17.741 -10.264 1163 1HB ALA 57 1HB ALA 147 -17.984 -16.561 -9.115 1164 2HB ALA 57 2HB ALA 147 -19.046 -16.975 -10.483 1165 3HB ALA 57 3HB ALA 147 -18.377 -18.255 -9.449 1166 NH1 ARG 58 NH2 ARG 148 -14.157 -18.016 -17.066 1167 NH2 ARG 58 NH1 ARG 148 -13.581 -20.035 -17.940 1168 H ARG 58 H ARG 148 -15.858 -19.666 -10.894 1169 HA ARG 58 HA ARG 148 -16.516 -20.106 -13.755 1170 1HB ARG 58 2HB ARG 148 -14.512 -21.732 -12.130 1171 2HB ARG 58 1HB ARG 148 -14.693 -21.785 -13.867 1172 1HG ARG 58 1HG ARG 148 -13.624 -19.425 -12.234 1173 2HG ARG 58 2HG ARG 148 -12.670 -20.563 -13.150 1174 1HD ARG 58 1HD ARG 148 -14.717 -18.582 -14.361 1175 2HD ARG 58 2HD ARG 148 -12.974 -18.325 -14.289 1176 1HH1 ARG 58 2HH2 ARG 148 -14.300 -17.448 -16.224 1177 2HH1 ARG 58 1HH2 ARG 148 -14.280 -17.716 -18.039 1178 1HH2 ARG 58 1HH1 ARG 148 -13.286 -21.003 -17.768 1179 2HH2 ARG 58 2HH1 ARG 148 -13.744 -19.595 -18.852 1180 H LYS 59 H LYS 149 -16.337 -22.792 -14.028 1181 HA LYS 59 HA LYS 149 -18.195 -24.234 -12.215 1182 1HB LYS 59 1HB LYS 149 -19.905 -24.941 -13.787 1183 2HB LYS 59 2HB LYS 149 -19.960 -23.224 -13.453 1184 1HG LYS 59 1HG LYS 149 -18.864 -22.757 -15.708 1185 2HG LYS 59 2HG LYS 149 -18.876 -24.489 -16.051 1186 1HD LYS 59 1HD LYS 149 -21.396 -24.522 -15.832 1187 2HD LYS 59 2HD LYS 149 -21.389 -22.789 -15.483 1188 1HE LYS 59 1HE LYS 149 -20.360 -22.331 -17.766 1189 2HE LYS 59 2HE LYS 149 -20.373 -24.067 -18.117 1190 1HZ LYS 59 1HZ LYS 149 -22.759 -22.391 -17.563 1191 2HZ LYS 59 2HZ LYS 149 -22.284 -22.926 -19.033 1192 H GLY 60 H GLY 150 -17.213 -26.079 -11.948 1193 1HA GLY 60 1HA GLY 150 -16.148 -27.786 -14.099 1194 2HA GLY 60 2HA GLY 150 -14.804 -26.895 -13.364 1195 NH1 ARG 61 NH2 ARG 151 -17.366 -31.579 -6.383 1196 NH2 ARG 61 NH1 ARG 151 -17.436 -33.818 -6.027 1197 H ARG 61 H ARG 151 -14.385 -29.357 -13.092 1198 HA ARG 61 HA ARG 151 -15.303 -30.133 -10.292 1199 1HB ARG 61 1HB ARG 151 -16.629 -31.276 -12.191 1200 2HB ARG 61 2HB ARG 151 -15.221 -32.234 -12.483 1201 1HG ARG 61 1HG ARG 151 -17.037 -33.111 -10.981 1202 2HG ARG 61 2HG ARG 151 -15.420 -33.444 -10.468 1203 1HD ARG 61 1HD ARG 151 -15.617 -31.507 -8.730 1204 2HD ARG 61 2HD ARG 151 -17.292 -31.331 -9.175 1205 1HH1 ARG 61 2HH2 ARG 151 -17.175 -30.810 -7.035 1206 2HH1 ARG 61 1HH2 ARG 151 -17.676 -31.495 -5.408 1207 1HH2 ARG 61 1HH1 ARG 151 -17.298 -34.763 -6.402 1208 2HH2 ARG 61 2HH1 ARG 151 -17.740 -33.571 -5.079 1209 H ASN 62 H ASN 152 -14.301 -32.209 -9.703 1210 HA ASN 62 HA ASN 152 -11.281 -31.951 -9.489 1211 1HB ASN 62 1HB ASN 152 -12.960 -32.427 -7.481 1212 2HB ASN 62 2HB ASN 152 -13.133 -34.032 -8.140 1213 1HD2 ASN 62 2HD2 ASN 152 -10.175 -35.106 -6.428 1214 2HD2 ASN 62 1HD2 ASN 152 -11.790 -35.496 -7.208 1215 HA PRO 63 HA PRO 153 -10.881 -35.178 -12.812 1216 1HB PRO 63 1HB PRO 153 -8.424 -36.032 -11.185 1217 2HB PRO 63 2HB PRO 153 -8.578 -35.825 -12.943 1218 1HG PRO 63 1HG PRO 153 -7.426 -33.860 -11.471 1219 2HG PRO 63 2HG PRO 153 -8.586 -33.409 -12.743 1220 1HD PRO 63 1HD PRO 153 -9.073 -33.544 -9.721 1221 2HD PRO 63 2HD PRO 153 -9.626 -32.327 -10.914 1222 H GLN 64 H GLN 154 -10.968 -36.265 -9.454 1223 HA GLN 64 HA GLN 154 -11.167 -39.165 -10.108 1224 1HB GLN 64 1HB GLN 154 -10.047 -38.314 -8.014 1225 2HB GLN 64 2HB GLN 154 -11.564 -37.629 -7.446 1226 1HG GLN 64 1HG GLN 154 -12.590 -39.785 -7.105 1227 2HG GLN 64 2HG GLN 154 -11.349 -40.600 -8.036 1228 1HE2 GLN 64 2HE2 GLN 154 -9.147 -40.889 -5.173 1229 2HE2 GLN 64 1HE2 GLN 154 -9.412 -41.177 -6.966 1230 H THR 65 H THR 155 -13.376 -37.052 -8.399 1231 HA THR 65 HA THR 155 -15.541 -38.989 -8.444 1232 HB THR 65 HB THR 155 -16.718 -37.392 -7.016 1233 HG1 THR 65 HG1 THR 155 -15.760 -35.403 -6.591 1234 1HG2 THR 65 1HG2 THR 155 -14.777 -38.731 -5.965 1235 2HG2 THR 65 2HG2 THR 155 -13.715 -37.345 -6.253 1236 3HG2 THR 65 3HG2 THR 155 -15.087 -37.168 -5.149 1237 H GLY 66 H GLY 156 -15.135 -36.014 -10.318 1238 1HA GLY 66 1HA GLY 156 -16.391 -35.206 -12.202 1239 2HA GLY 66 2HA GLY 156 -16.949 -36.846 -12.417 1240 H GLU 67 H GLU 157 -17.657 -34.607 -9.733 1241 HA GLU 67 HA GLU 157 -20.649 -34.518 -10.581 1242 1HB GLU 67 2HB GLU 157 -19.889 -35.938 -8.490 1243 2HB GLU 67 1HB GLU 157 -19.574 -34.367 -7.740 1244 1HG GLU 67 1HG GLU 157 -22.037 -33.747 -8.122 1245 2HG GLU 67 2HG GLU 157 -22.305 -35.327 -8.850 1246 HE1 GLU 67 HE2 GLU 157 -22.381 -37.077 -5.869 1247 H GLU 68 H GLU 158 -18.986 -32.752 -11.502 1248 HA GLU 68 HA GLU 158 -18.119 -30.489 -10.963 1249 1HB GLU 68 1HB GLU 158 -18.956 -29.192 -12.786 1250 2HB GLU 68 2HB GLU 158 -18.720 -30.860 -13.245 1251 1HG GLU 68 1HG GLU 158 -21.232 -31.262 -13.130 1252 2HG GLU 68 2HG GLU 158 -21.475 -29.584 -12.660 1253 HE2 GLU 68 HE2 GLU 158 -20.708 -30.605 -16.477 1254 H MET 69 H MET 159 -18.051 -28.805 -9.868 1255 HA MET 69 HA MET 159 -20.584 -27.582 -8.645 1256 1HB MET 69 1HB MET 159 -19.545 -27.219 -6.580 1257 2HB MET 69 2HB MET 159 -19.207 -28.882 -6.979 1258 1HG MET 69 1HG MET 159 -17.209 -26.527 -7.161 1259 2HG MET 69 2HG MET 159 -17.273 -27.739 -5.881 1260 1HE MET 69 3HE MET 159 -14.603 -27.148 -7.227 1261 2HE MET 69 2HE MET 159 -14.110 -28.178 -8.608 1262 3HE MET 69 1HE MET 159 -15.215 -26.804 -8.871 1263 H GLU 70 H GLU 160 -20.696 -25.406 -8.342 1264 HA GLU 70 HA GLU 160 -19.327 -23.638 -10.230 1265 1HB GLU 70 2HB GLU 160 -21.806 -23.651 -9.009 1266 2HB GLU 70 1HB GLU 160 -21.036 -22.566 -7.922 1267 1HG GLU 70 1HG GLU 160 -21.214 -22.345 -11.032 1268 2HG GLU 70 2HG GLU 160 -22.374 -21.636 -9.925 1269 HE1 GLU 70 HE2 GLU 160 -19.737 -19.331 -8.698 1270 H ILE 71 H ILE 161 -17.337 -22.717 -9.887 1271 HA ILE 71 HA ILE 161 -16.042 -22.822 -7.222 1272 HB ILE 71 HB ILE 161 -15.043 -21.978 -10.013 1273 1HG1 ILE 71 1HG1 ILE 161 -14.434 -24.615 -8.508 1274 2HG1 ILE 71 2HG1 ILE 161 -15.704 -24.508 -9.704 1275 1HG2 ILE 71 2HG2 ILE 161 -13.723 -20.960 -8.151 1276 2HG2 ILE 71 3HG2 ILE 161 -13.444 -22.582 -7.460 1277 3HG2 ILE 71 1HG2 ILE 161 -12.773 -22.148 -9.066 1278 1HD1 ILE 71 1HD1 ILE 161 -14.080 -23.914 -11.509 1279 2HD1 ILE 71 2HD1 ILE 161 -12.734 -24.065 -10.343 1280 3HD1 ILE 71 3HD1 ILE 161 -13.734 -25.478 -10.744 1281 HA PRO 72 HA PRO 162 -17.806 -18.537 -6.863 1282 1HB PRO 72 1HB PRO 162 -17.032 -17.895 -4.270 1283 2HB PRO 72 2HB PRO 162 -18.304 -19.058 -4.669 1284 1HG PRO 72 1HG PRO 162 -15.378 -19.664 -3.999 1285 2HG PRO 72 2HG PRO 162 -16.835 -20.411 -3.298 1286 1HD PRO 72 1HD PRO 162 -15.431 -21.601 -5.360 1287 2HD PRO 72 2HD PRO 162 -17.213 -21.753 -5.261 1288 H ALA 73 H ALA 163 -17.203 -16.381 -6.831 1289 HA ALA 73 HA ALA 163 -14.792 -15.573 -8.185 1290 1HB ALA 73 2HB ALA 163 -16.897 -14.102 -8.004 1291 2HB ALA 73 3HB ALA 163 -16.513 -13.803 -6.270 1292 3HB ALA 73 1HB ALA 163 -15.444 -13.205 -7.530 1293 H SER 74 H SER 164 -13.313 -13.954 -7.513 1294 HA SER 74 HA SER 164 -13.096 -13.333 -4.747 1295 1HB SER 74 1HB SER 164 -10.593 -14.862 -5.867 1296 2HB SER 74 2HB SER 164 -10.487 -13.871 -4.414 1297 HG SER 74 HG SER 164 -12.222 -16.073 -4.794 1298 H LYS 75 H LYS 165 -12.389 -11.426 -4.325 1299 HA LYS 75 HA LYS 165 -11.533 -9.577 -6.531 1300 1HB LYS 75 2HB LYS 165 -11.566 -8.592 -3.701 1301 2HB LYS 75 1HB LYS 165 -11.873 -7.788 -5.188 1302 1HG LYS 75 1HG LYS 165 -13.804 -9.729 -3.799 1303 2HG LYS 75 2HG LYS 165 -13.852 -7.978 -3.691 1304 1HD LYS 75 1HD LYS 165 -14.244 -7.795 -6.166 1305 2HD LYS 75 2HD LYS 165 -14.230 -9.545 -6.328 1306 1HE LYS 75 1HE LYS 165 -16.260 -7.968 -4.596 1307 2HE LYS 75 2HE LYS 165 -16.543 -8.469 -6.262 1308 1HZ LYS 75 1HZ LYS 165 -17.496 -10.008 -4.688 1309 2HZ LYS 75 2HZ LYS 165 -16.049 -10.305 -3.988 1310 H VAL 76 H VAL 166 -9.194 -9.000 -6.978 1311 HA VAL 76 HA VAL 166 -7.204 -9.963 -5.166 1312 HB VAL 76 HB VAL 166 -7.938 -9.476 -8.052 1313 1HG1 VAL 76 1HG2 VAL 166 -5.132 -9.413 -7.247 1314 2HG1 VAL 76 2HG2 VAL 166 -5.842 -9.689 -8.928 1315 3HG1 VAL 76 3HG2 VAL 166 -6.137 -8.158 -8.073 1316 1HG2 VAL 76 3HG1 VAL 166 -8.208 -11.732 -7.042 1317 2HG2 VAL 76 1HG1 VAL 166 -7.068 -11.708 -8.399 1318 3HG2 VAL 76 2HG1 VAL 166 -6.448 -11.775 -6.715 1319 HA PRO 77 HA PRO 167 -6.902 -5.413 -4.282 1320 1HB PRO 77 1HB PRO 167 -5.255 -5.552 -2.036 1321 2HB PRO 77 2HB PRO 167 -6.911 -6.176 -2.017 1322 1HG PRO 77 1HG PRO 167 -4.326 -7.752 -2.479 1323 2HG PRO 77 2HG PRO 167 -5.629 -8.135 -1.339 1324 1HD PRO 77 1HD PRO 167 -5.410 -9.248 -3.988 1325 2HD PRO 77 2HD PRO 167 -7.004 -9.040 -3.207 1326 H ALA 78 H ALA 168 -5.865 -3.893 -4.828 1327 HA ALA 78 HA ALA 168 -2.896 -3.973 -5.574 1328 1HB ALA 78 3HB ALA 168 -4.551 -4.471 -7.475 1329 2HB ALA 78 1HB ALA 168 -5.256 -2.859 -7.247 1330 3HB ALA 78 2HB ALA 168 -3.561 -3.021 -7.762 1331 H PHE 79 H PHE 169 -2.119 -1.877 -6.092 1332 HA PHE 79 HA PHE 169 -3.102 0.579 -4.500 1333 1HB PHE 79 2HB PHE 169 -2.176 -0.282 -2.742 1334 2HB PHE 79 1HB PHE 169 -0.772 -0.944 -3.632 1335 HD1 PHE 79 HD2 PHE 169 -2.207 2.247 -2.272 1336 HD2 PHE 79 HD1 PHE 169 1.211 0.384 -4.111 1337 HE1 PHE 79 HE2 PHE 169 -0.885 4.295 -1.936 1338 HE2 PHE 79 HE1 PHE 169 2.488 2.461 -3.827 1339 HZ PHE 79 HZ PHE 169 1.435 4.429 -2.781 1340 H LYS 80 H LYS 170 -2.724 1.983 -5.861 1341 HA LYS 80 HA LYS 170 -0.783 2.150 -8.347 1342 1HB LYS 80 2HB LYS 170 -3.178 3.820 -7.521 1343 2HB LYS 80 1HB LYS 170 -2.012 4.345 -8.717 1344 1HG LYS 80 1HG LYS 170 -2.456 2.261 -10.086 1345 2HG LYS 80 2HG LYS 170 -3.662 1.741 -8.907 1346 1HD LYS 80 1HD LYS 170 -5.050 3.761 -9.371 1347 2HD LYS 80 2HD LYS 170 -3.826 4.396 -10.477 1348 1HE LYS 80 1HE LYS 170 -4.160 2.412 -12.010 1349 2HE LYS 80 2HE LYS 170 -5.342 1.723 -10.888 1350 1HZ LYS 80 1HZ LYS 170 -6.433 2.912 -12.634 1351 2HZ LYS 80 2HZ LYS 170 -6.732 3.664 -11.213 1352 HA PRO 81 HA PRO 171 1.714 4.919 -5.739 1353 1HB PRO 81 1HB PRO 171 3.715 5.514 -7.554 1354 2HB PRO 81 2HB PRO 171 3.515 3.870 -6.937 1355 1HG PRO 81 1HG PRO 171 2.490 4.983 -9.596 1356 2HG PRO 81 2HG PRO 171 3.459 3.512 -9.330 1357 1HD PRO 81 1HD PRO 171 0.661 3.503 -9.521 1358 2HD PRO 81 2HD PRO 171 1.560 2.286 -8.559 1359 H GLY 82 H GLY 172 -0.717 5.908 -6.962 1360 1HA GLY 82 1HA GLY 172 -1.802 7.649 -8.292 1361 2HA GLY 82 2HA GLY 172 -0.957 8.512 -7.020 1362 H LYS 83 H LYS 173 0.987 7.120 -9.426 1363 HA LYS 83 HA LYS 173 2.500 8.090 -11.106 1364 1HB LYS 83 2HB LYS 173 0.224 10.040 -11.351 1365 2HB LYS 83 1HB LYS 173 1.742 10.796 -11.632 1366 1HG LYS 83 1HG LYS 173 2.285 9.004 -13.395 1367 2HG LYS 83 2HG LYS 173 0.724 8.245 -13.072 1368 1HD LYS 83 1HD LYS 173 -0.455 10.388 -13.805 1369 2HD LYS 83 2HD LYS 173 1.110 11.128 -14.101 1370 1HE LYS 83 1HE LYS 173 0.282 10.441 -16.247 1371 2HE LYS 83 2HE LYS 173 1.617 9.355 -15.870 1372 1HZ LYS 83 1HZ LYS 173 -0.004 7.683 -15.202 1373 2HZ LYS 83 2HZ LYS 173 -0.252 8.159 -16.746 1374 H ALA 84 H ALA 174 1.509 10.234 -8.750 1375 HA ALA 84 HA ALA 174 3.685 12.105 -8.360 1376 1HB ALA 84 2HB ALA 174 1.325 12.281 -7.542 1377 2HB ALA 84 3HB ALA 174 1.558 10.856 -6.492 1378 3HB ALA 84 1HB ALA 174 2.460 12.359 -6.150 1379 H LEU 85 H LEU 175 3.018 8.967 -6.573 1380 HA LEU 85 HA LEU 175 5.510 9.036 -5.041 1381 1HB LEU 85 2HB LEU 175 3.603 7.736 -4.206 1382 2HB LEU 85 1HB LEU 175 3.597 6.749 -5.657 1383 HG LEU 85 HG LEU 175 5.976 6.178 -5.175 1384 1HD1 LEU 85 3HD1 LEU 175 6.355 7.871 -3.249 1385 2HD1 LEU 85 1HD1 LEU 175 5.259 6.926 -2.243 1386 3HD1 LEU 85 2HD1 LEU 175 6.796 6.212 -2.802 1387 1HD2 LEU 85 3HD2 LEU 175 4.160 4.490 -4.920 1388 2HD2 LEU 85 1HD2 LEU 175 5.294 4.261 -3.581 1389 3HD2 LEU 85 2HD2 LEU 175 3.742 5.095 -3.304 1390 H LYS 86 H LYS 176 4.534 7.800 -8.180 1391 HA LYS 86 HA LYS 176 7.048 6.508 -8.891 1392 1HB LYS 86 1HB LYS 176 4.738 6.421 -10.192 1393 2HB LYS 86 2HB LYS 176 5.388 7.771 -11.108 1394 1HG LYS 86 1HG LYS 176 7.414 6.354 -11.698 1395 2HG LYS 86 2HG LYS 176 6.735 5.008 -10.796 1396 1HD LYS 86 1HD LYS 176 5.415 6.353 -13.248 1397 2HD LYS 86 2HD LYS 176 6.421 4.911 -13.306 1398 1HE LYS 86 1HE LYS 176 4.757 3.674 -11.819 1399 2HE LYS 86 2HE LYS 176 3.717 5.106 -11.810 1400 1HZ LYS 86 1HZ LYS 176 4.533 3.617 -14.241 1401 2HZ LYS 86 2HZ LYS 176 3.582 4.947 -14.231 1402 H ASP 87 H ASP 177 6.492 9.885 -8.575 1403 HA ASP 87 HA ASP 177 9.208 10.552 -9.787 1404 1HB ASP 87 1HB ASP 177 6.615 11.897 -9.505 1405 2HB ASP 87 2HB ASP 177 7.589 12.627 -8.305 1406 HD1 ASP 87 HD2 ASP 177 8.289 13.073 -12.301 1407 H ALA 88 H ALA 178 7.563 10.463 -6.572 1408 HA ALA 88 HA ALA 178 9.682 11.350 -4.797 1409 1HB ALA 88 3HB ALA 178 7.362 10.535 -3.939 1410 2HB ALA 88 1HB ALA 178 7.803 8.895 -4.416 1411 3HB ALA 88 2HB ALA 178 8.703 9.641 -3.135 1412 H VAL 89 H VAL 179 9.008 8.089 -6.157 1413 HA VAL 89 HA VAL 179 10.932 6.670 -4.645 1414 HB VAL 89 HB VAL 179 8.526 6.224 -5.448 1415 1HG1 VAL 89 2HG2 VAL 179 8.987 6.779 -7.923 1416 2HG1 VAL 89 3HG2 VAL 179 9.759 5.162 -8.022 1417 3HG1 VAL 89 1HG2 VAL 179 8.052 5.309 -7.516 1418 1HG2 VAL 89 3HG1 VAL 179 10.513 4.085 -5.967 1419 2HG2 VAL 89 1HG1 VAL 179 9.716 4.593 -4.404 1420 3HG2 VAL 89 2HG1 VAL 179 8.732 3.951 -5.747 1421 H LYS 90 H LYS 180 11.211 8.236 -7.738 1422 HA LYS 90 HA LYS 180 13.285 6.932 -9.104 1423 1HB LYS 90 1HB LYS 180 11.725 9.237 -9.330 1424 2HB LYS 90 2HB LYS 180 13.162 10.049 -8.813 1425 1HG LYS 90 1HG LYS 180 14.309 9.468 -10.878 1426 2HG LYS 90 2HG LYS 180 13.189 8.143 -11.229 1427 1HD LYS 90 1HD LYS 180 11.277 9.773 -11.499 1428 2HD LYS 90 2HD LYS 180 12.347 11.108 -11.115 1429 1HE LYS 90 1HE LYS 180 11.952 11.063 -13.483 1430 2HE LYS 90 2HE LYS 180 13.661 10.712 -13.196 1431 1HZ LYS 90 1HZ LYS 180 13.179 8.364 -13.569 1432 2HZ LYS 90 2HZ LYS 180 12.748 9.261 -14.865 Start of MODEL 14 Raw file had 1432 H/Q atoms Start of MODEL 14 1 1H MET 1 1H MET 1 -12.422 6.877 -0.749 2 2H MET 1 2H MET 1 -13.776 6.369 0.014 3 HA MET 1 HA MET 1 -14.318 8.577 0.708 4 1HB MET 1 1HB MET 1 -11.540 7.526 1.551 5 2HB MET 1 2HB MET 1 -12.338 8.870 2.326 6 1HG MET 1 1HG MET 1 -13.029 7.276 3.785 7 2HG MET 1 2HG MET 1 -14.384 7.127 2.671 8 1HE MET 1 1HE MET 1 -12.791 5.039 4.890 9 2HE MET 1 3HE MET 1 -11.922 3.708 4.064 10 3HE MET 1 2HE MET 1 -11.167 5.308 4.203 11 H ASN 2 H ASN 2 -10.963 9.301 0.441 12 HA ASN 2 HA ASN 2 -10.443 10.590 -1.774 13 1HB ASN 2 1HB ASN 2 -10.833 12.920 -1.992 14 2HB ASN 2 2HB ASN 2 -12.342 12.075 -1.883 15 1HD2 ASN 2 1HD2 ASN 2 -13.480 13.959 0.959 16 2HD2 ASN 2 2HD2 ASN 2 -13.782 12.533 -0.154 17 H LYS 3 H LYS 3 -10.311 11.216 1.535 18 HA LYS 3 HA LYS 3 -7.914 10.843 2.506 19 1HB LYS 3 1HB LYS 3 -6.728 12.156 0.601 20 2HB LYS 3 2HB LYS 3 -7.317 13.628 1.318 21 1HG LYS 3 1HG LYS 3 -5.990 13.028 3.441 22 2HG LYS 3 2HG LYS 3 -5.565 11.476 2.723 23 1HD LYS 3 1HD LYS 3 -4.365 12.761 0.828 24 2HD LYS 3 2HD LYS 3 -4.710 14.247 1.696 25 1HE LYS 3 1HE LYS 3 -2.450 13.683 2.254 26 2HE LYS 3 2HE LYS 3 -3.379 13.329 3.709 27 1HZ LYS 3 1HZ LYS 3 -1.811 11.584 3.170 28 2HZ LYS 3 2HZ LYS 3 -2.448 11.360 1.682 29 H THR 4 H THR 4 -10.313 13.431 2.198 30 HA THR 4 HA THR 4 -9.923 14.419 4.904 31 HB THR 4 HB THR 4 -11.578 15.203 2.419 32 HG1 THR 4 HG1 THR 4 -10.110 16.965 2.358 33 1HG2 THR 4 3HG2 THR 4 -11.161 16.509 5.108 34 2HG2 THR 4 1HG2 THR 4 -11.861 17.342 3.633 35 3HG2 THR 4 2HG2 THR 4 -12.689 15.909 4.362 36 H GLU 5 H GLU 5 -12.090 12.398 2.941 37 HA GLU 5 HA GLU 5 -14.334 12.320 4.882 38 1HB GLU 5 1HB GLU 5 -14.799 12.170 2.499 39 2HB GLU 5 2HB GLU 5 -13.468 11.057 2.204 40 1HG GLU 5 1HG GLU 5 -15.373 9.884 1.976 41 2HG GLU 5 2HG GLU 5 -14.531 9.304 3.422 42 HE2 GLU 5 HE2 GLU 5 -17.217 9.847 5.543 43 H LEU 6 H LEU 6 -10.979 11.096 4.485 44 HA LEU 6 HA LEU 6 -11.292 8.781 6.220 45 1HB LEU 6 2HB LEU 6 -9.341 9.984 4.333 46 2HB LEU 6 1HB LEU 6 -8.582 10.177 5.859 47 HG LEU 6 HG LEU 6 -7.928 8.064 5.343 48 1HD1 LEU 6 2HD1 LEU 6 -9.109 7.463 7.386 49 2HD1 LEU 6 3HD1 LEU 6 -10.459 6.817 6.414 50 3HD1 LEU 6 1HD1 LEU 6 -8.859 6.087 6.284 51 1HD2 LEU 6 1HD2 LEU 6 -8.939 8.034 3.056 52 2HD2 LEU 6 2HD2 LEU 6 -8.975 6.406 3.759 53 3HD2 LEU 6 3HD2 LEU 6 -10.451 7.410 3.737 54 H ILE 7 H ILE 7 -10.347 12.223 6.456 55 HA ILE 7 HA ILE 7 -9.296 12.231 9.175 56 HB ILE 7 HB ILE 7 -10.643 14.496 7.620 57 1HG1 ILE 7 1HG1 ILE 7 -7.651 13.841 7.997 58 2HG1 ILE 7 2HG1 ILE 7 -8.524 13.293 6.630 59 1HG2 ILE 7 2HG2 ILE 7 -10.540 15.048 10.095 60 2HG2 ILE 7 3HG2 ILE 7 -8.799 14.761 10.054 61 3HG2 ILE 7 1HG2 ILE 7 -9.492 16.094 9.124 62 1HD1 ILE 7 3HD1 ILE 7 -9.229 15.780 6.180 63 2HD1 ILE 7 1HD1 ILE 7 -7.843 16.131 7.167 64 3HD1 ILE 7 2HD1 ILE 7 -7.627 15.132 5.693 65 H ASN 8 H ASN 8 -12.556 12.876 7.967 66 HA ASN 8 HA ASN 8 -13.800 12.849 10.692 67 1HB ASN 8 1HB ASN 8 -15.175 12.313 7.950 68 2HB ASN 8 2HB ASN 8 -16.031 12.522 9.459 69 1HD2 ASN 8 2HD2 ASN 8 -14.968 15.888 7.460 70 2HD2 ASN 8 1HD2 ASN 8 -14.609 14.201 6.833 71 H ALA 9 H ALA 9 -12.546 10.229 8.918 72 HA ALA 9 HA ALA 9 -14.240 8.071 10.184 73 1HB ALA 9 2HB ALA 9 -12.671 7.714 7.947 74 2HB ALA 9 3HB ALA 9 -11.312 7.752 9.057 75 3HB ALA 9 1HB ALA 9 -12.459 6.497 9.270 76 H VAL 10 H VAL 10 -11.014 9.566 10.645 77 HA VAL 10 HA VAL 10 -10.261 7.813 12.714 78 HB VAL 10 HB VAL 10 -8.908 10.499 12.295 79 1HG1 VAL 10 3HG2 VAL 10 -8.155 8.525 13.968 80 2HG1 VAL 10 1HG2 VAL 10 -7.293 7.999 12.487 81 3HG1 VAL 10 2HG2 VAL 10 -7.012 9.622 13.126 82 1HG2 VAL 10 1HG1 VAL 10 -8.969 8.186 10.365 83 2HG2 VAL 10 2HG1 VAL 10 -9.190 9.958 10.166 84 3HG2 VAL 10 3HG1 VAL 10 -7.543 9.322 10.444 85 H ALA 11 H ALA 11 -11.081 11.129 12.548 86 HA ALA 11 HA ALA 11 -11.168 11.421 15.345 87 1HB ALA 11 2HB ALA 11 -10.906 13.378 13.739 88 2HB ALA 11 3HB ALA 11 -12.577 13.148 13.167 89 3HB ALA 11 1HB ALA 11 -12.266 13.720 14.839 90 H GLU 12 H GLU 12 -13.627 10.118 13.256 91 HA GLU 12 HA GLU 12 -15.752 10.295 15.373 92 1HB GLU 12 1HB GLU 12 -16.445 10.311 12.980 93 2HB GLU 12 2HB GLU 12 -15.704 8.729 12.717 94 1HG GLU 12 1HG GLU 12 -17.367 7.687 14.306 95 2HG GLU 12 2HG GLU 12 -18.080 9.267 14.622 96 HE1 GLU 12 HE2 GLU 12 -19.828 9.452 11.634 97 H THR 13 H THR 13 -13.666 7.645 13.998 98 HA THR 13 HA THR 13 -14.468 5.993 16.406 99 HB THR 13 HB THR 13 -14.482 5.308 13.957 100 HG1 THR 13 HG1 THR 13 -14.247 3.166 14.652 101 1HG2 THR 13 1HG2 THR 13 -12.098 5.608 13.370 102 2HG2 THR 13 2HG2 THR 13 -11.668 4.324 14.529 103 3HG2 THR 13 3HG2 THR 13 -12.684 3.950 13.105 104 H SER 14 H SER 14 -12.483 8.094 16.410 105 HA SER 14 HA SER 14 -10.780 6.803 18.647 106 1HB SER 14 1HB SER 14 -9.348 7.100 16.574 107 2HB SER 14 2HB SER 14 -9.589 8.850 16.674 108 HG SER 14 HG SER 14 -8.704 8.778 18.771 109 H GLY 15 H GLY 15 -12.346 9.874 17.598 110 1HA GLY 15 1HA GLY 15 -12.818 11.838 18.820 111 2HA GLY 15 2HA GLY 15 -12.619 10.902 20.298 112 H LEU 16 H LEU 16 -10.541 12.063 17.728 113 HA LEU 16 HA LEU 16 -8.666 13.570 19.574 114 1HB LEU 16 1HB LEU 16 -6.974 13.343 17.901 115 2HB LEU 16 2HB LEU 16 -7.438 11.885 18.756 116 HG LEU 16 HG LEU 16 -8.639 11.021 17.011 117 1HD1 LEU 16 2HD1 LEU 16 -9.737 13.113 16.083 118 2HD1 LEU 16 3HD1 LEU 16 -8.158 13.448 15.306 119 3HD1 LEU 16 1HD1 LEU 16 -9.144 11.986 14.859 120 1HD2 LEU 16 3HD2 LEU 16 -6.653 10.198 16.766 121 2HD2 LEU 16 1HD2 LEU 16 -7.690 10.248 15.317 122 3HD2 LEU 16 2HD2 LEU 16 -6.355 11.382 15.441 123 H SER 17 H SER 17 -8.299 14.654 16.859 124 HA SER 17 HA SER 17 -10.394 16.878 16.799 125 1HB SER 17 1HB SER 17 -7.462 17.618 16.421 126 2HB SER 17 2HB SER 17 -8.857 18.666 16.363 127 HG SER 17 HG SER 17 -7.819 18.762 18.362 128 H LYS 18 H LYS 18 -10.605 17.874 14.749 129 HA LYS 18 HA LYS 18 -10.244 16.041 12.377 130 1HB LYS 18 1HB LYS 18 -11.526 18.815 12.651 131 2HB LYS 18 2HB LYS 18 -11.009 18.249 11.082 132 1HG LYS 18 1HG LYS 18 -13.321 17.715 11.268 133 2HG LYS 18 2HG LYS 18 -12.408 16.218 11.210 134 1HD LYS 18 1HD LYS 18 -12.666 15.989 13.738 135 2HD LYS 18 2HD LYS 18 -13.611 17.481 13.761 136 1HE LYS 18 1HE LYS 18 -15.338 16.388 12.239 137 2HE LYS 18 2HE LYS 18 -14.363 14.910 12.196 138 1HZ LYS 18 1HZ LYS 18 -15.577 16.113 14.621 139 2HZ LYS 18 2HZ LYS 18 -16.126 14.795 13.826 140 H LYS 19 H LYS 19 -8.715 19.015 13.530 141 HA LYS 19 HA LYS 19 -6.546 19.121 11.531 142 1HB LYS 19 2HB LYS 19 -6.629 20.167 14.427 143 2HB LYS 19 1HB LYS 19 -5.242 20.397 13.367 144 1HG LYS 19 1HG LYS 19 -6.426 22.425 13.303 145 2HG LYS 19 2HG LYS 19 -6.629 21.678 11.737 146 1HD LYS 19 1HD LYS 19 -8.677 22.799 12.425 147 2HD LYS 19 2HD LYS 19 -8.988 21.084 12.261 148 1HE LYS 19 1HE LYS 19 -8.850 20.828 14.807 149 2HE LYS 19 2HE LYS 19 -8.526 22.562 14.951 150 1HZ LYS 19 1HZ LYS 19 -10.837 22.080 15.288 151 2HZ LYS 19 2HZ LYS 19 -10.671 23.002 13.949 152 H ASP 20 H ASP 20 -6.843 17.248 14.650 153 HA ASP 20 HA ASP 20 -4.035 16.178 14.389 154 1HB ASP 20 1HB ASP 20 -6.381 15.523 16.278 155 2HB ASP 20 2HB ASP 20 -5.055 14.404 16.175 156 HD2 ASP 20 HD2 ASP 20 -4.650 17.705 18.310 157 H ALA 21 H ALA 21 -7.188 15.088 13.293 158 HA ALA 21 HA ALA 21 -6.264 12.398 12.413 159 1HB ALA 21 2HB ALA 21 -8.887 13.970 12.081 160 2HB ALA 21 3HB ALA 21 -8.587 12.412 11.262 161 3HB ALA 21 1HB ALA 21 -8.535 12.526 13.001 162 H THR 22 H THR 22 -6.582 15.597 10.750 163 HA THR 22 HA THR 22 -5.827 14.748 8.088 164 HB THR 22 HB THR 22 -5.019 17.431 9.435 165 HG1 THR 22 HG1 THR 22 -7.176 17.026 9.898 166 1HG2 THR 22 3HG2 THR 22 -5.844 16.670 6.569 167 2HG2 THR 22 1HG2 THR 22 -5.633 18.344 7.149 168 3HG2 THR 22 2HG2 THR 22 -4.242 17.203 7.123 169 H LYS 23 H LYS 23 -3.877 15.828 10.757 170 HA LYS 23 HA LYS 23 -1.230 15.445 9.522 171 1HB LYS 23 2HB LYS 23 -2.319 15.321 12.467 172 2HB LYS 23 1HB LYS 23 -0.628 15.179 12.158 173 1HG LYS 23 1HG LYS 23 -0.521 17.516 11.184 174 2HG LYS 23 2HG LYS 23 -2.261 17.694 11.410 175 1HD LYS 23 1HD LYS 23 -1.936 17.344 13.939 176 2HD LYS 23 2HD LYS 23 -0.205 17.236 13.663 177 1HE LYS 23 1HE LYS 23 -0.613 19.469 14.429 178 2HE LYS 23 2HE LYS 23 -0.216 19.617 12.718 179 1HZ LYS 23 1HZ LYS 23 -2.618 19.759 12.264 180 2HZ LYS 23 2HZ LYS 23 -2.966 19.617 13.855 181 H ALA 24 H ALA 24 -3.015 13.441 11.764 182 HA ALA 24 HA ALA 24 -1.175 11.294 12.012 183 1HB ALA 24 2HB ALA 24 -2.924 11.704 13.563 184 2HB ALA 24 3HB ALA 24 -4.186 11.303 12.346 185 3HB ALA 24 1HB ALA 24 -3.061 10.032 12.952 186 H VAL 25 H VAL 25 -3.803 11.562 9.603 187 HA VAL 25 HA VAL 25 -3.219 8.978 8.121 188 HB VAL 25 HB VAL 25 -4.520 11.863 7.728 189 1HG1 VAL 25 1HG2 VAL 25 -4.212 9.891 5.386 190 2HG1 VAL 25 2HG2 VAL 25 -5.296 11.331 5.397 191 3HG1 VAL 25 3HG2 VAL 25 -3.558 11.528 5.509 192 1HG2 VAL 25 3HG1 VAL 25 -5.876 10.118 8.904 193 2HG2 VAL 25 1HG1 VAL 25 -6.647 10.757 7.447 194 3HG2 VAL 25 2HG1 VAL 25 -5.891 9.133 7.410 195 H ASP 26 H ASP 26 -2.199 12.421 7.430 196 HA ASP 26 HA ASP 26 -0.079 11.572 5.574 197 1HB ASP 26 1HB ASP 26 -1.105 13.931 5.809 198 2HB ASP 26 2HB ASP 26 -0.121 14.171 7.240 199 HD1 ASP 26 HD2 ASP 26 1.442 14.188 3.489 200 H ALA 27 H ALA 27 -0.117 11.346 8.977 201 HA ALA 27 HA ALA 27 2.783 11.238 9.501 202 1HB ALA 27 2HB ALA 27 0.748 11.926 11.145 203 2HB ALA 27 3HB ALA 27 0.664 10.189 11.380 204 3HB ALA 27 1HB ALA 27 2.131 11.113 11.763 205 H VAL 28 H VAL 28 0.256 8.855 9.078 206 HA VAL 28 HA VAL 28 1.969 6.442 9.191 207 HB VAL 28 HB VAL 28 -0.638 6.772 7.486 208 1HG1 VAL 28 2HG2 VAL 28 1.118 4.488 8.275 209 2HG1 VAL 28 3HG2 VAL 28 -0.613 4.188 8.426 210 3HG1 VAL 28 1HG2 VAL 28 0.014 4.749 6.868 211 1HG2 VAL 28 2HG1 VAL 28 -0.526 6.117 10.407 212 2HG2 VAL 28 3HG1 VAL 28 -1.442 7.384 9.494 213 3HG2 VAL 28 1HG1 VAL 28 -1.889 5.695 9.282 214 H PHE 29 H PHE 29 0.458 8.164 6.652 215 HA PHE 29 HA PHE 29 1.920 6.975 4.367 216 1HB PHE 29 2HB PHE 29 -0.112 9.275 4.382 217 2HB PHE 29 1HB PHE 29 0.350 8.384 2.955 218 HD1 PHE 29 HD1 PHE 29 0.281 5.520 3.702 219 HD2 PHE 29 HD2 PHE 29 -2.380 8.710 4.807 220 HE1 PHE 29 HE1 PHE 29 -1.433 3.881 4.303 221 HE2 PHE 29 HE2 PHE 29 -4.082 7.053 5.438 222 HZ PHE 29 HZ PHE 29 -3.563 4.630 5.249 223 H ASP 30 H ASP 30 3.147 9.297 6.328 224 HA ASP 30 HA ASP 30 4.944 10.234 4.056 225 1HB ASP 30 1HB ASP 30 4.196 11.878 5.900 226 2HB ASP 30 2HB ASP 30 5.232 11.042 7.028 227 HD2 ASP 30 HD2 ASP 30 8.068 12.684 6.065 228 H SER 31 H SER 31 5.151 8.517 7.030 229 HA SER 31 HA SER 31 8.011 7.671 6.811 230 1HB SER 31 1HB SER 31 5.879 6.082 8.313 231 2HB SER 31 2HB SER 31 7.629 6.009 8.542 232 HG SER 31 HG SER 31 7.606 8.192 9.168 233 H ILE 32 H ILE 32 4.947 6.005 5.585 234 HA ILE 32 HA ILE 32 6.160 3.701 4.613 235 HB ILE 32 HB ILE 32 3.659 5.101 3.602 236 1HG1 ILE 32 1HG1 ILE 32 4.183 3.088 5.826 237 2HG1 ILE 32 2HG1 ILE 32 3.799 4.765 6.040 238 1HG2 ILE 32 2HG2 ILE 32 5.126 2.515 3.018 239 2HG2 ILE 32 3HG2 ILE 32 3.417 2.244 3.334 240 3HG2 ILE 32 1HG2 ILE 32 3.988 3.337 2.012 241 1HD1 ILE 32 1HD1 ILE 32 1.765 2.994 4.709 242 2HD1 ILE 32 2HD1 ILE 32 1.876 3.343 6.468 243 3HD1 ILE 32 3HD1 ILE 32 1.639 4.686 5.304 244 H THR 33 H THR 33 5.412 6.714 2.901 245 HA THR 33 HA THR 33 6.649 6.011 0.293 246 HB THR 33 HB THR 33 5.158 7.649 0.145 247 HG1 THR 33 HG1 THR 33 7.028 8.162 -0.970 248 1HG2 THR 33 3HG2 THR 33 4.990 8.367 2.573 249 2HG2 THR 33 1HG2 THR 33 6.378 9.417 2.336 250 3HG2 THR 33 2HG2 THR 33 4.828 9.707 1.457 251 H GLU 34 H GLU 34 7.986 7.178 3.272 252 HA GLU 34 HA GLU 34 10.780 7.481 2.159 253 1HB GLU 34 1HB GLU 34 9.764 7.471 5.082 254 2HB GLU 34 2HB GLU 34 11.462 7.588 4.648 255 1HG GLU 34 1HG GLU 34 11.120 9.751 3.479 256 2HG GLU 34 2HG GLU 34 9.382 9.670 3.727 257 HE2 GLU 34 HE2 GLU 34 11.802 11.004 6.603 258 H ALA 35 H ALA 35 8.757 4.902 3.663 259 HA ALA 35 HA ALA 35 11.030 3.062 3.897 260 1HB ALA 35 3HB ALA 35 8.735 2.541 5.159 261 2HB ALA 35 1HB ALA 35 8.024 2.232 3.573 262 3HB ALA 35 2HB ALA 35 9.275 1.178 4.175 263 H LEU 36 H LEU 36 8.329 3.177 1.419 264 HA LEU 36 HA LEU 36 9.561 1.273 -0.414 265 1HB LEU 36 2HB LEU 36 7.663 3.523 -0.891 266 2HB LEU 36 1HB LEU 36 7.932 2.214 -1.975 267 HG LEU 36 HG LEU 36 6.751 2.267 0.279 268 1HD1 LEU 36 1HD2 LEU 36 8.296 -0.249 0.353 269 2HD1 LEU 36 2HD2 LEU 36 7.663 0.755 1.684 270 3HD1 LEU 36 3HD2 LEU 36 6.665 -0.485 0.973 271 1HD2 LEU 36 2HD1 LEU 36 4.865 2.281 -0.366 272 2HD2 LEU 36 3HD1 LEU 36 4.953 0.503 -0.334 273 3HD2 LEU 36 1HD1 LEU 36 5.214 1.368 1.168 274 NH1 ARG 37 NH2 ARG 37 13.674 10.540 -1.643 275 NH2 ARG 37 NH1 ARG 37 12.343 11.229 -3.353 276 H ARG 37 H ARG 37 9.860 4.876 -0.261 277 HA ARG 37 HA ARG 37 11.261 4.858 -2.743 278 1HB ARG 37 1HB ARG 37 11.649 7.058 -2.798 279 2HB ARG 37 2HB ARG 37 10.177 6.941 -1.874 280 1HG ARG 37 1HG ARG 37 11.861 7.060 0.239 281 2HG ARG 37 2HG ARG 37 13.039 7.616 -0.936 282 1HD ARG 37 1HD ARG 37 10.360 8.872 -0.234 283 2HD ARG 37 2HD ARG 37 11.962 9.446 0.254 284 1HH1 ARG 37 2HH2 ARG 37 13.761 9.987 -0.784 285 2HH1 ARG 37 1HH2 ARG 37 14.406 11.106 -2.086 286 1HH2 ARG 37 1HH1 ARG 37 11.419 11.201 -3.798 287 2HH2 ARG 37 2HH1 ARG 37 13.167 11.746 -3.679 288 H LYS 38 H LYS 38 12.326 4.151 0.540 289 HA LYS 38 HA LYS 38 15.247 4.622 -0.128 290 1HB LYS 38 1HB LYS 38 14.185 5.671 1.934 291 2HB LYS 38 2HB LYS 38 14.031 4.057 2.621 292 1HG LYS 38 1HG LYS 38 16.541 3.842 2.657 293 2HG LYS 38 2HG LYS 38 16.698 5.335 1.744 294 1HD LYS 38 1HD LYS 38 17.193 5.893 4.021 295 2HD LYS 38 2HD LYS 38 15.655 6.627 3.637 296 1HE LYS 38 1HE LYS 38 15.444 5.763 5.866 297 2HE LYS 38 2HE LYS 38 14.459 4.700 4.868 298 1HZ LYS 38 1HZ LYS 38 16.339 3.129 4.846 299 2HZ LYS 38 2HZ LYS 38 17.232 4.130 5.781 300 H GLY 39 H GLY 39 13.225 2.080 -0.598 301 1HA GLY 39 1HA GLY 39 13.623 -0.274 -0.922 302 2HA GLY 39 2HA GLY 39 15.306 -0.053 -0.482 303 H ASP 40 H ASP 40 12.419 0.704 1.394 304 HA ASP 40 HA ASP 40 13.037 -1.425 3.506 305 1HB ASP 40 1HB ASP 40 12.218 1.434 3.966 306 2HB ASP 40 2HB ASP 40 12.162 0.206 5.205 307 HD1 ASP 40 HD2 ASP 40 15.649 1.821 3.979 308 H LYS 41 H LYS 41 11.607 -2.577 4.401 309 HA LYS 41 HA LYS 41 8.825 -2.662 3.212 310 1HB LYS 41 2HB LYS 41 9.924 -4.552 5.363 311 2HB LYS 41 1HB LYS 41 8.416 -4.714 4.462 312 1HG LYS 41 1HG LYS 41 9.985 -4.824 2.314 313 2HG LYS 41 2HG LYS 41 11.283 -5.126 3.457 314 1HD LYS 41 1HD LYS 41 10.004 -7.110 4.392 315 2HD LYS 41 2HD LYS 41 8.669 -6.775 3.282 316 1HE LYS 41 1HE LYS 41 10.227 -7.148 1.303 317 2HE LYS 41 2HE LYS 41 11.541 -7.538 2.428 318 1HZ LYS 41 1HZ LYS 41 10.227 -9.378 3.259 319 2HZ LYS 41 2HZ LYS 41 10.467 -9.516 1.648 320 H VAL 42 H VAL 42 7.042 -1.892 4.341 321 HA VAL 42 HA VAL 42 7.114 -0.671 6.884 322 HB VAL 42 HB VAL 42 4.862 -1.395 4.963 323 1HG1 VAL 42 3HG2 VAL 42 4.191 -0.138 7.038 324 2HG1 VAL 42 1HG2 VAL 42 5.379 1.131 6.607 325 3HG1 VAL 42 2HG2 VAL 42 3.979 0.825 5.541 326 1HG2 VAL 42 2HG1 VAL 42 6.803 -0.217 3.626 327 2HG2 VAL 42 3HG1 VAL 42 5.295 0.665 3.708 328 3HG2 VAL 42 1HG1 VAL 42 6.642 1.144 4.769 329 H GLN 43 H GLN 43 4.449 -1.853 7.187 330 HA GLN 43 HA GLN 43 3.691 -3.994 7.543 331 1HB GLN 43 1HB GLN 43 5.855 -4.762 9.381 332 2HB GLN 43 2HB GLN 43 4.270 -5.531 9.558 333 1HG GLN 43 1HG GLN 43 4.189 -6.224 7.267 334 2HG GLN 43 2HG GLN 43 5.619 -5.349 6.822 335 1HE2 GLN 43 2HE2 GLN 43 7.735 -8.133 7.685 336 2HE2 GLN 43 1HE2 GLN 43 7.487 -6.562 6.773 337 H LEU 44 H LEU 44 1.915 -4.599 8.337 338 HA LEU 44 HA LEU 44 0.762 -3.084 10.709 339 1HB LEU 44 2HB LEU 44 -0.816 -3.583 8.102 340 2HB LEU 44 1HB LEU 44 -1.338 -2.700 9.524 341 HG LEU 44 HG LEU 44 0.881 -1.213 8.831 342 1HD1 LEU 44 1HD1 LEU 44 1.393 -2.581 6.757 343 2HD1 LEU 44 2HD1 LEU 44 -0.194 -2.143 6.089 344 3HD1 LEU 44 3HD1 LEU 44 1.034 -0.888 6.392 345 1HD2 LEU 44 2HD2 LEU 44 -1.434 -0.308 9.200 346 2HD2 LEU 44 3HD2 LEU 44 -0.675 0.426 7.773 347 3HD2 LEU 44 1HD2 LEU 44 -1.917 -0.834 7.571 348 H ILE 45 H ILE 45 0.112 -4.668 12.152 349 HA ILE 45 HA ILE 45 -0.249 -7.460 11.261 350 HB ILE 45 HB ILE 45 0.895 -6.833 13.386 351 1HG1 ILE 45 1HG1 ILE 45 -1.347 -8.904 13.752 352 2HG1 ILE 45 2HG1 ILE 45 0.084 -9.169 12.771 353 1HG2 ILE 45 1HG2 ILE 45 -0.835 -5.172 14.206 354 2HG2 ILE 45 2HG2 ILE 45 -1.933 -6.522 14.561 355 3HG2 ILE 45 3HG2 ILE 45 -0.375 -6.377 15.434 356 1HD1 ILE 45 3HD1 ILE 45 1.575 -8.857 14.792 357 2HD1 ILE 45 1HD1 ILE 45 0.124 -8.665 15.813 358 3HD1 ILE 45 2HD1 ILE 45 0.422 -10.201 14.971 359 H GLY 46 H GLY 46 -2.060 -8.673 11.400 360 1HA GLY 46 1HA GLY 46 -4.309 -9.190 10.753 361 2HA GLY 46 2HA GLY 46 -4.780 -7.883 11.808 362 H PHE 47 H PHE 47 -2.980 -6.554 9.239 363 HA PHE 47 HA PHE 47 -5.316 -6.212 7.360 364 1HB PHE 47 2HB PHE 47 -5.124 -4.535 9.297 365 2HB PHE 47 1HB PHE 47 -3.588 -3.986 8.686 366 HD1 PHE 47 HD2 PHE 47 -7.239 -4.299 7.666 367 HD2 PHE 47 HD1 PHE 47 -3.441 -2.456 6.809 368 HE1 PHE 47 HE2 PHE 47 -8.207 -3.081 5.720 369 HE2 PHE 47 HE1 PHE 47 -4.460 -1.272 4.913 370 HZ PHE 47 HZ PHE 47 -6.849 -1.697 4.346 371 H GLY 48 H GLY 48 -1.707 -5.789 7.634 372 1HA GLY 48 1HA GLY 48 -1.497 -5.813 4.693 373 2HA GLY 48 2HA GLY 48 -1.297 -4.202 5.321 374 H ASN 49 H ASN 49 0.477 -5.557 3.744 375 HA ASN 49 HA ASN 49 2.960 -4.962 5.369 376 1HB ASN 49 1HB ASN 49 2.748 -7.377 5.694 377 2HB ASN 49 2HB ASN 49 2.519 -7.681 3.993 378 1HD2 ASN 49 1HD2 ASN 49 5.995 -8.670 4.514 379 2HD2 ASN 49 2HD2 ASN 49 4.265 -9.228 4.761 380 H PHE 50 H PHE 50 3.343 -3.155 4.179 381 HA PHE 50 HA PHE 50 3.181 -3.174 1.160 382 1HB PHE 50 2HB PHE 50 4.312 -1.017 2.976 383 2HB PHE 50 1HB PHE 50 4.340 -0.863 1.272 384 HD1 PHE 50 HD1 PHE 50 2.300 -0.930 4.288 385 HD2 PHE 50 HD2 PHE 50 2.689 0.452 0.268 386 HE1 PHE 50 HE1 PHE 50 0.359 0.628 4.628 387 HE2 PHE 50 HE2 PHE 50 0.809 2.029 0.644 388 HZ PHE 50 HZ PHE 50 -0.432 1.942 2.757 389 H GLU 51 H GLU 51 4.910 -3.038 -0.143 390 HA GLU 51 HA GLU 51 7.508 -2.425 0.706 391 1HB GLU 51 1HB GLU 51 8.830 -4.563 0.398 392 2HB GLU 51 2HB GLU 51 7.681 -4.795 1.681 393 1HG GLU 51 1HG GLU 51 7.248 -5.821 -1.208 394 2HG GLU 51 2HG GLU 51 8.024 -6.752 0.055 395 HE1 GLU 51 HE2 GLU 51 5.152 -7.518 1.825 396 H VAL 52 H VAL 52 9.306 -2.540 -0.959 397 HA VAL 52 HA VAL 52 8.027 -1.870 -3.516 398 HB VAL 52 HB VAL 52 9.857 -0.654 -1.663 399 1HG1 VAL 52 1HG2 VAL 52 11.507 -1.735 -3.960 400 2HG1 VAL 52 2HG2 VAL 52 11.965 -0.419 -2.814 401 3HG1 VAL 52 3HG2 VAL 52 11.664 -2.090 -2.230 402 1HG2 VAL 52 3HG1 VAL 52 9.325 0.087 -4.551 403 2HG2 VAL 52 1HG1 VAL 52 8.351 0.485 -3.113 404 3HG2 VAL 52 2HG1 VAL 52 9.991 1.113 -3.265 405 NH1 ARG 53 NH2 ARG 53 11.573 -7.949 -10.604 406 NH2 ARG 53 NH1 ARG 53 10.984 -10.023 -9.891 407 H ARG 53 H ARG 53 8.980 -2.540 -5.493 408 HA ARG 53 HA ARG 53 10.393 -5.283 -5.396 409 1HB ARG 53 1HB ARG 53 7.855 -5.255 -6.064 410 2HB ARG 53 2HB ARG 53 8.377 -4.571 -7.584 411 1HG ARG 53 1HG ARG 53 9.247 -7.243 -6.383 412 2HG ARG 53 2HG ARG 53 8.034 -6.996 -7.648 413 1HD ARG 53 1HD ARG 53 9.804 -6.209 -9.246 414 2HD ARG 53 2HD ARG 53 11.045 -6.424 -8.001 415 1HH1 ARG 53 2HH2 ARG 53 11.513 -6.935 -10.459 416 2HH1 ARG 53 1HH2 ARG 53 12.078 -8.434 -11.353 417 1HH2 ARG 53 1HH1 ARG 53 10.478 -10.594 -9.206 418 2HH2 ARG 53 2HH1 ARG 53 11.531 -10.363 -10.690 419 H GLU 54 H GLU 54 12.376 -4.648 -5.788 420 HA GLU 54 HA GLU 54 13.188 -2.534 -7.722 421 1HB GLU 54 1HB GLU 54 14.533 -3.082 -5.725 422 2HB GLU 54 2HB GLU 54 14.921 -4.675 -6.340 423 1HG GLU 54 1HG GLU 54 15.640 -2.050 -7.817 424 2HG GLU 54 2HG GLU 54 16.667 -2.748 -6.575 425 HE1 GLU 54 HE2 GLU 54 17.486 -5.624 -8.567 426 NH1 ARG 55 NH2 ARG 55 10.128 -8.173 -14.463 427 NH2 ARG 55 NH1 ARG 55 10.347 -7.547 -16.636 428 H ARG 55 H ARG 55 13.137 -2.765 -9.854 429 HA ARG 55 HA ARG 55 12.704 -5.456 -11.107 430 1HB ARG 55 1HB ARG 55 11.282 -3.500 -11.774 431 2HB ARG 55 2HB ARG 55 12.695 -2.649 -12.361 432 1HG ARG 55 1HG ARG 55 11.513 -3.533 -14.245 433 2HG ARG 55 2HG ARG 55 13.044 -4.390 -14.139 434 1HD ARG 55 1HD ARG 55 11.883 -6.377 -13.098 435 2HD ARG 55 2HD ARG 55 10.338 -5.507 -13.114 436 1HH1 ARG 55 2HH2 ARG 55 10.263 -7.931 -13.475 437 2HH1 ARG 55 1HH2 ARG 55 9.725 -9.040 -14.834 438 1HH2 ARG 55 1HH1 ARG 55 10.649 -6.832 -17.307 439 2HH2 ARG 55 2HH1 ARG 55 9.930 -8.458 -16.855 440 H ALA 56 H ALA 56 14.466 -6.616 -11.483 441 HA ALA 56 HA ALA 56 17.179 -5.642 -11.365 442 1HB ALA 56 2HB ALA 56 16.587 -7.968 -10.809 443 2HB ALA 56 3HB ALA 56 16.175 -8.322 -12.507 444 3HB ALA 56 1HB ALA 56 17.853 -7.942 -12.050 445 H ALA 57 H ALA 57 17.733 -4.106 -12.794 446 HA ALA 57 HA ALA 57 17.313 -3.682 -15.419 447 1HB ALA 57 3HB ALA 57 18.775 -2.196 -14.013 448 2HB ALA 57 1HB ALA 57 20.111 -3.371 -14.108 449 3HB ALA 57 2HB ALA 57 19.577 -2.504 -15.563 450 NH1 ARG 58 NH2 ARG 58 12.682 -5.203 -18.139 451 NH2 ARG 58 NH1 ARG 58 12.430 -5.132 -20.396 452 H ARG 58 H ARG 58 17.417 -4.421 -17.272 453 HA ARG 58 HA ARG 58 18.668 -7.075 -17.547 454 1HB ARG 58 2HB ARG 58 16.692 -5.870 -19.534 455 2HB ARG 58 1HB ARG 58 17.121 -7.567 -19.360 456 1HG ARG 58 1HG ARG 58 16.085 -7.435 -16.986 457 2HG ARG 58 2HG ARG 58 15.473 -5.845 -17.421 458 1HD ARG 58 1HD ARG 58 14.802 -8.480 -18.884 459 2HD ARG 58 2HD ARG 58 13.790 -7.734 -17.668 460 1HH1 ARG 58 2HH2 ARG 58 13.128 -5.653 -17.332 461 2HH1 ARG 58 1HH2 ARG 58 12.021 -4.419 -18.118 462 1HH2 ARG 58 1HH1 ARG 58 12.683 -5.523 -21.310 463 2HH2 ARG 58 2HH1 ARG 58 11.788 -4.353 -20.217 464 H LYS 59 H LYS 59 18.894 -7.381 -20.290 465 HA LYS 59 HA LYS 59 20.727 -5.261 -21.417 466 1HB LYS 59 1HB LYS 59 22.247 -6.892 -20.194 467 2HB LYS 59 2HB LYS 59 21.678 -8.192 -21.237 468 1HG LYS 59 1HG LYS 59 22.550 -6.922 -23.260 469 2HG LYS 59 2HG LYS 59 23.072 -5.603 -22.209 470 1HD LYS 59 1HD LYS 59 24.613 -7.227 -20.981 471 2HD LYS 59 2HD LYS 59 24.105 -8.512 -22.086 472 1HE LYS 59 1HE LYS 59 24.989 -7.148 -24.050 473 2HE LYS 59 2HE LYS 59 25.525 -5.889 -22.931 474 1HZ LYS 59 1HZ LYS 59 26.448 -8.710 -22.891 475 2HZ LYS 59 2HZ LYS 59 26.940 -7.549 -21.850 476 H GLY 60 H GLY 60 19.768 -4.860 -23.344 477 1HA GLY 60 1HA GLY 60 17.773 -6.943 -24.470 478 2HA GLY 60 2HA GLY 60 17.628 -5.220 -24.714 479 NH1 ARG 61 NH2 ARG 61 17.935 0.816 -29.827 480 NH2 ARG 61 NH1 ARG 61 16.173 -0.294 -30.735 481 H ARG 61 H ARG 61 19.575 -4.188 -25.631 482 HA ARG 61 HA ARG 61 20.633 -5.424 -28.194 483 1HB ARG 61 1HB ARG 61 20.816 -2.665 -27.194 484 2HB ARG 61 2HB ARG 61 21.420 -3.316 -28.703 485 1HG ARG 61 1HG ARG 61 19.167 -3.944 -29.466 486 2HG ARG 61 2HG ARG 61 18.465 -3.348 -27.963 487 1HD ARG 61 1HD ARG 61 19.400 -1.024 -28.470 488 2HD ARG 61 2HD ARG 61 20.003 -1.635 -30.011 489 1HH1 ARG 61 2HH2 ARG 61 18.850 0.758 -29.367 490 2HH1 ARG 61 1HH2 ARG 61 17.420 1.671 -30.065 491 1HH2 ARG 61 1HH1 ARG 61 15.743 -1.195 -30.973 492 2HH2 ARG 61 2HH1 ARG 61 15.782 0.638 -30.912 493 H ASN 62 H ASN 62 22.711 -6.043 -28.666 494 HA ASN 62 HA ASN 62 24.424 -6.786 -26.290 495 1HB ASN 62 1HB ASN 62 22.967 -8.620 -28.321 496 2HB ASN 62 2HB ASN 62 24.492 -9.095 -27.706 497 1HD2 ASN 62 2HD2 ASN 62 21.380 -9.743 -25.258 498 2HD2 ASN 62 1HD2 ASN 62 21.213 -9.127 -26.979 499 HA PRO 63 HA PRO 63 27.912 -5.930 -29.159 500 1HB PRO 63 1HB PRO 63 29.206 -8.442 -27.988 501 2HB PRO 63 2HB PRO 63 29.900 -6.823 -28.207 502 1HG PRO 63 1HG PRO 63 29.063 -7.611 -25.743 503 2HG PRO 63 2HG PRO 63 28.697 -5.958 -26.293 504 1HD PRO 63 1HD PRO 63 26.815 -8.388 -26.278 505 2HD PRO 63 2HD PRO 63 26.511 -6.702 -25.767 506 H GLN 64 H GLN 64 26.700 -9.260 -29.082 507 HA GLN 64 HA GLN 64 27.809 -10.360 -31.524 508 1HB GLN 64 1HB GLN 64 26.432 -11.539 -29.589 509 2HB GLN 64 2HB GLN 64 24.999 -10.866 -30.293 510 1HG GLN 64 1HG GLN 64 25.024 -13.042 -31.065 511 2HG GLN 64 2HG GLN 64 25.499 -12.117 -32.471 512 1HE2 GLN 64 2HE2 GLN 64 28.195 -14.838 -30.999 513 2HE2 GLN 64 1HE2 GLN 64 26.613 -14.474 -30.144 514 H THR 65 H THR 65 24.617 -8.997 -30.999 515 HA THR 65 HA THR 65 23.636 -9.051 -33.670 516 HB THR 65 HB THR 65 21.709 -7.816 -32.798 517 HG1 THR 65 HG1 THR 65 21.753 -7.027 -30.697 518 1HG2 THR 65 2HG2 THR 65 21.997 -10.278 -32.061 519 2HG2 THR 65 3HG2 THR 65 22.746 -9.705 -30.565 520 3HG2 THR 65 1HG2 THR 65 21.054 -9.300 -30.894 521 H GLY 66 H GLY 66 25.300 -6.341 -32.142 522 1HA GLY 66 1HA GLY 66 26.461 -4.909 -34.102 523 2HA GLY 66 2HA GLY 66 24.815 -4.592 -34.635 524 H GLU 67 H GLU 67 23.471 -4.239 -32.213 525 HA GLU 67 HA GLU 67 24.662 -1.586 -31.247 526 1HB GLU 67 2HB GLU 67 22.536 -1.592 -32.792 527 2HB GLU 67 1HB GLU 67 21.656 -2.302 -31.448 528 1HG GLU 67 1HG GLU 67 22.220 -0.277 -30.027 529 2HG GLU 67 2HG GLU 67 23.200 0.380 -31.337 530 HE2 GLU 67 HE2 GLU 67 20.285 2.269 -31.644 531 H GLU 68 H GLU 68 24.116 -1.174 -28.940 532 HA GLU 68 HA GLU 68 23.128 -3.495 -27.358 533 1HB GLU 68 1HB GLU 68 25.638 -3.871 -27.721 534 2HB GLU 68 2HB GLU 68 26.023 -2.321 -27.018 535 1HG GLU 68 1HG GLU 68 24.819 -4.707 -25.483 536 2HG GLU 68 2HG GLU 68 26.527 -4.381 -25.648 537 HE1 GLU 68 HE2 GLU 68 26.520 -1.559 -23.516 538 H MET 69 H MET 69 22.108 -2.972 -25.391 539 HA MET 69 HA MET 69 22.910 -0.584 -23.916 540 1HB MET 69 1HB MET 69 21.212 0.901 -24.013 541 2HB MET 69 2HB MET 69 21.304 0.443 -25.689 542 1HG MET 69 1HG MET 69 19.159 -0.489 -23.663 543 2HG MET 69 2HG MET 69 18.964 0.770 -24.881 544 1HE MET 69 3HE MET 69 16.959 -1.714 -24.626 545 2HE MET 69 2HE MET 69 17.296 -3.092 -25.717 546 3HE MET 69 1HE MET 69 18.217 -2.916 -24.203 547 H GLU 70 H GLU 70 22.626 -0.911 -21.880 548 HA GLU 70 HA GLU 70 21.143 -3.245 -20.803 549 1HB GLU 70 2HB GLU 70 22.043 -2.759 -18.649 550 2HB GLU 70 1HB GLU 70 23.317 -2.765 -19.874 551 1HG GLU 70 1HG GLU 70 23.350 -0.218 -19.818 552 2HG GLU 70 2HG GLU 70 22.102 -0.230 -18.576 553 HE1 GLU 70 HE2 GLU 70 24.163 -1.200 -15.979 554 H ILE 71 H ILE 71 19.056 -3.239 -20.151 555 HA ILE 71 HA ILE 71 17.433 -0.834 -20.393 556 HB ILE 71 HB ILE 71 16.704 -3.699 -19.514 557 1HG1 ILE 71 1HG1 ILE 71 16.509 -2.384 -22.320 558 2HG1 ILE 71 2HG1 ILE 71 17.734 -3.553 -21.880 559 1HG2 ILE 71 2HG2 ILE 71 14.999 -2.006 -18.874 560 2HG2 ILE 71 3HG2 ILE 71 14.940 -1.416 -20.567 561 3HG2 ILE 71 1HG2 ILE 71 14.400 -3.074 -20.157 562 1HD1 ILE 71 2HD1 ILE 71 16.023 -5.354 -21.585 563 2HD1 ILE 71 3HD1 ILE 71 14.738 -4.207 -22.060 564 3HD1 ILE 71 1HD1 ILE 71 16.008 -4.643 -23.210 565 HA PRO 72 HA PRO 72 18.341 0.145 -15.998 566 1HB PRO 72 1HB PRO 72 16.828 2.465 -15.639 567 2HB PRO 72 2HB PRO 72 18.308 2.363 -16.601 568 1HG PRO 72 1HG PRO 72 15.421 2.203 -17.610 569 2HG PRO 72 2HG PRO 72 16.738 3.229 -18.229 570 1HD PRO 72 1HD PRO 72 16.098 0.826 -19.421 571 2HD PRO 72 2HD PRO 72 17.802 1.370 -19.337 572 H ALA 73 H ALA 73 17.542 0.243 -13.917 573 HA ALA 73 HA ALA 73 15.213 -1.538 -13.334 574 1HB ALA 73 1HB ALA 73 17.367 -1.610 -11.919 575 2HB ALA 73 2HB ALA 73 17.019 0.063 -11.349 576 3HB ALA 73 3HB ALA 73 15.946 -1.264 -10.924 577 H SER 74 H SER 74 13.851 -1.081 -11.546 578 HA SER 74 HA SER 74 13.655 1.442 -10.436 579 1HB SER 74 1HB SER 74 12.330 2.150 -12.564 580 2HB SER 74 2HB SER 74 11.072 0.979 -12.154 581 HG SER 74 HG SER 74 10.610 3.090 -11.481 582 H LYS 75 H LYS 75 12.467 1.617 -8.607 583 HA LYS 75 HA LYS 75 11.580 -0.967 -7.337 584 1HB LYS 75 2HB LYS 75 11.178 1.412 -5.621 585 2HB LYS 75 1HB LYS 75 11.769 -0.191 -5.310 586 1HG LYS 75 1HG LYS 75 14.033 0.448 -6.224 587 2HG LYS 75 2HG LYS 75 13.415 2.061 -6.598 588 1HD LYS 75 1HD LYS 75 12.886 2.401 -4.103 589 2HD LYS 75 2HD LYS 75 13.592 0.826 -3.783 590 1HE LYS 75 1HE LYS 75 15.277 2.434 -3.233 591 2HE LYS 75 2HE LYS 75 15.829 1.632 -4.703 592 1HZ LYS 75 1HZ LYS 75 14.475 4.279 -4.586 593 2HZ LYS 75 2HZ LYS 75 14.975 3.552 -5.963 594 H VAL 76 H VAL 76 9.315 -1.686 -7.397 595 HA VAL 76 HA VAL 76 7.323 0.229 -8.250 596 HB VAL 76 HB VAL 76 8.368 -2.532 -8.638 597 1HG1 VAL 76 3HG2 VAL 76 5.438 -2.363 -8.423 598 2HG1 VAL 76 1HG2 VAL 76 6.456 -3.694 -9.180 599 3HG1 VAL 76 2HG2 VAL 76 6.598 -3.332 -7.453 600 1HG2 VAL 76 2HG1 VAL 76 8.415 -0.838 -10.382 601 2HG2 VAL 76 3HG1 VAL 76 7.555 -2.320 -10.849 602 3HG2 VAL 76 1HG1 VAL 76 6.617 -0.845 -10.422 603 HA PRO 77 HA PRO 77 6.004 -0.361 -3.851 604 1HB PRO 77 1HB PRO 77 4.068 1.652 -3.724 605 2HB PRO 77 2HB PRO 77 5.786 2.037 -3.908 606 1HG PRO 77 1HG PRO 77 3.665 1.836 -6.102 607 2HG PRO 77 2HG PRO 77 4.802 3.154 -5.838 608 1HD PRO 77 1HD PRO 77 5.223 0.950 -7.679 609 2HD PRO 77 2HD PRO 77 6.606 1.799 -6.940 610 H ALA 78 H ALA 78 4.791 -1.518 -2.900 611 HA ALA 78 HA ALA 78 2.091 -2.476 -3.985 612 1HB ALA 78 2HB ALA 78 4.134 -3.910 -4.596 613 2HB ALA 78 3HB ALA 78 4.423 -4.184 -2.864 614 3HB ALA 78 1HB ALA 78 2.924 -4.776 -3.617 615 H PHE 79 H PHE 79 0.970 -3.698 -2.496 616 HA PHE 79 HA PHE 79 1.166 -3.114 0.514 617 1HB PHE 79 2HB PHE 79 0.030 -1.281 0.183 618 2HB PHE 79 1HB PHE 79 -0.981 -1.999 -1.100 619 HD1 PHE 79 HD1 PHE 79 -0.523 -1.880 2.621 620 HD2 PHE 79 HD2 PHE 79 -3.037 -3.219 -0.604 621 HE1 PHE 79 HE1 PHE 79 -2.262 -2.540 4.230 622 HE2 PHE 79 HE2 PHE 79 -4.726 -3.947 1.023 623 HZ PHE 79 HZ PHE 79 -4.330 -3.652 3.436 624 H LYS 80 H LYS 80 0.895 -4.987 1.142 625 HA LYS 80 HA LYS 80 -0.536 -7.479 -0.124 626 1HB LYS 80 2HB LYS 80 1.265 -7.224 2.304 627 2HB LYS 80 1HB LYS 80 0.293 -8.636 1.996 628 1HG LYS 80 1HG LYS 80 1.421 -9.014 -0.207 629 2HG LYS 80 2HG LYS 80 2.392 -7.555 0.004 630 1HD LYS 80 1HD LYS 80 3.496 -8.513 2.016 631 2HD LYS 80 2HD LYS 80 2.479 -9.958 1.941 632 1HE LYS 80 1HE LYS 80 3.484 -10.561 -0.306 633 2HE LYS 80 2HE LYS 80 4.475 -9.096 -0.269 634 1HZ LYS 80 1HZ LYS 80 5.510 -9.923 1.769 635 2HZ LYS 80 2HZ LYS 80 4.596 -11.277 1.739 636 HA PRO 81 HA PRO 81 -3.921 -6.459 2.783 637 1HB PRO 81 1HB PRO 81 -5.582 -8.595 2.277 638 2HB PRO 81 2HB PRO 81 -5.217 -7.395 1.036 639 1HG PRO 81 1HG PRO 81 -3.906 -10.142 1.404 640 2HG PRO 81 2HG PRO 81 -4.654 -9.485 -0.074 641 1HD PRO 81 1HD PRO 81 -1.910 -9.313 0.472 642 2HD PRO 81 2HD PRO 81 -2.769 -8.087 -0.515 643 H GLY 82 H GLY 82 -1.502 -7.455 3.932 644 1HA GLY 82 1HA GLY 82 -0.409 -9.030 5.402 645 2HA GLY 82 2HA GLY 82 -1.760 -8.475 6.370 646 H LYS 83 H LYS 83 -2.556 -10.501 3.740 647 HA LYS 83 HA LYS 83 -3.505 -12.708 3.591 648 1HB LYS 83 2HB LYS 83 -1.672 -13.202 5.924 649 2HB LYS 83 1HB LYS 83 -3.117 -14.131 6.044 650 1HG LYS 83 1HG LYS 83 -2.693 -15.050 3.682 651 2HG LYS 83 2HG LYS 83 -1.223 -14.076 3.589 652 1HD LYS 83 1HD LYS 83 -0.277 -15.312 5.591 653 2HD LYS 83 2HD LYS 83 -1.750 -16.286 5.683 654 1HE LYS 83 1HE LYS 83 -1.293 -17.192 3.344 655 2HE LYS 83 2HE LYS 83 0.185 -16.222 3.262 656 1HZ LYS 83 1HZ LYS 83 0.666 -18.451 3.941 657 2HZ LYS 83 2HZ LYS 83 1.042 -17.430 5.161 658 H ALA 84 H ALA 84 -3.762 -11.321 6.617 659 HA ALA 84 HA ALA 84 -6.215 -12.298 7.788 660 1HB ALA 84 2HB ALA 84 -4.304 -11.129 8.918 661 2HB ALA 84 3HB ALA 84 -4.613 -9.652 7.969 662 3HB ALA 84 1HB ALA 84 -5.815 -10.193 9.172 663 H LEU 85 H LEU 85 -5.669 -9.224 5.856 664 HA LEU 85 HA LEU 85 -8.513 -8.499 5.801 665 1HB LEU 85 2HB LEU 85 -6.825 -6.699 5.488 666 2HB LEU 85 1HB LEU 85 -6.151 -7.545 4.119 667 HG LEU 85 HG LEU 85 -8.461 -7.466 3.106 668 1HD1 LEU 85 2HD1 LEU 85 -9.821 -6.708 5.051 669 2HD1 LEU 85 3HD1 LEU 85 -8.920 -5.182 5.103 670 3HD1 LEU 85 1HD1 LEU 85 -9.975 -5.554 3.714 671 1HD2 LEU 85 1HD2 LEU 85 -6.455 -6.054 2.338 672 2HD2 LEU 85 2HD2 LEU 85 -8.003 -5.279 2.028 673 3HD2 LEU 85 3HD2 LEU 85 -6.993 -4.740 3.402 674 H LYS 86 H LYS 86 -6.328 -10.402 3.762 675 HA LYS 86 HA LYS 86 -8.204 -10.976 1.596 676 1HB LYS 86 1HB LYS 86 -5.544 -11.716 2.042 677 2HB LYS 86 2HB LYS 86 -6.314 -13.252 2.270 678 1HG LYS 86 1HG LYS 86 -6.679 -11.455 -0.226 679 2HG LYS 86 2HG LYS 86 -5.421 -12.666 -0.047 680 1HD LYS 86 1HD LYS 86 -7.195 -14.473 0.217 681 2HD LYS 86 2HD LYS 86 -8.443 -13.262 -0.097 682 1HE LYS 86 1HE LYS 86 -7.496 -12.798 -2.374 683 2HE LYS 86 2HE LYS 86 -6.147 -13.903 -2.073 684 1HZ LYS 86 1HZ LYS 86 -7.898 -14.930 -3.351 685 2HZ LYS 86 2HZ LYS 86 -9.008 -14.666 -2.180 686 H ASP 87 H ASP 87 -8.140 -12.316 4.872 687 HA ASP 87 HA ASP 87 -10.233 -14.365 4.289 688 1HB ASP 87 1HB ASP 87 -8.201 -13.925 6.301 689 2HB ASP 87 2HB ASP 87 -9.646 -13.483 7.115 690 HD1 ASP 87 HD2 ASP 87 -8.842 -17.305 5.943 691 H ALA 88 H ALA 88 -10.068 -11.118 5.821 692 HA ALA 88 HA ALA 88 -12.812 -10.697 6.659 693 1HB ALA 88 1HB ALA 88 -10.836 -9.026 6.999 694 2HB ALA 88 2HB ALA 88 -10.927 -8.632 5.281 695 3HB ALA 88 3HB ALA 88 -12.284 -8.234 6.306 696 H VAL 89 H VAL 89 -11.298 -10.266 3.437 697 HA VAL 89 HA VAL 89 -13.673 -9.075 2.191 698 HB VAL 89 HB VAL 89 -10.999 -8.453 2.414 699 1HG1 VAL 89 2HG2 VAL 89 -10.336 -10.715 1.397 700 2HG1 VAL 89 3HG2 VAL 89 -10.827 -10.044 -0.174 701 3HG1 VAL 89 1HG2 VAL 89 -9.563 -9.243 0.815 702 1HG2 VAL 89 1HG1 VAL 89 -12.588 -8.028 -0.050 703 2HG2 VAL 89 2HG1 VAL 89 -12.525 -7.080 1.489 704 3HG2 VAL 89 3HG1 VAL 89 -11.056 -7.201 0.484 705 H LYS 90 H LYS 90 -12.572 -12.256 2.546 706 HA LYS 90 HA LYS 90 -13.503 -13.380 -0.087 707 1HB LYS 90 1HB LYS 90 -12.091 -14.396 2.429 708 2HB LYS 90 2HB LYS 90 -13.107 -15.554 1.612 709 1HG LYS 90 1HG LYS 90 -11.879 -15.206 -0.556 710 2HG LYS 90 2HG LYS 90 -10.888 -13.977 0.203 711 1HD LYS 90 1HD LYS 90 -9.545 -15.922 0.152 712 2HD LYS 90 2HD LYS 90 -9.986 -15.701 1.839 713 1HE LYS 90 1HE LYS 90 -11.780 -17.509 1.589 714 2HE LYS 90 2HE LYS 90 -11.342 -17.695 -0.116 715 1HZ LYS 90 1HZ LYS 90 -10.274 -19.328 1.279 716 2HZ LYS 90 2HZ LYS 90 -9.564 -18.185 2.207 717 1H MET 1 1H MET 91 8.568 -1.251 8.761 718 2H MET 1 2H MET 91 9.590 -2.004 9.864 719 HA MET 1 HA MET 91 8.384 -1.086 11.365 720 1HB MET 1 1HB MET 91 6.068 -0.833 9.363 721 2HB MET 1 2HB MET 91 6.036 -0.211 10.981 722 1HG MET 1 1HG MET 91 7.961 1.353 10.435 723 2HG MET 1 2HG MET 91 7.941 0.734 8.767 724 1HE MET 1 1HE MET 91 7.086 2.442 7.197 725 2HE MET 1 3HE MET 91 5.885 3.702 7.593 726 3HE MET 1 2HE MET 91 7.465 3.667 8.444 727 H ASN 2 H ASN 92 5.293 -2.198 10.984 728 HA ASN 2 HA ASN 92 4.991 -4.762 11.383 729 1HB ASN 2 1HB ASN 92 5.089 -5.707 13.559 730 2HB ASN 2 2HB ASN 92 6.675 -5.149 13.102 731 1HD2 ASN 2 1HD2 ASN 92 7.016 -3.061 15.998 732 2HD2 ASN 2 2HD2 ASN 92 7.738 -3.652 14.419 733 H LYS 3 H LYS 93 4.217 -1.921 13.099 734 HA LYS 3 HA LYS 93 1.709 -1.147 12.588 735 1HB LYS 3 1HB LYS 93 0.793 -3.605 13.172 736 2HB LYS 3 2HB LYS 93 1.189 -3.263 14.820 737 1HG LYS 3 1HG LYS 93 -1.104 -2.950 14.667 738 2HG LYS 3 2HG LYS 93 -0.561 -1.292 14.649 739 1HD LYS 3 1HD LYS 93 -1.017 -1.041 12.277 740 2HD LYS 3 2HD LYS 93 -1.031 -2.778 11.996 741 1HE LYS 3 1HE LYS 93 -3.147 -3.096 13.224 742 2HE LYS 3 2HE LYS 93 -3.203 -1.391 13.667 743 1HZ LYS 3 1HZ LYS 93 -3.347 -0.825 11.324 744 2HZ LYS 3 2HZ LYS 93 -4.563 -1.829 11.754 745 H THR 4 H THR 94 4.014 -1.822 15.202 746 HA THR 4 HA THR 94 3.011 0.307 16.934 747 HB THR 4 HB THR 94 5.140 -1.941 17.073 748 HG1 THR 4 HG1 THR 94 2.931 -2.621 17.153 749 1HG2 THR 4 3HG2 THR 94 4.106 0.063 19.093 750 2HG2 THR 4 1HG2 THR 94 5.096 -1.421 19.488 751 3HG2 THR 4 2HG2 THR 94 5.778 -0.114 18.440 752 H GLU 5 H GLU 95 5.591 -0.469 14.668 753 HA GLU 5 HA GLU 95 7.257 1.984 15.278 754 1HB GLU 5 1HB GLU 95 7.298 0.459 12.651 755 2HB GLU 5 2HB GLU 95 8.465 1.633 13.205 756 1HG GLU 5 1HG GLU 95 8.019 -1.210 14.269 757 2HG GLU 5 2HG GLU 95 9.354 -0.672 13.288 758 HE1 GLU 5 HE2 GLU 95 11.145 0.864 15.851 759 H LEU 6 H LEU 96 4.315 1.149 13.790 760 HA LEU 6 HA LEU 96 3.845 3.513 12.053 761 1HB LEU 6 2HB LEU 96 2.541 0.987 12.519 762 2HB LEU 6 1HB LEU 96 1.457 2.102 13.304 763 HG LEU 6 HG LEU 96 2.299 2.285 10.409 764 1HD1 LEU 6 2HD1 LEU 96 0.782 0.400 10.809 765 2HD1 LEU 6 3HD1 LEU 96 -0.360 1.470 11.650 766 3HD1 LEU 6 1HD1 LEU 96 -0.052 1.686 9.912 767 1HD2 LEU 6 1HD2 LEU 96 0.868 4.306 12.119 768 2HD2 LEU 6 2HD2 LEU 96 1.961 4.536 10.751 769 3HD2 LEU 6 3HD2 LEU 96 0.277 4.035 10.476 770 H ILE 7 H ILE 97 2.940 2.481 15.401 771 HA ILE 7 HA ILE 97 1.439 4.849 16.154 772 HB ILE 7 HB ILE 97 2.984 2.938 18.012 773 1HG1 ILE 7 1HG1 ILE 97 0.019 2.769 17.239 774 2HG1 ILE 7 2HG1 ILE 97 1.217 1.876 16.392 775 1HG2 ILE 7 2HG2 ILE 97 2.238 5.063 19.210 776 2HG2 ILE 7 3HG2 ILE 97 0.578 4.727 18.703 777 3HG2 ILE 7 1HG2 ILE 97 1.401 3.631 19.822 778 1HD1 ILE 7 3HD1 ILE 97 1.952 0.785 18.624 779 2HD1 ILE 7 1HD1 ILE 97 0.427 1.377 19.263 780 3HD1 ILE 7 2HD1 ILE 97 0.428 0.283 17.849 781 H ASN 8 H ASN 98 4.836 4.024 16.800 782 HA ASN 8 HA ASN 98 5.471 6.711 17.895 783 1HB ASN 8 1HB ASN 98 7.421 4.555 16.795 784 2HB ASN 8 2HB ASN 98 7.941 6.025 17.585 785 1HD2 ASN 8 2HD2 ASN 98 6.891 2.935 19.984 786 2HD2 ASN 8 1HD2 ASN 98 6.878 2.825 18.152 787 H ALA 9 H ALA 99 5.046 5.782 14.614 788 HA ALA 9 HA ALA 99 6.663 8.025 13.409 789 1HB ALA 9 2HB ALA 99 5.759 5.901 12.007 790 2HB ALA 9 3HB ALA 99 4.138 6.556 12.236 791 3HB ALA 9 1HB ALA 99 5.265 7.504 11.327 792 H VAL 10 H VAL 100 3.245 7.405 14.331 793 HA VAL 10 HA VAL 100 2.308 9.814 13.212 794 HB VAL 10 HB VAL 100 0.682 8.354 15.305 795 1HG1 VAL 10 3HG2 VAL 100 -0.038 10.431 13.754 796 2HG1 VAL 10 1HG2 VAL 100 -0.457 9.087 12.644 797 3HG1 VAL 10 2HG2 VAL 100 -1.162 9.129 14.266 798 1HG2 VAL 10 1HG1 VAL 100 1.527 7.264 12.614 799 2HG2 VAL 10 2HG1 VAL 100 1.511 6.568 14.268 800 3HG2 VAL 10 3HG1 VAL 100 -0.039 6.760 13.394 801 H ALA 11 H ALA 101 2.708 8.663 16.392 802 HA ALA 11 HA ALA 101 2.179 11.179 17.540 803 1HB ALA 11 2HB ALA 101 1.996 8.998 18.837 804 2HB ALA 11 3HB ALA 101 3.763 8.785 18.758 805 3HB ALA 11 1HB ALA 101 3.056 10.105 19.746 806 H GLU 12 H GLU 102 5.170 10.072 16.157 807 HA GLU 12 HA GLU 102 6.728 12.318 17.409 808 1HB GLU 12 1HB GLU 102 7.911 10.159 16.870 809 2HB GLU 12 2HB GLU 102 7.566 10.388 15.164 810 1HG GLU 12 1HG GLU 102 9.872 10.978 15.581 811 2HG GLU 12 2HG GLU 102 9.026 12.443 15.126 812 HE2 GLU 12 HE2 GLU 102 9.651 14.100 18.077 813 H THR 13 H THR 103 5.363 11.590 14.116 814 HA THR 13 HA THR 103 5.907 14.486 13.431 815 HB THR 13 HB THR 103 6.491 12.411 12.046 816 HG1 THR 13 HG1 THR 103 6.464 13.763 10.228 817 1HG2 THR 13 3HG2 THR 103 4.293 11.436 11.616 818 2HG2 THR 13 1HG2 THR 103 3.775 12.922 10.776 819 3HG2 THR 13 2HG2 THR 103 5.098 11.923 10.111 820 H SER 14 H SER 104 3.659 13.464 14.972 821 HA SER 14 HA SER 104 1.738 15.725 14.084 822 1HB SER 14 1HB SER 104 0.734 13.466 13.499 823 2HB SER 14 2HB SER 104 0.694 13.059 15.220 824 HG SER 14 HG SER 104 -0.581 14.911 15.559 825 H GLY 15 H GLY 105 3.035 13.995 16.961 826 1HA GLY 15 1HA GLY 105 3.021 14.616 19.240 827 2HA GLY 15 2HA GLY 105 2.613 16.257 18.749 828 H LEU 16 H LEU 106 1.005 13.135 18.693 829 HA LEU 16 HA LEU 106 -1.362 14.066 20.334 830 1HB LEU 16 1HB LEU 106 -2.644 12.317 19.315 831 2HB LEU 16 2HB LEU 106 -2.192 13.660 18.286 832 HG LEU 16 HG LEU 106 -0.575 12.500 17.165 833 1HD1 LEU 16 2HD1 LEU 106 0.432 11.125 19.047 834 2HD1 LEU 16 3HD1 LEU 106 -0.992 10.053 18.858 835 3HD1 LEU 16 1HD1 LEU 106 0.233 10.251 17.526 836 1HD2 LEU 16 2HD2 LEU 106 -2.339 12.202 15.947 837 2HD2 LEU 16 3HD2 LEU 106 -1.033 11.000 15.769 838 3HD2 LEU 16 1HD2 LEU 106 -2.494 10.540 16.623 839 H SER 17 H SER 107 -1.275 11.117 20.466 840 HA SER 17 HA SER 107 0.511 10.662 22.909 841 1HB SER 17 1HB SER 107 -2.371 9.656 22.947 842 2HB SER 17 2HB SER 107 -1.138 9.406 24.161 843 HG SER 17 HG SER 107 -2.163 11.922 23.366 844 H LYS 18 H LYS 108 0.946 8.411 23.317 845 HA LYS 18 HA LYS 108 1.364 6.752 20.833 846 1HB LYS 18 1HB LYS 108 1.921 6.032 23.773 847 2HB LYS 18 2HB LYS 108 2.061 4.890 22.444 848 1HG LYS 18 1HG LYS 108 3.721 6.468 21.279 849 2HG LYS 18 2HG LYS 108 3.653 7.509 22.692 850 1HD LYS 18 1HD LYS 108 5.629 6.201 22.907 851 2HD LYS 18 2HD LYS 108 4.519 5.600 24.134 852 1HE LYS 18 1HE LYS 108 3.965 3.602 22.665 853 2HE LYS 18 2HE LYS 108 4.985 4.249 21.375 854 1HZ LYS 18 1HZ LYS 108 6.889 4.061 22.842 855 2HZ LYS 18 2HZ LYS 108 6.156 2.614 22.641 856 H LYS 19 H LYS 109 -0.810 6.617 23.640 857 HA LYS 19 HA LYS 109 -2.540 4.443 22.640 858 1HB LYS 19 2HB LYS 109 -3.154 6.729 24.611 859 2HB LYS 19 1HB LYS 109 -4.356 5.522 24.151 860 1HG LYS 19 1HG LYS 109 -3.570 4.737 26.173 861 2HG LYS 19 2HG LYS 109 -2.803 3.680 25.002 862 1HD LYS 19 1HD LYS 109 -0.629 4.932 25.281 863 2HD LYS 19 2HD LYS 109 -1.418 6.099 26.347 864 1HE LYS 19 1HE LYS 109 -1.909 4.231 28.007 865 2HE LYS 19 2HE LYS 109 -1.124 3.069 26.926 866 1HZ LYS 19 1HZ LYS 109 0.201 5.440 28.125 867 2HZ LYS 19 2HZ LYS 109 0.925 4.363 27.131 868 H ASP 20 H ASP 110 -2.565 8.023 21.951 869 HA ASP 20 HA ASP 110 -5.114 7.791 20.352 870 1HB ASP 20 1HB ASP 110 -3.038 10.055 20.598 871 2HB ASP 20 2HB ASP 110 -4.326 10.141 19.425 872 HD2 ASP 20 HD2 ASP 110 -5.091 11.577 22.877 873 H ALA 21 H ALA 111 -1.695 7.528 19.595 874 HA ALA 21 HA ALA 111 -2.032 7.520 16.638 875 1HB ALA 21 1HB ALA 111 0.328 6.884 18.511 876 2HB ALA 21 2HB ALA 111 0.404 6.692 16.734 877 3HB ALA 21 3HB ALA 111 0.080 8.246 17.447 878 H THR 22 H THR 112 -1.790 4.913 19.141 879 HA THR 22 HA THR 112 -2.003 2.636 17.383 880 HB THR 22 HB THR 112 -3.277 2.809 20.195 881 HG1 THR 22 HG1 THR 112 -1.236 3.738 20.294 882 1HG2 THR 22 2HG2 THR 112 -1.741 0.630 18.656 883 2HG2 THR 22 3HG2 THR 112 -2.277 0.488 20.355 884 3HG2 THR 22 1HG2 THR 112 -3.486 0.630 19.027 885 H LYS 23 H LYS 113 -4.533 4.467 18.955 886 HA LYS 23 HA LYS 113 -6.881 3.132 17.792 887 1HB LYS 23 2HB LYS 113 -6.327 6.075 18.677 888 2HB LYS 23 1HB LYS 113 -7.912 5.577 18.180 889 1HG LYS 23 1HG LYS 113 -8.108 3.940 20.076 890 2HG LYS 23 2HG LYS 113 -6.465 4.309 20.594 891 1HD LYS 23 1HD LYS 113 -7.149 6.749 20.943 892 2HD LYS 23 2HD LYS 113 -8.806 6.323 20.503 893 1HE LYS 23 1HE LYS 113 -8.903 4.702 22.465 894 2HE LYS 23 2HE LYS 113 -7.237 5.124 22.894 895 1HZ LYS 23 1HZ LYS 113 -7.965 7.426 23.185 896 2HZ LYS 23 2HZ LYS 113 -9.503 7.040 22.785 897 H ALA 24 H ALA 114 -5.343 6.124 16.839 898 HA ALA 24 HA ALA 114 -6.834 6.773 14.515 899 1HB ALA 24 2HB ALA 114 -5.433 8.314 15.712 900 2HB ALA 24 3HB ALA 114 -3.951 7.435 15.215 901 3HB ALA 24 1HB ALA 114 -4.957 8.292 13.992 902 H VAL 25 H VAL 115 -3.970 4.733 14.648 903 HA VAL 25 HA VAL 115 -3.782 4.007 11.760 904 HB VAL 25 HB VAL 115 -2.959 2.962 14.628 905 1HG1 VAL 25 2HG2 VAL 115 -2.607 1.216 12.130 906 2HG1 VAL 25 3HG2 VAL 115 -1.753 0.983 13.696 907 3HG1 VAL 25 1HG2 VAL 115 -3.503 0.835 13.605 908 1HG2 VAL 25 1HG1 VAL 115 -1.588 4.721 13.590 909 2HG2 VAL 25 2HG1 VAL 115 -0.666 3.220 13.791 910 3HG2 VAL 25 3HG1 VAL 115 -1.311 3.682 12.173 911 H ASP 26 H ASP 116 -5.309 2.230 14.528 912 HA ASP 26 HA ASP 116 -7.108 0.720 12.597 913 1HB ASP 26 1HB ASP 116 -7.125 0.905 15.676 914 2HB ASP 26 2HB ASP 116 -8.171 -0.165 14.749 915 HD1 ASP 26 HD2 ASP 116 -5.705 -2.478 13.867 916 H ALA 27 H ALA 117 -7.232 3.542 12.920 917 HA ALA 27 HA ALA 117 -10.220 3.996 12.813 918 1HB ALA 27 2HB ALA 117 -8.573 5.413 14.465 919 2HB ALA 27 3HB ALA 117 -8.302 6.308 12.983 920 3HB ALA 27 1HB ALA 117 -9.920 6.160 13.709 921 H VAL 28 H VAL 118 -7.244 4.839 11.109 922 HA VAL 28 HA VAL 118 -8.483 5.472 8.494 923 HB VAL 28 HB VAL 118 -5.631 4.382 9.169 924 1HG1 VAL 28 3HG2 VAL 118 -6.652 5.608 6.529 925 2HG1 VAL 28 1HG2 VAL 118 -4.938 5.362 6.942 926 3HG1 VAL 28 2HG2 VAL 118 -5.983 3.953 6.814 927 1HG2 VAL 28 1HG1 VAL 118 -6.064 6.557 10.096 928 2HG2 VAL 28 2HG1 VAL 118 -4.809 6.540 8.807 929 3HG2 VAL 28 3HG1 VAL 118 -6.493 7.157 8.434 930 H PHE 29 H PHE 119 -6.635 2.796 9.595 931 HA PHE 29 HA PHE 119 -7.271 0.880 7.432 932 1HB PHE 29 2HB PHE 119 -5.912 0.183 10.070 933 2HB PHE 29 1HB PHE 119 -5.902 -0.800 8.613 934 HD1 PHE 29 HD1 PHE 119 -5.189 0.652 6.343 935 HD2 PHE 29 HD2 PHE 119 -3.900 1.440 10.359 936 HE1 PHE 29 HE1 PHE 119 -3.468 2.168 5.491 937 HE2 PHE 29 HE2 PHE 119 -2.246 3.031 9.512 938 HZ PHE 29 HZ PHE 119 -2.092 3.449 7.070 939 H ASP 30 H ASP 120 -9.073 1.473 10.344 940 HA ASP 30 HA ASP 120 -10.538 -1.131 10.088 941 1HB ASP 30 1HB ASP 120 -10.199 0.306 12.258 942 2HB ASP 30 2HB ASP 120 -11.513 1.315 11.708 943 HD2 ASP 30 HD2 ASP 120 -14.041 -0.921 12.422 944 H SER 31 H SER 121 -11.009 2.151 9.216 945 HA SER 31 HA SER 121 -13.744 1.847 7.967 946 1HB SER 31 2HB SER 121 -11.748 4.169 7.692 947 2HB SER 31 1HB SER 121 -13.383 4.138 6.998 948 HG SER 31 HG SER 121 -14.189 3.791 9.104 949 H ILE 32 H ILE 122 -10.305 1.678 6.574 950 HA ILE 32 HA ILE 122 -11.001 1.254 3.898 951 HB ILE 32 HB ILE 122 -8.628 0.006 5.279 952 1HG1 ILE 32 1HG1 ILE 122 -9.370 2.884 4.916 953 2HG1 ILE 32 2HG1 ILE 122 -8.597 1.960 6.185 954 1HG2 ILE 32 1HG2 ILE 122 -9.394 -0.340 2.711 955 2HG2 ILE 32 2HG2 ILE 122 -8.791 1.280 2.496 956 3HG2 ILE 32 3HG2 ILE 122 -7.688 0.025 3.062 957 1HD1 ILE 32 2HD1 ILE 122 -7.103 2.734 3.704 958 2HD1 ILE 32 3HD1 ILE 122 -7.298 3.749 5.160 959 3HD1 ILE 32 1HD1 ILE 122 -6.479 2.157 5.315 960 H THR 33 H THR 123 -10.248 -1.172 6.391 961 HA THR 33 HA THR 123 -11.061 -3.452 4.680 962 HB THR 33 HB THR 123 -9.763 -3.934 6.713 963 HG1 THR 33 HG1 THR 123 -12.321 -5.055 6.996 964 1HG2 THR 33 3HG2 THR 123 -10.763 -2.115 8.169 965 2HG2 THR 33 1HG2 THR 123 -12.121 -3.159 8.516 966 3HG2 THR 33 2HG2 THR 123 -10.450 -3.629 9.016 967 H GLU 34 H GLU 124 -13.056 -1.330 6.629 968 HA GLU 34 HA GLU 124 -15.582 -2.873 6.153 969 1HB GLU 34 1HB GLU 124 -15.319 -1.283 8.123 970 2HB GLU 34 2HB GLU 124 -15.222 0.078 7.011 971 1HG GLU 34 1HG GLU 124 -17.587 -0.395 6.222 972 2HG GLU 34 2HG GLU 124 -17.659 -1.817 7.257 973 HE1 GLU 34 HE2 GLU 124 -18.003 1.930 8.757 974 H ALA 35 H ALA 125 -13.843 -0.267 4.467 975 HA ALA 35 HA ALA 125 -15.814 0.012 2.321 976 1HB ALA 35 2HB ALA 125 -13.674 1.703 2.672 977 2HB ALA 35 3HB ALA 125 -12.684 0.406 2.056 978 3HB ALA 35 1HB ALA 125 -13.834 1.145 1.001 979 H LEU 36 H LEU 126 -12.783 -1.935 2.478 980 HA LEU 36 HA LEU 126 -13.027 -3.213 -0.111 981 1HB LEU 36 2HB LEU 126 -11.545 -4.279 2.225 982 2HB LEU 36 1HB LEU 126 -11.224 -4.521 0.517 983 HG LEU 36 HG LEU 126 -10.770 -1.888 2.001 984 1HD1 LEU 36 1HD2 LEU 126 -8.887 -3.500 0.297 985 2HD1 LEU 36 2HD2 LEU 126 -8.548 -1.919 1.076 986 3HD1 LEU 36 3HD2 LEU 126 -8.908 -3.322 2.111 987 1HD2 LEU 36 3HD1 LEU 126 -11.867 -1.217 -0.117 988 2HD2 LEU 36 1HD1 LEU 126 -10.180 -0.750 -0.077 989 3HD2 LEU 36 2HD1 LEU 126 -10.679 -2.190 -1.038 990 NH1 ARG 37 NH2 ARG 127 -14.730 -4.541 8.589 991 NH2 ARG 37 NH1 ARG 127 -16.777 -3.877 9.313 992 H ARG 37 H ARG 127 -13.970 -4.386 3.205 993 HA ARG 37 HA ARG 127 -14.878 -6.869 2.068 994 1HB ARG 37 1HB ARG 127 -15.752 -7.591 4.131 995 2HB ARG 37 2HB ARG 127 -14.300 -6.692 4.507 996 1HG ARG 37 1HG ARG 127 -15.835 -4.670 5.084 997 2HG ARG 37 2HG ARG 127 -17.227 -5.705 4.846 998 1HD ARG 37 1HD ARG 127 -16.573 -7.223 6.591 999 2HD ARG 37 2HD ARG 127 -14.999 -6.434 6.803 1000 1HH1 ARG 37 2HH2 ARG 127 -14.188 -5.102 7.923 1001 2HH1 ARG 37 1HH2 ARG 127 -14.358 -3.919 9.315 1002 1HH2 ARG 37 1HH1 ARG 127 -17.796 -3.941 9.215 1003 2HH2 ARG 37 2HH1 ARG 127 -16.258 -3.311 9.994 1004 H LYS 38 H LYS 128 -16.372 -3.684 2.265 1005 HA LYS 38 HA LYS 128 -19.146 -4.861 1.927 1006 1HB LYS 38 1HB LYS 128 -18.683 -3.250 3.818 1007 2HB LYS 38 2HB LYS 128 -18.457 -1.977 2.620 1008 1HG LYS 38 1HG LYS 128 -20.858 -2.149 1.956 1009 2HG LYS 38 2HG LYS 128 -21.054 -3.598 2.933 1010 1HD LYS 38 1HD LYS 128 -22.032 -1.755 4.133 1011 2HD LYS 38 2HD LYS 128 -20.615 -2.289 5.028 1012 1HE LYS 38 1HE LYS 128 -19.284 -0.324 4.062 1013 2HE LYS 38 2HE LYS 128 -20.720 0.193 3.166 1014 1HZ LYS 38 1HZ LYS 128 -20.541 -0.048 6.121 1015 2HZ LYS 38 2HZ LYS 128 -21.869 0.436 5.300 1016 H GLY 39 H GLY 129 -16.844 -4.199 -0.231 1017 1HA GLY 39 1HA GLY 129 -16.870 -3.685 -2.572 1018 2HA GLY 39 2HA GLY 129 -18.617 -3.588 -2.515 1019 H ASP 40 H ASP 130 -16.268 -1.638 -0.761 1020 HA ASP 40 HA ASP 130 -17.047 0.900 -2.291 1021 1HB ASP 40 1HB ASP 130 -16.184 0.982 0.568 1022 2HB ASP 40 2HB ASP 130 -16.771 2.281 -0.408 1023 HD1 ASP 40 HD2 ASP 130 -20.137 1.485 -0.172 1024 H LYS 41 H LYS 131 -15.654 2.242 -3.089 1025 HA LYS 41 HA LYS 131 -12.734 1.470 -3.116 1026 1HB LYS 41 2HB LYS 131 -13.888 3.892 -4.533 1027 2HB LYS 41 1HB LYS 131 -12.306 3.156 -4.774 1028 1HG LYS 41 1HG LYS 131 -13.541 1.053 -5.659 1029 2HG LYS 41 2HG LYS 131 -15.031 1.997 -5.608 1030 1HD LYS 41 1HD LYS 131 -13.957 3.731 -7.143 1031 2HD LYS 41 2HD LYS 131 -12.495 2.739 -7.206 1032 1HE LYS 41 1HE LYS 131 -13.875 0.822 -8.200 1033 2HE LYS 41 2HE LYS 131 -15.299 1.875 -8.191 1034 1HZ LYS 41 1HZ LYS 131 -14.231 1.893 -10.322 1035 2HZ LYS 41 2HZ LYS 131 -14.143 3.388 -9.665 1036 H VAL 42 H VAL 132 -11.379 2.378 -1.650 1037 HA VAL 42 HA VAL 132 -11.961 4.722 -0.056 1038 HB VAL 42 HB VAL 132 -9.649 2.686 -0.365 1039 1HG1 VAL 42 1HG2 VAL 132 -10.345 4.459 1.981 1040 2HG1 VAL 42 2HG2 VAL 132 -9.076 3.190 1.941 1041 3HG1 VAL 42 3HG2 VAL 132 -8.901 4.607 0.873 1042 1HG2 VAL 42 3HG1 VAL 132 -11.959 2.819 1.650 1043 2HG2 VAL 42 1HG1 VAL 132 -11.740 1.575 0.355 1044 3HG2 VAL 42 2HG1 VAL 132 -10.641 1.634 1.728 1045 H GLN 43 H GLN 133 -10.585 6.283 0.000 1046 HA GLN 43 HA GLN 133 -8.696 6.915 -2.253 1047 1HB GLN 43 1HB GLN 133 -11.117 8.636 -2.240 1048 2HB GLN 43 2HB GLN 133 -9.629 8.952 -3.134 1049 1HG GLN 43 1HG GLN 133 -10.030 6.655 -4.260 1050 2HG GLN 43 2HG GLN 133 -11.562 6.579 -3.400 1051 1HE2 GLN 43 2HE2 GLN 133 -12.638 7.747 -6.652 1052 2HE2 GLN 43 1HE2 GLN 133 -12.119 6.250 -5.735 1053 H LEU 44 H LEU 134 -7.075 8.085 -2.055 1054 HA LEU 44 HA LEU 134 -6.690 9.979 0.274 1055 1HB LEU 44 2HB LEU 134 -4.558 7.859 -0.353 1056 2HB LEU 44 1HB LEU 134 -4.407 9.134 0.823 1057 HG LEU 44 HG LEU 134 -6.567 6.960 1.122 1058 1HD1 LEU 44 2HD1 LEU 134 -3.631 6.760 2.037 1059 2HD1 LEU 44 3HD1 LEU 134 -4.947 5.664 2.529 1060 3HD1 LEU 44 1HD1 LEU 134 -4.446 5.738 0.829 1061 1HD2 LEU 44 1HD2 LEU 134 -5.101 8.727 3.203 1062 2HD2 LEU 44 2HD2 LEU 134 -6.776 8.945 2.642 1063 3HD2 LEU 44 3HD2 LEU 134 -6.335 7.495 3.563 1064 H ILE 45 H ILE 135 -6.034 11.811 -0.818 1065 HA ILE 45 HA ILE 135 -5.019 11.638 -3.594 1066 HB ILE 45 HB ILE 135 -6.698 13.319 -2.878 1067 1HG1 ILE 45 1HG1 ILE 135 -4.266 14.588 -4.262 1068 2HG1 ILE 45 2HG1 ILE 135 -5.302 13.399 -5.031 1069 1HG2 ILE 45 3HG2 ILE 135 -5.640 14.084 -0.747 1070 2HG2 ILE 45 1HG2 ILE 135 -4.314 14.844 -1.664 1071 3HG2 ILE 45 2HG2 ILE 135 -5.988 15.452 -1.831 1072 1HD1 ILE 45 2HD1 ILE 135 -7.312 14.911 -4.752 1073 2HD1 ILE 45 3HD1 ILE 135 -6.251 16.164 -4.053 1074 3HD1 ILE 45 1HD1 ILE 135 -6.015 15.633 -5.732 1075 H GLY 46 H GLY 136 -3.095 12.426 -4.347 1076 1HA GLY 46 1HA GLY 136 -0.708 12.390 -4.472 1077 2HA GLY 46 2HA GLY 136 -0.721 13.108 -2.882 1078 H PHE 47 H PHE 137 -2.068 9.946 -2.746 1079 HA PHE 47 HA PHE 137 0.535 8.505 -2.344 1080 1HB PHE 47 2HB PHE 137 -0.455 9.762 -0.284 1081 2HB PHE 47 1HB PHE 137 -1.785 8.642 -0.273 1082 HD1 PHE 47 HD1 PHE 137 1.921 8.928 0.219 1083 HD2 PHE 47 HD2 PHE 137 -1.425 6.214 0.305 1084 HE1 PHE 47 HE1 PHE 137 3.361 7.126 1.091 1085 HE2 PHE 47 HE2 PHE 137 0.066 4.426 1.094 1086 HZ PHE 47 HZ PHE 137 2.486 4.865 1.350 1087 H GLY 48 H GLY 138 -3.097 8.047 -2.527 1088 1HA GLY 48 1HA GLY 138 -2.992 5.757 -4.052 1089 2HA GLY 48 2HA GLY 138 -2.783 5.076 -2.441 1090 H ASN 49 H ASN 139 -4.618 4.328 -4.221 1091 HA ASN 49 HA ASN 139 -7.266 5.060 -2.853 1092 1HB ASN 49 1HB ASN 139 -6.920 4.698 -5.895 1093 2HB ASN 49 2HB ASN 139 -8.449 4.859 -5.055 1094 1HD2 ASN 49 1HD2 ASN 139 -7.658 8.192 -6.520 1095 2HD2 ASN 49 2HD2 ASN 139 -7.854 6.472 -7.129 1096 H PHE 50 H PHE 140 -7.721 3.235 -1.792 1097 HA PHE 50 HA PHE 140 -6.899 0.539 -2.830 1098 1HB PHE 50 2HB PHE 140 -8.619 0.966 -0.328 1099 2HB PHE 50 1HB PHE 140 -7.970 -0.514 -0.820 1100 HD1 PHE 50 HD2 PHE 140 -7.105 2.939 0.248 1101 HD2 PHE 50 HD1 PHE 140 -6.069 -1.220 0.374 1102 HE1 PHE 50 HE2 PHE 140 -5.314 3.430 1.896 1103 HE2 PHE 50 HE1 PHE 140 -4.293 -0.699 2.044 1104 HZ PHE 50 HZ PHE 140 -3.858 1.644 2.634 1105 H GLU 51 H GLU 141 -8.282 -1.047 -3.476 1106 HA GLU 51 HA GLU 141 -11.175 -0.787 -3.222 1107 1HB GLU 51 1HB GLU 141 -11.893 -0.582 -5.615 1108 2HB GLU 51 2HB GLU 141 -10.993 0.831 -5.119 1109 1HG GLU 51 1HG GLU 141 -8.917 -0.092 -6.311 1110 2HG GLU 51 2HG GLU 141 -9.871 -1.467 -6.858 1111 HE1 GLU 51 HE2 GLU 141 -11.580 -1.100 -8.136 1112 H VAL 52 H VAL 142 -12.536 -2.598 -4.043 1113 HA VAL 52 HA VAL 142 -10.971 -5.069 -3.763 1114 HB VAL 52 HB VAL 142 -13.453 -3.856 -2.772 1115 1HG1 VAL 52 1HG2 VAL 142 -14.181 -5.966 -4.823 1116 2HG1 VAL 52 2HG2 VAL 142 -15.235 -5.333 -3.515 1117 3HG1 VAL 52 3HG2 VAL 142 -14.609 -4.257 -4.810 1118 1HG2 VAL 52 3HG1 VAL 142 -12.159 -6.550 -2.466 1119 2HG2 VAL 52 1HG1 VAL 142 -12.301 -5.185 -1.363 1120 3HG2 VAL 52 2HG1 VAL 142 -13.736 -6.155 -1.743 1121 NH1 ARG 53 NH2 ARG 143 -9.551 -2.493 -10.047 1122 NH2 ARG 53 NH1 ARG 143 -7.749 -2.719 -8.680 1123 H ARG 53 H ARG 143 -11.385 -6.917 -5.329 1124 HA ARG 53 HA ARG 143 -12.276 -5.978 -8.107 1125 1HB ARG 53 1HB ARG 143 -9.586 -6.531 -7.233 1126 2HB ARG 53 2HB ARG 143 -10.157 -8.077 -7.601 1127 1HG ARG 53 1HG ARG 143 -9.071 -7.348 -9.571 1128 2HG ARG 53 2HG ARG 143 -10.778 -7.421 -9.952 1129 1HD ARG 53 1HD ARG 143 -9.831 -5.394 -10.959 1130 2HD ARG 53 2HD ARG 143 -10.969 -4.907 -9.702 1131 1HH1 ARG 53 2HH2 ARG 143 -10.325 -2.953 -10.540 1132 2HH1 ARG 53 1HH2 ARG 143 -9.331 -1.491 -10.049 1133 1HH2 ARG 53 1HH1 ARG 143 -7.149 -3.347 -8.133 1134 2HH2 ARG 53 2HH1 ARG 143 -7.650 -1.702 -8.775 1135 H GLU 54 H GLU 144 -14.281 -7.198 -8.269 1136 HA GLU 54 HA GLU 144 -14.684 -9.887 -7.528 1137 1HB GLU 54 1HB GLU 144 -16.384 -8.462 -8.740 1138 2HB GLU 54 2HB GLU 144 -15.571 -8.778 -10.270 1139 1HG GLU 54 1HG GLU 144 -16.037 -11.271 -9.975 1140 2HG GLU 54 2HG GLU 144 -16.825 -10.942 -8.436 1141 HE1 GLU 54 HE2 GLU 144 -19.758 -9.701 -9.796 1142 NH1 ARG 55 NH2 ARG 145 -15.419 -14.275 -11.886 1143 NH2 ARG 55 NH1 ARG 145 -16.782 -16.035 -11.426 1144 H ARG 55 H ARG 145 -13.196 -11.747 -7.737 1145 HA ARG 55 HA ARG 145 -10.945 -11.834 -8.800 1146 1HB ARG 55 1HB ARG 145 -11.291 -14.307 -8.626 1147 2HB ARG 55 2HB ARG 145 -12.151 -13.440 -7.418 1148 1HG ARG 55 1HG ARG 145 -13.910 -14.836 -8.001 1149 2HG ARG 55 2HG ARG 145 -14.244 -13.609 -9.137 1150 1HD ARG 55 1HD ARG 145 -12.945 -14.993 -10.946 1151 2HD ARG 55 2HD ARG 145 -12.759 -16.242 -9.745 1152 1HH1 ARG 55 2HH2 ARG 145 -14.521 -13.808 -11.716 1153 2HH1 ARG 55 1HH2 ARG 145 -16.169 -13.956 -12.509 1154 1HH2 ARG 55 1HH1 ARG 145 -16.927 -16.909 -10.908 1155 2HH2 ARG 55 2HH1 ARG 145 -17.436 -15.593 -12.081 1156 H ALA 56 H ALA 146 -9.862 -13.161 -10.050 1157 HA ALA 56 HA ALA 146 -10.764 -13.975 -12.830 1158 1HB ALA 56 1HB ALA 146 -8.128 -12.492 -12.132 1159 2HB ALA 56 2HB ALA 146 -8.562 -13.146 -13.734 1160 3HB ALA 56 3HB ALA 146 -9.501 -11.799 -13.036 1161 H ALA 57 H ALA 147 -10.762 -15.629 -10.554 1162 HA ALA 57 HA ALA 147 -8.504 -17.306 -10.253 1163 1HB ALA 57 1HB ALA 147 -10.525 -17.466 -8.822 1164 2HB ALA 57 2HB ALA 147 -11.432 -18.241 -10.147 1165 3HB ALA 57 3HB ALA 147 -10.030 -19.059 -9.414 1166 NH1 ARG 58 NH2 ARG 148 -10.826 -15.002 -15.690 1167 NH2 ARG 58 NH1 ARG 148 -11.814 -16.482 -17.105 1168 H ARG 58 H ARG 148 -7.264 -17.951 -11.683 1169 HA ARG 58 HA ARG 148 -8.070 -20.113 -13.414 1170 1HB ARG 58 2HB ARG 148 -6.811 -18.632 -15.545 1171 2HB ARG 58 1HB ARG 148 -8.532 -18.943 -15.384 1172 1HG ARG 58 1HG ARG 148 -8.786 -16.693 -14.177 1173 2HG ARG 58 2HG ARG 148 -7.072 -16.439 -14.398 1174 1HD ARG 58 1HD ARG 148 -8.131 -15.192 -16.157 1175 2HD ARG 58 2HD ARG 148 -7.437 -16.589 -16.951 1176 1HH1 ARG 58 2HH2 ARG 148 -9.960 -14.673 -15.250 1177 2HH1 ARG 58 1HH2 ARG 148 -11.768 -14.617 -15.558 1178 1HH2 ARG 58 1HH1 ARG 148 -11.706 -17.280 -17.740 1179 2HH2 ARG 58 2HH1 ARG 148 -12.686 -15.995 -16.872 1180 H LYS 59 H LYS 149 -6.202 -21.157 -14.513 1181 HA LYS 59 HA LYS 149 -3.619 -20.732 -13.042 1182 1HB LYS 59 1HB LYS 149 -4.630 -23.044 -13.770 1183 2HB LYS 59 2HB LYS 149 -3.939 -22.729 -15.343 1184 1HG LYS 59 1HG LYS 149 -2.472 -22.913 -12.630 1185 2HG LYS 59 2HG LYS 149 -2.527 -24.164 -13.848 1186 1HD LYS 59 1HD LYS 149 -1.069 -21.465 -14.090 1187 2HD LYS 59 2HD LYS 149 -0.324 -22.998 -13.742 1188 1HE LYS 59 1HE LYS 149 -1.746 -22.325 -16.411 1189 2HE LYS 59 2HE LYS 149 -0.014 -22.211 -16.127 1190 1HZ LYS 59 1HZ LYS 149 -1.582 -24.717 -15.906 1191 2HZ LYS 59 2HZ LYS 149 0.029 -24.589 -15.663 1192 H GLY 60 H GLY 150 -2.462 -19.066 -13.602 1193 1HA GLY 60 1HA GLY 150 -2.098 -18.261 -16.567 1194 2HA GLY 60 2HA GLY 150 -2.433 -17.074 -15.319 1195 NH1 ARG 61 NH2 ARG 151 5.894 -19.663 -16.957 1196 NH2 ARG 61 NH1 ARG 151 7.897 -18.614 -17.164 1197 H ARG 61 H ARG 151 -0.573 -15.968 -15.470 1198 HA ARG 61 HA ARG 151 1.939 -17.174 -14.375 1199 1HB ARG 61 1HB ARG 151 1.961 -17.582 -16.936 1200 2HB ARG 61 2HB ARG 151 2.084 -15.843 -17.162 1201 1HG ARG 61 1HG ARG 151 4.282 -15.859 -15.876 1202 2HG ARG 61 2HG ARG 151 4.077 -17.584 -15.561 1203 1HD ARG 61 1HD ARG 151 4.066 -17.993 -18.118 1204 2HD ARG 61 2HD ARG 151 4.406 -16.286 -18.340 1205 1HH1 ARG 61 2HH2 ARG 151 4.872 -19.591 -16.992 1206 2HH1 ARG 61 1HH2 ARG 151 6.444 -20.505 -16.751 1207 1HH2 ARG 61 1HH1 ARG 151 8.406 -17.744 -17.356 1208 2HH2 ARG 61 2HH1 ARG 151 8.305 -19.529 -16.944 1209 H ASN 62 H ASN 152 3.124 -15.783 -13.295 1210 HA ASN 62 HA ASN 152 2.003 -13.134 -12.646 1211 1HB ASN 62 1HB ASN 152 3.032 -14.780 -10.998 1212 2HB ASN 62 2HB ASN 152 4.615 -14.410 -11.660 1213 1HD2 ASN 62 2HD2 ASN 152 3.121 -11.903 -8.875 1214 2HD2 ASN 62 1HD2 ASN 152 2.226 -13.404 -9.436 1215 HA PRO 63 HA PRO 153 4.627 -10.984 -15.782 1216 1HB PRO 63 1HB PRO 153 4.049 -8.332 -15.211 1217 2HB PRO 63 2HB PRO 153 2.916 -9.461 -15.968 1218 1HG PRO 63 1HG PRO 153 3.077 -8.691 -13.010 1219 2HG PRO 63 2HG PRO 153 1.634 -8.724 -14.052 1220 1HD PRO 63 1HD PRO 153 2.276 -10.819 -12.361 1221 2HD PRO 63 2HD PRO 153 1.486 -11.123 -13.939 1222 H GLN 64 H GLN 154 5.249 -10.285 -12.330 1223 HA GLN 64 HA GLN 154 7.805 -8.771 -12.910 1224 1HB GLN 64 1HB GLN 154 6.625 -9.662 -10.210 1225 2HB GLN 64 2HB GLN 154 8.040 -8.665 -10.416 1226 1HG GLN 64 1HG GLN 154 5.187 -7.871 -11.268 1227 2HG GLN 64 2HG GLN 154 5.928 -7.581 -9.712 1228 1HE2 GLN 64 1HE2 GLN 154 6.926 -5.078 -12.825 1229 2HE2 GLN 64 2HE2 GLN 154 5.814 -6.523 -13.030 1230 H THR 65 H THR 155 7.031 -11.411 -10.771 1231 HA THR 65 HA THR 155 9.589 -12.691 -10.723 1232 HB THR 65 HB THR 155 8.617 -14.609 -9.606 1233 HG1 THR 65 HG1 THR 155 6.118 -13.563 -10.398 1234 1HG2 THR 65 1HG2 THR 155 8.727 -12.447 -8.262 1235 2HG2 THR 65 2HG2 THR 155 7.043 -12.103 -8.722 1236 3HG2 THR 65 3HG2 THR 155 7.409 -13.532 -7.732 1237 H GLY 66 H GLY 156 6.960 -13.581 -12.946 1238 1HA GLY 66 1HA GLY 156 7.112 -14.782 -15.028 1239 2HA GLY 66 2HA GLY 156 8.846 -14.932 -14.827 1240 H GLU 67 H GLU 157 6.300 -16.038 -12.569 1241 HA GLU 67 HA GLU 157 6.944 -18.952 -13.215 1242 1HB GLU 67 2HB GLU 157 7.749 -17.928 -11.003 1243 2HB GLU 67 1HB GLU 157 6.067 -17.693 -10.532 1244 1HG GLU 67 1HG GLU 157 6.914 -19.700 -9.452 1245 2HG GLU 67 2HG GLU 157 5.653 -20.154 -10.579 1246 HE1 GLU 67 HE2 GLU 157 9.509 -21.299 -11.121 1247 H GLU 68 H GLU 158 5.330 -20.269 -13.554 1248 HA GLU 68 HA GLU 158 2.594 -19.167 -13.992 1249 1HB GLU 68 1HB GLU 158 1.944 -21.287 -15.052 1250 2HB GLU 68 2HB GLU 158 3.285 -20.461 -15.783 1251 1HG GLU 68 1HG GLU 158 3.861 -22.721 -15.966 1252 2HG GLU 68 2HG GLU 158 4.903 -22.131 -14.691 1253 HE1 GLU 68 HE2 GLU 158 1.871 -23.612 -15.295 1254 H MET 69 H MET 159 0.904 -19.357 -12.703 1255 HA MET 69 HA MET 159 0.782 -21.437 -10.525 1256 1HB MET 69 1HB MET 159 0.748 -19.993 -8.647 1257 2HB MET 69 2HB MET 159 2.175 -19.561 -9.550 1258 1HG MET 69 1HG MET 159 -0.462 -17.957 -9.430 1259 2HG MET 69 2HG MET 159 1.040 -17.565 -8.594 1260 1HE MET 69 1HE MET 159 -0.569 -15.546 -10.349 1261 2HE MET 69 3HE MET 159 0.060 -15.230 -11.992 1262 3HE MET 69 2HE MET 159 -1.018 -16.622 -11.708 1263 H GLU 70 H GLU 160 -1.122 -21.691 -9.509 1264 HA GLU 70 HA GLU 160 -3.596 -20.971 -10.979 1265 1HB GLU 70 2HB GLU 160 -4.832 -22.385 -9.590 1266 2HB GLU 70 1HB GLU 160 -3.386 -23.234 -10.098 1267 1HG GLU 70 1HG GLU 160 -3.923 -22.064 -7.287 1268 2HG GLU 70 2HG GLU 160 -4.104 -23.736 -7.759 1269 HE1 GLU 70 HE2 GLU 160 -0.722 -24.525 -7.752 1270 H ILE 71 H ILE 161 -4.607 -19.072 -10.756 1271 HA ILE 71 HA ILE 161 -4.063 -17.239 -8.540 1272 HB ILE 71 HB ILE 161 -5.879 -17.022 -11.034 1273 1HG1 ILE 71 1HG1 ILE 161 -3.113 -15.716 -10.577 1274 2HG1 ILE 71 2HG1 ILE 161 -3.286 -17.249 -11.399 1275 1HG2 ILE 71 2HG2 ILE 161 -6.644 -15.459 -9.299 1276 2HG2 ILE 71 3HG2 ILE 161 -4.978 -14.832 -9.087 1277 3HG2 ILE 71 1HG2 ILE 161 -5.861 -14.582 -10.625 1278 1HD1 ILE 71 2HD1 ILE 161 -4.744 -16.203 -13.176 1279 2HD1 ILE 71 3HD1 ILE 161 -4.466 -14.608 -12.427 1280 3HD1 ILE 71 1HD1 ILE 161 -3.100 -15.532 -13.091 1281 HA PRO 72 HA PRO 162 -7.986 -18.783 -6.515 1282 1HB PRO 72 1HB PRO 162 -7.540 -17.932 -3.927 1283 2HB PRO 72 2HB PRO 162 -6.561 -19.207 -4.669 1284 1HG PRO 72 1HG PRO 162 -5.849 -16.242 -4.380 1285 2HG PRO 72 2HG PRO 162 -4.836 -17.650 -3.986 1286 1HD PRO 72 1HD PRO 162 -4.681 -16.249 -6.424 1287 2HD PRO 72 2HD PRO 162 -4.240 -17.975 -6.261 1288 H ALA 73 H ALA 163 -10.006 -17.910 -6.000 1289 HA ALA 73 HA ALA 163 -10.382 -15.057 -6.779 1290 1HB ALA 73 3HB ALA 163 -12.627 -17.032 -5.961 1291 2HB ALA 73 1HB ALA 163 -12.866 -15.384 -6.409 1292 3HB ALA 73 2HB ALA 163 -12.189 -16.429 -7.625 1293 H SER 74 H SER 164 -11.515 -13.674 -5.876 1294 HA SER 74 HA SER 164 -13.021 -13.839 -3.530 1295 1HB SER 74 1HB SER 164 -10.623 -13.753 -2.401 1296 2HB SER 74 2HB SER 164 -10.400 -12.153 -3.090 1297 HG SER 74 HG SER 164 -11.055 -12.114 -0.932 1298 H LYS 75 H LYS 165 -13.291 -11.287 -2.659 1299 HA LYS 75 HA LYS 165 -13.501 -9.353 -5.048 1300 1HB LYS 75 2HB LYS 165 -14.150 -8.393 -2.303 1301 2HB LYS 75 1HB LYS 165 -14.540 -7.769 -3.897 1302 1HG LYS 75 1HG LYS 165 -16.187 -9.643 -4.251 1303 2HG LYS 75 2HG LYS 165 -15.840 -10.265 -2.643 1304 1HD LYS 75 1HD LYS 165 -17.043 -7.499 -3.288 1305 2HD LYS 75 2HD LYS 165 -17.957 -8.898 -2.772 1306 1HE LYS 75 1HE LYS 165 -15.862 -7.409 -1.043 1307 2HE LYS 75 2HE LYS 165 -17.606 -7.230 -0.936 1308 1HZ LYS 75 1HZ LYS 165 -16.828 -8.713 0.739 1309 2HZ LYS 75 2HZ LYS 165 -17.787 -9.545 -0.292 1310 H VAL 76 H VAL 166 -11.508 -9.009 -5.395 1311 HA VAL 76 HA VAL 166 -9.462 -9.545 -3.498 1312 HB VAL 76 HB VAL 166 -8.051 -10.106 -4.932 1313 1HG1 VAL 76 3HG2 VAL 166 -10.111 -11.387 -5.043 1314 2HG1 VAL 76 1HG2 VAL 166 -10.490 -10.559 -6.564 1315 3HG1 VAL 76 2HG2 VAL 166 -9.037 -11.607 -6.465 1316 1HG2 VAL 76 3HG1 VAL 166 -8.134 -7.991 -6.595 1317 2HG2 VAL 76 1HG1 VAL 166 -7.167 -9.479 -6.748 1318 3HG2 VAL 76 2HG1 VAL 166 -8.674 -9.382 -7.613 1319 HA PRO 77 HA PRO 167 -8.936 -5.212 -2.567 1320 1HB PRO 77 1HB PRO 167 -7.455 -5.403 -0.211 1321 2HB PRO 77 2HB PRO 167 -9.137 -5.959 -0.324 1322 1HG PRO 77 1HG PRO 167 -6.593 -7.649 -0.618 1323 2HG PRO 77 2HG PRO 167 -7.969 -7.960 0.452 1324 1HD PRO 77 1HD PRO 167 -7.675 -9.129 -2.127 1325 2HD PRO 77 2HD PRO 167 -9.287 -8.784 -1.466 1326 H ALA 78 H ALA 168 -7.870 -3.896 -3.385 1327 HA ALA 78 HA ALA 168 -4.897 -4.121 -4.074 1328 1HB ALA 78 3HB ALA 168 -6.672 -4.438 -5.891 1329 2HB ALA 78 1HB ALA 168 -7.279 -2.800 -5.566 1330 3HB ALA 78 2HB ALA 168 -5.629 -3.031 -6.192 1331 H PHE 79 H PHE 169 -4.040 -2.015 -4.637 1332 HA PHE 79 HA PHE 169 -4.768 0.467 -2.958 1333 1HB PHE 79 2HB PHE 169 -3.794 -0.543 -1.267 1334 2HB PHE 79 1HB PHE 169 -2.498 -1.248 -2.293 1335 HD1 PHE 79 HD2 PHE 169 -3.660 1.983 -0.760 1336 HD2 PHE 79 HD1 PHE 169 -0.461 -0.028 -2.816 1337 HE1 PHE 79 HE2 PHE 169 -2.207 3.942 -0.442 1338 HE2 PHE 79 HE1 PHE 169 0.949 1.965 -2.560 1339 HZ PHE 79 HZ PHE 169 0.072 3.963 -1.421 1340 H LYS 80 H LYS 170 -4.471 1.754 -4.432 1341 HA LYS 80 HA LYS 170 -2.658 1.768 -7.000 1342 1HB LYS 80 2HB LYS 170 -4.644 3.859 -6.030 1343 2HB LYS 80 1HB LYS 170 -3.621 4.016 -7.445 1344 1HG LYS 80 1HG LYS 170 -5.832 1.900 -7.085 1345 2HG LYS 80 2HG LYS 170 -5.989 3.427 -7.935 1346 1HD LYS 80 1HD LYS 170 -4.111 2.681 -9.526 1347 2HD LYS 80 2HD LYS 170 -4.135 1.099 -8.763 1348 1HE LYS 80 1HE LYS 170 -6.531 2.428 -10.214 1349 2HE LYS 80 2HE LYS 170 -5.449 1.232 -10.922 1350 1HZ LYS 80 1HZ LYS 170 -6.182 -0.376 -9.298 1351 2HZ LYS 80 2HZ LYS 170 -7.447 0.205 -10.154 1352 HA PRO 81 HA PRO 171 0.206 4.283 -4.434 1353 1HB PRO 81 1HB PRO 171 2.240 4.618 -6.255 1354 2HB PRO 81 2HB PRO 171 1.848 3.026 -5.593 1355 1HG PRO 81 1HG PRO 171 0.962 4.184 -8.290 1356 2HG PRO 81 2HG PRO 171 1.753 2.616 -7.987 1357 1HD PRO 81 1HD PRO 171 -1.029 2.936 -8.193 1358 2HD PRO 81 2HD PRO 171 -0.284 1.639 -7.205 1359 H GLY 82 H GLY 172 -2.142 5.496 -5.535 1360 1HA GLY 82 1HA GLY 172 -3.141 7.339 -6.732 1361 2HA GLY 82 2HA GLY 172 -2.088 8.157 -5.597 1362 H LYS 83 H LYS 173 -0.540 6.499 -8.132 1363 HA LYS 83 HA LYS 173 0.833 7.206 -9.967 1364 1HB LYS 83 2HB LYS 173 -1.236 9.345 -10.139 1365 2HB LYS 83 1HB LYS 173 0.293 9.993 -10.559 1366 1HG LYS 83 1HG LYS 173 -0.961 7.470 -11.852 1367 2HG LYS 83 2HG LYS 173 -1.065 9.096 -12.517 1368 1HD LYS 83 1HD LYS 173 1.433 9.201 -12.784 1369 2HD LYS 83 2HD LYS 173 1.598 7.591 -12.082 1370 1HE LYS 83 1HE LYS 173 0.205 6.617 -13.979 1371 2HE LYS 83 2HE LYS 173 0.078 8.228 -14.701 1372 1HZ LYS 83 1HZ LYS 173 2.478 8.281 -14.911 1373 2HZ LYS 83 2HZ LYS 173 1.855 6.985 -15.687 1374 H ALA 84 H ALA 174 0.319 9.560 -7.670 1375 HA ALA 84 HA ALA 174 2.689 11.223 -7.609 1376 1HB ALA 84 2HB ALA 174 0.446 11.697 -6.602 1377 2HB ALA 84 3HB ALA 174 0.617 10.309 -5.497 1378 3HB ALA 84 1HB ALA 174 1.690 11.722 -5.307 1379 H LEU 85 H LEU 175 1.890 8.292 -5.525 1380 HA LEU 85 HA LEU 175 4.514 8.224 -4.251 1381 1HB LEU 85 2HB LEU 175 2.541 7.169 -3.168 1382 2HB LEU 85 1HB LEU 175 2.349 6.079 -4.530 1383 HG LEU 85 HG LEU 175 4.730 5.372 -4.126 1384 1HD1 LEU 85 3HD1 LEU 175 5.424 7.100 -2.441 1385 2HD1 LEU 85 1HD1 LEU 175 4.222 6.438 -1.301 1386 3HD1 LEU 85 2HD1 LEU 175 5.630 5.459 -1.797 1387 1HD2 LEU 85 3HD2 LEU 175 2.780 3.850 -3.666 1388 2HD2 LEU 85 1HD2 LEU 175 3.981 3.611 -2.386 1389 3HD2 LEU 85 2HD2 LEU 175 2.524 4.590 -2.072 1390 H LYS 86 H LYS 176 3.129 6.752 -7.186 1391 HA LYS 86 HA LYS 176 5.455 5.168 -7.946 1392 1HB LYS 86 1HB LYS 176 3.087 5.052 -8.981 1393 2HB LYS 86 2HB LYS 176 3.530 6.427 -9.979 1394 1HG LYS 86 1HG LYS 176 5.446 5.082 -10.946 1395 2HG LYS 86 2HG LYS 176 4.993 3.718 -9.917 1396 1HD LYS 86 1HD LYS 176 2.719 3.636 -11.037 1397 2HD LYS 86 2HD LYS 176 3.170 5.010 -12.054 1398 1HE LYS 86 1HE LYS 176 5.080 3.642 -13.046 1399 2HE LYS 86 2HE LYS 176 4.610 2.266 -12.036 1400 1HZ LYS 86 1HZ LYS 176 2.465 2.240 -13.133 1401 2HZ LYS 86 2HZ LYS 176 3.676 2.080 -14.219 1402 H ASP 87 H ASP 177 5.043 8.660 -8.121 1403 HA ASP 87 HA ASP 177 7.495 9.114 -9.749 1404 1HB ASP 87 1HB ASP 177 5.078 10.562 -9.024 1405 2HB ASP 87 2HB ASP 177 6.299 11.329 -8.106 1406 HD1 ASP 87 HD2 ASP 177 6.165 11.529 -12.171 1407 H ALA 88 H ALA 178 6.533 9.326 -6.287 1408 HA ALA 88 HA ALA 178 8.971 10.243 -5.022 1409 1HB ALA 88 3HB ALA 178 6.728 9.719 -3.798 1410 2HB ALA 88 1HB ALA 178 7.054 7.998 -3.999 1411 3HB ALA 88 2HB ALA 178 8.131 8.943 -3.002 1412 H VAL 89 H VAL 179 7.954 6.931 -5.873 1413 HA VAL 89 HA VAL 179 10.357 5.613 -4.848 1414 HB VAL 89 HB VAL 179 7.635 5.351 -4.644 1415 1HG1 VAL 89 2HG2 VAL 179 7.462 5.190 -7.240 1416 2HG1 VAL 89 3HG2 VAL 179 8.000 3.509 -7.044 1417 3HG1 VAL 89 1HG2 VAL 179 6.529 4.111 -6.208 1418 1HG2 VAL 89 3HG1 VAL 179 9.357 2.950 -4.943 1419 2HG2 VAL 89 1HG1 VAL 179 9.098 4.018 -3.497 1420 3HG2 VAL 89 2HG1 VAL 179 7.720 3.126 -4.185 1421 H LYS 90 H LYS 180 9.749 6.932 -7.911 1422 HA LYS 90 HA LYS 180 10.480 4.832 -9.715 1423 1HB LYS 90 1HB LYS 180 9.344 7.280 -9.980 1424 2HB LYS 90 2HB LYS 180 10.961 7.818 -10.320 1425 1HG LYS 90 1HG LYS 180 11.062 6.313 -12.319 1426 2HG LYS 90 2HG LYS 180 9.590 5.492 -11.818 1427 1HD LYS 90 1HD LYS 180 8.898 6.977 -13.561 1428 2HD LYS 90 2HD LYS 180 8.259 7.612 -12.067 1429 1HE LYS 90 1HE LYS 180 9.032 9.492 -13.371 1430 2HE LYS 90 2HE LYS 180 10.122 9.355 -11.997 1431 1HZ LYS 90 1HZ LYS 180 11.722 8.251 -13.442 1432 2HZ LYS 90 2HZ LYS 180 11.332 9.732 -14.014 Start of MODEL 15 Raw file had 1432 H/Q atoms Start of MODEL 15 1 1H MET 1 1H MET 1 -14.107 5.853 0.200 2 2H MET 1 2H MET 1 -12.922 6.052 -0.909 3 HA MET 1 HA MET 1 -14.024 8.133 0.840 4 1HB MET 1 1HB MET 1 -11.384 6.551 1.090 5 2HB MET 1 2HB MET 1 -11.711 8.023 1.954 6 1HG MET 1 1HG MET 1 -12.415 6.677 3.616 7 2HG MET 1 2HG MET 1 -13.953 6.679 2.766 8 1HE MET 1 3HE MET 1 -10.610 4.718 3.556 9 2HE MET 1 2HE MET 1 -11.918 4.357 4.709 10 3HE MET 1 1HE MET 1 -11.296 3.078 3.621 11 H ASN 2 H ASN 2 -10.860 8.826 0.297 12 HA ASN 2 HA ASN 2 -10.454 10.103 -1.966 13 1HB ASN 2 1HB ASN 2 -11.064 12.338 -2.231 14 2HB ASN 2 2HB ASN 2 -12.518 11.427 -1.987 15 1HD2 ASN 2 1HD2 ASN 2 -11.696 14.444 0.634 16 2HD2 ASN 2 2HD2 ASN 2 -10.424 13.771 -0.507 17 H LYS 3 H LYS 3 -10.400 10.725 1.374 18 HA LYS 3 HA LYS 3 -7.961 10.507 2.326 19 1HB LYS 3 1HB LYS 3 -6.946 12.112 0.488 20 2HB LYS 3 2HB LYS 3 -7.732 13.425 1.317 21 1HG LYS 3 1HG LYS 3 -6.335 12.728 3.431 22 2HG LYS 3 2HG LYS 3 -5.626 11.449 2.465 23 1HD LYS 3 1HD LYS 3 -4.004 13.189 2.523 24 2HD LYS 3 2HD LYS 3 -4.647 13.184 0.899 25 1HE LYS 3 1HE LYS 3 -4.401 15.498 1.566 26 2HE LYS 3 2HE LYS 3 -6.134 15.194 1.508 27 1HZ LYS 3 1HZ LYS 3 -6.073 14.889 3.938 28 2HZ LYS 3 2HZ LYS 3 -4.467 15.188 3.970 29 H THR 4 H THR 4 -10.682 12.779 2.193 30 HA THR 4 HA THR 4 -10.344 13.661 4.949 31 HB THR 4 HB THR 4 -12.125 14.388 2.526 32 HG1 THR 4 HG1 THR 4 -9.915 15.050 2.386 33 1HG2 THR 4 3HG2 THR 4 -11.831 15.538 5.308 34 2HG2 THR 4 1HG2 THR 4 -12.638 16.392 3.902 35 3HG2 THR 4 2HG2 THR 4 -13.289 14.821 4.524 36 H GLU 5 H GLU 5 -12.233 11.552 2.980 37 HA GLU 5 HA GLU 5 -14.393 11.002 5.033 38 1HB GLU 5 1HB GLU 5 -13.520 9.175 2.750 39 2HB GLU 5 2HB GLU 5 -14.950 8.969 3.737 40 1HG GLU 5 1HG GLU 5 -14.425 11.140 1.636 41 2HG GLU 5 2HG GLU 5 -15.469 9.760 1.449 42 HE1 GLU 5 HE2 GLU 5 -18.150 11.056 3.253 43 H LEU 6 H LEU 6 -10.953 10.252 4.456 44 HA LEU 6 HA LEU 6 -10.828 7.935 6.201 45 1HB LEU 6 2HB LEU 6 -9.208 9.431 4.189 46 2HB LEU 6 1HB LEU 6 -8.361 9.663 5.661 47 HG LEU 6 HG LEU 6 -7.496 7.665 5.124 48 1HD1 LEU 6 2HD1 LEU 6 -8.678 6.734 7.051 49 2HD1 LEU 6 3HD1 LEU 6 -9.878 6.005 5.950 50 3HD1 LEU 6 1HD1 LEU 6 -8.184 5.508 5.858 51 1HD2 LEU 6 1HD2 LEU 6 -8.382 7.692 2.813 52 2HD2 LEU 6 2HD2 LEU 6 -8.282 6.015 3.375 53 3HD2 LEU 6 3HD2 LEU 6 -9.855 6.859 3.341 54 H ILE 7 H ILE 7 -10.305 11.482 6.407 55 HA ILE 7 HA ILE 7 -9.152 11.585 9.080 56 HB ILE 7 HB ILE 7 -10.840 13.704 7.646 57 1HG1 ILE 7 1HG1 ILE 7 -7.779 13.452 7.880 58 2HG1 ILE 7 2HG1 ILE 7 -8.608 12.769 6.553 59 1HG2 ILE 7 2HG2 ILE 7 -10.677 14.211 10.132 60 2HG2 ILE 7 3HG2 ILE 7 -8.919 14.114 10.004 61 3HG2 ILE 7 1HG2 ILE 7 -9.793 15.392 9.152 62 1HD1 ILE 7 2HD1 ILE 7 -9.665 15.130 6.101 63 2HD1 ILE 7 3HD1 ILE 7 -8.305 15.690 7.029 64 3HD1 ILE 7 1HD1 ILE 7 -8.012 14.695 5.565 65 H ASN 8 H ASN 8 -12.528 11.864 8.009 66 HA ASN 8 HA ASN 8 -13.675 11.656 10.754 67 1HB ASN 8 1HB ASN 8 -15.043 10.921 8.047 68 2HB ASN 8 2HB ASN 8 -15.879 11.073 9.573 69 1HD2 ASN 8 2HD2 ASN 8 -15.269 14.474 7.439 70 2HD2 ASN 8 1HD2 ASN 8 -14.663 12.837 6.875 71 H ALA 9 H ALA 9 -12.200 9.209 8.867 72 HA ALA 9 HA ALA 9 -13.624 6.861 10.111 73 1HB ALA 9 2HB ALA 9 -12.114 6.729 7.825 74 2HB ALA 9 3HB ALA 9 -10.720 6.895 8.881 75 3HB ALA 9 1HB ALA 9 -11.709 5.511 9.101 76 H VAL 10 H VAL 10 -10.558 8.657 10.534 77 HA VAL 10 HA VAL 10 -9.578 6.937 12.538 78 HB VAL 10 HB VAL 10 -8.472 9.739 12.189 79 1HG1 VAL 10 3HG2 VAL 10 -7.538 7.742 13.734 80 2HG1 VAL 10 1HG2 VAL 10 -6.678 7.358 12.208 81 3HG1 VAL 10 2HG2 VAL 10 -6.501 8.965 12.925 82 1HG2 VAL 10 1HG1 VAL 10 -8.424 7.528 10.136 83 2HG2 VAL 10 2HG1 VAL 10 -8.767 9.291 10.047 84 3HG2 VAL 10 3HG1 VAL 10 -7.075 8.749 10.239 85 H ALA 11 H ALA 11 -10.737 10.146 12.473 86 HA ALA 11 HA ALA 11 -10.760 10.359 15.289 87 1HB ALA 11 2HB ALA 11 -10.745 12.379 13.737 88 2HB ALA 11 3HB ALA 11 -12.402 11.998 13.206 89 3HB ALA 11 1HB ALA 11 -12.097 12.553 14.885 90 H GLU 12 H GLU 12 -13.147 8.876 13.227 91 HA GLU 12 HA GLU 12 -15.204 8.781 15.416 92 1HB GLU 12 1HB GLU 12 -15.991 8.814 13.055 93 2HB GLU 12 2HB GLU 12 -15.107 7.328 12.698 94 1HG GLU 12 1HG GLU 12 -16.585 6.050 14.281 95 2HG GLU 12 2HG GLU 12 -17.438 7.529 14.716 96 HE1 GLU 12 HE2 GLU 12 -19.348 7.676 11.829 97 H THR 13 H THR 13 -12.929 6.391 13.873 98 HA THR 13 HA THR 13 -13.508 4.581 16.225 99 HB THR 13 HB THR 13 -13.505 3.983 13.745 100 HG1 THR 13 HG1 THR 13 -13.077 1.850 14.366 101 1HG2 THR 13 1HG2 THR 13 -11.184 4.498 13.116 102 2HG2 THR 13 2HG2 THR 13 -10.597 3.255 14.252 103 3HG2 THR 13 3HG2 THR 13 -11.602 2.793 12.847 104 H SER 14 H SER 14 -11.708 6.863 16.241 105 HA SER 14 HA SER 14 -9.854 5.644 18.400 106 1HB SER 14 1HB SER 14 -8.821 7.905 16.586 107 2HB SER 14 2HB SER 14 -7.935 7.030 17.825 108 HG SER 14 HG SER 14 -9.068 5.905 15.482 109 H GLY 15 H GLY 15 -11.688 8.603 17.501 110 1HA GLY 15 1HA GLY 15 -12.290 10.477 18.803 111 2HA GLY 15 2HA GLY 15 -11.948 9.522 20.242 112 H LEU 16 H LEU 16 -10.115 10.987 17.634 113 HA LEU 16 HA LEU 16 -8.329 12.596 19.479 114 1HB LEU 16 1HB LEU 16 -6.668 12.577 17.755 115 2HB LEU 16 2HB LEU 16 -6.972 11.057 18.572 116 HG LEU 16 HG LEU 16 -8.134 10.141 16.836 117 1HD1 LEU 16 2HD1 LEU 16 -9.455 12.147 16.008 118 2HD1 LEU 16 3HD1 LEU 16 -7.940 12.650 15.195 119 3HD1 LEU 16 1HD1 LEU 16 -8.802 11.113 14.735 120 1HD2 LEU 16 2HD2 LEU 16 -6.085 9.523 16.491 121 2HD2 LEU 16 3HD2 LEU 16 -7.187 9.508 15.090 122 3HD2 LEU 16 1HD2 LEU 16 -5.964 10.763 15.189 123 H SER 17 H SER 17 -8.138 13.781 16.788 124 HA SER 17 HA SER 17 -10.401 15.841 16.874 125 1HB SER 17 1HB SER 17 -7.533 16.790 16.453 126 2HB SER 17 2HB SER 17 -8.993 17.750 16.443 127 HG SER 17 HG SER 17 -9.360 17.165 18.607 128 H LYS 18 H LYS 18 -10.726 16.938 14.885 129 HA LYS 18 HA LYS 18 -10.413 15.241 12.413 130 1HB LYS 18 1HB LYS 18 -11.459 18.127 12.587 131 2HB LYS 18 2HB LYS 18 -11.482 17.122 11.151 132 1HG LYS 18 1HG LYS 18 -13.017 16.515 13.756 133 2HG LYS 18 2HG LYS 18 -13.694 17.296 12.341 134 1HD LYS 18 1HD LYS 18 -13.432 15.248 10.960 135 2HD LYS 18 2HD LYS 18 -12.514 14.452 12.225 136 1HE LYS 18 1HE LYS 18 -14.734 13.524 12.279 137 2HE LYS 18 2HE LYS 18 -14.499 14.445 13.761 138 1HZ LYS 18 1HZ LYS 18 -15.777 16.254 12.785 139 2HZ LYS 18 2HZ LYS 18 -16.647 14.870 12.822 140 H LYS 19 H LYS 19 -8.976 18.274 13.575 141 HA LYS 19 HA LYS 19 -6.899 18.485 11.499 142 1HB LYS 19 2HB LYS 19 -7.540 20.383 12.981 143 2HB LYS 19 1HB LYS 19 -6.879 19.560 14.392 144 1HG LYS 19 1HG LYS 19 -5.348 21.298 13.624 145 2HG LYS 19 2HG LYS 19 -4.588 19.732 13.485 146 1HD LYS 19 1HD LYS 19 -3.973 21.069 11.551 147 2HD LYS 19 2HD LYS 19 -4.929 19.710 11.018 148 1HE LYS 19 1HE LYS 19 -5.624 21.631 9.728 149 2HE LYS 19 2HE LYS 19 -6.971 21.225 10.785 150 1HZ LYS 19 1HZ LYS 19 -6.526 23.591 10.719 151 2HZ LYS 19 2HZ LYS 19 -4.985 23.393 11.228 152 H ASP 20 H ASP 20 -6.985 16.582 14.615 153 HA ASP 20 HA ASP 20 -4.121 15.707 14.288 154 1HB ASP 20 1HB ASP 20 -6.374 14.759 16.160 155 2HB ASP 20 2HB ASP 20 -4.898 13.843 16.039 156 HD1 ASP 20 HD2 ASP 20 -2.797 16.170 17.547 157 H ALA 21 H ALA 21 -7.207 14.426 13.209 158 HA ALA 21 HA ALA 21 -6.110 11.835 12.230 159 1HB ALA 21 2HB ALA 21 -8.837 13.242 11.981 160 2HB ALA 21 3HB ALA 21 -8.452 11.701 11.158 161 3HB ALA 21 1HB ALA 21 -8.377 11.828 12.893 162 H THR 22 H THR 22 -6.790 15.018 10.647 163 HA THR 22 HA THR 22 -5.966 14.346 7.958 164 HB THR 22 HB THR 22 -5.456 17.074 9.340 165 HG1 THR 22 HG1 THR 22 -7.543 17.618 8.816 166 1HG2 THR 22 3HG2 THR 22 -6.263 16.228 6.494 167 2HG2 THR 22 1HG2 THR 22 -6.241 17.916 7.076 168 3HG2 THR 22 2HG2 THR 22 -4.723 16.953 7.004 169 H LYS 23 H LYS 23 -4.114 15.572 10.639 170 HA LYS 23 HA LYS 23 -1.438 15.528 9.412 171 1HB LYS 23 2HB LYS 23 -2.530 15.156 12.328 172 2HB LYS 23 1HB LYS 23 -0.832 15.145 12.048 173 1HG LYS 23 1HG LYS 23 -0.821 17.491 11.176 174 2HG LYS 23 2HG LYS 23 -2.573 17.594 11.338 175 1HD LYS 23 1HD LYS 23 -2.403 17.250 13.814 176 2HD LYS 23 2HD LYS 23 -0.659 17.077 13.721 177 1HE LYS 23 1HE LYS 23 -2.195 19.640 12.893 178 2HE LYS 23 2HE LYS 23 -1.523 19.362 14.498 179 1HZ LYS 23 1HZ LYS 23 0.678 19.171 13.502 180 2HZ LYS 23 2HZ LYS 23 0.076 19.414 12.002 181 H ALA 24 H ALA 24 -3.012 13.210 11.515 182 HA ALA 24 HA ALA 24 -0.945 11.267 11.662 183 1HB ALA 24 2HB ALA 24 -2.695 11.429 13.243 184 2HB ALA 24 3HB ALA 24 -3.936 10.974 12.028 185 3HB ALA 24 1HB ALA 24 -2.692 9.782 12.560 186 H VAL 25 H VAL 25 -3.596 11.364 9.278 187 HA VAL 25 HA VAL 25 -2.711 8.988 7.627 188 HB VAL 25 HB VAL 25 -4.385 11.700 7.452 189 1HG1 VAL 25 2HG2 VAL 25 -3.828 9.998 4.948 190 2HG1 VAL 25 3HG2 VAL 25 -5.065 11.296 5.086 191 3HG1 VAL 25 1HG2 VAL 25 -3.359 11.683 5.217 192 1HG2 VAL 25 3HG1 VAL 25 -5.485 9.726 8.471 193 2HG2 VAL 25 1HG1 VAL 25 -6.325 10.330 7.039 194 3HG2 VAL 25 2HG1 VAL 25 -5.343 8.835 6.925 195 H ASP 26 H ASP 26 -2.090 12.553 7.189 196 HA ASP 26 HA ASP 26 0.309 12.002 5.440 197 1HB ASP 26 1HB ASP 26 -0.690 14.572 6.819 198 2HB ASP 26 2HB ASP 26 0.662 14.531 5.699 199 HD1 ASP 26 HD2 ASP 26 -1.195 14.190 2.792 200 H ALA 27 H ALA 27 0.166 11.177 8.230 201 HA ALA 27 HA ALA 27 2.997 11.736 9.191 202 1HB ALA 27 3HB ALA 27 0.879 12.165 10.777 203 2HB ALA 27 1HB ALA 27 0.953 10.420 10.968 204 3HB ALA 27 2HB ALA 27 2.316 11.466 11.410 205 H VAL 28 H VAL 28 0.674 9.139 8.698 206 HA VAL 28 HA VAL 28 2.590 6.876 8.696 207 HB VAL 28 HB VAL 28 -0.050 7.005 7.013 208 1HG1 VAL 28 1HG2 VAL 28 1.983 4.904 7.600 209 2HG1 VAL 28 2HG2 VAL 28 0.319 4.375 7.811 210 3HG1 VAL 28 3HG2 VAL 28 0.781 5.098 6.264 211 1HG2 VAL 28 1HG1 VAL 28 0.161 6.188 9.870 212 2HG2 VAL 28 2HG1 VAL 28 -0.900 7.399 9.034 213 3HG2 VAL 28 3HG1 VAL 28 -1.144 5.681 8.708 214 H PHE 29 H PHE 29 0.833 8.475 6.167 215 HA PHE 29 HA PHE 29 2.368 7.479 3.883 216 1HB PHE 29 2HB PHE 29 0.237 9.684 3.965 217 2HB PHE 29 1HB PHE 29 0.765 8.893 2.502 218 HD1 PHE 29 HD2 PHE 29 0.804 6.050 2.916 219 HD2 PHE 29 HD1 PHE 29 -1.942 8.905 4.559 220 HE1 PHE 29 HE2 PHE 29 -0.739 4.233 3.481 221 HE2 PHE 29 HE1 PHE 29 -3.478 7.079 5.146 222 HZ PHE 29 HZ PHE 29 -2.821 4.726 4.666 223 H ASP 30 H ASP 30 3.154 10.157 5.846 224 HA ASP 30 HA ASP 30 4.863 11.374 3.682 225 1HB ASP 30 1HB ASP 30 3.750 12.609 5.739 226 2HB ASP 30 2HB ASP 30 5.072 12.014 6.702 227 HD1 ASP 30 HD2 ASP 30 5.590 15.019 4.050 228 H SER 31 H SER 31 5.237 9.348 6.416 229 HA SER 31 HA SER 31 8.247 9.036 6.249 230 1HB SER 31 1HB SER 31 6.299 7.243 7.780 231 2HB SER 31 2HB SER 31 8.060 7.236 7.919 232 HG SER 31 HG SER 31 6.384 9.449 8.487 233 H ILE 32 H ILE 32 5.386 7.018 4.947 234 HA ILE 32 HA ILE 32 6.890 5.002 3.818 235 HB ILE 32 HB ILE 32 4.330 6.049 2.668 236 1HG1 ILE 32 1HG1 ILE 32 4.928 4.631 5.248 237 2HG1 ILE 32 2HG1 ILE 32 4.006 6.067 4.846 238 1HG2 ILE 32 3HG2 ILE 32 5.667 4.358 1.358 239 2HG2 ILE 32 1HG2 ILE 32 5.647 3.235 2.682 240 3HG2 ILE 32 2HG2 ILE 32 4.139 3.651 1.854 241 1HD1 ILE 32 2HD1 ILE 32 2.838 3.486 3.986 242 2HD1 ILE 32 3HD1 ILE 32 2.749 4.095 5.677 243 3HD1 ILE 32 1HD1 ILE 32 2.109 5.104 4.353 244 H THR 33 H THR 33 5.701 8.015 2.311 245 HA THR 33 HA THR 33 7.102 7.567 -0.252 246 HB THR 33 HB THR 33 5.375 9.179 -0.200 247 HG1 THR 33 HG1 THR 33 7.786 10.574 -0.578 248 1HG2 THR 33 1HG2 THR 33 5.710 9.976 2.203 249 2HG2 THR 33 2HG2 THR 33 6.963 11.060 1.653 250 3HG2 THR 33 3HG2 THR 33 5.253 11.256 1.087 251 H GLU 34 H GLU 34 8.306 8.951 2.759 252 HA GLU 34 HA GLU 34 11.015 9.526 1.630 253 1HB GLU 34 1HB GLU 34 10.079 10.753 3.665 254 2HB GLU 34 2HB GLU 34 10.106 9.250 4.581 255 1HG GLU 34 1HG GLU 34 12.633 9.167 4.368 256 2HG GLU 34 2HG GLU 34 12.607 10.620 3.376 257 HE1 GLU 34 HE2 GLU 34 12.087 10.770 7.391 258 H ALA 35 H ALA 35 9.498 6.692 3.253 259 HA ALA 35 HA ALA 35 11.967 5.106 3.195 260 1HB ALA 35 3HB ALA 35 9.764 4.287 4.544 261 2HB ALA 35 1HB ALA 35 8.966 4.111 3.005 262 3HB ALA 35 2HB ALA 35 10.284 3.055 3.392 263 H LEU 36 H LEU 36 9.228 5.228 0.874 264 HA LEU 36 HA LEU 36 10.240 3.298 -1.060 265 1HB LEU 36 2HB LEU 36 8.275 5.463 -1.502 266 2HB LEU 36 1HB LEU 36 8.401 3.984 -2.388 267 HG LEU 36 HG LEU 36 8.082 2.797 -0.743 268 1HD1 LEU 36 2HD2 LEU 36 5.653 4.117 -1.328 269 2HD1 LEU 36 3HD2 LEU 36 6.324 2.500 -1.812 270 3HD1 LEU 36 1HD2 LEU 36 5.546 2.723 -0.231 271 1HD2 LEU 36 3HD1 LEU 36 8.937 2.448 0.968 272 2HD2 LEU 36 1HD1 LEU 36 7.517 3.101 1.687 273 3HD2 LEU 36 2HD1 LEU 36 7.348 1.639 0.731 274 NH1 ARG 37 NH2 ARG 37 9.862 12.496 0.715 275 NH2 ARG 37 NH1 ARG 37 11.674 13.049 1.967 276 H ARG 37 H ARG 37 10.391 6.949 -0.941 277 HA ARG 37 HA ARG 37 11.721 6.976 -3.468 278 1HB ARG 37 1HB ARG 37 12.149 9.299 -3.318 279 2HB ARG 37 2HB ARG 37 10.584 9.030 -2.588 280 1HG ARG 37 1HG ARG 37 11.846 9.079 -0.272 281 2HG ARG 37 2HG ARG 37 13.268 9.619 -1.146 282 1HD ARG 37 1HD ARG 37 12.119 11.588 -2.005 283 2HD ARG 37 2HD ARG 37 10.573 11.045 -1.313 284 1HH1 ARG 37 2HH2 ARG 37 9.497 12.011 -0.112 285 2HH1 ARG 37 1HH2 ARG 37 9.321 13.028 1.406 286 1HH2 ARG 37 1HH1 ARG 37 12.690 12.989 2.099 287 2HH2 ARG 37 2HH1 ARG 37 11.004 13.542 2.567 288 H LYS 38 H LYS 38 12.840 6.391 -0.204 289 HA LYS 38 HA LYS 38 15.707 7.066 -0.769 290 1HB LYS 38 1HB LYS 38 14.697 7.731 1.357 291 2HB LYS 38 2HB LYS 38 14.275 6.055 1.742 292 1HG LYS 38 1HG LYS 38 16.640 5.472 2.053 293 2HG LYS 38 2HG LYS 38 17.166 7.080 1.540 294 1HD LYS 38 1HD LYS 38 16.124 8.148 3.486 295 2HD LYS 38 2HD LYS 38 15.216 6.696 3.904 296 1HE LYS 38 1HE LYS 38 17.325 5.461 4.454 297 2HE LYS 38 2HE LYS 38 18.297 6.875 4.006 298 1HZ LYS 38 1HZ LYS 38 17.944 6.778 6.366 299 2HZ LYS 38 2HZ LYS 38 17.231 8.121 5.765 300 H GLY 39 H GLY 39 13.727 4.291 -1.166 301 1HA GLY 39 1HA GLY 39 14.330 2.012 -1.736 302 2HA GLY 39 2HA GLY 39 16.009 2.327 -1.360 303 H ASP 40 H ASP 40 13.307 2.901 0.825 304 HA ASP 40 HA ASP 40 14.174 0.695 2.744 305 1HB ASP 40 1HB ASP 40 12.574 3.113 3.495 306 2HB ASP 40 2HB ASP 40 13.186 1.885 4.558 307 HD2 ASP 40 HD2 ASP 40 15.241 4.818 4.881 308 H LYS 41 H LYS 41 12.910 -0.887 3.333 309 HA LYS 41 HA LYS 41 10.196 -1.184 2.053 310 1HB LYS 41 2HB LYS 41 11.426 -3.188 3.965 311 2HB LYS 41 1HB LYS 41 10.061 -3.437 2.885 312 1HG LYS 41 1HG LYS 41 11.685 -3.077 0.900 313 2HG LYS 41 2HG LYS 41 13.009 -3.088 2.060 314 1HD LYS 41 1HD LYS 41 12.360 -5.416 2.815 315 2HD LYS 41 2HD LYS 41 10.977 -5.384 1.735 316 1HE LYS 41 1HE LYS 41 12.641 -6.698 0.624 317 2HE LYS 41 2HE LYS 41 12.534 -5.188 -0.275 318 1HZ LYS 41 1HZ LYS 41 14.614 -5.887 1.733 319 2HZ LYS 41 2HZ LYS 41 14.810 -5.893 0.111 320 H VAL 42 H VAL 42 8.406 -0.515 3.105 321 HA VAL 42 HA VAL 42 8.301 0.074 5.969 322 HB VAL 42 HB VAL 42 6.597 0.490 3.428 323 1HG1 VAL 42 3HG2 VAL 42 5.129 0.510 5.334 324 2HG1 VAL 42 1HG2 VAL 42 6.200 1.778 6.113 325 3HG1 VAL 42 2HG2 VAL 42 5.321 2.124 4.563 326 1HG2 VAL 42 1HG1 VAL 42 8.332 2.361 5.122 327 2HG2 VAL 42 2HG1 VAL 42 8.504 1.884 3.377 328 3HG2 VAL 42 3HG1 VAL 42 7.204 2.949 3.910 329 H GLN 43 H GLN 43 6.964 -0.831 7.146 330 HA GLN 43 HA GLN 43 5.535 -3.438 6.428 331 1HB GLN 43 1HB GLN 43 7.705 -3.529 8.475 332 2HB GLN 43 2HB GLN 43 6.481 -4.781 8.236 333 1HG GLN 43 1HG GLN 43 7.264 -4.986 5.842 334 2HG GLN 43 2HG GLN 43 8.496 -3.766 6.149 335 1HE2 GLN 43 2HE2 GLN 43 10.465 -6.783 6.493 336 2HE2 GLN 43 1HE2 GLN 43 9.769 -5.597 5.281 337 H LEU 44 H LEU 44 3.772 -3.942 7.154 338 HA LEU 44 HA LEU 44 2.583 -2.753 9.692 339 1HB LEU 44 2HB LEU 44 0.955 -3.149 7.101 340 2HB LEU 44 1HB LEU 44 0.453 -2.398 8.606 341 HG LEU 44 HG LEU 44 2.477 -0.698 7.962 342 1HD1 LEU 44 1HD1 LEU 44 3.167 -1.880 5.826 343 2HD1 LEU 44 2HD1 LEU 44 1.549 -1.594 5.154 344 3HD1 LEU 44 3HD1 LEU 44 2.620 -0.225 5.541 345 1HD2 LEU 44 2HD2 LEU 44 0.038 -0.067 8.292 346 2HD2 LEU 44 3HD2 LEU 44 0.754 0.819 6.931 347 3HD2 LEU 44 1HD2 LEU 44 -0.324 -0.566 6.626 348 H ILE 45 H ILE 45 2.175 -4.553 10.983 349 HA ILE 45 HA ILE 45 1.874 -7.239 9.780 350 HB ILE 45 HB ILE 45 3.176 -6.838 11.856 351 1HG1 ILE 45 1HG1 ILE 45 1.039 -9.024 12.181 352 2HG1 ILE 45 2HG1 ILE 45 2.357 -9.114 11.026 353 1HG2 ILE 45 1HG2 ILE 45 1.565 -5.354 13.058 354 2HG2 ILE 45 2HG2 ILE 45 0.444 -6.722 13.273 355 3HG2 ILE 45 3HG2 ILE 45 2.052 -6.740 14.059 356 1HD1 ILE 45 2HD1 ILE 45 4.056 -8.984 12.901 357 2HD1 ILE 45 3HD1 ILE 45 2.721 -8.987 14.085 358 3HD1 ILE 45 1HD1 ILE 45 2.971 -10.390 13.025 359 H GLY 46 H GLY 46 0.138 -8.587 9.950 360 1HA GLY 46 1HA GLY 46 -2.144 -9.167 9.536 361 2HA GLY 46 2HA GLY 46 -2.586 -7.871 10.612 362 H PHE 47 H PHE 47 -1.071 -6.251 8.116 363 HA PHE 47 HA PHE 47 -3.468 -6.149 6.273 364 1HB PHE 47 2HB PHE 47 -3.447 -4.526 8.243 365 2HB PHE 47 1HB PHE 47 -1.991 -3.778 7.648 366 HD1 PHE 47 HD2 PHE 47 -5.607 -4.415 6.692 367 HD2 PHE 47 HD1 PHE 47 -2.012 -2.226 5.763 368 HE1 PHE 47 HE2 PHE 47 -6.742 -3.239 4.810 369 HE2 PHE 47 HE1 PHE 47 -3.189 -1.107 3.920 370 HZ PHE 47 HZ PHE 47 -5.560 -1.711 3.434 371 H GLY 48 H GLY 48 0.064 -5.267 6.458 372 1HA GLY 48 1HA GLY 48 0.130 -5.064 3.492 373 2HA GLY 48 2HA GLY 48 0.204 -3.514 4.271 374 H ASN 49 H ASN 49 2.118 -4.723 2.529 375 HA ASN 49 HA ASN 49 4.498 -3.843 4.183 376 1HB ASN 49 1HB ASN 49 4.546 -6.261 4.476 377 2HB ASN 49 2HB ASN 49 4.418 -6.567 2.762 378 1HD2 ASN 49 1HD2 ASN 49 7.962 -7.145 3.530 379 2HD2 ASN 49 2HD2 ASN 49 6.304 -7.875 3.820 380 H PHE 50 H PHE 50 4.674 -1.972 3.045 381 HA PHE 50 HA PHE 50 4.583 -1.934 0.039 382 1HB PHE 50 2HB PHE 50 5.540 0.397 1.762 383 2HB PHE 50 1HB PHE 50 5.340 0.452 0.076 384 HD1 PHE 50 HD2 PHE 50 3.602 -0.008 3.334 385 HD2 PHE 50 HD1 PHE 50 3.375 1.514 -0.670 386 HE1 PHE 50 HE2 PHE 50 1.453 1.123 3.876 387 HE2 PHE 50 HE1 PHE 50 1.260 2.661 -0.090 388 HZ PHE 50 HZ PHE 50 0.275 2.338 2.125 389 H GLU 51 H GLU 51 6.336 -1.777 -1.252 390 HA GLU 51 HA GLU 51 8.983 -1.248 -0.250 391 1HB GLU 51 1HB GLU 51 10.165 -3.444 -0.725 392 2HB GLU 51 2HB GLU 51 9.075 -3.514 0.645 393 1HG GLU 51 1HG GLU 51 7.339 -4.704 -0.817 394 2HG GLU 51 2HG GLU 51 8.488 -4.685 -2.152 395 HE1 GLU 51 HE2 GLU 51 8.962 -7.142 1.044 396 H VAL 52 H VAL 52 10.354 -0.550 -1.813 397 HA VAL 52 HA VAL 52 9.003 -0.059 -4.330 398 HB VAL 52 HB VAL 52 10.496 1.382 -2.384 399 1HG1 VAL 52 1HG2 VAL 52 12.443 0.809 -4.641 400 2HG1 VAL 52 2HG2 VAL 52 12.571 2.128 -3.421 401 3HG1 VAL 52 3HG2 VAL 52 12.602 0.403 -2.924 402 1HG2 VAL 52 1HG1 VAL 52 8.867 2.322 -3.858 403 2HG2 VAL 52 2HG1 VAL 52 10.330 3.262 -3.739 404 3HG2 VAL 52 3HG1 VAL 52 10.062 2.329 -5.207 405 NH1 ARG 53 NH2 ARG 53 14.299 -5.160 -9.002 406 NH2 ARG 53 NH1 ARG 53 13.827 -7.087 -10.112 407 H ARG 53 H ARG 53 10.142 -0.219 -6.424 408 HA ARG 53 HA ARG 53 11.973 -2.707 -6.546 409 1HB ARG 53 1HB ARG 53 9.546 -3.090 -7.406 410 2HB ARG 53 2HB ARG 53 9.957 -2.011 -8.716 411 1HG ARG 53 1HG ARG 53 10.224 -4.204 -9.559 412 2HG ARG 53 2HG ARG 53 11.810 -3.459 -9.478 413 1HD ARG 53 1HD ARG 53 12.219 -4.781 -7.256 414 2HD ARG 53 2HD ARG 53 10.663 -5.552 -7.510 415 1HH1 ARG 53 2HH2 ARG 53 13.958 -4.404 -8.399 416 2HH1 ARG 53 1HH2 ARG 53 15.248 -5.266 -9.378 417 1HH2 ARG 53 1HH1 ARG 53 13.131 -7.801 -10.353 418 2HH2 ARG 53 2HH1 ARG 53 14.808 -7.059 -10.410 419 H GLU 54 H GLU 54 13.875 -1.672 -6.669 420 HA GLU 54 HA GLU 54 14.418 0.525 -8.618 421 1HB GLU 54 1HB GLU 54 16.712 0.497 -7.922 422 2HB GLU 54 2HB GLU 54 15.587 0.641 -6.591 423 1HG GLU 54 1HG GLU 54 15.978 -1.848 -6.046 424 2HG GLU 54 2HG GLU 54 17.197 -1.891 -7.316 425 HE1 GLU 54 HE2 GLU 54 17.869 -0.007 -3.791 426 NH1 ARG 55 NH2 ARG 55 13.551 1.612 -16.371 427 NH2 ARG 55 NH1 ARG 55 13.744 -0.211 -17.715 428 H ARG 55 H ARG 55 14.053 -0.026 -10.600 429 HA ARG 55 HA ARG 55 14.834 -2.710 -11.777 430 1HB ARG 55 1HB ARG 55 13.519 -2.156 -13.698 431 2HB ARG 55 2HB ARG 55 12.571 -1.937 -12.255 432 1HG ARG 55 1HG ARG 55 12.568 0.457 -12.433 433 2HG ARG 55 2HG ARG 55 13.913 0.516 -13.554 434 1HD ARG 55 1HD ARG 55 11.136 -0.664 -14.224 435 2HD ARG 55 2HD ARG 55 11.593 0.995 -14.544 436 1HH1 ARG 55 2HH2 ARG 55 13.185 2.008 -15.498 437 2HH1 ARG 55 1HH2 ARG 55 14.098 2.103 -17.087 438 1HH2 ARG 55 1HH1 ARG 55 13.530 -1.202 -17.869 439 2HH2 ARG 55 2HH1 ARG 55 14.278 0.406 -18.337 440 H ALA 56 H ALA 56 15.391 -1.965 -14.428 441 HA ALA 56 HA ALA 56 17.457 -1.899 -15.668 442 1HB ALA 56 2HB ALA 56 16.227 0.144 -15.956 443 2HB ALA 56 3HB ALA 56 17.102 0.900 -14.602 444 3HB ALA 56 1HB ALA 56 17.979 0.409 -16.081 445 H ALA 57 H ALA 57 19.063 0.189 -14.115 446 HA ALA 57 HA ALA 57 21.364 0.239 -13.533 447 1HB ALA 57 3HB ALA 57 20.117 0.393 -11.527 448 2HB ALA 57 1HB ALA 57 20.140 -1.375 -11.294 449 3HB ALA 57 2HB ALA 57 21.665 -0.413 -11.211 450 NH1 ARG 58 NH2 ARG 58 19.172 -0.750 -18.845 451 NH2 ARG 58 NH1 ARG 58 17.493 -2.281 -18.847 452 H ARG 58 H ARG 58 22.542 -0.335 -14.975 453 HA ARG 58 HA ARG 58 23.637 -3.118 -14.867 454 1HB ARG 58 2HB ARG 58 23.374 -1.602 -17.522 455 2HB ARG 58 1HB ARG 58 23.592 -3.337 -17.303 456 1HG ARG 58 1HG ARG 58 21.188 -3.385 -16.360 457 2HG ARG 58 2HG ARG 58 21.071 -1.670 -16.766 458 1HD ARG 58 1HD ARG 58 21.505 -2.201 -19.217 459 2HD ARG 58 2HD ARG 58 21.558 -3.914 -18.817 460 1HH1 ARG 58 2HH2 ARG 58 20.180 -0.571 -18.781 461 2HH1 ARG 58 1HH2 ARG 58 18.430 -0.051 -18.962 462 1HH2 ARG 58 1HH1 ARG 58 17.218 -3.268 -18.787 463 2HH2 ARG 58 2HH1 ARG 58 16.869 -1.475 -18.961 464 H LYS 59 H LYS 59 25.594 -2.846 -16.851 465 HA LYS 59 HA LYS 59 27.294 -0.481 -16.282 466 1HB LYS 59 1HB LYS 59 27.888 -2.052 -14.351 467 2HB LYS 59 2HB LYS 59 28.525 -3.205 -15.518 468 1HG LYS 59 1HG LYS 59 30.178 -1.439 -16.317 469 2HG LYS 59 2HG LYS 59 29.488 -0.278 -15.185 470 1HD LYS 59 1HD LYS 59 30.134 -1.783 -13.253 471 2HD LYS 59 2HD LYS 59 30.869 -2.924 -14.369 472 1HE LYS 59 1HE LYS 59 31.755 0.030 -14.019 473 2HE LYS 59 2HE LYS 59 32.497 -1.345 -13.204 474 1HZ LYS 59 1HZ LYS 59 33.718 -0.699 -15.162 475 2HZ LYS 59 2HZ LYS 59 32.426 -0.930 -16.138 476 H GLY 60 H GLY 60 27.930 0.082 -18.194 477 1HA GLY 60 1HA GLY 60 28.820 -1.933 -20.301 478 2HA GLY 60 2HA GLY 60 27.370 -1.010 -20.699 479 NH1 ARG 61 NH2 ARG 61 35.572 -0.158 -22.249 480 NH2 ARG 61 NH1 ARG 61 36.055 2.006 -22.734 481 H ARG 61 H ARG 61 28.095 0.372 -22.207 482 HA ARG 61 HA ARG 61 30.249 2.374 -21.495 483 1HB ARG 61 1HB ARG 61 30.367 1.079 -24.277 484 2HB ARG 61 2HB ARG 61 31.427 2.305 -23.590 485 1HG ARG 61 1HG ARG 61 32.149 0.490 -21.829 486 2HG ARG 61 2HG ARG 61 31.270 -0.654 -22.820 487 1HD ARG 61 1HD ARG 61 33.460 -0.905 -23.627 488 2HD ARG 61 2HD ARG 61 32.746 0.131 -24.838 489 1HH1 ARG 61 2HH2 ARG 61 34.918 -0.942 -22.347 490 2HH1 ARG 61 1HH2 ARG 61 36.462 -0.160 -21.737 491 1HH2 ARG 61 1HH1 ARG 61 35.774 2.875 -23.200 492 2HH2 ARG 61 2HH1 ARG 61 36.910 1.850 -22.188 493 H ASN 62 H ASN 62 30.151 4.297 -22.547 494 HA ASN 62 HA ASN 62 27.462 5.281 -23.004 495 1HB ASN 62 1HB ASN 62 29.367 6.513 -21.900 496 2HB ASN 62 2HB ASN 62 30.124 6.722 -23.470 497 1HD2 ASN 62 2HD2 ASN 62 27.162 9.284 -22.448 498 2HD2 ASN 62 1HD2 ASN 62 27.596 7.852 -21.385 499 HA PRO 63 HA PRO 63 27.194 4.464 -27.548 500 1HB PRO 63 1HB PRO 63 25.113 6.708 -27.432 501 2HB PRO 63 2HB PRO 63 25.024 5.142 -28.265 502 1HG PRO 63 1HG PRO 63 23.774 5.463 -25.874 503 2HG PRO 63 2HG PRO 63 24.675 3.959 -26.181 504 1HD PRO 63 1HD PRO 63 25.571 6.376 -24.523 505 2HD PRO 63 2HD PRO 63 25.751 4.626 -24.188 506 H GLN 64 H GLN 64 27.402 7.931 -26.591 507 HA GLN 64 HA GLN 64 28.351 8.820 -29.275 508 1HB GLN 64 1HB GLN 64 26.991 10.274 -27.582 509 2HB GLN 64 2HB GLN 64 28.420 10.358 -26.593 510 1HG GLN 64 1HG GLN 64 28.375 12.384 -27.771 511 2HG GLN 64 2HG GLN 64 29.676 11.469 -28.507 512 1HE2 GLN 64 2HE2 GLN 64 26.475 12.493 -30.869 513 2HE2 GLN 64 1HE2 GLN 64 26.481 12.792 -29.059 514 H THR 65 H THR 65 29.845 9.019 -26.104 515 HA THR 65 HA THR 65 32.521 9.513 -27.104 516 HB THR 65 HB THR 65 33.180 9.729 -24.778 517 HG1 THR 65 HG1 THR 65 30.665 8.618 -24.152 518 1HG2 THR 65 2HG2 THR 65 31.680 11.593 -25.774 519 2HG2 THR 65 3HG2 THR 65 30.285 10.809 -25.017 520 3HG2 THR 65 1HG2 THR 65 31.573 11.462 -23.990 521 H GLY 66 H GLY 66 31.172 6.489 -25.851 522 1HA GLY 66 1HA GLY 66 32.083 4.271 -25.966 523 2HA GLY 66 2HA GLY 66 33.483 4.883 -26.821 524 H GLU 67 H GLU 67 32.392 5.953 -23.577 525 HA GLU 67 HA GLU 67 34.853 4.685 -22.304 526 1HB GLU 67 2HB GLU 67 34.646 7.241 -22.432 527 2HB GLU 67 1HB GLU 67 33.238 7.148 -21.376 528 1HG GLU 67 1HG GLU 67 35.169 7.750 -20.043 529 2HG GLU 67 2HG GLU 67 34.642 6.158 -19.540 530 HE2 GLU 67 HE2 GLU 67 37.586 4.569 -20.352 531 H GLU 68 H GLU 68 34.558 3.418 -20.612 532 HA GLU 68 HA GLU 68 31.976 2.166 -20.243 533 1HB GLU 68 1HB GLU 68 32.997 0.658 -18.558 534 2HB GLU 68 2HB GLU 68 33.790 0.701 -20.114 535 1HG GLU 68 1HG GLU 68 35.626 2.150 -19.200 536 2HG GLU 68 2HG GLU 68 34.839 2.187 -17.623 537 HE2 GLU 68 HE2 GLU 68 35.968 -0.901 -16.620 538 H MET 69 H MET 69 30.378 2.480 -18.916 539 HA MET 69 HA MET 69 30.717 3.982 -16.307 540 1HB MET 69 1HB MET 69 29.266 5.744 -16.749 541 2HB MET 69 2HB MET 69 30.215 5.662 -18.207 542 1HG MET 69 1HG MET 69 27.287 4.805 -17.805 543 2HG MET 69 2HG MET 69 27.892 6.118 -18.825 544 1HE MET 69 1HE MET 69 25.827 3.877 -19.445 545 2HE MET 69 3HE MET 69 26.202 4.758 -20.950 546 3HE MET 69 2HE MET 69 26.280 2.970 -20.913 547 H GLU 70 H GLU 70 29.253 3.589 -14.788 548 HA GLU 70 HA GLU 70 27.502 1.213 -14.985 549 1HB GLU 70 2HB GLU 70 27.018 1.428 -12.663 550 2HB GLU 70 1HB GLU 70 28.755 1.508 -12.966 551 1HG GLU 70 1HG GLU 70 28.660 4.043 -12.630 552 2HG GLU 70 2HG GLU 70 26.942 3.918 -12.267 553 HE1 GLU 70 HE2 GLU 70 27.321 2.615 -9.094 554 H ILE 71 H ILE 71 25.486 1.203 -15.735 555 HA ILE 71 HA ILE 71 24.005 3.621 -16.412 556 HB ILE 71 HB ILE 71 23.386 0.621 -16.674 557 1HG1 ILE 71 1HG1 ILE 71 24.029 2.633 -18.935 558 2HG1 ILE 71 2HG1 ILE 71 25.354 1.896 -18.074 559 1HG2 ILE 71 1HG2 ILE 71 21.860 3.015 -17.835 560 2HG2 ILE 71 2HG2 ILE 71 21.617 1.299 -18.286 561 3HG2 ILE 71 3HG2 ILE 71 21.259 1.838 -16.629 562 1HD1 ILE 71 2HD1 ILE 71 23.263 0.242 -19.593 563 2HD1 ILE 71 3HD1 ILE 71 24.880 0.710 -20.177 564 3HD1 ILE 71 1HD1 ILE 71 24.736 -0.364 -18.774 565 HA PRO 72 HA PRO 72 21.884 3.594 -12.292 566 1HB PRO 72 1HB PRO 72 20.078 5.784 -13.422 567 2HB PRO 72 2HB PRO 72 21.107 5.819 -11.981 568 1HG PRO 72 1HG PRO 72 21.838 7.157 -14.239 569 2HG PRO 72 2HG PRO 72 23.071 6.288 -13.290 570 1HD PRO 72 1HD PRO 72 21.650 5.317 -15.845 571 2HD PRO 72 2HD PRO 72 23.389 5.335 -15.429 572 H ALA 73 H ALA 73 19.770 3.675 -11.239 573 HA ALA 73 HA ALA 73 17.803 1.712 -12.478 574 1HB ALA 73 1HB ALA 73 18.765 1.390 -10.045 575 2HB ALA 73 2HB ALA 73 17.901 2.892 -9.587 576 3HB ALA 73 3HB ALA 73 16.998 1.477 -10.106 577 H SER 74 H SER 74 15.556 1.996 -11.449 578 HA SER 74 HA SER 74 14.913 4.617 -10.587 579 1HB SER 74 1HB SER 74 12.796 5.110 -11.970 580 2HB SER 74 2HB SER 74 14.254 5.134 -12.962 581 HG SER 74 HG SER 74 13.785 2.966 -13.555 582 H LYS 75 H LYS 75 13.791 4.475 -8.839 583 HA LYS 75 HA LYS 75 12.801 1.825 -7.936 584 1HB LYS 75 2HB LYS 75 12.242 4.109 -6.112 585 2HB LYS 75 1HB LYS 75 12.718 2.474 -5.810 586 1HG LYS 75 1HG LYS 75 15.077 3.021 -6.649 587 2HG LYS 75 2HG LYS 75 14.580 4.709 -6.765 588 1HD LYS 75 1HD LYS 75 14.047 4.699 -4.261 589 2HD LYS 75 2HD LYS 75 14.555 3.019 -4.190 590 1HE LYS 75 1HE LYS 75 16.413 4.290 -3.377 591 2HE LYS 75 2HE LYS 75 16.894 3.670 -4.952 592 1HZ LYS 75 1HZ LYS 75 17.502 5.962 -4.703 593 2HZ LYS 75 2HZ LYS 75 16.395 5.841 -5.901 594 H VAL 76 H VAL 76 10.646 1.003 -8.210 595 HA VAL 76 HA VAL 76 8.553 2.874 -8.943 596 HB VAL 76 HB VAL 76 9.809 0.354 -9.758 597 1HG1 VAL 76 2HG2 VAL 76 8.275 -0.837 -8.341 598 2HG1 VAL 76 3HG2 VAL 76 6.910 -0.132 -9.243 599 3HG1 VAL 76 1HG2 VAL 76 8.146 -1.194 -10.074 600 1HG2 VAL 76 2HG1 VAL 76 9.276 2.155 -11.206 601 2HG2 VAL 76 3HG1 VAL 76 8.608 0.591 -11.741 602 3HG2 VAL 76 1HG1 VAL 76 7.516 1.823 -10.990 603 HA PRO 77 HA PRO 77 6.906 1.680 -4.829 604 1HB PRO 77 1HB PRO 77 4.662 3.338 -4.731 605 2HB PRO 77 2HB PRO 77 6.288 4.019 -4.827 606 1HG PRO 77 1HG PRO 77 4.303 3.588 -7.095 607 2HG PRO 77 2HG PRO 77 5.270 5.029 -6.771 608 1HD PRO 77 1HD PRO 77 5.929 2.849 -8.629 609 2HD PRO 77 2HD PRO 77 7.113 4.020 -8.019 610 H ALA 78 H ALA 78 5.813 0.334 -3.943 611 HA ALA 78 HA ALA 78 3.305 -0.927 -5.126 612 1HB ALA 78 2HB ALA 78 5.395 -2.017 -6.033 613 2HB ALA 78 3HB ALA 78 5.959 -2.332 -4.380 614 3HB ALA 78 1HB ALA 78 4.489 -3.144 -4.983 615 H PHE 79 H PHE 79 2.414 -2.413 -3.765 616 HA PHE 79 HA PHE 79 2.636 -2.070 -0.700 617 1HB PHE 79 2HB PHE 79 1.248 -0.407 -0.948 618 2HB PHE 79 1HB PHE 79 0.298 -1.216 -2.225 619 HD1 PHE 79 HD1 PHE 79 0.834 -1.090 1.471 620 HD2 PHE 79 HD2 PHE 79 -1.521 -2.778 -1.705 621 HE1 PHE 79 HE1 PHE 79 -0.797 -1.928 3.110 622 HE2 PHE 79 HE2 PHE 79 -3.090 -3.690 -0.049 623 HZ PHE 79 HZ PHE 79 -2.717 -3.303 2.356 624 H LYS 80 H LYS 80 2.578 -3.964 -0.095 625 HA LYS 80 HA LYS 80 1.440 -6.561 -1.431 626 1HB LYS 80 2HB LYS 80 3.193 -6.215 1.027 627 2HB LYS 80 1HB LYS 80 2.393 -7.706 0.619 628 1HG LYS 80 1HG LYS 80 3.605 -7.769 -1.607 629 2HG LYS 80 2HG LYS 80 4.451 -6.277 -1.189 630 1HD LYS 80 1HD LYS 80 5.518 -7.386 0.785 631 2HD LYS 80 2HD LYS 80 4.615 -8.874 0.474 632 1HE LYS 80 1HE LYS 80 5.771 -9.099 -1.785 633 2HE LYS 80 2HE LYS 80 6.683 -7.617 -1.460 634 1HZ LYS 80 1HZ LYS 80 7.927 -9.600 -0.908 635 2HZ LYS 80 2HZ LYS 80 6.787 -10.110 0.148 636 HA PRO 81 HA PRO 81 -1.980 -5.909 1.582 637 1HB PRO 81 1HB PRO 81 -3.476 -8.147 1.014 638 2HB PRO 81 2HB PRO 81 -3.254 -6.853 -0.167 639 1HG PRO 81 1HG PRO 81 -1.678 -9.483 0.020 640 2HG PRO 81 2HG PRO 81 -2.548 -8.848 -1.400 641 1HD PRO 81 1HD PRO 81 0.175 -8.450 -0.966 642 2HD PRO 81 2HD PRO 81 -0.826 -7.229 -1.819 643 H GLY 82 H GLY 82 0.515 -6.704 2.680 644 1HA GLY 82 1HA GLY 82 1.778 -8.197 4.071 645 2HA GLY 82 2HA GLY 82 0.377 -7.861 5.064 646 H LYS 83 H LYS 83 -0.218 -9.846 2.353 647 HA LYS 83 HA LYS 83 -0.861 -12.141 2.096 648 1HB LYS 83 2HB LYS 83 1.084 -12.515 4.370 649 2HB LYS 83 1HB LYS 83 -0.213 -13.642 4.430 650 1HG LYS 83 1HG LYS 83 1.576 -14.677 3.181 651 2HG LYS 83 2HG LYS 83 0.312 -14.334 2.009 652 1HD LYS 83 1HD LYS 83 1.602 -12.227 1.290 653 2HD LYS 83 2HD LYS 83 2.826 -12.600 2.490 654 1HE LYS 83 1HE LYS 83 3.708 -13.337 0.384 655 2HE LYS 83 2HE LYS 83 3.326 -14.802 1.286 656 1HZ LYS 83 1HZ LYS 83 2.589 -14.965 -0.977 657 2HZ LYS 83 2HZ LYS 83 1.281 -14.994 0.002 658 H ALA 84 H ALA 84 -1.215 -10.985 5.208 659 HA ALA 84 HA ALA 84 -3.494 -12.343 6.354 660 1HB ALA 84 2HB ALA 84 -1.719 -11.011 7.523 661 2HB ALA 84 3HB ALA 84 -2.241 -9.530 6.679 662 3HB ALA 84 1HB ALA 84 -3.334 -10.300 7.861 663 H LEU 85 H LEU 85 -3.390 -9.101 4.617 664 HA LEU 85 HA LEU 85 -6.300 -8.755 4.675 665 1HB LEU 85 2HB LEU 85 -4.848 -6.713 4.426 666 2HB LEU 85 1HB LEU 85 -4.143 -7.394 2.978 667 HG LEU 85 HG LEU 85 -6.505 -7.546 2.088 668 1HD1 LEU 85 2HD1 LEU 85 -7.850 -7.097 4.111 669 2HD1 LEU 85 3HD1 LEU 85 -7.105 -5.495 4.278 670 3HD1 LEU 85 1HD1 LEU 85 -8.185 -5.843 2.901 671 1HD2 LEU 85 1HD2 LEU 85 -4.748 -5.875 1.283 672 2HD2 LEU 85 2HD2 LEU 85 -6.387 -5.244 1.140 673 3HD2 LEU 85 3HD2 LEU 85 -5.333 -4.695 2.475 674 H LYS 86 H LYS 86 -3.926 -10.194 2.463 675 HA LYS 86 HA LYS 86 -5.751 -10.850 0.286 676 1HB LYS 86 1HB LYS 86 -3.066 -11.113 0.436 677 2HB LYS 86 2HB LYS 86 -3.448 -12.772 0.827 678 1HG LYS 86 1HG LYS 86 -4.767 -12.975 -1.323 679 2HG LYS 86 2HG LYS 86 -4.489 -11.265 -1.660 680 1HD LYS 86 1HD LYS 86 -1.960 -11.716 -1.703 681 2HD LYS 86 2HD LYS 86 -2.299 -13.420 -1.441 682 1HE LYS 86 1HE LYS 86 -1.908 -13.161 -3.801 683 2HE LYS 86 2HE LYS 86 -3.631 -13.481 -3.628 684 1HZ LYS 86 1HZ LYS 86 -4.043 -11.106 -3.878 685 2HZ LYS 86 2HZ LYS 86 -3.233 -11.701 -5.168 686 H ASP 87 H ASP 87 -5.498 -12.367 3.439 687 HA ASP 87 HA ASP 87 -7.257 -14.664 2.668 688 1HB ASP 87 1HB ASP 87 -5.230 -14.173 4.666 689 2HB ASP 87 2HB ASP 87 -6.686 -14.012 5.566 690 HD1 ASP 87 HD2 ASP 87 -7.474 -17.419 5.417 691 H ALA 88 H ALA 88 -7.501 -11.566 4.438 692 HA ALA 88 HA ALA 88 -10.254 -11.667 5.368 693 1HB ALA 88 1HB ALA 88 -8.591 -9.706 5.816 694 2HB ALA 88 2HB ALA 88 -8.776 -9.211 4.131 695 3HB ALA 88 3HB ALA 88 -10.163 -9.130 5.191 696 H VAL 89 H VAL 89 -8.906 -10.803 2.131 697 HA VAL 89 HA VAL 89 -11.459 -9.769 1.116 698 HB VAL 89 HB VAL 89 -8.944 -8.806 1.407 699 1HG1 VAL 89 2HG2 VAL 89 -7.930 -10.902 0.264 700 2HG1 VAL 89 3HG2 VAL 89 -8.484 -10.217 -1.271 701 3HG1 VAL 89 1HG2 VAL 89 -7.359 -9.303 -0.213 702 1HG2 VAL 89 2HG1 VAL 89 -10.651 -7.627 0.392 703 2HG2 VAL 89 3HG1 VAL 89 -9.061 -7.435 -0.396 704 3HG2 VAL 89 1HG1 VAL 89 -10.331 -8.455 -1.192 705 H LYS 90 H LYS 90 -9.777 -12.780 0.832 706 HA LYS 90 HA LYS 90 -10.080 -13.398 -1.921 707 1HB LYS 90 1HB LYS 90 -9.357 -15.554 -1.373 708 2HB LYS 90 2HB LYS 90 -8.580 -14.458 -0.267 709 1HG LYS 90 1HG LYS 90 -10.240 -15.133 1.548 710 2HG LYS 90 2HG LYS 90 -10.943 -16.311 0.444 711 1HD LYS 90 1HD LYS 90 -8.763 -17.519 0.259 712 2HD LYS 90 2HD LYS 90 -7.964 -16.304 1.259 713 1HE LYS 90 1HE LYS 90 -9.458 -16.902 3.218 714 2HE LYS 90 2HE LYS 90 -10.283 -18.115 2.226 715 1HZ LYS 90 1HZ LYS 90 -8.580 -19.116 3.554 716 2HZ LYS 90 2HZ LYS 90 -8.192 -19.281 1.974 717 1H MET 1 1H MET 91 9.453 -0.211 7.689 718 2H MET 1 2H MET 91 10.567 -1.098 8.584 719 HA MET 1 HA MET 91 9.643 -0.017 10.244 720 1HB MET 1 1HB MET 91 6.995 0.018 8.665 721 2HB MET 1 2HB MET 91 7.164 0.644 10.273 722 1HG MET 1 1HG MET 91 8.843 2.364 9.442 723 2HG MET 1 2HG MET 91 8.598 1.749 7.788 724 1HE MET 1 2HE MET 91 7.593 3.894 6.685 725 2HE MET 1 1HE MET 91 6.331 4.905 7.431 726 3HE MET 1 3HE MET 91 7.953 4.805 8.183 727 H ASN 2 H ASN 92 6.642 -1.554 10.009 728 HA ASN 2 HA ASN 92 6.622 -4.069 10.337 729 1HB ASN 2 1HB ASN 92 6.906 -5.135 12.444 730 2HB ASN 2 2HB ASN 92 8.380 -4.365 11.975 731 1HD2 ASN 2 1HD2 ASN 92 6.653 -3.240 15.495 732 2HD2 ASN 2 2HD2 ASN 92 5.759 -4.201 14.210 733 H LYS 3 H LYS 93 5.630 -1.361 12.025 734 HA LYS 3 HA LYS 93 3.129 -0.759 11.684 735 1HB LYS 3 1HB LYS 93 2.302 -3.166 11.872 736 2HB LYS 3 2HB LYS 93 2.629 -3.140 13.590 737 1HG LYS 3 1HG LYS 93 0.857 -1.317 13.834 738 2HG LYS 3 2HG LYS 93 0.707 -1.223 12.076 739 1HD LYS 3 1HD LYS 93 -0.073 -3.646 12.046 740 2HD LYS 3 2HD LYS 93 0.002 -3.674 13.812 741 1HE LYS 3 1HE LYS 93 -1.725 -1.797 13.898 742 2HE LYS 3 2HE LYS 93 -1.793 -1.794 12.127 743 1HZ LYS 3 1HZ LYS 93 -2.450 -4.122 13.843 744 2HZ LYS 3 2HZ LYS 93 -2.516 -4.109 12.210 745 H THR 4 H THR 94 5.481 -1.408 14.256 746 HA THR 4 HA THR 94 4.318 0.558 16.076 747 HB THR 4 HB THR 94 6.652 -1.476 16.121 748 HG1 THR 4 HG1 THR 94 4.534 -2.391 16.167 749 1HG2 THR 4 3HG2 THR 94 5.422 0.323 18.219 750 2HG2 THR 4 1HG2 THR 94 6.559 -1.067 18.553 751 3HG2 THR 4 2HG2 THR 94 7.102 0.347 17.564 752 H GLU 5 H GLU 95 6.957 0.097 13.757 753 HA GLU 5 HA GLU 95 8.395 2.651 14.486 754 1HB GLU 5 1HB GLU 95 8.606 1.383 11.743 755 2HB GLU 5 2HB GLU 95 9.695 2.510 12.494 756 1HG GLU 5 1HG GLU 95 9.318 -0.461 13.194 757 2HG GLU 5 2HG GLU 95 10.650 0.227 12.305 758 HE1 GLU 5 HE2 GLU 95 12.367 1.464 15.065 759 H LEU 6 H LEU 96 5.539 1.664 12.976 760 HA LEU 6 HA LEU 96 4.841 4.034 11.327 761 1HB LEU 6 2HB LEU 96 3.781 1.385 11.704 762 2HB LEU 6 1HB LEU 96 2.614 2.350 12.562 763 HG LEU 6 HG LEU 96 3.366 2.766 9.674 764 1HD1 LEU 6 3HD1 LEU 96 0.832 1.605 10.926 765 2HD1 LEU 6 1HD1 LEU 96 1.069 1.944 9.196 766 3HD1 LEU 6 2HD1 LEU 96 2.055 0.706 10.002 767 1HD2 LEU 6 1HD2 LEU 96 1.733 4.504 11.517 768 2HD2 LEU 6 2HD2 LEU 96 2.800 4.945 10.180 769 3HD2 LEU 6 3HD2 LEU 96 1.186 4.276 9.852 770 H ILE 7 H ILE 97 4.029 2.787 14.618 771 HA ILE 7 HA ILE 97 2.329 4.971 15.458 772 HB ILE 7 HB ILE 97 4.031 3.181 17.296 773 1HG1 ILE 7 1HG1 ILE 97 1.136 2.689 16.379 774 2HG1 ILE 7 2HG1 ILE 97 2.475 1.945 15.609 775 1HG2 ILE 7 2HG2 ILE 97 3.068 5.108 18.558 776 2HG2 ILE 7 3HG2 ILE 97 1.464 4.734 17.927 777 3HG2 ILE 7 1HG2 ILE 97 2.260 3.602 19.014 778 1HD1 ILE 7 3HD1 ILE 97 3.220 0.876 17.804 779 2HD1 ILE 7 1HD1 ILE 97 1.666 1.360 18.463 780 3HD1 ILE 7 2HD1 ILE 97 1.727 0.274 17.044 781 H ASN 8 H ASN 98 5.790 4.425 16.076 782 HA ASN 8 HA ASN 98 6.183 7.095 17.317 783 1HB ASN 8 1HB ASN 98 8.332 5.212 16.107 784 2HB ASN 8 2HB ASN 98 8.687 6.649 17.038 785 1HD2 ASN 8 2HD2 ASN 98 7.993 3.265 19.126 786 2HD2 ASN 8 1HD2 ASN 98 8.120 3.331 17.296 787 H ALA 9 H ALA 99 5.823 6.299 13.990 788 HA ALA 9 HA ALA 99 7.224 8.732 12.905 789 1HB ALA 9 3HB ALA 99 6.498 6.601 11.406 790 2HB ALA 9 1HB ALA 99 4.830 7.117 11.651 791 3HB ALA 9 2HB ALA 99 5.883 8.190 10.796 792 H VAL 10 H VAL 100 3.873 7.767 13.786 793 HA VAL 10 HA VAL 100 2.704 10.141 12.808 794 HB VAL 10 HB VAL 100 1.261 8.402 14.819 795 1HG1 VAL 10 3HG2 VAL 100 0.306 10.481 13.387 796 2HG1 VAL 10 1HG2 VAL 100 -0.010 9.152 12.229 797 3HG1 VAL 10 2HG2 VAL 100 -0.668 9.053 13.867 798 1HG2 VAL 10 1HG1 VAL 100 2.161 7.563 12.061 799 2HG2 VAL 10 2HG1 VAL 100 2.247 6.775 13.671 800 3HG2 VAL 10 3HG1 VAL 100 0.669 6.857 12.835 801 H ALA 11 H ALA 101 3.247 8.849 15.909 802 HA ALA 11 HA ALA 101 2.507 11.233 17.211 803 1HB ALA 11 2HB ALA 101 2.493 8.942 18.359 804 2HB ALA 11 3HB ALA 101 4.264 8.869 18.275 805 3HB ALA 11 1HB ALA 101 3.462 10.047 19.358 806 H GLU 12 H GLU 102 5.579 10.475 15.770 807 HA GLU 12 HA GLU 102 6.920 12.783 17.158 808 1HB GLU 12 1HB GLU 102 8.305 10.773 16.523 809 2HB GLU 12 2HB GLU 102 7.930 11.043 14.829 810 1HG GLU 12 1HG GLU 102 10.168 11.835 15.240 811 2HG GLU 12 2HG GLU 102 9.176 13.233 14.883 812 HE1 GLU 12 HE2 GLU 102 10.893 12.693 18.515 813 H THR 13 H THR 103 5.625 12.096 13.827 814 HA THR 13 HA THR 103 5.980 15.039 13.259 815 HB THR 13 HB THR 103 6.672 13.061 11.766 816 HG1 THR 13 HG1 THR 103 6.538 14.485 10.014 817 1HG2 THR 13 2HG2 THR 103 4.470 12.012 11.342 818 2HG2 THR 13 3HG2 THR 103 3.916 13.499 10.533 819 3HG2 THR 13 1HG2 THR 103 5.267 12.555 9.849 820 H SER 14 H SER 104 3.772 13.756 14.719 821 HA SER 14 HA SER 104 1.705 15.924 13.899 822 1HB SER 14 1HB SER 104 0.788 13.207 15.007 823 2HB SER 14 2HB SER 104 -0.217 14.523 14.418 824 HG SER 14 HG SER 104 0.089 12.902 12.888 825 H GLY 15 H GLY 105 3.132 14.247 16.734 826 1HA GLY 15 1HA GLY 105 3.024 14.781 19.031 827 2HA GLY 15 2HA GLY 105 2.476 16.396 18.587 828 H LEU 16 H LEU 106 1.141 13.158 18.371 829 HA LEU 16 HA LEU 106 -1.324 13.795 20.023 830 1HB LEU 16 1HB LEU 106 -2.414 11.956 18.955 831 2HB LEU 16 2HB LEU 106 -2.095 13.361 17.959 832 HG LEU 16 HG LEU 106 -0.347 12.394 16.838 833 1HD1 LEU 16 2HD1 LEU 106 0.756 11.063 18.677 834 2HD1 LEU 16 3HD1 LEU 106 -0.574 9.876 18.460 835 3HD1 LEU 16 1HD1 LEU 106 0.636 10.202 17.140 836 1HD2 LEU 16 2HD2 LEU 106 -2.063 12.009 15.582 837 2HD2 LEU 16 3HD2 LEU 106 -0.663 10.924 15.382 838 3HD2 LEU 16 1HD2 LEU 106 -2.096 10.314 16.190 839 H SER 17 H SER 107 -0.945 10.869 20.096 840 HA SER 17 HA SER 107 0.932 10.559 22.480 841 1HB SER 17 1HB SER 107 -1.774 9.170 22.602 842 2HB SER 17 2HB SER 107 -0.479 9.133 23.769 843 HG SER 17 HG SER 107 -2.085 10.601 24.355 844 H LYS 18 H LYS 108 1.725 8.473 22.738 845 HA LYS 18 HA LYS 108 2.250 6.880 20.233 846 1HB LYS 18 1HB LYS 108 3.830 7.301 22.340 847 2HB LYS 18 2HB LYS 108 2.953 6.006 23.115 848 1HG LYS 18 1HG LYS 108 4.396 5.758 20.380 849 2HG LYS 18 2HG LYS 108 5.217 5.547 21.916 850 1HD LYS 18 1HD LYS 108 3.747 3.656 22.545 851 2HD LYS 18 2HD LYS 108 2.815 3.845 21.067 852 1HE LYS 18 1HE LYS 108 4.936 3.359 19.694 853 2HE LYS 18 2HE LYS 108 5.823 3.105 21.202 854 1HZ LYS 18 1HZ LYS 108 4.255 1.318 21.738 855 2HZ LYS 18 2HZ LYS 108 3.439 1.558 20.341 856 H LYS 19 H LYS 109 0.247 6.380 23.120 857 HA LYS 19 HA LYS 109 -1.183 3.995 22.097 858 1HB LYS 19 2HB LYS 109 -2.118 6.090 24.142 859 2HB LYS 19 1HB LYS 109 -3.027 4.633 23.763 860 1HG LYS 19 1HG LYS 109 -0.236 4.752 25.045 861 2HG LYS 19 2HG LYS 109 -1.743 4.421 25.867 862 1HD LYS 19 1HD LYS 109 -0.404 2.601 23.768 863 2HD LYS 19 2HD LYS 109 -0.370 2.385 25.510 864 1HE LYS 19 1HE LYS 109 -2.897 2.068 25.539 865 2HE LYS 19 2HE LYS 109 -2.935 2.252 23.779 866 1HZ LYS 19 1HZ LYS 109 -1.471 0.144 25.265 867 2HZ LYS 19 2HZ LYS 109 -2.879 -0.052 24.458 868 H ASP 20 H ASP 110 -1.788 7.553 21.583 869 HA ASP 20 HA ASP 110 -4.344 7.013 20.084 870 1HB ASP 20 1HB ASP 110 -2.649 9.543 20.492 871 2HB ASP 20 2HB ASP 110 -3.817 9.521 19.205 872 HD2 ASP 20 HD2 ASP 110 -5.036 9.925 22.975 873 H ALA 21 H ALA 111 -0.967 7.224 19.158 874 HA ALA 21 HA ALA 111 -1.452 7.237 16.224 875 1HB ALA 21 1HB ALA 111 1.063 6.900 17.960 876 2HB ALA 21 2HB ALA 111 1.080 6.689 16.186 877 3HB ALA 21 3HB ALA 111 0.585 8.204 16.894 878 H THR 22 H THR 112 -0.760 4.618 18.631 879 HA THR 22 HA THR 112 -0.801 2.359 16.864 880 HB THR 22 HB THR 112 -2.075 2.368 19.677 881 HG1 THR 22 HG1 THR 112 -0.015 2.061 20.474 882 1HG2 THR 22 2HG2 THR 112 -0.359 0.349 18.107 883 2HG2 THR 22 3HG2 THR 112 -0.859 0.150 19.808 884 3HG2 THR 22 1HG2 THR 112 -2.088 0.189 18.495 885 H LYS 23 H LYS 113 -3.480 3.879 18.474 886 HA LYS 23 HA LYS 113 -5.711 2.356 17.295 887 1HB LYS 23 2HB LYS 113 -5.427 5.316 18.271 888 2HB LYS 23 1HB LYS 113 -6.964 4.679 17.804 889 1HG LYS 23 1HG LYS 113 -6.895 2.954 19.663 890 2HG LYS 23 2HG LYS 113 -5.313 3.556 20.154 891 1HD LYS 23 1HD LYS 113 -6.381 5.884 20.537 892 2HD LYS 23 2HD LYS 113 -7.937 5.178 20.137 893 1HE LYS 23 1HE LYS 113 -7.836 5.254 22.533 894 2HE LYS 23 2HE LYS 113 -7.684 3.551 22.105 895 1HZ LYS 23 1HZ LYS 113 -5.265 3.786 22.389 896 2HZ LYS 23 2HZ LYS 113 -5.424 5.366 22.778 897 H ALA 24 H ALA 114 -4.487 5.510 16.432 898 HA ALA 24 HA ALA 114 -6.066 6.088 14.151 899 1HB ALA 24 2HB ALA 114 -4.779 7.717 15.380 900 2HB ALA 24 3HB ALA 114 -3.238 6.991 14.816 901 3HB ALA 24 1HB ALA 114 -4.346 7.793 13.650 902 H VAL 25 H VAL 115 -3.033 4.311 14.176 903 HA VAL 25 HA VAL 115 -2.822 3.744 11.253 904 HB VAL 25 HB VAL 115 -1.870 2.627 14.046 905 1HG1 VAL 25 2HG2 VAL 115 -1.407 1.061 11.442 906 2HG1 VAL 25 3HG2 VAL 115 -0.494 0.818 12.974 907 3HG1 VAL 25 1HG2 VAL 115 -2.224 0.509 12.908 908 1HG2 VAL 25 3HG1 VAL 115 -0.333 3.643 11.621 909 2HG2 VAL 25 1HG1 VAL 115 -0.683 4.561 13.103 910 3HG2 VAL 25 2HG1 VAL 115 0.383 3.148 13.199 911 H ASP 26 H ASP 116 -4.140 1.701 13.955 912 HA ASP 26 HA ASP 116 -5.814 0.167 11.930 913 1HB ASP 26 1HB ASP 116 -4.714 -0.748 14.120 914 2HB ASP 26 2HB ASP 116 -6.011 0.071 14.995 915 HD2 ASP 26 HD2 ASP 116 -8.206 -2.535 14.518 916 H ALA 27 H ALA 117 -6.186 2.896 12.425 917 HA ALA 27 HA ALA 117 -9.211 3.099 12.361 918 1HB ALA 27 2HB ALA 117 -7.652 4.572 14.045 919 2HB ALA 27 3HB ALA 117 -7.507 5.563 12.609 920 3HB ALA 27 1HB ALA 117 -9.085 5.227 13.359 921 H VAL 28 H VAL 118 -6.351 4.303 10.677 922 HA VAL 28 HA VAL 118 -7.674 4.963 8.113 923 HB VAL 28 HB VAL 118 -4.729 4.107 8.713 924 1HG1 VAL 28 1HG2 VAL 118 -5.879 5.381 6.149 925 2HG1 VAL 28 2HG2 VAL 118 -4.144 5.247 6.539 926 3HG1 VAL 28 3HG2 VAL 118 -5.080 3.771 6.336 927 1HG2 VAL 28 1HG1 VAL 118 -5.357 6.183 9.755 928 2HG2 VAL 28 2HG1 VAL 118 -4.112 6.346 8.466 929 3HG2 VAL 28 3HG1 VAL 118 -5.845 6.830 8.127 930 H PHE 29 H PHE 119 -5.566 2.413 9.023 931 HA PHE 29 HA PHE 119 -6.072 0.563 6.758 932 1HB PHE 29 2HB PHE 119 -4.592 -0.136 9.329 933 2HB PHE 29 1HB PHE 119 -4.520 -1.023 7.812 934 HD1 PHE 29 HD1 PHE 119 -4.000 0.614 5.628 935 HD2 PHE 29 HD2 PHE 119 -2.709 1.307 9.662 936 HE1 PHE 29 HE1 PHE 119 -2.447 2.326 4.834 937 HE2 PHE 29 HE2 PHE 119 -1.231 3.088 8.877 938 HZ PHE 29 HZ PHE 119 -1.173 3.652 6.458 939 H ASP 30 H ASP 120 -7.849 0.827 9.748 940 HA ASP 30 HA ASP 120 -9.051 -1.897 9.377 941 1HB ASP 30 1HB ASP 120 -8.753 -0.525 11.617 942 2HB ASP 30 2HB ASP 120 -10.209 0.328 11.179 943 HD2 ASP 30 HD2 ASP 120 -10.314 -3.433 12.604 944 H SER 31 H SER 121 -9.861 1.354 8.698 945 HA SER 31 HA SER 121 -12.611 0.845 7.536 946 1HB SER 31 2HB SER 121 -10.874 3.374 7.345 947 2HB SER 31 1HB SER 121 -12.518 3.213 6.689 948 HG SER 31 HG SER 121 -12.487 4.083 8.775 949 H ILE 32 H ILE 122 -9.231 1.193 6.026 950 HA ILE 32 HA ILE 122 -9.940 0.850 3.336 951 HB ILE 32 HB ILE 122 -7.418 -0.269 4.563 952 1HG1 ILE 32 1HG1 ILE 122 -8.418 2.556 4.479 953 2HG1 ILE 32 2HG1 ILE 122 -7.521 1.600 5.638 954 1HG2 ILE 32 1HG2 ILE 122 -8.238 -0.436 1.983 955 2HG2 ILE 32 2HG2 ILE 122 -7.840 1.277 1.976 956 3HG2 ILE 32 3HG2 ILE 122 -6.568 0.090 2.315 957 1HD1 ILE 32 2HD1 ILE 122 -6.198 2.678 3.166 958 2HD1 ILE 32 3HD1 ILE 122 -6.417 3.573 4.698 959 3HD1 ILE 32 1HD1 ILE 122 -5.466 2.044 4.709 960 H THR 33 H THR 123 -8.933 -1.626 5.676 961 HA THR 33 HA THR 123 -9.503 -3.868 3.816 962 HB THR 33 HB THR 123 -8.126 -4.336 5.813 963 HG1 THR 33 HG1 THR 123 -10.542 -5.747 6.039 964 1HG2 THR 33 2HG2 THR 123 -9.288 -2.744 7.393 965 2HG2 THR 33 3HG2 THR 123 -10.527 -3.951 7.678 966 3HG2 THR 33 1HG2 THR 123 -8.809 -4.273 8.130 967 H GLU 34 H GLU 124 -11.708 -2.099 5.933 968 HA GLU 34 HA GLU 124 -14.015 -3.928 5.353 969 1HB GLU 34 1HB GLU 124 -13.932 -2.379 7.409 970 2HB GLU 34 2HB GLU 124 -14.070 -0.988 6.340 971 1HG GLU 34 1HG GLU 124 -16.351 -1.877 5.555 972 2HG GLU 34 2HG GLU 124 -16.170 -3.244 6.649 973 HE1 GLU 34 HE2 GLU 124 -17.134 0.454 7.977 974 H ALA 35 H ALA 125 -12.600 -1.058 3.771 975 HA ALA 35 HA ALA 125 -14.614 -0.900 1.655 976 1HB ALA 35 2HB ALA 125 -12.668 0.976 2.027 977 2HB ALA 35 3HB ALA 125 -11.579 -0.183 1.285 978 3HB ALA 35 1HB ALA 125 -12.864 0.489 0.338 979 H LEU 36 H LEU 126 -11.396 -2.503 1.696 980 HA LEU 36 HA LEU 126 -11.538 -3.762 -0.903 981 1HB LEU 36 2HB LEU 126 -9.917 -4.667 1.402 982 2HB LEU 36 1HB LEU 126 -9.582 -4.862 -0.308 983 HG LEU 36 HG LEU 126 -9.471 -2.164 1.152 984 1HD1 LEU 36 1HD2 LEU 126 -7.380 -3.508 -0.545 985 2HD1 LEU 36 2HD2 LEU 126 -7.286 -1.884 0.219 986 3HD1 LEU 36 3HD2 LEU 126 -7.413 -3.315 1.270 987 1HD2 LEU 36 2HD1 LEU 126 -9.360 -2.523 -1.877 988 2HD2 LEU 36 3HD1 LEU 126 -10.650 -1.685 -0.959 989 3HD2 LEU 36 1HD1 LEU 126 -9.035 -1.006 -0.959 990 NH1 ARG 37 NH2 ARG 127 -12.587 -10.579 6.780 991 NH2 ARG 37 NH1 ARG 127 -14.540 -11.701 7.070 992 H ARG 37 H ARG 127 -12.192 -5.113 2.380 993 HA ARG 37 HA ARG 127 -12.912 -7.664 1.382 994 1HB ARG 37 1HB ARG 127 -12.286 -7.177 3.778 995 2HB ARG 37 2HB ARG 127 -13.775 -6.250 3.984 996 1HG ARG 37 1HG ARG 127 -15.070 -8.476 3.597 997 2HG ARG 37 2HG ARG 127 -13.505 -9.286 3.630 998 1HD ARG 37 1HD ARG 127 -13.117 -8.117 5.957 999 2HD ARG 37 2HD ARG 127 -14.770 -7.543 5.845 1000 1HH1 ARG 37 2HH2 ARG 127 -12.117 -9.734 6.437 1001 2HH1 ARG 37 1HH2 ARG 127 -12.145 -11.393 7.221 1002 1HH2 ARG 37 1HH1 ARG 127 -15.559 -11.717 6.950 1003 2HH2 ARG 37 2HH1 ARG 127 -13.959 -12.435 7.491 1004 H LYS 38 H LYS 128 -14.807 -4.649 1.473 1005 HA LYS 38 HA LYS 128 -17.442 -6.203 1.229 1006 1HB LYS 38 1HB LYS 128 -17.119 -4.474 3.093 1007 2HB LYS 38 2HB LYS 128 -17.091 -3.227 1.847 1008 1HG LYS 38 1HG LYS 128 -19.475 -3.758 1.266 1009 2HG LYS 38 2HG LYS 128 -19.439 -5.165 2.320 1010 1HD LYS 38 1HD LYS 128 -20.618 -3.416 3.473 1011 2HD LYS 38 2HD LYS 128 -19.104 -3.688 4.327 1012 1HE LYS 38 1HE LYS 128 -18.112 -1.614 3.198 1013 2HE LYS 38 2HE LYS 128 -19.641 -1.362 2.343 1014 1HZ LYS 38 1HZ LYS 128 -19.268 -1.357 5.288 1015 2HZ LYS 38 2HZ LYS 128 -19.463 -0.037 4.345 1016 H GLY 39 H GLY 129 -15.281 -5.358 -0.983 1017 1HA GLY 39 1HA GLY 129 -15.415 -4.770 -3.327 1018 2HA GLY 39 2HA GLY 129 -17.155 -4.946 -3.234 1019 H ASP 40 H ASP 130 -14.989 -2.756 -1.534 1020 HA ASP 40 HA ASP 130 -16.197 -0.257 -2.807 1021 1HB ASP 40 1HB ASP 130 -15.920 -0.935 0.116 1022 2HB ASP 40 2HB ASP 130 -15.931 0.739 -0.404 1023 HD2 ASP 40 HD2 ASP 130 -19.263 -1.472 -0.244 1024 H LYS 41 H LYS 131 -15.135 1.460 -3.125 1025 HA LYS 41 HA LYS 131 -12.124 1.205 -3.325 1026 1HB LYS 41 2HB LYS 131 -13.814 3.530 -4.381 1027 2HB LYS 41 1HB LYS 131 -12.120 3.190 -4.734 1028 1HG LYS 41 1HG LYS 131 -12.929 0.977 -5.843 1029 2HG LYS 41 2HG LYS 131 -14.569 1.585 -5.676 1030 1HD LYS 41 1HD LYS 131 -13.962 3.626 -7.061 1031 2HD LYS 41 2HD LYS 131 -12.303 3.055 -7.165 1032 1HE LYS 41 1HE LYS 131 -13.330 2.490 -9.257 1033 2HE LYS 41 2HE LYS 131 -13.082 0.970 -8.402 1034 1HZ LYS 41 1HZ LYS 131 -15.437 1.062 -7.737 1035 2HZ LYS 41 2HZ LYS 131 -15.647 2.471 -8.538 1036 H VAL 42 H VAL 132 -10.760 2.360 -1.983 1037 HA VAL 42 HA VAL 132 -11.598 4.130 0.087 1038 HB VAL 42 HB VAL 132 -8.918 3.124 -1.013 1039 1HG1 VAL 42 1HG2 VAL 132 -8.848 4.785 0.957 1040 2HG1 VAL 42 2HG2 VAL 132 -9.717 3.554 1.899 1041 3HG1 VAL 42 3HG2 VAL 132 -8.107 3.187 1.216 1042 1HG2 VAL 42 3HG1 VAL 132 -10.591 1.136 -0.470 1043 2HG2 VAL 42 1HG1 VAL 132 -9.095 1.134 0.417 1044 3HG2 VAL 42 2HG1 VAL 132 -10.565 1.730 1.210 1045 H GLN 43 H GLN 133 -9.080 5.472 -0.442 1046 HA GLN 43 HA GLN 133 -8.226 6.668 -2.184 1047 1HB GLN 43 1HB GLN 133 -10.708 8.135 -2.785 1048 2HB GLN 43 2HB GLN 133 -9.153 8.899 -3.151 1049 1HG GLN 43 1HG GLN 133 -8.402 7.002 -4.427 1050 2HG GLN 43 2HG GLN 133 -9.783 6.034 -4.044 1051 1HE2 GLN 43 2HE2 GLN 133 -11.293 7.160 -7.096 1052 2HE2 GLN 43 1HE2 GLN 133 -10.802 5.799 -5.971 1053 H LEU 44 H LEU 134 -6.803 8.280 -2.326 1054 HA LEU 44 HA LEU 134 -6.374 9.972 0.140 1055 1HB LEU 44 2HB LEU 134 -4.210 7.982 -0.765 1056 2HB LEU 44 1HB LEU 134 -3.986 9.218 0.450 1057 HG LEU 44 HG LEU 134 -6.017 6.927 0.802 1058 1HD1 LEU 44 2HD1 LEU 134 -3.044 6.918 1.597 1059 2HD1 LEU 44 3HD1 LEU 134 -4.260 5.714 2.094 1060 3HD1 LEU 44 1HD1 LEU 134 -3.828 5.880 0.382 1061 1HD2 LEU 44 2HD2 LEU 134 -6.306 8.865 2.383 1062 2HD2 LEU 44 3HD2 LEU 134 -5.746 7.417 3.241 1063 3HD2 LEU 44 1HD2 LEU 134 -4.602 8.734 2.881 1064 H ILE 45 H ILE 135 -6.052 11.911 -0.920 1065 HA ILE 45 HA ILE 135 -5.080 11.962 -3.714 1066 HB ILE 45 HB ILE 135 -6.934 13.425 -2.932 1067 1HG1 ILE 45 1HG1 ILE 135 -6.277 15.476 -4.228 1068 2HG1 ILE 45 2HG1 ILE 135 -4.624 14.898 -4.332 1069 1HG2 ILE 45 3HG2 ILE 135 -5.975 14.212 -0.787 1070 2HG2 ILE 45 1HG2 ILE 135 -4.729 15.144 -1.660 1071 3HG2 ILE 45 2HG2 ILE 135 -6.457 15.578 -1.825 1072 1HD1 ILE 45 3HD1 ILE 135 -7.098 13.434 -5.500 1073 2HD1 ILE 45 1HD1 ILE 135 -5.967 14.456 -6.419 1074 3HD1 ILE 45 2HD1 ILE 135 -5.401 12.926 -5.720 1075 H GLY 46 H GLY 136 -3.267 12.983 -4.458 1076 1HA GLY 46 1HA GLY 136 -0.895 13.260 -4.591 1077 2HA GLY 46 2HA GLY 136 -0.944 13.802 -2.935 1078 H PHE 47 H PHE 137 -1.988 10.589 -2.883 1079 HA PHE 47 HA PHE 137 0.746 9.338 -2.777 1080 1HB PHE 47 2HB PHE 137 -0.166 10.363 -0.580 1081 2HB PHE 47 1HB PHE 137 -1.420 9.155 -0.551 1082 HD1 PHE 47 HD1 PHE 137 2.294 9.638 -0.275 1083 HD2 PHE 47 HD2 PHE 137 -0.886 6.733 -0.183 1084 HE1 PHE 47 HE1 PHE 137 3.890 7.848 0.341 1085 HE2 PHE 47 HE2 PHE 137 0.750 4.982 0.354 1086 HZ PHE 47 HZ PHE 137 3.161 5.544 0.465 1087 H GLY 48 H GLY 138 -2.843 8.566 -2.881 1088 1HA GLY 48 1HA GLY 138 -2.377 6.235 -4.392 1089 2HA GLY 48 2HA GLY 138 -2.385 5.657 -2.740 1090 H ASN 49 H ASN 139 -3.960 4.946 -4.965 1091 HA ASN 49 HA ASN 139 -6.786 5.481 -3.860 1092 1HB ASN 49 1HB ASN 139 -6.126 4.926 -6.819 1093 2HB ASN 49 2HB ASN 139 -7.702 5.193 -6.119 1094 1HD2 ASN 49 1HD2 ASN 139 -6.901 8.351 -7.806 1095 2HD2 ASN 49 2HD2 ASN 139 -7.228 6.592 -8.211 1096 H PHE 50 H PHE 140 -7.027 3.644 -2.636 1097 HA PHE 50 HA PHE 140 -6.084 0.972 -3.694 1098 1HB PHE 50 2HB PHE 140 -7.687 1.375 -1.141 1099 2HB PHE 50 1HB PHE 140 -7.103 -0.147 -1.690 1100 HD1 PHE 50 HD1 PHE 140 -6.166 3.208 -0.454 1101 HD2 PHE 50 HD2 PHE 140 -5.184 -0.961 -0.640 1102 HE1 PHE 50 HE1 PHE 140 -4.416 3.528 1.291 1103 HE2 PHE 50 HE2 PHE 140 -3.464 -0.611 1.117 1104 HZ PHE 50 HZ PHE 140 -3.013 1.660 1.918 1105 H GLU 51 H GLU 141 -7.399 -0.607 -4.309 1106 HA GLU 51 HA GLU 141 -10.213 -0.700 -3.802 1107 1HB GLU 51 1HB GLU 141 -11.219 -0.451 -6.101 1108 2HB GLU 51 2HB GLU 141 -10.512 1.056 -5.596 1109 1HG GLU 51 1HG GLU 141 -9.203 -0.907 -7.599 1110 2HG GLU 51 2HG GLU 141 -10.211 0.454 -8.041 1111 HE2 GLU 51 HE2 GLU 141 -6.342 0.965 -7.287 1112 H VAL 52 H VAL 142 -11.352 -2.618 -4.489 1113 HA VAL 52 HA VAL 142 -9.406 -4.784 -4.835 1114 HB VAL 52 HB VAL 142 -11.520 -4.138 -3.051 1115 1HG1 VAL 52 1HG2 VAL 142 -12.686 -6.105 -5.031 1116 2HG1 VAL 52 2HG2 VAL 142 -13.271 -5.775 -3.359 1117 3HG1 VAL 52 3HG2 VAL 142 -13.260 -4.484 -4.606 1118 1HG2 VAL 52 1HG1 VAL 142 -10.221 -6.827 -3.535 1119 2HG2 VAL 52 2HG1 VAL 142 -9.682 -5.492 -2.473 1120 3HG2 VAL 52 3HG1 VAL 142 -11.178 -6.349 -2.126 1121 NH1 ARG 53 NH2 ARG 143 -5.663 -6.558 -12.565 1122 NH2 ARG 53 NH1 ARG 143 -5.814 -4.360 -12.002 1123 H ARG 53 H ARG 143 -9.891 -6.624 -6.223 1124 HA ARG 53 HA ARG 143 -11.418 -5.847 -8.806 1125 1HB ARG 53 1HB ARG 143 -8.831 -5.748 -8.940 1126 2HB ARG 53 2HB ARG 143 -8.851 -7.491 -8.729 1127 1HG ARG 53 1HG ARG 143 -10.214 -7.815 -10.764 1128 2HG ARG 53 2HG ARG 143 -10.286 -6.078 -11.042 1129 1HD ARG 53 1HD ARG 143 -7.702 -7.784 -10.990 1130 2HD ARG 53 2HD ARG 143 -8.575 -7.320 -12.453 1131 1HH1 ARG 53 2HH2 ARG 143 -6.109 -7.482 -12.570 1132 2HH1 ARG 53 1HH2 ARG 143 -4.737 -6.321 -12.936 1133 1HH2 ARG 53 1HH1 ARG 143 -6.370 -3.609 -11.578 1134 2HH2 ARG 53 2HH1 ARG 143 -4.878 -4.275 -12.412 1135 H GLU 54 H GLU 144 -13.255 -6.962 -8.361 1136 HA GLU 54 HA GLU 144 -13.396 -9.711 -7.300 1137 1HB GLU 54 1HB GLU 144 -15.184 -7.959 -7.082 1138 2HB GLU 54 2HB GLU 144 -15.518 -8.069 -8.808 1139 1HG GLU 54 1HG GLU 144 -16.157 -10.527 -8.478 1140 2HG GLU 54 2HG GLU 144 -15.830 -10.360 -6.753 1141 HE1 GLU 54 HE2 GLU 144 -19.181 -8.872 -8.456 1142 NH1 ARG 55 NH2 ARG 145 -12.555 -13.956 -15.819 1143 NH2 ARG 55 NH1 ARG 145 -10.526 -14.939 -16.111 1144 H ARG 55 H ARG 145 -12.280 -11.183 -8.435 1145 HA ARG 55 HA ARG 145 -13.086 -12.017 -11.185 1146 1HB ARG 55 1HB ARG 145 -11.715 -10.129 -11.886 1147 2HB ARG 55 2HB ARG 145 -10.414 -10.560 -10.795 1148 1HG ARG 55 1HG ARG 145 -9.657 -11.176 -12.937 1149 2HG ARG 55 2HG ARG 145 -9.976 -12.663 -12.088 1150 1HD ARG 55 1HD ARG 145 -12.314 -12.716 -13.305 1151 2HD ARG 55 2HD ARG 145 -11.697 -11.416 -14.338 1152 1HH1 ARG 55 2HH2 ARG 145 -13.112 -13.256 -15.317 1153 2HH1 ARG 55 1HH2 ARG 145 -12.883 -14.591 -16.555 1154 1HH2 ARG 55 1HH1 ARG 145 -9.540 -14.992 -15.833 1155 2HH2 ARG 55 2HH1 ARG 145 -10.994 -15.508 -16.824 1156 H ALA 56 H ALA 146 -13.118 -14.192 -10.448 1157 HA ALA 56 HA ALA 146 -10.629 -15.576 -11.232 1158 1HB ALA 56 1HB ALA 146 -12.082 -16.054 -8.559 1159 2HB ALA 56 2HB ALA 146 -10.897 -17.182 -9.257 1160 3HB ALA 56 3HB ALA 146 -10.395 -15.543 -8.781 1161 H ALA 57 H ALA 147 -13.039 -15.054 -12.618 1162 HA ALA 57 HA ALA 147 -14.762 -17.503 -12.590 1163 1HB ALA 57 1HB ALA 147 -15.820 -15.350 -12.912 1164 2HB ALA 57 2HB ALA 147 -14.948 -15.114 -14.453 1165 3HB ALA 57 3HB ALA 147 -16.127 -16.445 -14.268 1166 NH1 ARG 58 NH2 ARG 148 -8.949 -18.923 -10.547 1167 NH2 ARG 58 NH1 ARG 148 -7.640 -17.144 -11.080 1168 H ARG 58 H ARG 148 -13.818 -19.207 -12.986 1169 HA ARG 58 HA ARG 148 -12.857 -19.600 -15.777 1170 1HB ARG 58 2HB ARG 148 -11.470 -21.120 -13.494 1171 2HB ARG 58 1HB ARG 148 -10.865 -20.861 -15.129 1172 1HG ARG 58 1HG ARG 148 -10.553 -18.374 -14.467 1173 2HG ARG 58 2HG ARG 148 -11.030 -18.840 -12.829 1174 1HD ARG 58 1HD ARG 148 -9.076 -20.505 -12.757 1175 2HD ARG 58 2HD ARG 148 -8.568 -19.916 -14.335 1176 1HH1 ARG 58 2HH2 ARG 148 -9.477 -19.739 -10.876 1177 2HH1 ARG 58 1HH2 ARG 148 -8.850 -18.606 -9.576 1178 1HH2 ARG 58 1HH1 ARG 148 -7.169 -16.601 -11.813 1179 2HH2 ARG 58 2HH1 ARG 148 -7.634 -16.951 -10.072 1180 H LYS 59 H LYS 149 -12.348 -22.226 -15.912 1181 HA LYS 59 HA LYS 149 -14.570 -23.830 -14.674 1182 1HB LYS 59 1HB LYS 149 -15.565 -22.890 -16.806 1183 2HB LYS 59 2HB LYS 149 -14.357 -23.753 -17.750 1184 1HG LYS 59 1HG LYS 149 -15.230 -25.946 -16.927 1185 2HG LYS 59 2HG LYS 149 -16.302 -25.139 -15.781 1186 1HD LYS 59 1HD LYS 149 -17.542 -24.040 -17.673 1187 2HD LYS 59 2HD LYS 149 -16.516 -24.834 -18.854 1188 1HE LYS 59 1HE LYS 149 -18.292 -26.359 -16.814 1189 2HE LYS 59 2HE LYS 149 -18.839 -25.877 -18.418 1190 1HZ LYS 59 1HZ LYS 149 -16.526 -27.654 -17.907 1191 2HZ LYS 59 2HZ LYS 149 -17.044 -27.187 -19.385 1192 H GLY 60 H GLY 150 -13.243 -25.158 -13.661 1193 1HA GLY 60 1HA GLY 150 -10.597 -26.069 -14.955 1194 2HA GLY 60 2HA GLY 150 -10.848 -25.874 -13.240 1195 NH1 ARG 61 NH2 ARG 151 -8.833 -35.195 -15.818 1196 NH2 ARG 61 NH1 ARG 151 -10.640 -36.511 -15.399 1197 H ARG 61 H ARG 151 -11.058 -27.748 -12.224 1198 HA ARG 61 HA ARG 151 -12.790 -29.954 -13.204 1199 1HB ARG 61 1HB ARG 151 -10.528 -30.243 -14.467 1200 2HB ARG 61 2HB ARG 151 -9.793 -30.644 -12.923 1201 1HG ARG 61 1HG ARG 151 -11.405 -32.602 -12.700 1202 2HG ARG 61 2HG ARG 151 -12.193 -32.125 -14.206 1203 1HD ARG 61 1HD ARG 151 -10.005 -32.500 -15.458 1204 2HD ARG 61 2HD ARG 151 -9.238 -33.003 -13.937 1205 1HH1 ARG 61 2HH2 ARG 151 -8.397 -34.271 -15.727 1206 2HH1 ARG 61 1HH2 ARG 151 -8.428 -36.024 -16.267 1207 1HH2 ARG 61 1HH1 ARG 151 -11.578 -36.593 -14.991 1208 2HH2 ARG 61 2HH1 ARG 151 -10.111 -37.249 -15.877 1209 H ASN 62 H ASN 152 -13.444 -31.266 -11.652 1210 HA ASN 62 HA ASN 152 -13.016 -30.500 -8.829 1211 1HB ASN 62 1HB ASN 152 -15.240 -31.180 -9.877 1212 2HB ASN 62 2HB ASN 152 -14.657 -32.832 -9.985 1213 1HD2 ASN 62 2HD2 ASN 152 -16.168 -31.603 -6.447 1214 2HD2 ASN 62 1HD2 ASN 152 -16.034 -30.480 -7.892 1215 HA PRO 63 HA PRO 153 -9.574 -33.510 -8.297 1216 1HB PRO 63 1HB PRO 153 -9.271 -33.505 -5.529 1217 2HB PRO 63 2HB PRO 153 -8.798 -32.180 -6.602 1218 1HG PRO 63 1HG PRO 153 -11.393 -32.439 -5.001 1219 2HG PRO 63 2HG PRO 153 -10.295 -31.040 -5.080 1220 1HD PRO 63 1HD PRO 153 -12.573 -31.180 -6.625 1221 2HD PRO 63 2HD PRO 153 -11.091 -30.414 -7.271 1222 H GLN 64 H GLN 154 -12.668 -34.305 -6.700 1223 HA GLN 64 HA GLN 154 -11.764 -37.150 -6.106 1224 1HB GLN 64 1HB GLN 154 -14.487 -35.836 -5.535 1225 2HB GLN 64 2HB GLN 154 -13.991 -37.431 -5.027 1226 1HG GLN 64 1HG GLN 154 -12.720 -34.782 -4.070 1227 2HG GLN 64 2HG GLN 154 -14.059 -35.634 -3.324 1228 1HE2 GLN 64 2HE2 GLN 154 -11.876 -38.017 -1.673 1229 2HE2 GLN 64 1HE2 GLN 154 -13.589 -37.463 -2.025 1230 H THR 65 H THR 155 -14.724 -35.814 -7.380 1231 HA THR 65 HA THR 155 -15.470 -37.963 -9.073 1232 HB THR 65 HB THR 155 -17.194 -36.577 -10.080 1233 HG1 THR 65 HG1 THR 155 -15.839 -34.389 -8.915 1234 1HG2 THR 65 1HG2 THR 155 -17.549 -37.234 -7.654 1235 2HG2 THR 65 2HG2 THR 155 -16.847 -35.678 -7.150 1236 3HG2 THR 65 3HG2 THR 155 -18.356 -35.699 -8.087 1237 H GLY 66 H GLY 156 -13.601 -35.161 -10.231 1238 1HA GLY 66 1HA GLY 156 -12.258 -34.999 -12.225 1239 2HA GLY 66 2HA GLY 156 -12.705 -36.627 -12.689 1240 H GLU 67 H GLU 157 -14.891 -33.898 -11.989 1241 HA GLU 67 HA GLU 157 -15.858 -33.824 -14.894 1242 1HB GLU 67 2HB GLU 157 -17.384 -34.743 -13.017 1243 2HB GLU 67 1HB GLU 157 -17.433 -33.137 -12.311 1244 1HG GLU 67 1HG GLU 157 -18.353 -33.815 -15.188 1245 2HG GLU 67 2HG GLU 157 -19.404 -33.873 -13.788 1246 HE2 GLU 67 HE2 GLU 157 -19.105 -30.526 -15.717 1247 H GLU 68 H GLU 158 -15.942 -31.848 -15.825 1248 HA GLU 68 HA GLU 158 -14.218 -29.740 -14.781 1249 1HB GLU 68 1HB GLU 158 -16.054 -29.645 -17.237 1250 2HB GLU 68 2HB GLU 158 -14.953 -28.351 -16.775 1251 1HG GLU 68 1HG GLU 158 -12.988 -29.996 -16.926 1252 2HG GLU 68 2HG GLU 158 -14.104 -31.216 -17.526 1253 HE1 GLU 68 HE2 GLU 158 -12.922 -28.091 -19.820 1254 H MET 69 H MET 159 -14.684 -28.352 -13.280 1255 HA MET 69 HA MET 159 -17.580 -27.556 -12.702 1256 1HB MET 69 1HB MET 159 -17.053 -27.416 -10.349 1257 2HB MET 69 2HB MET 159 -16.682 -28.996 -10.987 1258 1HG MET 69 1HG MET 159 -14.892 -28.588 -9.516 1259 2HG MET 69 2HG MET 159 -14.166 -28.205 -11.085 1260 1HE MET 69 1HE MET 159 -12.554 -27.353 -8.934 1261 2HE MET 69 3HE MET 159 -12.222 -26.344 -10.378 1262 3HE MET 69 2HE MET 159 -12.437 -25.580 -8.778 1263 H GLU 70 H GLU 160 -18.103 -25.541 -12.383 1264 HA GLU 70 HA GLU 160 -16.397 -23.388 -13.461 1265 1HB GLU 70 2HB GLU 160 -18.234 -21.872 -13.246 1266 2HB GLU 70 1HB GLU 160 -18.717 -23.367 -14.047 1267 1HG GLU 70 1HG GLU 160 -19.836 -24.128 -11.869 1268 2HG GLU 70 2HG GLU 160 -19.385 -22.598 -11.125 1269 HE1 GLU 70 HE2 GLU 160 -22.426 -22.847 -13.765 1270 H ILE 71 H ILE 161 -14.942 -22.229 -12.395 1271 HA ILE 71 HA ILE 161 -14.842 -22.086 -9.421 1272 HB ILE 71 HB ILE 161 -12.905 -21.153 -11.661 1273 1HG1 ILE 71 1HG1 ILE 161 -12.696 -23.628 -9.823 1274 2HG1 ILE 71 2HG1 ILE 161 -13.271 -23.737 -11.469 1275 1HG2 ILE 71 2HG2 ILE 161 -12.602 -19.903 -9.523 1276 2HG2 ILE 71 3HG2 ILE 161 -12.427 -21.448 -8.640 1277 3HG2 ILE 71 1HG2 ILE 161 -11.221 -20.957 -9.875 1278 1HD1 ILE 71 1HD1 ILE 161 -10.412 -22.869 -10.730 1279 2HD1 ILE 71 2HD1 ILE 161 -10.930 -24.447 -11.348 1280 3HD1 ILE 71 3HD1 ILE 161 -11.071 -23.015 -12.384 1281 HA PRO 72 HA PRO 162 -16.733 -17.839 -10.271 1282 1HB PRO 72 1HB PRO 162 -17.879 -17.348 -7.809 1283 2HB PRO 72 2HB PRO 162 -18.461 -18.644 -8.860 1284 1HG PRO 72 1HG PRO 162 -16.527 -18.899 -6.491 1285 2HG PRO 72 2HG PRO 162 -18.009 -19.840 -6.790 1286 1HD PRO 72 1HD PRO 162 -15.466 -20.740 -7.528 1287 2HD PRO 72 2HD PRO 162 -16.939 -21.191 -8.439 1288 H ALA 73 H ALA 163 -16.749 -15.672 -8.924 1289 HA ALA 73 HA ALA 163 -14.368 -14.277 -9.233 1290 1HB ALA 73 2HB ALA 163 -16.604 -13.207 -8.571 1291 2HB ALA 73 3HB ALA 163 -16.318 -13.722 -6.868 1292 3HB ALA 73 1HB ALA 163 -15.248 -12.557 -7.638 1293 H SER 74 H SER 164 -12.966 -13.188 -7.945 1294 HA SER 74 HA SER 164 -12.888 -13.655 -5.114 1295 1HB SER 74 1HB SER 164 -10.371 -14.386 -6.864 1296 2HB SER 74 2HB SER 164 -10.175 -14.051 -5.153 1297 HG SER 74 HG SER 164 -10.418 -16.258 -5.585 1298 H LYS 75 H LYS 165 -12.543 -11.779 -4.153 1299 HA LYS 75 HA LYS 165 -11.856 -9.372 -5.745 1300 1HB LYS 75 2HB LYS 165 -11.953 -8.866 -2.835 1301 2HB LYS 75 1HB LYS 165 -12.523 -7.976 -4.203 1302 1HG LYS 75 1HG LYS 165 -14.510 -9.504 -4.424 1303 2HG LYS 75 2HG LYS 165 -13.935 -10.445 -3.043 1304 1HD LYS 75 1HD LYS 165 -14.075 -8.389 -1.575 1305 2HD LYS 75 2HD LYS 165 -14.693 -7.448 -2.922 1306 1HE LYS 75 1HE LYS 165 -16.110 -9.935 -1.742 1307 2HE LYS 75 2HE LYS 165 -16.450 -8.269 -1.278 1308 1HZ LYS 75 1HZ LYS 165 -16.806 -9.383 -3.997 1309 2HZ LYS 75 2HZ LYS 165 -17.995 -9.071 -2.921 1310 H VAL 76 H VAL 166 -9.687 -8.664 -6.204 1311 HA VAL 76 HA VAL 166 -7.543 -9.655 -4.523 1312 HB VAL 76 HB VAL 166 -8.402 -9.453 -7.294 1313 1HG1 VAL 76 3HG2 VAL 166 -7.230 -7.353 -7.484 1314 2HG1 VAL 76 1HG2 VAL 166 -5.729 -8.161 -6.972 1315 3HG1 VAL 76 2HG2 VAL 166 -6.610 -8.657 -8.502 1316 1HG2 VAL 76 3HG1 VAL 166 -7.567 -11.424 -6.245 1317 2HG2 VAL 76 1HG1 VAL 166 -6.693 -11.000 -7.741 1318 3HG2 VAL 76 2HG1 VAL 166 -5.927 -10.683 -6.136 1319 HA PRO 77 HA PRO 167 -7.439 -5.232 -3.301 1320 1HB PRO 77 1HB PRO 167 -5.648 -5.427 -1.148 1321 2HB PRO 77 2HB PRO 167 -7.257 -6.170 -1.088 1322 1HG PRO 77 1HG PRO 167 -4.605 -7.509 -1.821 1323 2HG PRO 77 2HG PRO 167 -5.802 -8.073 -0.652 1324 1HD PRO 77 1HD PRO 167 -5.653 -8.949 -3.409 1325 2HD PRO 77 2HD PRO 167 -7.202 -8.950 -2.528 1326 H ALA 78 H ALA 168 -6.554 -3.650 -3.944 1327 HA ALA 78 HA ALA 168 -3.664 -3.588 -4.948 1328 1HB ALA 78 3HB ALA 168 -5.480 -4.132 -6.689 1329 2HB ALA 78 1HB ALA 168 -6.178 -2.524 -6.396 1330 3HB ALA 78 2HB ALA 168 -4.530 -2.670 -7.047 1331 H PHE 79 H PHE 169 -2.992 -1.520 -5.439 1332 HA PHE 79 HA PHE 169 -3.898 0.901 -3.750 1333 1HB PHE 79 2HB PHE 169 -2.819 0.011 -2.079 1334 2HB PHE 79 1HB PHE 169 -1.507 -0.649 -3.100 1335 HD1 PHE 79 HD1 PHE 169 -2.731 2.472 -1.453 1336 HD2 PHE 79 HD2 PHE 169 0.420 0.720 -3.800 1337 HE1 PHE 79 HE1 PHE 169 -1.348 4.475 -1.118 1338 HE2 PHE 79 HE2 PHE 169 1.755 2.761 -3.523 1339 HZ PHE 79 HZ PHE 169 0.863 4.657 -2.229 1340 H LYS 80 H LYS 170 -3.642 2.291 -5.154 1341 HA LYS 80 HA LYS 170 -1.767 2.474 -7.677 1342 1HB LYS 80 2HB LYS 170 -3.978 4.376 -6.850 1343 2HB LYS 80 1HB LYS 170 -2.953 4.536 -8.264 1344 1HG LYS 80 1HG LYS 170 -4.984 2.264 -7.793 1345 2HG LYS 80 2HG LYS 170 -5.255 3.701 -8.763 1346 1HD LYS 80 1HD LYS 170 -3.397 3.016 -10.334 1347 2HD LYS 80 2HD LYS 170 -3.115 1.562 -9.367 1348 1HE LYS 80 1HE LYS 170 -5.491 0.784 -9.822 1349 2HE LYS 80 2HE LYS 170 -5.779 2.233 -10.798 1350 1HZ LYS 80 1HZ LYS 170 -3.969 1.526 -12.260 1351 2HZ LYS 80 2HZ LYS 170 -3.699 0.190 -11.358 1352 HA PRO 81 HA PRO 171 0.675 5.267 -5.000 1353 1HB PRO 81 1HB PRO 171 2.639 6.004 -6.779 1354 2HB PRO 81 2HB PRO 171 2.459 4.335 -6.225 1355 1HG PRO 81 1HG PRO 171 1.421 5.557 -8.846 1356 2HG PRO 81 2HG PRO 171 2.419 4.094 -8.657 1357 1HD PRO 81 1HD PRO 171 -0.383 4.044 -8.856 1358 2HD PRO 81 2HD PRO 171 0.542 2.794 -7.961 1359 H GLY 82 H GLY 172 -1.814 6.246 -6.042 1360 1HA GLY 82 1HA GLY 172 -3.030 8.059 -7.081 1361 2HA GLY 82 2HA GLY 172 -2.013 8.931 -5.948 1362 H LYS 83 H LYS 173 -0.351 7.514 -8.557 1363 HA LYS 83 HA LYS 173 0.883 8.402 -10.418 1364 1HB LYS 83 2HB LYS 173 -1.415 10.363 -10.462 1365 2HB LYS 83 1HB LYS 173 0.054 11.057 -11.010 1366 1HG LYS 83 1HG LYS 173 -1.180 10.172 -12.934 1367 2HG LYS 83 2HG LYS 173 0.287 9.234 -12.753 1368 1HD LYS 83 1HD LYS 173 -1.504 7.722 -13.325 1369 2HD LYS 83 2HD LYS 173 -1.005 7.356 -11.681 1370 1HE LYS 83 1HE LYS 173 -3.027 8.665 -10.798 1371 2HE LYS 83 2HE LYS 173 -3.512 9.010 -12.464 1372 1HZ LYS 83 1HZ LYS 173 -4.659 7.108 -11.537 1373 2HZ LYS 83 2HZ LYS 173 -3.259 6.315 -11.243 1374 H ALA 84 H ALA 174 0.172 10.678 -8.083 1375 HA ALA 84 HA ALA 174 2.345 12.583 -8.071 1376 1HB ALA 84 2HB ALA 174 0.089 12.792 -7.004 1377 2HB ALA 84 3HB ALA 174 0.445 11.421 -5.920 1378 3HB ALA 84 1HB ALA 174 1.358 12.943 -5.742 1379 H LEU 85 H LEU 175 1.930 9.560 -5.998 1380 HA LEU 85 HA LEU 175 4.563 9.792 -4.764 1381 1HB LEU 85 2HB LEU 175 2.760 8.477 -3.675 1382 2HB LEU 85 1HB LEU 175 2.681 7.405 -5.061 1383 HG LEU 85 HG LEU 175 5.115 6.969 -4.709 1384 1HD1 LEU 85 3HD1 LEU 175 5.754 8.716 -3.088 1385 2HD1 LEU 85 1HD1 LEU 175 4.604 8.073 -1.902 1386 3HD1 LEU 85 2HD1 LEU 175 6.044 7.123 -2.364 1387 1HD2 LEU 85 3HD2 LEU 175 3.289 5.283 -4.193 1388 2HD2 LEU 85 1HD2 LEU 175 4.614 5.104 -3.034 1389 3HD2 LEU 85 2HD2 LEU 175 3.115 5.944 -2.554 1390 H LYS 86 H LYS 176 3.346 8.233 -7.719 1391 HA LYS 86 HA LYS 176 5.842 6.935 -8.488 1392 1HB LYS 86 1HB LYS 176 3.473 6.580 -9.537 1393 2HB LYS 86 2HB LYS 176 3.855 7.931 -10.592 1394 1HG LYS 86 1HG LYS 176 5.892 6.686 -11.427 1395 2HG LYS 86 2HG LYS 176 5.560 5.374 -10.292 1396 1HD LYS 86 1HD LYS 176 3.333 4.955 -11.426 1397 2HD LYS 86 2HD LYS 176 3.676 6.255 -12.574 1398 1HE LYS 86 1HE LYS 176 5.734 4.996 -13.387 1399 2HE LYS 86 2HE LYS 176 5.399 3.699 -12.229 1400 1HZ LYS 86 1HZ LYS 176 3.618 4.550 -14.446 1401 2HZ LYS 86 2HZ LYS 176 4.556 3.211 -14.428 1402 H ASP 87 H ASP 177 5.042 10.354 -8.603 1403 HA ASP 87 HA ASP 177 7.450 11.064 -10.220 1404 1HB ASP 87 1HB ASP 177 4.907 12.268 -9.513 1405 2HB ASP 87 2HB ASP 177 6.026 13.131 -8.546 1406 HD1 ASP 87 HD2 ASP 177 7.552 14.772 -11.241 1407 H ALA 88 H ALA 178 6.470 11.150 -6.756 1408 HA ALA 88 HA ALA 178 8.797 12.297 -5.476 1409 1HB ALA 88 3HB ALA 178 6.627 11.496 -4.261 1410 2HB ALA 88 1HB ALA 178 7.148 9.829 -4.504 1411 3HB ALA 88 2HB ALA 178 8.111 10.865 -3.482 1412 H VAL 89 H VAL 179 8.151 8.918 -6.402 1413 HA VAL 89 HA VAL 179 10.608 7.828 -5.275 1414 HB VAL 89 HB VAL 179 7.952 7.299 -5.204 1415 1HG1 VAL 89 2HG2 VAL 179 7.852 7.229 -7.802 1416 2HG1 VAL 89 3HG2 VAL 179 8.573 5.609 -7.671 1417 3HG1 VAL 89 1HG2 VAL 179 7.032 5.999 -6.840 1418 1HG2 VAL 89 1HG1 VAL 179 9.465 6.002 -4.068 1419 2HG2 VAL 89 2HG1 VAL 179 8.167 5.073 -4.843 1420 3HG2 VAL 89 3HG1 VAL 179 9.824 5.023 -5.562 1421 H LYS 90 H LYS 180 9.832 8.917 -8.474 1422 HA LYS 90 HA LYS 180 10.992 6.941 -10.155 1423 1HB LYS 90 1HB LYS 180 9.590 9.347 -10.477 1424 2HB LYS 90 2HB LYS 180 11.156 9.889 -10.988 1425 1HG LYS 90 1HG LYS 180 11.177 8.140 -12.802 1426 2HG LYS 90 2HG LYS 180 9.735 7.396 -12.123 1427 1HD LYS 90 1HD LYS 180 8.922 8.668 -13.966 1428 2HD LYS 90 2HD LYS 180 8.408 9.508 -12.526 1429 1HE LYS 90 1HE LYS 180 9.110 11.182 -14.120 1430 2HE LYS 90 2HE LYS 180 10.301 11.197 -12.824 1431 1HZ LYS 90 1HZ LYS 180 10.625 9.809 -15.434 1432 2HZ LYS 90 2HZ LYS 180 11.744 9.826 -14.243 Start of MODEL 16 Raw file had 1432 H/Q atoms Start of MODEL 16 1 1H MET 1 1H MET 1 -10.781 7.896 -3.491 2 2H MET 1 2H MET 1 -10.693 6.794 -2.287 3 HA MET 1 HA MET 1 -11.257 8.930 -1.435 4 1HB MET 1 1HB MET 1 -8.519 7.789 -0.567 5 2HB MET 1 2HB MET 1 -9.280 9.125 0.248 6 1HG MET 1 1HG MET 1 -10.045 7.489 1.610 7 2HG MET 1 2HG MET 1 -11.405 7.486 0.493 8 1HE MET 1 1HE MET 1 -10.284 5.095 2.541 9 2HE MET 1 3HE MET 1 -9.299 3.836 1.735 10 3HE MET 1 2HE MET 1 -8.574 5.417 2.135 11 H ASN 2 H ASN 2 -7.987 9.786 -1.415 12 HA ASN 2 HA ASN 2 -7.183 11.211 -3.354 13 1HB ASN 2 1HB ASN 2 -7.729 13.486 -3.684 14 2HB ASN 2 2HB ASN 2 -9.146 12.501 -3.870 15 1HD2 ASN 2 1HD2 ASN 2 -11.023 14.421 -1.491 16 2HD2 ASN 2 2HD2 ASN 2 -10.990 13.026 -2.683 17 H LYS 3 H LYS 3 -7.774 11.648 -0.116 18 HA LYS 3 HA LYS 3 -5.733 11.563 1.477 19 1HB LYS 3 1HB LYS 3 -4.125 12.691 -0.138 20 2HB LYS 3 2HB LYS 3 -4.935 14.222 0.109 21 1HG LYS 3 1HG LYS 3 -4.224 14.258 2.485 22 2HG LYS 3 2HG LYS 3 -3.694 12.586 2.434 23 1HD LYS 3 1HD LYS 3 -2.393 14.795 0.725 24 2HD LYS 3 2HD LYS 3 -1.893 14.481 2.371 25 1HE LYS 3 1HE LYS 3 -1.768 12.360 0.124 26 2HE LYS 3 2HE LYS 3 -0.431 13.402 0.590 27 1HZ LYS 3 1HZ LYS 3 -0.312 11.239 1.626 28 2HZ LYS 3 2HZ LYS 3 -1.757 11.436 2.365 29 H THR 4 H THR 4 -8.383 13.900 0.496 30 HA THR 4 HA THR 4 -8.678 14.824 3.196 31 HB THR 4 HB THR 4 -10.114 15.198 0.492 32 HG1 THR 4 HG1 THR 4 -7.992 16.086 0.649 33 1HG2 THR 4 3HG2 THR 4 -10.384 16.547 3.195 34 2HG2 THR 4 1HG2 THR 4 -11.087 17.165 1.630 35 3HG2 THR 4 2HG2 THR 4 -11.614 15.576 2.310 36 H GLU 5 H GLU 5 -10.068 12.402 0.975 37 HA GLU 5 HA GLU 5 -12.397 11.792 2.752 38 1HB GLU 5 1HB GLU 5 -11.382 9.815 0.706 39 2HB GLU 5 2HB GLU 5 -12.972 9.912 1.404 40 1HG GLU 5 1HG GLU 5 -11.717 11.774 -0.694 41 2HG GLU 5 2HG GLU 5 -12.899 10.533 -1.001 42 HE1 GLU 5 HE2 GLU 5 -15.665 12.355 0.036 43 H LEU 6 H LEU 6 -9.074 11.298 2.830 44 HA LEU 6 HA LEU 6 -8.725 8.762 4.290 45 1HB LEU 6 2HB LEU 6 -7.182 10.793 2.767 46 2HB LEU 6 1HB LEU 6 -6.655 11.034 4.399 47 HG LEU 6 HG LEU 6 -6.226 8.483 4.340 48 1HD1 LEU 6 2HD1 LEU 6 -7.711 7.712 2.546 49 2HD1 LEU 6 3HD1 LEU 6 -6.813 8.671 1.352 50 3HD1 LEU 6 1HD1 LEU 6 -6.042 7.271 2.156 51 1HD2 LEU 6 2HD2 LEU 6 -4.450 10.236 3.952 52 2HD2 LEU 6 3HD2 LEU 6 -4.083 8.604 3.387 53 3HD2 LEU 6 1HD2 LEU 6 -4.557 9.869 2.218 54 H ILE 7 H ILE 7 -8.707 12.266 4.898 55 HA ILE 7 HA ILE 7 -8.327 12.308 7.740 56 HB ILE 7 HB ILE 7 -9.998 14.373 6.145 57 1HG1 ILE 7 1HG1 ILE 7 -6.943 14.251 6.320 58 2HG1 ILE 7 2HG1 ILE 7 -7.891 13.928 4.927 59 1HG2 ILE 7 2HG2 ILE 7 -9.958 14.665 8.657 60 2HG2 ILE 7 3HG2 ILE 7 -8.188 14.755 8.585 61 3HG2 ILE 7 1HG2 ILE 7 -9.180 16.010 7.808 62 1HD1 ILE 7 3HD1 ILE 7 -8.764 16.265 4.803 63 2HD1 ILE 7 1HD1 ILE 7 -7.748 16.714 6.169 64 3HD1 ILE 7 2HD1 ILE 7 -6.990 16.138 4.667 65 H ASN 8 H ASN 8 -11.347 12.414 5.862 66 HA ASN 8 HA ASN 8 -13.073 12.210 8.272 67 1HB ASN 8 1HB ASN 8 -13.804 11.606 5.304 68 2HB ASN 8 2HB ASN 8 -14.972 11.652 6.602 69 1HD2 ASN 8 2HD2 ASN 8 -13.960 15.197 4.927 70 2HD2 ASN 8 1HD2 ASN 8 -13.287 13.591 4.348 71 H ALA 9 H ALA 9 -11.292 9.719 6.696 72 HA ALA 9 HA ALA 9 -12.985 7.446 7.744 73 1HB ALA 9 2HB ALA 9 -11.170 7.078 5.836 74 2HB ALA 9 3HB ALA 9 -9.927 7.503 7.026 75 3HB ALA 9 1HB ALA 9 -10.867 6.070 7.307 76 H VAL 10 H VAL 10 -9.960 9.209 8.702 77 HA VAL 10 HA VAL 10 -9.477 7.521 10.887 78 HB VAL 10 HB VAL 10 -8.320 10.314 10.783 79 1HG1 VAL 10 3HG2 VAL 10 -7.702 8.340 12.494 80 2HG1 VAL 10 1HG2 VAL 10 -6.559 7.948 11.170 81 3HG1 VAL 10 2HG2 VAL 10 -6.529 9.557 11.901 82 1HG2 VAL 10 1HG1 VAL 10 -7.852 8.098 8.787 83 2HG2 VAL 10 2HG1 VAL 10 -8.216 9.844 8.611 84 3HG2 VAL 10 3HG1 VAL 10 -6.574 9.356 9.128 85 H ALA 11 H ALA 11 -10.591 10.725 10.627 86 HA ALA 11 HA ALA 11 -11.175 10.921 13.362 87 1HB ALA 11 2HB ALA 11 -10.854 12.952 11.873 88 2HB ALA 11 3HB ALA 11 -12.375 12.584 11.021 89 3HB ALA 11 1HB ALA 11 -12.404 13.119 12.734 90 H GLU 12 H GLU 12 -13.118 9.445 10.891 91 HA GLU 12 HA GLU 12 -15.564 9.369 12.625 92 1HB GLU 12 1HB GLU 12 -15.837 9.399 10.147 93 2HB GLU 12 2HB GLU 12 -14.911 7.906 9.987 94 1HG GLU 12 1HG GLU 12 -16.707 6.642 11.227 95 2HG GLU 12 2HG GLU 12 -17.609 8.136 11.474 96 HE1 GLU 12 HE2 GLU 12 -17.480 6.285 7.858 97 H THR 13 H THR 13 -13.009 6.985 11.620 98 HA THR 13 HA THR 13 -14.057 5.172 13.803 99 HB THR 13 HB THR 13 -13.564 4.570 11.376 100 HG1 THR 13 HG1 THR 13 -14.237 3.192 13.049 101 1HG2 THR 13 1HG2 THR 13 -11.186 5.129 11.189 102 2HG2 THR 13 2HG2 THR 13 -10.794 3.911 12.434 103 3HG2 THR 13 3HG2 THR 13 -11.500 3.409 10.869 104 H SER 14 H SER 14 -12.289 7.451 14.164 105 HA SER 14 HA SER 14 -10.888 6.253 16.647 106 1HB SER 14 1HB SER 14 -9.163 6.741 14.839 107 2HB SER 14 2HB SER 14 -9.553 8.460 14.964 108 HG SER 14 HG SER 14 -9.018 8.345 17.175 109 H GLY 15 H GLY 15 -12.563 9.182 15.400 110 1HA GLY 15 1HA GLY 15 -13.432 11.049 16.554 111 2HA GLY 15 2HA GLY 15 -13.384 10.085 18.027 112 H LEU 16 H LEU 16 -11.063 11.576 15.871 113 HA LEU 16 HA LEU 16 -9.723 13.193 18.053 114 1HB LEU 16 1HB LEU 16 -7.724 13.171 16.709 115 2HB LEU 16 2HB LEU 16 -8.187 11.657 17.459 116 HG LEU 16 HG LEU 16 -8.957 10.720 15.531 117 1HD1 LEU 16 2HD1 LEU 16 -10.084 12.723 14.433 118 2HD1 LEU 16 3HD1 LEU 16 -8.436 13.223 13.943 119 3HD1 LEU 16 1HD1 LEU 16 -9.187 11.675 13.338 120 1HD2 LEU 16 1HD2 LEU 16 -6.895 10.074 15.586 121 2HD2 LEU 16 2HD2 LEU 16 -7.689 10.074 13.991 122 3HD2 LEU 16 3HD2 LEU 16 -6.501 11.313 14.340 123 H SER 17 H SER 17 -8.963 14.376 15.455 124 HA SER 17 HA SER 17 -11.211 16.416 15.041 125 1HB SER 17 1HB SER 17 -8.332 17.400 15.220 126 2HB SER 17 2HB SER 17 -9.773 18.337 14.906 127 HG SER 17 HG SER 17 -10.567 17.732 16.955 128 H LYS 18 H LYS 18 -11.106 17.517 12.991 129 HA LYS 18 HA LYS 18 -10.183 15.766 10.712 130 1HB LYS 18 1HB LYS 18 -11.547 18.523 10.609 131 2HB LYS 18 2HB LYS 18 -10.891 17.708 9.197 132 1HG LYS 18 1HG LYS 18 -12.375 15.666 9.712 133 2HG LYS 18 2HG LYS 18 -13.110 16.596 11.008 134 1HD LYS 18 1HD LYS 18 -14.584 16.738 9.141 135 2HD LYS 18 2HD LYS 18 -13.872 18.338 9.319 136 1HE LYS 18 1HE LYS 18 -12.286 17.855 7.390 137 2HE LYS 18 2HE LYS 18 -12.916 16.209 7.267 138 1HZ LYS 18 1HZ LYS 18 -13.947 17.645 5.672 139 2HZ LYS 18 2HZ LYS 18 -15.080 17.119 6.727 140 H LYS 19 H LYS 19 -9.069 18.803 12.208 141 HA LYS 19 HA LYS 19 -6.630 18.959 10.513 142 1HB LYS 19 2HB LYS 19 -7.170 20.146 13.310 143 2HB LYS 19 1HB LYS 19 -5.642 20.359 12.444 144 1HG LYS 19 1HG LYS 19 -6.894 21.464 10.521 145 2HG LYS 19 2HG LYS 19 -8.392 21.284 11.419 146 1HD LYS 19 1HD LYS 19 -7.711 23.530 11.751 147 2HD LYS 19 2HD LYS 19 -7.446 22.721 13.291 148 1HE LYS 19 1HE LYS 19 -4.950 22.560 12.764 149 2HE LYS 19 2HE LYS 19 -5.235 23.324 11.194 150 1HZ LYS 19 1HZ LYS 19 -6.058 25.280 12.354 151 2HZ LYS 19 2HZ LYS 19 -4.517 24.933 12.776 152 H ASP 20 H ASP 20 -7.362 17.167 13.624 153 HA ASP 20 HA ASP 20 -4.499 16.247 13.774 154 1HB ASP 20 1HB ASP 20 -7.049 15.487 15.353 155 2HB ASP 20 2HB ASP 20 -5.655 14.454 15.461 156 HD2 ASP 20 HD2 ASP 20 -7.012 17.310 16.357 157 H ALA 21 H ALA 21 -7.328 14.946 12.210 158 HA ALA 21 HA ALA 21 -6.118 12.285 11.633 159 1HB ALA 21 2HB ALA 21 -8.611 13.797 10.616 160 2HB ALA 21 3HB ALA 21 -8.089 12.241 9.918 161 3HB ALA 21 1HB ALA 21 -8.496 12.356 11.602 162 H THR 22 H THR 22 -6.265 15.382 9.784 163 HA THR 22 HA THR 22 -4.934 14.134 7.488 164 HB THR 22 HB THR 22 -6.391 15.980 7.525 165 HG1 THR 22 HG1 THR 22 -5.174 15.024 5.759 166 1HG2 THR 22 2HG2 THR 22 -5.803 17.900 8.520 167 2HG2 THR 22 3HG2 THR 22 -4.368 18.098 7.401 168 3HG2 THR 22 1HG2 THR 22 -6.033 18.102 6.779 169 H LYS 23 H LYS 23 -3.829 15.976 10.126 170 HA LYS 23 HA LYS 23 -0.950 16.233 9.642 171 1HB LYS 23 2HB LYS 23 -3.129 15.902 11.847 172 2HB LYS 23 1HB LYS 23 -1.440 15.896 12.420 173 1HG LYS 23 1HG LYS 23 -0.967 18.152 11.372 174 2HG LYS 23 2HG LYS 23 -2.669 18.304 10.953 175 1HD LYS 23 1HD LYS 23 -3.252 18.069 13.436 176 2HD LYS 23 2HD LYS 23 -1.546 17.990 13.829 177 1HE LYS 23 1HE LYS 23 -2.927 20.391 12.429 178 2HE LYS 23 2HE LYS 23 -2.674 20.261 14.166 179 1HZ LYS 23 1HZ LYS 23 -0.283 20.151 13.772 180 2HZ LYS 23 2HZ LYS 23 -0.495 20.272 12.156 181 H ALA 24 H ALA 24 -2.957 13.787 11.290 182 HA ALA 24 HA ALA 24 -0.851 11.928 11.963 183 1HB ALA 24 3HB ALA 24 -3.868 11.654 11.737 184 2HB ALA 24 1HB ALA 24 -2.780 10.434 12.484 185 3HB ALA 24 2HB ALA 24 -2.881 12.074 13.174 186 H VAL 25 H VAL 25 -2.995 12.000 9.076 187 HA VAL 25 HA VAL 25 -1.871 9.698 7.636 188 HB VAL 25 HB VAL 25 -3.352 12.424 7.168 189 1HG1 VAL 25 1HG2 VAL 25 -2.292 10.850 4.758 190 2HG1 VAL 25 2HG2 VAL 25 -3.485 12.195 4.723 191 3HG1 VAL 25 3HG2 VAL 25 -1.836 12.493 5.230 192 1HG2 VAL 25 3HG1 VAL 25 -4.658 10.422 7.830 193 2HG2 VAL 25 1HG1 VAL 25 -5.159 11.105 6.280 194 3HG2 VAL 25 2HG1 VAL 25 -4.180 9.602 6.318 195 H ASP 26 H ASP 26 -0.975 13.209 7.419 196 HA ASP 26 HA ASP 26 1.730 12.455 6.267 197 1HB ASP 26 1HB ASP 26 0.271 14.552 5.713 198 2HB ASP 26 2HB ASP 26 0.816 15.212 7.256 199 HD2 ASP 26 HD2 ASP 26 3.826 16.290 5.961 200 H ALA 27 H ALA 27 0.961 11.724 8.839 201 HA ALA 27 HA ALA 27 3.527 12.194 10.397 202 1HB ALA 27 3HB ALA 27 1.126 12.736 11.488 203 2HB ALA 27 1HB ALA 27 1.118 11.002 11.736 204 3HB ALA 27 2HB ALA 27 2.382 12.052 12.426 205 H VAL 28 H VAL 28 1.242 9.640 9.528 206 HA VAL 28 HA VAL 28 3.082 7.340 9.865 207 HB VAL 28 HB VAL 28 0.604 7.730 7.999 208 1HG1 VAL 28 2HG2 VAL 28 2.111 5.132 8.691 209 2HG1 VAL 28 3HG2 VAL 28 0.487 5.208 7.977 210 3HG1 VAL 28 1HG2 VAL 28 1.834 5.875 7.066 211 1HG2 VAL 28 3HG1 VAL 28 0.048 7.812 10.328 212 2HG2 VAL 28 1HG1 VAL 28 -0.604 6.366 9.479 213 3HG2 VAL 28 2HG1 VAL 28 0.862 6.199 10.562 214 H PHE 29 H PHE 29 1.802 8.893 7.093 215 HA PHE 29 HA PHE 29 3.666 7.859 5.069 216 1HB PHE 29 2HB PHE 29 1.766 10.217 4.678 217 2HB PHE 29 1HB PHE 29 2.544 9.304 3.393 218 HD1 PHE 29 HD2 PHE 29 2.271 6.539 3.769 219 HD2 PHE 29 HD1 PHE 29 -0.517 9.585 4.923 220 HE1 PHE 29 HE2 PHE 29 0.584 4.822 4.203 221 HE2 PHE 29 HE1 PHE 29 -2.184 7.864 5.427 222 HZ PHE 29 HZ PHE 29 -1.563 5.469 5.188 223 H ASP 30 H ASP 30 4.092 10.640 7.095 224 HA ASP 30 HA ASP 30 6.195 11.795 5.321 225 1HB ASP 30 1HB ASP 30 4.711 12.980 7.179 226 2HB ASP 30 2HB ASP 30 5.887 12.418 8.332 227 HD2 ASP 30 HD2 ASP 30 6.574 15.606 6.020 228 H SER 31 H SER 31 6.089 9.731 8.052 229 HA SER 31 HA SER 31 9.084 9.404 8.404 230 1HB SER 31 1HB SER 31 6.917 7.548 9.514 231 2HB SER 31 2HB SER 31 8.622 7.571 9.972 232 HG SER 31 HG SER 31 8.354 9.738 10.652 233 H ILE 32 H ILE 32 6.471 7.458 6.632 234 HA ILE 32 HA ILE 32 8.110 5.423 5.727 235 HB ILE 32 HB ILE 32 5.762 6.538 4.132 236 1HG1 ILE 32 1HG1 ILE 32 5.878 5.270 6.867 237 2HG1 ILE 32 2HG1 ILE 32 4.993 6.618 6.186 238 1HG2 ILE 32 3HG2 ILE 32 7.298 4.606 3.237 239 2HG2 ILE 32 1HG2 ILE 32 6.852 3.745 4.691 240 3HG2 ILE 32 2HG2 ILE 32 5.609 4.078 3.479 241 1HD1 ILE 32 3HD1 ILE 32 4.238 3.783 5.549 242 2HD1 ILE 32 1HD1 ILE 32 3.654 4.746 6.944 243 3HD1 ILE 32 2HD1 ILE 32 3.318 5.328 5.276 244 H THR 33 H THR 33 7.210 8.437 4.077 245 HA THR 33 HA THR 33 9.014 8.104 1.737 246 HB THR 33 HB THR 33 7.293 9.597 1.589 247 HG1 THR 33 HG1 THR 33 9.140 10.041 0.410 248 1HG2 THR 33 3HG2 THR 33 7.362 10.487 4.030 249 2HG2 THR 33 1HG2 THR 33 8.552 11.654 3.517 250 3HG2 THR 33 2HG2 THR 33 6.887 11.660 2.809 251 H GLU 34 H GLU 34 9.688 9.289 4.950 252 HA GLU 34 HA GLU 34 12.553 9.934 4.313 253 1HB GLU 34 1HB GLU 34 11.309 11.191 6.158 254 2HB GLU 34 2HB GLU 34 11.192 9.700 7.072 255 1HG GLU 34 1HG GLU 34 12.999 11.063 7.974 256 2HG GLU 34 2HG GLU 34 13.699 9.609 7.292 257 HE1 GLU 34 HE2 GLU 34 14.443 13.277 5.726 258 H ALA 35 H ALA 35 10.685 7.067 5.433 259 HA ALA 35 HA ALA 35 13.116 5.505 5.994 260 1HB ALA 35 3HB ALA 35 10.738 4.616 6.857 261 2HB ALA 35 1HB ALA 35 10.281 4.410 5.167 262 3HB ALA 35 2HB ALA 35 11.529 3.407 5.847 263 H LEU 36 H LEU 36 10.842 5.421 3.097 264 HA LEU 36 HA LEU 36 12.561 3.759 1.445 265 1HB LEU 36 2HB LEU 36 10.503 5.779 0.732 266 2HB LEU 36 1HB LEU 36 10.959 4.395 -0.235 267 HG LEU 36 HG LEU 36 9.637 4.064 2.530 268 1HD1 LEU 36 2HD1 LEU 36 7.923 4.255 0.749 269 2HD1 LEU 36 3HD1 LEU 36 8.527 2.585 0.265 270 3HD1 LEU 36 1HD1 LEU 36 7.907 2.901 1.922 271 1HD2 LEU 36 3HD2 LEU 36 10.988 1.877 1.427 272 2HD2 LEU 36 1HD2 LEU 36 11.083 2.656 3.021 273 3HD2 LEU 36 2HD2 LEU 36 9.651 1.747 2.586 274 NH1 ARG 37 NH2 ARG 37 11.495 13.555 0.950 275 NH2 ARG 37 NH1 ARG 37 13.033 14.252 -0.572 276 H ARG 37 H ARG 37 12.388 7.360 1.709 277 HA ARG 37 HA ARG 37 14.185 7.599 -0.476 278 1HB ARG 37 1HB ARG 37 14.333 9.859 -0.376 279 2HB ARG 37 2HB ARG 37 12.751 9.527 0.268 280 1HG ARG 37 1HG ARG 37 14.069 9.664 2.649 281 2HG ARG 37 2HG ARG 37 15.303 10.486 1.713 282 1HD ARG 37 1HD ARG 37 12.371 11.255 2.014 283 2HD ARG 37 2HD ARG 37 13.751 11.982 2.873 284 1HH1 ARG 37 2HH2 ARG 37 11.267 12.914 1.718 285 2HH1 ARG 37 1HH2 ARG 37 10.886 14.278 0.552 286 1HH2 ARG 37 1HH1 ARG 37 13.973 14.144 -0.967 287 2HH2 ARG 37 2HH1 ARG 37 12.317 14.927 -0.864 288 H LYS 38 H LYS 38 14.757 6.888 2.919 289 HA LYS 38 HA LYS 38 17.695 7.639 2.754 290 1HB LYS 38 1HB LYS 38 16.229 8.666 4.546 291 2HB LYS 38 2HB LYS 38 16.065 7.069 5.267 292 1HG LYS 38 1HG LYS 38 18.482 7.024 5.820 293 2HG LYS 38 2HG LYS 38 18.782 8.441 4.823 294 1HD LYS 38 1HD LYS 38 18.808 9.122 7.137 295 2HD LYS 38 2HD LYS 38 17.424 9.871 6.353 296 1HE LYS 38 1HE LYS 38 15.892 8.104 7.395 297 2HE LYS 38 2HE LYS 38 17.297 7.359 8.172 298 1HZ LYS 38 1HZ LYS 38 16.387 10.154 8.596 299 2HZ LYS 38 2HZ LYS 38 17.681 9.470 9.324 300 H GLY 39 H GLY 39 16.073 4.955 1.947 301 1HA GLY 39 1HA GLY 39 16.711 2.649 1.771 302 2HA GLY 39 2HA GLY 39 18.253 3.033 2.497 303 H ASP 40 H ASP 40 15.092 3.490 4.006 304 HA ASP 40 HA ASP 40 15.646 1.332 6.099 305 1HB ASP 40 1HB ASP 40 13.773 3.626 6.536 306 2HB ASP 40 2HB ASP 40 14.265 2.423 7.680 307 HD1 ASP 40 HD2 ASP 40 17.379 3.788 8.381 308 H LYS 41 H LYS 41 14.367 -0.332 6.407 309 HA LYS 41 HA LYS 41 12.040 -0.748 4.542 310 1HB LYS 41 2HB LYS 41 12.837 -2.672 6.739 311 2HB LYS 41 1HB LYS 41 11.754 -2.983 5.388 312 1HG LYS 41 1HG LYS 41 13.779 -2.613 3.812 313 2HG LYS 41 2HG LYS 41 14.803 -2.596 5.249 314 1HD LYS 41 1HD LYS 41 13.976 -4.901 5.866 315 2HD LYS 41 2HD LYS 41 12.950 -4.942 4.440 316 1HE LYS 41 1HE LYS 41 16.041 -4.701 4.375 317 2HE LYS 41 2HE LYS 41 15.149 -6.213 4.230 318 1HZ LYS 41 1HZ LYS 41 14.897 -3.936 2.348 319 2HZ LYS 41 2HZ LYS 41 14.085 -5.350 2.229 320 H VAL 42 H VAL 42 10.055 -0.075 5.124 321 HA VAL 42 HA VAL 42 9.240 0.742 7.725 322 HB VAL 42 HB VAL 42 7.760 0.288 5.074 323 1HG1 VAL 42 3HG2 VAL 42 6.314 0.808 7.003 324 2HG1 VAL 42 1HG2 VAL 42 7.287 2.304 7.296 325 3HG1 VAL 42 2HG2 VAL 42 6.329 2.108 5.781 326 1HG2 VAL 42 2HG1 VAL 42 9.857 1.945 4.973 327 2HG2 VAL 42 3HG1 VAL 42 8.297 2.423 4.318 328 3HG2 VAL 42 1HG1 VAL 42 8.812 3.030 5.929 329 H GLN 43 H GLN 43 7.562 -0.141 8.597 330 HA GLN 43 HA GLN 43 6.532 -2.902 8.058 331 1HB GLN 43 1HB GLN 43 8.234 -2.879 10.508 332 2HB GLN 43 2HB GLN 43 7.126 -4.164 10.021 333 1HG GLN 43 1HG GLN 43 8.478 -4.313 7.854 334 2HG GLN 43 2HG GLN 43 9.581 -3.108 8.517 335 1HE2 GLN 43 2HE2 GLN 43 11.415 -6.150 9.189 336 2HE2 GLN 43 1HE2 GLN 43 10.954 -4.991 7.849 337 H LEU 44 H LEU 44 4.693 -3.472 8.575 338 HA LEU 44 HA LEU 44 2.997 -2.045 10.662 339 1HB LEU 44 2HB LEU 44 2.289 -2.341 7.673 340 2HB LEU 44 1HB LEU 44 1.075 -1.972 8.879 341 HG LEU 44 HG LEU 44 3.506 -0.153 8.426 342 1HD1 LEU 44 3HD1 LEU 44 2.328 -0.386 6.244 343 2HD1 LEU 44 1HD1 LEU 44 0.769 0.022 7.003 344 3HD1 LEU 44 2HD1 LEU 44 2.072 1.235 6.919 345 1HD2 LEU 44 2HD2 LEU 44 2.190 0.241 10.566 346 2HD2 LEU 44 3HD2 LEU 44 2.033 1.608 9.442 347 3HD2 LEU 44 1HD2 LEU 44 0.701 0.444 9.610 348 H ILE 45 H ILE 45 2.326 -3.830 11.867 349 HA ILE 45 HA ILE 45 2.232 -6.523 10.659 350 HB ILE 45 HB ILE 45 3.079 -6.101 12.972 351 1HG1 ILE 45 1HG1 ILE 45 2.109 -8.162 14.038 352 2HG1 ILE 45 2HG1 ILE 45 0.921 -8.281 12.752 353 1HG2 ILE 45 1HG2 ILE 45 1.265 -4.585 13.774 354 2HG2 ILE 45 2HG2 ILE 45 0.118 -5.947 13.774 355 3HG2 ILE 45 3HG2 ILE 45 1.529 -5.961 14.876 356 1HD1 ILE 45 3HD1 ILE 45 3.997 -8.420 12.361 357 2HD1 ILE 45 1HD1 ILE 45 2.893 -9.814 12.425 358 3HD1 ILE 45 2HD1 ILE 45 2.784 -8.668 11.074 359 H GLY 46 H GLY 46 0.480 -7.845 10.472 360 1HA GLY 46 1HA GLY 46 -1.676 -8.402 9.586 361 2HA GLY 46 2HA GLY 46 -2.313 -7.116 10.575 362 H PHE 47 H PHE 47 -0.265 -5.600 8.363 363 HA PHE 47 HA PHE 47 -2.265 -5.409 6.114 364 1HB PHE 47 2HB PHE 47 -2.508 -3.711 8.054 365 2HB PHE 47 1HB PHE 47 -0.979 -3.005 7.614 366 HD1 PHE 47 HD1 PHE 47 -4.500 -3.539 6.397 367 HD2 PHE 47 HD2 PHE 47 -0.704 -1.709 5.495 368 HE1 PHE 47 HE1 PHE 47 -5.454 -2.449 4.391 369 HE2 PHE 47 HE2 PHE 47 -1.684 -0.705 3.478 370 HZ PHE 47 HZ PHE 47 -4.038 -1.208 2.870 371 H GLY 48 H GLY 48 1.196 -4.678 7.040 372 1HA GLY 48 1HA GLY 48 2.005 -4.941 4.287 373 2HA GLY 48 2HA GLY 48 1.851 -3.230 4.617 374 H ASN 49 H ASN 49 4.036 -4.287 3.627 375 HA ASN 49 HA ASN 49 6.056 -3.330 5.652 376 1HB ASN 49 1HB ASN 49 6.078 -5.721 6.101 377 2HB ASN 49 2HB ASN 49 6.220 -6.139 4.413 378 1HD2 ASN 49 1HD2 ASN 49 9.590 -6.659 5.790 379 2HD2 ASN 49 2HD2 ASN 49 7.900 -7.370 5.860 380 H PHE 50 H PHE 50 6.414 -1.544 4.456 381 HA PHE 50 HA PHE 50 6.810 -1.675 1.466 382 1HB PHE 50 2HB PHE 50 7.406 0.815 3.154 383 2HB PHE 50 1HB PHE 50 7.393 0.751 1.470 384 HD1 PHE 50 HD2 PHE 50 5.282 0.318 4.494 385 HD2 PHE 50 HD1 PHE 50 5.617 1.908 0.535 386 HE1 PHE 50 HE2 PHE 50 3.102 1.496 4.771 387 HE2 PHE 50 HE1 PHE 50 3.437 3.069 0.841 388 HZ PHE 50 HZ PHE 50 2.153 2.679 2.891 389 H GLU 51 H GLU 51 8.736 -1.095 0.487 390 HA GLU 51 HA GLU 51 10.976 -0.215 1.876 391 1HB GLU 51 1HB GLU 51 12.662 -2.124 1.818 392 2HB GLU 51 2HB GLU 51 11.353 -2.521 2.880 393 1HG GLU 51 1HG GLU 51 11.595 -3.603 -0.010 394 2HG GLU 51 2HG GLU 51 12.233 -4.408 1.408 395 HE2 GLU 51 HE2 GLU 51 8.380 -4.749 0.453 396 H VAL 52 H VAL 52 13.021 0.134 0.665 397 HA VAL 52 HA VAL 52 12.216 0.691 -2.093 398 HB VAL 52 HB VAL 52 13.370 2.076 0.165 399 1HG1 VAL 52 1HG2 VAL 52 15.619 1.470 -1.763 400 2HG1 VAL 52 2HG2 VAL 52 15.573 2.798 -0.544 401 3HG1 VAL 52 3HG2 VAL 52 15.496 1.076 -0.041 402 1HG2 VAL 52 3HG1 VAL 52 13.213 2.895 -2.740 403 2HG2 VAL 52 1HG1 VAL 52 11.976 3.043 -1.470 404 3HG2 VAL 52 2HG1 VAL 52 13.477 3.955 -1.353 405 NH1 ARG 53 NH2 ARG 53 14.009 -2.620 -10.431 406 NH2 ARG 53 NH1 ARG 53 15.391 -0.831 -10.211 407 H ARG 53 H ARG 53 13.666 0.389 -3.823 408 HA ARG 53 HA ARG 53 15.465 -2.107 -3.613 409 1HB ARG 53 1HB ARG 53 13.179 -2.505 -4.766 410 2HB ARG 53 2HB ARG 53 13.636 -1.319 -5.943 411 1HG ARG 53 1HG ARG 53 15.883 -3.094 -5.998 412 2HG ARG 53 2HG ARG 53 14.548 -4.154 -5.625 413 1HD ARG 53 1HD ARG 53 14.757 -4.184 -8.008 414 2HD ARG 53 2HD ARG 53 13.303 -3.231 -7.695 415 1HH1 ARG 53 2HH2 ARG 53 13.551 -3.420 -9.981 416 2HH1 ARG 53 1HH2 ARG 53 13.925 -2.336 -11.414 417 1HH2 ARG 53 1HH1 ARG 53 15.988 -0.265 -9.597 418 2HH2 ARG 53 2HH1 ARG 53 15.211 -0.673 -11.209 419 H GLU 54 H GLU 54 17.388 -0.978 -3.500 420 HA GLU 54 HA GLU 54 18.109 1.367 -5.115 421 1HB GLU 54 1HB GLU 54 19.292 0.596 -3.001 422 2HB GLU 54 2HB GLU 54 20.034 -0.718 -3.911 423 1HG GLU 54 1HG GLU 54 21.156 1.006 -5.426 424 2HG GLU 54 2HG GLU 54 20.362 2.301 -4.535 425 HE2 GLU 54 HE2 GLU 54 23.607 0.403 -3.079 426 NH1 ARG 55 NH2 ARG 55 24.229 -0.022 -10.061 427 NH2 ARG 55 NH1 ARG 55 25.397 1.869 -9.586 428 H ARG 55 H ARG 55 18.885 1.522 -7.316 429 HA ARG 55 HA ARG 55 17.922 -0.310 -9.126 430 1HB ARG 55 1HB ARG 55 19.207 1.119 -10.657 431 2HB ARG 55 2HB ARG 55 18.636 2.052 -9.329 432 1HG ARG 55 1HG ARG 55 20.762 2.744 -8.837 433 2HG ARG 55 2HG ARG 55 21.236 1.171 -8.412 434 1HD ARG 55 1HD ARG 55 21.824 0.604 -10.812 435 2HD ARG 55 2HD ARG 55 21.454 2.247 -11.290 436 1HH1 ARG 55 2HH2 ARG 55 23.328 -0.442 -10.314 437 2HH1 ARG 55 1HH2 ARG 55 25.118 -0.514 -9.915 438 1HH2 ARG 55 1HH1 ARG 55 25.390 2.889 -9.475 439 2HH2 ARG 55 2HH1 ARG 55 26.202 1.244 -9.474 440 H ALA 56 H ALA 56 18.893 -1.300 -10.942 441 HA ALA 56 HA ALA 56 21.676 -2.450 -10.650 442 1HB ALA 56 2HB ALA 56 19.895 -4.235 -10.145 443 2HB ALA 56 3HB ALA 56 19.175 -3.943 -11.751 444 3HB ALA 56 1HB ALA 56 20.812 -4.634 -11.615 445 H ALA 57 H ALA 57 20.743 -0.095 -12.157 446 HA ALA 57 HA ALA 57 20.734 0.697 -14.510 447 1HB ALA 57 3HB ALA 57 22.791 1.280 -13.277 448 2HB ALA 57 1HB ALA 57 23.580 -0.212 -13.853 449 3HB ALA 57 2HB ALA 57 23.118 1.072 -15.011 450 NH1 ARG 58 NH2 ARG 58 23.816 -5.303 -16.092 451 NH2 ARG 58 NH1 ARG 58 23.061 -5.670 -13.980 452 H ARG 58 H ARG 58 19.314 -0.517 -15.546 453 HA ARG 58 HA ARG 58 20.534 -2.075 -17.717 454 1HB ARG 58 2HB ARG 58 19.401 -3.177 -15.362 455 2HB ARG 58 1HB ARG 58 18.020 -3.200 -16.335 456 1HG ARG 58 1HG ARG 58 18.913 -5.190 -16.479 457 2HG ARG 58 2HG ARG 58 19.182 -4.383 -18.038 458 1HD ARG 58 1HD ARG 58 21.197 -5.745 -17.602 459 2HD ARG 58 2HD ARG 58 21.664 -4.056 -17.407 460 1HH1 ARG 58 2HH2 ARG 58 23.587 -5.076 -17.066 461 2HH1 ARG 58 1HH2 ARG 58 24.751 -5.479 -15.706 462 1HH2 ARG 58 1HH1 ARG 58 22.259 -5.722 -13.342 463 2HH2 ARG 58 2HH1 ARG 58 24.047 -5.821 -13.742 464 H LYS 59 H LYS 59 17.716 -2.765 -17.811 465 HA LYS 59 HA LYS 59 15.914 -0.827 -18.915 466 1HB LYS 59 1HB LYS 59 15.801 -1.170 -21.363 467 2HB LYS 59 2HB LYS 59 17.229 -0.314 -20.839 468 1HG LYS 59 1HG LYS 59 18.612 -2.434 -21.127 469 2HG LYS 59 2HG LYS 59 17.173 -3.271 -21.714 470 1HD LYS 59 1HD LYS 59 16.969 -1.613 -23.609 471 2HD LYS 59 2HD LYS 59 18.402 -0.760 -23.022 472 1HE LYS 59 1HE LYS 59 19.802 -2.851 -23.379 473 2HE LYS 59 2HE LYS 59 18.369 -3.715 -23.958 474 1HZ LYS 59 1HZ LYS 59 19.706 -2.827 -25.754 475 2HZ LYS 59 2HZ LYS 59 19.553 -1.295 -25.205 476 H GLY 60 H GLY 60 13.942 -1.894 -18.560 477 1HA GLY 60 1HA GLY 60 13.653 -4.806 -19.145 478 2HA GLY 60 2HA GLY 60 13.814 -4.487 -17.414 479 NH1 ARG 61 NH2 ARG 61 6.968 -5.339 -22.552 480 NH2 ARG 61 NH1 ARG 61 8.310 -6.671 -23.812 481 H ARG 61 H ARG 61 11.637 -5.668 -18.209 482 HA ARG 61 HA ARG 61 9.380 -3.675 -17.756 483 1HB ARG 61 1HB ARG 61 9.303 -5.531 -20.204 484 2HB ARG 61 2HB ARG 61 8.184 -4.233 -19.776 485 1HG ARG 61 1HG ARG 61 10.066 -2.578 -20.411 486 2HG ARG 61 2HG ARG 61 10.995 -3.946 -20.983 487 1HD ARG 61 1HD ARG 61 8.232 -3.065 -22.057 488 2HD ARG 61 2HD ARG 61 9.778 -2.732 -22.797 489 1HH1 ARG 61 1HH2 ARG 61 6.238 -6.039 -22.728 490 2HH1 ARG 61 2HH2 ARG 61 6.875 -4.481 -21.998 491 1HH2 ARG 61 1HH1 ARG 61 9.237 -6.831 -24.220 492 2HH2 ARG 61 2HH1 ARG 61 7.487 -7.277 -23.900 493 H ASN 62 H ASN 62 7.328 -4.645 -17.643 494 HA ASN 62 HA ASN 62 5.724 -6.036 -16.956 495 1HB ASN 62 1HB ASN 62 5.357 -7.965 -18.349 496 2HB ASN 62 2HB ASN 62 5.853 -6.542 -19.200 497 1HD2 ASN 62 2HD2 ASN 62 8.172 -9.855 -19.579 498 2HD2 ASN 62 1HD2 ASN 62 7.062 -9.655 -18.123 499 HA PRO 63 HA PRO 63 6.849 -8.740 -13.368 500 1HB PRO 63 1HB PRO 63 4.245 -7.429 -12.442 501 2HB PRO 63 2HB PRO 63 5.666 -7.886 -11.482 502 1HG PRO 63 1HG PRO 63 5.312 -5.290 -12.236 503 2HG PRO 63 2HG PRO 63 6.938 -6.006 -12.315 504 1HD PRO 63 1HD PRO 63 4.998 -5.505 -14.624 505 2HD PRO 63 2HD PRO 63 6.773 -5.304 -14.556 506 H GLN 64 H GLN 64 3.494 -8.153 -14.453 507 HA GLN 64 HA GLN 64 3.286 -10.926 -15.588 508 1HB GLN 64 1HB GLN 64 0.669 -9.832 -15.908 509 2HB GLN 64 2HB GLN 64 1.151 -11.310 -15.200 510 1HG GLN 64 1HG GLN 64 -0.243 -10.349 -13.552 511 2HG GLN 64 2HG GLN 64 1.376 -10.063 -12.906 512 1HE2 GLN 64 1HE2 GLN 64 0.800 -6.500 -12.849 513 2HE2 GLN 64 2HE2 GLN 64 1.787 -7.949 -12.306 514 H THR 65 H THR 65 1.410 -7.923 -16.248 515 HA THR 65 HA THR 65 3.536 -6.885 -18.077 516 HB THR 65 HB THR 65 2.042 -6.258 -19.570 517 HG1 THR 65 HG1 THR 65 0.339 -5.588 -18.239 518 1HG2 THR 65 2HG2 THR 65 2.402 -8.869 -19.472 519 2HG2 THR 65 3HG2 THR 65 0.932 -9.000 -18.503 520 3HG2 THR 65 1HG2 THR 65 0.780 -8.507 -20.199 521 H GLY 66 H GLY 66 3.072 -5.912 -15.267 522 1HA GLY 66 1HA GLY 66 1.416 -3.365 -15.526 523 2HA GLY 66 2HA GLY 66 2.196 -3.949 -14.074 524 H GLU 67 H GLU 67 4.418 -3.856 -16.875 525 HA GLU 67 HA GLU 67 5.274 -1.028 -16.177 526 1HB GLU 67 2HB GLU 67 6.038 -3.080 -14.555 527 2HB GLU 67 1HB GLU 67 7.123 -3.475 -15.843 528 1HG GLU 67 1HG GLU 67 8.360 -2.152 -14.230 529 2HG GLU 67 2HG GLU 67 8.107 -1.067 -15.588 530 HE1 GLU 67 HE2 GLU 67 6.309 -0.445 -12.006 531 H GLU 68 H GLU 68 6.960 -0.261 -17.323 532 HA GLU 68 HA GLU 68 8.426 -1.748 -19.269 533 1HB GLU 68 1HB GLU 68 7.991 -0.580 -21.394 534 2HB GLU 68 2HB GLU 68 6.673 -1.594 -20.886 535 1HG GLU 68 1HG GLU 68 6.685 1.494 -20.702 536 2HG GLU 68 2HG GLU 68 5.991 0.549 -21.996 537 HE2 GLU 68 HE2 GLU 68 3.935 1.215 -18.665 538 H MET 69 H MET 69 10.471 -0.857 -18.619 539 HA MET 69 HA MET 69 10.720 2.128 -18.473 540 1HB MET 69 1HB MET 69 11.180 2.370 -16.164 541 2HB MET 69 2HB MET 69 9.686 1.482 -16.243 542 1HG MET 69 1HG MET 69 12.461 0.281 -15.588 543 2HG MET 69 2HG MET 69 11.192 0.669 -14.422 544 1HE MET 69 2HE MET 69 12.344 -2.112 -14.201 545 2HE MET 69 1HE MET 69 11.606 -3.427 -15.180 546 3HE MET 69 3HE MET 69 12.755 -2.304 -15.930 547 H GLU 70 H GLU 70 12.781 2.948 -17.893 548 HA GLU 70 HA GLU 70 15.110 1.336 -18.908 549 1HB GLU 70 2HB GLU 70 14.126 4.007 -19.326 550 2HB GLU 70 1HB GLU 70 15.365 4.275 -18.175 551 1HG GLU 70 1HG GLU 70 15.648 2.693 -20.857 552 2HG GLU 70 2HG GLU 70 15.830 4.432 -20.742 553 HE2 GLU 70 HE2 GLU 70 18.895 2.077 -19.950 554 H ILE 71 H ILE 71 16.301 0.305 -17.255 555 HA ILE 71 HA ILE 71 15.596 0.789 -14.476 556 HB ILE 71 HB ILE 71 17.300 -1.346 -15.868 557 1HG1 ILE 71 1HG1 ILE 71 14.697 -1.463 -14.230 558 2HG1 ILE 71 2HG1 ILE 71 14.763 -1.406 -15.982 559 1HG2 ILE 71 2HG2 ILE 71 18.380 -0.814 -13.743 560 2HG2 ILE 71 3HG2 ILE 71 16.818 -1.001 -12.882 561 3HG2 ILE 71 1HG2 ILE 71 17.602 -2.406 -13.711 562 1HD1 ILE 71 2HD1 ILE 71 15.957 -3.725 -14.321 563 2HD1 ILE 71 3HD1 ILE 71 14.406 -3.737 -15.160 564 3HD1 ILE 71 1HD1 ILE 71 15.896 -3.620 -16.103 565 HA PRO 72 HA PRO 72 20.247 2.683 -14.073 566 1HB PRO 72 1HB PRO 72 19.326 4.951 -15.917 567 2HB PRO 72 2HB PRO 72 20.991 4.531 -15.425 568 1HG PRO 72 1HG PRO 72 20.104 3.449 -17.741 569 2HG PRO 72 2HG PRO 72 20.871 2.346 -16.566 570 1HD PRO 72 1HD PRO 72 17.880 2.735 -17.071 571 2HD PRO 72 2HD PRO 72 18.779 1.220 -16.793 572 H ALA 73 H ALA 73 20.828 4.070 -12.509 573 HA ALA 73 HA ALA 73 19.468 3.540 -10.641 574 1HB ALA 73 1HB ALA 73 21.539 4.471 -9.971 575 2HB ALA 73 2HB ALA 73 20.764 6.118 -9.816 576 3HB ALA 73 3HB ALA 73 20.253 4.767 -8.817 577 H SER 74 H SER 74 18.128 3.545 -9.455 578 HA SER 74 HA SER 74 17.195 5.857 -8.057 579 1HB SER 74 1HB SER 74 15.033 4.490 -9.838 580 2HB SER 74 2HB SER 74 14.527 5.319 -8.359 581 HG SER 74 HG SER 74 14.442 6.655 -10.167 582 H LYS 75 H LYS 75 16.278 5.430 -6.070 583 HA LYS 75 HA LYS 75 16.190 2.541 -5.082 584 1HB LYS 75 2HB LYS 75 15.248 4.709 -3.270 585 2HB LYS 75 1HB LYS 75 15.889 3.119 -2.962 586 1HG LYS 75 1HG LYS 75 18.205 3.894 -3.645 587 2HG LYS 75 2HG LYS 75 17.565 5.525 -3.885 588 1HD LYS 75 1HD LYS 75 16.844 5.588 -1.443 589 2HD LYS 75 2HD LYS 75 17.518 3.970 -1.215 590 1HE LYS 75 1HE LYS 75 19.824 4.836 -1.852 591 2HE LYS 75 2HE LYS 75 19.151 6.460 -2.064 592 1HZ LYS 75 1HZ LYS 75 18.506 6.456 0.256 593 2HZ LYS 75 2HZ LYS 75 20.114 6.217 0.097 594 H VAL 76 H VAL 76 14.208 1.471 -5.628 595 HA VAL 76 HA VAL 76 12.005 3.052 -6.595 596 HB VAL 76 HB VAL 76 13.688 0.621 -7.069 597 1HG1 VAL 76 3HG2 VAL 76 10.835 0.462 -7.761 598 2HG1 VAL 76 1HG2 VAL 76 12.237 -0.602 -8.313 599 3HG1 VAL 76 2HG2 VAL 76 11.769 -0.551 -6.600 600 1HG2 VAL 76 2HG1 VAL 76 13.942 2.645 -8.378 601 2HG2 VAL 76 3HG1 VAL 76 13.534 1.217 -9.336 602 3HG2 VAL 76 1HG1 VAL 76 12.272 2.456 -8.996 603 HA PRO 77 HA PRO 77 10.056 1.654 -2.643 604 1HB PRO 77 1HB PRO 77 7.839 3.339 -2.670 605 2HB PRO 77 2HB PRO 77 9.486 3.965 -2.486 606 1HG PRO 77 1HG PRO 77 7.842 3.782 -5.067 607 2HG PRO 77 2HG PRO 77 8.673 5.203 -4.421 608 1HD PRO 77 1HD PRO 77 9.828 3.417 -6.367 609 2HD PRO 77 2HD PRO 77 10.871 4.282 -5.203 610 H ALA 78 H ALA 78 8.953 0.218 -2.086 611 HA ALA 78 HA ALA 78 6.703 -1.048 -3.739 612 1HB ALA 78 2HB ALA 78 9.039 -2.114 -3.872 613 2HB ALA 78 3HB ALA 78 8.970 -2.408 -2.120 614 3HB ALA 78 1HB ALA 78 7.799 -3.201 -3.202 615 H PHE 79 H PHE 79 5.520 -2.569 -2.417 616 HA PHE 79 HA PHE 79 4.909 -1.851 0.533 617 1HB PHE 79 2HB PHE 79 3.710 -0.195 -0.257 618 2HB PHE 79 1HB PHE 79 3.078 -1.168 -1.627 619 HD1 PHE 79 HD1 PHE 79 2.800 -0.756 2.110 620 HD2 PHE 79 HD2 PHE 79 1.082 -2.528 -1.414 621 HE1 PHE 79 HE1 PHE 79 0.887 -1.563 3.430 622 HE2 PHE 79 HE2 PHE 79 -0.783 -3.384 -0.067 623 HZ PHE 79 HZ PHE 79 -0.863 -2.951 2.355 624 H LYS 80 H LYS 80 4.797 -3.749 1.174 625 HA LYS 80 HA LYS 80 3.881 -6.426 -0.199 626 1HB LYS 80 2HB LYS 80 5.154 -5.897 2.507 627 2HB LYS 80 1HB LYS 80 4.445 -7.429 2.058 628 1HG LYS 80 1HG LYS 80 6.025 -7.683 0.144 629 2HG LYS 80 2HG LYS 80 6.725 -6.094 0.458 630 1HD LYS 80 1HD LYS 80 7.553 -6.832 2.682 631 2HD LYS 80 2HD LYS 80 6.799 -8.419 2.483 632 1HE LYS 80 1HE LYS 80 8.289 -8.890 0.494 633 2HE LYS 80 2HE LYS 80 9.009 -7.279 0.632 634 1HZ LYS 80 1HZ LYS 80 10.379 -8.906 1.693 635 2HZ LYS 80 2HZ LYS 80 9.820 -7.864 2.822 636 HA PRO 81 HA PRO 81 -0.073 -5.635 1.960 637 1HB PRO 81 1HB PRO 81 -1.465 -7.861 1.142 638 2HB PRO 81 2HB PRO 81 -0.937 -6.631 -0.010 639 1HG PRO 81 1HG PRO 81 0.453 -9.290 0.637 640 2HG PRO 81 2HG PRO 81 -0.026 -8.681 -0.969 641 1HD PRO 81 1HD PRO 81 2.536 -8.334 0.117 642 2HD PRO 81 2HD PRO 81 1.819 -7.161 -1.034 643 H GLY 82 H GLY 82 2.136 -6.529 3.549 644 1HA GLY 82 1HA GLY 82 2.973 -8.046 5.238 645 2HA GLY 82 2HA GLY 82 1.423 -7.566 5.902 646 H LYS 83 H LYS 83 1.267 -9.594 3.172 647 HA LYS 83 HA LYS 83 0.490 -11.843 2.818 648 1HB LYS 83 2HB LYS 83 1.858 -12.289 5.460 649 2HB LYS 83 1HB LYS 83 0.469 -13.292 5.288 650 1HG LYS 83 1HG LYS 83 1.412 -14.133 3.023 651 2HG LYS 83 2HG LYS 83 2.804 -13.087 3.264 652 1HD LYS 83 1HD LYS 83 3.513 -15.268 3.893 653 2HD LYS 83 2HD LYS 83 3.387 -14.354 5.391 654 1HE LYS 83 1HE LYS 83 1.132 -15.471 5.862 655 2HE LYS 83 2HE LYS 83 1.261 -16.358 4.336 656 1HZ LYS 83 1HZ LYS 83 3.181 -16.549 6.593 657 2HZ LYS 83 2HZ LYS 83 3.309 -17.367 5.183 658 H ALA 84 H ALA 84 -0.431 -10.539 5.754 659 HA ALA 84 HA ALA 84 -3.007 -11.685 6.401 660 1HB ALA 84 2HB ALA 84 -1.434 -10.445 7.903 661 2HB ALA 84 3HB ALA 84 -1.635 -8.962 6.932 662 3HB ALA 84 1HB ALA 84 -3.018 -9.598 7.864 663 H LEU 85 H LEU 85 -2.271 -8.509 4.683 664 HA LEU 85 HA LEU 85 -5.073 -7.945 4.070 665 1HB LEU 85 2HB LEU 85 -3.411 -6.102 4.120 666 2HB LEU 85 1HB LEU 85 -2.477 -6.880 2.860 667 HG LEU 85 HG LEU 85 -4.576 -6.829 1.466 668 1HD1 LEU 85 3HD1 LEU 85 -6.272 -6.163 3.137 669 2HD1 LEU 85 1HD1 LEU 85 -5.420 -4.630 3.416 670 3HD1 LEU 85 2HD1 LEU 85 -6.205 -4.948 1.845 671 1HD2 LEU 85 1HD2 LEU 85 -2.514 -5.373 1.052 672 2HD2 LEU 85 2HD2 LEU 85 -3.989 -4.551 0.555 673 3HD2 LEU 85 3HD2 LEU 85 -3.199 -4.109 2.094 674 H LYS 86 H LYS 86 -2.464 -9.726 2.452 675 HA LYS 86 HA LYS 86 -3.868 -10.272 -0.042 676 1HB LYS 86 1HB LYS 86 -1.339 -10.741 0.490 677 2HB LYS 86 2HB LYS 86 -1.879 -12.304 1.080 678 1HG LYS 86 1HG LYS 86 -2.950 -12.749 -1.190 679 2HG LYS 86 2HG LYS 86 -2.401 -11.164 -1.742 680 1HD LYS 86 1HD LYS 86 0.001 -11.866 -1.321 681 2HD LYS 86 2HD LYS 86 -0.539 -13.462 -0.823 682 1HE LYS 86 1HE LYS 86 -1.005 -12.225 -3.630 683 2HE LYS 86 2HE LYS 86 0.314 -13.316 -3.217 684 1HZ LYS 86 1HZ LYS 86 -1.337 -15.013 -2.647 685 2HZ LYS 86 2HZ LYS 86 -2.563 -14.011 -3.056 686 H ASP 87 H ASP 87 -4.397 -11.716 3.152 687 HA ASP 87 HA ASP 87 -6.230 -13.809 2.038 688 1HB ASP 87 1HB ASP 87 -4.682 -13.423 4.452 689 2HB ASP 87 2HB ASP 87 -6.278 -13.065 4.974 690 HD1 ASP 87 HD2 ASP 87 -7.393 -16.374 4.738 691 H ALA 88 H ALA 88 -6.539 -10.628 3.692 692 HA ALA 88 HA ALA 88 -9.409 -10.361 3.978 693 1HB ALA 88 1HB ALA 88 -7.653 -8.563 4.689 694 2HB ALA 88 2HB ALA 88 -7.428 -8.160 2.985 695 3HB ALA 88 3HB ALA 88 -8.985 -7.866 3.717 696 H VAL 89 H VAL 89 -7.317 -9.770 1.125 697 HA VAL 89 HA VAL 89 -9.450 -8.605 -0.509 698 HB VAL 89 HB VAL 89 -6.972 -7.871 0.269 699 1HG1 VAL 89 2HG2 VAL 89 -5.978 -10.126 -0.483 700 2HG1 VAL 89 3HG2 VAL 89 -6.096 -9.531 -2.145 701 3HG1 VAL 89 1HG2 VAL 89 -5.147 -8.632 -0.914 702 1HG2 VAL 89 2HG1 VAL 89 -8.268 -6.621 -1.152 703 2HG2 VAL 89 3HG1 VAL 89 -6.545 -6.660 -1.602 704 3HG2 VAL 89 1HG1 VAL 89 -7.738 -7.610 -2.585 705 H LYS 90 H LYS 90 -7.997 -11.733 -0.230 706 HA LYS 90 HA LYS 90 -8.365 -12.691 -3.002 707 1HB LYS 90 1HB LYS 90 -7.462 -13.846 -0.337 708 2HB LYS 90 2HB LYS 90 -8.151 -14.990 -1.457 709 1HG LYS 90 1HG LYS 90 -6.527 -14.312 -3.259 710 2HG LYS 90 2HG LYS 90 -5.848 -13.098 -2.196 711 1HD LYS 90 1HD LYS 90 -4.330 -14.926 -2.055 712 2HD LYS 90 2HD LYS 90 -5.201 -14.942 -0.541 713 1HE LYS 90 1HE LYS 90 -4.966 -17.236 -1.259 714 2HE LYS 90 2HE LYS 90 -6.675 -16.843 -1.406 715 1HZ LYS 90 1HZ LYS 90 -6.346 -16.526 -3.784 716 2HZ LYS 90 2HZ LYS 90 -5.895 -18.027 -3.322 717 1H MET 1 1H MET 91 10.005 0.443 9.989 718 2H MET 1 2H MET 91 11.035 -0.416 11.004 719 HA MET 1 HA MET 91 9.906 0.527 12.597 720 1HB MET 1 1HB MET 91 7.611 0.853 10.557 721 2HB MET 1 2HB MET 91 7.424 1.227 12.245 722 1HG MET 1 1HG MET 91 7.956 3.326 11.587 723 2HG MET 1 2HG MET 91 9.607 2.797 11.875 724 1HE MET 1 1HE MET 91 8.052 5.088 9.780 725 2HE MET 1 3HE MET 91 8.116 4.584 8.065 726 3HE MET 1 2HE MET 91 6.909 3.862 9.160 727 H ASN 2 H ASN 92 6.948 -0.903 11.741 728 HA ASN 2 HA ASN 92 6.789 -3.416 12.091 729 1HB ASN 2 1HB ASN 92 6.620 -4.483 14.182 730 2HB ASN 2 2HB ASN 92 8.183 -3.737 14.033 731 1HD2 ASN 2 1HD2 ASN 92 7.820 -1.947 17.121 732 2HD2 ASN 2 2HD2 ASN 92 8.876 -2.372 15.683 733 H LYS 3 H LYS 93 5.542 -0.679 13.499 734 HA LYS 3 HA LYS 93 3.132 -0.048 12.738 735 1HB LYS 3 1HB LYS 93 2.169 -2.330 12.698 736 2HB LYS 3 2HB LYS 93 2.372 -2.511 14.425 737 1HG LYS 3 1HG LYS 93 0.562 -1.076 14.932 738 2HG LYS 3 2HG LYS 93 0.744 -0.105 13.494 739 1HD LYS 3 1HD LYS 93 -0.417 -2.961 13.437 740 2HD LYS 3 2HD LYS 93 -1.366 -1.494 13.641 741 1HE LYS 3 1HE LYS 93 -0.402 -0.622 11.397 742 2HE LYS 3 2HE LYS 93 0.331 -2.208 11.162 743 1HZ LYS 3 1HZ LYS 93 -1.798 -1.998 10.073 744 2HZ LYS 3 2HZ LYS 93 -2.565 -1.648 11.474 745 H THR 4 H THR 94 4.943 -0.848 15.705 746 HA THR 4 HA THR 94 3.536 1.130 17.299 747 HB THR 4 HB THR 94 5.777 -0.946 17.768 748 HG1 THR 4 HG1 THR 94 3.709 -1.876 17.314 749 1HG2 THR 4 3HG2 THR 94 4.063 0.782 19.573 750 2HG2 THR 4 1HG2 THR 94 5.105 -0.613 20.137 751 3HG2 THR 4 2HG2 THR 94 5.851 0.832 19.340 752 H GLU 5 H GLU 95 6.487 0.697 15.511 753 HA GLU 5 HA GLU 95 7.874 3.093 16.734 754 1HB GLU 5 1HB GLU 95 8.580 1.966 13.996 755 2HB GLU 5 2HB GLU 95 9.541 3.023 14.990 756 1HG GLU 5 1HG GLU 95 8.962 0.040 15.453 757 2HG GLU 5 2HG GLU 95 10.443 0.717 14.838 758 HE2 GLU 5 HE2 GLU 95 9.699 0.603 18.789 759 H LEU 6 H LEU 96 5.259 2.365 14.501 760 HA LEU 6 HA LEU 96 5.269 4.915 13.095 761 1HB LEU 6 2HB LEU 96 4.046 2.165 13.000 762 2HB LEU 6 1HB LEU 96 2.735 3.232 13.237 763 HG LEU 6 HG LEU 96 2.855 3.503 11.044 764 1HD1 LEU 6 2HD1 LEU 96 3.785 5.740 11.304 765 2HD1 LEU 6 3HD1 LEU 96 5.409 5.112 10.921 766 3HD1 LEU 6 1HD1 LEU 96 4.128 5.041 9.704 767 1HD2 LEU 6 2HD2 LEU 96 4.283 1.430 10.800 768 2HD2 LEU 6 3HD2 LEU 96 4.531 2.546 9.443 769 3HD2 LEU 6 1HD2 LEU 96 5.727 2.460 10.759 770 H ILE 7 H ILE 97 3.598 3.373 15.892 771 HA ILE 7 HA ILE 97 1.653 5.488 16.372 772 HB ILE 7 HB ILE 97 2.922 3.594 18.425 773 1HG1 ILE 7 1HG1 ILE 97 0.184 3.349 17.079 774 2HG1 ILE 7 2HG1 ILE 97 1.529 2.726 16.254 775 1HG2 ILE 7 2HG2 ILE 97 1.741 5.551 19.568 776 2HG2 ILE 7 3HG2 ILE 97 0.278 5.149 18.664 777 3HG2 ILE 7 1HG2 ILE 97 0.914 4.009 19.856 778 1HD1 ILE 7 2HD1 ILE 97 2.029 1.413 18.564 779 2HD1 ILE 7 3HD1 ILE 97 0.296 1.566 18.690 780 3HD1 ILE 7 1HD1 ILE 97 0.998 0.798 17.234 781 H ASN 8 H ASN 98 4.936 5.003 17.681 782 HA ASN 8 HA ASN 98 5.046 7.711 18.955 783 1HB ASN 8 1HB ASN 98 7.405 5.847 18.111 784 2HB ASN 8 2HB ASN 98 7.593 7.298 19.062 785 1HD2 ASN 8 2HD2 ASN 98 6.499 3.901 21.030 786 2HD2 ASN 8 1HD2 ASN 98 6.644 3.958 19.202 787 H ALA 9 H ALA 99 5.192 6.894 15.647 788 HA ALA 9 HA ALA 99 6.828 9.264 14.757 789 1HB ALA 9 2HB ALA 99 6.351 7.083 13.190 790 2HB ALA 9 3HB ALA 99 4.690 7.647 13.092 791 3HB ALA 9 1HB ALA 99 5.908 8.668 12.441 792 H VAL 10 H VAL 100 3.381 8.316 15.008 793 HA VAL 10 HA VAL 100 2.434 10.683 13.813 794 HB VAL 10 HB VAL 100 0.603 8.958 15.497 795 1HG1 VAL 10 3HG2 VAL 100 -0.011 11.057 13.921 796 2HG1 VAL 10 1HG2 VAL 100 -0.110 9.739 12.710 797 3HG1 VAL 10 2HG2 VAL 100 -1.083 9.640 14.185 798 1HG2 VAL 10 1HG1 VAL 100 2.041 8.108 12.980 799 2HG2 VAL 10 2HG1 VAL 100 1.740 7.306 14.560 800 3HG2 VAL 10 3HG1 VAL 100 0.395 7.449 13.392 801 H ALA 11 H ALA 101 2.378 9.394 16.959 802 HA ALA 11 HA ALA 101 1.363 11.783 18.084 803 1HB ALA 11 1HB ALA 101 1.181 9.518 19.240 804 2HB ALA 11 2HB ALA 101 2.943 9.498 19.502 805 3HB ALA 11 3HB ALA 101 1.914 10.681 20.374 806 H GLU 12 H GLU 102 4.668 11.027 17.255 807 HA GLU 12 HA GLU 102 5.743 13.345 18.837 808 1HB GLU 12 1HB GLU 102 7.226 11.385 18.453 809 2HB GLU 12 2HB GLU 102 7.096 11.578 16.702 810 1HG GLU 12 1HG GLU 102 8.293 13.786 16.836 811 2HG GLU 12 2HG GLU 102 8.356 13.668 18.593 812 HE1 GLU 12 HE2 GLU 102 9.367 12.367 15.645 813 H THR 13 H THR 103 5.102 12.660 15.319 814 HA THR 13 HA THR 103 5.443 15.627 14.862 815 HB THR 13 HB THR 103 6.497 13.694 13.556 816 HG1 THR 13 HG1 THR 103 5.421 15.973 12.271 817 1HG2 THR 13 3HG2 THR 103 4.526 12.550 12.671 818 2HG2 THR 13 1HG2 THR 103 4.057 14.019 11.773 819 3HG2 THR 13 2HG2 THR 103 5.577 13.165 11.379 820 H SER 14 H SER 104 3.051 14.320 15.892 821 HA SER 14 HA SER 104 1.176 16.510 14.774 822 1HB SER 14 1HB SER 104 0.062 13.706 15.388 823 2HB SER 14 2HB SER 104 -0.832 15.102 14.805 824 HG SER 14 HG SER 104 1.310 13.822 13.465 825 H GLY 15 H GLY 105 2.035 14.677 17.729 826 1HA GLY 15 1HA GLY 105 1.452 15.066 19.982 827 2HA GLY 15 2HA GLY 105 1.004 16.703 19.517 828 H LEU 16 H LEU 106 -0.221 13.454 19.084 829 HA LEU 16 HA LEU 106 -2.965 14.091 20.198 830 1HB LEU 16 1HB LEU 106 -3.829 12.291 18.859 831 2HB LEU 16 2HB LEU 106 -3.317 13.734 18.006 832 HG LEU 16 HG LEU 106 -1.392 12.807 17.205 833 1HD1 LEU 16 2HD1 LEU 106 -0.643 11.420 19.205 834 2HD1 LEU 16 3HD1 LEU 106 -1.859 10.221 18.665 835 3HD1 LEU 16 1HD1 LEU 106 -0.420 10.647 17.633 836 1HD2 LEU 16 2HD2 LEU 106 -2.852 12.414 15.651 837 2HD2 LEU 16 3HD2 LEU 106 -1.400 11.379 15.688 838 3HD2 LEU 16 1HD2 LEU 106 -2.932 10.700 16.207 839 H SER 17 H SER 107 -2.657 11.159 20.214 840 HA SER 17 HA SER 107 -1.407 10.705 22.975 841 1HB SER 17 1HB SER 107 -4.092 9.415 22.327 842 2HB SER 17 2HB SER 107 -3.145 9.257 23.786 843 HG SER 17 HG SER 107 -3.378 11.492 24.141 844 H LYS 18 H LYS 108 -0.820 8.513 23.387 845 HA LYS 18 HA LYS 108 0.332 7.038 21.021 846 1HB LYS 18 1HB LYS 108 0.189 6.079 23.938 847 2HB LYS 18 2HB LYS 108 1.043 5.268 22.640 848 1HG LYS 18 1HG LYS 108 1.718 8.081 23.707 849 2HG LYS 18 2HG LYS 108 2.517 6.597 24.186 850 1HD LYS 18 1HD LYS 108 3.454 6.250 21.909 851 2HD LYS 18 2HD LYS 108 2.506 7.578 21.265 852 1HE LYS 18 1HE LYS 108 4.754 8.389 21.524 853 2HE LYS 18 2HE LYS 108 3.742 9.241 22.685 854 1HZ LYS 18 1HZ LYS 108 4.566 7.765 24.418 855 2HZ LYS 18 2HZ LYS 108 5.794 8.555 23.682 856 H LYS 19 H LYS 109 -2.381 6.486 23.245 857 HA LYS 19 HA LYS 109 -3.561 4.212 21.763 858 1HB LYS 19 2HB LYS 109 -4.915 6.260 23.620 859 2HB LYS 19 1HB LYS 109 -5.768 4.890 22.896 860 1HG LYS 19 1HG LYS 109 -4.176 3.287 24.025 861 2HG LYS 19 2HG LYS 109 -3.351 4.646 24.792 862 1HD LYS 19 1HD LYS 109 -5.504 5.314 25.940 863 2HD LYS 19 2HD LYS 109 -6.338 3.959 25.171 864 1HE LYS 19 1HE LYS 109 -4.778 2.328 26.347 865 2HE LYS 19 2HE LYS 109 -3.942 3.684 27.118 866 1HZ LYS 19 1HZ LYS 109 -6.055 4.309 28.152 867 2HZ LYS 19 2HZ LYS 109 -6.825 3.053 27.443 868 H ASP 20 H ASP 110 -3.878 7.816 21.273 869 HA ASP 20 HA ASP 110 -5.963 7.412 19.129 870 1HB ASP 20 1HB ASP 110 -4.412 9.889 20.084 871 2HB ASP 20 2HB ASP 110 -5.221 9.936 18.544 872 HD2 ASP 20 HD2 ASP 110 -7.340 10.262 21.891 873 H ALA 21 H ALA 111 -2.457 7.579 19.147 874 HA ALA 21 HA ALA 111 -2.152 7.754 16.192 875 1HB ALA 21 1HB ALA 111 -0.198 7.249 18.516 876 2HB ALA 21 2HB ALA 111 0.293 7.177 16.796 877 3HB ALA 21 3HB ALA 111 -0.369 8.638 17.475 878 H THR 22 H THR 112 -2.126 5.005 18.546 879 HA THR 22 HA THR 112 -1.696 2.853 16.661 880 HB THR 22 HB THR 112 -3.494 2.680 19.174 881 HG1 THR 22 HG1 THR 112 -1.626 2.325 20.334 882 1HG2 THR 22 2HG2 THR 112 -1.525 0.769 17.778 883 2HG2 THR 22 3HG2 THR 112 -2.254 0.459 19.381 884 3HG2 THR 22 1HG2 THR 112 -3.290 0.586 17.913 885 H LYS 23 H LYS 113 -4.669 4.284 17.786 886 HA LYS 23 HA LYS 113 -6.558 2.809 16.080 887 1HB LYS 23 2HB LYS 113 -6.519 5.706 17.266 888 2HB LYS 23 1HB LYS 113 -7.897 5.150 16.390 889 1HG LYS 23 1HG LYS 113 -8.355 3.322 18.062 890 2HG LYS 23 2HG LYS 113 -6.905 3.758 18.964 891 1HD LYS 23 1HD LYS 113 -7.879 6.097 19.340 892 2HD LYS 23 2HD LYS 113 -9.353 5.587 18.511 893 1HE LYS 23 1HE LYS 113 -9.696 3.770 20.271 894 2HE LYS 23 2HE LYS 113 -8.220 4.302 21.095 895 1HZ LYS 23 1HZ LYS 113 -10.649 5.947 20.646 896 2HZ LYS 23 2HZ LYS 113 -10.204 5.258 22.059 897 H ALA 24 H ALA 114 -5.157 5.992 15.639 898 HA ALA 24 HA ALA 114 -6.309 6.676 13.142 899 1HB ALA 24 2HB ALA 114 -5.396 8.253 14.640 900 2HB ALA 24 3HB ALA 114 -3.735 7.603 14.433 901 3HB ALA 24 1HB ALA 114 -4.576 8.425 13.065 902 H VAL 25 H VAL 115 -3.229 4.978 13.633 903 HA VAL 25 HA VAL 115 -2.580 4.488 10.737 904 HB VAL 25 HB VAL 115 -2.019 3.340 13.648 905 1HG1 VAL 25 2HG2 VAL 115 -1.019 1.888 11.120 906 2HG1 VAL 25 3HG2 VAL 115 -0.481 1.581 12.805 907 3HG1 VAL 25 1HG2 VAL 115 -2.135 1.241 12.333 908 1HG2 VAL 25 1HG1 VAL 115 -0.721 5.319 12.906 909 2HG2 VAL 25 2HG1 VAL 115 0.278 3.922 13.324 910 3HG2 VAL 25 3HG1 VAL 115 0.019 4.340 11.601 911 H ASP 26 H ASP 116 -4.217 2.352 13.170 912 HA ASP 26 HA ASP 116 -5.506 0.701 10.989 913 1HB ASP 26 1HB ASP 116 -5.988 0.853 14.036 914 2HB ASP 26 2HB ASP 116 -6.799 -0.295 12.985 915 HD2 ASP 26 HD2 ASP 116 -3.081 -1.009 14.249 916 H ALA 27 H ALA 117 -6.070 3.543 11.380 917 HA ALA 27 HA ALA 117 -9.068 3.653 10.916 918 1HB ALA 27 1HB ALA 117 -7.914 5.169 12.790 919 2HB ALA 27 2HB ALA 117 -7.442 6.133 11.394 920 3HB ALA 27 3HB ALA 117 -9.145 5.820 11.792 921 H VAL 28 H VAL 118 -6.022 4.898 9.625 922 HA VAL 28 HA VAL 118 -6.966 5.569 6.891 923 HB VAL 28 HB VAL 118 -4.147 4.622 7.872 924 1HG1 VAL 28 2HG2 VAL 118 -5.125 5.704 5.191 925 2HG1 VAL 28 3HG2 VAL 118 -3.470 6.006 5.712 926 3HG1 VAL 28 1HG2 VAL 118 -3.998 4.330 5.578 927 1HG2 VAL 28 1HG1 VAL 118 -4.785 6.703 8.885 928 2HG2 VAL 28 2HG1 VAL 118 -3.380 6.781 7.767 929 3HG2 VAL 28 3HG1 VAL 118 -5.003 7.411 7.217 930 H PHE 29 H PHE 119 -5.093 2.978 8.175 931 HA PHE 29 HA PHE 119 -5.215 1.138 5.893 932 1HB PHE 29 2HB PHE 119 -4.273 0.466 8.719 933 2HB PHE 29 1HB PHE 119 -3.957 -0.521 7.306 934 HD1 PHE 29 HD1 PHE 119 -3.069 1.121 5.148 935 HD2 PHE 29 HD2 PHE 119 -2.259 1.590 9.331 936 HE1 PHE 29 HE1 PHE 119 -1.327 2.760 4.620 937 HE2 PHE 29 HE2 PHE 119 -0.530 3.255 8.804 938 HZ PHE 29 HZ PHE 119 -0.194 3.940 6.433 939 H ASP 30 H ASP 120 -7.552 1.479 8.365 940 HA ASP 30 HA ASP 120 -8.771 -1.189 7.749 941 1HB ASP 30 1HB ASP 120 -9.003 0.212 9.976 942 2HB ASP 30 2HB ASP 120 -10.220 1.156 9.165 943 HD2 ASP 30 HD2 ASP 120 -12.714 -1.219 9.306 944 H SER 31 H SER 121 -9.284 2.079 6.860 945 HA SER 31 HA SER 121 -11.692 1.625 5.087 946 1HB SER 31 2HB SER 121 -9.904 4.112 5.315 947 2HB SER 31 1HB SER 121 -11.343 3.984 4.278 948 HG SER 31 HG SER 121 -11.273 3.554 7.081 949 H ILE 32 H ILE 122 -8.048 1.811 4.392 950 HA ILE 32 HA ILE 122 -8.165 1.436 1.614 951 HB ILE 32 HB ILE 122 -6.024 0.299 3.402 952 1HG1 ILE 32 1HG1 ILE 122 -6.896 3.136 3.039 953 2HG1 ILE 32 2HG1 ILE 122 -6.296 2.208 4.396 954 1HG2 ILE 32 3HG2 ILE 122 -6.231 0.032 0.734 955 2HG2 ILE 32 1HG2 ILE 122 -5.744 1.706 0.702 956 3HG2 ILE 32 2HG2 ILE 122 -4.667 0.512 1.431 957 1HD1 ILE 32 1HD1 ILE 122 -4.451 3.158 2.225 958 2HD1 ILE 32 2HD1 ILE 122 -4.969 4.130 3.628 959 3HD1 ILE 32 3HD1 ILE 122 -4.082 2.596 3.916 960 H THR 33 H THR 123 -7.749 -1.020 4.169 961 HA THR 33 HA THR 123 -8.011 -3.277 2.258 962 HB THR 33 HB THR 123 -7.072 -3.724 4.476 963 HG1 THR 33 HG1 THR 123 -9.520 -5.088 4.266 964 1HG2 THR 33 2HG2 THR 123 -8.514 -2.083 5.775 965 2HG2 THR 33 3HG2 THR 123 -9.797 -3.270 5.822 966 3HG2 THR 33 1HG2 THR 123 -8.209 -3.602 6.617 967 H GLU 34 H GLU 124 -10.519 -1.384 3.824 968 HA GLU 34 HA GLU 124 -12.766 -3.074 2.800 969 1HB GLU 34 1HB GLU 124 -13.021 -1.521 4.806 970 2HB GLU 34 2HB GLU 124 -12.794 -0.129 3.752 971 1HG GLU 34 1HG GLU 124 -14.904 -0.750 2.487 972 2HG GLU 34 2HG GLU 124 -15.102 -2.180 3.493 973 HE1 GLU 34 HE2 GLU 124 -16.338 -0.499 6.248 974 H ALA 35 H ALA 125 -10.921 -0.278 1.538 975 HA ALA 35 HA ALA 125 -12.430 -0.102 -0.965 976 1HB ALA 35 2HB ALA 125 -10.568 1.741 -0.120 977 2HB ALA 35 3HB ALA 125 -9.357 0.560 -0.551 978 3HB ALA 35 1HB ALA 125 -10.333 1.250 -1.800 979 H LEU 36 H LEU 126 -9.347 -1.802 -0.217 980 HA LEU 36 HA LEU 126 -8.954 -3.045 -2.811 981 1HB LEU 36 2HB LEU 126 -7.907 -4.042 -0.229 982 2HB LEU 36 1HB LEU 126 -7.226 -4.218 -1.832 983 HG LEU 36 HG LEU 126 -7.288 -1.602 -0.263 984 1HD1 LEU 36 3HD2 LEU 126 -5.369 -2.914 0.167 985 2HD1 LEU 36 1HD2 LEU 126 -4.980 -2.987 -1.613 986 3HD1 LEU 36 2HD2 LEU 126 -4.947 -1.427 -0.721 987 1HD2 LEU 36 3HD1 LEU 126 -8.006 -0.961 -2.563 988 2HD2 LEU 36 1HD1 LEU 126 -6.422 -0.343 -2.156 989 3HD2 LEU 36 2HD1 LEU 126 -6.565 -1.784 -3.228 990 NH1 ARG 37 NH2 ARG 127 -12.354 -4.850 5.421 991 NH2 ARG 37 NH1 ARG 127 -14.528 -4.225 5.620 992 H ARG 37 H ARG 127 -10.483 -4.351 0.203 993 HA ARG 37 HA ARG 127 -10.916 -6.869 -1.103 994 1HB ARG 37 1HB ARG 127 -12.174 -7.706 0.707 995 2HB ARG 37 2HB ARG 127 -10.906 -6.716 1.395 996 1HG ARG 37 1HG ARG 127 -12.672 -4.823 1.638 997 2HG ARG 37 2HG ARG 127 -13.902 -5.949 1.104 998 1HD ARG 37 1HD ARG 127 -13.536 -7.449 2.947 999 2HD ARG 37 2HD ARG 127 -12.094 -6.572 3.484 1000 1HH1 ARG 37 2HH2 ARG 127 -11.651 -5.384 4.898 1001 2HH1 ARG 37 1HH2 ARG 127 -12.195 -4.279 6.259 1002 1HH2 ARG 37 1HH1 ARG 127 -15.485 -4.281 5.255 1003 2HH2 ARG 37 2HH1 ARG 127 -14.213 -3.696 6.441 1004 H LYS 38 H LYS 128 -12.676 -3.828 -1.180 1005 HA LYS 38 HA LYS 128 -15.225 -5.168 -2.129 1006 1HB LYS 38 1HB LYS 128 -15.241 -3.519 -0.184 1007 2HB LYS 38 2HB LYS 128 -14.903 -2.237 -1.342 1008 1HG LYS 38 1HG LYS 128 -17.118 -2.839 -2.502 1009 2HG LYS 38 2HG LYS 128 -17.394 -4.071 -1.281 1010 1HD LYS 38 1HD LYS 128 -17.082 -1.038 -0.761 1011 2HD LYS 38 2HD LYS 128 -18.612 -1.890 -0.909 1012 1HE LYS 38 1HE LYS 128 -18.061 -3.280 1.149 1013 2HE LYS 38 2HE LYS 128 -16.532 -2.408 1.325 1014 1HZ LYS 38 1HZ LYS 128 -19.232 -1.192 1.425 1015 2HZ LYS 38 2HZ LYS 128 -18.261 -1.487 2.706 1016 H GLY 39 H GLY 129 -12.498 -4.120 -3.655 1017 1HA GLY 39 1HA GLY 129 -12.039 -3.505 -5.930 1018 2HA GLY 39 2HA GLY 129 -13.746 -3.596 -6.291 1019 H ASP 40 H ASP 130 -12.306 -1.430 -3.905 1020 HA ASP 40 HA ASP 130 -12.954 1.029 -5.579 1021 1HB ASP 40 1HB ASP 130 -12.600 1.147 -2.601 1022 2HB ASP 40 2HB ASP 130 -13.177 2.381 -3.667 1023 HD1 ASP 40 HD2 ASP 130 -16.384 1.048 -4.107 1024 H LYS 41 H LYS 131 -11.619 2.632 -5.977 1025 HA LYS 41 HA LYS 131 -8.661 2.119 -5.616 1026 1HB LYS 41 2HB LYS 131 -9.847 4.569 -6.957 1027 2HB LYS 41 1HB LYS 131 -8.164 4.060 -6.983 1028 1HG LYS 41 1HG LYS 131 -8.838 1.987 -8.294 1029 2HG LYS 41 2HG LYS 131 -10.485 2.587 -8.383 1030 1HD LYS 41 1HD LYS 131 -7.998 4.085 -9.448 1031 2HD LYS 41 2HD LYS 131 -9.007 3.053 -10.435 1032 1HE LYS 41 1HE LYS 131 -9.978 5.650 -9.056 1033 2HE LYS 41 2HE LYS 131 -9.449 5.521 -10.728 1034 1HZ LYS 41 1HZ LYS 131 -11.816 5.422 -10.591 1035 2HZ LYS 41 2HZ LYS 131 -11.251 4.005 -11.179 1036 H VAL 42 H VAL 132 -7.640 2.958 -3.876 1037 HA VAL 42 HA VAL 132 -8.625 5.117 -2.222 1038 HB VAL 42 HB VAL 132 -6.132 3.271 -2.276 1039 1HG1 VAL 42 1HG2 VAL 132 -7.436 4.744 0.022 1040 2HG1 VAL 42 2HG2 VAL 132 -6.039 3.617 0.126 1041 3HG1 VAL 42 3HG2 VAL 132 -5.849 5.150 -0.774 1042 1HG2 VAL 42 2HG1 VAL 132 -8.744 3.005 -0.687 1043 2HG2 VAL 42 3HG1 VAL 132 -8.229 1.940 -2.056 1044 3HG2 VAL 42 1HG1 VAL 132 -7.343 1.917 -0.535 1045 H GLN 43 H GLN 133 -7.434 6.747 -1.896 1046 HA GLN 43 HA GLN 133 -5.233 7.653 -3.768 1047 1HB GLN 43 1HB GLN 133 -7.767 9.204 -4.067 1048 2HB GLN 43 2HB GLN 133 -6.182 9.687 -4.674 1049 1HG GLN 43 1HG GLN 133 -6.137 7.473 -5.962 1050 2HG GLN 43 2HG GLN 133 -7.778 7.166 -5.400 1051 1HE2 GLN 43 2HE2 GLN 133 -8.361 8.443 -8.750 1052 2HE2 GLN 43 1HE2 GLN 133 -7.810 6.961 -7.826 1053 H LEU 44 H LEU 134 -3.724 8.678 -3.096 1054 HA LEU 44 HA LEU 134 -3.861 10.632 -0.769 1055 1HB LEU 44 2HB LEU 134 -1.508 8.697 -1.216 1056 2HB LEU 44 1HB LEU 134 -1.769 9.804 0.117 1057 HG LEU 44 HG LEU 134 -3.957 8.221 0.454 1058 1HD1 LEU 44 1HD1 LEU 134 -3.534 6.709 -1.530 1059 2HD1 LEU 44 2HD1 LEU 134 -1.974 6.230 -0.832 1060 3HD1 LEU 44 3HD1 LEU 134 -3.496 5.826 -0.001 1061 1HD2 LEU 44 2HD2 LEU 134 -2.083 8.596 2.145 1062 2HD2 LEU 44 3HD2 LEU 134 -2.623 6.904 2.140 1063 3HD2 LEU 44 1HD2 LEU 134 -1.101 7.360 1.333 1064 H ILE 45 H ILE 135 -3.453 12.541 -1.922 1065 HA ILE 45 HA ILE 135 -2.086 12.429 -4.431 1066 HB ILE 45 HB ILE 135 -4.060 13.907 -3.964 1067 1HG1 ILE 45 1HG1 ILE 135 -3.408 15.931 -5.294 1068 2HG1 ILE 45 2HG1 ILE 135 -1.725 15.434 -5.242 1069 1HG2 ILE 45 3HG2 ILE 135 -3.316 14.834 -1.777 1070 2HG2 ILE 45 1HG2 ILE 135 -2.057 15.794 -2.593 1071 3HG2 ILE 45 2HG2 ILE 135 -3.786 16.120 -2.907 1072 1HD1 ILE 45 2HD1 ILE 135 -4.029 13.812 -6.545 1073 2HD1 ILE 45 3HD1 ILE 135 -2.840 14.815 -7.410 1074 3HD1 ILE 45 1HD1 ILE 135 -2.306 13.345 -6.568 1075 H GLY 46 H GLY 136 -0.740 13.192 -1.811 1076 1HA GLY 46 1HA GLY 136 1.930 14.130 -3.131 1077 2HA GLY 46 2HA GLY 136 1.598 14.409 -1.440 1078 H PHE 47 H PHE 137 0.639 11.201 -2.333 1079 HA PHE 47 HA PHE 137 3.349 9.996 -1.702 1080 1HB PHE 47 2HB PHE 137 1.904 10.734 0.324 1081 2HB PHE 47 1HB PHE 137 0.740 9.514 -0.078 1082 HD1 PHE 47 HD1 PHE 137 4.347 9.985 0.967 1083 HD2 PHE 47 HD2 PHE 137 1.181 7.128 0.361 1084 HE1 PHE 47 HE1 PHE 137 5.766 8.167 1.863 1085 HE2 PHE 47 HE2 PHE 137 2.644 5.346 1.208 1086 HZ PHE 47 HZ PHE 137 4.977 5.866 1.848 1087 H GLY 48 H GLY 138 -0.014 9.136 -2.750 1088 1HA GLY 48 1HA GLY 138 0.924 6.568 -3.807 1089 2HA GLY 48 2HA GLY 138 0.125 6.341 -2.282 1090 H ASN 49 H ASN 139 -0.655 5.099 -4.540 1091 HA ASN 49 HA ASN 139 -3.574 5.795 -4.347 1092 1HB ASN 49 1HB ASN 139 -2.962 7.116 -6.288 1093 2HB ASN 49 2HB ASN 139 -2.149 5.785 -7.066 1094 1HD2 ASN 49 1HD2 ASN 139 -5.376 6.136 -8.821 1095 2HD2 ASN 49 2HD2 ASN 139 -3.819 7.068 -8.553 1096 H PHE 50 H PHE 140 -3.952 3.944 -3.243 1097 HA PHE 50 HA PHE 140 -2.857 1.306 -4.174 1098 1HB PHE 50 2HB PHE 140 -4.998 1.602 -1.999 1099 2HB PHE 50 1HB PHE 140 -4.234 0.144 -2.442 1100 HD1 PHE 50 HD1 PHE 140 -3.645 3.557 -1.072 1101 HD2 PHE 50 HD2 PHE 140 -2.573 -0.598 -0.972 1102 HE1 PHE 50 HE1 PHE 140 -2.272 3.948 0.966 1103 HE2 PHE 50 HE2 PHE 140 -1.242 -0.180 1.079 1104 HZ PHE 50 HZ PHE 140 -1.001 2.116 1.908 1105 H GLU 51 H GLU 141 -4.007 -0.238 -5.212 1106 HA GLU 51 HA GLU 141 -6.867 -0.231 -5.377 1107 1HB GLU 51 1HB GLU 141 -7.319 0.183 -7.826 1108 2HB GLU 51 2HB GLU 141 -6.724 1.613 -7.019 1109 1HG GLU 51 1HG GLU 141 -4.382 1.152 -7.998 1110 2HG GLU 51 2HG GLU 141 -5.071 -0.198 -8.895 1111 HE2 GLU 51 HE2 GLU 141 -5.648 3.632 -10.013 1112 H VAL 52 H VAL 142 -7.833 -2.101 -6.262 1113 HA VAL 52 HA VAL 142 -5.913 -4.286 -6.099 1114 HB VAL 52 HB VAL 142 -8.422 -3.535 -4.957 1115 1HG1 VAL 52 1HG2 VAL 142 -9.078 -5.584 -7.085 1116 2HG1 VAL 52 2HG2 VAL 142 -10.080 -5.141 -5.654 1117 3HG1 VAL 52 3HG2 VAL 142 -9.696 -3.931 -6.919 1118 1HG2 VAL 52 1HG1 VAL 142 -7.146 -6.272 -4.976 1119 2HG2 VAL 52 2HG1 VAL 142 -6.805 -4.888 -3.894 1120 3HG2 VAL 52 3HG1 VAL 142 -8.380 -5.665 -3.868 1121 NH1 ARG 53 NH2 ARG 143 -4.588 -10.159 -12.782 1122 NH2 ARG 53 NH1 ARG 143 -3.535 -11.210 -11.065 1123 H ARG 53 H ARG 143 -6.089 -6.189 -7.444 1124 HA ARG 53 HA ARG 143 -6.761 -5.548 -10.395 1125 1HB ARG 53 1HB ARG 143 -4.246 -5.643 -9.840 1126 2HB ARG 53 2HB ARG 143 -4.473 -7.324 -9.422 1127 1HG ARG 53 1HG ARG 143 -5.532 -7.564 -11.877 1128 2HG ARG 53 2HG ARG 143 -4.801 -5.998 -12.163 1129 1HD ARG 53 1HD ARG 143 -3.265 -7.681 -13.000 1130 2HD ARG 53 2HD ARG 143 -2.522 -6.972 -11.582 1131 1HH1 ARG 53 2HH2 ARG 143 -4.766 -9.280 -13.280 1132 2HH1 ARG 53 1HH2 ARG 143 -4.968 -11.084 -13.013 1133 1HH2 ARG 53 1HH1 ARG 143 -2.908 -11.136 -10.256 1134 2HH2 ARG 53 2HH1 ARG 143 -3.989 -12.060 -11.415 1135 H GLU 54 H GLU 144 -8.766 -6.461 -10.376 1136 HA GLU 54 HA GLU 144 -9.406 -9.082 -9.199 1137 1HB GLU 54 1HB GLU 144 -11.585 -8.952 -10.200 1138 2HB GLU 54 2HB GLU 144 -11.147 -7.505 -9.321 1139 1HG GLU 54 1HG GLU 144 -10.682 -6.314 -11.547 1140 2HG GLU 54 2HG GLU 144 -11.194 -7.765 -12.401 1141 HE1 GLU 54 HE2 GLU 144 -13.861 -5.336 -10.557 1142 NH1 ARG 55 NH2 ARG 145 -5.862 -17.961 -9.936 1143 NH2 ARG 55 NH1 ARG 145 -5.252 -18.549 -12.046 1144 H ARG 55 H ARG 145 -8.894 -11.005 -9.901 1145 HA ARG 55 HA ARG 145 -7.565 -11.415 -12.552 1146 1HB ARG 55 1HB ARG 145 -6.706 -12.448 -10.423 1147 2HB ARG 55 2HB ARG 145 -8.196 -13.364 -10.278 1148 1HG ARG 55 1HG ARG 145 -7.620 -14.504 -12.519 1149 2HG ARG 55 2HG ARG 145 -6.036 -13.715 -12.419 1150 1HD ARG 55 1HD ARG 145 -5.612 -14.883 -10.224 1151 2HD ARG 55 2HD ARG 145 -7.255 -15.562 -10.263 1152 1HH1 ARG 55 1HH2 ARG 145 -5.648 -18.932 -9.685 1153 2HH1 ARG 55 2HH2 ARG 145 -6.196 -17.222 -9.307 1154 1HH2 ARG 55 1HH1 ARG 145 -5.123 -18.264 -13.024 1155 2HH2 ARG 55 2HH1 ARG 145 -5.082 -19.480 -11.650 1156 H ALA 56 H ALA 146 -8.313 -12.676 -14.161 1157 HA ALA 56 HA ALA 146 -11.332 -13.008 -14.438 1158 1HB ALA 56 3HB ALA 146 -10.198 -11.837 -16.298 1159 2HB ALA 56 1HB ALA 146 -9.125 -13.230 -16.584 1160 3HB ALA 56 2HB ALA 146 -10.877 -13.377 -16.858 1161 H ALA 57 H ALA 147 -11.762 -14.838 -13.296 1162 HA ALA 57 HA ALA 147 -10.595 -17.217 -12.912 1163 1HB ALA 57 1HB ALA 147 -12.934 -16.682 -12.125 1164 2HB ALA 57 2HB ALA 147 -13.576 -16.966 -13.762 1165 3HB ALA 57 3HB ALA 147 -12.912 -18.313 -12.818 1166 NH1 ARG 58 NH2 ARG 148 -6.929 -16.227 -19.142 1167 NH2 ARG 58 NH1 ARG 148 -5.761 -18.033 -19.880 1168 H ARG 58 H ARG 148 -9.840 -18.947 -13.646 1169 HA ARG 58 HA ARG 148 -9.736 -19.108 -16.609 1170 1HB ARG 58 2HB ARG 148 -7.826 -20.416 -14.609 1171 2HB ARG 58 1HB ARG 148 -7.573 -20.354 -16.340 1172 1HG ARG 58 1HG ARG 148 -7.549 -17.958 -14.426 1173 2HG ARG 58 2HG ARG 148 -6.149 -18.774 -15.072 1174 1HD ARG 58 1HD ARG 148 -8.223 -17.236 -16.778 1175 2HD ARG 58 2HD ARG 148 -6.690 -16.576 -16.208 1176 1HH1 ARG 58 2HH2 ARG 148 -7.424 -15.776 -18.364 1177 2HH1 ARG 58 1HH2 ARG 148 -6.796 -15.850 -20.087 1178 1HH2 ARG 58 1HH1 ARG 148 -5.367 -18.956 -19.669 1179 2HH2 ARG 58 2HH1 ARG 148 -5.710 -17.531 -20.773 1180 H LYS 59 H LYS 149 -8.786 -21.714 -16.913 1181 HA LYS 59 HA LYS 149 -10.789 -23.664 -15.796 1182 1HB LYS 59 1HB LYS 149 -11.841 -22.819 -17.965 1183 2HB LYS 59 2HB LYS 149 -10.457 -23.446 -18.856 1184 1HG LYS 59 1HG LYS 149 -10.993 -25.782 -17.947 1185 2HG LYS 59 2HG LYS 149 -12.383 -25.109 -17.091 1186 1HD LYS 59 1HD LYS 149 -13.343 -24.348 -19.342 1187 2HD LYS 59 2HD LYS 149 -11.962 -25.103 -20.151 1188 1HE LYS 59 1HE LYS 149 -12.644 -27.357 -19.131 1189 2HE LYS 59 2HE LYS 149 -14.054 -26.579 -18.404 1190 1HZ LYS 59 1HZ LYS 149 -14.574 -27.640 -20.494 1191 2HZ LYS 59 2HZ LYS 149 -13.467 -26.753 -21.306 1192 H GLY 60 H GLY 150 -9.511 -25.290 -15.066 1193 1HA GLY 60 1HA GLY 150 -6.557 -25.358 -15.995 1194 2HA GLY 60 2HA GLY 150 -7.086 -25.817 -14.395 1195 NH1 ARG 61 NH2 ARG 151 -5.110 -32.657 -15.945 1196 NH2 ARG 61 NH1 ARG 151 -4.456 -30.604 -16.670 1197 H ARG 61 H ARG 151 -8.801 -27.466 -14.340 1198 HA ARG 61 HA ARG 151 -8.223 -29.958 -15.959 1199 1HB ARG 61 1HB ARG 151 -9.871 -29.652 -13.552 1200 2HB ARG 61 2HB ARG 151 -9.502 -31.107 -14.438 1201 1HG ARG 61 1HG ARG 151 -7.379 -29.445 -13.008 1202 2HG ARG 61 2HG ARG 151 -8.208 -30.844 -12.380 1203 1HD ARG 61 1HD ARG 151 -6.160 -31.738 -13.093 1204 2HD ARG 61 2HD ARG 151 -7.293 -32.235 -14.350 1205 1HH1 ARG 61 2HH2 ARG 151 -5.673 -33.201 -15.281 1206 2HH1 ARG 61 1HH2 ARG 151 -4.507 -33.028 -16.688 1207 1HH2 ARG 61 1HH1 ARG 151 -4.518 -29.586 -16.560 1208 2HH2 ARG 61 2HH1 ARG 151 -3.898 -31.115 -17.362 1209 H ASN 62 H ASN 152 -9.522 -31.057 -17.354 1210 HA ASN 62 HA ASN 152 -11.561 -29.364 -18.800 1211 1HB ASN 62 1HB ASN 152 -8.797 -30.378 -19.784 1212 2HB ASN 62 2HB ASN 152 -10.097 -30.284 -20.892 1213 1HD2 ASN 62 2HD2 ASN 152 -8.269 -26.800 -20.093 1214 2HD2 ASN 62 1HD2 ASN 152 -7.695 -28.422 -19.453 1215 HA PRO 63 HA PRO 153 -13.626 -33.394 -19.566 1216 1HB PRO 63 1HB PRO 153 -14.052 -32.376 -22.420 1217 2HB PRO 63 2HB PRO 153 -15.226 -33.103 -21.304 1218 1HG PRO 63 1HG PRO 153 -15.199 -30.408 -21.659 1219 2HG PRO 63 2HG PRO 153 -15.390 -31.059 -20.013 1220 1HD PRO 63 1HD PRO 153 -12.835 -29.945 -21.304 1221 2HD PRO 63 2HD PRO 153 -13.510 -29.653 -19.674 1222 H GLN 64 H GLN 154 -11.213 -32.361 -21.938 1223 HA GLN 64 HA GLN 154 -10.662 -34.834 -23.354 1224 1HB GLN 64 1HB GLN 154 -9.801 -32.368 -23.816 1225 2HB GLN 64 2HB GLN 154 -8.663 -32.602 -22.529 1226 1HG GLN 64 1HG GLN 154 -7.406 -32.985 -24.419 1227 2HG GLN 64 2HG GLN 154 -7.674 -34.602 -23.812 1228 1HE2 GLN 64 2HE2 GLN 154 -9.173 -33.703 -27.522 1229 2HE2 GLN 64 1HE2 GLN 154 -8.366 -32.442 -26.461 1230 H THR 65 H THR 155 -8.900 -33.407 -20.662 1231 HA THR 65 HA THR 155 -7.033 -35.513 -20.202 1232 HB THR 65 HB THR 155 -6.300 -34.215 -18.271 1233 HG1 THR 65 HG1 THR 155 -8.670 -32.715 -18.629 1234 1HG2 THR 65 1HG2 THR 155 -5.785 -33.262 -20.609 1235 2HG2 THR 65 2HG2 THR 155 -7.214 -32.229 -20.468 1236 3HG2 THR 65 3HG2 THR 155 -5.869 -32.002 -19.339 1237 H GLY 66 H GLY 156 -10.120 -35.061 -18.527 1238 1HA GLY 66 1HA GLY 156 -10.951 -37.497 -17.720 1239 2HA GLY 66 2HA GLY 156 -9.517 -37.473 -16.701 1240 H GLU 67 H GLU 157 -9.452 -34.835 -15.854 1241 HA GLU 67 HA GLU 157 -11.842 -34.744 -13.938 1242 1HB GLU 67 2HB GLU 157 -9.442 -35.215 -13.026 1243 2HB GLU 67 1HB GLU 157 -8.995 -33.585 -13.514 1244 1HG GLU 67 1HG GLU 157 -10.783 -32.650 -11.964 1245 2HG GLU 67 2HG GLU 157 -11.263 -34.286 -11.523 1246 HE1 GLU 67 HE2 GLU 157 -8.580 -34.871 -9.412 1247 H GLU 68 H GLU 158 -12.461 -32.416 -13.454 1248 HA GLU 68 HA GLU 158 -11.408 -30.346 -15.271 1249 1HB GLU 68 1HB GLU 158 -13.198 -31.537 -16.658 1250 2HB GLU 68 2HB GLU 158 -14.414 -31.254 -15.439 1251 1HG GLU 68 1HG GLU 158 -13.028 -29.032 -17.063 1252 2HG GLU 68 2HG GLU 158 -14.483 -29.865 -17.568 1253 HE2 GLU 68 HE2 GLU 158 -14.811 -26.678 -15.353 1254 H MET 69 H MET 159 -11.481 -28.262 -14.372 1255 HA MET 69 HA MET 159 -13.670 -27.503 -12.597 1256 1HB MET 69 1HB MET 159 -12.816 -27.222 -10.517 1257 2HB MET 69 2HB MET 159 -12.149 -28.775 -10.934 1258 1HG MET 69 1HG MET 159 -10.620 -26.086 -10.888 1259 2HG MET 69 2HG MET 159 -10.565 -27.334 -9.646 1260 1HE MET 69 1HE MET 159 -7.934 -26.168 -10.937 1261 2HE MET 69 3HE MET 159 -7.266 -27.060 -12.337 1262 3HE MET 69 2HE MET 159 -8.635 -25.944 -12.567 1263 H GLU 70 H GLU 160 -14.026 -25.464 -12.755 1264 HA GLU 70 HA GLU 160 -12.244 -23.623 -14.261 1265 1HB GLU 70 2HB GLU 160 -13.939 -22.003 -14.267 1266 2HB GLU 70 1HB GLU 160 -14.652 -23.544 -14.712 1267 1HG GLU 70 1HG GLU 160 -14.983 -22.105 -11.992 1268 2HG GLU 70 2HG GLU 160 -16.121 -22.077 -13.316 1269 HE2 GLU 70 HE2 GLU 160 -16.147 -25.061 -10.693 1270 H ILE 71 H ILE 161 -10.670 -22.365 -13.338 1271 HA ILE 71 HA ILE 161 -10.212 -22.478 -10.450 1272 HB ILE 71 HB ILE 161 -8.713 -21.024 -12.715 1273 1HG1 ILE 71 1HG1 ILE 161 -8.012 -23.729 -11.381 1274 2HG1 ILE 71 2HG1 ILE 161 -8.793 -23.606 -12.943 1275 1HG2 ILE 71 2HG2 ILE 161 -8.215 -20.077 -10.475 1276 2HG2 ILE 71 3HG2 ILE 161 -7.812 -21.713 -9.862 1277 3HG2 ILE 71 1HG2 ILE 161 -6.810 -20.936 -11.130 1278 1HD1 ILE 71 2HD1 ILE 161 -5.960 -22.541 -12.383 1279 2HD1 ILE 71 3HD1 ILE 161 -6.391 -24.027 -13.234 1280 3HD1 ILE 71 1HD1 ILE 161 -6.824 -22.456 -13.945 1281 HA PRO 72 HA PRO 162 -12.851 -18.681 -10.102 1282 1HB PRO 72 1HB PRO 162 -12.735 -18.236 -7.356 1283 2HB PRO 72 2HB PRO 162 -13.625 -19.565 -8.111 1284 1HG PRO 72 1HG PRO 162 -10.814 -19.663 -6.898 1285 2HG PRO 72 2HG PRO 162 -12.179 -20.762 -6.579 1286 1HD PRO 72 1HD PRO 162 -10.195 -21.392 -8.395 1287 2HD PRO 72 2HD PRO 162 -11.890 -21.895 -8.685 1288 H ALA 73 H ALA 163 -12.794 -16.447 -9.381 1289 HA ALA 73 HA ALA 163 -10.408 -14.983 -10.249 1290 1HB ALA 73 2HB ALA 163 -12.770 -13.956 -10.285 1291 2HB ALA 73 3HB ALA 163 -12.730 -13.880 -8.484 1292 3HB ALA 73 1HB ALA 163 -11.605 -12.923 -9.439 1293 H SER 74 H SER 164 -9.440 -13.297 -9.056 1294 HA SER 74 HA SER 164 -9.798 -13.116 -6.268 1295 1HB SER 74 1HB SER 164 -7.410 -13.551 -5.350 1296 2HB SER 74 2HB SER 164 -8.119 -15.011 -6.039 1297 HG SER 74 HG SER 164 -6.324 -13.236 -7.334 1298 H LYS 75 H LYS 165 -9.534 -11.159 -5.545 1299 HA LYS 75 HA LYS 165 -8.388 -9.007 -7.307 1300 1HB LYS 75 2HB LYS 165 -9.312 -8.210 -4.597 1301 2HB LYS 75 1HB LYS 165 -9.336 -7.385 -6.121 1302 1HG LYS 75 1HG LYS 165 -11.205 -8.908 -6.936 1303 2HG LYS 75 2HG LYS 165 -11.249 -9.650 -5.334 1304 1HD LYS 75 1HD LYS 165 -11.800 -7.380 -4.317 1305 2HD LYS 75 2HD LYS 165 -11.803 -6.677 -5.940 1306 1HE LYS 75 1HE LYS 165 -13.662 -8.277 -6.632 1307 2HE LYS 75 2HE LYS 165 -13.679 -8.955 -4.998 1308 1HZ LYS 75 1HZ LYS 165 -14.215 -6.114 -5.667 1309 2HZ LYS 75 2HZ LYS 165 -14.238 -6.745 -4.159 1310 H VAL 76 H VAL 166 -6.142 -8.401 -7.196 1311 HA VAL 76 HA VAL 166 -4.573 -9.382 -4.981 1312 HB VAL 76 HB VAL 166 -4.681 -9.042 -7.962 1313 1HG1 VAL 76 1HG2 VAL 166 -2.086 -8.475 -6.715 1314 2HG1 VAL 76 2HG2 VAL 166 -2.464 -8.896 -8.467 1315 3HG1 VAL 76 3HG2 VAL 166 -3.122 -7.416 -7.737 1316 1HG2 VAL 76 3HG1 VAL 166 -4.823 -11.216 -6.856 1317 2HG2 VAL 76 1HG1 VAL 166 -3.468 -11.088 -7.996 1318 3HG2 VAL 76 2HG1 VAL 166 -3.157 -10.994 -6.225 1319 HA PRO 77 HA PRO 167 -4.344 -4.884 -4.030 1320 1HB PRO 77 1HB PRO 167 -2.962 -5.034 -1.592 1321 2HB PRO 77 2HB PRO 167 -4.585 -5.707 -1.768 1322 1HG PRO 77 1HG PRO 167 -1.917 -7.179 -1.928 1323 2HG PRO 77 2HG PRO 167 -3.356 -7.650 -1.015 1324 1HD PRO 77 1HD PRO 167 -2.653 -8.611 -3.679 1325 2HD PRO 77 2HD PRO 167 -4.318 -8.634 -3.055 1326 H ALA 78 H ALA 168 -3.269 -3.330 -4.407 1327 HA ALA 78 HA ALA 168 -0.231 -3.348 -4.729 1328 1HB ALA 78 3HB ALA 168 -1.475 -3.962 -6.863 1329 2HB ALA 78 1HB ALA 168 -2.332 -2.407 -6.795 1330 3HB ALA 78 2HB ALA 168 -0.565 -2.435 -7.017 1331 H PHE 79 H PHE 169 0.575 -1.301 -5.107 1332 HA PHE 79 HA PHE 169 -0.749 1.161 -3.778 1333 1HB PHE 79 2HB PHE 169 -0.015 0.360 -1.892 1334 2HB PHE 79 1HB PHE 169 1.506 -0.257 -2.594 1335 HD1 PHE 79 HD2 PHE 169 -0.188 2.875 -1.443 1336 HD2 PHE 79 HD1 PHE 169 3.497 1.142 -2.824 1337 HE1 PHE 79 HE2 PHE 169 1.016 4.934 -0.853 1338 HE2 PHE 79 HE1 PHE 169 4.668 3.242 -2.317 1339 HZ PHE 79 HZ PHE 169 3.428 5.153 -1.373 1340 H LYS 80 H LYS 170 -0.279 2.540 -5.110 1341 HA LYS 80 HA LYS 170 2.037 2.841 -7.225 1342 1HB LYS 80 2HB LYS 170 -0.523 4.410 -6.766 1343 2HB LYS 80 1HB LYS 170 0.778 4.980 -7.777 1344 1HG LYS 80 1HG LYS 170 0.568 3.003 -9.290 1345 2HG LYS 80 2HG LYS 170 -0.630 2.273 -8.234 1346 1HD LYS 80 1HD LYS 170 -1.771 3.222 -10.147 1347 2HD LYS 80 2HD LYS 170 -2.266 4.048 -8.693 1348 1HE LYS 80 1HE LYS 170 -2.042 5.701 -10.455 1349 2HE LYS 80 2HE LYS 170 -0.771 6.023 -9.283 1350 1HZ LYS 80 1HZ LYS 170 -0.447 4.593 -11.869 1351 2HZ LYS 80 2HZ LYS 170 0.022 6.128 -11.552 1352 HA PRO 81 HA PRO 171 3.806 5.664 -4.072 1353 1HB PRO 81 1HB PRO 171 6.037 6.508 -5.445 1354 2HB PRO 81 2HB PRO 171 5.854 4.830 -4.925 1355 1HG PRO 81 1HG PRO 171 5.268 5.990 -7.702 1356 2HG PRO 81 2HG PRO 171 6.291 4.585 -7.305 1357 1HD PRO 81 1HD PRO 171 3.597 4.375 -8.047 1358 2HD PRO 81 2HD PRO 171 4.381 3.186 -6.957 1359 H GLY 82 H GLY 172 1.499 6.545 -5.505 1360 1HA GLY 82 1HA GLY 172 0.406 8.246 -6.826 1361 2HA GLY 82 2HA GLY 172 1.075 9.137 -5.475 1362 H LYS 83 H LYS 173 3.314 7.990 -7.763 1363 HA LYS 83 HA LYS 173 4.829 9.108 -9.284 1364 1HB LYS 83 2HB LYS 173 2.442 10.897 -9.663 1365 2HB LYS 83 1HB LYS 173 3.920 11.768 -9.814 1366 1HG LYS 83 1HG LYS 173 4.713 10.052 -11.565 1367 2HG LYS 83 2HG LYS 173 3.181 9.193 -11.380 1368 1HD LYS 83 1HD LYS 173 1.935 11.279 -12.130 1369 2HD LYS 83 2HD LYS 173 3.478 12.118 -12.333 1370 1HE LYS 83 1HE LYS 173 4.180 10.398 -14.077 1371 2HE LYS 83 2HE LYS 173 2.633 9.563 -13.871 1372 1HZ LYS 83 1HZ LYS 173 2.945 12.378 -14.760 1373 2HZ LYS 83 2HZ LYS 173 1.514 11.612 -14.562 1374 H ALA 84 H ALA 174 3.497 11.124 -6.976 1375 HA ALA 84 HA ALA 174 5.455 13.155 -6.382 1376 1HB ALA 84 2HB ALA 174 3.025 13.098 -5.750 1377 2HB ALA 84 3HB ALA 174 3.301 11.674 -4.714 1378 3HB ALA 84 1HB ALA 174 4.027 13.240 -4.267 1379 H LEU 85 H LEU 175 4.940 9.938 -4.707 1380 HA LEU 85 HA LEU 175 7.271 10.250 -2.957 1381 1HB LEU 85 2HB LEU 175 5.381 8.812 -2.251 1382 2HB LEU 85 1HB LEU 175 5.586 7.798 -3.665 1383 HG LEU 85 HG LEU 175 7.959 7.463 -2.919 1384 1HD1 LEU 85 2HD1 LEU 175 8.182 9.170 -1.142 1385 2HD1 LEU 85 3HD1 LEU 175 6.931 8.354 -0.182 1386 3HD1 LEU 85 1HD1 LEU 175 8.500 7.557 -0.479 1387 1HD2 LEU 85 3HD2 LEU 175 6.232 5.632 -2.799 1388 2HD2 LEU 85 1HD2 LEU 175 7.320 5.498 -1.409 1389 3HD2 LEU 85 2HD2 LEU 175 5.694 6.206 -1.206 1390 H LYS 86 H LYS 176 6.644 8.789 -6.141 1391 HA LYS 86 HA LYS 176 9.291 7.657 -6.560 1392 1HB LYS 86 1HB LYS 176 7.200 7.253 -8.015 1393 2HB LYS 86 2HB LYS 176 7.588 8.739 -8.866 1394 1HG LYS 86 1HG LYS 176 9.837 7.779 -9.498 1395 2HG LYS 86 2HG LYS 176 9.477 6.322 -8.567 1396 1HD LYS 86 1HD LYS 176 7.486 5.854 -10.096 1397 2HD LYS 86 2HD LYS 176 7.862 7.313 -11.000 1398 1HE LYS 86 1HE LYS 176 8.746 5.483 -12.283 1399 2HE LYS 86 2HE LYS 176 10.140 6.339 -11.628 1400 1HZ LYS 86 1HZ LYS 176 8.960 3.852 -10.498 1401 2HZ LYS 86 2HZ LYS 176 10.252 4.635 -9.873 1402 H ASP 87 H ASP 177 8.328 11.053 -6.603 1403 HA ASP 87 HA ASP 177 10.892 12.006 -7.796 1404 1HB ASP 87 1HB ASP 177 8.189 13.010 -7.360 1405 2HB ASP 87 2HB ASP 177 9.129 13.870 -6.221 1406 HD1 ASP 87 HD2 ASP 177 9.551 14.385 -10.239 1407 H ALA 88 H ALA 178 9.415 11.786 -4.515 1408 HA ALA 88 HA ALA 178 11.486 12.934 -2.844 1409 1HB ALA 88 3HB ALA 178 9.202 12.030 -1.990 1410 2HB ALA 88 1HB ALA 178 9.783 10.385 -2.260 1411 3HB ALA 88 2HB ALA 178 10.576 11.368 -1.054 1412 H VAL 89 H VAL 179 11.100 9.588 -4.013 1413 HA VAL 89 HA VAL 179 13.500 8.544 -2.710 1414 HB VAL 89 HB VAL 179 10.837 7.882 -2.950 1415 1HG1 VAL 89 2HG2 VAL 179 11.088 7.865 -5.526 1416 2HG1 VAL 89 3HG2 VAL 179 11.853 6.287 -5.343 1417 3HG1 VAL 89 1HG2 VAL 179 10.191 6.568 -4.728 1418 1HG2 VAL 89 3HG1 VAL 179 12.996 5.837 -2.987 1419 2HG2 VAL 89 1HG1 VAL 179 12.278 6.750 -1.602 1420 3HG2 VAL 89 2HG1 VAL 179 11.245 5.648 -2.545 1421 H LYS 90 H LYS 180 13.143 9.976 -5.767 1422 HA LYS 90 HA LYS 180 14.418 8.146 -7.557 1423 1HB LYS 90 1HB LYS 180 13.162 10.702 -7.682 1424 2HB LYS 90 2HB LYS 180 14.789 11.122 -8.107 1425 1HG LYS 90 1HG LYS 180 14.726 9.520 -10.035 1426 2HG LYS 90 2HG LYS 180 13.189 8.858 -9.468 1427 1HD LYS 90 1HD LYS 180 12.127 11.194 -9.733 1428 2HD LYS 90 2HD LYS 180 13.647 11.760 -10.403 1429 1HE LYS 90 1HE LYS 180 12.159 11.329 -12.238 1430 2HE LYS 90 2HE LYS 180 13.419 10.093 -12.310 1431 1HZ LYS 90 1HZ LYS 180 10.700 9.718 -11.162 1432 2HZ LYS 90 2HZ LYS 180 11.850 8.558 -11.233 Start of MODEL 17 Raw file had 1432 H/Q atoms Start of MODEL 17 1 1H MET 1 1H MET 1 -13.362 6.739 -0.593 2 2H MET 1 2H MET 1 -13.331 7.787 -1.846 3 HA MET 1 HA MET 1 -13.682 8.932 0.145 4 1HB MET 1 1HB MET 1 -11.867 9.040 1.923 5 2HB MET 1 2HB MET 1 -12.901 7.624 1.847 6 1HG MET 1 1HG MET 1 -11.029 6.308 0.822 7 2HG MET 1 2HG MET 1 -9.990 7.733 0.933 8 1HE MET 1 3HE MET 1 -11.376 4.638 2.515 9 2HE MET 1 2HE MET 1 -10.827 4.705 4.203 10 3HE MET 1 1HE MET 1 -12.370 5.475 3.735 11 H ASN 2 H ASN 2 -10.281 9.586 0.027 12 HA ASN 2 HA ASN 2 -9.766 11.002 -2.139 13 1HB ASN 2 1HB ASN 2 -10.202 13.309 -2.266 14 2HB ASN 2 2HB ASN 2 -11.697 12.440 -2.199 15 1HD2 ASN 2 1HD2 ASN 2 -12.824 14.057 0.833 16 2HD2 ASN 2 2HD2 ASN 2 -13.016 12.568 -0.222 17 H LYS 3 H LYS 3 -9.636 11.586 1.200 18 HA LYS 3 HA LYS 3 -7.239 11.298 2.193 19 1HB LYS 3 1HB LYS 3 -6.011 12.418 0.278 20 2HB LYS 3 2HB LYS 3 -6.651 13.970 0.784 21 1HG LYS 3 1HG LYS 3 -5.387 13.691 2.993 22 2HG LYS 3 2HG LYS 3 -4.897 12.067 2.508 23 1HD LYS 3 1HD LYS 3 -3.648 13.066 0.537 24 2HD LYS 3 2HD LYS 3 -4.073 14.683 1.080 25 1HE LYS 3 1HE LYS 3 -2.399 12.650 2.716 26 2HE LYS 3 2HE LYS 3 -1.725 13.912 1.691 27 1HZ LYS 3 1HZ LYS 3 -3.463 14.418 4.039 28 2HZ LYS 3 2HZ LYS 3 -2.824 15.573 3.076 29 H THR 4 H THR 4 -9.782 13.781 1.853 30 HA THR 4 HA THR 4 -9.407 14.883 4.502 31 HB THR 4 HB THR 4 -11.279 15.366 2.101 32 HG1 THR 4 HG1 THR 4 -9.055 16.857 3.093 33 1HG2 THR 4 3HG2 THR 4 -10.820 16.860 4.687 34 2HG2 THR 4 1HG2 THR 4 -11.735 17.496 3.240 35 3HG2 THR 4 2HG2 THR 4 -12.318 16.032 4.123 36 H GLU 5 H GLU 5 -11.536 12.566 2.653 37 HA GLU 5 HA GLU 5 -13.557 12.280 4.792 38 1HB GLU 5 1HB GLU 5 -14.249 12.066 2.488 39 2HB GLU 5 2HB GLU 5 -12.840 11.126 2.033 40 1HG GLU 5 1HG GLU 5 -14.559 9.684 1.976 41 2HG GLU 5 2HG GLU 5 -13.569 9.239 3.367 42 HE1 GLU 5 HE2 GLU 5 -17.448 10.412 3.783 43 H LEU 6 H LEU 6 -10.299 11.455 4.160 44 HA LEU 6 HA LEU 6 -9.973 8.986 5.774 45 1HB LEU 6 2HB LEU 6 -8.371 10.457 3.924 46 2HB LEU 6 1HB LEU 6 -7.660 10.973 5.426 47 HG LEU 6 HG LEU 6 -7.900 8.085 4.529 48 1HD1 LEU 6 3HD1 LEU 6 -5.536 9.996 4.696 49 2HD1 LEU 6 1HD1 LEU 6 -5.396 8.248 4.399 50 3HD1 LEU 6 2HD1 LEU 6 -6.244 9.311 3.243 51 1HD2 LEU 6 3HD2 LEU 6 -7.115 9.158 7.236 52 2HD2 LEU 6 1HD2 LEU 6 -8.105 7.759 6.810 53 3HD2 LEU 6 2HD2 LEU 6 -6.350 7.709 6.571 54 H ILE 7 H ILE 7 -9.458 12.503 6.185 55 HA ILE 7 HA ILE 7 -8.457 12.518 8.884 56 HB ILE 7 HB ILE 7 -10.110 14.780 7.576 57 1HG1 ILE 7 1HG1 ILE 7 -7.096 14.281 7.254 58 2HG1 ILE 7 2HG1 ILE 7 -8.274 13.991 6.044 59 1HG2 ILE 7 2HG2 ILE 7 -9.559 15.098 10.035 60 2HG2 ILE 7 3HG2 ILE 7 -7.838 14.928 9.638 61 3HG2 ILE 7 1HG2 ILE 7 -8.767 16.304 9.008 62 1HD1 ILE 7 3HD1 ILE 7 -8.949 16.407 5.935 63 2HD1 ILE 7 1HD1 ILE 7 -7.660 16.798 7.066 64 3HD1 ILE 7 2HD1 ILE 7 -7.253 16.078 5.490 65 H ASN 8 H ASN 8 -11.770 13.008 7.702 66 HA ASN 8 HA ASN 8 -12.948 13.003 10.435 67 1HB ASN 8 1HB ASN 8 -14.377 12.477 7.720 68 2HB ASN 8 2HB ASN 8 -15.213 12.660 9.243 69 1HD2 ASN 8 2HD2 ASN 8 -14.232 16.059 7.280 70 2HD2 ASN 8 1HD2 ASN 8 -13.903 14.382 6.610 71 H ALA 9 H ALA 9 -11.828 10.337 8.582 72 HA ALA 9 HA ALA 9 -13.495 8.242 9.968 73 1HB ALA 9 2HB ALA 9 -12.078 7.806 7.706 74 2HB ALA 9 3HB ALA 9 -10.629 7.947 8.702 75 3HB ALA 9 1HB ALA 9 -11.723 6.649 9.052 76 H VAL 10 H VAL 10 -10.230 9.705 10.327 77 HA VAL 10 HA VAL 10 -9.454 7.936 12.384 78 HB VAL 10 HB VAL 10 -8.020 10.567 11.995 79 1HG1 VAL 10 3HG2 VAL 10 -7.325 8.496 13.551 80 2HG1 VAL 10 1HG2 VAL 10 -6.570 7.960 12.016 81 3HG1 VAL 10 2HG2 VAL 10 -6.140 9.537 12.693 82 1HG2 VAL 10 1HG1 VAL 10 -8.232 8.341 9.961 83 2HG2 VAL 10 2HG1 VAL 10 -8.446 10.117 9.839 84 3HG2 VAL 10 3HG1 VAL 10 -6.791 9.458 10.021 85 H ALA 11 H ALA 11 -10.223 11.252 12.264 86 HA ALA 11 HA ALA 11 -10.244 11.514 15.067 87 1HB ALA 11 2HB ALA 11 -9.998 13.492 13.484 88 2HB ALA 11 3HB ALA 11 -11.686 13.292 12.952 89 3HB ALA 11 1HB ALA 11 -11.323 13.835 14.624 90 H GLU 12 H GLU 12 -12.766 10.250 13.033 91 HA GLU 12 HA GLU 12 -14.835 10.440 15.201 92 1HB GLU 12 1HB GLU 12 -15.580 10.505 12.828 93 2HB GLU 12 2HB GLU 12 -14.872 8.917 12.519 94 1HG GLU 12 1HG GLU 12 -16.513 7.859 14.102 95 2HG GLU 12 2HG GLU 12 -17.184 9.438 14.504 96 HE1 GLU 12 HE2 GLU 12 -19.027 9.779 11.590 97 H THR 13 H THR 13 -12.831 7.777 13.743 98 HA THR 13 HA THR 13 -13.605 6.095 16.132 99 HB THR 13 HB THR 13 -13.671 5.439 13.669 100 HG1 THR 13 HG1 THR 13 -12.647 3.691 15.644 101 1HG2 THR 13 1HG2 THR 13 -11.347 5.679 12.989 102 2HG2 THR 13 2HG2 THR 13 -10.841 4.453 14.183 103 3HG2 THR 13 3HG2 THR 13 -11.906 4.003 12.819 104 H SER 14 H SER 14 -11.565 8.165 16.090 105 HA SER 14 HA SER 14 -9.853 6.810 18.280 106 1HB SER 14 1HB SER 14 -8.565 8.890 16.417 107 2HB SER 14 2HB SER 14 -7.789 7.937 17.675 108 HG SER 14 HG SER 14 -7.473 7.089 15.616 109 H GLY 15 H GLY 15 -11.370 9.917 17.302 110 1HA GLY 15 1HA GLY 15 -11.789 11.869 18.559 111 2HA GLY 15 2HA GLY 15 -11.564 10.909 20.017 112 H LEU 16 H LEU 16 -9.577 12.158 17.421 113 HA LEU 16 HA LEU 16 -7.674 13.621 19.270 114 1HB LEU 16 1HB LEU 16 -5.984 13.377 17.572 115 2HB LEU 16 2HB LEU 16 -6.452 11.924 18.432 116 HG LEU 16 HG LEU 16 -7.681 11.076 16.706 117 1HD1 LEU 16 2HD1 LEU 16 -8.753 13.196 15.794 118 2HD1 LEU 16 3HD1 LEU 16 -7.182 13.495 14.986 119 3HD1 LEU 16 1HD1 LEU 16 -8.215 12.044 14.578 120 1HD2 LEU 16 3HD2 LEU 16 -5.739 10.189 16.400 121 2HD2 LEU 16 1HD2 LEU 16 -6.804 10.282 14.971 122 3HD2 LEU 16 2HD2 LEU 16 -5.434 11.373 15.077 123 H SER 17 H SER 17 -7.302 14.714 16.552 124 HA SER 17 HA SER 17 -9.373 16.972 16.526 125 1HB SER 17 1HB SER 17 -6.434 17.664 16.115 126 2HB SER 17 2HB SER 17 -7.811 18.735 16.077 127 HG SER 17 HG SER 17 -6.739 18.786 18.067 128 H LYS 18 H LYS 18 -9.565 18.036 14.462 129 HA LYS 18 HA LYS 18 -9.266 16.181 12.095 130 1HB LYS 18 1HB LYS 18 -10.376 19.051 12.205 131 2HB LYS 18 2HB LYS 18 -10.077 18.188 10.703 132 1HG LYS 18 1HG LYS 18 -11.611 16.294 11.481 133 2HG LYS 18 2HG LYS 18 -11.978 17.230 12.921 134 1HD LYS 18 1HD LYS 18 -13.788 17.551 11.399 135 2HD LYS 18 2HD LYS 18 -12.931 19.086 11.480 136 1HE LYS 18 1HE LYS 18 -11.816 18.596 9.252 137 2HE LYS 18 2HE LYS 18 -12.575 17.001 9.205 138 1HZ LYS 18 1HZ LYS 18 -13.773 18.638 7.910 139 2HZ LYS 18 2HZ LYS 18 -14.001 19.604 9.209 140 H LYS 19 H LYS 19 -7.630 19.108 13.269 141 HA LYS 19 HA LYS 19 -5.554 19.053 11.142 142 1HB LYS 19 2HB LYS 19 -5.439 20.269 13.978 143 2HB LYS 19 1HB LYS 19 -4.122 20.405 12.804 144 1HG LYS 19 1HG LYS 19 -5.657 21.602 11.198 145 2HG LYS 19 2HG LYS 19 -6.972 21.495 12.371 146 1HD LYS 19 1HD LYS 19 -5.577 22.838 14.038 147 2HD LYS 19 2HD LYS 19 -4.284 22.928 12.853 148 1HE LYS 19 1HE LYS 19 -5.428 25.034 12.750 149 2HE LYS 19 2HE LYS 19 -5.831 24.189 11.258 150 1HZ LYS 19 1HZ LYS 19 -7.954 23.553 12.288 151 2HZ LYS 19 2HZ LYS 19 -7.561 24.326 13.674 152 H ASP 20 H ASP 20 -5.825 17.343 14.368 153 HA ASP 20 HA ASP 20 -3.071 16.170 13.988 154 1HB ASP 20 1HB ASP 20 -5.324 15.703 16.062 155 2HB ASP 20 2HB ASP 20 -4.078 14.505 15.920 156 HD2 ASP 20 HD2 ASP 20 -3.297 18.032 17.662 157 H ALA 21 H ALA 21 -6.262 15.164 13.007 158 HA ALA 21 HA ALA 21 -5.461 12.371 12.319 159 1HB ALA 21 2HB ALA 21 -7.967 14.073 11.747 160 2HB ALA 21 3HB ALA 21 -7.714 12.467 11.006 161 3HB ALA 21 1HB ALA 21 -7.782 12.640 12.731 162 H THR 22 H THR 22 -5.638 15.452 10.442 163 HA THR 22 HA THR 22 -4.877 14.030 7.994 164 HB THR 22 HB THR 22 -6.143 15.979 8.201 165 HG1 THR 22 HG1 THR 22 -5.612 16.394 5.952 166 1HG2 THR 22 2HG2 THR 22 -5.218 17.874 8.979 167 2HG2 THR 22 3HG2 THR 22 -4.003 17.899 7.608 168 3HG2 THR 22 1HG2 THR 22 -5.749 18.039 7.298 169 H LYS 23 H LYS 23 -3.132 15.791 10.305 170 HA LYS 23 HA LYS 23 -0.370 15.710 9.359 171 1HB LYS 23 2HB LYS 23 -2.198 15.581 11.885 172 2HB LYS 23 1HB LYS 23 -0.465 15.384 12.210 173 1HG LYS 23 1HG LYS 23 -1.496 17.932 10.835 174 2HG LYS 23 2HG LYS 23 -1.304 17.744 12.575 175 1HD LYS 23 1HD LYS 23 1.164 17.225 12.267 176 2HD LYS 23 2HD LYS 23 0.973 17.420 10.532 177 1HE LYS 23 1HE LYS 23 1.927 19.474 11.332 178 2HE LYS 23 2HE LYS 23 0.264 19.853 10.889 179 1HZ LYS 23 1HZ LYS 23 -0.331 19.716 13.236 180 2HZ LYS 23 2HZ LYS 23 0.836 20.832 12.984 181 H ALA 24 H ALA 24 -2.350 13.492 11.323 182 HA ALA 24 HA ALA 24 -0.387 11.386 11.588 183 1HB ALA 24 3HB ALA 24 -3.407 11.483 11.968 184 2HB ALA 24 1HB ALA 24 -2.380 10.112 12.474 185 3HB ALA 24 2HB ALA 24 -2.114 11.728 13.185 186 H VAL 25 H VAL 25 -2.983 11.800 9.172 187 HA VAL 25 HA VAL 25 -2.446 9.388 7.568 188 HB VAL 25 HB VAL 25 -3.666 12.286 7.376 189 1HG1 VAL 25 1HG2 VAL 25 -3.265 10.632 4.825 190 2HG1 VAL 25 2HG2 VAL 25 -4.303 12.088 5.002 191 3HG1 VAL 25 3HG2 VAL 25 -2.561 12.211 5.191 192 1HG2 VAL 25 3HG1 VAL 25 -5.030 10.497 8.338 193 2HG2 VAL 25 1HG1 VAL 25 -5.735 11.109 6.835 194 3HG2 VAL 25 2HG1 VAL 25 -4.848 9.540 6.856 195 H ASP 26 H ASP 26 -1.197 12.781 7.169 196 HA ASP 26 HA ASP 26 1.131 11.731 5.543 197 1HB ASP 26 1HB ASP 26 -0.124 14.013 5.277 198 2HB ASP 26 2HB ASP 26 0.758 14.549 6.710 199 HD1 ASP 26 HD2 ASP 26 2.588 13.994 3.093 200 H ALA 27 H ALA 27 0.769 11.004 8.173 201 HA ALA 27 HA ALA 27 3.623 11.075 9.256 202 1HB ALA 27 2HB ALA 27 1.833 11.844 10.918 203 2HB ALA 27 3HB ALA 27 1.152 10.218 10.775 204 3HB ALA 27 1HB ALA 27 2.784 10.433 11.370 205 H VAL 28 H VAL 28 0.915 8.868 8.818 206 HA VAL 28 HA VAL 28 2.452 6.325 8.766 207 HB VAL 28 HB VAL 28 -0.334 7.008 7.531 208 1HG1 VAL 28 2HG2 VAL 28 0.854 4.248 8.237 209 2HG1 VAL 28 3HG2 VAL 28 -0.823 4.586 7.717 210 3HG1 VAL 28 1HG2 VAL 28 0.500 4.901 6.598 211 1HG2 VAL 28 3HG1 VAL 28 -0.279 7.309 9.946 212 2HG2 VAL 28 1HG1 VAL 28 -1.341 5.976 9.385 213 3HG2 VAL 28 2HG1 VAL 28 0.294 5.608 10.122 214 H PHE 29 H PHE 29 0.788 8.160 6.386 215 HA PHE 29 HA PHE 29 2.019 6.963 3.974 216 1HB PHE 29 2HB PHE 29 0.385 9.475 3.835 217 2HB PHE 29 1HB PHE 29 0.839 8.406 2.502 218 HD1 PHE 29 HD2 PHE 29 0.313 5.734 2.981 219 HD2 PHE 29 HD1 PHE 29 -1.788 9.053 4.714 220 HE1 PHE 29 HE2 PHE 29 -1.367 4.203 3.870 221 HE2 PHE 29 HE1 PHE 29 -3.416 7.513 5.675 222 HZ PHE 29 HZ PHE 29 -3.127 5.070 5.343 223 H ASP 30 H ASP 30 3.213 9.561 5.921 224 HA ASP 30 HA ASP 30 5.191 10.399 3.850 225 1HB ASP 30 1HB ASP 30 4.205 11.753 5.910 226 2HB ASP 30 2HB ASP 30 5.437 10.990 6.867 227 HD2 ASP 30 HD2 ASP 30 4.718 13.183 4.469 228 H SER 31 H SER 31 5.058 8.240 6.495 229 HA SER 31 HA SER 31 8.027 7.584 6.582 230 1HB SER 31 1HB SER 31 5.800 6.126 8.055 231 2HB SER 31 2HB SER 31 7.531 5.873 8.277 232 HG SER 31 HG SER 31 6.159 8.308 8.735 233 H ILE 32 H ILE 32 4.999 6.031 5.169 234 HA ILE 32 HA ILE 32 6.356 3.715 4.163 235 HB ILE 32 HB ILE 32 4.315 5.115 2.495 236 1HG1 ILE 32 1HG1 ILE 32 3.310 5.522 4.341 237 2HG1 ILE 32 2HG1 ILE 32 2.424 4.609 3.099 238 1HG2 ILE 32 3HG2 ILE 32 5.571 2.857 2.070 239 2HG2 ILE 32 1HG2 ILE 32 4.277 2.171 3.080 240 3HG2 ILE 32 2HG2 ILE 32 3.896 3.025 1.550 241 1HD1 ILE 32 2HD1 ILE 32 2.404 2.653 4.823 242 2HD1 ILE 32 3HD1 ILE 32 2.753 3.978 6.019 243 3HD1 ILE 32 1HD1 ILE 32 1.352 4.052 4.953 244 H THR 33 H THR 33 5.676 6.926 2.671 245 HA THR 33 HA THR 33 7.252 6.378 0.230 246 HB THR 33 HB THR 33 5.714 8.083 0.080 247 HG1 THR 33 HG1 THR 33 8.313 9.064 -0.349 248 1HG2 THR 33 3HG2 THR 33 5.929 9.268 2.256 249 2HG2 THR 33 1HG2 THR 33 7.484 9.964 1.759 250 3HG2 THR 33 2HG2 THR 33 5.976 10.411 0.899 251 H GLU 34 H GLU 34 8.358 7.417 3.317 252 HA GLU 34 HA GLU 34 11.190 7.831 2.346 253 1HB GLU 34 1HB GLU 34 10.291 9.206 4.337 254 2HB GLU 34 2HB GLU 34 10.167 7.723 5.262 255 1HG GLU 34 1HG GLU 34 12.189 8.880 5.927 256 2HG GLU 34 2HG GLU 34 12.678 7.411 5.110 257 HE1 GLU 34 HE2 GLU 34 13.525 11.078 3.620 258 H ALA 35 H ALA 35 9.117 5.192 3.618 259 HA ALA 35 HA ALA 35 11.387 3.362 3.952 260 1HB ALA 35 3HB ALA 35 9.023 2.731 5.022 261 2HB ALA 35 1HB ALA 35 8.400 2.613 3.380 262 3HB ALA 35 2HB ALA 35 9.581 1.458 3.934 263 H LEU 36 H LEU 36 8.862 3.551 1.257 264 HA LEU 36 HA LEU 36 10.331 1.769 -0.527 265 1HB LEU 36 2HB LEU 36 8.384 3.968 -1.056 266 2HB LEU 36 1HB LEU 36 8.811 2.747 -2.199 267 HG LEU 36 HG LEU 36 7.446 2.574 -0.043 268 1HD1 LEU 36 1HD2 LEU 36 9.070 0.106 -0.078 269 2HD1 LEU 36 2HD2 LEU 36 8.342 1.003 1.280 270 3HD1 LEU 36 3HD2 LEU 36 7.413 -0.205 0.432 271 1HD2 LEU 36 2HD1 LEU 36 5.621 2.614 -0.790 272 2HD2 LEU 36 3HD1 LEU 36 5.777 0.851 -1.037 273 3HD2 LEU 36 1HD1 LEU 36 5.878 1.464 0.591 274 NH1 ARG 37 NH2 ARG 37 15.445 10.588 -0.617 275 NH2 ARG 37 NH1 ARG 37 15.426 12.029 -2.375 276 H ARG 37 H ARG 37 10.389 5.393 -0.287 277 HA ARG 37 HA ARG 37 12.059 5.597 -2.541 278 1HB ARG 37 1HB ARG 37 10.899 7.594 -1.593 279 2HB ARG 37 2HB ARG 37 11.923 7.526 -0.153 280 1HG ARG 37 1HG ARG 37 13.946 8.034 -1.723 281 2HG ARG 37 2HG ARG 37 12.770 8.314 -3.001 282 1HD ARG 37 1HD ARG 37 11.650 10.048 -1.448 283 2HD ARG 37 2HD ARG 37 12.901 9.745 -0.249 284 1HH1 ARG 37 2HH2 ARG 37 14.941 9.878 -0.075 285 2HH1 ARG 37 1HH2 ARG 37 16.393 10.938 -0.439 286 1HH2 ARG 37 1HH1 ARG 37 14.911 12.419 -3.172 287 2HH2 ARG 37 2HH1 ARG 37 16.374 12.280 -2.074 288 H LYS 38 H LYS 38 12.893 4.692 0.796 289 HA LYS 38 HA LYS 38 15.875 5.128 0.245 290 1HB LYS 38 1HB LYS 38 14.781 6.468 2.155 291 2HB LYS 38 2HB LYS 38 14.596 4.945 3.010 292 1HG LYS 38 1HG LYS 38 17.125 4.678 3.017 293 2HG LYS 38 2HG LYS 38 17.273 6.137 2.054 294 1HD LYS 38 1HD LYS 38 17.765 6.687 4.368 295 2HD LYS 38 2HD LYS 38 16.301 7.513 3.885 296 1HE LYS 38 1HE LYS 38 16.009 6.720 6.161 297 2HE LYS 38 2HE LYS 38 14.895 5.816 5.146 298 1HZ LYS 38 1HZ LYS 38 16.451 3.961 5.172 299 2HZ LYS 38 2HZ LYS 38 16.012 4.383 6.689 300 H GLY 39 H GLY 39 14.112 2.754 -0.516 301 1HA GLY 39 1HA GLY 39 14.407 0.394 -0.689 302 2HA GLY 39 2HA GLY 39 16.034 0.602 -0.085 303 H ASP 40 H ASP 40 12.964 1.231 1.556 304 HA ASP 40 HA ASP 40 13.518 -0.959 3.621 305 1HB ASP 40 1HB ASP 40 11.960 1.461 4.389 306 2HB ASP 40 2HB ASP 40 12.557 0.185 5.383 307 HD2 ASP 40 HD2 ASP 40 14.821 3.350 4.581 308 H LYS 41 H LYS 41 12.121 -2.423 4.047 309 HA LYS 41 HA LYS 41 9.548 -2.559 2.469 310 1HB LYS 41 2HB LYS 41 10.418 -4.608 4.523 311 2HB LYS 41 1HB LYS 41 9.208 -4.811 3.274 312 1HG LYS 41 1HG LYS 41 11.081 -4.628 1.516 313 2HG LYS 41 2HG LYS 41 12.254 -4.581 2.830 314 1HD LYS 41 1HD LYS 41 11.392 -6.826 3.658 315 2HD LYS 41 2HD LYS 41 10.289 -6.908 2.297 316 1HE LYS 41 1HE LYS 41 13.380 -6.783 2.087 317 2HE LYS 41 2HE LYS 41 12.414 -8.254 2.005 318 1HZ LYS 41 1HZ LYS 41 13.008 -7.459 -0.172 319 2HZ LYS 41 2HZ LYS 41 12.292 -6.010 0.075 320 H VAL 42 H VAL 42 7.722 -1.678 3.375 321 HA VAL 42 HA VAL 42 7.477 -0.756 6.094 322 HB VAL 42 HB VAL 42 5.544 -1.101 3.729 323 1HG1 VAL 42 1HG2 VAL 42 5.502 0.724 6.121 324 2HG1 VAL 42 2HG2 VAL 42 4.369 0.850 4.720 325 3HG1 VAL 42 3HG2 VAL 42 4.348 -0.630 5.732 326 1HG2 VAL 42 2HG1 VAL 42 7.605 0.527 3.319 327 2HG2 VAL 42 3HG1 VAL 42 5.975 1.038 2.985 328 3HG2 VAL 42 1HG1 VAL 42 6.764 1.611 4.481 329 H GLN 43 H GLN 43 5.887 -1.539 7.245 330 HA GLN 43 HA GLN 43 4.578 -4.189 6.856 331 1HB GLN 43 1HB GLN 43 6.651 -4.359 8.980 332 2HB GLN 43 2HB GLN 43 5.349 -5.520 8.702 333 1HG GLN 43 1HG GLN 43 6.311 -5.757 6.333 334 2HG GLN 43 2HG GLN 43 7.625 -4.689 6.825 335 1HE2 GLN 43 2HE2 GLN 43 9.221 -7.908 7.216 336 2HE2 GLN 43 1HE2 GLN 43 8.754 -6.629 5.990 337 H LEU 44 H LEU 44 2.735 -4.392 7.486 338 HA LEU 44 HA LEU 44 1.652 -3.136 10.047 339 1HB LEU 44 2HB LEU 44 0.250 -3.084 7.312 340 2HB LEU 44 1HB LEU 44 -0.589 -2.764 8.805 341 HG LEU 44 HG LEU 44 1.840 -1.047 8.068 342 1HD1 LEU 44 1HD1 LEU 44 0.472 -1.072 5.993 343 2HD1 LEU 44 2HD1 LEU 44 -0.984 -0.613 6.910 344 3HD1 LEU 44 3HD1 LEU 44 0.393 0.514 6.782 345 1HD2 LEU 44 2HD2 LEU 44 0.788 -0.732 10.337 346 2HD2 LEU 44 3HD2 LEU 44 0.549 0.712 9.331 347 3HD2 LEU 44 1HD2 LEU 44 -0.793 -0.425 9.581 348 H ILE 45 H ILE 45 1.238 -5.012 11.141 349 HA ILE 45 HA ILE 45 1.052 -7.497 9.711 350 HB ILE 45 HB ILE 45 2.353 -7.219 11.837 351 1HG1 ILE 45 1HG1 ILE 45 1.852 -9.431 12.926 352 2HG1 ILE 45 2HG1 ILE 45 0.429 -9.611 11.914 353 1HG2 ILE 45 1HG2 ILE 45 0.654 -5.950 13.146 354 2HG2 ILE 45 2HG2 ILE 45 -0.356 -7.413 13.279 355 3HG2 ILE 45 3HG2 ILE 45 1.259 -7.359 14.042 356 1HD1 ILE 45 1HD1 ILE 45 3.348 -9.391 10.881 357 2HD1 ILE 45 2HD1 ILE 45 2.402 -10.892 11.026 358 3HD1 ILE 45 3HD1 ILE 45 1.915 -9.653 9.849 359 H GLY 46 H GLY 46 -1.311 -5.931 10.822 360 1HA GLY 46 1HA GLY 46 -3.430 -8.162 10.329 361 2HA GLY 46 2HA GLY 46 -3.815 -6.700 11.203 362 H PHE 47 H PHE 47 -1.927 -5.814 8.467 363 HA PHE 47 HA PHE 47 -4.310 -5.592 6.618 364 1HB PHE 47 2HB PHE 47 -4.058 -3.734 8.405 365 2HB PHE 47 1HB PHE 47 -2.604 -3.201 7.625 366 HD1 PHE 47 HD2 PHE 47 -6.322 -3.516 7.161 367 HD2 PHE 47 HD1 PHE 47 -2.666 -2.109 5.366 368 HE1 PHE 47 HE2 PHE 47 -7.585 -2.457 5.314 369 HE2 PHE 47 HE1 PHE 47 -3.958 -1.166 3.505 370 HZ PHE 47 HZ PHE 47 -6.423 -1.443 3.451 371 H GLY 48 H GLY 48 -0.699 -4.965 6.726 372 1HA GLY 48 1HA GLY 48 -0.592 -5.235 3.816 373 2HA GLY 48 2HA GLY 48 -0.611 -3.556 4.245 374 H ASN 49 H ASN 49 1.356 -5.901 3.343 375 HA ASN 49 HA ASN 49 3.829 -4.640 4.655 376 1HB ASN 49 1HB ASN 49 3.649 -7.015 5.101 377 2HB ASN 49 2HB ASN 49 3.454 -7.414 3.409 378 1HD2 ASN 49 1HD2 ASN 49 6.954 -8.262 4.230 379 2HD2 ASN 49 2HD2 ASN 49 5.251 -8.786 4.667 380 H PHE 50 H PHE 50 4.061 -2.841 3.362 381 HA PHE 50 HA PHE 50 3.975 -3.038 0.345 382 1HB PHE 50 2HB PHE 50 5.086 -0.614 1.855 383 2HB PHE 50 1HB PHE 50 4.837 -0.690 0.214 384 HD1 PHE 50 HD1 PHE 50 3.106 -0.909 3.472 385 HD2 PHE 50 HD2 PHE 50 3.145 0.718 -0.475 386 HE1 PHE 50 HE1 PHE 50 1.129 0.511 4.037 387 HE2 PHE 50 HE2 PHE 50 1.180 2.139 0.110 388 HZ PHE 50 HZ PHE 50 0.142 1.878 2.321 389 H GLU 51 H GLU 51 5.779 -2.738 -0.945 390 HA GLU 51 HA GLU 51 8.320 -2.141 0.100 391 1HB GLU 51 1HB GLU 51 9.639 -4.357 -0.264 392 2HB GLU 51 2HB GLU 51 8.452 -4.498 1.005 393 1HG GLU 51 1HG GLU 51 6.844 -5.609 -0.709 394 2HG GLU 51 2HG GLU 51 8.169 -5.602 -1.866 395 HE2 GLU 51 HE2 GLU 51 9.596 -8.439 -0.592 396 H VAL 52 H VAL 52 10.224 -2.156 -1.391 397 HA VAL 52 HA VAL 52 9.127 -1.303 -3.966 398 HB VAL 52 HB VAL 52 10.729 -0.202 -1.868 399 1HG1 VAL 52 1HG2 VAL 52 12.634 -0.970 -4.094 400 2HG1 VAL 52 2HG2 VAL 52 12.909 0.228 -2.774 401 3HG1 VAL 52 3HG2 VAL 52 12.652 -1.507 -2.401 402 1HG2 VAL 52 1HG1 VAL 52 9.309 1.016 -3.351 403 2HG2 VAL 52 2HG1 VAL 52 10.923 1.715 -3.257 404 3HG2 VAL 52 3HG1 VAL 52 10.452 0.811 -4.706 405 NH1 ARG 53 NH2 ARG 53 12.611 -4.755 -12.405 406 NH2 ARG 53 NH1 ARG 53 12.319 -7.005 -12.539 407 H ARG 53 H ARG 53 10.256 -1.657 -5.916 408 HA ARG 53 HA ARG 53 11.715 -4.374 -6.104 409 1HB ARG 53 1HB ARG 53 9.317 -4.357 -6.946 410 2HB ARG 53 2HB ARG 53 9.756 -3.197 -8.164 411 1HG ARG 53 1HG ARG 53 11.121 -5.957 -7.915 412 2HG ARG 53 2HG ARG 53 9.628 -5.693 -8.805 413 1HD ARG 53 1HD ARG 53 10.806 -4.001 -10.303 414 2HD ARG 53 2HD ARG 53 12.332 -4.361 -9.478 415 1HH1 ARG 53 2HH2 ARG 53 12.485 -3.897 -11.855 416 2HH1 ARG 53 1HH2 ARG 53 13.041 -4.832 -13.333 417 1HH2 ARG 53 1HH1 ARG 53 11.971 -7.863 -12.097 418 2HH2 ARG 53 2HH1 ARG 53 12.768 -6.925 -13.458 419 H GLU 54 H GLU 54 13.752 -3.628 -6.121 420 HA GLU 54 HA GLU 54 14.641 -1.179 -7.517 421 1HB GLU 54 1HB GLU 54 15.730 -2.126 -5.447 422 2HB GLU 54 2HB GLU 54 16.406 -3.435 -6.412 423 1HG GLU 54 1HG GLU 54 17.624 -1.681 -7.842 424 2HG GLU 54 2HG GLU 54 16.933 -0.406 -6.845 425 HE1 GLU 54 HE2 GLU 54 18.983 -0.966 -4.092 426 NH1 ARG 55 NH2 ARG 55 17.789 1.101 -14.724 427 NH2 ARG 55 NH1 ARG 55 16.164 2.686 -14.756 428 H ARG 55 H ARG 55 14.946 -0.974 -9.593 429 HA ARG 55 HA ARG 55 14.999 -3.339 -11.471 430 1HB ARG 55 1HB ARG 55 13.479 -1.452 -11.910 431 2HB ARG 55 2HB ARG 55 14.800 -0.313 -12.030 432 1HG ARG 55 1HG ARG 55 14.680 -2.768 -13.885 433 2HG ARG 55 2HG ARG 55 13.616 -1.413 -14.182 434 1HD ARG 55 1HD ARG 55 16.690 -1.230 -14.108 435 2HD ARG 55 2HD ARG 55 15.719 -1.370 -15.566 436 1HH1 ARG 55 2HH2 ARG 55 18.024 0.103 -14.675 437 2HH1 ARG 55 1HH2 ARG 55 18.447 1.885 -14.792 438 1HH2 ARG 55 1HH1 ARG 55 15.161 2.901 -14.732 439 2HH2 ARG 55 2HH1 ARG 55 16.936 3.359 -14.823 440 H ALA 56 H ALA 56 16.813 -4.081 -12.320 441 HA ALA 56 HA ALA 56 19.409 -3.265 -11.340 442 1HB ALA 56 2HB ALA 56 18.905 -5.611 -11.940 443 2HB ALA 56 3HB ALA 56 18.771 -5.187 -13.666 444 3HB ALA 56 1HB ALA 56 20.334 -5.047 -12.824 445 H ALA 57 H ALA 57 20.436 -1.511 -11.916 446 HA ALA 57 HA ALA 57 20.398 0.184 -14.011 447 1HB ALA 57 3HB ALA 57 21.922 0.492 -12.044 448 2HB ALA 57 1HB ALA 57 23.035 -0.755 -12.666 449 3HB ALA 57 2HB ALA 57 22.839 0.780 -13.533 450 NH1 ARG 58 NH2 ARG 58 15.570 1.940 -20.073 451 NH2 ARG 58 NH1 ARG 58 14.388 1.296 -18.241 452 H ARG 58 H ARG 58 20.704 0.467 -15.986 453 HA ARG 58 HA ARG 58 21.233 -1.898 -17.560 454 1HB ARG 58 2HB ARG 58 20.642 0.794 -18.861 455 2HB ARG 58 1HB ARG 58 20.328 -0.804 -19.514 456 1HG ARG 58 1HG ARG 58 18.558 -1.154 -17.719 457 2HG ARG 58 2HG ARG 58 18.886 0.482 -17.134 458 1HD ARG 58 1HD ARG 58 18.243 1.442 -19.379 459 2HD ARG 58 2HD ARG 58 17.819 -0.186 -19.948 460 1HH1 ARG 58 2HH2 ARG 58 16.459 1.905 -20.585 461 2HH1 ARG 58 1HH2 ARG 58 14.717 2.435 -20.356 462 1HH2 ARG 58 1HH1 ARG 58 14.372 0.773 -17.358 463 2HH2 ARG 58 2HH1 ARG 58 13.618 1.838 -18.648 464 H LYS 59 H LYS 59 22.328 -1.180 -19.945 465 HA LYS 59 HA LYS 59 25.076 0.034 -19.439 466 1HB LYS 59 1HB LYS 59 26.290 -1.714 -20.617 467 2HB LYS 59 2HB LYS 59 25.589 -2.256 -19.111 468 1HG LYS 59 1HG LYS 59 23.761 -3.466 -20.405 469 2HG LYS 59 2HG LYS 59 24.502 -2.940 -21.918 470 1HD LYS 59 1HD LYS 59 26.637 -4.140 -21.305 471 2HD LYS 59 2HD LYS 59 25.909 -4.666 -19.783 472 1HE LYS 59 1HE LYS 59 24.122 -5.936 -21.070 473 2HE LYS 59 2HE LYS 59 24.843 -5.407 -22.597 474 1HZ LYS 59 1HZ LYS 59 26.239 -7.017 -20.530 475 2HZ LYS 59 2HZ LYS 59 26.893 -6.538 -21.949 476 H GLY 60 H GLY 60 25.045 1.720 -20.714 477 1HA GLY 60 1HA GLY 60 23.854 1.531 -23.560 478 2HA GLY 60 2HA GLY 60 23.488 2.868 -22.493 479 NH1 ARG 61 NH2 ARG 61 31.066 1.991 -26.522 480 NH2 ARG 61 NH1 ARG 61 31.998 3.351 -28.085 481 H ARG 61 H ARG 61 24.446 4.514 -23.476 482 HA ARG 61 HA ARG 61 27.437 4.547 -23.847 483 1HB ARG 61 1HB ARG 61 26.094 3.764 -26.079 484 2HB ARG 61 2HB ARG 61 25.694 5.453 -26.227 485 1HG ARG 61 1HG ARG 61 27.584 5.103 -27.603 486 2HG ARG 61 2HG ARG 61 28.247 5.963 -26.217 487 1HD ARG 61 1HD ARG 61 29.118 3.802 -25.258 488 2HD ARG 61 2HD ARG 61 28.313 2.877 -26.534 489 1HH1 ARG 61 2HH2 ARG 61 30.283 1.818 -25.882 490 2HH1 ARG 61 1HH2 ARG 61 31.887 1.393 -26.665 491 1HH2 ARG 61 1HH1 ARG 61 31.932 4.216 -28.634 492 2HH2 ARG 61 2HH1 ARG 61 32.753 2.658 -28.118 493 H ASN 62 H ASN 62 28.338 6.494 -23.661 494 HA ASN 62 HA ASN 62 26.764 8.619 -22.344 495 1HB ASN 62 1HB ASN 62 29.082 7.845 -21.663 496 2HB ASN 62 2HB ASN 62 29.735 8.636 -23.087 497 1HD2 ASN 62 2HD2 ASN 62 29.032 10.920 -19.836 498 2HD2 ASN 62 1HD2 ASN 62 28.708 9.113 -19.860 499 HA PRO 63 HA PRO 63 25.914 10.850 -26.325 500 1HB PRO 63 1HB PRO 63 25.370 13.185 -24.422 501 2HB PRO 63 2HB PRO 63 24.419 12.631 -25.815 502 1HG PRO 63 1HG PRO 63 23.637 11.960 -23.301 503 2HG PRO 63 2HG PRO 63 23.568 10.728 -24.583 504 1HD PRO 63 1HD PRO 63 25.703 11.052 -22.405 505 2HD PRO 63 2HD PRO 63 24.911 9.569 -23.019 506 H GLN 64 H GLN 64 27.972 12.562 -23.922 507 HA GLN 64 HA GLN 64 29.163 14.403 -25.937 508 1HB GLN 64 1HB GLN 64 28.842 14.911 -23.393 509 2HB GLN 64 2HB GLN 64 30.128 13.786 -23.065 510 1HG GLN 64 1HG GLN 64 31.128 15.901 -22.956 511 2HG GLN 64 2HG GLN 64 31.719 15.208 -24.452 512 1HE2 GLN 64 2HE2 GLN 64 29.475 18.641 -24.684 513 2HE2 GLN 64 1HE2 GLN 64 29.695 17.730 -23.106 514 H THR 65 H THR 65 30.637 11.998 -23.851 515 HA THR 65 HA THR 65 33.147 11.899 -25.288 516 HB THR 65 HB THR 65 33.866 10.318 -23.571 517 HG1 THR 65 HG1 THR 65 32.016 9.065 -23.505 518 1HG2 THR 65 2HG2 THR 65 33.583 12.798 -22.879 519 2HG2 THR 65 3HG2 THR 65 31.986 12.390 -22.233 520 3HG2 THR 65 1HG2 THR 65 33.425 11.655 -21.509 521 H GLY 66 H GLY 66 30.476 9.588 -25.470 522 1HA GLY 66 1HA GLY 66 30.200 7.689 -26.931 523 2HA GLY 66 2HA GLY 66 31.699 8.098 -27.749 524 H GLU 67 H GLU 67 31.145 7.396 -24.286 525 HA GLU 67 HA GLU 67 32.802 4.836 -24.444 526 1HB GLU 67 2HB GLU 67 33.778 6.964 -23.337 527 2HB GLU 67 1HB GLU 67 32.519 6.861 -22.105 528 1HG GLU 67 1HG GLU 67 33.398 4.554 -21.445 529 2HG GLU 67 2HG GLU 67 34.635 4.677 -22.693 530 HE1 GLU 67 HE2 GLU 67 34.910 6.712 -19.206 531 H GLU 68 H GLU 68 31.996 3.091 -23.363 532 HA GLU 68 HA GLU 68 29.131 2.907 -23.029 533 1HB GLU 68 1HB GLU 68 30.730 1.036 -23.716 534 2HB GLU 68 2HB GLU 68 31.235 0.852 -22.052 535 1HG GLU 68 1HG GLU 68 28.365 0.420 -23.140 536 2HG GLU 68 2HG GLU 68 29.560 -0.836 -22.932 537 HE2 GLU 68 HE2 GLU 68 27.332 0.370 -19.859 538 H MET 69 H MET 69 27.942 3.585 -21.410 539 HA MET 69 HA MET 69 29.090 3.839 -18.578 540 1HB MET 69 1HB MET 69 27.953 5.926 -18.249 541 2HB MET 69 2HB MET 69 28.933 6.028 -19.688 542 1HG MET 69 1HG MET 69 26.987 7.150 -20.360 543 2HG MET 69 2HG MET 69 26.654 5.537 -21.016 544 1HE MET 69 1HE MET 69 24.488 7.451 -20.900 545 2HE MET 69 3HE MET 69 23.863 5.775 -21.015 546 3HE MET 69 2HE MET 69 23.169 6.916 -19.824 547 H GLU 70 H GLU 70 27.888 3.281 -16.868 548 HA GLU 70 HA GLU 70 25.583 1.514 -17.292 549 1HB GLU 70 2HB GLU 70 27.711 1.553 -15.485 550 2HB GLU 70 1HB GLU 70 26.502 2.296 -14.499 551 1HG GLU 70 1HG GLU 70 25.022 0.188 -15.100 552 2HG GLU 70 2HG GLU 70 26.395 -0.434 -16.016 553 HE1 GLU 70 HE2 GLU 70 28.193 -0.943 -14.953 554 H ILE 71 H ILE 71 23.510 2.151 -17.238 555 HA ILE 71 HA ILE 71 22.709 4.922 -16.529 556 HB ILE 71 HB ILE 71 21.267 2.502 -17.727 557 1HG1 ILE 71 1HG1 ILE 71 21.959 5.159 -19.129 558 2HG1 ILE 71 2HG1 ILE 71 23.135 3.866 -19.102 559 1HG2 ILE 71 3HG2 ILE 71 20.228 5.361 -17.347 560 2HG2 ILE 71 1HG2 ILE 71 19.423 4.082 -18.315 561 3HG2 ILE 71 2HG2 ILE 71 19.607 3.880 -16.560 562 1HD1 ILE 71 3HD1 ILE 71 20.346 3.563 -20.364 563 2HD1 ILE 71 1HD1 ILE 71 21.872 3.878 -21.216 564 3HD1 ILE 71 2HD1 ILE 71 21.652 2.340 -20.352 565 HA PRO 72 HA PRO 72 22.074 3.365 -12.213 566 1HB PRO 72 1HB PRO 72 20.406 5.945 -12.002 567 2HB PRO 72 2HB PRO 72 21.576 5.286 -10.840 568 1HG PRO 72 1HG PRO 72 22.339 7.286 -12.505 569 2HG PRO 72 2HG PRO 72 23.452 5.918 -12.242 570 1HD PRO 72 1HD PRO 72 21.619 6.416 -14.643 571 2HD PRO 72 2HD PRO 72 23.308 5.833 -14.597 572 H ALA 73 H ALA 73 20.560 2.598 -10.774 573 HA ALA 73 HA ALA 73 18.350 1.091 -11.770 574 1HB ALA 73 1HB ALA 73 19.557 0.730 -9.498 575 2HB ALA 73 2HB ALA 73 18.682 2.164 -8.854 576 3HB ALA 73 3HB ALA 73 17.795 0.720 -9.319 577 H SER 74 H SER 74 16.207 1.022 -10.750 578 HA SER 74 HA SER 74 15.264 3.413 -9.538 579 1HB SER 74 1HB SER 74 13.179 3.980 -10.933 580 2HB SER 74 2HB SER 74 14.665 4.217 -11.843 581 HG SER 74 HG SER 74 14.347 2.127 -12.744 582 H LYS 75 H LYS 75 14.065 3.045 -7.931 583 HA LYS 75 HA LYS 75 13.034 0.308 -7.326 584 1HB LYS 75 2HB LYS 75 12.400 2.416 -5.330 585 2HB LYS 75 1HB LYS 75 12.920 0.768 -5.175 586 1HG LYS 75 1HG LYS 75 15.288 1.421 -5.714 587 2HG LYS 75 2HG LYS 75 14.777 3.097 -5.926 588 1HD LYS 75 1HD LYS 75 13.975 3.152 -3.522 589 2HD LYS 75 2HD LYS 75 14.591 1.524 -3.278 590 1HE LYS 75 1HE LYS 75 16.328 3.955 -4.085 591 2HE LYS 75 2HE LYS 75 16.102 3.379 -2.436 592 1HZ LYS 75 1HZ LYS 75 17.068 1.252 -3.088 593 2HZ LYS 75 2HZ LYS 75 17.296 1.773 -4.620 594 H VAL 76 H VAL 76 10.758 -0.421 -7.697 595 HA VAL 76 HA VAL 76 8.805 1.579 -8.376 596 HB VAL 76 HB VAL 76 9.924 -1.142 -9.061 597 1HG1 VAL 76 3HG2 VAL 76 7.022 -0.812 -9.314 598 2HG1 VAL 76 1HG2 VAL 76 8.122 -2.081 -10.072 599 3HG1 VAL 76 2HG2 VAL 76 7.958 -1.975 -8.306 600 1HG2 VAL 76 2HG1 VAL 76 10.309 0.840 -10.464 601 2HG2 VAL 76 3HG1 VAL 76 9.485 -0.484 -11.316 602 3HG2 VAL 76 1HG1 VAL 76 8.543 0.949 -10.768 603 HA PRO 77 HA PRO 77 7.027 0.176 -4.349 604 1HB PRO 77 1HB PRO 77 4.935 2.004 -4.142 605 2HB PRO 77 2HB PRO 77 6.616 2.551 -4.191 606 1HG PRO 77 1HG PRO 77 4.609 2.461 -6.488 607 2HG PRO 77 2HG PRO 77 5.694 3.785 -6.043 608 1HD PRO 77 1HD PRO 77 6.224 1.703 -8.054 609 2HD PRO 77 2HD PRO 77 7.477 2.727 -7.330 610 H ALA 78 H ALA 78 5.816 -1.099 -3.585 611 HA ALA 78 HA ALA 78 3.245 -2.111 -4.904 612 1HB ALA 78 2HB ALA 78 5.394 -3.400 -5.484 613 2HB ALA 78 3HB ALA 78 5.584 -3.793 -3.762 614 3HB ALA 78 1HB ALA 78 4.166 -4.390 -4.658 615 H PHE 79 H PHE 79 2.134 -3.582 -3.472 616 HA PHE 79 HA PHE 79 2.054 -2.878 -0.437 617 1HB PHE 79 2HB PHE 79 0.873 -1.175 -1.054 618 2HB PHE 79 1HB PHE 79 -0.026 -2.097 -2.311 619 HD1 PHE 79 HD2 PHE 79 0.221 -1.539 1.385 620 HD2 PHE 79 HD1 PHE 79 -2.021 -3.411 -1.771 621 HE1 PHE 79 HE2 PHE 79 -1.571 -2.100 2.971 622 HE2 PHE 79 HE1 PHE 79 -3.760 -4.042 -0.154 623 HZ PHE 79 HZ PHE 79 -3.520 -3.432 2.225 624 H LYS 80 H LYS 80 1.905 -4.770 0.262 625 HA LYS 80 HA LYS 80 0.513 -7.350 -0.887 626 1HB LYS 80 2HB LYS 80 2.234 -7.125 1.594 627 2HB LYS 80 1HB LYS 80 1.377 -8.557 1.053 628 1HG LYS 80 1HG LYS 80 2.731 -8.631 -1.059 629 2HG LYS 80 2HG LYS 80 3.605 -7.176 -0.576 630 1HD LYS 80 1HD LYS 80 4.488 -8.354 1.465 631 2HD LYS 80 2HD LYS 80 3.605 -9.819 1.017 632 1HE LYS 80 1HE LYS 80 4.946 -9.957 -1.143 633 2HE LYS 80 2HE LYS 80 5.820 -8.486 -0.693 634 1HZ LYS 80 1HZ LYS 80 5.820 -11.042 0.816 635 2HZ LYS 80 2HZ LYS 80 7.036 -10.475 -0.117 636 HA PRO 81 HA PRO 81 -2.810 -6.075 1.981 637 1HB PRO 81 1HB PRO 81 -4.532 -8.194 1.644 638 2HB PRO 81 2HB PRO 81 -4.155 -7.078 0.328 639 1HG PRO 81 1HG PRO 81 -2.895 -9.827 0.851 640 2HG PRO 81 2HG PRO 81 -3.656 -9.254 -0.657 641 1HD PRO 81 1HD PRO 81 -0.905 -9.116 -0.181 642 2HD PRO 81 2HD PRO 81 -1.751 -7.913 -1.206 643 H GLY 82 H GLY 82 -0.424 -6.997 3.220 644 1HA GLY 82 1HA GLY 82 0.632 -8.424 4.844 645 2HA GLY 82 2HA GLY 82 -0.750 -7.820 5.735 646 H LYS 83 H LYS 83 -1.490 -10.035 3.252 647 HA LYS 83 HA LYS 83 -2.429 -12.248 3.251 648 1HB LYS 83 2HB LYS 83 -0.572 -12.577 5.598 649 2HB LYS 83 1HB LYS 83 -2.000 -13.526 5.773 650 1HG LYS 83 1HG LYS 83 -1.567 -14.565 3.466 651 2HG LYS 83 2HG LYS 83 -0.118 -13.568 3.307 652 1HD LYS 83 1HD LYS 83 0.862 -14.659 5.366 653 2HD LYS 83 2HD LYS 83 -0.563 -15.671 5.539 654 1HE LYS 83 1HE LYS 83 1.330 -15.704 3.081 655 2HE LYS 83 2HE LYS 83 1.456 -16.797 4.457 656 1HZ LYS 83 1HZ LYS 83 -0.732 -17.657 3.963 657 2HZ LYS 83 2HZ LYS 83 0.273 -17.837 2.687 658 H ALA 84 H ALA 84 -2.686 -10.703 6.203 659 HA ALA 84 HA ALA 84 -5.120 -11.637 7.438 660 1HB ALA 84 2HB ALA 84 -3.239 -10.339 8.474 661 2HB ALA 84 3HB ALA 84 -3.584 -8.944 7.418 662 3HB ALA 84 1HB ALA 84 -4.772 -9.421 8.660 663 H LEU 85 H LEU 85 -4.633 -8.704 5.292 664 HA LEU 85 HA LEU 85 -7.478 -8.012 5.240 665 1HB LEU 85 2HB LEU 85 -5.754 -6.271 4.866 666 2HB LEU 85 1HB LEU 85 -5.131 -7.145 3.484 667 HG LEU 85 HG LEU 85 -7.468 -7.033 2.542 668 1HD1 LEU 85 1HD1 LEU 85 -8.773 -6.234 4.462 669 2HD1 LEU 85 2HD1 LEU 85 -7.806 -4.748 4.548 670 3HD1 LEU 85 3HD1 LEU 85 -8.890 -5.037 3.158 671 1HD2 LEU 85 1HD2 LEU 85 -5.476 -5.717 1.643 672 2HD2 LEU 85 2HD2 LEU 85 -6.980 -4.826 1.428 673 3HD2 LEU 85 3HD2 LEU 85 -5.860 -4.378 2.745 674 H LYS 86 H LYS 86 -5.310 -10.001 3.232 675 HA LYS 86 HA LYS 86 -7.226 -10.662 1.140 676 1HB LYS 86 1HB LYS 86 -4.688 -11.191 1.145 677 2HB LYS 86 2HB LYS 86 -5.071 -12.636 2.065 678 1HG LYS 86 1HG LYS 86 -6.595 -13.400 0.190 679 2HG LYS 86 2HG LYS 86 -6.225 -11.920 -0.703 680 1HD LYS 86 1HD LYS 86 -3.780 -12.570 -0.771 681 2HD LYS 86 2HD LYS 86 -4.143 -14.044 0.136 682 1HE LYS 86 1HE LYS 86 -5.670 -14.829 -1.741 683 2HE LYS 86 2HE LYS 86 -5.315 -13.352 -2.650 684 1HZ LYS 86 1HZ LYS 86 -3.341 -15.414 -1.840 685 2HZ LYS 86 2HZ LYS 86 -3.944 -15.198 -3.344 686 H ASP 87 H ASP 87 -7.137 -11.795 4.489 687 HA ASP 87 HA ASP 87 -9.152 -13.946 4.056 688 1HB ASP 87 1HB ASP 87 -7.160 -13.213 6.048 689 2HB ASP 87 2HB ASP 87 -8.643 -12.824 6.806 690 HD1 ASP 87 HD2 ASP 87 -7.549 -16.654 5.968 691 H ALA 88 H ALA 88 -9.116 -10.582 5.354 692 HA ALA 88 HA ALA 88 -11.894 -10.220 6.096 693 1HB ALA 88 1HB ALA 88 -10.043 -8.412 6.366 694 2HB ALA 88 2HB ALA 88 -10.069 -8.160 4.619 695 3HB ALA 88 3HB ALA 88 -11.494 -7.763 5.550 696 H VAL 89 H VAL 89 -10.311 -9.785 2.927 697 HA VAL 89 HA VAL 89 -12.727 -8.894 1.540 698 HB VAL 89 HB VAL 89 -10.134 -8.064 1.846 699 1HG1 VAL 89 2HG2 VAL 89 -9.300 -10.369 0.998 700 2HG1 VAL 89 3HG2 VAL 89 -9.683 -9.792 -0.629 701 3HG1 VAL 89 1HG2 VAL 89 -8.532 -8.892 0.418 702 1HG2 VAL 89 2HG1 VAL 89 -11.522 -7.914 -0.781 703 2HG2 VAL 89 3HG1 VAL 89 -11.689 -6.864 0.681 704 3HG2 VAL 89 1HG1 VAL 89 -10.120 -6.938 -0.167 705 H LYS 90 H LYS 90 -11.435 -12.048 1.925 706 HA LYS 90 HA LYS 90 -11.539 -13.095 -0.740 707 1HB LYS 90 1HB LYS 90 -10.760 -14.013 1.831 708 2HB LYS 90 2HB LYS 90 -12.146 -15.015 1.554 709 1HG LYS 90 1HG LYS 90 -11.116 -15.854 -0.593 710 2HG LYS 90 2HG LYS 90 -9.793 -14.694 -0.425 711 1HD LYS 90 1HD LYS 90 -9.165 -15.777 1.803 712 2HD LYS 90 2HD LYS 90 -10.383 -17.014 1.534 713 1HE LYS 90 1HE LYS 90 -7.956 -16.452 -0.313 714 2HE LYS 90 2HE LYS 90 -8.005 -17.686 0.943 715 1HZ LYS 90 1HZ LYS 90 -8.475 -18.600 -1.225 716 2HZ LYS 90 2HZ LYS 90 -9.754 -17.607 -1.450 717 1H MET 1 1H MET 91 8.615 -1.530 7.992 718 2H MET 1 2H MET 91 9.871 -2.216 8.875 719 HA MET 1 HA MET 91 9.125 -1.206 10.609 720 1HB MET 1 1HB MET 91 6.555 -0.667 8.980 721 2HB MET 1 2HB MET 91 6.791 -0.105 10.610 722 1HG MET 1 1HG MET 91 9.043 1.006 9.707 723 2HG MET 1 2HG MET 91 8.328 0.780 8.107 724 1HE MET 1 2HE MET 91 7.262 2.682 7.070 725 2HE MET 1 1HE MET 91 5.598 2.254 7.601 726 3HE MET 1 3HE MET 91 6.205 3.893 7.843 727 H ASN 2 H ASN 92 5.875 -2.277 10.375 728 HA ASN 2 HA ASN 92 5.553 -4.765 10.796 729 1HB ASN 2 1HB ASN 92 5.670 -5.784 12.928 730 2HB ASN 2 2HB ASN 92 7.236 -5.204 12.484 731 1HD2 ASN 2 1HD2 ASN 92 5.547 -3.778 15.908 732 2HD2 ASN 2 2HD2 ASN 92 4.606 -4.694 14.625 733 H LYS 3 H LYS 93 4.847 -1.911 12.376 734 HA LYS 3 HA LYS 93 2.421 -1.059 11.986 735 1HB LYS 3 1HB LYS 93 1.269 -3.284 12.205 736 2HB LYS 3 2HB LYS 93 1.717 -3.387 13.894 737 1HG LYS 3 1HG LYS 93 0.228 -1.540 14.481 738 2HG LYS 3 2HG LYS 93 0.055 -1.013 12.819 739 1HD LYS 3 1HD LYS 93 -1.016 -3.730 13.816 740 2HD LYS 3 2HD LYS 93 -1.934 -2.231 13.913 741 1HE LYS 3 1HE LYS 93 -1.767 -1.933 11.392 742 2HE LYS 3 2HE LYS 93 -0.904 -3.471 11.273 743 1HZ LYS 3 1HZ LYS 93 -2.839 -4.557 12.263 744 2HZ LYS 3 2HZ LYS 93 -3.635 -3.134 12.381 745 H THR 4 H THR 94 4.676 -1.895 14.602 746 HA THR 4 HA THR 94 3.743 0.261 16.322 747 HB THR 4 HB THR 94 5.819 -2.023 16.469 748 HG1 THR 4 HG1 THR 94 4.289 -2.929 17.923 749 1HG2 THR 4 3HG2 THR 94 4.740 -0.049 18.490 750 2HG2 THR 4 1HG2 THR 94 5.684 -1.562 18.906 751 3HG2 THR 4 2HG2 THR 94 6.432 -0.256 17.900 752 H GLU 5 H GLU 95 6.275 -0.498 14.063 753 HA GLU 5 HA GLU 95 8.022 1.828 14.897 754 1HB GLU 5 1HB GLU 95 8.158 0.630 12.107 755 2HB GLU 5 2HB GLU 95 9.353 1.585 12.930 756 1HG GLU 5 1HG GLU 95 8.599 -1.344 13.496 757 2HG GLU 5 2HG GLU 95 10.038 -0.782 12.684 758 HE1 GLU 5 HE2 GLU 95 11.761 0.168 15.560 759 H LEU 6 H LEU 96 4.980 1.268 13.238 760 HA LEU 6 HA LEU 96 4.852 3.814 11.828 761 1HB LEU 6 2HB LEU 96 3.485 1.134 12.040 762 2HB LEU 6 1HB LEU 96 2.318 2.268 12.547 763 HG LEU 6 HG LEU 96 1.941 2.608 10.426 764 1HD1 LEU 6 2HD1 LEU 96 3.087 4.714 10.345 765 2HD1 LEU 6 3HD1 LEU 96 4.543 3.937 9.677 766 3HD1 LEU 6 1HD1 LEU 96 3.045 3.953 8.738 767 1HD2 LEU 6 2HD2 LEU 96 3.006 0.372 9.876 768 2HD2 LEU 6 3HD2 LEU 96 3.085 1.455 8.473 769 3HD2 LEU 6 1HD2 LEU 96 4.524 1.198 9.495 770 H ILE 7 H ILE 97 3.732 2.362 14.924 771 HA ILE 7 HA ILE 97 2.039 4.575 15.780 772 HB ILE 7 HB ILE 97 3.579 2.569 17.525 773 1HG1 ILE 7 1HG1 ILE 97 0.613 2.555 16.762 774 2HG1 ILE 7 2HG1 ILE 97 1.727 1.818 15.712 775 1HG2 ILE 7 2HG2 ILE 97 2.784 4.604 18.880 776 2HG2 ILE 7 3HG2 ILE 97 1.144 4.279 18.302 777 3HG2 ILE 7 1HG2 ILE 97 1.952 3.107 19.349 778 1HD1 ILE 7 1HD1 ILE 97 2.531 0.454 17.893 779 2HD1 ILE 7 2HD1 ILE 97 0.891 0.803 18.383 780 3HD1 ILE 7 3HD1 ILE 97 1.181 -0.043 16.828 781 H ASN 8 H ASN 98 5.471 3.884 16.463 782 HA ASN 8 HA ASN 98 5.956 6.602 17.635 783 1HB ASN 8 1HB ASN 98 8.037 4.595 16.483 784 2HB ASN 8 2HB ASN 98 8.453 6.062 17.338 785 1HD2 ASN 8 2HD2 ASN 98 7.622 2.799 19.586 786 2HD2 ASN 8 1HD2 ASN 98 7.625 2.781 17.750 787 H ALA 9 H ALA 99 5.435 5.775 14.390 788 HA ALA 9 HA ALA 99 7.005 8.059 13.201 789 1HB ALA 9 2HB ALA 99 6.124 5.945 11.711 790 2HB ALA 9 3HB ALA 99 4.501 6.569 11.966 791 3HB ALA 9 1HB ALA 99 5.595 7.558 11.091 792 H VAL 10 H VAL 100 3.650 7.319 14.073 793 HA VAL 10 HA VAL 100 2.648 9.818 13.165 794 HB VAL 10 HB VAL 100 0.819 8.393 15.016 795 1HG1 VAL 10 3HG2 VAL 100 0.397 10.341 13.357 796 2HG1 VAL 10 1HG2 VAL 100 0.285 9.033 12.140 797 3HG1 VAL 10 2HG2 VAL 100 -0.787 9.000 13.567 798 1HG2 VAL 10 1HG1 VAL 100 1.946 7.149 12.417 799 2HG2 VAL 10 2HG1 VAL 100 1.826 6.448 14.063 800 3HG2 VAL 10 3HG1 VAL 100 0.341 6.670 13.067 801 H ALA 11 H ALA 101 3.066 8.407 16.147 802 HA ALA 11 HA ALA 101 2.416 10.745 17.574 803 1HB ALA 11 2HB ALA 101 2.350 8.484 18.725 804 2HB ALA 11 3HB ALA 101 4.099 8.264 18.468 805 3HB ALA 11 1HB ALA 101 3.517 9.455 19.650 806 H GLU 12 H GLU 102 5.480 9.910 16.113 807 HA GLU 12 HA GLU 102 6.796 12.192 17.581 808 1HB GLU 12 1HB GLU 102 8.158 10.060 17.012 809 2HB GLU 12 2HB GLU 102 7.887 10.376 15.310 810 1HG GLU 12 1HG GLU 102 10.123 11.064 15.817 811 2HG GLU 12 2HG GLU 102 9.214 12.518 15.465 812 HE2 GLU 12 HE2 GLU 102 9.580 13.916 18.610 813 H THR 13 H THR 103 5.748 11.473 14.174 814 HA THR 13 HA THR 103 6.332 14.365 13.628 815 HB THR 13 HB THR 103 6.898 12.320 12.160 816 HG1 THR 13 HG1 THR 103 6.015 14.791 11.101 817 1HG2 THR 13 3HG2 THR 103 4.629 11.561 11.593 818 2HG2 THR 13 1HG2 THR 103 4.303 13.100 10.756 819 3HG2 THR 13 2HG2 THR 103 5.580 12.001 10.157 820 H SER 14 H SER 104 3.929 13.264 14.999 821 HA SER 14 HA SER 104 2.235 15.719 14.108 822 1HB SER 14 1HB SER 104 1.072 13.512 13.617 823 2HB SER 14 2HB SER 104 1.028 13.218 15.363 824 HG SER 14 HG SER 104 -0.852 14.192 14.569 825 H GLY 15 H GLY 105 2.925 13.742 17.129 826 1HA GLY 15 1HA GLY 105 3.662 15.566 19.101 827 2HA GLY 15 2HA GLY 105 1.972 16.081 18.799 828 H LEU 16 H LEU 106 0.822 13.883 18.116 829 HA LEU 16 HA LEU 106 -0.668 12.741 19.754 830 1HB LEU 16 1HB LEU 106 1.053 12.069 17.350 831 2HB LEU 16 2HB LEU 106 0.563 10.595 18.210 832 HG LEU 16 HG LEU 106 -1.196 12.687 17.013 833 1HD1 LEU 16 3HD2 LEU 106 -0.565 9.892 15.990 834 2HD1 LEU 16 1HD2 LEU 106 -1.804 10.995 15.335 835 3HD1 LEU 16 2HD2 LEU 106 -0.094 11.435 15.230 836 1HD2 LEU 16 1HD1 LEU 106 -1.541 9.932 18.299 837 2HD2 LEU 16 2HD1 LEU 106 -2.139 11.474 18.988 838 3HD2 LEU 16 3HD1 LEU 106 -2.894 10.821 17.481 839 H SER 17 H SER 107 -0.952 11.262 20.860 840 HA SER 17 HA SER 107 0.942 9.934 22.821 841 1HB SER 17 1HB SER 107 -1.955 9.107 22.486 842 2HB SER 17 2HB SER 107 -0.875 8.725 23.817 843 HG SER 17 HG SER 107 -2.223 10.468 24.287 844 H LYS 18 H LYS 108 1.242 7.683 23.068 845 HA LYS 18 HA LYS 108 1.794 6.217 20.470 846 1HB LYS 18 1HB LYS 108 2.334 5.316 23.361 847 2HB LYS 18 2HB LYS 108 2.519 4.279 21.953 848 1HG LYS 18 1HG LYS 108 4.141 6.015 20.933 849 2HG LYS 18 2HG LYS 108 4.044 6.903 22.444 850 1HD LYS 18 1HD LYS 108 6.048 5.628 22.541 851 2HD LYS 18 2HD LYS 108 4.947 4.867 23.685 852 1HE LYS 18 1HE LYS 108 4.452 3.030 22.002 853 2HE LYS 18 2HE LYS 108 5.459 3.841 20.797 854 1HZ LYS 18 1HZ LYS 108 6.658 2.098 21.894 855 2HZ LYS 18 2HZ LYS 108 7.364 3.534 22.231 856 H LYS 19 H LYS 109 -0.417 5.842 23.261 857 HA LYS 19 HA LYS 109 -2.063 3.728 22.044 858 1HB LYS 19 2HB LYS 109 -2.174 4.193 24.458 859 2HB LYS 19 1HB LYS 109 -2.770 5.833 24.188 860 1HG LYS 19 1HG LYS 109 -4.582 4.405 24.933 861 2HG LYS 19 2HG LYS 109 -4.915 4.962 23.304 862 1HD LYS 19 1HD LYS 109 -4.141 2.701 22.397 863 2HD LYS 19 2HD LYS 109 -3.854 2.157 24.054 864 1HE LYS 19 1HE LYS 109 -6.318 2.504 24.586 865 2HE LYS 19 2HE LYS 109 -6.596 3.089 22.938 866 1HZ LYS 19 1HZ LYS 109 -5.580 0.386 23.628 867 2HZ LYS 19 2HZ LYS 109 -5.850 0.931 22.111 868 H ASP 20 H ASP 110 -2.130 7.350 21.618 869 HA ASP 20 HA ASP 110 -4.647 7.133 19.952 870 1HB ASP 20 1HB ASP 110 -2.762 9.529 20.308 871 2HB ASP 20 2HB ASP 110 -4.234 9.547 19.337 872 HD2 ASP 20 HD2 ASP 110 -4.741 10.940 22.732 873 H ALA 21 H ALA 111 -1.209 7.045 19.273 874 HA ALA 21 HA ALA 111 -1.446 7.286 16.320 875 1HB ALA 21 1HB ALA 111 0.831 6.361 18.184 876 2HB ALA 21 2HB ALA 111 0.974 6.438 16.415 877 3HB ALA 21 3HB ALA 111 0.652 7.907 17.351 878 H THR 22 H THR 112 -1.302 4.469 18.582 879 HA THR 22 HA THR 112 -1.355 2.335 16.624 880 HB THR 22 HB THR 112 -2.698 2.263 19.412 881 HG1 THR 22 HG1 THR 112 -0.662 3.205 19.603 882 1HG2 THR 22 1HG2 THR 112 -1.157 0.210 17.711 883 2HG2 THR 22 2HG2 THR 112 -1.657 -0.060 19.405 884 3HG2 THR 22 3HG2 THR 112 -2.890 0.175 18.116 885 H LYS 23 H LYS 113 -3.957 3.965 18.270 886 HA LYS 23 HA LYS 113 -6.223 2.695 16.894 887 1HB LYS 23 2HB LYS 113 -5.758 5.542 18.118 888 2HB LYS 23 1HB LYS 113 -7.299 5.110 17.476 889 1HG LYS 23 1HG LYS 113 -7.369 3.049 19.085 890 2HG LYS 23 2HG LYS 113 -5.974 3.722 19.902 891 1HD LYS 23 1HD LYS 113 -8.734 5.079 19.596 892 2HD LYS 23 2HD LYS 113 -8.179 4.183 21.004 893 1HE LYS 23 1HE LYS 113 -6.287 5.889 21.322 894 2HE LYS 23 2HE LYS 113 -6.956 6.828 19.975 895 1HZ LYS 23 1HZ LYS 113 -7.727 7.604 22.119 896 2HZ LYS 23 2HZ LYS 113 -8.375 6.150 22.491 897 H ALA 24 H ALA 114 -4.651 5.746 16.261 898 HA ALA 24 HA ALA 114 -6.140 6.627 14.015 899 1HB ALA 24 2HB ALA 114 -4.807 8.049 15.345 900 2HB ALA 24 3HB ALA 114 -3.290 7.235 14.831 901 3HB ALA 24 1HB ALA 114 -4.268 8.183 13.650 902 H VAL 25 H VAL 115 -3.217 4.620 13.919 903 HA VAL 25 HA VAL 115 -3.145 4.132 10.923 904 HB VAL 25 HB VAL 115 -2.206 2.857 13.696 905 1HG1 VAL 25 2HG2 VAL 115 -1.769 1.397 11.023 906 2HG1 VAL 25 3HG2 VAL 115 -0.978 1.000 12.588 907 3HG1 VAL 25 1HG2 VAL 115 -2.714 0.816 12.405 908 1HG2 VAL 25 1HG1 VAL 115 -0.870 4.735 12.790 909 2HG2 VAL 25 2HG1 VAL 115 0.061 3.247 12.985 910 3HG2 VAL 25 3HG1 VAL 115 -0.457 3.760 11.347 911 H ASP 26 H ASP 116 -4.486 2.103 13.623 912 HA ASP 26 HA ASP 116 -6.299 0.588 11.766 913 1HB ASP 26 1HB ASP 116 -6.282 0.865 14.835 914 2HB ASP 26 2HB ASP 116 -7.333 -0.238 13.964 915 HD1 ASP 26 HD2 ASP 116 -4.879 -2.549 13.088 916 H ALA 27 H ALA 117 -6.503 3.534 12.235 917 HA ALA 27 HA ALA 117 -9.511 3.957 12.216 918 1HB ALA 27 2HB ALA 117 -7.922 5.328 13.859 919 2HB ALA 27 3HB ALA 117 -7.567 6.242 12.397 920 3HB ALA 27 1HB ALA 117 -9.211 6.113 13.037 921 H VAL 28 H VAL 118 -6.579 4.746 10.441 922 HA VAL 28 HA VAL 118 -7.852 5.598 7.906 923 HB VAL 28 HB VAL 118 -5.098 4.118 8.123 924 1HG1 VAL 28 1HG2 VAL 118 -6.632 5.393 5.935 925 2HG1 VAL 28 2HG2 VAL 118 -4.990 6.006 6.047 926 3HG1 VAL 28 3HG2 VAL 118 -5.228 4.251 5.936 927 1HG2 VAL 28 3HG1 VAL 118 -5.464 7.059 8.417 928 2HG2 VAL 28 1HG1 VAL 118 -4.707 5.830 9.523 929 3HG2 VAL 28 2HG1 VAL 118 -3.941 6.182 7.964 930 H PHE 29 H PHE 119 -6.176 2.721 8.843 931 HA PHE 29 HA PHE 119 -6.933 0.964 6.638 932 1HB PHE 29 2HB PHE 119 -5.539 0.286 9.275 933 2HB PHE 29 1HB PHE 119 -5.579 -0.768 7.880 934 HD1 PHE 29 HD2 PHE 119 -4.979 0.750 5.526 935 HD2 PHE 29 HD1 PHE 119 -3.323 1.190 9.453 936 HE1 PHE 29 HE2 PHE 119 -3.131 2.061 4.589 937 HE2 PHE 29 HE1 PHE 119 -1.468 2.502 8.517 938 HZ PHE 29 HZ PHE 119 -1.443 3.020 6.072 939 H ASP 30 H ASP 120 -8.763 1.588 9.471 940 HA ASP 30 HA ASP 120 -10.335 -0.953 9.144 941 1HB ASP 30 1HB ASP 120 -10.076 0.472 11.337 942 2HB ASP 30 2HB ASP 120 -11.285 1.550 10.699 943 HD1 ASP 30 HD2 ASP 120 -13.983 -0.549 11.213 944 H SER 31 H SER 121 -10.656 2.361 8.280 945 HA SER 31 HA SER 121 -13.332 2.163 6.902 946 1HB SER 31 2HB SER 121 -11.215 4.388 6.693 947 2HB SER 31 1HB SER 121 -12.827 4.438 5.948 948 HG SER 31 HG SER 121 -12.260 4.116 8.710 949 H ILE 32 H ILE 122 -9.851 1.969 5.638 950 HA ILE 32 HA ILE 122 -10.430 1.556 2.932 951 HB ILE 32 HB ILE 122 -8.131 0.279 4.406 952 1HG1 ILE 32 1HG1 ILE 122 -8.810 3.162 4.075 953 2HG1 ILE 32 2HG1 ILE 122 -8.095 2.215 5.360 954 1HG2 ILE 32 3HG2 ILE 122 -8.762 -0.036 1.800 955 2HG2 ILE 32 1HG2 ILE 122 -8.177 1.597 1.652 956 3HG2 ILE 32 2HG2 ILE 122 -7.075 0.353 2.225 957 1HD1 ILE 32 1HD1 ILE 122 -6.511 2.892 2.901 958 2HD1 ILE 32 2HD1 ILE 122 -6.716 3.986 4.291 959 3HD1 ILE 32 3HD1 ILE 122 -5.952 2.387 4.549 960 H THR 33 H THR 123 -9.812 -0.883 5.461 961 HA THR 33 HA THR 123 -10.447 -3.163 3.669 962 HB THR 33 HB THR 123 -9.239 -3.599 5.756 963 HG1 THR 33 HG1 THR 123 -10.516 -5.253 4.942 964 1HG2 THR 33 3HG2 THR 123 -10.489 -1.859 7.167 965 2HG2 THR 33 1HG2 THR 123 -11.751 -3.037 7.438 966 3HG2 THR 33 2HG2 THR 123 -10.064 -3.346 8.015 967 H GLU 34 H GLU 124 -12.622 -1.114 5.568 968 HA GLU 34 HA GLU 124 -15.052 -2.729 4.858 969 1HB GLU 34 1HB GLU 124 -14.710 0.156 5.937 970 2HB GLU 34 2HB GLU 124 -16.281 -0.478 5.506 971 1HG GLU 34 1HG GLU 124 -14.454 -1.686 7.680 972 2HG GLU 34 2HG GLU 124 -15.798 -0.599 7.967 973 HE1 GLU 34 HE2 GLU 124 -17.803 -1.249 7.438 974 H ALA 35 H ALA 125 -13.246 -0.091 3.289 975 HA ALA 35 HA ALA 125 -15.118 0.191 1.051 976 1HB ALA 35 2HB ALA 125 -13.018 1.894 1.508 977 2HB ALA 35 3HB ALA 125 -11.989 0.616 0.914 978 3HB ALA 35 1HB ALA 125 -13.115 1.350 -0.171 979 H LEU 36 H LEU 126 -12.072 -1.708 1.353 980 HA LEU 36 HA LEU 126 -12.129 -3.097 -1.198 981 1HB LEU 36 2HB LEU 126 -10.844 -4.020 1.319 982 2HB LEU 36 1HB LEU 126 -10.366 -4.373 -0.323 983 HG LEU 36 HG LEU 126 -10.110 -1.596 0.952 984 1HD1 LEU 36 3HD2 LEU 126 -8.275 -3.018 1.452 985 2HD1 LEU 36 1HD2 LEU 126 -8.012 -3.329 -0.324 986 3HD1 LEU 36 2HD2 LEU 126 -7.798 -1.684 0.361 987 1HD2 LEU 36 3HD1 LEU 126 -10.948 -1.221 -1.350 988 2HD2 LEU 36 1HD1 LEU 126 -9.302 -0.670 -1.125 989 3HD2 LEU 36 2HD1 LEU 126 -9.604 -2.224 -1.985 990 NH1 ARG 37 NH2 ARG 127 -14.579 -9.034 6.916 991 NH2 ARG 37 NH1 ARG 127 -16.625 -10.016 7.021 992 H ARG 37 H ARG 127 -13.161 -4.200 2.071 993 HA ARG 37 HA ARG 127 -14.096 -6.706 1.144 994 1HB ARG 37 1HB ARG 127 -13.631 -6.134 3.547 995 2HB ARG 37 2HB ARG 127 -15.009 -5.028 3.557 996 1HG ARG 37 1HG ARG 127 -16.508 -7.145 3.161 997 2HG ARG 37 2HG ARG 127 -15.048 -8.097 3.440 998 1HD ARG 37 1HD ARG 127 -14.776 -6.718 5.673 999 2HD ARG 37 2HD ARG 127 -16.354 -6.032 5.329 1000 1HH1 ARG 37 1HH2 ARG 127 -14.265 -9.803 7.518 1001 2HH1 ARG 37 2HH2 ARG 127 -14.007 -8.264 6.552 1002 1HH2 ARG 37 1HH1 ARG 127 -17.611 -9.999 6.740 1003 2HH2 ARG 37 2HH1 ARG 127 -16.166 -10.716 7.615 1004 H LYS 38 H LYS 128 -15.616 -3.498 0.956 1005 HA LYS 38 HA LYS 128 -18.323 -4.739 0.310 1006 1HB LYS 38 1HB LYS 128 -18.142 -3.149 2.329 1007 2HB LYS 38 2HB LYS 128 -17.860 -1.851 1.179 1008 1HG LYS 38 1HG LYS 128 -20.172 -2.272 0.192 1009 2HG LYS 38 2HG LYS 128 -20.358 -3.659 1.253 1010 1HD LYS 38 1HD LYS 128 -21.599 -1.863 2.223 1011 2HD LYS 38 2HD LYS 128 -20.217 -2.146 3.274 1012 1HE LYS 38 1HE LYS 128 -19.033 -0.129 2.259 1013 2HE LYS 38 2HE LYS 128 -20.398 0.122 1.161 1014 1HZ LYS 38 1HZ LYS 128 -21.817 0.436 3.110 1015 2HZ LYS 38 2HZ LYS 128 -20.559 0.192 4.125 1016 H GLY 39 H GLY 129 -15.859 -4.210 -1.519 1017 1HA GLY 39 1HA GLY 129 -15.522 -3.628 -3.813 1018 2HA GLY 39 2HA GLY 129 -17.262 -3.633 -4.008 1019 H ASP 40 H ASP 130 -15.186 -1.540 -2.096 1020 HA ASP 40 HA ASP 130 -16.032 0.931 -3.698 1021 1HB ASP 40 1HB ASP 130 -15.418 1.070 -0.775 1022 2HB ASP 40 2HB ASP 130 -16.004 2.337 -1.798 1023 HD1 ASP 40 HD2 ASP 130 -19.300 1.134 -2.018 1024 H LYS 41 H LYS 131 -14.757 2.476 -4.290 1025 HA LYS 41 HA LYS 131 -11.795 1.942 -4.257 1026 1HB LYS 41 2HB LYS 131 -13.097 4.359 -5.548 1027 2HB LYS 41 1HB LYS 131 -11.446 3.791 -5.771 1028 1HG LYS 41 1HG LYS 131 -12.391 1.664 -6.853 1029 2HG LYS 41 2HG LYS 131 -13.999 2.391 -6.769 1030 1HD LYS 41 1HD LYS 131 -13.205 4.333 -8.159 1031 2HD LYS 41 2HD LYS 131 -11.590 3.648 -8.254 1032 1HE LYS 41 1HE LYS 131 -14.143 2.275 -9.357 1033 2HE LYS 41 2HE LYS 131 -13.054 3.279 -10.311 1034 1HZ LYS 41 1HZ LYS 131 -12.303 0.749 -8.964 1035 2HZ LYS 41 2HZ LYS 131 -12.577 0.942 -10.564 1036 H VAL 42 H VAL 132 -10.553 2.808 -2.709 1037 HA VAL 42 HA VAL 132 -11.290 5.005 -0.970 1038 HB VAL 42 HB VAL 132 -8.905 3.052 -1.343 1039 1HG1 VAL 42 3HG2 VAL 132 -8.298 4.990 0.046 1040 2HG1 VAL 42 1HG2 VAL 132 -9.669 4.567 1.162 1041 3HG1 VAL 42 2HG2 VAL 132 -8.305 3.438 0.917 1042 1HG2 VAL 42 1HG1 VAL 132 -11.219 3.004 0.676 1043 2HG2 VAL 42 2HG1 VAL 132 -11.022 1.880 -0.727 1044 3HG2 VAL 42 3HG1 VAL 132 -9.893 1.821 0.616 1045 H GLN 43 H GLN 133 -9.931 6.608 -0.772 1046 HA GLN 43 HA GLN 133 -8.069 7.419 -2.972 1047 1HB GLN 43 1HB GLN 133 -10.496 9.131 -2.835 1048 2HB GLN 43 2HB GLN 133 -9.015 9.518 -3.712 1049 1HG GLN 43 1HG GLN 133 -9.360 7.305 -4.990 1050 2HG GLN 43 2HG GLN 133 -10.888 7.120 -4.137 1051 1HE2 GLN 43 2HE2 GLN 133 -11.968 8.419 -7.335 1052 2HE2 GLN 43 1HE2 GLN 133 -11.300 6.916 -6.533 1053 H LEU 44 H LEU 134 -6.418 8.544 -2.755 1054 HA LEU 44 HA LEU 134 -5.957 10.231 -0.280 1055 1HB LEU 44 2HB LEU 134 -3.633 8.465 -1.073 1056 2HB LEU 44 1HB LEU 134 -3.970 9.189 0.473 1057 HG LEU 44 HG LEU 134 -5.498 6.728 -0.611 1058 1HD1 LEU 44 2HD1 LEU 134 -3.075 6.215 -0.663 1059 2HD1 LEU 44 3HD1 LEU 134 -2.885 6.747 1.030 1060 3HD1 LEU 44 1HD1 LEU 134 -3.852 5.313 0.634 1061 1HD2 LEU 44 2HD2 LEU 134 -6.516 7.863 1.445 1062 2HD2 LEU 44 3HD2 LEU 134 -5.989 6.194 1.732 1063 3HD2 LEU 44 1HD2 LEU 134 -4.986 7.547 2.304 1064 H ILE 45 H ILE 135 -5.298 12.160 -1.241 1065 HA ILE 45 HA ILE 135 -4.249 12.147 -4.026 1066 HB ILE 45 HB ILE 135 -5.932 13.797 -3.296 1067 1HG1 ILE 45 1HG1 ILE 135 -3.430 15.122 -4.493 1068 2HG1 ILE 45 2HG1 ILE 135 -4.444 13.994 -5.376 1069 1HG2 ILE 45 3HG2 ILE 135 -4.988 14.430 -1.087 1070 2HG2 ILE 45 1HG2 ILE 135 -3.595 15.214 -1.876 1071 3HG2 ILE 45 2HG2 ILE 135 -5.245 15.868 -2.100 1072 1HD1 ILE 45 3HD1 ILE 135 -6.445 15.514 -5.109 1073 2HD1 ILE 45 1HD1 ILE 135 -5.413 16.705 -4.272 1074 3HD1 ILE 45 2HD1 ILE 135 -5.091 16.285 -5.968 1075 H GLY 46 H GLY 136 -2.313 12.951 -4.689 1076 1HA GLY 46 1HA GLY 136 0.077 12.885 -4.777 1077 2HA GLY 46 2HA GLY 136 0.044 13.502 -3.146 1078 H PHE 47 H PHE 137 -1.341 10.376 -3.151 1079 HA PHE 47 HA PHE 137 1.248 8.876 -2.835 1080 1HB PHE 47 2HB PHE 137 0.313 10.026 -0.721 1081 2HB PHE 47 1HB PHE 137 -1.064 8.965 -0.755 1082 HD1 PHE 47 HD1 PHE 137 2.686 8.989 -0.312 1083 HD2 PHE 47 HD2 PHE 137 -0.861 6.555 -0.232 1084 HE1 PHE 47 HE1 PHE 137 3.990 7.031 0.470 1085 HE2 PHE 47 HE2 PHE 137 0.478 4.640 0.516 1086 HZ PHE 47 HZ PHE 137 2.929 4.859 0.706 1087 H GLY 48 H GLY 138 -2.400 8.445 -3.135 1088 1HA GLY 48 1HA GLY 138 -2.199 6.136 -4.683 1089 2HA GLY 48 2HA GLY 138 -2.132 5.492 -3.048 1090 H ASN 49 H ASN 139 -3.845 4.624 -4.794 1091 HA ASN 49 HA ASN 139 -6.532 5.419 -3.604 1092 1HB ASN 49 1HB ASN 139 -6.085 5.042 -6.639 1093 2HB ASN 49 2HB ASN 139 -7.651 5.123 -5.858 1094 1HD2 ASN 49 1HD2 ASN 139 -6.965 8.484 -7.325 1095 2HD2 ASN 49 2HD2 ASN 139 -6.963 6.755 -7.940 1096 H PHE 50 H PHE 140 -7.042 3.579 -2.582 1097 HA PHE 50 HA PHE 140 -6.115 0.889 -3.614 1098 1HB PHE 50 2HB PHE 140 -7.864 1.276 -1.126 1099 2HB PHE 50 1HB PHE 140 -7.215 -0.211 -1.673 1100 HD1 PHE 50 HD1 PHE 140 -6.331 3.181 -0.420 1101 HD2 PHE 50 HD2 PHE 140 -5.338 -0.996 -0.541 1102 HE1 PHE 50 HE1 PHE 140 -4.664 3.499 1.392 1103 HE2 PHE 50 HE2 PHE 140 -3.646 -0.615 1.228 1104 HZ PHE 50 HZ PHE 140 -3.230 1.666 2.019 1105 H GLU 51 H GLU 141 -7.496 -0.709 -4.190 1106 HA GLU 51 HA GLU 141 -10.365 -0.560 -3.941 1107 1HB GLU 51 1HB GLU 141 -11.115 -0.404 -6.321 1108 2HB GLU 51 2HB GLU 141 -10.303 1.064 -5.873 1109 1HG GLU 51 1HG GLU 141 -8.999 -1.168 -7.570 1110 2HG GLU 51 2HG GLU 141 -9.841 0.223 -8.219 1111 HE2 GLU 51 HE2 GLU 141 -6.040 0.514 -7.055 1112 H VAL 52 H VAL 142 -11.574 -2.550 -4.796 1113 HA VAL 52 HA VAL 142 -9.749 -4.836 -4.500 1114 HB VAL 52 HB VAL 142 -12.415 -3.924 -3.594 1115 1HG1 VAL 52 3HG2 VAL 142 -13.316 -4.535 -5.792 1116 2HG1 VAL 52 1HG2 VAL 142 -12.777 -6.201 -5.558 1117 3HG1 VAL 52 2HG2 VAL 142 -13.997 -5.498 -4.440 1118 1HG2 VAL 52 1HG1 VAL 142 -10.890 -6.529 -3.297 1119 2HG2 VAL 52 2HG1 VAL 142 -11.031 -5.146 -2.205 1120 3HG2 VAL 52 3HG1 VAL 142 -12.442 -6.168 -2.504 1121 NH1 ARG 53 NH2 ARG 143 -5.325 -8.333 -12.026 1122 NH2 ARG 53 NH1 ARG 143 -6.628 -8.792 -13.832 1123 H ARG 53 H ARG 143 -10.158 -6.750 -6.153 1124 HA ARG 53 HA ARG 143 -10.613 -5.633 -8.939 1125 1HB ARG 53 1HB ARG 143 -8.464 -6.790 -8.134 1126 2HB ARG 53 2HB ARG 143 -9.450 -8.190 -7.853 1127 1HG ARG 53 1HG ARG 143 -9.650 -8.724 -10.131 1128 2HG ARG 53 2HG ARG 143 -9.806 -7.051 -10.646 1129 1HD ARG 53 1HD ARG 143 -7.321 -6.692 -10.385 1130 2HD ARG 53 2HD ARG 143 -7.129 -8.375 -9.874 1131 1HH1 ARG 53 2HH2 ARG 143 -5.281 -8.034 -11.046 1132 2HH1 ARG 53 1HH2 ARG 143 -4.533 -8.577 -12.631 1133 1HH2 ARG 53 1HH1 ARG 143 -7.573 -8.848 -14.228 1134 2HH2 ARG 53 2HH1 ARG 143 -5.747 -9.007 -14.311 1135 H GLU 54 H GLU 144 -11.369 -8.419 -8.078 1136 HA GLU 54 HA GLU 144 -13.599 -9.455 -7.774 1137 1HB GLU 54 1HB GLU 144 -14.976 -7.661 -8.861 1138 2HB GLU 54 2HB GLU 144 -14.440 -8.177 -10.457 1139 1HG GLU 54 1HG GLU 144 -15.568 -10.439 -10.043 1140 2HG GLU 54 2HG GLU 144 -16.053 -9.899 -8.440 1141 HE1 GLU 54 HE2 GLU 144 -18.688 -7.946 -9.512 1142 NH1 ARG 55 NH2 ARG 145 -8.588 -11.408 -11.258 1143 NH2 ARG 55 NH1 ARG 145 -6.705 -11.524 -9.995 1144 H ARG 55 H ARG 145 -12.485 -11.492 -7.943 1145 HA ARG 55 HA ARG 145 -11.235 -12.260 -10.563 1146 1HB ARG 55 1HB ARG 145 -10.131 -12.766 -8.350 1147 2HB ARG 55 2HB ARG 145 -11.436 -13.863 -7.963 1148 1HG ARG 55 1HG ARG 145 -9.554 -15.166 -8.697 1149 2HG ARG 55 2HG ARG 145 -10.837 -15.345 -9.871 1150 1HD ARG 55 1HD ARG 145 -8.713 -15.186 -11.036 1151 2HD ARG 55 2HD ARG 145 -9.673 -13.793 -11.465 1152 1HH1 ARG 55 2HH2 ARG 145 -9.412 -11.893 -11.629 1153 2HH1 ARG 55 1HH2 ARG 145 -8.322 -10.432 -11.426 1154 1HH2 ARG 55 1HH1 ARG 145 -6.093 -12.093 -9.399 1155 2HH2 ARG 55 2HH1 ARG 145 -6.573 -10.539 -10.247 1156 H ALA 56 H ALA 146 -12.334 -13.285 -12.099 1157 HA ALA 56 HA ALA 146 -15.182 -13.983 -11.787 1158 1HB ALA 56 3HB ALA 146 -14.337 -13.000 -13.883 1159 2HB ALA 56 1HB ALA 146 -13.320 -14.429 -14.200 1160 3HB ALA 56 2HB ALA 146 -15.094 -14.572 -14.202 1161 H ALA 57 H ALA 147 -15.466 -15.706 -10.419 1162 HA ALA 57 HA ALA 147 -14.243 -18.197 -10.352 1163 1HB ALA 57 1HB ALA 147 -16.066 -17.464 -8.738 1164 2HB ALA 57 2HB ALA 147 -17.297 -17.755 -9.988 1165 3HB ALA 57 3HB ALA 147 -16.364 -19.112 -9.317 1166 NH1 ARG 58 NH2 ARG 148 -8.172 -19.124 -15.694 1167 NH2 ARG 58 NH1 ARG 148 -8.271 -16.977 -14.950 1168 H ARG 58 H ARG 148 -13.916 -19.876 -11.388 1169 HA ARG 58 HA ARG 148 -15.131 -19.998 -14.100 1170 1HB ARG 58 2HB ARG 148 -12.553 -21.417 -13.310 1171 2HB ARG 58 1HB ARG 148 -13.122 -21.080 -14.940 1172 1HG ARG 58 1HG ARG 148 -12.805 -18.578 -14.443 1173 2HG ARG 58 2HG ARG 148 -12.074 -19.042 -12.898 1174 1HD ARG 58 1HD ARG 148 -10.306 -20.382 -14.122 1175 2HD ARG 58 2HD ARG 148 -11.010 -19.886 -15.674 1176 1HH1 ARG 58 2HH2 ARG 148 -8.642 -20.031 -15.782 1177 2HH1 ARG 58 1HH2 ARG 148 -7.235 -18.882 -16.035 1178 1HH2 ARG 58 1HH1 ARG 148 -8.813 -16.251 -14.468 1179 2HH2 ARG 58 2HH1 ARG 148 -7.328 -16.883 -15.341 1180 H LYS 59 H LYS 149 -14.574 -22.470 -14.965 1181 HA LYS 59 HA LYS 149 -15.375 -24.599 -13.056 1182 1HB LYS 59 1HB LYS 149 -17.639 -23.796 -13.858 1183 2HB LYS 59 2HB LYS 149 -17.204 -24.245 -15.504 1184 1HG LYS 59 1HG LYS 149 -16.886 -26.670 -14.712 1185 2HG LYS 59 2HG LYS 149 -17.266 -26.163 -13.074 1186 1HD LYS 59 1HD LYS 149 -19.245 -27.164 -13.903 1187 2HD LYS 59 2HD LYS 149 -19.583 -25.439 -13.838 1188 1HE LYS 59 1HE LYS 149 -19.160 -25.288 -16.364 1189 2HE LYS 59 2HE LYS 149 -18.809 -27.022 -16.397 1190 1HZ LYS 59 1HZ LYS 149 -21.383 -25.810 -15.548 1191 2HZ LYS 59 2HZ LYS 149 -21.065 -27.414 -15.556 1192 H GLY 60 H GLY 150 -13.535 -25.618 -13.383 1193 1HA GLY 60 1HA GLY 150 -12.424 -26.071 -16.234 1194 2HA GLY 60 2HA GLY 150 -11.404 -25.799 -14.834 1195 NH1 ARG 61 NH2 ARG 151 -9.770 -35.276 -17.995 1196 NH2 ARG 61 NH1 ARG 151 -7.737 -34.445 -17.410 1197 H ARG 61 H ARG 151 -10.437 -27.695 -14.473 1198 HA ARG 61 HA ARG 151 -12.044 -30.112 -13.747 1199 1HB ARG 61 1HB ARG 151 -11.592 -30.161 -16.365 1200 2HB ARG 61 2HB ARG 151 -9.921 -30.498 -15.949 1201 1HG ARG 61 1HG ARG 151 -10.873 -32.545 -14.545 1202 2HG ARG 61 2HG ARG 151 -12.432 -32.152 -15.232 1203 1HD ARG 61 1HD ARG 151 -11.606 -33.918 -16.553 1204 2HD ARG 61 2HD ARG 151 -11.415 -32.501 -17.589 1205 1HH1 ARG 61 2HH2 ARG 151 -10.789 -35.161 -17.975 1206 2HH1 ARG 61 1HH2 ARG 151 -9.246 -36.046 -18.427 1207 1HH2 ARG 61 1HH1 ARG 151 -7.205 -33.700 -16.945 1208 2HH2 ARG 61 2HH1 ARG 151 -7.354 -35.270 -17.884 1209 H ASN 62 H ASN 152 -11.027 -31.431 -12.378 1210 HA ASN 62 HA ASN 152 -8.520 -30.531 -11.076 1211 1HB ASN 62 1HB ASN 152 -10.524 -31.535 -9.852 1212 2HB ASN 62 2HB ASN 152 -10.120 -33.106 -10.551 1213 1HD2 ASN 62 2HD2 ASN 152 -7.665 -33.673 -7.986 1214 2HD2 ASN 62 1HD2 ASN 152 -8.602 -34.316 -9.427 1215 HA PRO 63 HA PRO 153 -6.009 -33.009 -14.030 1216 1HB PRO 63 1HB PRO 153 -3.470 -32.773 -12.910 1217 2HB PRO 63 2HB PRO 153 -4.337 -31.472 -13.739 1218 1HG PRO 63 1HG PRO 153 -4.188 -31.983 -10.724 1219 2HG PRO 63 2HG PRO 153 -3.893 -30.454 -11.588 1220 1HD PRO 63 1HD PRO 153 -6.324 -31.004 -10.412 1221 2HD PRO 63 2HD PRO 153 -6.251 -30.088 -11.949 1222 H GLN 64 H GLN 154 -6.243 -34.200 -10.708 1223 HA GLN 64 HA GLN 154 -4.707 -36.746 -11.326 1224 1HB GLN 64 1HB GLN 154 -6.175 -35.963 -8.738 1225 2HB GLN 64 2HB GLN 154 -5.170 -37.371 -8.959 1226 1HG GLN 64 1HG GLN 154 -4.180 -34.443 -9.070 1227 2HG GLN 64 2HG GLN 154 -4.253 -35.473 -7.654 1228 1HE2 GLN 64 2HE2 GLN 154 -1.204 -37.241 -8.536 1229 2HE2 GLN 64 1HE2 GLN 154 -2.638 -37.095 -7.401 1230 H THR 65 H THR 155 -7.745 -36.134 -9.728 1231 HA THR 65 HA THR 155 -9.116 -38.515 -10.464 1232 HB THR 65 HB THR 155 -11.195 -37.549 -9.630 1233 HG1 THR 65 HG1 THR 155 -11.273 -35.378 -9.071 1234 1HG2 THR 65 1HG2 THR 155 -9.440 -38.126 -7.891 1235 2HG2 THR 65 2HG2 THR 155 -8.866 -36.443 -7.934 1236 3HG2 THR 65 3HG2 THR 155 -10.516 -36.793 -7.376 1237 H GLY 66 H GLY 156 -9.317 -35.488 -12.318 1238 1HA GLY 66 1HA GLY 156 -10.100 -35.160 -14.572 1239 2HA GLY 66 2HA GLY 156 -10.471 -36.867 -14.717 1240 H GLU 67 H GLU 157 -11.656 -34.554 -12.261 1241 HA GLU 67 HA GLU 157 -14.530 -34.853 -13.261 1242 1HB GLU 67 2HB GLU 157 -13.785 -35.986 -11.052 1243 2HB GLU 67 1HB GLU 157 -13.523 -34.381 -10.368 1244 1HG GLU 67 1HG GLU 157 -15.980 -33.833 -10.785 1245 2HG GLU 67 2HG GLU 157 -16.219 -35.438 -11.472 1246 HE1 GLU 67 HE2 GLU 157 -16.223 -37.120 -8.444 1247 H GLU 68 H GLU 158 -15.664 -33.013 -13.478 1248 HA GLU 68 HA GLU 158 -14.257 -30.531 -13.908 1249 1HB GLU 68 1HB GLU 158 -17.304 -30.950 -13.748 1250 2HB GLU 68 2HB GLU 158 -16.562 -29.454 -14.267 1251 1HG GLU 68 1HG GLU 158 -16.227 -32.156 -15.717 1252 2HG GLU 68 2HG GLU 158 -17.375 -30.905 -16.148 1253 HE1 GLU 68 HE2 GLU 158 -15.061 -28.722 -17.565 1254 H MET 69 H MET 159 -13.639 -29.035 -12.550 1255 HA MET 69 HA MET 159 -14.840 -28.852 -9.740 1256 1HB MET 69 1HB MET 159 -12.718 -28.105 -8.913 1257 2HB MET 69 2HB MET 159 -12.455 -29.576 -9.825 1258 1HG MET 69 1HG MET 159 -11.632 -28.130 -11.797 1259 2HG MET 69 2HG MET 159 -11.790 -26.708 -10.758 1260 1HE MET 69 3HE MET 159 -9.293 -27.070 -12.159 1261 2HE MET 69 2HE MET 159 -9.253 -25.911 -10.803 1262 3HE MET 69 1HE MET 159 -7.952 -27.125 -10.976 1263 H GLU 70 H GLU 160 -15.834 -27.025 -9.105 1264 HA GLU 70 HA GLU 160 -15.947 -24.661 -10.897 1265 1HB GLU 70 2HB GLU 160 -17.796 -26.001 -9.222 1266 2HB GLU 70 1HB GLU 160 -17.346 -24.669 -8.222 1267 1HG GLU 70 1HG GLU 160 -17.936 -23.164 -10.321 1268 2HG GLU 70 2HG GLU 160 -18.370 -24.647 -11.168 1269 HE1 GLU 70 HE2 GLU 160 -19.097 -22.541 -8.636 1270 H ILE 71 H ILE 161 -14.183 -23.346 -10.784 1271 HA ILE 71 HA ILE 161 -12.430 -23.248 -8.460 1272 HB ILE 71 HB ILE 161 -12.343 -21.647 -11.092 1273 1HG1 ILE 71 1HG1 ILE 161 -11.061 -24.391 -10.443 1274 2HG1 ILE 71 2HG1 ILE 161 -12.361 -24.126 -11.584 1275 1HG2 ILE 71 2HG2 ILE 161 -10.904 -20.757 -9.243 1276 2HG2 ILE 71 3HG2 ILE 161 -10.117 -22.360 -9.095 1277 3HG2 ILE 71 1HG2 ILE 161 -9.942 -21.393 -10.593 1278 1HD1 ILE 71 1HD1 ILE 161 -10.811 -22.746 -13.061 1279 2HD1 ILE 71 2HD1 ILE 161 -9.469 -23.189 -11.975 1280 3HD1 ILE 71 3HD1 ILE 161 -10.352 -24.449 -12.860 1281 HA PRO 72 HA PRO 162 -15.139 -19.861 -6.858 1282 1HB PRO 72 1HB PRO 162 -14.040 -19.468 -4.344 1283 2HB PRO 72 2HB PRO 162 -14.934 -20.921 -4.812 1284 1HG PRO 72 1HG PRO 162 -11.893 -20.546 -4.769 1285 2HG PRO 72 2HG PRO 162 -12.839 -21.870 -4.045 1286 1HD PRO 72 1HD PRO 162 -11.648 -22.101 -6.540 1287 2HD PRO 72 2HD PRO 162 -13.200 -22.913 -6.175 1288 H ALA 73 H ALA 163 -15.206 -17.678 -6.306 1289 HA ALA 73 HA ALA 163 -13.119 -15.933 -7.578 1290 1HB ALA 73 2HB ALA 163 -15.594 -15.290 -7.777 1291 2HB ALA 73 3HB ALA 163 -15.643 -15.029 -5.987 1292 3HB ALA 73 1HB ALA 163 -14.645 -14.020 -7.010 1293 H SER 74 H SER 164 -12.619 -13.989 -6.583 1294 HA SER 74 HA SER 164 -12.979 -13.553 -3.814 1295 1HB SER 74 1HB SER 164 -9.947 -13.754 -4.677 1296 2HB SER 74 2HB SER 164 -10.431 -12.969 -3.179 1297 HG SER 74 HG SER 164 -9.844 -15.125 -2.876 1298 H LYS 75 H LYS 165 -12.886 -11.380 -3.250 1299 HA LYS 75 HA LYS 165 -12.588 -9.439 -5.571 1300 1HB LYS 75 2HB LYS 165 -13.104 -8.358 -2.816 1301 2HB LYS 75 1HB LYS 165 -13.558 -7.767 -4.406 1302 1HG LYS 75 1HG LYS 165 -15.370 -9.518 -4.548 1303 2HG LYS 75 2HG LYS 165 -14.910 -10.099 -2.942 1304 1HD LYS 75 1HD LYS 165 -15.371 -7.728 -2.011 1305 2HD LYS 75 2HD LYS 165 -15.910 -7.258 -3.613 1306 1HE LYS 75 1HE LYS 165 -17.902 -7.707 -2.375 1307 2HE LYS 75 2HE LYS 165 -17.746 -9.061 -3.493 1308 1HZ LYS 75 1HZ LYS 165 -16.936 -9.076 -0.630 1309 2HZ LYS 75 2HZ LYS 165 -16.767 -10.346 -1.646 1310 H VAL 76 H VAL 166 -10.571 -8.946 -5.964 1311 HA VAL 76 HA VAL 166 -8.550 -9.416 -3.980 1312 HB VAL 76 HB VAL 166 -7.079 -9.975 -5.312 1313 1HG1 VAL 76 3HG2 VAL 166 -9.163 -11.364 -5.312 1314 2HG1 VAL 76 1HG2 VAL 166 -9.574 -10.611 -6.881 1315 3HG1 VAL 76 2HG2 VAL 166 -8.123 -11.670 -6.760 1316 1HG2 VAL 76 3HG1 VAL 166 -7.062 -8.119 -7.135 1317 2HG2 VAL 76 1HG1 VAL 166 -6.334 -9.734 -7.324 1318 3HG2 VAL 76 2HG1 VAL 166 -7.881 -9.444 -8.055 1319 HA PRO 77 HA PRO 167 -7.999 -5.061 -3.179 1320 1HB PRO 77 1HB PRO 167 -6.426 -5.181 -0.875 1321 2HB PRO 77 2HB PRO 167 -8.124 -5.698 -0.902 1322 1HG PRO 77 1HG PRO 167 -5.640 -7.462 -1.239 1323 2HG PRO 77 2HG PRO 167 -6.965 -7.683 -0.089 1324 1HD PRO 77 1HD PRO 167 -6.847 -8.989 -2.588 1325 2HD PRO 77 2HD PRO 167 -8.426 -8.507 -1.922 1326 H ALA 78 H ALA 168 -6.909 -3.678 -3.880 1327 HA ALA 78 HA ALA 168 -3.954 -3.935 -4.623 1328 1HB ALA 78 3HB ALA 168 -5.630 -4.524 -6.458 1329 2HB ALA 78 1HB ALA 168 -6.328 -2.902 -6.343 1330 3HB ALA 78 2HB ALA 168 -4.641 -3.110 -6.873 1331 H PHE 79 H PHE 169 -3.161 -1.853 -5.292 1332 HA PHE 79 HA PHE 169 -3.980 0.643 -3.653 1333 1HB PHE 79 2HB PHE 169 -3.026 -0.273 -1.934 1334 2HB PHE 79 1HB PHE 169 -1.690 -0.983 -2.884 1335 HD1 PHE 79 HD2 PHE 169 -2.948 2.258 -1.472 1336 HD2 PHE 79 HD1 PHE 169 0.333 0.262 -3.415 1337 HE1 PHE 79 HE2 PHE 169 -1.538 4.250 -1.172 1338 HE2 PHE 79 HE1 PHE 169 1.704 2.282 -3.162 1339 HZ PHE 79 HZ PHE 169 0.766 4.289 -2.091 1340 H LYS 80 H LYS 170 -3.610 2.016 -5.045 1341 HA LYS 80 HA LYS 170 -1.728 2.073 -7.566 1342 1HB LYS 80 2HB LYS 170 -3.861 4.054 -6.682 1343 2HB LYS 80 1HB LYS 170 -2.780 4.281 -8.041 1344 1HG LYS 80 1HG LYS 170 -4.883 2.046 -7.772 1345 2HG LYS 80 2HG LYS 170 -5.080 3.524 -8.684 1346 1HD LYS 80 1HD LYS 170 -3.046 1.291 -9.315 1347 2HD LYS 80 2HD LYS 170 -4.595 1.537 -10.105 1348 1HE LYS 80 1HE LYS 170 -3.816 3.802 -10.971 1349 2HE LYS 80 2HE LYS 170 -2.240 3.545 -10.208 1350 1HZ LYS 80 1HZ LYS 170 -1.975 1.548 -11.565 1351 2HZ LYS 80 2HZ LYS 170 -3.429 1.781 -12.274 1352 HA PRO 81 HA PRO 171 0.964 4.644 -4.877 1353 1HB PRO 81 1HB PRO 171 3.092 4.965 -6.581 1354 2HB PRO 81 2HB PRO 171 2.678 3.388 -5.896 1355 1HG PRO 81 1HG PRO 171 1.946 4.454 -8.677 1356 2HG PRO 81 2HG PRO 171 2.734 2.906 -8.279 1357 1HD PRO 81 1HD PRO 171 -0.032 3.185 -8.666 1358 2HD PRO 81 2HD PRO 171 0.663 1.929 -7.592 1359 H GLY 82 H GLY 172 -1.327 5.840 -6.076 1360 1HA GLY 82 1HA GLY 172 -2.294 7.616 -7.379 1361 2HA GLY 82 2HA GLY 172 -1.310 8.458 -6.201 1362 H LYS 83 H LYS 173 0.384 6.825 -8.655 1363 HA LYS 83 HA LYS 173 1.842 7.580 -10.429 1364 1HB LYS 83 2HB LYS 173 -0.294 9.676 -10.681 1365 2HB LYS 83 1HB LYS 173 1.256 10.310 -11.078 1366 1HG LYS 83 1HG LYS 173 1.589 8.405 -12.765 1367 2HG LYS 83 2HG LYS 173 0.012 7.752 -12.315 1368 1HD LYS 83 1HD LYS 173 -1.097 9.912 -13.104 1369 2HD LYS 83 2HD LYS 173 0.485 10.549 -13.527 1370 1HE LYS 83 1HE LYS 173 -0.500 9.791 -15.581 1371 2HE LYS 83 2HE LYS 173 0.796 8.656 -15.216 1372 1HZ LYS 83 1HZ LYS 173 -0.867 7.115 -14.363 1373 2HZ LYS 83 2HZ LYS 173 -1.178 7.516 -15.917 1374 H ALA 84 H ALA 174 1.133 9.918 -8.164 1375 HA ALA 84 HA ALA 174 3.437 11.658 -7.984 1376 1HB ALA 84 2HB ALA 174 1.122 12.051 -7.100 1377 2HB ALA 84 3HB ALA 174 1.290 10.678 -5.976 1378 3HB ALA 84 1HB ALA 174 2.300 12.131 -5.748 1379 H LEU 85 H LEU 175 2.622 8.709 -5.922 1380 HA LEU 85 HA LEU 175 5.184 8.727 -4.525 1381 1HB LEU 85 2HB LEU 175 3.204 7.604 -3.533 1382 2HB LEU 85 1HB LEU 175 3.116 6.501 -4.895 1383 HG LEU 85 HG LEU 175 5.484 5.873 -4.394 1384 1HD1 LEU 85 1HD1 LEU 175 6.184 7.592 -2.787 1385 2HD1 LEU 85 2HD1 LEU 175 4.908 7.100 -1.658 1386 3HD1 LEU 85 3HD1 LEU 175 6.283 6.010 -1.992 1387 1HD2 LEU 85 3HD2 LEU 175 3.560 4.308 -3.949 1388 2HD2 LEU 85 1HD2 LEU 175 4.766 4.107 -2.668 1389 3HD2 LEU 85 2HD2 LEU 175 3.282 5.049 -2.358 1390 H LYS 86 H LYS 176 3.993 7.202 -7.512 1391 HA LYS 86 HA LYS 176 6.411 5.671 -8.120 1392 1HB LYS 86 1HB LYS 176 4.109 5.347 -9.181 1393 2HB LYS 86 2HB LYS 176 4.394 6.774 -10.160 1394 1HG LYS 86 1HG LYS 176 6.373 5.631 -11.240 1395 2HG LYS 86 2HG LYS 176 6.152 4.251 -10.169 1396 1HD LYS 86 1HD LYS 176 5.208 3.647 -12.289 1397 2HD LYS 86 2HD LYS 176 3.870 3.818 -11.160 1398 1HE LYS 86 1HE LYS 176 3.361 6.129 -12.137 1399 2HE LYS 86 2HE LYS 176 4.725 5.951 -13.249 1400 1HZ LYS 86 1HZ LYS 176 2.363 4.155 -13.133 1401 2HZ LYS 86 2HZ LYS 176 3.620 3.980 -14.163 1402 H ASP 87 H ASP 177 5.900 9.150 -8.342 1403 HA ASP 87 HA ASP 177 8.429 9.578 -9.906 1404 1HB ASP 87 1HB ASP 177 5.945 11.017 -9.347 1405 2HB ASP 87 2HB ASP 177 7.109 11.841 -8.404 1406 HD1 ASP 87 HD2 ASP 177 8.809 13.216 -11.134 1407 H ALA 88 H ALA 178 7.259 9.859 -6.498 1408 HA ALA 88 HA ALA 178 9.566 10.915 -5.112 1409 1HB ALA 88 3HB ALA 178 7.310 10.246 -3.958 1410 2HB ALA 88 1HB ALA 178 7.759 8.553 -4.142 1411 3HB ALA 88 2HB ALA 178 8.734 9.562 -3.115 1412 H VAL 89 H VAL 179 8.767 7.543 -5.955 1413 HA VAL 89 HA VAL 179 11.106 6.358 -4.683 1414 HB VAL 89 HB VAL 179 8.449 5.958 -4.698 1415 1HG1 VAL 89 2HG2 VAL 179 8.408 5.909 -7.301 1416 2HG1 VAL 89 3HG2 VAL 179 9.015 4.247 -7.159 1417 3HG1 VAL 89 1HG2 VAL 179 7.479 4.738 -6.369 1418 1HG2 VAL 89 1HG1 VAL 179 9.886 4.604 -3.529 1419 2HG2 VAL 89 2HG1 VAL 179 8.560 3.721 -4.330 1420 3HG2 VAL 89 3HG1 VAL 179 10.237 3.606 -5.007 1421 H LYS 90 H LYS 180 10.492 7.388 -7.914 1422 HA LYS 90 HA LYS 180 12.062 5.404 -9.433 1423 1HB LYS 90 1HB LYS 180 10.167 6.524 -10.362 1424 2HB LYS 90 2HB LYS 180 10.777 8.139 -9.998 1425 1HG LYS 90 1HG LYS 180 12.506 7.905 -11.769 1426 2HG LYS 90 2HG LYS 180 11.975 6.253 -12.118 1427 1HD LYS 90 1HD LYS 180 9.728 7.034 -12.825 1428 2HD LYS 90 2HD LYS 180 10.016 8.641 -12.187 1429 1HE LYS 90 1HE LYS 180 10.151 8.826 -14.546 1430 2HE LYS 90 2HE LYS 180 11.774 9.085 -13.908 1431 1HZ LYS 90 1HZ LYS 180 10.773 6.543 -15.095 1432 2HZ LYS 90 2HZ LYS 180 12.280 6.756 -14.499 Start of MODEL 18 Raw file had 1432 H/Q atoms Start of MODEL 18 1 1H MET 1 1H MET 1 -11.741 8.965 -1.206 2 2H MET 1 2H MET 1 -11.674 7.366 -0.872 3 HA MET 1 HA MET 1 -10.645 8.608 0.831 4 1HB MET 1 1HB MET 1 -9.609 6.290 -0.318 5 2HB MET 1 2HB MET 1 -8.201 7.308 -0.161 6 1HG MET 1 1HG MET 1 -8.358 5.993 1.843 7 2HG MET 1 2HG MET 1 -8.782 7.650 2.277 8 1HE MET 1 3HE MET 1 -10.594 4.413 0.697 9 2HE MET 1 2HE MET 1 -9.891 3.941 2.277 10 3HE MET 1 1HE MET 1 -11.664 4.007 2.052 11 H ASN 2 H ASN 2 -9.116 9.363 -2.056 12 HA ASN 2 HA ASN 2 -7.247 10.655 -2.448 13 1HB ASN 2 1HB ASN 2 -7.961 12.888 -3.307 14 2HB ASN 2 2HB ASN 2 -8.776 11.437 -3.802 15 1HD2 ASN 2 1HD2 ASN 2 -10.877 13.853 -1.188 16 2HD2 ASN 2 2HD2 ASN 2 -9.082 14.039 -1.410 17 H LYS 3 H LYS 3 -7.234 10.494 -0.103 18 HA LYS 3 HA LYS 3 -5.745 10.765 1.776 19 1HB LYS 3 1HB LYS 3 -4.132 11.831 -0.145 20 2HB LYS 3 2HB LYS 3 -4.530 13.347 0.594 21 1HG LYS 3 1HG LYS 3 -3.494 12.593 2.763 22 2HG LYS 3 2HG LYS 3 -3.379 10.936 2.172 23 1HD LYS 3 1HD LYS 3 -1.798 11.720 0.330 24 2HD LYS 3 2HD LYS 3 -1.811 13.337 1.013 25 1HE LYS 3 1HE LYS 3 -0.865 10.789 2.517 26 2HE LYS 3 2HE LYS 3 0.198 11.868 1.619 27 1HZ LYS 3 1HZ LYS 3 -1.442 12.692 3.946 28 2HZ LYS 3 2HZ LYS 3 -0.451 13.677 3.098 29 H THR 4 H THR 4 -8.116 13.029 0.861 30 HA THR 4 HA THR 4 -8.363 14.112 3.545 31 HB THR 4 HB THR 4 -9.308 14.738 0.667 32 HG1 THR 4 HG1 THR 4 -7.583 16.106 2.478 33 1HG2 THR 4 3HG2 THR 4 -9.846 16.170 3.277 34 2HG2 THR 4 1HG2 THR 4 -10.113 16.865 1.609 35 3HG2 THR 4 2HG2 THR 4 -11.029 15.408 2.152 36 H GLU 5 H GLU 5 -10.136 12.041 1.139 37 HA GLU 5 HA GLU 5 -12.499 11.864 3.003 38 1HB GLU 5 1HB GLU 5 -12.173 9.897 0.747 39 2HB GLU 5 2HB GLU 5 -13.585 10.329 1.630 40 1HG GLU 5 1HG GLU 5 -12.097 12.045 -0.456 41 2HG GLU 5 2HG GLU 5 -13.540 11.110 -0.743 42 HE2 GLU 5 HE2 GLU 5 -13.727 14.780 0.867 43 H LEU 6 H LEU 6 -9.304 10.770 2.806 44 HA LEU 6 HA LEU 6 -9.364 8.335 4.465 45 1HB LEU 6 2HB LEU 6 -7.375 9.745 3.055 46 2HB LEU 6 1HB LEU 6 -6.991 10.279 4.662 47 HG LEU 6 HG LEU 6 -7.082 7.432 3.656 48 1HD1 LEU 6 3HD1 LEU 6 -4.743 9.197 4.438 49 2HD1 LEU 6 1HD1 LEU 6 -4.648 7.456 4.072 50 3HD1 LEU 6 2HD1 LEU 6 -5.168 8.611 2.826 51 1HD2 LEU 6 3HD2 LEU 6 -6.902 8.403 6.522 52 2HD2 LEU 6 1HD2 LEU 6 -7.775 7.016 5.853 53 3HD2 LEU 6 2HD2 LEU 6 -6.008 6.968 6.014 54 H ILE 7 H ILE 7 -8.864 11.830 5.124 55 HA ILE 7 HA ILE 7 -8.584 11.747 7.983 56 HB ILE 7 HB ILE 7 -9.844 14.035 6.334 57 1HG1 ILE 7 1HG1 ILE 7 -6.871 13.732 7.029 58 2HG1 ILE 7 2HG1 ILE 7 -7.499 13.201 5.514 59 1HG2 ILE 7 2HG2 ILE 7 -10.133 14.352 8.830 60 2HG2 ILE 7 3HG2 ILE 7 -8.383 14.212 9.024 61 3HG2 ILE 7 1HG2 ILE 7 -9.070 15.578 8.131 62 1HD1 ILE 7 3HD1 ILE 7 -8.376 15.561 5.036 63 2HD1 ILE 7 1HD1 ILE 7 -7.354 16.102 6.368 64 3HD1 ILE 7 2HD1 ILE 7 -6.621 15.262 4.974 65 H ASN 8 H ASN 8 -11.507 12.212 6.007 66 HA ASN 8 HA ASN 8 -13.339 12.145 8.343 67 1HB ASN 8 1HB ASN 8 -14.041 11.498 5.373 68 2HB ASN 8 2HB ASN 8 -15.220 11.773 6.633 69 1HD2 ASN 8 2HD2 ASN 8 -13.756 15.037 4.727 70 2HD2 ASN 8 1HD2 ASN 8 -13.266 13.323 4.292 71 H ALA 9 H ALA 9 -11.823 9.505 6.717 72 HA ALA 9 HA ALA 9 -13.699 7.361 7.681 73 1HB ALA 9 2HB ALA 9 -11.846 6.905 5.801 74 2HB ALA 9 3HB ALA 9 -10.619 7.139 7.051 75 3HB ALA 9 1HB ALA 9 -11.704 5.802 7.220 76 H VAL 10 H VAL 10 -10.663 8.876 8.799 77 HA VAL 10 HA VAL 10 -10.283 7.056 10.953 78 HB VAL 10 HB VAL 10 -8.779 9.625 11.038 79 1HG1 VAL 10 3HG2 VAL 10 -8.494 7.437 12.476 80 2HG1 VAL 10 1HG2 VAL 10 -7.626 6.848 11.030 81 3HG1 VAL 10 2HG2 VAL 10 -7.062 8.328 11.845 82 1HG2 VAL 10 1HG1 VAL 10 -8.611 7.615 8.757 83 2HG2 VAL 10 2HG1 VAL 10 -8.774 9.400 8.764 84 3HG2 VAL 10 3HG1 VAL 10 -7.203 8.661 9.218 85 H ALA 11 H ALA 11 -11.124 10.291 10.732 86 HA ALA 11 HA ALA 11 -11.763 10.447 13.491 87 1HB ALA 11 2HB ALA 11 -11.219 12.512 12.145 88 2HB ALA 11 3HB ALA 11 -12.731 12.331 11.219 89 3HB ALA 11 1HB ALA 11 -12.782 12.761 12.960 90 H GLU 12 H GLU 12 -13.736 9.223 10.903 91 HA GLU 12 HA GLU 12 -16.243 9.280 12.554 92 1HB GLU 12 1HB GLU 12 -16.374 9.437 10.050 93 2HB GLU 12 2HB GLU 12 -15.675 7.825 9.897 94 1HG GLU 12 1HG GLU 12 -17.716 6.877 11.123 95 2HG GLU 12 2HG GLU 12 -18.377 8.505 11.247 96 HE1 GLU 12 HE2 GLU 12 -18.405 6.441 7.760 97 H THR 13 H THR 13 -13.870 6.731 11.517 98 HA THR 13 HA THR 13 -15.112 4.753 13.305 99 HB THR 13 HB THR 13 -13.047 3.307 12.845 100 HG1 THR 13 HG1 THR 13 -12.179 5.663 11.573 101 1HG2 THR 13 2HG2 THR 13 -13.913 4.614 10.207 102 2HG2 THR 13 3HG2 THR 13 -12.956 3.134 10.408 103 3HG2 THR 13 1HG2 THR 13 -14.649 3.172 10.965 104 H SER 14 H SER 14 -13.225 7.081 14.162 105 HA SER 14 HA SER 14 -12.200 5.673 16.735 106 1HB SER 14 1HB SER 14 -10.580 7.861 15.320 107 2HB SER 14 2HB SER 14 -10.085 6.891 16.705 108 HG SER 14 HG SER 14 -10.222 5.052 15.347 109 H GLY 15 H GLY 15 -13.463 8.787 15.485 110 1HA GLY 15 1HA GLY 15 -14.167 10.733 16.635 111 2HA GLY 15 2HA GLY 15 -14.314 9.765 18.101 112 H LEU 16 H LEU 16 -11.577 10.717 16.094 113 HA LEU 16 HA LEU 16 -10.088 12.096 18.330 114 1HB LEU 16 1HB LEU 16 -8.115 11.963 16.984 115 2HB LEU 16 2HB LEU 16 -8.747 10.454 17.607 116 HG LEU 16 HG LEU 16 -9.596 9.773 15.616 117 1HD1 LEU 16 2HD1 LEU 16 -10.486 11.948 14.681 118 2HD1 LEU 16 3HD1 LEU 16 -8.787 12.330 14.255 119 3HD1 LEU 16 1HD1 LEU 16 -9.673 10.935 13.489 120 1HD2 LEU 16 3HD2 LEU 16 -7.638 8.857 15.602 121 2HD2 LEU 16 1HD2 LEU 16 -8.400 9.098 14.012 122 3HD2 LEU 16 2HD2 LEU 16 -7.069 10.134 14.473 123 H SER 17 H SER 17 -9.238 13.404 15.808 124 HA SER 17 HA SER 17 -11.301 15.649 15.566 125 1HB SER 17 1HB SER 17 -8.344 16.361 15.839 126 2HB SER 17 2HB SER 17 -9.683 17.449 15.564 127 HG SER 17 HG SER 17 -10.577 16.792 17.553 128 H LYS 18 H LYS 18 -11.066 16.900 13.618 129 HA LYS 18 HA LYS 18 -10.353 15.290 11.171 130 1HB LYS 18 1HB LYS 18 -11.160 18.252 11.329 131 2HB LYS 18 2HB LYS 18 -10.869 17.372 9.842 132 1HG LYS 18 1HG LYS 18 -13.085 16.687 11.874 133 2HG LYS 18 2HG LYS 18 -13.298 17.660 10.430 134 1HD LYS 18 1HD LYS 18 -12.743 15.712 8.950 135 2HD LYS 18 2HD LYS 18 -12.365 14.722 10.348 136 1HE LYS 18 1HE LYS 18 -14.552 14.060 9.617 137 2HE LYS 18 2HE LYS 18 -14.748 14.876 11.165 138 1HZ LYS 18 1HZ LYS 18 -15.257 16.060 8.487 139 2HZ LYS 18 2HZ LYS 18 -16.395 15.555 9.546 140 H LYS 19 H LYS 19 -8.949 18.072 12.859 141 HA LYS 19 HA LYS 19 -6.430 18.171 11.334 142 1HB LYS 19 2HB LYS 19 -7.233 20.054 12.752 143 2HB LYS 19 1HB LYS 19 -7.021 19.102 14.219 144 1HG LYS 19 1HG LYS 19 -5.199 20.711 13.963 145 2HG LYS 19 2HG LYS 19 -4.577 19.079 13.923 146 1HD LYS 19 1HD LYS 19 -3.368 20.400 12.308 147 2HD LYS 19 2HD LYS 19 -4.295 19.192 11.433 148 1HE LYS 19 1HE LYS 19 -6.045 20.968 10.860 149 2HE LYS 19 2HE LYS 19 -5.109 22.170 11.761 150 1HZ LYS 19 1HZ LYS 19 -4.187 20.668 9.374 151 2HZ LYS 19 2HZ LYS 19 -4.650 22.235 9.404 152 H ASP 20 H ASP 20 -7.405 16.154 14.222 153 HA ASP 20 HA ASP 20 -4.629 15.004 14.473 154 1HB ASP 20 1HB ASP 20 -7.287 14.260 15.813 155 2HB ASP 20 2HB ASP 20 -5.946 13.149 15.878 156 HD2 ASP 20 HD2 ASP 20 -5.953 16.369 18.214 157 H ALA 21 H ALA 21 -7.491 14.115 12.646 158 HA ALA 21 HA ALA 21 -6.490 11.442 11.799 159 1HB ALA 21 2HB ALA 21 -8.861 13.191 10.898 160 2HB ALA 21 3HB ALA 21 -8.448 11.619 10.149 161 3HB ALA 21 1HB ALA 21 -8.857 11.719 11.834 162 H THR 22 H THR 22 -6.465 14.726 10.270 163 HA THR 22 HA THR 22 -5.043 14.043 7.859 164 HB THR 22 HB THR 22 -4.669 16.695 9.410 165 HG1 THR 22 HG1 THR 22 -6.542 17.396 8.429 166 1HG2 THR 22 3HG2 THR 22 -4.943 15.962 6.434 167 2HG2 THR 22 1HG2 THR 22 -4.840 17.630 7.069 168 3HG2 THR 22 2HG2 THR 22 -3.454 16.497 7.258 169 H LYS 23 H LYS 23 -3.779 15.053 10.948 170 HA LYS 23 HA LYS 23 -0.905 14.779 10.424 171 1HB LYS 23 2HB LYS 23 -2.658 14.329 12.971 172 2HB LYS 23 1HB LYS 23 -0.934 14.207 13.068 173 1HG LYS 23 1HG LYS 23 -0.596 16.594 12.391 174 2HG LYS 23 2HG LYS 23 -2.334 16.815 12.193 175 1HD LYS 23 1HD LYS 23 -2.702 16.291 14.633 176 2HD LYS 23 2HD LYS 23 -0.970 16.019 14.852 177 1HE LYS 23 1HE LYS 23 -0.490 18.422 14.237 178 2HE LYS 23 2HE LYS 23 -2.212 18.710 13.951 179 1HZ LYS 23 1HZ LYS 23 -1.038 17.864 16.543 180 2HZ LYS 23 2HZ LYS 23 -2.628 18.133 16.277 181 H ALA 24 H ALA 24 -3.095 12.532 11.967 182 HA ALA 24 HA ALA 24 -1.391 10.310 12.411 183 1HB ALA 24 2HB ALA 24 -3.497 10.597 13.486 184 2HB ALA 24 3HB ALA 24 -4.390 10.399 11.943 185 3HB ALA 24 1HB ALA 24 -3.489 9.018 12.660 186 H VAL 25 H VAL 25 -3.254 10.967 9.492 187 HA VAL 25 HA VAL 25 -2.371 8.622 7.830 188 HB VAL 25 HB VAL 25 -3.559 11.562 7.564 189 1HG1 VAL 25 1HG2 VAL 25 -2.610 10.001 5.101 190 2HG1 VAL 25 2HG2 VAL 25 -3.716 11.420 5.090 191 3HG1 VAL 25 3HG2 VAL 25 -2.060 11.591 5.656 192 1HG2 VAL 25 2HG1 VAL 25 -4.631 8.847 6.719 193 2HG2 VAL 25 3HG1 VAL 25 -5.115 9.785 8.147 194 3HG2 VAL 25 1HG1 VAL 25 -5.474 10.430 6.539 195 H ASP 26 H ASP 26 -1.151 12.038 7.910 196 HA ASP 26 HA ASP 26 1.502 11.169 6.759 197 1HB ASP 26 1HB ASP 26 0.286 13.496 6.554 198 2HB ASP 26 2HB ASP 26 0.877 13.820 8.182 199 HD1 ASP 26 HD2 ASP 26 3.352 13.702 4.930 200 H ALA 27 H ALA 27 0.502 10.254 9.334 201 HA ALA 27 HA ALA 27 3.057 10.200 10.963 202 1HB ALA 27 2HB ALA 27 0.655 10.927 12.021 203 2HB ALA 27 3HB ALA 27 0.491 9.183 12.143 204 3HB ALA 27 1HB ALA 27 1.816 10.052 12.941 205 H VAL 28 H VAL 28 0.568 8.081 9.688 206 HA VAL 28 HA VAL 28 2.107 5.543 9.900 207 HB VAL 28 HB VAL 28 -0.102 6.270 7.794 208 1HG1 VAL 28 2HG2 VAL 28 1.318 3.686 8.526 209 2HG1 VAL 28 3HG2 VAL 28 -0.362 3.627 7.966 210 3HG1 VAL 28 1HG2 VAL 28 0.844 4.382 6.934 211 1HG2 VAL 28 2HG1 VAL 28 -0.448 5.039 10.486 212 2HG2 VAL 28 3HG1 VAL 28 -1.194 6.506 9.742 213 3HG2 VAL 28 1HG1 VAL 28 -1.628 4.906 9.104 214 H PHE 29 H PHE 29 1.209 7.569 7.258 215 HA PHE 29 HA PHE 29 3.009 6.444 5.226 216 1HB PHE 29 2HB PHE 29 1.291 8.958 5.014 217 2HB PHE 29 1HB PHE 29 2.032 8.124 3.663 218 HD1 PHE 29 HD2 PHE 29 1.549 5.360 3.735 219 HD2 PHE 29 HD1 PHE 29 -1.031 8.435 5.249 220 HE1 PHE 29 HE2 PHE 29 -0.308 3.759 3.822 221 HE2 PHE 29 HE1 PHE 29 -2.847 6.821 5.431 222 HZ PHE 29 HZ PHE 29 -2.474 4.455 4.743 223 H ASP 30 H ASP 30 3.748 8.919 7.523 224 HA ASP 30 HA ASP 30 6.016 9.922 5.817 225 1HB ASP 30 1HB ASP 30 4.694 11.196 7.747 226 2HB ASP 30 2HB ASP 30 5.742 10.373 8.869 227 HD1 ASP 30 HD2 ASP 30 8.577 12.228 8.169 228 H SER 31 H SER 31 5.572 7.719 8.404 229 HA SER 31 HA SER 31 8.481 6.984 8.781 230 1HB SER 31 1HB SER 31 6.114 5.273 9.675 231 2HB SER 31 2HB SER 31 7.792 5.141 10.207 232 HG SER 31 HG SER 31 7.648 7.252 11.047 233 H ILE 32 H ILE 32 5.691 5.478 6.827 234 HA ILE 32 HA ILE 32 7.081 3.303 5.735 235 HB ILE 32 HB ILE 32 4.999 4.885 4.230 236 1HG1 ILE 32 1HG1 ILE 32 4.788 3.448 6.853 237 2HG1 ILE 32 2HG1 ILE 32 4.094 4.923 6.215 238 1HG2 ILE 32 1HG2 ILE 32 6.395 2.698 3.399 239 2HG2 ILE 32 2HG2 ILE 32 5.334 1.872 4.529 240 3HG2 ILE 32 3HG2 ILE 32 4.631 2.744 3.154 241 1HD1 ILE 32 1HD1 ILE 32 3.090 2.223 5.341 242 2HD1 ILE 32 2HD1 ILE 32 2.578 3.081 6.816 243 3HD1 ILE 32 3HD1 ILE 32 2.310 3.863 5.218 244 H THR 33 H THR 33 6.626 6.543 4.338 245 HA THR 33 HA THR 33 8.502 6.011 2.085 246 HB THR 33 HB THR 33 6.972 7.906 1.881 247 HG1 THR 33 HG1 THR 33 9.603 8.876 2.037 248 1HG2 THR 33 3HG2 THR 33 6.973 8.570 4.356 249 2HG2 THR 33 1HG2 THR 33 8.440 9.481 4.078 250 3HG2 THR 33 2HG2 THR 33 6.908 9.919 3.225 251 H GLU 34 H GLU 34 9.194 6.963 5.397 252 HA GLU 34 HA GLU 34 12.129 7.364 4.900 253 1HB GLU 34 1HB GLU 34 10.570 6.861 7.520 254 2HB GLU 34 2HB GLU 34 12.318 7.022 7.465 255 1HG GLU 34 1HG GLU 34 12.198 9.337 6.631 256 2HG GLU 34 2HG GLU 34 10.456 9.258 6.445 257 HE2 GLU 34 HE2 GLU 34 12.137 10.017 10.000 258 H ALA 35 H ALA 35 10.046 4.554 5.778 259 HA ALA 35 HA ALA 35 12.277 2.679 5.859 260 1HB ALA 35 2HB ALA 35 9.724 2.028 6.598 261 2HB ALA 35 3HB ALA 35 9.344 1.992 4.887 262 3HB ALA 35 1HB ALA 35 10.449 0.822 5.529 263 H LEU 36 H LEU 36 10.069 3.492 3.171 264 HA LEU 36 HA LEU 36 11.260 1.835 1.110 265 1HB LEU 36 2HB LEU 36 9.689 4.307 0.682 266 2HB LEU 36 1HB LEU 36 9.857 2.926 -0.375 267 HG LEU 36 HG LEU 36 8.319 2.864 2.272 268 1HD1 LEU 36 1HD2 LEU 36 7.001 3.592 0.425 269 2HD1 LEU 36 2HD2 LEU 36 7.410 2.067 -0.485 270 3HD1 LEU 36 3HD2 LEU 36 6.471 2.003 1.044 271 1HD2 LEU 36 2HD1 LEU 36 9.643 0.768 2.240 272 2HD2 LEU 36 3HD1 LEU 36 7.928 0.482 2.058 273 3HD2 LEU 36 1HD1 LEU 36 8.998 0.396 0.611 274 NH1 ARG 37 NH2 ARG 37 13.243 11.953 3.715 275 NH2 ARG 37 NH1 ARG 37 14.102 11.225 5.689 276 H ARG 37 H ARG 37 11.745 5.348 1.850 277 HA ARG 37 HA ARG 37 13.585 5.588 -0.325 278 1HB ARG 37 1HB ARG 37 14.178 7.772 0.271 279 2HB ARG 37 2HB ARG 37 12.496 7.615 0.715 280 1HG ARG 37 1HG ARG 37 13.294 7.212 3.157 281 2HG ARG 37 2HG ARG 37 14.934 7.546 2.635 282 1HD ARG 37 1HD ARG 37 14.341 9.801 1.879 283 2HD ARG 37 2HD ARG 37 12.630 9.525 2.324 284 1HH1 ARG 37 2HH2 ARG 37 12.990 11.728 2.746 285 2HH1 ARG 37 1HH2 ARG 37 13.134 12.859 4.184 286 1HH2 ARG 37 1HH1 ARG 37 14.502 10.449 6.229 287 2HH2 ARG 37 2HH1 ARG 37 13.934 12.182 6.020 288 H LYS 38 H LYS 38 13.992 4.331 2.954 289 HA LYS 38 HA LYS 38 17.002 4.705 2.862 290 1HB LYS 38 1HB LYS 38 15.635 5.542 4.835 291 2HB LYS 38 2HB LYS 38 15.300 3.865 5.258 292 1HG LYS 38 1HG LYS 38 17.755 3.498 5.701 293 2HG LYS 38 2HG LYS 38 18.122 5.091 5.055 294 1HD LYS 38 1HD LYS 38 18.211 5.260 7.440 295 2HD LYS 38 2HD LYS 38 16.800 6.170 6.915 296 1HE LYS 38 1HE LYS 38 15.302 4.206 7.589 297 2HE LYS 38 2HE LYS 38 16.735 3.300 8.098 298 1HZ LYS 38 1HZ LYS 38 17.190 5.010 9.728 299 2HZ LYS 38 2HZ LYS 38 15.697 4.381 9.948 300 H GLY 39 H GLY 39 15.089 2.388 1.634 301 1HA GLY 39 1HA GLY 39 15.443 0.079 1.075 302 2HA GLY 39 2HA GLY 39 17.038 0.171 1.789 303 H ASP 40 H ASP 40 13.922 0.704 3.356 304 HA ASP 40 HA ASP 40 14.233 -1.783 5.106 305 1HB ASP 40 1HB ASP 40 13.074 0.833 6.013 306 2HB ASP 40 2HB ASP 40 13.183 -0.617 6.962 307 HD1 ASP 40 HD2 ASP 40 16.528 -0.337 7.737 308 H LYS 41 H LYS 41 12.683 -3.030 5.657 309 HA LYS 41 HA LYS 41 10.132 -2.963 4.034 310 1HB LYS 41 2HB LYS 41 10.872 -5.126 6.064 311 2HB LYS 41 1HB LYS 41 9.587 -5.175 4.857 312 1HG LYS 41 1HG LYS 41 11.450 -5.074 3.045 313 2HG LYS 41 2HG LYS 41 12.617 -5.296 4.343 314 1HD LYS 41 1HD LYS 41 11.424 -7.443 5.017 315 2HD LYS 41 2HD LYS 41 10.305 -7.248 3.676 316 1HE LYS 41 1HE LYS 41 13.374 -7.573 3.388 317 2HE LYS 41 2HE LYS 41 12.205 -8.886 3.264 318 1HZ LYS 41 1HZ LYS 41 12.808 -8.098 1.107 319 2HZ LYS 41 2HZ LYS 41 11.217 -7.816 1.357 320 H VAL 42 H VAL 42 8.205 -2.278 4.943 321 HA VAL 42 HA VAL 42 7.865 -1.410 7.638 322 HB VAL 42 HB VAL 42 6.084 -1.673 5.161 323 1HG1 VAL 42 3HG2 VAL 42 4.932 -0.823 7.236 324 2HG1 VAL 42 1HG2 VAL 42 6.143 0.499 7.305 325 3HG1 VAL 42 2HG2 VAL 42 5.026 0.364 5.915 326 1HG2 VAL 42 2HG1 VAL 42 8.318 -0.343 4.641 327 2HG2 VAL 42 3HG1 VAL 42 6.850 0.561 4.430 328 3HG2 VAL 42 1HG1 VAL 42 7.796 0.803 5.906 329 H GLN 43 H GLN 43 5.167 -2.498 7.190 330 HA GLN 43 HA GLN 43 4.335 -4.653 7.105 331 1HB GLN 43 1HB GLN 43 6.041 -5.691 9.289 332 2HB GLN 43 2HB GLN 43 4.478 -6.456 8.984 333 1HG GLN 43 1HG GLN 43 4.915 -6.856 6.685 334 2HG GLN 43 2HG GLN 43 6.385 -5.941 6.662 335 1HE2 GLN 43 2HE2 GLN 43 8.376 -8.747 7.724 336 2HE2 GLN 43 1HE2 GLN 43 8.290 -7.020 7.118 337 H LEU 44 H LEU 44 2.478 -5.406 7.445 338 HA LEU 44 HA LEU 44 0.749 -4.210 9.640 339 1HB LEU 44 2HB LEU 44 -0.173 -4.379 6.705 340 2HB LEU 44 1HB LEU 44 -1.029 -3.689 8.071 341 HG LEU 44 HG LEU 44 1.233 -2.117 8.098 342 1HD1 LEU 44 1HD1 LEU 44 2.238 -3.235 6.036 343 2HD1 LEU 44 2HD1 LEU 44 0.854 -2.662 5.082 344 3HD1 LEU 44 3HD1 LEU 44 1.968 -1.501 5.854 345 1HD2 LEU 44 2HD2 LEU 44 -1.113 -1.263 8.032 346 2HD2 LEU 44 3HD2 LEU 44 -0.080 -0.368 6.901 347 3HD2 LEU 44 1HD2 LEU 44 -1.212 -1.599 6.285 348 H ILE 45 H ILE 45 -0.135 -6.007 10.672 349 HA ILE 45 HA ILE 45 -0.126 -8.647 9.353 350 HB ILE 45 HB ILE 45 0.460 -8.325 11.745 351 1HG1 ILE 45 1HG1 ILE 45 -1.721 -10.450 11.323 352 2HG1 ILE 45 2HG1 ILE 45 -0.109 -10.562 10.639 353 1HG2 ILE 45 1HG2 ILE 45 -1.428 -6.811 12.400 354 2HG2 ILE 45 2HG2 ILE 45 -2.577 -8.163 12.226 355 3HG2 ILE 45 3HG2 ILE 45 -1.301 -8.223 13.479 356 1HD1 ILE 45 1HD1 ILE 45 0.919 -10.517 12.952 357 2HD1 ILE 45 2HD1 ILE 45 -0.718 -10.490 13.661 358 3HD1 ILE 45 3HD1 ILE 45 -0.188 -11.887 12.700 359 H GLY 46 H GLY 46 -1.839 -9.935 8.902 360 1HA GLY 46 1HA GLY 46 -3.776 -10.401 7.560 361 2HA GLY 46 2HA GLY 46 -4.608 -9.390 8.716 362 H PHE 47 H PHE 47 -2.361 -7.584 6.845 363 HA PHE 47 HA PHE 47 -4.273 -6.876 4.633 364 1HB PHE 47 2HB PHE 47 -4.522 -5.569 6.873 365 2HB PHE 47 1HB PHE 47 -2.953 -4.862 6.604 366 HD1 PHE 47 HD1 PHE 47 -6.391 -5.171 5.025 367 HD2 PHE 47 HD2 PHE 47 -2.635 -3.063 4.961 368 HE1 PHE 47 HE1 PHE 47 -7.169 -3.746 3.150 369 HE2 PHE 47 HE2 PHE 47 -3.466 -1.671 3.115 370 HZ PHE 47 HZ PHE 47 -5.721 -2.099 2.164 371 H GLY 48 H GLY 48 -0.838 -6.538 5.795 372 1HA GLY 48 1HA GLY 48 0.119 -6.422 3.099 373 2HA GLY 48 2HA GLY 48 -0.011 -4.755 3.631 374 H ASN 49 H ASN 49 2.112 -5.593 2.579 375 HA ASN 49 HA ASN 49 4.179 -5.134 4.739 376 1HB ASN 49 1HB ASN 49 4.113 -7.601 4.637 377 2HB ASN 49 2HB ASN 49 4.253 -7.605 2.900 378 1HD2 ASN 49 1HD2 ASN 49 7.633 -8.487 3.963 379 2HD2 ASN 49 2HD2 ASN 49 5.944 -9.170 3.744 380 H PHE 50 H PHE 50 4.754 -3.201 3.923 381 HA PHE 50 HA PHE 50 5.118 -2.770 0.958 382 1HB PHE 50 2HB PHE 50 5.831 -0.833 3.199 383 2HB PHE 50 1HB PHE 50 6.065 -0.471 1.536 384 HD1 PHE 50 HD1 PHE 50 3.605 -1.102 4.200 385 HD2 PHE 50 HD2 PHE 50 4.412 0.765 0.428 386 HE1 PHE 50 HE1 PHE 50 1.504 0.235 4.398 387 HE2 PHE 50 HE2 PHE 50 2.337 2.086 0.660 388 HZ PHE 50 HZ PHE 50 0.856 1.695 2.579 389 H GLU 51 H GLU 51 7.043 -2.527 -0.014 390 HA GLU 51 HA GLU 51 9.528 -2.146 1.377 391 1HB GLU 51 1HB GLU 51 10.768 -4.273 0.934 392 2HB GLU 51 2HB GLU 51 9.404 -4.614 1.958 393 1HG GLU 51 1HG GLU 51 9.487 -5.196 -1.083 394 2HG GLU 51 2HG GLU 51 9.908 -6.343 0.168 395 HE2 GLU 51 HE2 GLU 51 6.101 -5.752 -0.834 396 H VAL 52 H VAL 52 11.442 -1.822 0.073 397 HA VAL 52 HA VAL 52 10.621 -0.894 -2.592 398 HB VAL 52 HB VAL 52 11.948 0.164 -0.277 399 1HG1 VAL 52 1HG2 VAL 52 14.114 -0.532 -2.274 400 2HG1 VAL 52 2HG2 VAL 52 14.211 0.680 -0.943 401 3HG1 VAL 52 3HG2 VAL 52 13.943 -1.058 -0.593 402 1HG2 VAL 52 3HG1 VAL 52 11.841 1.233 -3.105 403 2HG2 VAL 52 1HG1 VAL 52 10.683 1.455 -1.764 404 3HG2 VAL 52 2HG1 VAL 52 12.305 2.131 -1.652 405 NH1 ARG 53 NH2 ARG 53 8.739 -4.446 -7.460 406 NH2 ARG 53 NH1 ARG 53 8.205 -6.284 -6.239 407 H ARG 53 H ARG 53 12.053 -1.170 -4.415 408 HA ARG 53 HA ARG 53 13.574 -3.855 -4.423 409 1HB ARG 53 1HB ARG 53 11.159 -3.821 -5.432 410 2HB ARG 53 2HB ARG 53 11.821 -2.843 -6.723 411 1HG ARG 53 1HG ARG 53 13.476 -4.649 -7.275 412 2HG ARG 53 2HG ARG 53 12.862 -5.646 -5.968 413 1HD ARG 53 1HD ARG 53 11.198 -4.704 -8.412 414 2HD ARG 53 2HD ARG 53 12.006 -6.249 -8.283 415 1HH1 ARG 53 2HH2 ARG 53 9.459 -3.929 -7.976 416 2HH1 ARG 53 1HH2 ARG 53 7.758 -4.171 -7.331 417 1HH2 ARG 53 1HH1 ARG 53 8.514 -7.167 -5.819 418 2HH2 ARG 53 2HH1 ARG 53 7.263 -5.879 -6.196 419 H GLU 54 H GLU 54 15.584 -2.971 -4.299 420 HA GLU 54 HA GLU 54 16.547 -0.675 -5.844 421 1HB GLU 54 1HB GLU 54 17.565 -1.465 -3.721 422 2HB GLU 54 2HB GLU 54 18.203 -2.899 -4.499 423 1HG GLU 54 1HG GLU 54 18.895 -0.006 -5.360 424 2HG GLU 54 2HG GLU 54 19.778 -0.870 -4.112 425 HE2 GLU 54 HE2 GLU 54 21.227 -1.095 -7.599 426 NH1 ARG 55 NH2 ARG 55 13.996 -3.508 -9.803 427 NH2 ARG 55 NH1 ARG 55 12.139 -2.791 -10.893 428 H ARG 55 H ARG 55 16.976 -0.562 -7.928 429 HA ARG 55 HA ARG 55 16.909 -3.034 -9.617 430 1HB ARG 55 1HB ARG 55 15.524 -0.917 -10.086 431 2HB ARG 55 2HB ARG 55 17.006 -0.080 -10.478 432 1HG ARG 55 1HG ARG 55 15.965 -0.704 -12.532 433 2HG ARG 55 2HG ARG 55 17.421 -1.656 -12.381 434 1HD ARG 55 1HD ARG 55 15.752 -3.142 -13.246 435 2HD ARG 55 2HD ARG 55 15.998 -3.672 -11.607 436 1HH1 ARG 55 2HH2 ARG 55 15.011 -3.654 -9.827 437 2HH1 ARG 55 1HH2 ARG 55 13.363 -3.715 -9.022 438 1HH2 ARG 55 1HH1 ARG 55 11.733 -2.392 -11.747 439 2HH2 ARG 55 2HH1 ARG 55 11.637 -3.048 -10.036 440 H ALA 56 H ALA 56 18.655 -3.988 -10.419 441 HA ALA 56 HA ALA 56 21.410 -2.683 -10.212 442 1HB ALA 56 2HB ALA 56 21.158 -4.949 -9.250 443 2HB ALA 56 3HB ALA 56 20.648 -5.603 -10.828 444 3HB ALA 56 1HB ALA 56 22.293 -4.960 -10.613 445 H ALA 57 H ALA 57 20.809 -1.158 -11.849 446 HA ALA 57 HA ALA 57 20.236 -0.354 -13.933 447 1HB ALA 57 3HB ALA 57 22.648 -0.064 -13.466 448 2HB ALA 57 1HB ALA 57 23.026 -1.589 -14.311 449 3HB ALA 57 2HB ALA 57 22.382 -0.189 -15.217 450 NH1 ARG 58 NH2 ARG 58 12.014 0.105 -15.764 451 NH2 ARG 58 NH1 ARG 58 12.346 0.181 -13.516 452 H ARG 58 H ARG 58 19.004 -0.431 -15.503 453 HA ARG 58 HA ARG 58 18.462 -3.033 -16.678 454 1HB ARG 58 2HB ARG 58 17.062 -0.532 -17.703 455 2HB ARG 58 1HB ARG 58 16.487 -2.186 -17.754 456 1HG ARG 58 1HG ARG 58 16.252 -2.133 -15.225 457 2HG ARG 58 2HG ARG 58 16.770 -0.443 -15.235 458 1HD ARG 58 1HD ARG 58 14.805 0.146 -16.744 459 2HD ARG 58 2HD ARG 58 14.253 -1.539 -16.655 460 1HH1 ARG 58 2HH2 ARG 58 12.409 -0.088 -16.691 461 2HH1 ARG 58 1HH2 ARG 58 11.056 0.410 -15.556 462 1HH2 ARG 58 1HH1 ARG 58 12.991 0.048 -12.729 463 2HH2 ARG 58 2HH1 ARG 58 11.366 0.480 -13.463 464 H LYS 59 H LYS 59 17.828 -2.690 -19.334 465 HA LYS 59 HA LYS 59 19.973 -1.309 -20.841 466 1HB LYS 59 1HB LYS 59 21.028 -3.195 -21.986 467 2HB LYS 59 2HB LYS 59 21.390 -3.117 -20.281 468 1HG LYS 59 1HG LYS 59 19.669 -5.013 -19.879 469 2HG LYS 59 2HG LYS 59 19.459 -5.107 -21.621 470 1HD LYS 59 1HD LYS 59 20.965 -6.849 -21.063 471 2HD LYS 59 2HD LYS 59 21.937 -5.634 -21.883 472 1HE LYS 59 1HE LYS 59 22.792 -4.814 -19.612 473 2HE LYS 59 2HE LYS 59 21.787 -6.025 -18.805 474 1HZ LYS 59 1HZ LYS 59 24.028 -6.794 -19.071 475 2HZ LYS 59 2HZ LYS 59 23.023 -7.751 -19.935 476 H GLY 60 H GLY 60 18.987 -0.521 -22.508 477 1HA GLY 60 1HA GLY 60 17.459 -1.800 -24.539 478 2HA GLY 60 2HA GLY 60 16.227 -1.455 -23.323 479 NH1 ARG 61 NH2 ARG 61 21.169 6.223 -27.237 480 NH2 ARG 61 NH1 ARG 61 20.380 7.676 -28.797 481 H ARG 61 H ARG 61 17.767 -0.167 -25.978 482 HA ARG 61 HA ARG 61 17.890 2.553 -25.250 483 1HB ARG 61 1HB ARG 61 19.397 1.995 -26.809 484 2HB ARG 61 2HB ARG 61 18.171 1.661 -28.032 485 1HG ARG 61 1HG ARG 61 17.556 4.123 -27.999 486 2HG ARG 61 2HG ARG 61 18.659 4.396 -26.654 487 1HD ARG 61 1HD ARG 61 20.616 3.737 -28.140 488 2HD ARG 61 2HD ARG 61 19.498 3.460 -29.466 489 1HH1 ARG 61 2HH2 ARG 61 21.187 5.260 -26.883 490 2HH1 ARG 61 1HH2 ARG 61 21.665 7.031 -26.846 491 1HH2 ARG 61 1HH1 ARG 61 19.799 7.825 -29.629 492 2HH2 ARG 61 2HH1 ARG 61 20.931 8.382 -28.297 493 H ASN 62 H ASN 62 16.398 2.204 -27.872 494 HA ASN 62 HA ASN 62 13.511 3.036 -27.138 495 1HB ASN 62 1HB ASN 62 15.136 4.939 -27.842 496 2HB ASN 62 2HB ASN 62 15.186 4.243 -29.448 497 1HD2 ASN 62 2HD2 ASN 62 11.997 6.539 -28.475 498 2HD2 ASN 62 1HD2 ASN 62 13.224 6.024 -27.208 499 HA PRO 63 HA PRO 63 12.163 -0.228 -30.116 500 1HB PRO 63 1HB PRO 63 9.930 1.774 -30.762 501 2HB PRO 63 2HB PRO 63 9.810 0.021 -30.495 502 1HG PRO 63 1HG PRO 63 9.171 1.714 -28.475 503 2HG PRO 63 2HG PRO 63 10.153 0.276 -28.107 504 1HD PRO 63 1HD PRO 63 11.106 3.167 -28.435 505 2HD PRO 63 2HD PRO 63 11.606 1.930 -27.240 506 H GLN 64 H GLN 64 12.603 3.054 -31.376 507 HA GLN 64 HA GLN 64 12.433 2.324 -34.253 508 1HB GLN 64 1HB GLN 64 11.930 4.679 -33.263 509 2HB GLN 64 2HB GLN 64 13.624 4.834 -32.891 510 1HG GLN 64 1HG GLN 64 13.354 6.070 -34.824 511 2HG GLN 64 2HG GLN 64 14.183 4.627 -35.371 512 1HE2 GLN 64 2HE2 GLN 64 11.548 3.705 -37.646 513 2HE2 GLN 64 1HE2 GLN 64 13.206 3.353 -36.944 514 H THR 65 H THR 65 15.127 3.481 -32.244 515 HA THR 65 HA THR 65 17.135 2.830 -34.283 516 HB THR 65 HB THR 65 18.695 3.993 -32.836 517 HG1 THR 65 HG1 THR 65 18.020 4.741 -30.824 518 1HG2 THR 65 2HG2 THR 65 16.991 5.434 -34.126 519 2HG2 THR 65 3HG2 THR 65 15.994 5.495 -32.665 520 3HG2 THR 65 1HG2 THR 65 17.610 6.220 -32.639 521 H GLY 66 H GLY 66 16.315 1.373 -31.161 522 1HA GLY 66 1HA GLY 66 17.062 -0.605 -30.070 523 2HA GLY 66 2HA GLY 66 17.331 -1.218 -31.685 524 H GLU 67 H GLU 67 19.168 1.364 -29.999 525 HA GLU 67 HA GLU 67 21.687 -0.450 -30.040 526 1HB GLU 67 2HB GLU 67 21.507 1.646 -31.582 527 2HB GLU 67 1HB GLU 67 21.563 2.577 -30.070 528 1HG GLU 67 1HG GLU 67 23.845 1.472 -29.569 529 2HG GLU 67 2HG GLU 67 23.737 0.635 -31.114 530 HE1 GLU 67 HE2 GLU 67 24.021 3.587 -29.523 531 H GLU 68 H GLU 68 20.292 -0.900 -28.163 532 HA GLU 68 HA GLU 68 19.708 0.186 -25.851 533 1HB GLU 68 1HB GLU 68 20.043 -1.853 -24.537 534 2HB GLU 68 2HB GLU 68 19.345 -2.133 -26.115 535 1HG GLU 68 1HG GLU 68 21.619 -2.991 -26.933 536 2HG GLU 68 2HG GLU 68 22.274 -2.733 -25.320 537 HE1 GLU 68 HE2 GLU 68 19.837 -5.844 -26.142 538 H MET 69 H MET 69 20.359 1.703 -24.731 539 HA MET 69 HA MET 69 23.184 1.781 -23.603 540 1HB MET 69 1HB MET 69 23.017 3.995 -23.086 541 2HB MET 69 2HB MET 69 22.252 3.879 -24.648 542 1HG MET 69 1HG MET 69 20.778 4.201 -21.943 543 2HG MET 69 2HG MET 69 21.151 5.500 -23.072 544 1HE MET 69 3HE MET 69 18.289 4.579 -21.825 545 2HE MET 69 2HE MET 69 17.185 3.826 -23.015 546 3HE MET 69 1HE MET 69 18.395 2.829 -22.175 547 H GLU 70 H GLU 70 23.632 1.321 -21.584 548 HA GLU 70 HA GLU 70 21.806 0.073 -19.785 549 1HB GLU 70 2HB GLU 70 23.502 -0.054 -18.091 550 2HB GLU 70 1HB GLU 70 24.113 -0.532 -19.673 551 1HG GLU 70 1HG GLU 70 25.292 1.718 -19.878 552 2HG GLU 70 2HG GLU 70 24.693 2.176 -18.286 553 HE1 GLU 70 HE2 GLU 70 26.865 0.188 -16.476 554 H ILE 71 H ILE 71 20.290 0.819 -18.511 555 HA ILE 71 HA ILE 71 19.930 3.716 -17.958 556 HB ILE 71 HB ILE 71 18.227 1.212 -17.553 557 1HG1 ILE 71 1HG1 ILE 71 17.751 3.490 -19.591 558 2HG1 ILE 71 2HG1 ILE 71 18.735 2.111 -20.005 559 1HG2 ILE 71 2HG2 ILE 71 17.521 2.881 -15.913 560 2HG2 ILE 71 3HG2 ILE 71 17.412 4.138 -17.185 561 3HG2 ILE 71 1HG2 ILE 71 16.294 2.733 -17.184 562 1HD1 ILE 71 3HD1 ILE 71 15.781 1.835 -19.196 563 2HD1 ILE 71 1HD1 ILE 71 16.432 1.826 -20.845 564 3HD1 ILE 71 2HD1 ILE 71 16.871 0.522 -19.725 565 HA PRO 72 HA PRO 72 21.850 3.154 -13.755 566 1HB PRO 72 1HB PRO 72 20.217 5.698 -13.187 567 2HB PRO 72 2HB PRO 72 21.892 5.331 -12.728 568 1HG PRO 72 1HG PRO 72 21.431 6.913 -14.877 569 2HG PRO 72 2HG PRO 72 22.673 5.644 -15.005 570 1HD PRO 72 1HD PRO 72 19.807 5.583 -16.092 571 2HD PRO 72 2HD PRO 72 21.330 5.033 -16.856 572 H ALA 73 H ALA 73 21.282 2.990 -11.463 573 HA ALA 73 HA ALA 73 19.017 1.228 -10.967 574 1HB ALA 73 1HB ALA 73 21.110 1.235 -9.493 575 2HB ALA 73 2HB ALA 73 20.619 2.835 -8.829 576 3HB ALA 73 3HB ALA 73 19.635 1.405 -8.528 577 H SER 74 H SER 74 17.413 1.402 -9.403 578 HA SER 74 HA SER 74 17.025 3.707 -7.916 579 1HB SER 74 1HB SER 74 14.683 4.561 -8.618 580 2HB SER 74 2HB SER 74 15.867 4.804 -9.895 581 HG SER 74 HG SER 74 14.042 2.640 -9.688 582 H LYS 75 H LYS 75 15.725 3.447 -6.150 583 HA LYS 75 HA LYS 75 14.789 0.668 -5.489 584 1HB LYS 75 2HB LYS 75 14.061 2.819 -3.575 585 2HB LYS 75 1HB LYS 75 14.495 1.158 -3.356 586 1HG LYS 75 1HG LYS 75 16.919 1.684 -3.812 587 2HG LYS 75 2HG LYS 75 16.500 3.388 -4.018 588 1HD LYS 75 1HD LYS 75 15.609 3.459 -1.650 589 2HD LYS 75 2HD LYS 75 16.067 1.780 -1.412 590 1HE LYS 75 1HE LYS 75 18.065 4.048 -2.070 591 2HE LYS 75 2HE LYS 75 17.684 3.482 -0.445 592 1HZ LYS 75 1HZ LYS 75 19.664 2.448 -1.240 593 2HZ LYS 75 2HZ LYS 75 18.517 1.307 -1.009 594 H VAL 76 H VAL 76 12.638 -0.082 -6.093 595 HA VAL 76 HA VAL 76 10.707 1.882 -6.953 596 HB VAL 76 HB VAL 76 11.991 -0.720 -7.614 597 1HG1 VAL 76 3HG2 VAL 76 9.085 -0.599 -8.057 598 2HG1 VAL 76 1HG2 VAL 76 10.320 -1.765 -8.769 599 3HG1 VAL 76 2HG2 VAL 76 10.028 -1.727 -7.024 600 1HG2 VAL 76 2HG1 VAL 76 12.321 1.317 -8.926 601 2HG2 VAL 76 3HG1 VAL 76 11.666 -0.035 -9.872 602 3HG2 VAL 76 1HG1 VAL 76 10.580 1.306 -9.362 603 HA PRO 77 HA PRO 77 8.675 0.508 -3.034 604 1HB PRO 77 1HB PRO 77 6.710 2.479 -2.892 605 2HB PRO 77 2HB PRO 77 8.429 2.874 -2.714 606 1HG PRO 77 1HG PRO 77 6.729 3.048 -5.254 607 2HG PRO 77 2HG PRO 77 7.729 4.324 -4.557 608 1HD PRO 77 1HD PRO 77 8.590 2.521 -6.638 609 2HD PRO 77 2HD PRO 77 9.778 3.174 -5.475 610 H ALA 78 H ALA 78 7.385 -0.813 -2.558 611 HA ALA 78 HA ALA 78 4.921 -1.550 -4.225 612 1HB ALA 78 2HB ALA 78 7.051 -2.891 -4.667 613 2HB ALA 78 3HB ALA 78 7.067 -3.397 -2.963 614 3HB ALA 78 1HB ALA 78 5.725 -3.890 -4.023 615 H PHE 79 H PHE 79 3.579 -2.983 -3.145 616 HA PHE 79 HA PHE 79 3.205 -2.824 -0.102 617 1HB PHE 79 2HB PHE 79 2.129 -0.949 -0.364 618 2HB PHE 79 1HB PHE 79 1.378 -1.433 -1.908 619 HD1 PHE 79 HD1 PHE 79 1.097 -1.847 1.804 620 HD2 PHE 79 HD2 PHE 79 -0.678 -2.751 -2.011 621 HE1 PHE 79 HE1 PHE 79 -0.902 -2.741 2.928 622 HE2 PHE 79 HE2 PHE 79 -2.626 -3.714 -0.870 623 HZ PHE 79 HZ PHE 79 -2.730 -3.745 1.586 624 H LYS 80 H LYS 80 2.773 -4.721 0.240 625 HA LYS 80 HA LYS 80 1.692 -7.024 -1.602 626 1HB LYS 80 2HB LYS 80 2.999 -7.073 1.146 627 2HB LYS 80 1HB LYS 80 2.132 -8.439 0.479 628 1HG LYS 80 1HG LYS 80 3.655 -8.456 -1.538 629 2HG LYS 80 2HG LYS 80 4.549 -7.082 -0.886 630 1HD LYS 80 1HD LYS 80 5.252 -8.421 1.096 631 2HD LYS 80 2HD LYS 80 4.293 -9.802 0.551 632 1HE LYS 80 1HE LYS 80 5.725 -9.988 -1.529 633 2HE LYS 80 2HE LYS 80 6.654 -8.566 -1.034 634 1HZ LYS 80 1HZ LYS 80 7.779 -10.568 -0.416 635 2HZ LYS 80 2HZ LYS 80 7.361 -9.751 0.937 636 HA PRO 81 HA PRO 81 -2.250 -6.326 0.640 637 1HB PRO 81 1HB PRO 81 -3.811 -8.191 -0.637 638 2HB PRO 81 2HB PRO 81 -3.180 -6.764 -1.468 639 1HG PRO 81 1HG PRO 81 -2.031 -9.608 -1.510 640 2HG PRO 81 2HG PRO 81 -2.416 -8.572 -2.907 641 1HD PRO 81 1HD PRO 81 0.143 -8.757 -1.772 642 2HD PRO 81 2HD PRO 81 -0.433 -7.281 -2.611 643 H GLY 82 H GLY 82 -0.145 -7.698 1.972 644 1HA GLY 82 1HA GLY 82 0.557 -9.484 3.391 645 2HA GLY 82 2HA GLY 82 -0.987 -9.076 4.108 646 H LYS 83 H LYS 83 -1.173 -10.592 1.067 647 HA LYS 83 HA LYS 83 -2.004 -12.735 0.339 648 1HB LYS 83 2HB LYS 83 -0.622 -13.626 2.853 649 2HB LYS 83 1HB LYS 83 -2.019 -14.580 2.528 650 1HG LYS 83 1HG LYS 83 -1.147 -15.152 0.238 651 2HG LYS 83 2HG LYS 83 0.202 -14.030 0.431 652 1HD LYS 83 1HD LYS 83 1.158 -15.377 2.285 653 2HD LYS 83 2HD LYS 83 -0.231 -16.463 2.281 654 1HE LYS 83 1HE LYS 83 0.332 -17.187 -0.093 655 2HE LYS 83 2HE LYS 83 1.736 -16.108 -0.086 656 1HZ LYS 83 1HZ LYS 83 1.305 -18.354 1.808 657 2HZ LYS 83 2HZ LYS 83 2.604 -17.362 1.808 658 H ALA 84 H ALA 84 -2.887 -11.932 3.458 659 HA ALA 84 HA ALA 84 -5.494 -13.099 3.922 660 1HB ALA 84 2HB ALA 84 -3.883 -12.181 5.609 661 2HB ALA 84 3HB ALA 84 -4.027 -10.552 4.901 662 3HB ALA 84 1HB ALA 84 -5.433 -11.280 5.722 663 H LEU 85 H LEU 85 -4.668 -9.674 2.787 664 HA LEU 85 HA LEU 85 -7.465 -8.998 2.265 665 1HB LEU 85 2HB LEU 85 -5.784 -7.169 2.661 666 2HB LEU 85 1HB LEU 85 -4.877 -7.695 1.258 667 HG LEU 85 HG LEU 85 -7.006 -7.413 -0.056 668 1HD1 LEU 85 3HD1 LEU 85 -7.875 -5.730 2.354 669 2HD1 LEU 85 1HD1 LEU 85 -8.655 -5.637 0.749 670 3HD1 LEU 85 2HD1 LEU 85 -8.708 -7.141 1.684 671 1HD2 LEU 85 2HD2 LEU 85 -5.059 -5.881 -0.343 672 2HD2 LEU 85 3HD2 LEU 85 -6.553 -4.941 -0.481 673 3HD2 LEU 85 1HD2 LEU 85 -5.590 -4.878 1.022 674 H LYS 86 H LYS 86 -4.816 -10.420 0.404 675 HA LYS 86 HA LYS 86 -6.146 -10.547 -2.186 676 1HB LYS 86 1HB LYS 86 -3.585 -11.381 -1.312 677 2HB LYS 86 2HB LYS 86 -4.328 -12.877 -1.773 678 1HG LYS 86 1HG LYS 86 -4.042 -10.360 -3.533 679 2HG LYS 86 2HG LYS 86 -3.027 -11.792 -3.595 680 1HD LYS 86 1HD LYS 86 -5.067 -13.175 -4.327 681 2HD LYS 86 2HD LYS 86 -6.024 -11.702 -4.301 682 1HE LYS 86 1HE LYS 86 -5.475 -12.033 -6.589 683 2HE LYS 86 2HE LYS 86 -4.503 -10.663 -6.060 684 1HZ LYS 86 1HZ LYS 86 -2.610 -12.167 -5.841 685 2HZ LYS 86 2HZ LYS 86 -3.208 -12.183 -7.363 686 H ASP 87 H ASP 87 -6.803 -12.456 0.686 687 HA ASP 87 HA ASP 87 -8.532 -14.379 -0.840 688 1HB ASP 87 1HB ASP 87 -7.027 -14.479 1.607 689 2HB ASP 87 2HB ASP 87 -8.624 -14.206 2.188 690 HD1 ASP 87 HD2 ASP 87 -7.618 -17.595 0.105 691 H ALA 88 H ALA 88 -8.920 -11.546 1.324 692 HA ALA 88 HA ALA 88 -11.815 -11.413 1.560 693 1HB ALA 88 1HB ALA 88 -10.204 -9.684 2.652 694 2HB ALA 88 2HB ALA 88 -9.874 -9.016 1.048 695 3HB ALA 88 3HB ALA 88 -11.487 -8.882 1.704 696 H VAL 89 H VAL 89 -9.629 -10.321 -1.105 697 HA VAL 89 HA VAL 89 -11.765 -8.907 -2.535 698 HB VAL 89 HB VAL 89 -9.354 -8.234 -1.536 699 1HG1 VAL 89 2HG2 VAL 89 -8.230 -10.293 -2.566 700 2HG1 VAL 89 3HG2 VAL 89 -8.303 -9.497 -4.125 701 3HG1 VAL 89 1HG2 VAL 89 -7.428 -8.730 -2.765 702 1HG2 VAL 89 1HG1 VAL 89 -10.059 -7.515 -4.332 703 2HG2 VAL 89 2HG1 VAL 89 -10.649 -6.808 -2.779 704 3HG2 VAL 89 3HG1 VAL 89 -8.914 -6.698 -3.185 705 H LYS 90 H LYS 90 -10.412 -12.058 -2.793 706 HA LYS 90 HA LYS 90 -10.268 -12.219 -5.698 707 1HB LYS 90 1HB LYS 90 -9.443 -14.322 -5.483 708 2HB LYS 90 2HB LYS 90 -8.842 -13.441 -4.114 709 1HG LYS 90 1HG LYS 90 -10.540 -14.611 -2.620 710 2HG LYS 90 2HG LYS 90 -11.139 -15.498 -4.022 711 1HD LYS 90 1HD LYS 90 -8.772 -16.466 -4.366 712 2HD LYS 90 2HD LYS 90 -8.268 -15.628 -2.907 713 1HE LYS 90 1HE LYS 90 -8.691 -17.891 -2.253 714 2HE LYS 90 2HE LYS 90 -10.014 -16.953 -1.567 715 1HZ LYS 90 1HZ LYS 90 -10.134 -18.533 -4.088 716 2HZ LYS 90 2HZ LYS 90 -11.379 -17.668 -3.476 717 1H MET 1 1H MET 91 8.611 -2.281 9.723 718 2H MET 1 2H MET 91 9.400 -3.083 10.973 719 HA MET 1 HA MET 91 7.852 -2.414 12.260 720 1HB MET 1 1HB MET 91 6.060 -1.829 9.837 721 2HB MET 1 2HB MET 91 5.692 -1.393 11.475 722 1HG MET 1 1HG MET 91 7.708 0.150 11.534 723 2HG MET 1 2HG MET 91 8.040 -0.275 9.838 724 1HE MET 1 3HE MET 91 7.641 1.775 8.448 725 2HE MET 1 2HE MET 91 6.352 2.975 8.727 726 3HE MET 1 1HE MET 91 7.653 2.763 9.940 727 H ASN 2 H ASN 92 4.931 -3.336 11.065 728 HA ASN 2 HA ASN 92 4.489 -5.911 10.996 729 1HB ASN 2 1HB ASN 92 4.094 -7.131 13.018 730 2HB ASN 2 2HB ASN 92 5.741 -6.633 12.911 731 1HD2 ASN 2 1HD2 ASN 92 3.600 -5.425 16.146 732 2HD2 ASN 2 2HD2 ASN 92 2.829 -6.180 14.660 733 H LYS 3 H LYS 93 3.484 -3.243 12.797 734 HA LYS 3 HA LYS 93 1.212 -2.263 11.976 735 1HB LYS 3 1HB LYS 93 0.028 -4.472 11.651 736 2HB LYS 3 2HB LYS 93 0.012 -4.735 13.380 737 1HG LYS 3 1HG LYS 93 -1.491 -2.782 13.693 738 2HG LYS 3 2HG LYS 93 -1.243 -2.228 12.048 739 1HD LYS 3 1HD LYS 93 -2.646 -4.878 12.744 740 2HD LYS 3 2HD LYS 93 -3.497 -3.357 12.658 741 1HE LYS 3 1HE LYS 93 -1.968 -4.574 10.267 742 2HE LYS 3 2HE LYS 93 -3.687 -4.786 10.573 743 1HZ LYS 3 1HZ LYS 93 -3.318 -3.043 9.010 744 2HZ LYS 3 2HZ LYS 93 -4.011 -2.425 10.355 745 H THR 4 H THR 94 2.845 -3.421 14.912 746 HA THR 4 HA THR 94 1.474 -1.509 16.641 747 HB THR 4 HB THR 94 3.556 -3.777 16.971 748 HG1 THR 4 HG1 THR 94 1.795 -4.812 17.987 749 1HG2 THR 4 3HG2 THR 94 2.070 -2.028 18.941 750 2HG2 THR 4 1HG2 THR 94 2.986 -3.554 19.357 751 3HG2 THR 4 2HG2 THR 94 3.847 -2.130 18.648 752 H GLU 5 H GLU 95 4.514 -2.046 14.921 753 HA GLU 5 HA GLU 95 5.982 0.263 16.192 754 1HB GLU 5 1HB GLU 95 6.595 -0.899 13.450 755 2HB GLU 5 2HB GLU 95 7.627 0.122 14.419 756 1HG GLU 5 1HG GLU 95 6.895 -2.822 14.929 757 2HG GLU 5 2HG GLU 95 8.425 -2.212 14.359 758 HE2 GLU 5 HE2 GLU 95 7.566 -2.286 18.279 759 H LEU 6 H LEU 96 3.451 -0.246 14.022 760 HA LEU 6 HA LEU 96 3.371 2.306 12.503 761 1HB LEU 6 2HB LEU 96 2.039 -0.242 12.374 762 2HB LEU 6 1HB LEU 96 0.790 0.777 13.031 763 HG LEU 6 HG LEU 96 2.231 1.357 10.438 764 1HD1 LEU 6 2HD1 LEU 96 0.779 -0.645 10.251 765 2HD1 LEU 6 3HD1 LEU 96 -0.588 0.273 10.921 766 3HD1 LEU 6 1HD1 LEU 96 0.103 0.717 9.342 767 1HD2 LEU 6 1HD2 LEU 96 0.373 3.056 12.043 768 2HD2 LEU 6 2HD2 LEU 96 1.690 3.490 10.957 769 3HD2 LEU 6 3HD2 LEU 96 0.122 2.965 10.290 770 H ILE 7 H ILE 97 1.707 0.906 15.400 771 HA ILE 7 HA ILE 97 0.109 3.217 16.110 772 HB ILE 7 HB ILE 97 1.190 1.074 18.040 773 1HG1 ILE 7 1HG1 ILE 97 -1.522 1.025 16.604 774 2HG1 ILE 7 2HG1 ILE 97 -0.153 0.228 15.939 775 1HG2 ILE 7 2HG2 ILE 97 0.177 3.057 19.265 776 2HG2 ILE 7 3HG2 ILE 97 -1.318 2.821 18.356 777 3HG2 ILE 7 1HG2 ILE 97 -0.773 1.586 19.498 778 1HD1 ILE 7 3HD1 ILE 97 0.098 -1.134 18.122 779 2HD1 ILE 7 1HD1 ILE 97 -1.534 -0.602 18.495 780 3HD1 ILE 7 2HD1 ILE 97 -1.225 -1.516 16.992 781 H ASN 8 H ASN 98 3.291 2.207 17.329 782 HA ASN 8 HA ASN 98 3.684 4.675 18.919 783 1HB ASN 8 1HB ASN 98 5.891 2.759 17.839 784 2HB ASN 8 2HB ASN 98 6.141 3.982 19.062 785 1HD2 ASN 8 2HD2 ASN 98 4.916 0.365 20.343 786 2HD2 ASN 8 1HD2 ASN 98 5.395 0.730 18.610 787 H ALA 9 H ALA 99 3.987 4.230 15.512 788 HA ALA 9 HA ALA 99 5.814 6.570 15.021 789 1HB ALA 9 2HB ALA 99 5.247 4.666 13.187 790 2HB ALA 9 3HB ALA 99 3.614 5.333 13.135 791 3HB ALA 9 1HB ALA 99 4.919 6.355 12.628 792 H VAL 10 H VAL 100 2.277 5.927 15.079 793 HA VAL 10 HA VAL 100 1.614 8.493 14.118 794 HB VAL 10 HB VAL 100 -0.434 6.802 15.573 795 1HG1 VAL 10 3HG2 VAL 100 -0.832 9.077 14.219 796 2HG1 VAL 10 1HG2 VAL 100 -0.950 7.927 12.851 797 3HG1 VAL 10 2HG2 VAL 100 -2.014 7.725 14.252 798 1HG2 VAL 10 1HG1 VAL 100 0.987 6.086 13.006 799 2HG2 VAL 10 2HG1 VAL 100 0.627 5.165 14.506 800 3HG2 VAL 10 3HG1 VAL 100 -0.706 5.502 13.358 801 H ALA 11 H ALA 101 1.301 6.917 17.122 802 HA ALA 11 HA ALA 101 0.521 9.292 18.438 803 1HB ALA 11 2HB ALA 101 0.024 6.975 19.365 804 2HB ALA 11 3HB ALA 101 1.759 6.711 19.669 805 3HB ALA 11 1HB ALA 101 0.848 7.924 20.628 806 H GLU 12 H GLU 102 3.747 8.264 17.641 807 HA GLU 12 HA GLU 102 4.974 10.280 19.505 808 1HB GLU 12 1HB GLU 102 6.239 8.155 18.967 809 2HB GLU 12 2HB GLU 102 6.314 8.631 17.279 810 1HG GLU 12 1HG GLU 102 8.453 9.084 18.282 811 2HG GLU 12 2HG GLU 102 7.732 10.635 17.903 812 HE2 GLU 12 HE2 GLU 102 7.584 11.736 21.174 813 H THR 13 H THR 103 4.398 10.019 15.923 814 HA THR 13 HA THR 103 5.117 12.957 15.776 815 HB THR 13 HB THR 103 6.009 11.013 14.312 816 HG1 THR 13 HG1 THR 103 6.537 12.607 12.794 817 1HG2 THR 13 2HG2 THR 103 3.997 10.278 13.169 818 2HG2 THR 13 3HG2 THR 103 3.767 11.901 12.461 819 3HG2 THR 13 1HG2 THR 103 5.194 10.920 12.028 820 H SER 14 H SER 104 2.552 11.819 16.559 821 HA SER 14 HA SER 104 0.940 14.256 15.537 822 1HB SER 14 1HB SER 104 0.084 12.141 14.419 823 2HB SER 14 2HB SER 104 -0.399 11.523 16.004 824 HG SER 14 HG SER 104 -1.261 13.946 14.828 825 H GLY 15 H GLY 105 1.520 12.153 18.393 826 1HA GLY 15 1HA GLY 105 0.952 12.473 20.660 827 2HA GLY 15 2HA GLY 105 0.693 14.178 20.304 828 H LEU 16 H LEU 106 -0.876 11.145 19.517 829 HA LEU 16 HA LEU 106 -3.562 11.969 20.648 830 1HB LEU 16 1HB LEU 106 -4.578 10.404 19.143 831 2HB LEU 16 2HB LEU 106 -3.878 11.840 18.423 832 HG LEU 16 HG LEU 106 -2.047 10.754 17.590 833 1HD1 LEU 16 2HD1 LEU 106 -1.534 9.133 19.473 834 2HD1 LEU 16 3HD1 LEU 106 -2.880 8.143 18.822 835 3HD1 LEU 16 1HD1 LEU 106 -1.370 8.451 17.853 836 1HD2 LEU 16 2HD2 LEU 106 -3.469 10.676 15.964 837 2HD2 LEU 16 3HD2 LEU 106 -2.178 9.448 15.956 838 3HD2 LEU 16 1HD2 LEU 106 -3.807 8.954 16.374 839 H SER 17 H SER 107 -3.552 9.027 20.431 840 HA SER 17 HA SER 107 -2.402 8.227 23.152 841 1HB SER 17 1HB SER 107 -5.193 7.272 22.392 842 2HB SER 17 2HB SER 107 -4.285 6.905 23.837 843 HG SER 17 HG SER 107 -5.134 9.490 23.059 844 H LYS 18 H LYS 108 -2.026 5.970 23.368 845 HA LYS 18 HA LYS 108 -1.032 4.577 20.887 846 1HB LYS 18 1HB LYS 108 -1.279 3.429 23.727 847 2HB LYS 18 2HB LYS 108 -0.545 2.604 22.366 848 1HG LYS 18 1HG LYS 108 0.486 5.251 23.566 849 2HG LYS 18 2HG LYS 108 1.089 3.659 23.980 850 1HD LYS 18 1HD LYS 108 1.971 3.284 21.689 851 2HD LYS 18 2HD LYS 108 1.194 4.739 21.097 852 1HE LYS 18 1HE LYS 108 3.525 5.259 21.365 853 2HE LYS 18 2HE LYS 108 2.634 6.187 22.565 854 1HZ LYS 18 1HZ LYS 108 4.083 3.644 23.093 855 2HZ LYS 18 2HZ LYS 108 3.262 4.499 24.219 856 H LYS 19 H LYS 109 -3.801 4.167 23.056 857 HA LYS 19 HA LYS 109 -5.230 2.142 21.463 858 1HB LYS 19 2HB LYS 109 -5.768 2.752 23.873 859 2HB LYS 19 1HB LYS 109 -6.435 4.293 23.323 860 1HG LYS 19 1HG LYS 109 -8.139 2.927 21.912 861 2HG LYS 19 2HG LYS 109 -7.441 1.466 22.586 862 1HD LYS 19 1HD LYS 109 -9.429 1.909 23.850 863 2HD LYS 19 2HD LYS 109 -8.078 2.228 24.913 864 1HE LYS 19 1HE LYS 109 -9.749 3.949 25.288 865 2HE LYS 19 2HE LYS 109 -8.368 4.737 24.536 866 1HZ LYS 19 1HZ LYS 109 -10.836 3.877 23.118 867 2HZ LYS 19 2HZ LYS 109 -9.560 4.607 22.403 868 H ASP 20 H ASP 110 -5.171 5.795 21.216 869 HA ASP 20 HA ASP 110 -7.258 5.789 19.041 870 1HB ASP 20 1HB ASP 110 -5.439 7.995 20.173 871 2HB ASP 20 2HB ASP 110 -6.240 8.247 18.647 872 HD2 ASP 20 HD2 ASP 110 -8.346 8.377 22.052 873 H ALA 21 H ALA 111 -3.759 5.538 19.076 874 HA ALA 21 HA ALA 111 -3.405 5.891 16.138 875 1HB ALA 21 1HB ALA 111 -1.521 5.009 18.407 876 2HB ALA 21 2HB ALA 111 -1.047 5.004 16.683 877 3HB ALA 21 3HB ALA 111 -1.533 6.481 17.465 878 H THR 22 H THR 112 -3.700 3.003 18.310 879 HA THR 22 HA THR 112 -3.533 0.963 16.274 880 HB THR 22 HB THR 112 -5.359 0.802 18.767 881 HG1 THR 22 HG1 THR 112 -3.380 1.683 19.384 882 1HG2 THR 22 2HG2 THR 112 -3.522 -1.193 17.315 883 2HG2 THR 22 3HG2 THR 112 -4.400 -1.534 18.834 884 3HG2 THR 22 1HG2 THR 112 -5.305 -1.204 17.313 885 H LYS 23 H LYS 113 -6.327 2.632 17.514 886 HA LYS 23 HA LYS 113 -8.406 1.524 15.772 887 1HB LYS 23 2HB LYS 113 -7.934 4.316 17.105 888 2HB LYS 23 1HB LYS 113 -9.400 4.040 16.268 889 1HG LYS 23 1HG LYS 113 -8.725 2.087 18.545 890 2HG LYS 23 2HG LYS 113 -9.239 3.716 18.919 891 1HD LYS 23 1HD LYS 113 -11.173 2.306 19.017 892 2HD LYS 23 2HD LYS 113 -11.371 3.442 17.689 893 1HE LYS 23 1HE LYS 113 -10.775 1.620 16.024 894 2HE LYS 23 2HE LYS 113 -10.514 0.479 17.354 895 1HZ LYS 23 1HZ LYS 113 -12.827 0.739 17.972 896 2HZ LYS 23 2HZ LYS 113 -12.694 0.237 16.422 897 H ALA 24 H ALA 114 -6.603 4.491 15.465 898 HA ALA 24 HA ALA 114 -7.610 5.404 12.952 899 1HB ALA 24 3HB ALA 114 -4.971 5.964 14.367 900 2HB ALA 24 1HB ALA 114 -5.617 6.918 12.992 901 3HB ALA 24 2HB ALA 114 -6.531 6.841 14.523 902 H VAL 25 H VAL 115 -4.811 3.293 13.506 903 HA VAL 25 HA VAL 115 -4.059 2.841 10.636 904 HB VAL 25 HB VAL 115 -3.837 1.528 13.524 905 1HG1 VAL 25 2HG2 VAL 115 -2.943 -0.013 11.027 906 2HG1 VAL 25 3HG2 VAL 115 -2.473 -0.382 12.726 907 3HG1 VAL 25 1HG2 VAL 115 -4.152 -0.510 12.221 908 1HG2 VAL 25 3HG1 VAL 115 -1.730 2.423 11.525 909 2HG2 VAL 25 1HG1 VAL 115 -2.280 3.342 12.946 910 3HG2 VAL 25 2HG1 VAL 115 -1.416 1.813 13.192 911 H ASP 26 H ASP 116 -6.119 0.860 12.895 912 HA ASP 26 HA ASP 116 -7.478 -0.427 10.524 913 1HB ASP 26 1HB ASP 116 -7.025 -1.471 12.868 914 2HB ASP 26 2HB ASP 116 -8.338 -0.462 13.481 915 HD2 ASP 26 HD2 ASP 116 -10.721 -2.768 12.604 916 H ALA 27 H ALA 117 -7.618 2.331 11.002 917 HA ALA 27 HA ALA 117 -10.494 2.959 10.227 918 1HB ALA 27 2HB ALA 117 -9.549 4.298 12.175 919 2HB ALA 27 3HB ALA 117 -8.411 4.990 11.007 920 3HB ALA 27 1HB ALA 117 -10.121 5.168 10.738 921 H VAL 28 H VAL 118 -7.181 3.745 9.331 922 HA VAL 28 HA VAL 118 -7.731 4.583 6.552 923 HB VAL 28 HB VAL 118 -5.036 3.342 7.529 924 1HG1 VAL 28 1HG2 VAL 118 -5.975 4.786 5.085 925 2HG1 VAL 28 2HG2 VAL 118 -4.408 5.311 5.728 926 3HG1 VAL 28 3HG2 VAL 118 -4.641 3.600 5.382 927 1HG2 VAL 28 3HG1 VAL 118 -6.031 6.102 8.060 928 2HG2 VAL 28 1HG1 VAL 118 -5.100 4.904 9.046 929 3HG2 VAL 28 2HG1 VAL 118 -4.271 5.763 7.763 930 H PHE 29 H PHE 119 -6.176 1.791 7.876 931 HA PHE 29 HA PHE 119 -6.326 0.040 5.517 932 1HB PHE 29 2HB PHE 119 -5.469 -0.908 8.224 933 2HB PHE 29 1HB PHE 119 -5.194 -1.678 6.649 934 HD1 PHE 29 HD2 PHE 119 -4.129 -0.038 4.749 935 HD2 PHE 29 HD1 PHE 119 -3.649 0.495 8.984 936 HE1 PHE 29 HE2 PHE 119 -2.304 1.528 4.338 937 HE2 PHE 29 HE1 PHE 119 -1.871 2.117 8.566 938 HZ PHE 29 HZ PHE 119 -1.232 2.664 6.209 939 H ASP 30 H ASP 120 -8.742 0.547 7.957 940 HA ASP 30 HA ASP 120 -10.220 -1.940 7.155 941 1HB ASP 30 1HB ASP 120 -10.268 -0.621 9.457 942 2HB ASP 30 2HB ASP 120 -11.439 0.426 8.711 943 HD2 ASP 30 HD2 ASP 120 -12.459 -3.196 10.049 944 H SER 31 H SER 121 -10.156 1.404 6.403 945 HA SER 31 HA SER 121 -12.710 1.478 4.778 946 1HB SER 31 2HB SER 121 -10.610 3.683 5.150 947 2HB SER 31 1HB SER 121 -12.109 3.834 4.205 948 HG SER 31 HG SER 121 -11.938 3.136 6.942 949 H ILE 32 H ILE 122 -9.107 1.262 4.023 950 HA ILE 32 HA ILE 122 -9.392 1.201 1.185 951 HB ILE 32 HB ILE 122 -7.540 -0.715 2.508 952 1HG1 ILE 32 1HG1 ILE 122 -7.240 0.792 3.965 953 2HG1 ILE 32 2HG1 ILE 122 -5.803 0.213 3.084 954 1HG2 ILE 32 2HG2 ILE 122 -7.812 -0.187 -0.048 955 2HG2 ILE 32 3HG2 ILE 122 -6.734 1.184 0.338 956 3HG2 ILE 32 1HG2 ILE 122 -6.199 -0.506 0.609 957 1HD1 ILE 32 1HD1 ILE 122 -5.409 2.557 2.271 958 2HD1 ILE 32 2HD1 ILE 122 -6.737 3.089 3.399 959 3HD1 ILE 32 3HD1 ILE 122 -5.314 2.242 3.992 960 H THR 33 H THR 123 -9.423 -1.488 3.584 961 HA THR 33 HA THR 123 -9.960 -3.576 1.572 962 HB THR 33 HB THR 123 -9.086 -4.289 3.588 963 HG1 THR 33 HG1 THR 123 -11.618 -5.425 3.137 964 1HG2 THR 33 2HG2 THR 123 -10.247 -2.957 5.307 965 2HG2 THR 33 3HG2 THR 123 -11.780 -3.812 5.003 966 3HG2 THR 33 1HG2 THR 123 -10.377 -4.686 5.691 967 H GLU 34 H GLU 124 -12.163 -1.373 2.940 968 HA GLU 34 HA GLU 124 -14.547 -2.851 1.800 969 1HB GLU 34 1HB GLU 124 -14.792 -1.511 4.035 970 2HB GLU 34 2HB GLU 124 -14.520 -0.044 3.119 971 1HG GLU 34 1HG GLU 124 -16.885 -0.248 3.490 972 2HG GLU 34 2HG GLU 124 -16.644 -0.506 1.776 973 HE1 GLU 34 HE2 GLU 124 -17.722 -3.809 1.790 974 H ALA 35 H ALA 125 -12.207 -0.462 0.844 975 HA ALA 35 HA ALA 125 -13.745 0.345 -1.573 976 1HB ALA 35 1HB ALA 125 -11.774 1.940 -0.723 977 2HB ALA 35 2HB ALA 125 -10.671 0.622 -1.120 978 3HB ALA 35 3HB ALA 125 -11.532 1.425 -2.400 979 H LEU 36 H LEU 126 -10.656 -1.699 -1.157 980 HA LEU 36 HA LEU 126 -10.779 -2.726 -3.813 981 1HB LEU 36 2HB LEU 126 -9.564 -3.836 -1.331 982 2HB LEU 36 1HB LEU 126 -9.015 -4.154 -2.975 983 HG LEU 36 HG LEU 126 -8.893 -1.362 -1.693 984 1HD1 LEU 36 3HD1 LEU 126 -6.803 -2.674 -1.299 985 2HD1 LEU 36 1HD1 LEU 126 -6.526 -2.421 -3.094 986 3HD1 LEU 36 2HD1 LEU 126 -6.723 -1.018 -1.987 987 1HD2 LEU 36 2HD2 LEU 126 -8.752 -1.480 -4.500 988 2HD2 LEU 36 3HD2 LEU 126 -9.778 -0.537 -3.405 989 3HD2 LEU 36 1HD2 LEU 126 -8.072 -0.178 -3.503 990 NH1 ARG 37 NH2 ARG 127 -13.837 -9.912 3.378 991 NH2 ARG 37 NH1 ARG 127 -15.312 -11.373 2.459 992 H ARG 37 H ARG 127 -12.117 -4.124 -0.714 993 HA ARG 37 HA ARG 127 -12.805 -6.537 -2.037 994 1HB ARG 37 1HB ARG 127 -12.702 -6.304 0.483 995 2HB ARG 37 2HB ARG 127 -14.236 -5.422 0.450 996 1HG ARG 37 1HG ARG 127 -15.283 -7.579 -0.599 997 2HG ARG 37 2HG ARG 127 -13.717 -8.340 -0.330 998 1HD ARG 37 1HD ARG 127 -13.985 -7.599 2.185 999 2HD ARG 37 2HD ARG 127 -15.637 -7.149 1.768 1000 1HH1 ARG 37 2HH2 ARG 127 -13.452 -8.961 3.387 1001 2HH1 ARG 37 1HH2 ARG 127 -13.554 -10.696 3.977 1002 1HH2 ARG 37 1HH1 ARG 127 -16.053 -11.541 1.770 1003 2HH2 ARG 37 2HH1 ARG 127 -14.924 -12.053 3.123 1004 H LYS 38 H LYS 128 -14.444 -3.346 -2.069 1005 HA LYS 38 HA LYS 128 -17.092 -4.620 -2.925 1006 1HB LYS 38 1HB LYS 128 -16.959 -2.989 -0.925 1007 2HB LYS 38 2HB LYS 128 -16.608 -1.715 -2.090 1008 1HG LYS 38 1HG LYS 128 -18.886 -2.045 -3.120 1009 2HG LYS 38 2HG LYS 128 -19.151 -3.455 -2.105 1010 1HD LYS 38 1HD LYS 128 -20.374 -1.617 -1.154 1011 2HD LYS 38 2HD LYS 128 -19.073 -2.021 -0.043 1012 1HE LYS 38 1HE LYS 128 -17.721 -0.032 -0.928 1013 2HE LYS 38 2HE LYS 128 -19.041 0.352 -2.042 1014 1HZ LYS 38 1HZ LYS 128 -19.130 1.648 -0.018 1015 2HZ LYS 38 2HZ LYS 128 -19.214 0.312 0.921 1016 H GLY 39 H GLY 129 -14.475 -3.929 -4.629 1017 1HA GLY 39 1HA GLY 129 -14.071 -3.224 -6.905 1018 2HA GLY 39 2HA GLY 129 -15.805 -3.158 -7.162 1019 H ASP 40 H ASP 130 -13.743 -1.410 -4.906 1020 HA ASP 40 HA ASP 130 -14.367 1.319 -6.130 1021 1HB ASP 40 1HB ASP 130 -14.817 0.393 -3.296 1022 2HB ASP 40 2HB ASP 130 -14.524 2.089 -3.639 1023 HD1 ASP 40 HD2 ASP 130 -17.605 2.634 -5.129 1024 H LYS 41 H LYS 131 -13.075 2.911 -5.989 1025 HA LYS 41 HA LYS 131 -10.135 2.250 -5.725 1026 1HB LYS 41 2HB LYS 131 -11.350 4.960 -6.501 1027 2HB LYS 41 1HB LYS 131 -9.672 4.468 -6.697 1028 1HG LYS 41 1HG LYS 131 -10.438 2.727 -8.416 1029 2HG LYS 41 2HG LYS 131 -12.083 3.341 -8.253 1030 1HD LYS 41 1HD LYS 131 -11.268 5.657 -8.945 1031 2HD LYS 41 2HD LYS 131 -9.643 4.997 -9.162 1032 1HE LYS 41 1HE LYS 131 -10.574 3.375 -10.922 1033 2HE LYS 41 2HE LYS 131 -12.172 4.104 -10.718 1034 1HZ LYS 41 1HZ LYS 131 -9.719 5.507 -11.625 1035 2HZ LYS 41 2HZ LYS 131 -10.969 5.046 -12.572 1036 H VAL 42 H VAL 132 -8.851 3.025 -3.961 1037 HA VAL 42 HA VAL 132 -9.921 4.513 -1.764 1038 HB VAL 42 HB VAL 132 -7.163 3.523 -2.577 1039 1HG1 VAL 42 3HG2 VAL 132 -7.236 4.963 -0.555 1040 2HG1 VAL 42 1HG2 VAL 132 -8.487 3.879 0.141 1041 3HG1 VAL 42 2HG2 VAL 132 -6.821 3.269 -0.172 1042 1HG2 VAL 42 3HG1 VAL 132 -9.052 1.572 -2.444 1043 2HG2 VAL 42 1HG1 VAL 132 -7.591 1.385 -1.516 1044 3HG2 VAL 42 2HG1 VAL 132 -9.056 1.923 -0.713 1045 H GLN 43 H GLN 133 -7.159 5.626 -2.130 1046 HA GLN 43 HA GLN 133 -6.207 7.006 -3.815 1047 1HB GLN 43 1HB GLN 133 -8.531 8.882 -3.851 1048 2HB GLN 43 2HB GLN 133 -6.929 9.398 -4.363 1049 1HG GLN 43 1HG GLN 133 -6.782 7.374 -5.898 1050 2HG GLN 43 2HG GLN 133 -8.417 6.959 -5.528 1051 1HE2 GLN 43 2HE2 GLN 133 -8.463 8.892 -8.723 1052 2HE2 GLN 43 1HE2 GLN 133 -7.636 7.390 -8.075 1053 H LEU 44 H LEU 134 -4.262 7.485 -2.904 1054 HA LEU 44 HA LEU 134 -4.236 9.958 -1.179 1055 1HB LEU 44 2HB LEU 134 -2.100 7.760 -1.182 1056 2HB LEU 44 1HB LEU 134 -2.110 9.239 -0.243 1057 HG LEU 44 HG LEU 134 -4.433 8.244 0.642 1058 1HD1 LEU 44 1HD1 LEU 134 -4.535 6.161 -0.746 1059 2HD1 LEU 44 2HD1 LEU 134 -3.005 5.604 -0.027 1060 3HD1 LEU 44 3HD1 LEU 134 -4.458 5.792 0.979 1061 1HD2 LEU 44 1HD2 LEU 134 -1.614 7.254 1.532 1062 2HD2 LEU 44 2HD2 LEU 134 -2.437 8.725 2.104 1063 3HD2 LEU 44 3HD2 LEU 134 -3.065 7.125 2.538 1064 H ILE 45 H ILE 135 -3.575 11.672 -2.335 1065 HA ILE 45 HA ILE 135 -2.000 11.226 -4.797 1066 HB ILE 45 HB ILE 135 -4.104 12.605 -4.760 1067 1HG1 ILE 45 1HG1 ILE 135 -1.748 14.110 -6.030 1068 2HG1 ILE 45 2HG1 ILE 135 -2.408 12.613 -6.669 1069 1HG2 ILE 45 3HG2 ILE 135 -3.632 13.931 -2.692 1070 2HG2 ILE 45 1HG2 ILE 135 -2.345 14.820 -3.545 1071 3HG2 ILE 45 2HG2 ILE 135 -4.048 14.979 -4.063 1072 1HD1 ILE 45 2HD1 ILE 135 -4.672 13.702 -6.983 1073 2HD1 ILE 45 3HD1 ILE 135 -3.991 15.248 -6.408 1074 3HD1 ILE 45 1HD1 ILE 135 -3.376 14.504 -7.901 1075 H GLY 46 H GLY 136 -1.140 12.130 -2.046 1076 1HA GLY 46 1HA GLY 136 1.639 13.260 -2.877 1077 2HA GLY 46 2HA GLY 136 1.023 13.440 -1.252 1078 H PHE 47 H PHE 137 0.226 10.281 -2.111 1079 HA PHE 47 HA PHE 137 2.890 9.053 -1.398 1080 1HB PHE 47 2HB PHE 137 1.418 9.768 0.589 1081 2HB PHE 47 1HB PHE 137 0.224 8.594 0.137 1082 HD1 PHE 47 HD1 PHE 137 3.772 8.917 1.362 1083 HD2 PHE 47 HD2 PHE 137 0.621 6.152 0.371 1084 HE1 PHE 47 HE1 PHE 137 5.134 7.018 2.163 1085 HE2 PHE 47 HE2 PHE 137 2.044 4.292 1.096 1086 HZ PHE 47 HZ PHE 137 4.362 4.731 1.865 1087 H GLY 48 H GLY 138 -0.529 8.251 -2.392 1088 1HA GLY 48 1HA GLY 138 0.280 6.151 -4.025 1089 2HA GLY 48 2HA GLY 138 0.022 5.361 -2.505 1090 H ASN 49 H ASN 139 -1.296 5.800 -5.374 1091 HA ASN 49 HA ASN 139 -4.217 6.074 -4.472 1092 1HB ASN 49 1HB ASN 139 -3.150 6.034 -7.351 1093 2HB ASN 49 2HB ASN 139 -4.809 6.265 -6.868 1094 1HD2 ASN 49 1HD2 ASN 139 -4.295 9.786 -6.086 1095 2HD2 ASN 49 2HD2 ASN 139 -5.313 8.317 -5.675 1096 H PHE 50 H PHE 140 -4.999 4.109 -3.799 1097 HA PHE 50 HA PHE 140 -4.019 1.531 -5.085 1098 1HB PHE 50 2HB PHE 140 -6.122 1.762 -2.901 1099 2HB PHE 50 1HB PHE 140 -5.558 0.281 -3.485 1100 HD1 PHE 50 HD1 PHE 140 -4.724 3.350 -1.645 1101 HD2 PHE 50 HD2 PHE 140 -4.217 -0.875 -1.995 1102 HE1 PHE 50 HE1 PHE 140 -3.569 3.294 0.580 1103 HE2 PHE 50 HE2 PHE 140 -3.111 -0.901 0.241 1104 HZ PHE 50 HZ PHE 140 -2.642 1.219 1.360 1105 H GLU 51 H GLU 141 -5.442 0.071 -5.971 1106 HA GLU 51 HA GLU 141 -8.186 0.199 -5.833 1107 1HB GLU 51 1HB GLU 141 -9.046 0.809 -8.179 1108 2HB GLU 51 2HB GLU 141 -8.281 2.180 -7.429 1109 1HG GLU 51 1HG GLU 141 -6.166 1.773 -8.771 1110 2HG GLU 51 2HG GLU 141 -6.915 0.377 -9.538 1111 HE1 GLU 51 HE2 GLU 141 -8.918 2.182 -11.696 1112 H VAL 52 H VAL 142 -9.521 -1.395 -7.204 1113 HA VAL 52 HA VAL 142 -7.831 -3.779 -7.283 1114 HB VAL 52 HB VAL 142 -10.294 -2.921 -6.082 1115 1HG1 VAL 52 1HG2 VAL 142 -11.031 -4.632 -8.468 1116 2HG1 VAL 52 2HG2 VAL 142 -12.031 -4.355 -6.999 1117 3HG1 VAL 52 3HG2 VAL 142 -11.556 -2.989 -8.069 1118 1HG2 VAL 52 1HG1 VAL 142 -9.157 -5.705 -6.396 1119 2HG2 VAL 52 2HG1 VAL 142 -8.853 -4.502 -5.120 1120 3HG2 VAL 52 3HG1 VAL 142 -10.459 -5.211 -5.300 1121 NH1 ARG 53 NH2 ARG 143 -2.770 -6.671 -14.200 1122 NH2 ARG 53 NH1 ARG 143 -3.391 -8.632 -13.232 1123 H ARG 53 H ARG 143 -8.120 -5.403 -8.915 1124 HA ARG 53 HA ARG 143 -8.975 -4.360 -11.699 1125 1HB ARG 53 1HB ARG 143 -6.408 -4.366 -11.312 1126 2HB ARG 53 2HB ARG 143 -6.518 -6.109 -11.185 1127 1HG ARG 53 1HG ARG 143 -7.560 -6.177 -13.547 1128 2HG ARG 53 2HG ARG 143 -7.286 -4.445 -13.645 1129 1HD ARG 53 1HD ARG 143 -5.463 -5.500 -14.805 1130 2HD ARG 53 2HD ARG 143 -4.784 -4.837 -13.316 1131 1HH1 ARG 53 2HH2 ARG 143 -3.040 -5.723 -14.483 1132 2HH1 ARG 53 1HH2 ARG 143 -1.853 -7.114 -14.329 1133 1HH2 ARG 53 1HH1 ARG 143 -4.129 -9.178 -12.774 1134 2HH2 ARG 53 2HH1 ARG 143 -2.431 -8.937 -13.426 1135 H GLU 54 H GLU 144 -10.889 -5.464 -11.833 1136 HA GLU 54 HA GLU 144 -11.331 -8.221 -10.976 1137 1HB GLU 54 1HB GLU 144 -13.449 -8.214 -12.135 1138 2HB GLU 54 2HB GLU 144 -13.212 -6.838 -11.081 1139 1HG GLU 54 1HG GLU 144 -12.750 -5.357 -13.099 1140 2HG GLU 54 2HG GLU 144 -13.005 -6.740 -14.161 1141 HE1 GLU 54 HE2 GLU 144 -16.093 -4.843 -12.364 1142 NH1 ARG 55 NH2 ARG 145 -3.478 -12.336 -11.333 1143 NH2 ARG 55 NH1 ARG 145 -4.875 -13.433 -9.914 1144 H ARG 55 H ARG 145 -10.561 -10.014 -11.757 1145 HA ARG 55 HA ARG 145 -9.379 -10.093 -14.592 1146 1HB ARG 55 1HB ARG 145 -7.834 -9.978 -12.548 1147 2HB ARG 55 2HB ARG 145 -8.469 -11.533 -12.019 1148 1HG ARG 55 1HG ARG 145 -7.471 -12.661 -13.993 1149 2HG ARG 55 2HG ARG 145 -7.033 -11.111 -14.701 1150 1HD ARG 55 1HD ARG 145 -5.041 -12.102 -13.722 1151 2HD ARG 55 2HD ARG 145 -5.446 -10.642 -12.817 1152 1HH1 ARG 55 2HH2 ARG 145 -3.375 -11.790 -12.196 1153 2HH1 ARG 55 1HH2 ARG 145 -2.730 -12.607 -10.684 1154 1HH2 ARG 55 1HH1 ARG 145 -5.834 -13.726 -9.695 1155 2HH2 ARG 55 2HH1 ARG 145 -4.032 -13.628 -9.364 1156 H ALA 56 H ALA 146 -9.266 -12.173 -15.577 1157 HA ALA 56 HA ALA 146 -11.799 -13.723 -15.469 1158 1HB ALA 56 3HB ALA 146 -10.637 -13.299 -17.635 1159 2HB ALA 56 1HB ALA 146 -9.220 -14.240 -17.102 1160 3HB ALA 56 2HB ALA 146 -10.789 -15.042 -17.347 1161 H ALA 57 H ALA 147 -12.157 -15.625 -14.566 1162 HA ALA 57 HA ALA 147 -10.966 -16.734 -12.421 1163 1HB ALA 57 1HB ALA 147 -13.202 -17.485 -13.318 1164 2HB ALA 57 2HB ALA 147 -12.392 -18.459 -14.571 1165 3HB ALA 57 3HB ALA 147 -12.229 -18.891 -12.854 1166 NH1 ARG 58 NH2 ARG 148 -4.589 -14.839 -14.966 1167 NH2 ARG 58 NH1 ARG 148 -2.756 -15.634 -13.880 1168 H ARG 58 H ARG 148 -9.590 -17.911 -11.593 1169 HA ARG 58 HA ARG 148 -7.337 -18.686 -13.370 1170 1HB ARG 58 2HB ARG 148 -7.161 -18.274 -10.350 1171 2HB ARG 58 1HB ARG 148 -5.807 -18.384 -11.453 1172 1HG ARG 58 1HG ARG 148 -7.837 -16.083 -11.329 1173 2HG ARG 58 2HG ARG 148 -6.236 -16.065 -10.641 1174 1HD ARG 58 1HD ARG 148 -6.749 -16.414 -13.680 1175 2HD ARG 58 2HD ARG 148 -6.579 -14.851 -12.898 1176 1HH1 ARG 58 2HH2 ARG 148 -5.610 -14.740 -14.981 1177 2HH1 ARG 58 1HH2 ARG 148 -3.927 -14.491 -15.670 1178 1HH2 ARG 58 1HH1 ARG 148 -2.379 -16.138 -13.070 1179 2HH2 ARG 58 2HH1 ARG 148 -2.221 -15.231 -14.657 1180 H LYS 59 H LYS 149 -5.862 -20.306 -11.841 1181 HA LYS 59 HA LYS 149 -7.334 -22.666 -10.825 1182 1HB LYS 59 1HB LYS 149 -6.431 -24.408 -12.286 1183 2HB LYS 59 2HB LYS 149 -7.606 -23.376 -13.067 1184 1HG LYS 59 1HG LYS 149 -5.755 -22.147 -14.275 1185 2HG LYS 59 2HG LYS 149 -4.556 -23.203 -13.548 1186 1HD LYS 59 1HD LYS 149 -6.859 -24.159 -15.369 1187 2HD LYS 59 2HD LYS 149 -5.235 -23.768 -15.921 1188 1HE LYS 59 1HE LYS 149 -4.267 -25.598 -14.440 1189 2HE LYS 59 2HE LYS 149 -5.902 -26.032 -13.918 1190 1HZ LYS 59 1HZ LYS 149 -5.177 -27.422 -15.709 1191 2HZ LYS 59 2HZ LYS 149 -6.466 -26.541 -16.196 1192 H GLY 60 H GLY 150 -6.278 -22.647 -8.959 1193 1HA GLY 60 1HA GLY 150 -3.480 -23.359 -8.690 1194 2HA GLY 60 2HA GLY 150 -3.562 -21.595 -8.600 1195 NH1 ARG 61 NH2 ARG 151 -0.477 -26.485 -1.965 1196 NH2 ARG 61 NH1 ARG 151 0.082 -25.084 -0.264 1197 H ARG 61 H ARG 151 -2.838 -21.638 -6.540 1198 HA ARG 61 HA ARG 151 -4.287 -23.189 -4.374 1199 1HB ARG 61 1HB ARG 151 -1.539 -21.802 -4.370 1200 2HB ARG 61 2HB ARG 151 -2.285 -22.447 -2.919 1201 1HG ARG 61 1HG ARG 151 -2.352 -24.752 -3.852 1202 2HG ARG 61 2HG ARG 151 -1.730 -24.183 -5.391 1203 1HD ARG 61 1HD ARG 151 0.139 -25.169 -4.267 1204 2HD ARG 61 2HD ARG 151 0.417 -23.445 -4.291 1205 1HH1 ARG 61 2HH2 ARG 151 -0.650 -26.600 -2.970 1206 2HH1 ARG 61 1HH2 ARG 151 -0.528 -27.215 -1.245 1207 1HH2 ARG 61 1HH1 ARG 151 0.332 -24.134 0.030 1208 2HH2 ARG 61 2HH1 ARG 151 -0.008 -25.910 0.337 1209 H ASN 62 H ASN 152 -4.897 -22.280 -2.488 1210 HA ASN 62 HA ASN 152 -6.289 -19.681 -2.721 1211 1HB ASN 62 1HB ASN 152 -7.228 -21.799 -1.703 1212 2HB ASN 62 2HB ASN 152 -6.104 -21.642 -0.365 1213 1HD2 ASN 62 2HD2 ASN 152 -9.588 -19.688 -0.046 1214 2HD2 ASN 62 1HD2 ASN 152 -9.201 -20.883 -1.384 1215 HA PRO 63 HA PRO 153 -2.718 -17.270 -0.954 1216 1HB PRO 63 1HB PRO 153 -5.015 -15.379 -0.206 1217 2HB PRO 63 2HB PRO 153 -3.412 -14.977 -0.855 1218 1HG PRO 63 1HG PRO 153 -5.554 -15.072 -2.525 1219 2HG PRO 63 2HG PRO 153 -4.011 -15.779 -3.060 1220 1HD PRO 63 1HD PRO 153 -6.490 -17.235 -2.032 1221 2HD PRO 63 2HD PRO 153 -5.362 -17.699 -3.335 1222 H GLN 64 H GLN 154 -5.618 -17.648 1.115 1223 HA GLN 64 HA GLN 154 -4.069 -17.233 3.658 1224 1HB GLN 64 1HB GLN 154 -6.464 -16.449 3.353 1225 2HB GLN 64 2HB GLN 154 -7.005 -18.114 3.209 1226 1HG GLN 64 1HG GLN 154 -6.330 -18.618 5.537 1227 2HG GLN 64 2HG GLN 154 -5.556 -17.051 5.685 1228 1HE2 GLN 64 2HE2 GLN 154 -9.632 -17.265 6.181 1229 2HE2 GLN 64 1HE2 GLN 154 -8.631 -18.711 5.657 1230 H THR 65 H THR 155 -6.204 -19.797 2.760 1231 HA THR 65 HA THR 155 -5.116 -21.757 4.519 1232 HB THR 65 HB THR 155 -6.845 -23.254 3.719 1233 HG1 THR 65 HG1 THR 155 -8.091 -22.724 1.952 1234 1HG2 THR 65 1HG2 THR 155 -7.597 -21.180 5.092 1235 2HG2 THR 65 2HG2 THR 155 -7.992 -20.376 3.566 1236 3HG2 THR 65 3HG2 THR 155 -8.878 -21.840 4.027 1237 H GLY 66 H GLY 156 -4.398 -21.526 1.070 1238 1HA GLY 66 1HA GLY 156 -2.744 -22.719 -0.200 1239 2HA GLY 66 2HA GLY 156 -2.269 -23.603 1.233 1240 H GLU 67 H GLU 157 -5.584 -23.604 -0.116 1241 HA GLU 67 HA GLU 157 -5.356 -26.578 -0.758 1242 1HB GLU 67 2HB GLU 157 -7.178 -25.602 0.804 1243 2HB GLU 67 1HB GLU 157 -7.913 -24.857 -0.612 1244 1HG GLU 67 1HG GLU 157 -7.412 -27.893 -0.268 1245 2HG GLU 67 2HG GLU 157 -8.881 -27.081 0.232 1246 HE2 GLU 67 HE2 GLU 157 -8.606 -28.397 -3.429 1247 H GLU 68 H GLU 158 -5.485 -27.212 -2.835 1248 HA GLU 68 HA GLU 158 -5.270 -25.080 -4.946 1249 1HB GLU 68 1HB GLU 158 -3.520 -26.872 -4.714 1250 2HB GLU 68 2HB GLU 158 -4.676 -28.069 -5.291 1251 1HG GLU 68 1HG GLU 158 -4.865 -26.820 -7.486 1252 2HG GLU 68 2HG GLU 158 -3.825 -25.540 -6.873 1253 HE1 GLU 68 HE2 GLU 158 -0.849 -27.236 -7.262 1254 H MET 69 H MET 159 -6.957 -24.493 -6.058 1255 HA MET 69 HA MET 159 -8.921 -26.379 -7.275 1256 1HB MET 69 1HB MET 159 -10.946 -25.575 -6.259 1257 2HB MET 69 2HB MET 159 -9.900 -26.096 -4.973 1258 1HG MET 69 1HG MET 159 -10.392 -23.130 -5.746 1259 2HG MET 69 2HG MET 159 -11.211 -24.007 -4.458 1260 1HE MET 69 2HE MET 159 -8.027 -22.311 -5.718 1261 2HE MET 69 1HE MET 159 -8.623 -21.229 -4.421 1262 3HE MET 69 3HE MET 159 -7.072 -22.086 -4.253 1263 H GLU 70 H GLU 160 -10.588 -25.221 -8.583 1264 HA GLU 70 HA GLU 160 -9.407 -23.022 -10.190 1265 1HB GLU 70 2HB GLU 160 -11.283 -23.144 -11.656 1266 2HB GLU 70 1HB GLU 160 -10.611 -24.750 -11.358 1267 1HG GLU 70 1HG GLU 160 -12.552 -25.233 -9.768 1268 2HG GLU 70 2HG GLU 160 -13.229 -23.648 -10.127 1269 HE1 GLU 70 HE2 GLU 160 -14.386 -24.446 -13.291 1270 H ILE 71 H ILE 161 -9.548 -20.901 -9.737 1271 HA ILE 71 HA ILE 161 -11.275 -19.944 -7.498 1272 HB ILE 71 HB ILE 161 -8.888 -18.780 -9.036 1273 1HG1 ILE 71 1HG1 ILE 161 -8.953 -19.750 -6.107 1274 2HG1 ILE 71 2HG1 ILE 161 -8.507 -20.823 -7.414 1275 1HG2 ILE 71 2HG2 ILE 161 -10.265 -16.938 -8.194 1276 2HG2 ILE 71 3HG2 ILE 161 -10.303 -17.654 -6.557 1277 3HG2 ILE 71 1HG2 ILE 161 -8.767 -17.042 -7.256 1278 1HD1 ILE 71 1HD1 ILE 161 -6.571 -19.361 -8.056 1279 2HD1 ILE 71 2HD1 ILE 161 -6.934 -18.295 -6.668 1280 3HD1 ILE 71 3HD1 ILE 161 -6.472 -19.989 -6.395 1281 HA PRO 72 HA PRO 162 -13.905 -18.062 -10.935 1282 1HB PRO 72 1HB PRO 162 -16.072 -17.246 -9.433 1283 2HB PRO 72 2HB PRO 162 -15.777 -18.919 -9.933 1284 1HG PRO 72 1HG PRO 162 -15.164 -17.648 -7.221 1285 2HG PRO 72 2HG PRO 162 -15.938 -19.217 -7.540 1286 1HD PRO 72 1HD PRO 162 -13.236 -18.959 -6.920 1287 2HD PRO 72 2HD PRO 162 -13.832 -20.273 -7.980 1288 H ALA 73 H ALA 163 -13.378 -16.027 -11.674 1289 HA ALA 73 HA ALA 163 -11.868 -14.272 -11.845 1290 1HB ALA 73 2HB ALA 163 -14.228 -13.385 -11.507 1291 2HB ALA 73 3HB ALA 163 -13.841 -13.164 -9.755 1292 3HB ALA 73 1HB ALA 163 -12.962 -12.239 -10.987 1293 H SER 74 H SER 164 -10.751 -12.436 -10.913 1294 HA SER 74 HA SER 164 -10.650 -12.359 -8.059 1295 1HB SER 74 1HB SER 164 -7.821 -12.718 -9.357 1296 2HB SER 74 2HB SER 164 -8.063 -12.222 -7.680 1297 HG SER 74 HG SER 164 -9.156 -14.180 -7.322 1298 H LYS 75 H LYS 165 -10.977 -10.412 -7.493 1299 HA LYS 75 HA LYS 165 -10.191 -7.989 -9.139 1300 1HB LYS 75 2HB LYS 165 -11.082 -7.516 -6.364 1301 2HB LYS 75 1HB LYS 165 -11.215 -6.575 -7.824 1302 1HG LYS 75 1HG LYS 165 -13.024 -8.143 -8.680 1303 2HG LYS 75 2HG LYS 165 -12.913 -9.051 -7.167 1304 1HD LYS 75 1HD LYS 165 -13.483 -6.892 -5.891 1305 2HD LYS 75 2HD LYS 165 -13.718 -6.083 -7.446 1306 1HE LYS 75 1HE LYS 165 -15.559 -7.727 -8.034 1307 2HE LYS 75 2HE LYS 165 -15.309 -8.568 -6.496 1308 1HZ LYS 75 1HZ LYS 165 -15.904 -6.546 -5.332 1309 2HZ LYS 75 2HZ LYS 165 -17.109 -7.029 -6.325 1310 H VAL 76 H VAL 166 -7.961 -7.334 -9.046 1311 HA VAL 76 HA VAL 166 -6.310 -8.597 -7.017 1312 HB VAL 76 HB VAL 166 -6.508 -8.073 -9.890 1313 1HG1 VAL 76 1HG2 VAL 166 -3.905 -7.233 -8.755 1314 2HG1 VAL 76 2HG2 VAL 166 -4.334 -7.590 -10.505 1315 3HG1 VAL 76 3HG2 VAL 166 -5.099 -6.243 -9.649 1316 1HG2 VAL 76 3HG1 VAL 166 -6.293 -10.268 -8.894 1317 2HG2 VAL 76 1HG1 VAL 166 -5.071 -9.904 -10.129 1318 3HG2 VAL 76 2HG1 VAL 166 -4.617 -9.865 -8.389 1319 HA PRO 77 HA PRO 167 -6.290 -4.280 -5.445 1320 1HB PRO 77 1HB PRO 167 -5.339 -4.795 -2.848 1321 2HB PRO 77 2HB PRO 167 -6.929 -5.371 -3.380 1322 1HG PRO 77 1HG PRO 167 -4.292 -6.938 -3.365 1323 2HG PRO 77 2HG PRO 167 -5.831 -7.437 -2.663 1324 1HD PRO 77 1HD PRO 167 -4.940 -8.170 -5.316 1325 2HD PRO 77 2HD PRO 167 -6.680 -8.015 -4.951 1326 H ALA 78 H ALA 168 -5.087 -2.962 -6.063 1327 HA ALA 78 HA ALA 168 -2.051 -3.241 -6.210 1328 1HB ALA 78 3HB ALA 168 -3.499 -3.250 -8.316 1329 2HB ALA 78 1HB ALA 168 -4.043 -1.602 -7.912 1330 3HB ALA 78 2HB ALA 168 -2.324 -1.910 -8.258 1331 H PHE 79 H PHE 169 -0.995 -1.254 -6.240 1332 HA PHE 79 HA PHE 169 -1.936 1.076 -4.427 1333 1HB PHE 79 2HB PHE 169 -1.351 -0.197 -2.760 1334 2HB PHE 79 1HB PHE 169 0.122 -0.828 -3.586 1335 HD1 PHE 79 HD1 PHE 169 2.222 0.493 -3.692 1336 HD2 PHE 79 HD2 PHE 169 -1.237 2.057 -1.669 1337 HE1 PHE 79 HE1 PHE 169 3.572 2.340 -2.802 1338 HE2 PHE 79 HE2 PHE 169 0.149 3.848 -0.714 1339 HZ PHE 79 HZ PHE 169 2.538 4.042 -1.354 1340 H LYS 80 H LYS 170 -1.324 2.466 -5.744 1341 HA LYS 80 HA LYS 170 1.107 2.692 -7.748 1342 1HB LYS 80 2HB LYS 170 -1.325 4.508 -7.471 1343 2HB LYS 80 1HB LYS 170 0.156 4.939 -8.310 1344 1HG LYS 80 1HG LYS 170 -1.260 4.261 -10.026 1345 2HG LYS 80 2HG LYS 170 -0.122 2.939 -9.849 1346 1HD LYS 80 1HD LYS 170 -1.919 1.639 -8.548 1347 2HD LYS 80 2HD LYS 170 -3.028 2.993 -8.797 1348 1HE LYS 80 1HE LYS 170 -2.861 2.677 -11.303 1349 2HE LYS 80 2HE LYS 170 -1.728 1.337 -11.063 1350 1HZ LYS 80 1HZ LYS 170 -3.465 0.187 -9.803 1351 2HZ LYS 80 2HZ LYS 170 -4.511 1.422 -10.032 1352 HA PRO 81 HA PRO 171 2.889 5.025 -4.272 1353 1HB PRO 81 1HB PRO 171 5.285 5.771 -5.394 1354 2HB PRO 81 2HB PRO 171 4.871 4.081 -5.089 1355 1HG PRO 81 1HG PRO 171 4.621 5.607 -7.742 1356 2HG PRO 81 2HG PRO 171 5.471 4.065 -7.458 1357 1HD PRO 81 1HD PRO 171 2.828 4.221 -8.378 1358 2HD PRO 81 2HD PRO 171 3.414 2.847 -7.386 1359 H GLY 82 H GLY 172 0.797 6.320 -5.711 1360 1HA GLY 82 1HA GLY 172 -0.025 8.302 -6.790 1361 2HA GLY 82 2HA GLY 172 0.715 8.954 -5.339 1362 H LYS 83 H LYS 173 2.864 7.746 -7.694 1363 HA LYS 83 HA LYS 173 4.546 8.801 -9.079 1364 1HB LYS 83 2HB LYS 173 2.386 10.877 -9.359 1365 2HB LYS 83 1HB LYS 173 3.952 11.579 -9.407 1366 1HG LYS 83 1HG LYS 173 3.316 11.103 -11.681 1367 2HG LYS 83 2HG LYS 173 4.602 9.966 -11.296 1368 1HD LYS 83 1HD LYS 173 2.859 8.156 -10.887 1369 2HD LYS 83 2HD LYS 173 1.576 9.314 -11.248 1370 1HE LYS 83 1HE LYS 173 2.503 9.602 -13.603 1371 2HE LYS 83 2HE LYS 173 3.790 8.443 -13.235 1372 1HZ LYS 83 1HZ LYS 173 0.878 7.871 -13.204 1373 2HZ LYS 83 2HZ LYS 173 1.930 7.425 -14.372 1374 H ALA 84 H ALA 174 3.390 10.768 -6.641 1375 HA ALA 84 HA ALA 174 5.547 12.512 -5.852 1376 1HB ALA 84 2HB ALA 174 3.112 12.686 -5.273 1377 2HB ALA 84 3HB ALA 174 3.193 11.159 -4.355 1378 3HB ALA 84 1HB ALA 174 4.078 12.589 -3.761 1379 H LEU 85 H LEU 175 4.619 9.255 -4.441 1380 HA LEU 85 HA LEU 175 6.928 9.159 -2.636 1381 1HB LEU 85 2HB LEU 175 4.865 7.915 -2.075 1382 2HB LEU 85 1HB LEU 175 4.973 7.006 -3.571 1383 HG LEU 85 HG LEU 175 7.270 6.311 -2.804 1384 1HD1 LEU 85 1HD1 LEU 175 7.663 7.802 -0.887 1385 2HD1 LEU 85 2HD1 LEU 175 6.241 7.151 -0.047 1386 3HD1 LEU 85 3HD1 LEU 175 7.676 6.124 -0.313 1387 1HD2 LEU 85 3HD2 LEU 175 5.257 4.755 -2.891 1388 2HD2 LEU 85 1HD2 LEU 175 6.300 4.325 -1.535 1389 3HD2 LEU 85 2HD2 LEU 175 4.796 5.237 -1.244 1390 H LYS 86 H LYS 176 6.228 8.039 -5.938 1391 HA LYS 86 HA LYS 176 8.724 6.624 -6.417 1392 1HB LYS 86 1HB LYS 176 6.654 6.648 -7.966 1393 2HB LYS 86 2HB LYS 176 7.275 8.143 -8.646 1394 1HG LYS 86 1HG LYS 176 9.423 6.937 -9.263 1395 2HG LYS 86 2HG LYS 176 8.777 5.452 -8.556 1396 1HD LYS 86 1HD LYS 176 6.870 5.491 -10.222 1397 2HD LYS 86 2HD LYS 176 7.510 6.985 -10.921 1398 1HE LYS 86 1HE LYS 176 9.666 5.770 -11.536 1399 2HE LYS 86 2HE LYS 176 9.016 4.275 -10.846 1400 1HZ LYS 86 1HZ LYS 176 7.796 5.788 -13.090 1401 2HZ LYS 86 2HZ LYS 176 7.190 4.411 -12.451 1402 H ASP 87 H ASP 177 8.173 10.115 -6.201 1403 HA ASP 87 HA ASP 177 10.860 10.838 -7.264 1404 1HB ASP 87 1HB ASP 177 8.307 12.135 -6.827 1405 2HB ASP 87 2HB ASP 177 9.274 12.770 -5.564 1406 HD1 ASP 87 HD2 ASP 177 11.323 14.664 -7.676 1407 H ALA 88 H ALA 178 9.286 10.538 -4.034 1408 HA ALA 88 HA ALA 178 11.431 11.301 -2.238 1409 1HB ALA 88 3HB ALA 178 9.034 10.566 -1.507 1410 2HB ALA 88 1HB ALA 178 9.468 8.897 -1.886 1411 3HB ALA 88 2HB ALA 178 10.316 9.714 -0.597 1412 H VAL 89 H VAL 179 10.726 8.136 -3.730 1413 HA VAL 89 HA VAL 179 12.954 6.735 -2.448 1414 HB VAL 89 HB VAL 179 10.258 6.410 -2.730 1415 1HG1 VAL 89 2HG2 VAL 179 10.516 6.599 -5.312 1416 2HG1 VAL 89 3HG2 VAL 179 11.070 4.925 -5.270 1417 3HG1 VAL 89 1HG2 VAL 179 9.458 5.372 -4.621 1418 1HG2 VAL 89 3HG1 VAL 179 12.088 4.091 -3.066 1419 2HG2 VAL 89 1HG1 VAL 179 11.588 4.949 -1.549 1420 3HG2 VAL 89 2HG1 VAL 179 10.353 4.135 -2.543 1421 H LYS 90 H LYS 180 12.822 8.370 -5.440 1422 HA LYS 90 HA LYS 180 13.865 6.589 -7.344 1423 1HB LYS 90 1HB LYS 180 13.118 9.270 -7.333 1424 2HB LYS 90 2HB LYS 180 14.832 9.502 -7.353 1425 1HG LYS 90 1HG LYS 180 14.236 9.551 -9.617 1426 2HG LYS 90 2HG LYS 180 14.858 7.910 -9.473 1427 1HD LYS 90 1HD LYS 180 12.453 7.048 -9.241 1428 2HD LYS 90 2HD LYS 180 11.877 8.707 -9.274 1429 1HE LYS 90 1HE LYS 180 11.440 7.856 -11.428 1430 2HE LYS 90 2HE LYS 180 12.755 9.015 -11.613 1431 1HZ LYS 90 1HZ LYS 180 14.312 7.152 -11.695 1432 2HZ LYS 90 2HZ LYS 180 13.179 7.017 -12.866 Start of MODEL 19 Raw file had 1432 H/Q atoms Start of MODEL 19 1 1H MET 1 1H MET 1 -10.653 7.557 2.302 2 2H MET 1 2H MET 1 -10.429 5.954 2.532 3 HA MET 1 HA MET 1 -9.157 5.758 0.541 4 1HB MET 1 1HB MET 1 -11.840 7.047 -0.060 5 2HB MET 1 2HB MET 1 -10.974 5.914 -1.055 6 1HG MET 1 1HG MET 1 -12.318 5.230 1.640 7 2HG MET 1 2HG MET 1 -12.927 4.869 0.029 8 1HE MET 1 1HE MET 1 -11.178 3.461 3.011 9 2HE MET 1 3HE MET 1 -9.893 2.389 2.383 10 3HE MET 1 2HE MET 1 -9.634 4.138 2.406 11 H ASN 2 H ASN 2 -10.008 8.041 -1.441 12 HA ASN 2 HA ASN 2 -8.540 9.652 -2.138 13 1HB ASN 2 1HB ASN 2 -10.021 11.405 -2.849 14 2HB ASN 2 2HB ASN 2 -10.461 9.751 -3.089 15 1HD2 ASN 2 1HD2 ASN 2 -12.827 11.970 -0.538 16 2HD2 ASN 2 2HD2 ASN 2 -11.202 12.575 -1.118 17 H LYS 3 H LYS 3 -8.418 9.731 0.475 18 HA LYS 3 HA LYS 3 -6.840 10.609 2.100 19 1HB LYS 3 1HB LYS 3 -5.553 11.363 -0.036 20 2HB LYS 3 2HB LYS 3 -6.136 12.975 0.308 21 1HG LYS 3 1HG LYS 3 -4.930 12.976 2.515 22 2HG LYS 3 2HG LYS 3 -4.679 11.234 2.429 23 1HD LYS 3 1HD LYS 3 -3.181 11.554 0.401 24 2HD LYS 3 2HD LYS 3 -3.316 13.305 0.610 25 1HE LYS 3 1HE LYS 3 -2.303 13.094 2.930 26 2HE LYS 3 2HE LYS 3 -2.217 11.337 2.743 27 1HZ LYS 3 1HZ LYS 3 -0.127 12.341 2.234 28 2HZ LYS 3 2HZ LYS 3 -0.723 11.629 0.888 29 H THR 4 H THR 4 -9.629 12.255 1.034 30 HA THR 4 HA THR 4 -10.011 13.573 3.586 31 HB THR 4 HB THR 4 -11.285 13.615 0.770 32 HG1 THR 4 HG1 THR 4 -10.227 15.639 0.620 33 1HG2 THR 4 3HG2 THR 4 -11.569 15.390 3.221 34 2HG2 THR 4 1HG2 THR 4 -12.247 15.755 1.567 35 3HG2 THR 4 2HG2 THR 4 -12.817 14.311 2.494 36 H GLU 5 H GLU 5 -11.370 10.803 1.474 37 HA GLU 5 HA GLU 5 -13.655 10.360 3.303 38 1HB GLU 5 1HB GLU 5 -13.885 9.927 0.911 39 2HB GLU 5 2HB GLU 5 -12.323 9.122 0.819 40 1HG GLU 5 1HG GLU 5 -13.940 7.517 0.614 41 2HG GLU 5 2HG GLU 5 -13.079 7.282 2.143 42 HE1 GLU 5 HE2 GLU 5 -17.069 8.129 2.035 43 H LEU 6 H LEU 6 -10.252 10.070 3.167 44 HA LEU 6 HA LEU 6 -9.780 7.780 4.987 45 1HB LEU 6 2HB LEU 6 -8.126 9.324 3.312 46 2HB LEU 6 1HB LEU 6 -7.708 10.030 4.852 47 HG LEU 6 HG LEU 6 -7.486 7.128 4.013 48 1HD1 LEU 6 2HD1 LEU 6 -5.818 8.560 3.020 49 2HD1 LEU 6 3HD1 LEU 6 -5.365 9.216 4.586 50 3HD1 LEU 6 1HD1 LEU 6 -5.059 7.498 4.235 51 1HD2 LEU 6 1HD2 LEU 6 -7.275 8.328 6.808 52 2HD2 LEU 6 2HD2 LEU 6 -8.005 6.799 6.298 53 3HD2 LEU 6 3HD2 LEU 6 -6.242 6.981 6.353 54 H ILE 7 H ILE 7 -9.812 11.361 5.300 55 HA ILE 7 HA ILE 7 -9.286 11.583 8.118 56 HB ILE 7 HB ILE 7 -11.009 13.487 6.399 57 1HG1 ILE 7 1HG1 ILE 7 -7.986 13.702 6.876 58 2HG1 ILE 7 2HG1 ILE 7 -8.639 12.944 5.472 59 1HG2 ILE 7 2HG2 ILE 7 -11.144 14.008 8.902 60 2HG2 ILE 7 3HG2 ILE 7 -9.382 14.149 8.930 61 3HG2 ILE 7 1HG2 ILE 7 -10.346 15.303 8.001 62 1HD1 ILE 7 3HD1 ILE 7 -9.915 15.121 4.922 63 2HD1 ILE 7 1HD1 ILE 7 -8.841 15.897 6.080 64 3HD1 ILE 7 2HD1 ILE 7 -8.151 15.045 4.674 65 H ASN 8 H ASN 8 -12.401 11.428 6.400 66 HA ASN 8 HA ASN 8 -14.008 11.298 8.892 67 1HB ASN 8 1HB ASN 8 -14.834 10.340 6.042 68 2HB ASN 8 2HB ASN 8 -15.937 10.483 7.389 69 1HD2 ASN 8 2HD2 ASN 8 -15.191 13.845 5.240 70 2HD2 ASN 8 1HD2 ASN 8 -14.388 12.238 4.866 71 H ALA 9 H ALA 9 -12.230 8.782 7.336 72 HA ALA 9 HA ALA 9 -13.678 6.479 8.615 73 1HB ALA 9 1HB ALA 9 -11.926 6.175 6.610 74 2HB ALA 9 2HB ALA 9 -10.658 6.653 7.744 75 3HB ALA 9 3HB ALA 9 -11.534 5.190 8.070 76 H VAL 10 H VAL 10 -10.834 8.520 9.348 77 HA VAL 10 HA VAL 10 -10.015 6.979 11.596 78 HB VAL 10 HB VAL 10 -8.933 9.743 11.334 79 1HG1 VAL 10 3HG2 VAL 10 -8.200 7.775 12.925 80 2HG1 VAL 10 1HG2 VAL 10 -7.356 7.188 11.464 81 3HG1 VAL 10 2HG2 VAL 10 -6.975 8.806 12.100 82 1HG2 VAL 10 1HG1 VAL 10 -8.621 7.562 9.232 83 2HG2 VAL 10 2HG1 VAL 10 -9.053 9.296 9.099 84 3HG2 VAL 10 3HG1 VAL 10 -7.359 8.840 9.475 85 H ALA 11 H ALA 11 -11.358 10.017 11.195 86 HA ALA 11 HA ALA 11 -11.820 10.340 13.973 87 1HB ALA 11 2HB ALA 11 -11.699 12.325 12.427 88 2HB ALA 11 3HB ALA 11 -13.205 11.813 11.626 89 3HB ALA 11 1HB ALA 11 -13.239 12.408 13.318 90 H GLU 12 H GLU 12 -13.763 8.608 11.659 91 HA GLU 12 HA GLU 12 -16.140 8.460 13.485 92 1HB GLU 12 1HB GLU 12 -16.454 8.348 11.001 93 2HB GLU 12 2HB GLU 12 -15.530 6.846 10.934 94 1HG GLU 12 1HG GLU 12 -17.322 5.738 12.390 95 2HG GLU 12 2HG GLU 12 -18.206 7.261 12.436 96 HE1 GLU 12 HE2 GLU 12 -18.162 4.914 9.131 97 H THR 13 H THR 13 -13.462 6.205 12.501 98 HA THR 13 HA THR 13 -14.267 4.259 14.551 99 HB THR 13 HB THR 13 -12.031 3.105 14.080 100 HG1 THR 13 HG1 THR 13 -11.629 5.411 12.519 101 1HG2 THR 13 3HG2 THR 13 -13.287 3.971 11.417 102 2HG2 THR 13 1HG2 THR 13 -12.088 2.687 11.664 103 3HG2 THR 13 2HG2 THR 13 -13.716 2.524 12.370 104 H SER 14 H SER 14 -12.745 6.918 15.090 105 HA SER 14 HA SER 14 -11.512 5.952 17.760 106 1HB SER 14 1HB SER 14 -9.706 6.277 15.975 107 2HB SER 14 2HB SER 14 -10.079 7.999 15.958 108 HG SER 14 HG SER 14 -8.389 7.474 17.348 109 H GLY 15 H GLY 15 -13.134 8.718 16.205 110 1HA GLY 15 1HA GLY 15 -14.035 10.695 17.154 111 2HA GLY 15 2HA GLY 15 -13.990 9.907 18.728 112 H LEU 16 H LEU 16 -11.511 10.964 16.456 113 HA LEU 16 HA LEU 16 -10.102 12.756 18.432 114 1HB LEU 16 1HB LEU 16 -8.209 12.734 16.966 115 2HB LEU 16 2HB LEU 16 -8.595 11.234 17.782 116 HG LEU 16 HG LEU 16 -9.446 10.224 15.932 117 1HD1 LEU 16 2HD1 LEU 16 -10.714 12.141 14.866 118 2HD1 LEU 16 3HD1 LEU 16 -9.130 12.714 14.262 119 3HD1 LEU 16 1HD1 LEU 16 -9.837 11.119 13.729 120 1HD2 LEU 16 3HD2 LEU 16 -7.371 9.619 15.862 121 2HD2 LEU 16 1HD2 LEU 16 -8.253 9.575 14.315 122 3HD2 LEU 16 2HD2 LEU 16 -7.077 10.844 14.578 123 H SER 17 H SER 17 -9.584 13.879 15.728 124 HA SER 17 HA SER 17 -11.918 15.851 15.461 125 1HB SER 17 1HB SER 17 -9.037 16.871 15.480 126 2HB SER 17 2HB SER 17 -10.485 17.805 15.178 127 HG SER 17 HG SER 17 -9.803 17.970 17.317 128 H LYS 18 H LYS 18 -11.920 17.027 13.444 129 HA LYS 18 HA LYS 18 -11.329 15.378 11.009 130 1HB LYS 18 1HB LYS 18 -12.032 18.374 11.056 131 2HB LYS 18 2HB LYS 18 -12.033 17.341 9.646 132 1HG LYS 18 1HG LYS 18 -14.003 17.088 12.016 133 2HG LYS 18 2HG LYS 18 -14.266 18.012 10.563 134 1HD LYS 18 1HD LYS 18 -15.493 16.117 10.151 135 2HD LYS 18 2HD LYS 18 -14.059 15.847 9.172 136 1HE LYS 18 1HE LYS 18 -13.174 14.201 10.825 137 2HE LYS 18 2HE LYS 18 -14.418 14.633 12.006 138 1HZ LYS 18 1HZ LYS 18 -16.089 13.783 10.503 139 2HZ LYS 18 2HZ LYS 18 -14.987 12.631 10.866 140 H LYS 19 H LYS 19 -9.976 18.349 12.368 141 HA LYS 19 HA LYS 19 -7.576 18.473 10.676 142 1HB LYS 19 2HB LYS 19 -8.419 20.438 11.937 143 2HB LYS 19 1HB LYS 19 -8.059 19.662 13.481 144 1HG LYS 19 1HG LYS 19 -6.373 21.318 13.006 145 2HG LYS 19 2HG LYS 19 -5.610 19.742 12.970 146 1HD LYS 19 1HD LYS 19 -5.682 19.771 10.432 147 2HD LYS 19 2HD LYS 19 -6.443 21.354 10.457 148 1HE LYS 19 1HE LYS 19 -3.638 20.711 11.621 149 2HE LYS 19 2HE LYS 19 -3.929 21.335 10.000 150 1HZ LYS 19 1HZ LYS 19 -3.363 23.102 11.475 151 2HZ LYS 19 2HZ LYS 19 -4.893 23.321 10.945 152 H ASP 20 H ASP 20 -8.201 16.685 13.804 153 HA ASP 20 HA ASP 20 -5.316 15.830 13.961 154 1HB ASP 20 1HB ASP 20 -7.768 14.960 15.581 155 2HB ASP 20 2HB ASP 20 -6.311 14.007 15.631 156 HD2 ASP 20 HD2 ASP 20 -6.488 17.469 17.610 157 H ALA 21 H ALA 21 -8.184 14.473 12.466 158 HA ALA 21 HA ALA 21 -6.917 11.864 11.762 159 1HB ALA 21 2HB ALA 21 -9.543 13.257 10.921 160 2HB ALA 21 3HB ALA 21 -9.009 11.676 10.272 161 3HB ALA 21 1HB ALA 21 -9.308 11.885 11.966 162 H THR 22 H THR 22 -7.434 14.961 9.963 163 HA THR 22 HA THR 22 -6.124 14.221 7.518 164 HB THR 22 HB THR 22 -5.983 17.046 8.771 165 HG1 THR 22 HG1 THR 22 -8.003 17.402 7.898 166 1HG2 THR 22 3HG2 THR 22 -6.403 15.978 5.913 167 2HG2 THR 22 1HG2 THR 22 -6.464 17.703 6.375 168 3HG2 THR 22 2HG2 THR 22 -4.931 16.772 6.533 169 H LYS 23 H LYS 23 -4.764 15.736 10.365 170 HA LYS 23 HA LYS 23 -1.928 15.759 9.600 171 1HB LYS 23 2HB LYS 23 -3.393 15.433 12.339 172 2HB LYS 23 1HB LYS 23 -1.669 15.511 12.276 173 1HG LYS 23 1HG LYS 23 -1.791 17.791 11.059 174 2HG LYS 23 2HG LYS 23 -3.506 17.831 11.399 175 1HD LYS 23 1HD LYS 23 -1.217 17.724 13.473 176 2HD LYS 23 2HD LYS 23 -2.121 19.155 12.997 177 1HE LYS 23 1HE LYS 23 -4.266 18.066 13.920 178 2HE LYS 23 2HE LYS 23 -3.279 16.715 14.498 179 1HZ LYS 23 1HZ LYS 23 -2.000 18.298 15.819 180 2HZ LYS 23 2HZ LYS 23 -2.905 19.550 15.283 181 H ALA 24 H ALA 24 -3.685 13.453 11.531 182 HA ALA 24 HA ALA 24 -1.641 11.559 12.074 183 1HB ALA 24 3HB ALA 24 -4.649 11.223 11.897 184 2HB ALA 24 1HB ALA 24 -3.528 10.026 12.630 185 3HB ALA 24 2HB ALA 24 -3.636 11.670 13.316 186 H VAL 25 H VAL 25 -3.781 11.588 9.268 187 HA VAL 25 HA VAL 25 -2.598 9.207 7.815 188 HB VAL 25 HB VAL 25 -4.282 11.885 7.311 189 1HG1 VAL 25 1HG2 VAL 25 -3.266 10.153 4.975 190 2HG1 VAL 25 2HG2 VAL 25 -4.514 11.442 4.877 191 3HG1 VAL 25 3HG2 VAL 25 -2.854 11.842 5.281 192 1HG2 VAL 25 2HG1 VAL 25 -4.996 8.974 6.847 193 2HG2 VAL 25 3HG1 VAL 25 -5.515 10.006 8.201 194 3HG2 VAL 25 1HG1 VAL 25 -6.051 10.407 6.566 195 H ASP 26 H ASP 26 -1.999 12.762 7.419 196 HA ASP 26 HA ASP 26 0.694 12.269 6.157 197 1HB ASP 26 1HB ASP 26 -0.612 14.828 7.300 198 2HB ASP 26 2HB ASP 26 0.943 14.821 6.485 199 HD2 ASP 26 HD2 ASP 26 -2.445 14.755 4.361 200 H ALA 27 H ALA 27 0.061 11.456 8.869 201 HA ALA 27 HA ALA 27 2.673 11.999 10.326 202 1HB ALA 27 2HB ALA 27 0.539 12.441 11.633 203 2HB ALA 27 3HB ALA 27 0.193 10.712 11.451 204 3HB ALA 27 1HB ALA 27 1.653 11.214 12.262 205 H VAL 28 H VAL 28 0.500 9.387 9.385 206 HA VAL 28 HA VAL 28 2.428 7.167 9.671 207 HB VAL 28 HB VAL 28 0.116 7.186 7.562 208 1HG1 VAL 28 1HG2 VAL 28 2.036 5.176 8.657 209 2HG1 VAL 28 2HG2 VAL 28 0.363 4.623 8.540 210 3HG1 VAL 28 3HG2 VAL 28 1.135 5.296 7.092 211 1HG2 VAL 28 2HG1 VAL 28 -0.203 6.512 10.447 212 2HG2 VAL 28 3HG1 VAL 28 -1.106 7.650 9.349 213 3HG2 VAL 28 1HG1 VAL 28 -1.255 5.911 9.088 214 H PHE 29 H PHE 29 1.072 8.698 6.861 215 HA PHE 29 HA PHE 29 3.004 7.746 4.880 216 1HB PHE 29 2HB PHE 29 0.904 9.948 4.538 217 2HB PHE 29 1HB PHE 29 1.684 9.107 3.220 218 HD1 PHE 29 HD2 PHE 29 1.587 6.296 3.565 219 HD2 PHE 29 HD1 PHE 29 -1.304 9.190 4.860 220 HE1 PHE 29 HE2 PHE 29 -0.051 4.500 3.930 221 HE2 PHE 29 HE1 PHE 29 -2.935 7.403 5.217 222 HZ PHE 29 HZ PHE 29 -2.295 5.044 4.793 223 H ASP 30 H ASP 30 3.316 10.504 6.964 224 HA ASP 30 HA ASP 30 5.369 11.752 5.144 225 1HB ASP 30 1HB ASP 30 3.879 12.966 6.936 226 2HB ASP 30 2HB ASP 30 5.000 12.401 8.147 227 HD1 ASP 30 HD2 ASP 30 7.564 14.575 7.348 228 H SER 31 H SER 31 5.283 9.747 7.935 229 HA SER 31 HA SER 31 8.268 9.476 8.317 230 1HB SER 31 1HB SER 31 6.096 7.606 9.386 231 2HB SER 31 2HB SER 31 7.796 7.621 9.872 232 HG SER 31 HG SER 31 6.504 8.783 11.304 233 H ILE 32 H ILE 32 5.751 7.442 6.435 234 HA ILE 32 HA ILE 32 7.483 5.482 5.608 235 HB ILE 32 HB ILE 32 5.152 6.502 4.026 236 1HG1 ILE 32 1HG1 ILE 32 5.335 4.987 6.609 237 2HG1 ILE 32 2HG1 ILE 32 4.471 6.421 6.104 238 1HG2 ILE 32 2HG2 ILE 32 6.800 4.870 2.936 239 2HG2 ILE 32 3HG2 ILE 32 6.542 3.710 4.188 240 3HG2 ILE 32 1HG2 ILE 32 5.223 4.119 3.087 241 1HD1 ILE 32 2HD1 ILE 32 3.465 3.868 4.999 242 2HD1 ILE 32 3HD1 ILE 32 3.113 4.440 6.670 243 3HD1 ILE 32 1HD1 ILE 32 2.682 5.476 5.291 244 H THR 33 H THR 33 6.522 8.448 3.894 245 HA THR 33 HA THR 33 8.424 8.084 1.657 246 HB THR 33 HB THR 33 6.655 9.627 1.355 247 HG1 THR 33 HG1 THR 33 9.044 11.102 1.470 248 1HG2 THR 33 3HG2 THR 33 6.528 10.415 3.819 249 2HG2 THR 33 1HG2 THR 33 7.771 11.580 3.468 250 3HG2 THR 33 2HG2 THR 33 6.167 11.651 2.625 251 H GLU 34 H GLU 34 8.955 9.443 4.866 252 HA GLU 34 HA GLU 34 11.800 10.168 4.306 253 1HB GLU 34 1HB GLU 34 10.428 11.277 6.147 254 2HB GLU 34 2HB GLU 34 10.297 9.736 6.987 255 1HG GLU 34 1HG GLU 34 12.784 9.706 7.359 256 2HG GLU 34 2HG GLU 34 12.967 11.200 6.442 257 HE1 GLU 34 HE2 GLU 34 11.827 13.285 8.963 258 H ALA 35 H ALA 35 10.139 7.219 5.572 259 HA ALA 35 HA ALA 35 12.634 5.744 5.916 260 1HB ALA 35 3HB ALA 35 10.219 4.817 6.783 261 2HB ALA 35 1HB ALA 35 9.793 4.617 5.108 262 3HB ALA 35 2HB ALA 35 11.050 3.625 5.778 263 H LEU 36 H LEU 36 10.373 5.832 3.137 264 HA LEU 36 HA LEU 36 11.801 4.015 1.362 265 1HB LEU 36 2HB LEU 36 9.851 6.114 0.623 266 2HB LEU 36 1HB LEU 36 10.201 4.661 -0.249 267 HG LEU 36 HG LEU 36 9.626 3.435 1.272 268 1HD1 LEU 36 2HD2 LEU 36 8.090 3.239 -0.152 269 2HD1 LEU 36 3HD2 LEU 36 7.058 3.240 1.296 270 3HD1 LEU 36 1HD2 LEU 36 7.264 4.761 0.399 271 1HD2 LEU 36 1HD1 LEU 36 10.150 3.058 3.125 272 2HD2 LEU 36 2HD1 LEU 36 8.544 3.525 3.536 273 3HD2 LEU 36 3HD1 LEU 36 8.745 2.141 2.478 274 NH1 ARG 37 NH2 ARG 37 10.699 13.027 3.303 275 NH2 ARG 37 NH1 ARG 37 12.213 13.653 4.875 276 H ARG 37 H ARG 37 11.713 7.691 1.556 277 HA ARG 37 HA ARG 37 13.510 7.845 -0.634 278 1HB ARG 37 1HB ARG 37 13.804 10.163 -0.363 279 2HB ARG 37 2HB ARG 37 12.150 9.820 0.083 280 1HG ARG 37 1HG ARG 37 12.983 9.861 2.579 281 2HG ARG 37 2HG ARG 37 14.522 10.451 1.983 282 1HD ARG 37 1HD ARG 37 13.536 12.420 0.998 283 2HD ARG 37 2HD ARG 37 11.889 11.841 1.325 284 1HH1 ARG 37 2HH2 ARG 37 10.525 12.562 2.405 285 2HH1 ARG 37 1HH2 ARG 37 10.000 13.465 3.914 286 1HH2 ARG 37 1HH1 ARG 37 13.192 13.668 5.181 287 2HH2 ARG 37 2HH1 ARG 37 11.407 14.046 5.373 288 H LYS 38 H LYS 38 14.086 7.167 2.778 289 HA LYS 38 HA LYS 38 17.003 7.953 2.594 290 1HB LYS 38 1HB LYS 38 15.346 7.163 5.041 291 2HB LYS 38 2HB LYS 38 17.079 7.370 5.095 292 1HG LYS 38 1HG LYS 38 16.949 9.747 4.418 293 2HG LYS 38 2HG LYS 38 15.212 9.629 4.202 294 1HD LYS 38 1HD LYS 38 15.568 10.701 6.301 295 2HD LYS 38 2HD LYS 38 14.893 9.110 6.634 296 1HE LYS 38 1HE LYS 38 17.176 8.241 7.273 297 2HE LYS 38 2HE LYS 38 17.903 9.803 6.863 298 1HZ LYS 38 1HZ LYS 38 17.489 9.625 9.206 299 2HZ LYS 38 2HZ LYS 38 16.576 10.830 8.586 300 H GLY 39 H GLY 39 15.340 5.191 1.806 301 1HA GLY 39 1HA GLY 39 16.110 2.938 1.420 302 2HA GLY 39 2HA GLY 39 17.664 3.333 2.124 303 H ASP 40 H ASP 40 14.511 3.654 3.656 304 HA ASP 40 HA ASP 40 15.090 1.431 5.677 305 1HB ASP 40 1HB ASP 40 13.393 3.841 6.217 306 2HB ASP 40 2HB ASP 40 13.768 2.562 7.328 307 HD1 ASP 40 HD2 ASP 40 15.871 2.233 7.871 308 H LYS 41 H LYS 41 13.789 -0.171 6.015 309 HA LYS 41 HA LYS 41 11.330 -0.484 4.296 310 1HB LYS 41 2HB LYS 41 12.264 -2.507 6.364 311 2HB LYS 41 1HB LYS 41 11.071 -2.743 5.091 312 1HG LYS 41 1HG LYS 41 13.031 -2.302 3.398 313 2HG LYS 41 2HG LYS 41 14.118 -2.462 4.773 314 1HD LYS 41 1HD LYS 41 13.194 -4.770 5.255 315 2HD LYS 41 2HD LYS 41 12.061 -4.605 3.908 316 1HE LYS 41 1HE LYS 41 14.016 -4.381 2.295 317 2HE LYS 41 2HE LYS 41 15.142 -4.593 3.648 318 1HZ LYS 41 1HZ LYS 41 13.112 -6.563 2.747 319 2HZ LYS 41 2HZ LYS 41 14.720 -6.648 2.464 320 H VAL 42 H VAL 42 9.351 0.071 5.057 321 HA VAL 42 HA VAL 42 8.832 0.731 7.856 322 HB VAL 42 HB VAL 42 7.542 1.006 5.067 323 1HG1 VAL 42 3HG2 VAL 42 5.700 0.860 6.583 324 2HG1 VAL 42 1HG2 VAL 42 6.435 2.197 7.584 325 3HG1 VAL 42 2HG2 VAL 42 5.921 2.502 5.880 326 1HG2 VAL 42 1HG1 VAL 42 8.704 2.980 7.113 327 2HG2 VAL 42 2HG1 VAL 42 9.304 2.508 5.458 328 3HG2 VAL 42 3HG1 VAL 42 7.853 3.481 5.661 329 H GLN 43 H GLN 43 7.418 -0.240 8.956 330 HA GLN 43 HA GLN 43 6.259 -2.899 8.081 331 1HB GLN 43 1HB GLN 43 8.090 -2.851 10.421 332 2HB GLN 43 2HB GLN 43 6.983 -4.174 10.046 333 1HG GLN 43 1HG GLN 43 8.101 -4.402 7.797 334 2HG GLN 43 2HG GLN 43 9.197 -3.085 8.206 335 1HE2 GLN 43 2HE2 GLN 43 11.317 -5.923 8.943 336 2HE2 GLN 43 1HE2 GLN 43 10.751 -4.801 7.608 337 H LEU 44 H LEU 44 4.448 -3.572 8.483 338 HA LEU 44 HA LEU 44 2.734 -2.404 10.708 339 1HB LEU 44 2HB LEU 44 1.633 -2.901 7.871 340 2HB LEU 44 1HB LEU 44 0.835 -2.156 9.246 341 HG LEU 44 HG LEU 44 2.898 -0.382 8.936 342 1HD1 LEU 44 1HD1 LEU 44 3.958 -1.552 6.959 343 2HD1 LEU 44 2HD1 LEU 44 2.452 -1.360 6.037 344 3HD1 LEU 44 3HD1 LEU 44 3.387 0.068 6.546 345 1HD2 LEU 44 2HD2 LEU 44 0.449 0.188 8.900 346 2HD2 LEU 44 3HD2 LEU 44 1.331 1.070 7.638 347 3HD2 LEU 44 1HD2 LEU 44 0.332 -0.343 7.206 348 H ILE 45 H ILE 45 2.196 -4.219 11.929 349 HA ILE 45 HA ILE 45 2.228 -6.917 10.711 350 HB ILE 45 HB ILE 45 3.121 -6.487 12.996 351 1HG1 ILE 45 1HG1 ILE 45 2.273 -8.594 14.070 352 2HG1 ILE 45 2HG1 ILE 45 1.038 -8.745 12.834 353 1HG2 ILE 45 1HG2 ILE 45 1.315 -5.050 13.891 354 2HG2 ILE 45 2HG2 ILE 45 0.178 -6.423 13.873 355 3HG2 ILE 45 3HG2 ILE 45 1.608 -6.453 14.949 356 1HD1 ILE 45 3HD1 ILE 45 4.096 -8.767 12.306 357 2HD1 ILE 45 1HD1 ILE 45 3.052 -10.204 12.414 358 3HD1 ILE 45 2HD1 ILE 45 2.834 -9.058 11.076 359 H GLY 46 H GLY 46 0.536 -8.328 10.573 360 1HA GLY 46 1HA GLY 46 -1.607 -8.989 9.740 361 2HA GLY 46 2HA GLY 46 -2.285 -7.723 10.727 362 H PHE 47 H PHE 47 -0.359 -6.117 8.467 363 HA PHE 47 HA PHE 47 -2.411 -6.062 6.254 364 1HB PHE 47 2HB PHE 47 -2.727 -4.384 8.170 365 2HB PHE 47 1HB PHE 47 -1.215 -3.619 7.763 366 HD1 PHE 47 HD1 PHE 47 -4.684 -4.288 6.423 367 HD2 PHE 47 HD2 PHE 47 -0.966 -2.218 5.743 368 HE1 PHE 47 HE1 PHE 47 -5.618 -3.174 4.414 369 HE2 PHE 47 HE2 PHE 47 -1.931 -1.179 3.735 370 HZ PHE 47 HZ PHE 47 -4.227 -1.772 3.022 371 H GLY 48 H GLY 48 1.041 -5.140 7.062 372 1HA GLY 48 1HA GLY 48 1.750 -5.247 4.264 373 2HA GLY 48 2HA GLY 48 1.473 -3.577 4.676 374 H ASN 49 H ASN 49 3.735 -4.497 3.577 375 HA ASN 49 HA ASN 49 5.687 -3.350 5.572 376 1HB ASN 49 1HB ASN 49 5.950 -5.738 5.960 377 2HB ASN 49 2HB ASN 49 6.109 -6.093 4.257 378 1HD2 ASN 49 1HD2 ASN 49 9.547 -6.314 5.499 379 2HD2 ASN 49 2HD2 ASN 49 7.948 -7.214 5.501 380 H PHE 50 H PHE 50 6.031 -1.518 4.433 381 HA PHE 50 HA PHE 50 6.320 -1.540 1.435 382 1HB PHE 50 2HB PHE 50 6.875 0.886 3.207 383 2HB PHE 50 1HB PHE 50 6.907 0.897 1.506 384 HD1 PHE 50 HD2 PHE 50 4.721 0.296 4.478 385 HD2 PHE 50 HD1 PHE 50 5.037 1.893 0.508 386 HE1 PHE 50 HE2 PHE 50 2.460 1.315 4.693 387 HE2 PHE 50 HE1 PHE 50 2.800 2.922 0.773 388 HZ PHE 50 HZ PHE 50 1.490 2.458 2.784 389 H GLU 51 H GLU 51 8.208 -1.151 0.381 390 HA GLU 51 HA GLU 51 10.659 -0.472 1.764 391 1HB GLU 51 1HB GLU 51 12.047 -2.554 1.374 392 2HB GLU 51 2HB GLU 51 10.745 -2.810 2.502 393 1HG GLU 51 1HG GLU 51 10.873 -4.793 1.229 394 2HG GLU 51 2HG GLU 51 9.394 -4.005 0.722 395 HE2 GLU 51 HE2 GLU 51 10.269 -4.294 -2.560 396 H VAL 52 H VAL 52 12.489 0.063 0.456 397 HA VAL 52 HA VAL 52 11.580 0.745 -2.254 398 HB VAL 52 HB VAL 52 12.687 2.076 0.049 399 1HG1 VAL 52 1HG2 VAL 52 14.941 1.654 -1.927 400 2HG1 VAL 52 2HG2 VAL 52 14.836 2.948 -0.676 401 3HG1 VAL 52 3HG2 VAL 52 14.857 1.212 -0.218 402 1HG2 VAL 52 3HG1 VAL 52 12.426 3.057 -2.805 403 2HG2 VAL 52 1HG1 VAL 52 11.231 3.105 -1.471 404 3HG2 VAL 52 2HG1 VAL 52 12.715 4.032 -1.359 405 NH1 ARG 53 NH2 ARG 53 14.243 -2.580 -10.046 406 NH2 ARG 53 NH1 ARG 53 14.978 -4.692 -10.455 407 H ARG 53 H ARG 53 13.029 0.599 -4.040 408 HA ARG 53 HA ARG 53 14.920 -1.843 -3.969 409 1HB ARG 53 1HB ARG 53 12.638 -2.340 -4.963 410 2HB ARG 53 2HB ARG 53 12.910 -1.100 -6.160 411 1HG ARG 53 1HG ARG 53 14.957 -2.348 -6.999 412 2HG ARG 53 2HG ARG 53 14.633 -3.636 -5.838 413 1HD ARG 53 1HD ARG 53 12.465 -4.161 -6.919 414 2HD ARG 53 2HD ARG 53 12.541 -2.739 -7.946 415 1HH1 ARG 53 2HH2 ARG 53 13.760 -1.941 -9.405 416 2HH1 ARG 53 1HH2 ARG 53 14.643 -2.346 -10.961 417 1HH2 ARG 53 1HH1 ARG 53 15.059 -5.661 -10.128 418 2HH2 ARG 53 2HH1 ARG 53 15.327 -4.310 -11.341 419 H GLU 54 H GLU 54 16.773 -0.622 -3.835 420 HA GLU 54 HA GLU 54 17.390 1.662 -5.595 421 1HB GLU 54 1HB GLU 54 19.667 1.609 -4.805 422 2HB GLU 54 2HB GLU 54 18.487 1.620 -3.512 423 1HG GLU 54 1HG GLU 54 18.892 -0.850 -3.098 424 2HG GLU 54 2HG GLU 54 20.076 -0.881 -4.402 425 HE2 GLU 54 HE2 GLU 54 21.905 0.140 -4.181 426 NH1 ARG 55 NH2 ARG 55 18.874 -2.286 -13.407 427 NH2 ARG 55 NH1 ARG 55 18.372 -3.806 -11.793 428 H ARG 55 H ARG 55 18.011 1.695 -7.620 429 HA ARG 55 HA ARG 55 18.042 -0.817 -9.198 430 1HB ARG 55 1HB ARG 55 16.933 1.367 -9.920 431 2HB ARG 55 2HB ARG 55 18.517 2.090 -10.085 432 1HG ARG 55 1HG ARG 55 17.818 1.609 -12.251 433 2HG ARG 55 2HG ARG 55 19.062 0.426 -11.951 434 1HD ARG 55 1HD ARG 55 16.017 -0.124 -11.738 435 2HD ARG 55 2HD ARG 55 16.928 -0.347 -13.211 436 1HH1 ARG 55 1HH2 ARG 55 18.722 -1.344 -13.785 437 2HH1 ARG 55 2HH2 ARG 55 19.491 -3.010 -13.790 438 1HH2 ARG 55 1HH1 ARG 55 17.841 -4.027 -10.944 439 2HH2 ARG 55 2HH1 ARG 55 19.024 -4.424 -12.288 440 H ALA 56 H ALA 56 19.699 -1.704 -10.349 441 HA ALA 56 HA ALA 56 22.502 -1.331 -9.391 442 1HB ALA 56 2HB ALA 56 21.662 -3.601 -9.900 443 2HB ALA 56 3HB ALA 56 21.407 -3.172 -11.610 444 3HB ALA 56 1HB ALA 56 23.051 -3.208 -10.932 445 H ALA 57 H ALA 57 22.703 0.834 -9.987 446 HA ALA 57 HA ALA 57 22.553 2.117 -12.389 447 1HB ALA 57 3HB ALA 57 22.888 3.107 -10.155 448 2HB ALA 57 1HB ALA 57 24.610 2.685 -10.181 449 3HB ALA 57 2HB ALA 57 23.956 3.845 -11.359 450 NH1 ARG 58 NH2 ARG 58 26.078 7.254 -14.746 451 NH2 ARG 58 NH1 ARG 58 26.271 7.750 -12.539 452 H ARG 58 H ARG 58 23.399 1.094 -14.239 453 HA ARG 58 HA ARG 58 24.379 1.759 -15.658 454 1HB ARG 58 2HB ARG 58 27.103 2.171 -15.497 455 2HB ARG 58 1HB ARG 58 25.983 2.879 -16.503 456 1HG ARG 58 1HG ARG 58 25.322 4.570 -15.200 457 2HG ARG 58 2HG ARG 58 25.293 3.723 -13.751 458 1HD ARG 58 1HD ARG 58 27.915 3.857 -13.700 459 2HD ARG 58 2HD ARG 58 27.801 4.961 -15.065 460 1HH1 ARG 58 2HH2 ARG 58 26.222 6.567 -15.495 461 2HH1 ARG 58 1HH2 ARG 58 25.680 8.195 -14.843 462 1HH2 ARG 58 1HH1 ARG 58 26.561 7.446 -11.603 463 2HH2 ARG 58 2HH1 ARG 58 25.859 8.655 -12.790 464 H LYS 59 H LYS 59 24.825 1.213 -17.348 465 HA LYS 59 HA LYS 59 25.827 0.469 -19.128 466 1HB LYS 59 1HB LYS 59 26.862 -1.641 -19.733 467 2HB LYS 59 2HB LYS 59 27.480 -1.068 -18.206 468 1HG LYS 59 1HG LYS 59 25.896 -2.776 -17.032 469 2HG LYS 59 2HG LYS 59 25.484 -3.389 -18.629 470 1HD LYS 59 1HD LYS 59 27.910 -3.915 -19.071 471 2HD LYS 59 2HD LYS 59 28.355 -3.317 -17.480 472 1HE LYS 59 1HE LYS 59 26.438 -5.702 -17.986 473 2HE LYS 59 2HE LYS 59 28.166 -5.854 -17.678 474 1HZ LYS 59 1HZ LYS 59 26.865 -6.185 -15.690 475 2HZ LYS 59 2HZ LYS 59 26.190 -4.699 -15.794 476 H GLY 60 H GLY 60 24.389 0.530 -20.831 477 1HA GLY 60 1HA GLY 60 22.980 -1.638 -22.021 478 2HA GLY 60 2HA GLY 60 21.873 -1.123 -20.748 479 NH1 ARG 61 NH2 ARG 61 20.454 5.239 -27.617 480 NH2 ARG 61 NH1 ARG 61 22.200 5.937 -28.893 481 H ARG 61 H ARG 61 21.403 -1.001 -23.584 482 HA ARG 61 HA ARG 61 21.422 1.986 -24.120 483 1HB ARG 61 1HB ARG 61 22.636 0.350 -25.734 484 2HB ARG 61 2HB ARG 61 21.087 -0.037 -26.347 485 1HG ARG 61 1HG ARG 61 22.305 1.723 -27.688 486 2HG ARG 61 2HG ARG 61 20.720 2.191 -27.252 487 1HD ARG 61 1HD ARG 61 21.566 3.788 -25.551 488 2HD ARG 61 2HD ARG 61 23.192 3.144 -25.702 489 1HH1 ARG 61 2HH2 ARG 61 20.120 4.615 -26.875 490 2HH1 ARG 61 1HH2 ARG 61 19.897 5.924 -28.140 491 1HH2 ARG 61 1HH1 ARG 61 23.195 5.848 -29.124 492 2HH2 ARG 61 2HH1 ARG 61 21.523 6.574 -29.327 493 H ASN 62 H ASN 62 19.726 2.009 -26.119 494 HA ASN 62 HA ASN 62 16.928 1.993 -24.957 495 1HB ASN 62 1HB ASN 62 18.142 3.844 -26.533 496 2HB ASN 62 2HB ASN 62 17.783 2.759 -27.841 497 1HD2 ASN 62 2HD2 ASN 62 14.463 4.070 -28.104 498 2HD2 ASN 62 1HD2 ASN 62 15.885 3.188 -28.857 499 HA PRO 63 HA PRO 63 15.859 -1.993 -27.129 500 1HB PRO 63 1HB PRO 63 13.236 -0.556 -27.810 501 2HB PRO 63 2HB PRO 63 13.475 -2.211 -27.208 502 1HG PRO 63 1HG PRO 63 12.733 -0.270 -25.469 503 2HG PRO 63 2HG PRO 63 14.006 -1.412 -24.977 504 1HD PRO 63 1HD PRO 63 14.347 1.461 -25.985 505 2HD PRO 63 2HD PRO 63 15.184 0.624 -24.642 506 H GLN 64 H GLN 64 15.826 0.999 -28.948 507 HA GLN 64 HA GLN 64 15.338 -0.224 -31.622 508 1HB GLN 64 1HB GLN 64 14.615 2.137 -31.032 509 2HB GLN 64 2HB GLN 64 16.291 2.611 -30.799 510 1HG GLN 64 1HG GLN 64 16.828 2.303 -33.173 511 2HG GLN 64 2HG GLN 64 15.283 1.535 -33.465 512 1HE2 GLN 64 2HE2 GLN 64 15.448 5.650 -33.376 513 2HE2 GLN 64 1HE2 GLN 64 16.884 4.604 -32.915 514 H THR 65 H THR 65 18.045 1.648 -30.455 515 HA THR 65 HA THR 65 19.795 0.799 -32.590 516 HB THR 65 HB THR 65 21.394 2.375 -31.740 517 HG1 THR 65 HG1 THR 65 21.044 3.400 -29.765 518 1HG2 THR 65 2HG2 THR 65 19.251 3.351 -32.795 519 2HG2 THR 65 3HG2 THR 65 18.594 3.564 -31.167 520 3HG2 THR 65 1HG2 THR 65 20.047 4.463 -31.636 521 H GLY 66 H GLY 66 19.790 -0.176 -29.180 522 1HA GLY 66 1HA GLY 66 20.940 -1.992 -28.090 523 2HA GLY 66 2HA GLY 66 21.172 -2.695 -29.673 524 H GLU 67 H GLU 67 22.532 0.329 -28.492 525 HA GLU 67 HA GLU 67 25.426 -0.644 -28.755 526 1HB GLU 67 2HB GLU 67 24.623 1.355 -30.047 527 2HB GLU 67 1HB GLU 67 24.391 2.202 -28.516 528 1HG GLU 67 1HG GLU 67 26.909 1.821 -28.031 529 2HG GLU 67 2HG GLU 67 27.053 1.084 -29.623 530 HE1 GLU 67 HE2 GLU 67 26.271 3.878 -27.879 531 H GLU 68 H GLU 68 24.773 1.647 -26.754 532 HA GLU 68 HA GLU 68 24.093 0.774 -24.277 533 1HB GLU 68 1HB GLU 68 25.932 0.215 -22.726 534 2HB GLU 68 2HB GLU 68 25.664 -0.994 -23.943 535 1HG GLU 68 1HG GLU 68 27.706 -0.161 -25.230 536 2HG GLU 68 2HG GLU 68 27.983 1.057 -23.988 537 HE1 GLU 68 HE2 GLU 68 29.139 -1.154 -21.560 538 H MET 69 H MET 69 23.694 2.297 -23.056 539 HA MET 69 HA MET 69 25.557 4.698 -22.714 540 1HB MET 69 1HB MET 69 23.679 6.217 -22.418 541 2HB MET 69 2HB MET 69 23.674 5.481 -24.003 542 1HG MET 69 1HG MET 69 21.393 5.586 -23.347 543 2HG MET 69 2HG MET 69 21.838 3.882 -23.191 544 1HE MET 69 1HE MET 69 19.729 3.506 -22.058 545 2HE MET 69 3HE MET 69 20.452 2.753 -20.616 546 3HE MET 69 2HE MET 69 19.275 4.060 -20.415 547 H GLU 70 H GLU 70 25.945 5.265 -20.713 548 HA GLU 70 HA GLU 70 25.515 3.338 -18.564 549 1HB GLU 70 2HB GLU 70 26.894 4.818 -17.159 550 2HB GLU 70 1HB GLU 70 27.619 4.547 -18.734 551 1HG GLU 70 1HG GLU 70 26.808 6.903 -19.422 552 2HG GLU 70 2HG GLU 70 26.192 7.126 -17.789 553 HE1 GLU 70 HE2 GLU 70 30.133 7.338 -18.628 554 H ILE 71 H ILE 71 24.047 3.267 -16.927 555 HA ILE 71 HA ILE 71 21.791 5.217 -16.791 556 HB ILE 71 HB ILE 71 22.140 2.362 -15.773 557 1HG1 ILE 71 1HG1 ILE 71 20.245 2.111 -17.828 558 2HG1 ILE 71 2HG1 ILE 71 21.234 3.403 -18.494 559 1HG2 ILE 71 3HG2 ILE 71 19.685 4.139 -15.955 560 2HG2 ILE 71 1HG2 ILE 71 19.651 2.350 -15.640 561 3HG2 ILE 71 2HG2 ILE 71 20.454 3.440 -14.498 562 1HD1 ILE 71 3HD1 ILE 71 22.306 0.689 -17.468 563 2HD1 ILE 71 1HD1 ILE 71 21.997 1.108 -19.176 564 3HD1 ILE 71 2HD1 ILE 71 23.271 1.941 -18.272 565 HA PRO 72 HA PRO 72 23.292 6.114 -12.427 566 1HB PRO 72 1HB PRO 72 20.997 8.144 -12.482 567 2HB PRO 72 2HB PRO 72 22.683 8.392 -11.993 568 1HG PRO 72 1HG PRO 72 21.769 9.330 -14.398 569 2HG PRO 72 2HG PRO 72 23.404 8.627 -14.276 570 1HD PRO 72 1HD PRO 72 20.862 7.288 -15.344 571 2HD PRO 72 2HD PRO 72 22.522 7.290 -16.022 572 H ALA 73 H ALA 73 22.343 5.880 -10.294 573 HA ALA 73 HA ALA 73 20.405 3.689 -10.121 574 1HB ALA 73 1HB ALA 73 22.166 4.108 -8.286 575 2HB ALA 73 2HB ALA 73 21.227 5.546 -7.765 576 3HB ALA 73 3HB ALA 73 20.528 3.932 -7.645 577 H SER 74 H SER 74 18.576 3.593 -8.840 578 HA SER 74 HA SER 74 17.509 5.874 -7.620 579 1HB SER 74 1HB SER 74 15.206 6.242 -8.722 580 2HB SER 74 2HB SER 74 16.523 6.638 -9.811 581 HG SER 74 HG SER 74 16.301 4.531 -10.709 582 H LYS 75 H LYS 75 16.173 5.517 -6.003 583 HA LYS 75 HA LYS 75 15.506 2.698 -5.222 584 1HB LYS 75 2HB LYS 75 14.447 4.850 -3.474 585 2HB LYS 75 1HB LYS 75 15.080 3.276 -3.140 586 1HG LYS 75 1HG LYS 75 17.444 4.124 -3.612 587 2HG LYS 75 2HG LYS 75 16.767 5.736 -3.854 588 1HD LYS 75 1HD LYS 75 15.840 5.646 -1.445 589 2HD LYS 75 2HD LYS 75 16.642 4.092 -1.257 590 1HE LYS 75 1HE LYS 75 18.062 5.729 -0.224 591 2HE LYS 75 2HE LYS 75 18.895 5.160 -1.669 592 1HZ LYS 75 1HZ LYS 75 18.998 7.557 -1.407 593 2HZ LYS 75 2HZ LYS 75 17.369 7.699 -1.416 594 H VAL 76 H VAL 76 13.433 1.661 -5.804 595 HA VAL 76 HA VAL 76 11.294 3.320 -6.782 596 HB VAL 76 HB VAL 76 12.877 0.810 -7.230 597 1HG1 VAL 76 3HG2 VAL 76 10.009 0.717 -7.835 598 2HG1 VAL 76 1HG2 VAL 76 11.357 -0.387 -8.440 599 3HG1 VAL 76 2HG2 VAL 76 10.975 -0.304 -6.709 600 1HG2 VAL 76 2HG1 VAL 76 13.152 2.804 -8.644 601 2HG2 VAL 76 3HG1 VAL 76 12.646 1.363 -9.547 602 3HG2 VAL 76 1HG1 VAL 76 11.445 2.648 -9.172 603 HA PRO 77 HA PRO 77 9.425 1.855 -2.807 604 1HB PRO 77 1HB PRO 77 7.214 3.540 -2.750 605 2HB PRO 77 2HB PRO 77 8.861 4.178 -2.628 606 1HG PRO 77 1HG PRO 77 7.114 3.994 -5.129 607 2HG PRO 77 2HG PRO 77 7.981 5.410 -4.535 608 1HD PRO 77 1HD PRO 77 8.984 3.547 -6.532 609 2HD PRO 77 2HD PRO 77 10.090 4.490 -5.506 610 H ALA 78 H ALA 78 8.330 0.406 -2.246 611 HA ALA 78 HA ALA 78 5.989 -0.778 -3.836 612 1HB ALA 78 2HB ALA 78 8.290 -1.839 -4.208 613 2HB ALA 78 3HB ALA 78 8.377 -2.211 -2.474 614 3HB ALA 78 1HB ALA 78 7.119 -2.967 -3.479 615 H PHE 79 H PHE 79 4.889 -2.369 -2.584 616 HA PHE 79 HA PHE 79 4.488 -1.880 0.440 617 1HB PHE 79 2HB PHE 79 3.138 -0.273 -0.121 618 2HB PHE 79 1HB PHE 79 2.479 -1.145 -1.533 619 HD1 PHE 79 HD2 PHE 79 2.315 -0.953 2.197 620 HD2 PHE 79 HD1 PHE 79 0.647 -2.764 -1.331 621 HE1 PHE 79 HE2 PHE 79 0.510 -1.938 3.540 622 HE2 PHE 79 HE1 PHE 79 -1.097 -3.817 0.042 623 HZ PHE 79 HZ PHE 79 -1.148 -3.445 2.477 624 H LYS 80 H LYS 80 4.426 -3.756 1.060 625 HA LYS 80 HA LYS 80 3.710 -6.472 -0.356 626 1HB LYS 80 2HB LYS 80 5.001 -5.913 2.337 627 2HB LYS 80 1HB LYS 80 4.458 -7.487 1.820 628 1HG LYS 80 1HG LYS 80 6.043 -7.499 -0.100 629 2HG LYS 80 2HG LYS 80 6.530 -5.836 0.228 630 1HD LYS 80 1HD LYS 80 7.473 -6.502 2.446 631 2HD LYS 80 2HD LYS 80 6.991 -8.182 2.173 632 1HE LYS 80 1HE LYS 80 8.519 -8.293 0.152 633 2HE LYS 80 2HE LYS 80 8.958 -6.593 0.374 634 1HZ LYS 80 1HZ LYS 80 9.466 -8.778 2.315 635 2HZ LYS 80 2HZ LYS 80 10.577 -8.091 1.332 636 HA PRO 81 HA PRO 81 -0.223 -5.969 1.945 637 1HB PRO 81 1HB PRO 81 -1.510 -8.246 1.088 638 2HB PRO 81 2HB PRO 81 -1.116 -6.933 -0.027 639 1HG PRO 81 1HG PRO 81 0.470 -9.520 0.428 640 2HG PRO 81 2HG PRO 81 -0.120 -8.867 -1.123 641 1HD PRO 81 1HD PRO 81 2.459 -8.411 -0.142 642 2HD PRO 81 2HD PRO 81 1.617 -7.222 -1.186 643 H GLY 82 H GLY 82 2.066 -6.748 3.459 644 1HA GLY 82 1HA GLY 82 3.109 -8.292 4.995 645 2HA GLY 82 2HA GLY 82 1.578 -7.908 5.753 646 H LYS 83 H LYS 83 1.402 -9.902 2.993 647 HA LYS 83 HA LYS 83 0.700 -12.189 2.657 648 1HB LYS 83 2HB LYS 83 2.254 -12.577 5.192 649 2HB LYS 83 1HB LYS 83 0.906 -13.643 5.128 650 1HG LYS 83 1HG LYS 83 1.681 -14.459 2.817 651 2HG LYS 83 2HG LYS 83 3.056 -13.355 2.914 652 1HD LYS 83 1HD LYS 83 3.871 -14.575 5.005 653 2HD LYS 83 2HD LYS 83 2.482 -15.645 4.902 654 1HE LYS 83 1HE LYS 83 4.330 -16.870 3.984 655 2HE LYS 83 2HE LYS 83 3.286 -16.473 2.622 656 1HZ LYS 83 1HZ LYS 83 5.747 -14.991 3.392 657 2HZ LYS 83 2HZ LYS 83 4.792 -14.612 2.121 658 H ALA 84 H ALA 84 -0.110 -10.936 5.635 659 HA ALA 84 HA ALA 84 -2.587 -12.200 6.438 660 1HB ALA 84 2HB ALA 84 -0.995 -10.866 7.845 661 2HB ALA 84 3HB ALA 84 -1.338 -9.401 6.887 662 3HB ALA 84 1HB ALA 84 -2.626 -10.117 7.896 663 H LEU 85 H LEU 85 -2.112 -9.012 4.663 664 HA LEU 85 HA LEU 85 -4.972 -8.608 4.205 665 1HB LEU 85 2HB LEU 85 -3.438 -6.656 4.178 666 2HB LEU 85 1HB LEU 85 -2.523 -7.359 2.862 667 HG LEU 85 HG LEU 85 -4.696 -7.457 1.592 668 1HD1 LEU 85 2HD1 LEU 85 -6.328 -6.932 3.388 669 2HD1 LEU 85 3HD1 LEU 85 -5.614 -5.317 3.561 670 3HD1 LEU 85 1HD1 LEU 85 -6.463 -5.766 2.058 671 1HD2 LEU 85 1HD2 LEU 85 -2.846 -5.845 0.989 672 2HD2 LEU 85 2HD2 LEU 85 -4.409 -5.056 0.725 673 3HD2 LEU 85 3HD2 LEU 85 -3.446 -4.669 2.176 674 H LYS 86 H LYS 86 -2.323 -10.175 2.416 675 HA LYS 86 HA LYS 86 -3.818 -10.870 0.007 676 1HB LYS 86 1HB LYS 86 -1.289 -11.000 0.309 677 2HB LYS 86 2HB LYS 86 -1.506 -12.506 1.180 678 1HG LYS 86 1HG LYS 86 -2.532 -13.549 -0.866 679 2HG LYS 86 2HG LYS 86 -2.440 -12.003 -1.704 680 1HD LYS 86 1HD LYS 86 -0.597 -13.372 -2.482 681 2HD LYS 86 2HD LYS 86 0.050 -12.020 -1.582 682 1HE LYS 86 1HE LYS 86 1.357 -13.984 -1.024 683 2HE LYS 86 2HE LYS 86 0.469 -13.529 0.424 684 1HZ LYS 86 1HZ LYS 86 0.383 -15.883 0.064 685 2HZ LYS 86 2HZ LYS 86 -1.131 -15.279 -0.066 686 H ASP 87 H ASP 87 -4.107 -12.255 3.233 687 HA ASP 87 HA ASP 87 -5.832 -14.506 2.257 688 1HB ASP 87 1HB ASP 87 -4.107 -14.028 4.535 689 2HB ASP 87 2HB ASP 87 -5.677 -13.794 5.190 690 HD1 ASP 87 HD2 ASP 87 -4.344 -17.417 3.860 691 H ALA 88 H ALA 88 -6.208 -11.343 3.897 692 HA ALA 88 HA ALA 88 -9.074 -11.304 4.403 693 1HB ALA 88 1HB ALA 88 -7.405 -9.393 5.032 694 2HB ALA 88 2HB ALA 88 -7.320 -8.959 3.322 695 3HB ALA 88 3HB ALA 88 -8.843 -8.782 4.162 696 H VAL 89 H VAL 89 -7.217 -10.616 1.379 697 HA VAL 89 HA VAL 89 -9.530 -9.499 -0.027 698 HB VAL 89 HB VAL 89 -7.052 -8.642 0.590 699 1HG1 VAL 89 3HG2 VAL 89 -5.982 -10.834 -0.295 700 2HG1 VAL 89 1HG2 VAL 89 -6.246 -10.194 -1.920 701 3HG1 VAL 89 2HG2 VAL 89 -5.259 -9.282 -0.732 702 1HG2 VAL 89 1HG1 VAL 89 -8.067 -8.353 -2.188 703 2HG2 VAL 89 2HG1 VAL 89 -8.490 -7.422 -0.689 704 3HG2 VAL 89 3HG1 VAL 89 -6.819 -7.375 -1.303 705 H LYS 90 H LYS 90 -7.949 -12.582 0.019 706 HA LYS 90 HA LYS 90 -7.968 -13.301 -2.724 707 1HB LYS 90 1HB LYS 90 -7.351 -15.437 -2.052 708 2HB LYS 90 2HB LYS 90 -6.682 -14.330 -0.886 709 1HG LYS 90 1HG LYS 90 -8.548 -14.938 0.741 710 2HG LYS 90 2HG LYS 90 -9.149 -16.123 -0.414 711 1HD LYS 90 1HD LYS 90 -6.994 -17.380 -0.333 712 2HD LYS 90 2HD LYS 90 -6.280 -16.165 0.728 713 1HE LYS 90 1HE LYS 90 -7.993 -16.689 2.520 714 2HE LYS 90 2HE LYS 90 -8.739 -17.900 1.463 715 1HZ LYS 90 1HZ LYS 90 -5.952 -17.961 2.481 716 2HZ LYS 90 2HZ LYS 90 -7.193 -18.874 3.025 717 1H MET 1 1H MET 91 9.744 0.907 9.794 718 2H MET 1 2H MET 91 10.732 -0.191 10.598 719 HA MET 1 HA MET 91 9.834 0.670 12.330 720 1HB MET 1 1HB MET 91 7.502 1.654 12.452 721 2HB MET 1 2HB MET 91 8.719 2.483 11.499 722 1HG MET 1 1HG MET 91 7.619 1.695 9.398 723 2HG MET 1 2HG MET 91 6.388 0.863 10.364 724 1HE MET 1 3HE MET 91 8.116 4.316 9.522 725 2HE MET 1 2HE MET 91 6.757 4.207 8.366 726 3HE MET 1 1HE MET 91 6.724 5.427 9.647 727 H ASN 2 H ASN 92 6.671 -0.651 11.747 728 HA ASN 2 HA ASN 92 6.779 -3.270 12.080 729 1HB ASN 2 1HB ASN 92 6.754 -4.217 14.243 730 2HB ASN 2 2HB ASN 92 8.246 -3.409 13.957 731 1HD2 ASN 2 1HD2 ASN 92 6.056 -2.278 17.155 732 2HD2 ASN 2 2HD2 ASN 92 5.439 -3.384 15.826 733 H LYS 3 H LYS 93 5.279 -0.643 13.610 734 HA LYS 3 HA LYS 93 2.825 -0.283 12.803 735 1HB LYS 3 1HB LYS 93 2.205 -2.762 12.809 736 2HB LYS 3 2HB LYS 93 2.198 -2.742 14.557 737 1HG LYS 3 1HG LYS 93 0.282 -1.044 14.460 738 2HG LYS 3 2HG LYS 93 0.456 -0.949 12.706 739 1HD LYS 3 1HD LYS 93 -0.142 -3.421 12.552 740 2HD LYS 3 2HD LYS 93 -0.408 -3.442 14.300 741 1HE LYS 3 1HE LYS 93 -2.225 -1.670 14.026 742 2HE LYS 3 2HE LYS 93 -1.949 -1.672 12.277 743 1HZ LYS 3 1HZ LYS 93 -3.778 -3.078 12.849 744 2HZ LYS 3 2HZ LYS 93 -2.582 -3.987 12.206 745 H THR 4 H THR 94 4.654 -0.885 15.808 746 HA THR 4 HA THR 94 2.991 0.899 17.406 747 HB THR 4 HB THR 94 5.459 -0.895 17.874 748 HG1 THR 4 HG1 THR 94 3.486 -2.034 17.470 749 1HG2 THR 4 3HG2 THR 94 3.666 0.648 19.745 750 2HG2 THR 4 1HG2 THR 94 4.872 -0.635 20.242 751 3HG2 THR 4 2HG2 THR 94 5.427 0.877 19.423 752 H GLU 5 H GLU 95 6.145 0.757 15.618 753 HA GLU 5 HA GLU 95 7.221 3.294 16.722 754 1HB GLU 5 1HB GLU 95 8.746 1.532 16.088 755 2HB GLU 5 2HB GLU 95 7.876 1.148 14.618 756 1HG GLU 5 1HG GLU 95 9.754 2.122 13.924 757 2HG GLU 5 2HG GLU 95 8.474 3.299 13.631 758 HE2 GLU 5 HE2 GLU 95 9.857 5.785 15.636 759 H LEU 6 H LEU 96 4.748 2.193 14.644 760 HA LEU 6 HA LEU 96 4.337 4.554 12.885 761 1HB LEU 6 2HB LEU 96 3.337 1.873 12.992 762 2HB LEU 6 1HB LEU 96 1.972 2.763 13.606 763 HG LEU 6 HG LEU 96 3.294 3.297 10.949 764 1HD1 LEU 6 3HD1 LEU 96 0.636 1.951 11.582 765 2HD1 LEU 6 1HD1 LEU 96 1.220 2.373 9.954 766 3HD1 LEU 6 2HD1 LEU 96 2.087 1.167 10.925 767 1HD2 LEU 6 1HD2 LEU 96 1.228 4.897 12.446 768 2HD2 LEU 6 2HD2 LEU 96 2.519 5.429 11.364 769 3HD2 LEU 6 3HD2 LEU 96 1.036 4.703 10.705 770 H ILE 7 H ILE 97 2.897 3.235 15.915 771 HA ILE 7 HA ILE 97 0.947 5.292 16.460 772 HB ILE 7 HB ILE 97 2.430 3.552 18.518 773 1HG1 ILE 7 1HG1 ILE 97 -0.265 2.992 17.152 774 2HG1 ILE 7 2HG1 ILE 97 1.207 2.318 16.573 775 1HG2 ILE 7 2HG2 ILE 97 1.153 5.447 19.630 776 2HG2 ILE 7 3HG2 ILE 97 -0.315 4.893 18.816 777 3HG2 ILE 7 1HG2 ILE 97 0.469 3.865 20.021 778 1HD1 ILE 7 3HD1 ILE 97 1.621 1.251 18.887 779 2HD1 ILE 7 1HD1 ILE 97 -0.069 1.588 19.204 780 3HD1 ILE 7 2HD1 ILE 97 0.377 0.565 17.807 781 H ASN 8 H ASN 98 4.273 4.973 17.645 782 HA ASN 8 HA ASN 98 4.303 7.605 18.990 783 1HB ASN 8 1HB ASN 98 6.752 5.979 17.956 784 2HB ASN 8 2HB ASN 98 6.863 7.364 19.016 785 1HD2 ASN 8 2HD2 ASN 98 6.224 3.772 20.760 786 2HD2 ASN 8 1HD2 ASN 98 6.482 3.981 18.955 787 H ALA 9 H ALA 99 4.634 6.900 15.619 788 HA ALA 9 HA ALA 99 5.935 9.494 14.835 789 1HB ALA 9 2HB ALA 99 5.673 7.385 13.187 790 2HB ALA 9 3HB ALA 99 3.943 7.731 13.157 791 3HB ALA 9 1HB ALA 99 5.020 8.933 12.519 792 H VAL 10 H VAL 100 2.607 8.217 15.141 793 HA VAL 10 HA VAL 100 1.369 10.517 14.016 794 HB VAL 10 HB VAL 100 -0.320 8.655 15.622 795 1HG1 VAL 10 3HG2 VAL 100 -1.037 10.645 14.057 796 2HG1 VAL 10 1HG2 VAL 100 -0.709 9.472 12.754 797 3HG1 VAL 10 2HG2 VAL 100 -1.916 9.074 13.998 798 1HG2 VAL 10 1HG1 VAL 100 1.266 7.858 13.151 799 2HG2 VAL 10 2HG1 VAL 100 1.095 7.077 14.753 800 3HG2 VAL 10 3HG1 VAL 100 -0.286 7.034 13.608 801 H ALA 11 H ALA 101 1.523 9.214 17.098 802 HA ALA 11 HA ALA 101 0.359 11.488 18.300 803 1HB ALA 11 2HB ALA 101 0.364 9.244 19.447 804 2HB ALA 11 3HB ALA 101 2.132 9.331 19.653 805 3HB ALA 11 1HB ALA 101 1.060 10.447 20.560 806 H GLU 12 H GLU 102 3.676 11.035 17.350 807 HA GLU 12 HA GLU 102 4.635 13.398 18.930 808 1HB GLU 12 1HB GLU 102 6.228 11.523 18.405 809 2HB GLU 12 2HB GLU 102 6.061 11.849 16.688 810 1HG GLU 12 1HG GLU 102 8.158 12.773 17.448 811 2HG GLU 12 2HG GLU 102 7.128 14.121 17.012 812 HE2 GLU 12 HE2 GLU 102 7.058 15.507 20.171 813 H THR 13 H THR 103 3.867 12.752 15.436 814 HA THR 13 HA THR 103 4.120 15.605 14.785 815 HB THR 13 HB THR 103 3.012 15.026 12.554 816 HG1 THR 13 HG1 THR 103 2.296 12.927 12.322 817 1HG2 THR 13 1HG2 THR 103 5.038 12.828 13.244 818 2HG2 THR 13 2HG2 THR 103 4.421 13.245 11.634 819 3HG2 THR 13 3HG2 THR 103 5.406 14.425 12.537 820 H SER 14 H SER 104 1.724 14.294 16.275 821 HA SER 14 HA SER 104 -0.340 16.465 15.441 822 1HB SER 14 1HB SER 104 -1.139 13.590 16.176 823 2HB SER 14 2HB SER 104 -2.226 14.884 15.682 824 HG SER 14 HG SER 104 -0.126 13.765 14.139 825 H GLY 15 H GLY 105 0.798 14.530 18.242 826 1HA GLY 15 1HA GLY 105 0.343 14.773 20.558 827 2HA GLY 15 2HA GLY 105 -0.214 16.417 20.245 828 H LEU 16 H LEU 106 -1.380 13.239 19.262 829 HA LEU 16 HA LEU 106 -4.132 13.590 20.452 830 1HB LEU 16 1HB LEU 106 -4.858 11.759 19.096 831 2HB LEU 16 2HB LEU 106 -4.430 13.237 18.261 832 HG LEU 16 HG LEU 106 -2.452 12.433 17.470 833 1HD1 LEU 16 2HD1 LEU 106 -1.643 11.079 19.443 834 2HD1 LEU 16 3HD1 LEU 106 -2.801 9.817 18.907 835 3HD1 LEU 16 1HD1 LEU 106 -1.377 10.305 17.881 836 1HD2 LEU 16 2HD2 LEU 106 -3.808 12.014 15.844 837 2HD2 LEU 16 3HD2 LEU 106 -2.340 11.008 15.908 838 3HD2 LEU 16 1HD2 LEU 106 -3.873 10.295 16.361 839 H SER 17 H SER 107 -3.573 10.680 20.476 840 HA SER 17 HA SER 107 -2.246 10.343 23.212 841 1HB SER 17 1HB SER 107 -4.836 8.842 22.628 842 2HB SER 17 2HB SER 107 -3.845 8.757 24.063 843 HG SER 17 HG SER 107 -4.252 10.955 24.446 844 H LYS 18 H LYS 108 -1.465 8.215 23.587 845 HA LYS 18 HA LYS 108 -0.290 6.824 21.186 846 1HB LYS 18 1HB LYS 108 -0.240 5.898 24.117 847 2HB LYS 18 2HB LYS 108 0.596 5.106 22.796 848 1HG LYS 18 1HG LYS 108 1.154 7.988 23.741 849 2HG LYS 18 2HG LYS 108 2.054 6.571 24.246 850 1HD LYS 18 1HD LYS 108 2.911 6.175 21.944 851 2HD LYS 18 2HD LYS 108 1.869 7.423 21.291 852 1HE LYS 18 1HE LYS 108 4.078 8.361 21.415 853 2HE LYS 18 2HE LYS 108 3.077 9.205 22.591 854 1HZ LYS 18 1HZ LYS 108 4.974 7.003 23.218 855 2HZ LYS 18 2HZ LYS 108 4.050 7.778 24.322 856 H LYS 19 H LYS 109 -2.868 6.082 23.510 857 HA LYS 19 HA LYS 109 -3.921 3.726 22.113 858 1HB LYS 19 2HB LYS 109 -4.487 4.317 24.482 859 2HB LYS 19 1HB LYS 109 -5.406 5.719 23.936 860 1HG LYS 19 1HG LYS 109 -6.951 4.041 24.509 861 2HG LYS 19 2HG LYS 109 -7.049 4.162 22.774 862 1HD LYS 19 1HD LYS 109 -5.310 1.994 24.137 863 2HD LYS 19 2HD LYS 109 -7.054 1.822 24.046 864 1HE LYS 19 1HE LYS 109 -6.992 1.951 21.525 865 2HE LYS 19 2HE LYS 109 -5.236 2.093 21.563 866 1HZ LYS 19 1HZ LYS 109 -5.109 -0.050 22.638 867 2HZ LYS 19 2HZ LYS 109 -5.884 -0.155 21.203 868 H ASP 20 H ASP 110 -4.542 7.284 21.598 869 HA ASP 20 HA ASP 110 -6.660 6.760 19.519 870 1HB ASP 20 1HB ASP 110 -5.153 9.317 20.322 871 2HB ASP 20 2HB ASP 110 -6.124 9.283 18.875 872 HD1 ASP 20 HD2 ASP 110 -9.201 9.342 20.366 873 H ALA 21 H ALA 111 -3.160 7.124 19.422 874 HA ALA 21 HA ALA 111 -2.971 7.256 16.451 875 1HB ALA 21 1HB ALA 111 -0.885 7.004 18.697 876 2HB ALA 21 2HB ALA 111 -0.467 6.897 16.961 877 3HB ALA 21 3HB ALA 111 -1.220 8.324 17.605 878 H THR 22 H THR 112 -2.715 4.576 18.868 879 HA THR 22 HA THR 112 -2.207 2.393 17.055 880 HB THR 22 HB THR 112 -4.048 2.195 19.525 881 HG1 THR 22 HG1 THR 112 -2.274 3.436 20.101 882 1HG2 THR 22 2HG2 THR 112 -1.869 0.382 18.327 883 2HG2 THR 22 3HG2 THR 112 -2.744 0.058 19.849 884 3HG2 THR 22 1HG2 THR 112 -3.625 0.089 18.280 885 H LYS 23 H LYS 113 -5.263 3.695 18.156 886 HA LYS 23 HA LYS 113 -7.101 2.126 16.493 887 1HB LYS 23 2HB LYS 113 -7.152 5.038 17.641 888 2HB LYS 23 1HB LYS 113 -8.532 4.423 16.813 889 1HG LYS 23 1HG LYS 113 -8.862 2.573 18.486 890 2HG LYS 23 2HG LYS 113 -7.417 3.073 19.362 891 1HD LYS 23 1HD LYS 113 -8.456 5.316 19.848 892 2HD LYS 23 2HD LYS 113 -9.898 4.855 18.939 893 1HE LYS 23 1HE LYS 113 -10.356 2.977 20.568 894 2HE LYS 23 2HE LYS 113 -8.896 3.394 21.476 895 1HZ LYS 23 1HZ LYS 113 -9.836 5.563 21.929 896 2HZ LYS 23 2HZ LYS 113 -10.820 4.376 22.471 897 H ALA 24 H ALA 114 -5.835 5.337 15.996 898 HA ALA 24 HA ALA 114 -7.018 5.955 13.495 899 1HB ALA 24 3HB ALA 114 -4.446 6.966 14.743 900 2HB ALA 24 1HB ALA 114 -5.298 7.744 13.366 901 3HB ALA 24 2HB ALA 114 -6.118 7.599 14.946 902 H VAL 25 H VAL 115 -3.932 4.323 14.005 903 HA VAL 25 HA VAL 115 -3.231 3.840 11.105 904 HB VAL 25 HB VAL 115 -2.654 2.739 14.043 905 1HG1 VAL 25 2HG2 VAL 115 -1.618 1.266 11.553 906 2HG1 VAL 25 3HG2 VAL 115 -1.027 1.038 13.237 907 3HG1 VAL 25 1HG2 VAL 115 -2.681 0.626 12.813 908 1HG2 VAL 25 3HG1 VAL 115 -0.805 3.916 11.934 909 2HG2 VAL 25 1HG1 VAL 115 -1.466 4.759 13.356 910 3HG2 VAL 25 2HG1 VAL 115 -0.343 3.413 13.601 911 H ASP 26 H ASP 116 -4.807 1.670 13.578 912 HA ASP 26 HA ASP 116 -6.041 0.036 11.359 913 1HB ASP 26 1HB ASP 116 -5.315 -0.749 13.754 914 2HB ASP 26 2HB ASP 116 -6.794 0.014 14.339 915 HD1 ASP 26 HD2 ASP 116 -6.836 -3.420 12.112 916 H ALA 27 H ALA 117 -6.636 2.782 11.746 917 HA ALA 27 HA ALA 117 -9.601 2.881 11.085 918 1HB ALA 27 2HB ALA 117 -8.794 4.424 12.971 919 2HB ALA 27 3HB ALA 117 -7.858 5.256 11.716 920 3HB ALA 27 1HB ALA 117 -9.594 5.128 11.558 921 H VAL 28 H VAL 118 -6.459 4.053 9.997 922 HA VAL 28 HA VAL 118 -7.292 4.739 7.234 923 HB VAL 28 HB VAL 118 -4.401 3.806 7.979 924 1HG1 VAL 28 1HG2 VAL 118 -5.742 4.973 5.586 925 2HG1 VAL 28 2HG2 VAL 118 -4.212 5.752 6.012 926 3HG1 VAL 28 3HG2 VAL 118 -4.243 3.987 5.789 927 1HG2 VAL 28 1HG1 VAL 118 -5.452 6.572 8.321 928 2HG2 VAL 28 2HG1 VAL 118 -4.561 5.452 9.444 929 3HG2 VAL 28 3HG1 VAL 118 -3.710 6.124 8.053 930 H PHE 29 H PHE 119 -5.286 2.192 8.487 931 HA PHE 29 HA PHE 119 -5.398 0.390 6.186 932 1HB PHE 29 2HB PHE 119 -4.327 -0.246 8.971 933 2HB PHE 29 1HB PHE 119 -3.961 -1.132 7.501 934 HD1 PHE 29 HD2 PHE 119 -3.103 0.495 5.426 935 HD2 PHE 29 HD1 PHE 119 -2.642 1.311 9.609 936 HE1 PHE 29 HE2 PHE 119 -1.418 2.198 4.903 937 HE2 PHE 29 HE1 PHE 119 -1.017 3.051 9.092 938 HZ PHE 29 HZ PHE 119 -0.414 3.512 6.710 939 H ASP 30 H ASP 120 -7.643 0.587 8.866 940 HA ASP 30 HA ASP 120 -8.655 -2.197 8.326 941 1HB ASP 30 1HB ASP 120 -8.772 -0.854 10.578 942 2HB ASP 30 2HB ASP 120 -10.168 -0.034 9.921 943 HD1 ASP 30 HD2 ASP 120 -12.339 -2.716 10.196 944 H SER 31 H SER 121 -9.427 1.038 7.512 945 HA SER 31 HA SER 121 -11.934 0.455 5.926 946 1HB SER 31 2HB SER 121 -10.227 3.013 5.924 947 2HB SER 31 1HB SER 121 -11.775 2.797 5.079 948 HG SER 31 HG SER 121 -12.719 2.305 7.094 949 H ILE 32 H ILE 122 -8.350 0.855 4.987 950 HA ILE 32 HA ILE 122 -8.641 0.539 2.259 951 HB ILE 32 HB ILE 122 -6.268 -0.509 3.829 952 1HG1 ILE 32 1HG1 ILE 122 -7.332 2.289 3.461 953 2HG1 ILE 32 2HG1 ILE 122 -6.710 1.384 4.825 954 1HG2 ILE 32 1HG2 ILE 122 -6.592 -0.757 1.166 955 2HG2 ILE 32 2HG2 ILE 122 -6.509 0.996 1.173 956 3HG2 ILE 32 3HG2 ILE 122 -5.093 0.061 1.682 957 1HD1 ILE 32 2HD1 ILE 122 -4.772 2.324 2.756 958 2HD1 ILE 32 3HD1 ILE 122 -5.427 3.353 4.065 959 3HD1 ILE 32 1HD1 ILE 122 -4.545 1.863 4.497 960 H THR 33 H THR 123 -7.946 -1.944 4.691 961 HA THR 33 HA THR 123 -8.094 -4.296 2.891 962 HB THR 33 HB THR 123 -7.083 -4.559 4.919 963 HG1 THR 33 HG1 THR 123 -9.436 -6.100 4.955 964 1HG2 THR 33 2HG2 THR 123 -8.537 -2.996 6.323 965 2HG2 THR 33 3HG2 THR 123 -9.692 -4.290 6.538 966 3HG2 THR 33 1HG2 THR 123 -8.005 -4.439 7.176 967 H GLU 34 H GLU 124 -10.641 -2.495 4.387 968 HA GLU 34 HA GLU 124 -12.831 -4.340 3.423 969 1HB GLU 34 1HB GLU 124 -12.929 -1.506 4.680 970 2HB GLU 34 2HB GLU 124 -14.357 -2.310 4.062 971 1HG GLU 34 1HG GLU 124 -14.098 -4.190 5.693 972 2HG GLU 34 2HG GLU 124 -12.618 -3.481 6.328 973 HE1 GLU 34 HE2 GLU 124 -14.159 -0.934 8.116 974 H ALA 35 H ALA 125 -11.026 -1.537 2.213 975 HA ALA 35 HA ALA 125 -12.859 -1.159 -0.070 976 1HB ALA 35 2HB ALA 125 -11.104 0.794 0.566 977 2HB ALA 35 3HB ALA 125 -9.822 -0.295 0.048 978 3HB ALA 35 1HB ALA 125 -10.949 0.313 -1.128 979 H LEU 36 H LEU 126 -9.462 -2.629 0.134 980 HA LEU 36 HA LEU 126 -9.532 -3.774 -2.513 981 1HB LEU 36 2HB LEU 126 -8.056 -4.583 -0.063 982 2HB LEU 36 1HB LEU 126 -7.536 -4.853 -1.717 983 HG LEU 36 HG LEU 126 -7.801 -2.033 -0.514 984 1HD1 LEU 36 3HD1 LEU 126 -5.521 -2.984 -0.168 985 2HD1 LEU 36 1HD1 LEU 126 -5.353 -2.703 -1.976 986 3HD1 LEU 36 2HD1 LEU 126 -5.763 -1.350 -0.864 987 1HD2 LEU 36 2HD2 LEU 126 -7.824 -2.260 -3.306 988 2HD2 LEU 36 3HD2 LEU 126 -8.852 -1.374 -2.164 989 3HD2 LEU 36 1HD2 LEU 126 -7.213 -0.836 -2.443 990 NH1 ARG 37 NH2 ARG 127 -14.739 -9.582 3.998 991 NH2 ARG 37 NH1 ARG 127 -13.088 -11.028 4.593 992 H ARG 37 H ARG 127 -10.535 -5.217 0.674 993 HA ARG 37 HA ARG 127 -10.908 -7.723 -0.587 994 1HB ARG 37 1HB ARG 127 -11.735 -8.757 1.241 995 2HB ARG 37 2HB ARG 127 -10.690 -7.526 1.900 996 1HG ARG 37 1HG ARG 127 -12.993 -6.117 2.083 997 2HG ARG 37 2HG ARG 127 -13.773 -7.669 1.851 998 1HD ARG 37 1HD ARG 127 -11.847 -6.856 4.058 999 2HD ARG 37 2HD ARG 127 -13.604 -7.038 4.195 1000 1HH1 ARG 37 2HH2 ARG 127 -14.993 -8.628 3.718 1001 2HH1 ARG 37 1HH2 ARG 127 -15.375 -10.378 4.114 1002 1HH2 ARG 37 1HH1 ARG 127 -12.089 -11.179 4.769 1003 2HH2 ARG 37 2HH1 ARG 127 -13.838 -11.725 4.669 1004 H LYS 38 H LYS 128 -12.971 -4.875 -0.561 1005 HA LYS 38 HA LYS 128 -15.464 -6.442 -1.312 1006 1HB LYS 38 1HB LYS 128 -15.145 -3.477 -0.642 1007 2HB LYS 38 2HB LYS 128 -16.653 -4.193 -1.172 1008 1HG LYS 38 1HG LYS 128 -16.789 -5.670 0.806 1009 2HG LYS 38 2HG LYS 128 -15.210 -5.134 1.364 1010 1HD LYS 38 1HD LYS 128 -16.193 -2.692 1.377 1011 2HD LYS 38 2HD LYS 128 -17.775 -3.439 1.144 1012 1HE LYS 38 1HE LYS 128 -17.401 -4.794 3.285 1013 2HE LYS 38 2HE LYS 128 -15.823 -4.017 3.480 1014 1HZ LYS 38 1HZ LYS 128 -17.541 -2.944 4.784 1015 2HZ LYS 38 2HZ LYS 128 -18.447 -2.628 3.460 1016 H GLY 39 H GLY 129 -12.891 -5.181 -3.033 1017 1HA GLY 39 1HA GLY 129 -12.659 -4.696 -5.400 1018 2HA GLY 39 2HA GLY 129 -14.387 -4.870 -5.622 1019 H ASP 40 H ASP 130 -12.716 -2.724 -3.379 1020 HA ASP 40 HA ASP 130 -13.668 -0.211 -4.836 1021 1HB ASP 40 1HB ASP 130 -13.200 -0.291 -1.891 1022 2HB ASP 40 2HB ASP 130 -13.913 0.975 -2.832 1023 HD2 ASP 40 HD2 ASP 130 -14.689 -0.700 -0.631 1024 H LYS 41 H LYS 131 -12.418 1.389 -5.277 1025 HA LYS 41 HA LYS 131 -9.427 1.127 -4.910 1026 1HB LYS 41 2HB LYS 131 -10.921 3.484 -6.167 1027 2HB LYS 41 1HB LYS 131 -9.191 3.216 -6.211 1028 1HG LYS 41 1HG LYS 131 -9.331 2.087 -8.126 1029 2HG LYS 41 2HG LYS 131 -10.307 0.831 -7.413 1030 1HD LYS 41 1HD LYS 131 -11.399 3.457 -8.631 1031 2HD LYS 41 2HD LYS 131 -11.260 1.928 -9.489 1032 1HE LYS 41 1HE LYS 131 -12.873 0.840 -7.838 1033 2HE LYS 41 2HE LYS 131 -13.051 2.393 -7.008 1034 1HZ LYS 41 1HZ LYS 131 -14.803 2.009 -8.604 1035 2HZ LYS 41 2HZ LYS 131 -13.745 1.853 -9.840 1036 H VAL 42 H VAL 132 -8.309 2.275 -3.295 1037 HA VAL 42 HA VAL 132 -9.577 3.821 -1.278 1038 HB VAL 42 HB VAL 132 -6.715 3.049 -1.945 1039 1HG1 VAL 42 3HG2 VAL 132 -7.008 4.599 0.012 1040 2HG1 VAL 42 1HG2 VAL 132 -8.098 3.383 0.758 1041 3HG1 VAL 42 2HG2 VAL 132 -6.378 2.981 0.453 1042 1HG2 VAL 42 3HG1 VAL 132 -8.452 0.966 -1.750 1043 2HG2 VAL 42 1HG1 VAL 132 -7.007 0.931 -0.773 1044 3HG2 VAL 42 2HG1 VAL 132 -8.539 1.404 -0.038 1045 H GLN 43 H GLN 133 -6.957 5.227 -1.795 1046 HA GLN 43 HA GLN 133 -6.413 6.663 -3.527 1047 1HB GLN 43 1HB GLN 133 -8.967 8.069 -3.596 1048 2HB GLN 43 2HB GLN 133 -7.547 8.956 -4.120 1049 1HG GLN 43 1HG GLN 133 -6.907 7.206 -5.689 1050 2HG GLN 43 2HG GLN 133 -8.181 6.141 -5.152 1051 1HE2 GLN 43 2HE2 GLN 133 -9.882 7.382 -8.077 1052 2HE2 GLN 43 1HE2 GLN 133 -8.954 6.012 -7.288 1053 H LEU 44 H LEU 134 -4.419 6.861 -2.392 1054 HA LEU 44 HA LEU 134 -4.352 9.232 -0.481 1055 1HB LEU 44 2HB LEU 134 -1.893 7.632 -1.129 1056 2HB LEU 44 1HB LEU 134 -2.171 8.715 0.211 1057 HG LEU 44 HG LEU 134 -3.567 5.982 -0.186 1058 1HD1 LEU 44 3HD1 LEU 134 -1.146 6.765 1.542 1059 2HD1 LEU 44 1HD1 LEU 134 -2.022 5.225 1.681 1060 3HD1 LEU 44 2HD1 LEU 134 -1.181 5.622 0.174 1061 1HD2 LEU 44 2HD2 LEU 134 -3.568 7.854 2.257 1062 2HD2 LEU 44 3HD2 LEU 134 -4.959 7.491 1.198 1063 3HD2 LEU 44 1HD2 LEU 134 -4.258 6.208 2.204 1064 H ILE 45 H ILE 135 -4.325 11.162 -1.546 1065 HA ILE 45 HA ILE 135 -3.099 11.414 -4.246 1066 HB ILE 45 HB ILE 135 -5.244 12.516 -3.683 1067 1HG1 ILE 45 1HG1 ILE 135 -3.128 14.451 -4.790 1068 2HG1 ILE 45 2HG1 ILE 135 -3.760 13.077 -5.680 1069 1HG2 ILE 45 3HG2 ILE 135 -4.604 13.446 -1.431 1070 2HG2 ILE 45 1HG2 ILE 135 -3.530 14.620 -2.228 1071 3HG2 ILE 45 2HG2 ILE 135 -5.298 14.684 -2.506 1072 1HD1 ILE 45 3HD1 ILE 135 -6.106 14.025 -5.550 1073 2HD1 ILE 45 1HD1 ILE 135 -5.455 15.469 -4.728 1074 3HD1 ILE 45 2HD1 ILE 135 -4.956 15.092 -6.391 1075 H GLY 46 H GLY 136 -1.376 12.701 -4.742 1076 1HA GLY 46 1HA GLY 136 0.969 13.229 -4.549 1077 2HA GLY 46 2HA GLY 136 0.582 13.865 -2.970 1078 H PHE 47 H PHE 137 -0.104 10.576 -2.822 1079 HA PHE 47 HA PHE 137 2.679 9.672 -2.095 1080 1HB PHE 47 2HB PHE 137 1.218 10.579 -0.201 1081 2HB PHE 47 1HB PHE 137 0.079 9.282 -0.437 1082 HD1 PHE 47 HD1 PHE 137 0.735 6.879 -0.023 1083 HD2 PHE 47 HD2 PHE 137 3.522 10.055 0.794 1084 HE1 PHE 47 HE1 PHE 137 2.321 5.257 0.906 1085 HE2 PHE 47 HE2 PHE 137 5.063 8.390 1.776 1086 HZ PHE 47 HZ PHE 137 4.563 6.020 1.624 1087 H GLY 48 H GLY 138 -0.717 8.418 -2.849 1088 1HA GLY 48 1HA GLY 138 0.155 6.348 -4.375 1089 2HA GLY 48 2HA GLY 138 0.277 5.621 -2.803 1090 H ASN 49 H ASN 139 -1.414 5.533 -5.414 1091 HA ASN 49 HA ASN 139 -4.247 5.453 -4.249 1092 1HB ASN 49 1HB ASN 139 -3.994 6.757 -6.303 1093 2HB ASN 49 2HB ASN 139 -3.247 5.414 -7.151 1094 1HD2 ASN 49 2HD2 ASN 139 -6.659 5.361 -8.449 1095 2HD2 ASN 49 1HD2 ASN 139 -5.044 6.216 -8.611 1096 H PHE 50 H PHE 140 -4.636 3.547 -3.307 1097 HA PHE 50 HA PHE 140 -3.419 0.949 -4.299 1098 1HB PHE 50 2HB PHE 140 -5.481 1.331 -2.094 1099 2HB PHE 50 1HB PHE 140 -4.856 -0.200 -2.513 1100 HD1 PHE 50 HD2 PHE 140 -4.230 3.060 -0.986 1101 HD2 PHE 50 HD1 PHE 140 -3.153 -1.076 -1.170 1102 HE1 PHE 50 HE2 PHE 140 -2.922 3.294 1.121 1103 HE2 PHE 50 HE1 PHE 140 -1.850 -0.808 0.930 1104 HZ PHE 50 HZ PHE 140 -1.616 1.415 1.915 1105 H GLU 51 H GLU 141 -4.635 -0.696 -5.039 1106 HA GLU 51 HA GLU 141 -7.415 -0.856 -4.906 1107 1HB GLU 51 1HB GLU 141 -8.225 -0.629 -7.311 1108 2HB GLU 51 2HB GLU 141 -7.587 0.889 -6.775 1109 1HG GLU 51 1HG GLU 141 -5.973 -1.094 -8.523 1110 2HG GLU 51 2HG GLU 141 -7.012 0.158 -9.173 1111 HE2 GLU 51 HE2 GLU 141 -3.317 1.019 -7.993 1112 H VAL 52 H VAL 142 -8.469 -2.740 -6.180 1113 HA VAL 52 HA VAL 142 -6.491 -4.923 -5.963 1114 HB VAL 52 HB VAL 142 -8.919 -4.176 -4.670 1115 1HG1 VAL 52 1HG2 VAL 142 -9.684 -6.267 -6.727 1116 2HG1 VAL 52 2HG2 VAL 142 -10.585 -5.824 -5.232 1117 3HG1 VAL 52 3HG2 VAL 142 -10.320 -4.624 -6.538 1118 1HG2 VAL 52 2HG1 VAL 142 -7.183 -5.506 -3.734 1119 2HG2 VAL 52 3HG1 VAL 142 -8.751 -6.262 -3.531 1120 3HG2 VAL 52 1HG1 VAL 142 -7.644 -6.912 -4.740 1121 NH1 ARG 53 NH2 ARG 143 -1.579 -8.910 -12.985 1122 NH2 ARG 53 NH1 ARG 143 -2.757 -9.187 -14.910 1123 H ARG 53 H ARG 143 -6.723 -6.841 -7.237 1124 HA ARG 53 HA ARG 143 -7.590 -6.295 -10.154 1125 1HB ARG 53 1HB ARG 143 -5.072 -6.243 -9.713 1126 2HB ARG 53 2HB ARG 143 -5.167 -7.917 -9.216 1127 1HG ARG 53 1HG ARG 143 -6.069 -8.543 -11.514 1128 2HG ARG 53 2HG ARG 143 -5.911 -6.853 -12.009 1129 1HD ARG 53 1HD ARG 143 -3.413 -6.954 -11.554 1130 2HD ARG 53 2HD ARG 143 -3.583 -8.633 -11.011 1131 1HH1 ARG 53 2HH2 ARG 143 -1.583 -8.608 -12.005 1132 2HH1 ARG 53 1HH2 ARG 143 -0.781 -9.283 -13.510 1133 1HH2 ARG 53 1HH1 ARG 143 -3.655 -9.100 -15.398 1134 2HH2 ARG 53 2HH1 ARG 143 -1.877 -9.542 -15.300 1135 H GLU 54 H GLU 144 -9.567 -7.254 -9.959 1136 HA GLU 54 HA GLU 144 -10.073 -9.820 -8.639 1137 1HB GLU 54 1HB GLU 144 -12.318 -9.770 -9.469 1138 2HB GLU 54 2HB GLU 144 -11.836 -8.269 -8.711 1139 1HG GLU 54 1HG GLU 144 -11.570 -7.197 -11.015 1140 2HG GLU 54 2HG GLU 144 -12.100 -8.700 -11.765 1141 HE1 GLU 54 HE2 GLU 144 -15.449 -8.311 -11.033 1142 NH1 ARG 55 NH2 ARG 145 -4.923 -11.799 -13.067 1143 NH2 ARG 55 NH1 ARG 145 -3.827 -11.777 -11.076 1144 H ARG 55 H ARG 145 -9.560 -11.747 -9.246 1145 HA ARG 55 HA ARG 145 -8.598 -12.361 -11.996 1146 1HB ARG 55 1HB ARG 145 -7.581 -13.228 -9.756 1147 2HB ARG 55 2HB ARG 145 -8.921 -14.345 -9.663 1148 1HG ARG 55 1HG ARG 145 -7.007 -15.510 -10.548 1149 2HG ARG 55 2HG ARG 145 -8.183 -15.398 -11.838 1150 1HD ARG 55 1HD ARG 145 -5.923 -15.006 -12.726 1151 2HD ARG 55 2HD ARG 145 -6.900 -13.560 -12.931 1152 1HH1 ARG 55 2HH2 ARG 145 -5.617 -12.258 -13.667 1153 2HH1 ARG 55 1HH2 ARG 145 -4.367 -10.967 -13.294 1154 1HH2 ARG 55 1HH1 ARG 145 -3.686 -12.214 -10.159 1155 2HH2 ARG 55 2HH1 ARG 145 -3.349 -10.946 -11.441 1156 H ALA 56 H ALA 146 -9.563 -13.635 -13.491 1157 HA ALA 56 HA ALA 146 -12.482 -13.738 -13.544 1158 1HB ALA 56 3HB ALA 146 -11.145 -13.333 -15.580 1159 2HB ALA 56 1HB ALA 146 -10.479 -14.986 -15.523 1160 3HB ALA 56 2HB ALA 146 -12.217 -14.726 -15.803 1161 H ALA 57 H ALA 147 -13.448 -15.113 -12.178 1162 HA ALA 57 HA ALA 147 -12.961 -17.736 -11.441 1163 1HB ALA 57 1HB ALA 147 -14.881 -16.334 -10.559 1164 2HB ALA 57 2HB ALA 147 -15.760 -16.535 -12.094 1165 3HB ALA 57 3HB ALA 147 -15.489 -17.929 -11.034 1166 NH1 ARG 58 NH2 ARG 148 -10.105 -18.439 -17.864 1167 NH2 ARG 58 NH1 ARG 148 -12.017 -17.345 -17.301 1168 H ARG 58 H ARG 148 -13.072 -19.710 -11.951 1169 HA ARG 58 HA ARG 148 -13.406 -20.226 -14.870 1170 1HB ARG 58 2HB ARG 148 -11.811 -21.901 -12.876 1171 2HB ARG 58 1HB ARG 148 -11.809 -22.144 -14.609 1172 1HG ARG 58 1HG ARG 148 -10.689 -19.643 -13.194 1173 2HG ARG 58 2HG ARG 148 -9.785 -21.080 -13.581 1174 1HD ARG 58 1HD ARG 148 -9.248 -19.502 -15.292 1175 2HD ARG 58 2HD ARG 148 -10.221 -20.761 -16.056 1176 1HH1 ARG 58 2HH2 ARG 148 -9.400 -19.137 -17.602 1177 2HH1 ARG 58 1HH2 ARG 148 -10.129 -17.882 -18.725 1178 1HH2 ARG 58 1HH1 ARG 148 -12.768 -17.207 -16.615 1179 2HH2 ARG 58 2HH1 ARG 148 -11.911 -16.864 -18.201 1180 H LYS 59 H LYS 149 -13.526 -23.036 -14.777 1181 HA LYS 59 HA LYS 149 -15.850 -23.872 -13.083 1182 1HB LYS 59 1HB LYS 149 -16.897 -22.887 -15.243 1183 2HB LYS 59 2HB LYS 149 -16.152 -24.206 -16.134 1184 1HG LYS 59 1HG LYS 149 -17.442 -25.838 -14.518 1185 2HG LYS 59 2HG LYS 149 -18.203 -24.416 -13.831 1186 1HD LYS 59 1HD LYS 149 -19.785 -25.267 -15.348 1187 2HD LYS 59 2HD LYS 149 -19.140 -23.846 -16.158 1188 1HE LYS 59 1HE LYS 149 -17.650 -25.351 -17.586 1189 2HE LYS 59 2HE LYS 149 -18.253 -26.771 -16.720 1190 1HZ LYS 59 1HZ LYS 149 -19.888 -24.915 -18.358 1191 2HZ LYS 59 2HZ LYS 149 -19.400 -26.411 -18.801 1192 H GLY 60 H GLY 150 -15.584 -25.943 -12.474 1193 1HA GLY 60 1HA GLY 150 -13.519 -27.722 -13.895 1194 2HA GLY 60 2HA GLY 150 -13.414 -27.511 -12.158 1195 NH1 ARG 61 NH2 ARG 151 -22.284 -27.057 -15.142 1196 NH2 ARG 61 NH1 ARG 151 -21.837 -26.583 -12.962 1197 H ARG 61 H ARG 151 -14.692 -29.399 -14.442 1198 HA ARG 61 HA ARG 151 -16.835 -30.562 -12.678 1199 1HB ARG 61 1HB ARG 151 -17.957 -28.655 -13.553 1200 2HB ARG 61 2HB ARG 151 -17.414 -28.897 -15.200 1201 1HG ARG 61 1HG ARG 151 -18.933 -30.826 -15.480 1202 2HG ARG 61 2HG ARG 151 -19.436 -30.778 -13.812 1203 1HD ARG 61 1HD ARG 151 -19.911 -28.565 -15.927 1204 2HD ARG 61 2HD ARG 151 -21.104 -29.752 -15.391 1205 1HH1 ARG 61 2HH2 ARG 151 -22.072 -27.636 -15.962 1206 2HH1 ARG 61 1HH2 ARG 151 -22.978 -26.303 -15.085 1207 1HH2 ARG 61 1HH1 ARG 151 -21.287 -26.799 -12.124 1208 2HH2 ARG 61 2HH1 ARG 151 -22.560 -25.861 -13.054 1209 H ASN 62 H ASN 152 -17.326 -32.535 -13.105 1210 HA ASN 62 HA ASN 152 -17.172 -34.674 -13.680 1211 1HB ASN 62 1HB ASN 152 -17.826 -35.420 -15.857 1212 2HB ASN 62 2HB ASN 152 -18.823 -34.217 -15.132 1213 1HD2 ASN 62 2HD2 ASN 152 -17.102 -33.308 -18.706 1214 2HD2 ASN 62 1HD2 ASN 152 -16.328 -34.558 -17.593 1215 HA PRO 63 HA PRO 153 -12.769 -35.799 -14.622 1216 1HB PRO 63 1HB PRO 153 -12.500 -37.602 -12.482 1217 2HB PRO 63 2HB PRO 153 -12.041 -35.889 -12.465 1218 1HG PRO 63 1HG PRO 153 -14.630 -37.139 -11.448 1219 2HG PRO 63 2HG PRO 153 -13.626 -35.907 -10.653 1220 1HD PRO 63 1HD PRO 153 -15.892 -35.191 -12.009 1221 2HD PRO 63 2HD PRO 153 -14.442 -34.157 -12.104 1222 H GLN 64 H GLN 154 -15.233 -38.036 -13.349 1223 HA GLN 64 HA GLN 154 -15.514 -39.377 -16.032 1224 1HB GLN 64 1HB GLN 154 -16.571 -40.670 -13.440 1225 2HB GLN 64 2HB GLN 154 -16.800 -41.220 -15.072 1226 1HG GLN 64 1HG GLN 154 -14.104 -41.129 -13.543 1227 2HG GLN 64 2HG GLN 154 -15.188 -42.502 -13.644 1228 1HE2 GLN 64 2HE2 GLN 154 -12.642 -41.842 -16.791 1229 2HE2 GLN 64 1HE2 GLN 154 -12.726 -40.732 -15.332 1230 H THR 65 H THR 155 -17.659 -39.288 -13.204 1231 HA THR 65 HA THR 155 -18.677 -36.527 -13.840 1232 HB THR 65 HB THR 155 -20.776 -37.133 -13.324 1233 HG1 THR 65 HG1 THR 155 -20.418 -38.562 -11.615 1234 1HG2 THR 65 1HG2 THR 155 -19.904 -38.070 -15.616 1235 2HG2 THR 65 2HG2 THR 155 -19.605 -39.623 -14.820 1236 3HG2 THR 65 3HG2 THR 155 -21.287 -39.075 -15.003 1237 H GLY 66 H GLY 156 -16.654 -37.272 -11.618 1238 1HA GLY 66 1HA GLY 156 -18.274 -37.252 -9.035 1239 2HA GLY 66 2HA GLY 156 -16.532 -37.321 -9.163 1240 H GLU 67 H GLU 157 -18.075 -34.732 -11.016 1241 HA GLU 67 HA GLU 157 -17.749 -32.704 -8.773 1242 1HB GLU 67 2HB GLU 157 -15.555 -33.471 -10.035 1243 2HB GLU 67 1HB GLU 157 -16.157 -32.639 -11.430 1244 1HG GLU 67 1HG GLU 157 -16.162 -30.452 -10.133 1245 2HG GLU 67 2HG GLU 157 -15.643 -31.306 -8.683 1246 HE2 GLU 67 HE2 GLU 157 -13.725 -31.035 -8.332 1247 H GLU 68 H GLU 158 -18.692 -30.781 -9.206 1248 HA GLU 68 HA GLU 158 -19.423 -29.877 -11.837 1249 1HB GLU 68 1HB GLU 158 -21.920 -29.648 -11.670 1250 2HB GLU 68 2HB GLU 158 -21.311 -31.255 -11.973 1251 1HG GLU 68 1HG GLU 158 -21.695 -31.862 -9.519 1252 2HG GLU 68 2HG GLU 158 -22.378 -30.262 -9.250 1253 HE1 GLU 68 HE2 GLU 158 -24.423 -33.145 -11.209 1254 H MET 69 H MET 159 -18.302 -27.974 -11.264 1255 HA MET 69 HA MET 159 -19.753 -26.108 -9.425 1256 1HB MET 69 1HB MET 159 -17.859 -25.735 -7.853 1257 2HB MET 69 2HB MET 159 -18.523 -27.340 -7.743 1258 1HG MET 69 1HG MET 159 -16.103 -27.517 -7.514 1259 2HG MET 69 2HG MET 159 -16.529 -28.252 -9.071 1260 1HE MET 69 1HE MET 159 -14.286 -28.254 -10.026 1261 2HE MET 69 3HE MET 159 -13.154 -26.895 -10.049 1262 3HE MET 69 2HE MET 159 -13.594 -27.648 -8.493 1263 H GLU 70 H GLU 160 -19.188 -24.036 -9.509 1264 HA GLU 70 HA GLU 160 -17.341 -23.086 -11.712 1265 1HB GLU 70 2HB GLU 160 -18.331 -21.003 -11.685 1266 2HB GLU 70 1HB GLU 160 -19.662 -22.147 -11.561 1267 1HG GLU 70 1HG GLU 160 -20.322 -20.426 -10.132 1268 2HG GLU 70 2HG GLU 160 -19.718 -21.625 -9.005 1269 HE2 GLU 70 HE2 GLU 160 -17.756 -19.254 -7.509 1270 H ILE 71 H ILE 161 -15.266 -22.366 -11.198 1271 HA ILE 71 HA ILE 161 -14.357 -22.573 -8.399 1272 HB ILE 71 HB ILE 161 -12.793 -21.957 -10.982 1273 1HG1 ILE 71 1HG1 ILE 161 -13.257 -24.662 -9.570 1274 2HG1 ILE 71 2HG1 ILE 161 -14.004 -24.217 -11.092 1275 1HG2 ILE 71 2HG2 ILE 161 -11.644 -21.357 -8.841 1276 2HG2 ILE 71 3HG2 ILE 161 -11.880 -23.038 -8.258 1277 3HG2 ILE 71 1HG2 ILE 161 -10.843 -22.708 -9.683 1278 1HD1 ILE 71 1HD1 ILE 161 -11.716 -24.110 -12.189 1279 2HD1 ILE 71 2HD1 ILE 161 -11.030 -24.782 -10.668 1280 3HD1 ILE 71 3HD1 ILE 161 -12.204 -25.707 -11.609 1281 HA PRO 72 HA PRO 162 -15.432 -18.075 -8.302 1282 1HB PRO 72 1HB PRO 162 -14.870 -17.471 -5.632 1283 2HB PRO 72 2HB PRO 162 -16.265 -18.407 -6.183 1284 1HG PRO 72 1HG PRO 162 -13.593 -19.487 -5.145 1285 2HG PRO 72 2HG PRO 162 -15.233 -19.947 -4.623 1286 1HD PRO 72 1HD PRO 162 -13.840 -21.440 -6.471 1287 2HD PRO 72 2HD PRO 162 -15.613 -21.242 -6.620 1288 H ALA 73 H ALA 163 -14.580 -15.980 -7.852 1289 HA ALA 73 HA ALA 163 -12.036 -15.411 -9.135 1290 1HB ALA 73 2HB ALA 163 -14.015 -13.746 -8.896 1291 2HB ALA 73 3HB ALA 163 -13.619 -13.589 -7.149 1292 3HB ALA 73 1HB ALA 163 -12.478 -13.033 -8.368 1293 H SER 74 H SER 164 -10.451 -13.938 -8.252 1294 HA SER 74 HA SER 164 -10.343 -13.660 -5.398 1295 1HB SER 74 1HB SER 164 -7.797 -15.010 -6.626 1296 2HB SER 74 2HB SER 164 -7.800 -14.271 -5.023 1297 HG SER 74 HG SER 164 -8.186 -16.479 -4.949 1298 H LYS 75 H LYS 165 -9.996 -11.724 -4.925 1299 HA LYS 75 HA LYS 165 -8.913 -9.711 -6.871 1300 1HB LYS 75 2HB LYS 165 -9.636 -8.814 -4.129 1301 2HB LYS 75 1HB LYS 165 -9.760 -8.032 -5.669 1302 1HG LYS 75 1HG LYS 165 -11.694 -9.557 -6.313 1303 2HG LYS 75 2HG LYS 165 -11.628 -10.260 -4.696 1304 1HD LYS 75 1HD LYS 165 -12.101 -7.947 -3.702 1305 2HD LYS 75 2HD LYS 165 -12.211 -7.313 -5.338 1306 1HE LYS 75 1HE LYS 165 -14.467 -7.655 -4.618 1307 2HE LYS 75 2HE LYS 165 -14.145 -8.874 -5.847 1308 1HZ LYS 75 1HZ LYS 165 -14.127 -9.300 -2.905 1309 2HZ LYS 75 2HZ LYS 165 -15.308 -9.763 -3.935 1310 H VAL 76 H VAL 166 -6.649 -9.028 -6.935 1311 HA VAL 76 HA VAL 166 -4.916 -9.900 -4.801 1312 HB VAL 76 HB VAL 166 -5.226 -9.636 -7.777 1313 1HG1 VAL 76 1HG2 VAL 166 -2.562 -9.023 -6.706 1314 2HG1 VAL 76 2HG2 VAL 166 -3.054 -9.464 -8.426 1315 3HG1 VAL 76 3HG2 VAL 166 -3.668 -7.980 -7.668 1316 1HG2 VAL 76 3HG1 VAL 166 -5.247 -11.792 -6.614 1317 2HG2 VAL 76 1HG1 VAL 166 -3.969 -11.659 -7.842 1318 3HG2 VAL 76 2HG1 VAL 166 -3.550 -11.516 -6.097 1319 HA PRO 77 HA PRO 167 -4.842 -5.372 -3.972 1320 1HB PRO 77 1HB PRO 167 -3.359 -5.396 -1.596 1321 2HB PRO 77 2HB PRO 167 -4.956 -6.149 -1.695 1322 1HG PRO 77 1HG PRO 167 -2.228 -7.509 -1.923 1323 2HG PRO 77 2HG PRO 167 -3.612 -8.014 -0.938 1324 1HD PRO 77 1HD PRO 167 -3.002 -9.028 -3.600 1325 2HD PRO 77 2HD PRO 167 -4.640 -9.068 -2.907 1326 H ALA 78 H ALA 168 -3.864 -3.789 -4.435 1327 HA ALA 78 HA ALA 168 -0.866 -3.706 -5.029 1328 1HB ALA 78 3HB ALA 168 -2.390 -4.250 -7.025 1329 2HB ALA 78 1HB ALA 168 -3.164 -2.663 -6.823 1330 3HB ALA 78 2HB ALA 168 -1.435 -2.760 -7.226 1331 H PHE 79 H PHE 169 -0.140 -1.634 -5.395 1332 HA PHE 79 HA PHE 169 -1.332 0.777 -3.865 1333 1HB PHE 79 2HB PHE 169 -0.529 -0.117 -2.066 1334 2HB PHE 79 1HB PHE 169 0.972 -0.691 -2.869 1335 HD1 PHE 79 HD2 PHE 169 -0.693 2.314 -1.403 1336 HD2 PHE 79 HD1 PHE 169 2.908 0.812 -3.217 1337 HE1 PHE 79 HE2 PHE 169 0.493 4.384 -0.804 1338 HE2 PHE 79 HE1 PHE 169 4.052 2.916 -2.675 1339 HZ PHE 79 HZ PHE 169 2.842 4.719 -1.505 1340 H LYS 80 H LYS 170 -0.931 2.115 -5.301 1341 HA LYS 80 HA LYS 170 1.322 2.382 -7.498 1342 1HB LYS 80 2HB LYS 170 -1.198 4.057 -7.102 1343 2HB LYS 80 1HB LYS 170 0.074 4.360 -8.281 1344 1HG LYS 80 1HG LYS 170 -0.431 2.273 -9.506 1345 2HG LYS 80 2HG LYS 170 -1.551 1.747 -8.259 1346 1HD LYS 80 1HD LYS 170 -2.862 2.537 -10.091 1347 2HD LYS 80 2HD LYS 170 -3.097 3.637 -8.742 1348 1HE LYS 80 1HE LYS 170 -1.495 5.304 -9.828 1349 2HE LYS 80 2HE LYS 170 -1.241 4.177 -11.170 1350 1HZ LYS 80 1HZ LYS 170 -3.859 5.345 -10.393 1351 2HZ LYS 80 2HZ LYS 170 -3.625 4.310 -11.637 1352 HA PRO 81 HA PRO 171 2.928 5.321 -4.346 1353 1HB PRO 81 1HB PRO 171 5.288 6.038 -5.555 1354 2HB PRO 81 2HB PRO 171 4.990 4.400 -4.954 1355 1HG PRO 81 1HG PRO 171 4.713 5.402 -7.842 1356 2HG PRO 81 2HG PRO 171 5.643 3.995 -7.268 1357 1HD PRO 81 1HD PRO 171 3.021 3.814 -8.247 1358 2HD PRO 81 2HD PRO 171 3.663 2.674 -7.021 1359 H GLY 82 H GLY 172 0.773 6.232 -5.955 1360 1HA GLY 82 1HA GLY 172 -0.176 7.896 -7.408 1361 2HA GLY 82 2HA GLY 172 0.512 8.839 -6.101 1362 H LYS 83 H LYS 173 2.801 7.438 -8.192 1363 HA LYS 83 HA LYS 173 4.424 8.379 -9.709 1364 1HB LYS 83 2HB LYS 173 2.090 10.136 -10.405 1365 2HB LYS 83 1HB LYS 173 3.580 10.984 -10.552 1366 1HG LYS 83 1HG LYS 173 4.464 9.102 -12.088 1367 2HG LYS 83 2HG LYS 173 2.931 8.266 -11.885 1368 1HD LYS 83 1HD LYS 173 2.819 9.351 -14.001 1369 2HD LYS 83 2HD LYS 173 1.712 10.222 -12.946 1370 1HE LYS 83 1HE LYS 173 3.464 12.057 -12.643 1371 2HE LYS 83 2HE LYS 173 4.587 11.152 -13.667 1372 1HZ LYS 83 1HZ LYS 173 1.946 12.215 -14.504 1373 2HZ LYS 83 2HZ LYS 173 3.400 12.865 -14.873 1374 H ALA 84 H ALA 174 3.010 10.626 -7.697 1375 HA ALA 84 HA ALA 174 4.950 12.710 -7.229 1376 1HB ALA 84 2HB ALA 174 2.487 12.730 -6.745 1377 2HB ALA 84 3HB ALA 174 2.685 11.423 -5.549 1378 3HB ALA 84 1HB ALA 174 3.396 13.028 -5.226 1379 H LEU 85 H LEU 175 4.302 9.695 -5.218 1380 HA LEU 85 HA LEU 175 6.552 10.178 -3.413 1381 1HB LEU 85 2HB LEU 175 4.648 8.754 -2.681 1382 2HB LEU 85 1HB LEU 175 4.943 7.647 -4.013 1383 HG LEU 85 HG LEU 175 7.275 7.422 -3.095 1384 1HD1 LEU 85 1HD1 LEU 175 7.409 9.244 -1.453 1385 2HD1 LEU 85 2HD1 LEU 175 6.036 8.587 -0.544 1386 3HD1 LEU 85 3HD1 LEU 175 7.589 7.707 -0.586 1387 1HD2 LEU 85 3HD2 LEU 175 5.523 5.598 -2.952 1388 2HD2 LEU 85 1HD2 LEU 175 6.561 5.557 -1.524 1389 3HD2 LEU 85 2HD2 LEU 175 4.927 6.266 -1.416 1390 H LYS 86 H LYS 176 6.112 8.433 -6.480 1391 HA LYS 86 HA LYS 176 8.796 7.308 -6.645 1392 1HB LYS 86 1HB LYS 176 6.728 6.711 -8.121 1393 2HB LYS 86 2HB LYS 176 7.225 8.035 -9.162 1394 1HG LYS 86 1HG LYS 176 9.467 6.925 -9.496 1395 2HG LYS 86 2HG LYS 176 9.025 5.661 -8.345 1396 1HD LYS 86 1HD LYS 176 7.100 4.972 -9.851 1397 2HD LYS 86 2HD LYS 176 7.583 6.209 -11.019 1398 1HE LYS 86 1HE LYS 176 9.848 5.071 -11.280 1399 2HE LYS 86 2HE LYS 176 9.365 3.841 -10.102 1400 1HZ LYS 86 1HZ LYS 176 7.572 3.190 -11.572 1401 2HZ LYS 86 2HZ LYS 176 9.018 3.068 -12.323 1402 H ASP 87 H ASP 177 7.812 10.643 -7.062 1403 HA ASP 87 HA ASP 177 10.423 11.506 -8.210 1404 1HB ASP 87 1HB ASP 177 7.704 12.505 -8.074 1405 2HB ASP 87 2HB ASP 177 8.545 13.495 -6.956 1406 HD1 ASP 87 HD2 ASP 177 10.422 15.169 -9.393 1407 H ALA 88 H ALA 178 8.759 11.606 -5.008 1408 HA ALA 88 HA ALA 178 10.696 12.965 -3.342 1409 1HB ALA 88 3HB ALA 178 8.407 12.023 -2.511 1410 2HB ALA 88 1HB ALA 178 9.082 10.394 -2.596 1411 3HB ALA 88 2HB ALA 178 9.764 11.525 -1.456 1412 H VAL 89 H VAL 179 10.489 9.525 -4.235 1413 HA VAL 89 HA VAL 179 12.808 8.674 -2.670 1414 HB VAL 89 HB VAL 179 10.206 7.942 -2.989 1415 1HG1 VAL 89 2HG2 VAL 179 10.562 7.812 -5.573 1416 2HG1 VAL 89 3HG2 VAL 179 11.317 6.244 -5.260 1417 3HG1 VAL 89 1HG2 VAL 179 9.636 6.569 -4.728 1418 1HG2 VAL 89 3HG1 VAL 179 12.337 5.869 -2.922 1419 2HG2 VAL 89 1HG1 VAL 179 11.582 6.824 -1.580 1420 3HG2 VAL 89 2HG1 VAL 179 10.572 5.717 -2.531 1421 H LYS 90 H LYS 180 12.609 9.764 -5.890 1422 HA LYS 90 HA LYS 180 14.085 7.801 -7.364 1423 1HB LYS 90 1HB LYS 180 12.566 9.953 -8.000 1424 2HB LYS 90 2HB LYS 180 14.071 10.813 -8.050 1425 1HG LYS 90 1HG LYS 180 14.864 9.421 -9.936 1426 2HG LYS 90 2HG LYS 180 13.615 8.216 -9.648 1427 1HD LYS 90 1HD LYS 180 12.897 9.454 -11.564 1428 2HD LYS 90 2HD LYS 180 11.805 9.845 -10.245 1429 1HE LYS 90 1HE LYS 180 13.056 12.049 -9.879 1430 2HE LYS 90 2HE LYS 180 14.135 11.646 -11.224 1431 1HZ LYS 90 1HZ LYS 180 12.170 11.565 -12.666 1432 2HZ LYS 90 2HZ LYS 180 11.185 11.940 -11.417 Start of MODEL 20 Raw file had 1432 H/Q atoms Start of MODEL 20 1 1H MET 1 1H MET 1 -8.943 7.491 2.390 2 2H MET 1 2H MET 1 -10.403 8.207 2.219 3 HA MET 1 HA MET 1 -9.198 6.258 0.416 4 1HB MET 1 1HB MET 1 -11.739 7.758 -0.240 5 2HB MET 1 2HB MET 1 -10.996 6.441 -1.107 6 1HG MET 1 1HG MET 1 -12.367 6.163 1.657 7 2HG MET 1 2HG MET 1 -13.117 5.841 0.098 8 1HE MET 1 1HE MET 1 -11.633 4.130 3.037 9 2HE MET 1 3HE MET 1 -10.556 2.853 2.410 10 3HE MET 1 2HE MET 1 -9.984 4.534 2.460 11 H ASN 2 H ASN 2 -10.126 8.756 -1.455 12 HA ASN 2 HA ASN 2 -8.100 10.087 -2.046 13 1HB ASN 2 1HB ASN 2 -9.367 11.961 -2.957 14 2HB ASN 2 2HB ASN 2 -9.991 10.370 -3.213 15 1HD2 ASN 2 1HD2 ASN 2 -12.270 12.924 -0.907 16 2HD2 ASN 2 2HD2 ASN 2 -10.530 13.303 -1.331 17 H LYS 3 H LYS 3 -8.291 10.187 0.523 18 HA LYS 3 HA LYS 3 -6.699 10.944 2.250 19 1HB LYS 3 1HB LYS 3 -5.292 11.731 0.171 20 2HB LYS 3 2HB LYS 3 -5.824 13.345 0.573 21 1HG LYS 3 1HG LYS 3 -4.695 13.187 2.810 22 2HG LYS 3 2HG LYS 3 -4.471 11.446 2.619 23 1HD LYS 3 1HD LYS 3 -2.941 11.848 0.640 24 2HD LYS 3 2HD LYS 3 -3.080 13.591 0.900 25 1HE LYS 3 1HE LYS 3 -2.078 13.316 3.227 26 2HE LYS 3 2HE LYS 3 -1.983 11.566 2.982 27 1HZ LYS 3 1HZ LYS 3 0.100 12.671 2.520 28 2HZ LYS 3 2HZ LYS 3 -0.572 13.614 1.367 29 H THR 4 H THR 4 -9.400 12.744 1.072 30 HA THR 4 HA THR 4 -9.814 14.026 3.645 31 HB THR 4 HB THR 4 -10.936 14.216 0.774 32 HG1 THR 4 HG1 THR 4 -9.840 16.229 0.840 33 1HG2 THR 4 3HG2 THR 4 -11.399 15.856 3.284 34 2HG2 THR 4 1HG2 THR 4 -11.918 16.325 1.599 35 3HG2 THR 4 2HG2 THR 4 -12.592 14.845 2.387 36 H GLU 5 H GLU 5 -11.139 11.447 1.486 37 HA GLU 5 HA GLU 5 -13.541 10.938 3.235 38 1HB GLU 5 1HB GLU 5 -12.259 9.421 0.907 39 2HB GLU 5 2HB GLU 5 -13.542 8.713 1.869 40 1HG GLU 5 1HG GLU 5 -13.797 11.281 0.180 41 2HG GLU 5 2HG GLU 5 -14.327 9.682 -0.303 42 HE1 GLU 5 HE2 GLU 5 -17.207 9.628 1.624 43 H LEU 6 H LEU 6 -10.186 10.557 3.219 44 HA LEU 6 HA LEU 6 -9.853 8.204 4.988 45 1HB LEU 6 2HB LEU 6 -8.091 9.753 3.411 46 2HB LEU 6 1HB LEU 6 -7.710 10.392 4.989 47 HG LEU 6 HG LEU 6 -7.605 7.498 4.097 48 1HD1 LEU 6 2HD1 LEU 6 -5.804 8.852 3.159 49 2HD1 LEU 6 3HD1 LEU 6 -5.346 9.433 4.760 50 3HD1 LEU 6 1HD1 LEU 6 -5.161 7.709 4.359 51 1HD2 LEU 6 1HD2 LEU 6 -7.375 8.682 6.897 52 2HD2 LEU 6 2HD2 LEU 6 -8.137 7.170 6.375 53 3HD2 LEU 6 3HD2 LEU 6 -6.369 7.311 6.455 54 H ILE 7 H ILE 7 -9.808 11.776 5.370 55 HA ILE 7 HA ILE 7 -9.381 11.934 8.203 56 HB ILE 7 HB ILE 7 -11.008 13.922 6.488 57 1HG1 ILE 7 1HG1 ILE 7 -7.989 14.025 7.029 58 2HG1 ILE 7 2HG1 ILE 7 -8.631 13.328 5.591 59 1HG2 ILE 7 2HG2 ILE 7 -11.210 14.386 8.970 60 2HG2 ILE 7 3HG2 ILE 7 -9.448 14.472 9.070 61 3HG2 ILE 7 1HG2 ILE 7 -10.343 15.676 8.130 62 1HD1 ILE 7 3HD1 ILE 7 -9.820 15.534 5.043 63 2HD1 ILE 7 1HD1 ILE 7 -8.775 16.268 6.256 64 3HD1 ILE 7 2HD1 ILE 7 -8.049 15.424 4.861 65 H ASN 8 H ASN 8 -12.442 11.900 6.376 66 HA ASN 8 HA ASN 8 -14.094 11.819 8.853 67 1HB ASN 8 1HB ASN 8 -14.970 10.910 6.002 68 2HB ASN 8 2HB ASN 8 -16.059 11.198 7.339 69 1HD2 ASN 8 2HD2 ASN 8 -15.132 14.370 5.030 70 2HD2 ASN 8 1HD2 ASN 8 -14.614 12.650 4.656 71 H ALA 9 H ALA 9 -12.406 9.259 7.305 72 HA ALA 9 HA ALA 9 -13.987 6.996 8.504 73 1HB ALA 9 2HB ALA 9 -12.208 6.718 6.500 74 2HB ALA 9 3HB ALA 9 -10.951 7.079 7.683 75 3HB ALA 9 1HB ALA 9 -11.898 5.642 7.921 76 H VAL 10 H VAL 10 -11.036 8.892 9.325 77 HA VAL 10 HA VAL 10 -10.331 7.215 11.474 78 HB VAL 10 HB VAL 10 -9.231 10.029 11.279 79 1HG1 VAL 10 3HG2 VAL 10 -8.480 8.057 12.939 80 2HG1 VAL 10 1HG2 VAL 10 -7.426 7.664 11.544 81 3HG1 VAL 10 2HG2 VAL 10 -7.355 9.281 12.262 82 1HG2 VAL 10 1HG1 VAL 10 -8.857 7.819 9.249 83 2HG2 VAL 10 2HG1 VAL 10 -9.248 9.563 9.104 84 3HG2 VAL 10 3HG1 VAL 10 -7.575 9.085 9.517 85 H ALA 11 H ALA 11 -11.548 10.383 11.219 86 HA ALA 11 HA ALA 11 -12.006 10.563 14.007 87 1HB ALA 11 2HB ALA 11 -11.809 12.612 12.502 88 2HB ALA 11 3HB ALA 11 -13.357 12.199 11.723 89 3HB ALA 11 1HB ALA 11 -13.322 12.731 13.436 90 H GLU 12 H GLU 12 -14.005 9.039 11.617 91 HA GLU 12 HA GLU 12 -16.390 8.908 13.431 92 1HB GLU 12 1HB GLU 12 -16.737 8.957 10.967 93 2HB GLU 12 2HB GLU 12 -15.777 7.491 10.758 94 1HG GLU 12 1HG GLU 12 -17.506 6.154 12.001 95 2HG GLU 12 2HG GLU 12 -18.440 7.617 12.313 96 HE1 GLU 12 HE2 GLU 12 -18.362 5.871 8.643 97 H THR 13 H THR 13 -13.823 6.583 12.335 98 HA THR 13 HA THR 13 -14.779 4.732 14.521 99 HB THR 13 HB THR 13 -14.336 4.155 12.053 100 HG1 THR 13 HG1 THR 13 -14.022 2.017 12.735 101 1HG2 THR 13 1HG2 THR 13 -11.990 4.659 11.794 102 2HG2 THR 13 2HG2 THR 13 -11.551 3.494 13.075 103 3HG2 THR 13 3HG2 THR 13 -12.297 2.928 11.553 104 H SER 14 H SER 14 -12.976 7.024 14.796 105 HA SER 14 HA SER 14 -11.520 5.804 17.242 106 1HB SER 14 1HB SER 14 -10.163 8.009 15.577 107 2HB SER 14 2HB SER 14 -9.528 7.207 17.005 108 HG SER 14 HG SER 14 -8.747 6.322 15.089 109 H GLY 15 H GLY 15 -13.276 8.694 16.075 110 1HA GLY 15 1HA GLY 15 -14.118 10.548 17.265 111 2HA GLY 15 2HA GLY 15 -13.972 9.591 18.734 112 H LEU 16 H LEU 16 -11.765 11.106 16.465 113 HA LEU 16 HA LEU 16 -10.379 12.773 18.580 114 1HB LEU 16 1HB LEU 16 -8.463 12.846 17.139 115 2HB LEU 16 2HB LEU 16 -8.826 11.301 17.880 116 HG LEU 16 HG LEU 16 -9.658 10.370 15.966 117 1HD1 LEU 16 2HD1 LEU 16 -10.908 12.344 14.969 118 2HD1 LEU 16 3HD1 LEU 16 -9.302 12.927 14.427 119 3HD1 LEU 16 1HD1 LEU 16 -10.014 11.372 13.798 120 1HD2 LEU 16 1HD2 LEU 16 -7.564 9.824 15.921 121 2HD2 LEU 16 2HD2 LEU 16 -8.428 9.822 14.360 122 3HD2 LEU 16 3HD2 LEU 16 -7.283 11.108 14.689 123 H SER 17 H SER 17 -9.818 14.018 15.965 124 HA SER 17 HA SER 17 -12.175 15.957 15.698 125 1HB SER 17 1HB SER 17 -9.330 17.055 15.731 126 2HB SER 17 2HB SER 17 -10.820 17.940 15.502 127 HG SER 17 HG SER 17 -11.479 17.307 17.582 128 H LYS 18 H LYS 18 -12.231 17.066 13.669 129 HA LYS 18 HA LYS 18 -11.425 15.398 11.280 130 1HB LYS 18 1HB LYS 18 -12.686 18.204 11.307 131 2HB LYS 18 2HB LYS 18 -12.368 17.259 9.866 132 1HG LYS 18 1HG LYS 18 -14.291 16.405 12.121 133 2HG LYS 18 2HG LYS 18 -14.768 17.228 10.649 134 1HD LYS 18 1HD LYS 18 -14.060 15.296 9.237 135 2HD LYS 18 2HD LYS 18 -13.372 14.481 10.628 136 1HE LYS 18 1HE LYS 18 -15.476 13.415 10.178 137 2HE LYS 18 2HE LYS 18 -15.639 14.274 11.705 138 1HZ LYS 18 1HZ LYS 18 -16.816 16.033 10.542 139 2HZ LYS 18 2HZ LYS 18 -17.554 14.591 10.318 140 H LYS 19 H LYS 19 -10.362 18.479 12.685 141 HA LYS 19 HA LYS 19 -7.987 18.821 10.970 142 1HB LYS 19 2HB LYS 19 -8.975 20.646 12.409 143 2HB LYS 19 1HB LYS 19 -8.419 19.815 13.867 144 1HG LYS 19 1HG LYS 19 -6.019 20.067 13.035 145 2HG LYS 19 2HG LYS 19 -6.616 20.905 11.601 146 1HD LYS 19 1HD LYS 19 -7.604 22.713 13.073 147 2HD LYS 19 2HD LYS 19 -7.044 21.853 14.512 148 1HE LYS 19 1HE LYS 19 -4.634 22.098 13.724 149 2HE LYS 19 2HE LYS 19 -5.196 22.973 12.291 150 1HZ LYS 19 1HZ LYS 19 -6.124 24.665 13.728 151 2HZ LYS 19 2HZ LYS 19 -4.524 24.482 14.008 152 H ASP 20 H ASP 20 -8.475 16.910 14.055 153 HA ASP 20 HA ASP 20 -5.567 16.155 14.184 154 1HB ASP 20 1HB ASP 20 -8.033 15.094 15.681 155 2HB ASP 20 2HB ASP 20 -6.509 14.253 15.785 156 HD1 ASP 20 HD2 ASP 20 -4.794 16.633 17.631 157 H ALA 21 H ALA 21 -8.364 14.756 12.593 158 HA ALA 21 HA ALA 21 -7.041 12.189 11.871 159 1HB ALA 21 2HB ALA 21 -9.683 13.530 11.027 160 2HB ALA 21 3HB ALA 21 -9.095 11.989 10.335 161 3HB ALA 21 1HB ALA 21 -9.412 12.133 12.038 162 H THR 22 H THR 22 -7.546 15.327 10.130 163 HA THR 22 HA THR 22 -6.178 14.662 7.678 164 HB THR 22 HB THR 22 -6.059 17.437 9.042 165 HG1 THR 22 HG1 THR 22 -8.257 16.330 7.672 166 1HG2 THR 22 3HG2 THR 22 -6.412 16.488 6.135 167 2HG2 THR 22 1HG2 THR 22 -6.497 18.191 6.667 168 3HG2 THR 22 2HG2 THR 22 -4.964 17.264 6.826 169 H LYS 23 H LYS 23 -4.902 16.059 10.606 170 HA LYS 23 HA LYS 23 -2.053 16.137 9.916 171 1HB LYS 23 2HB LYS 23 -3.649 15.737 12.583 172 2HB LYS 23 1HB LYS 23 -1.934 15.899 12.634 173 1HG LYS 23 1HG LYS 23 -1.934 18.216 11.756 174 2HG LYS 23 2HG LYS 23 -3.631 18.121 11.332 175 1HD LYS 23 1HD LYS 23 -3.486 19.483 13.269 176 2HD LYS 23 2HD LYS 23 -4.298 17.997 13.734 177 1HE LYS 23 1HE LYS 23 -2.145 17.153 14.791 178 2HE LYS 23 2HE LYS 23 -1.318 18.638 14.301 179 1HZ LYS 23 1HZ LYS 23 -3.689 18.504 16.087 180 2HZ LYS 23 2HZ LYS 23 -2.936 19.883 15.635 181 H ALA 24 H ALA 24 -3.807 13.779 11.792 182 HA ALA 24 HA ALA 24 -1.753 11.890 12.336 183 1HB ALA 24 2HB ALA 24 -3.819 11.970 13.516 184 2HB ALA 24 3HB ALA 24 -4.753 11.500 12.057 185 3HB ALA 24 1HB ALA 24 -3.619 10.336 12.830 186 H VAL 25 H VAL 25 -3.887 11.951 9.496 187 HA VAL 25 HA VAL 25 -2.755 9.581 8.030 188 HB VAL 25 HB VAL 25 -4.376 12.272 7.529 189 1HG1 VAL 25 1HG2 VAL 25 -3.354 10.557 5.193 190 2HG1 VAL 25 2HG2 VAL 25 -4.615 11.833 5.096 191 3HG1 VAL 25 3HG2 VAL 25 -2.961 12.248 5.516 192 1HG2 VAL 25 2HG1 VAL 25 -5.108 9.360 7.037 193 2HG2 VAL 25 3HG1 VAL 25 -5.621 10.374 8.405 194 3HG2 VAL 25 1HG1 VAL 25 -6.160 10.799 6.776 195 H ASP 26 H ASP 26 -2.059 13.130 7.658 196 HA ASP 26 HA ASP 26 0.529 12.586 6.283 197 1HB ASP 26 1HB ASP 26 -0.953 14.756 6.222 198 2HB ASP 26 2HB ASP 26 -0.270 15.166 7.785 199 HD1 ASP 26 HD2 ASP 26 1.899 15.357 4.337 200 H ALA 27 H ALA 27 -0.148 11.919 9.320 201 HA ALA 27 HA ALA 27 2.589 12.270 10.515 202 1HB ALA 27 1HB ALA 27 0.173 12.711 11.740 203 2HB ALA 27 2HB ALA 27 0.295 10.988 12.001 204 3HB ALA 27 3HB ALA 27 1.518 12.107 12.629 205 H VAL 28 H VAL 28 0.380 9.705 9.610 206 HA VAL 28 HA VAL 28 2.261 7.442 9.982 207 HB VAL 28 HB VAL 28 -0.074 7.627 7.900 208 1HG1 VAL 28 2HG2 VAL 28 1.757 5.424 8.830 209 2HG1 VAL 28 3HG2 VAL 28 0.065 4.984 8.584 210 3HG1 VAL 28 1HG2 VAL 28 0.934 5.741 7.252 211 1HG2 VAL 28 2HG1 VAL 28 -0.277 6.644 10.713 212 2HG2 VAL 28 3HG1 VAL 28 -1.146 7.993 9.868 213 3HG2 VAL 28 1HG1 VAL 28 -1.446 6.328 9.352 214 H PHE 29 H PHE 29 1.032 9.094 7.223 215 HA PHE 29 HA PHE 29 2.801 7.953 5.190 216 1HB PHE 29 2HB PHE 29 0.843 10.272 4.875 217 2HB PHE 29 1HB PHE 29 1.579 9.421 3.535 218 HD1 PHE 29 HD2 PHE 29 1.412 6.615 3.884 219 HD2 PHE 29 HD1 PHE 29 -1.411 9.568 5.176 220 HE1 PHE 29 HE2 PHE 29 -0.275 4.860 4.196 221 HE2 PHE 29 HE1 PHE 29 -3.077 7.805 5.558 222 HZ PHE 29 HZ PHE 29 -2.483 5.438 5.111 223 H ASP 30 H ASP 30 3.479 10.683 7.208 224 HA ASP 30 HA ASP 30 5.586 11.625 5.269 225 1HB ASP 30 1HB ASP 30 4.395 13.057 7.131 226 2HB ASP 30 2HB ASP 30 5.484 12.338 8.279 227 HD2 ASP 30 HD2 ASP 30 5.090 14.457 5.747 228 H SER 31 H SER 31 5.489 9.713 8.119 229 HA SER 31 HA SER 31 8.440 9.174 8.360 230 1HB SER 31 1HB SER 31 6.248 7.364 9.486 231 2HB SER 31 2HB SER 31 7.951 7.393 9.950 232 HG SER 31 HG SER 31 6.140 9.550 10.254 233 H ILE 32 H ILE 32 5.705 7.325 6.695 234 HA ILE 32 HA ILE 32 7.186 5.138 5.692 235 HB ILE 32 HB ILE 32 4.919 6.493 4.233 236 1HG1 ILE 32 1HG1 ILE 32 4.940 5.264 6.949 237 2HG1 ILE 32 2HG1 ILE 32 4.109 6.626 6.230 238 1HG2 ILE 32 2HG2 ILE 32 6.357 4.391 3.371 239 2HG2 ILE 32 3HG2 ILE 32 5.588 3.550 4.710 240 3HG2 ILE 32 1HG2 ILE 32 4.585 4.199 3.391 241 1HD1 ILE 32 3HD1 ILE 32 3.280 3.815 5.607 242 2HD1 ILE 32 1HD1 ILE 32 2.797 4.689 7.069 243 3HD1 ILE 32 2HD1 ILE 32 2.348 5.370 5.463 244 H THR 33 H THR 33 6.423 8.197 4.057 245 HA THR 33 HA THR 33 8.182 7.533 1.746 246 HB THR 33 HB THR 33 6.494 9.248 1.444 247 HG1 THR 33 HG1 THR 33 8.370 9.464 0.242 248 1HG2 THR 33 3HG2 THR 33 6.534 10.239 3.790 249 2HG2 THR 33 1HG2 THR 33 7.958 11.166 3.363 250 3HG2 THR 33 2HG2 THR 33 6.390 11.454 2.518 251 H GLU 34 H GLU 34 8.986 9.016 4.855 252 HA GLU 34 HA GLU 34 11.848 9.509 4.092 253 1HB GLU 34 1HB GLU 34 10.457 9.341 6.851 254 2HB GLU 34 2HB GLU 34 12.178 9.569 6.694 255 1HG GLU 34 1HG GLU 34 10.049 11.527 5.619 256 2HG GLU 34 2HG GLU 34 10.947 11.698 7.114 257 HE2 GLU 34 HE2 GLU 34 12.549 12.734 3.581 258 H ALA 35 H ALA 35 10.018 6.707 5.420 259 HA ALA 35 HA ALA 35 12.379 5.022 5.718 260 1HB ALA 35 3HB ALA 35 9.875 4.287 6.564 261 2HB ALA 35 1HB ALA 35 9.511 3.978 4.878 262 3HB ALA 35 2HB ALA 35 10.702 3.007 5.668 263 H LEU 36 H LEU 36 10.075 5.282 2.989 264 HA LEU 36 HA LEU 36 11.402 3.511 1.114 265 1HB LEU 36 2HB LEU 36 9.616 5.783 0.444 266 2HB LEU 36 1HB LEU 36 9.878 4.296 -0.452 267 HG LEU 36 HG LEU 36 8.388 4.423 2.228 268 1HD1 LEU 36 1HD2 LEU 36 6.982 4.814 0.341 269 2HD1 LEU 36 2HD2 LEU 36 7.513 3.230 -0.391 270 3HD1 LEU 36 3HD2 LEU 36 6.611 3.271 1.165 271 1HD2 LEU 36 1HD1 LEU 36 9.357 1.903 0.824 272 2HD2 LEU 36 2HD1 LEU 36 9.849 2.476 2.448 273 3HD2 LEU 36 3HD1 LEU 36 8.194 1.958 2.193 274 NH1 ARG 37 NH2 ARG 37 15.793 12.451 2.562 275 NH2 ARG 37 NH1 ARG 37 16.194 14.041 0.988 276 H ARG 37 H ARG 37 11.504 7.078 1.382 277 HA ARG 37 HA ARG 37 13.326 7.411 -0.760 278 1HB ARG 37 1HB ARG 37 11.978 9.292 0.162 279 2HB ARG 37 2HB ARG 37 12.777 9.127 1.728 280 1HG ARG 37 1HG ARG 37 14.966 9.926 0.605 281 2HG ARG 37 2HG ARG 37 14.012 10.288 -0.834 282 1HD ARG 37 1HD ARG 37 12.504 11.755 0.601 283 2HD ARG 37 2HD ARG 37 13.439 11.331 2.029 284 1HH1 ARG 37 2HH2 ARG 37 15.214 11.660 2.864 285 2HH1 ARG 37 1HH2 ARG 37 16.596 12.851 3.060 286 1HH2 ARG 37 1HH1 ARG 37 15.925 14.464 0.093 287 2HH2 ARG 37 2HH1 ARG 37 16.971 14.328 1.594 288 H LYS 38 H LYS 38 13.936 6.415 2.612 289 HA LYS 38 HA LYS 38 16.924 6.981 2.233 290 1HB LYS 38 1HB LYS 38 15.457 6.892 4.906 291 2HB LYS 38 2HB LYS 38 17.194 6.963 4.714 292 1HG LYS 38 1HG LYS 38 17.048 9.129 3.474 293 2HG LYS 38 2HG LYS 38 15.303 9.158 3.664 294 1HD LYS 38 1HD LYS 38 17.309 9.132 6.018 295 2HD LYS 38 2HD LYS 38 16.634 10.587 5.292 296 1HE LYS 38 1HE LYS 38 14.292 9.827 5.887 297 2HE LYS 38 2HE LYS 38 14.952 8.389 6.678 298 1HZ LYS 38 1HZ LYS 38 14.541 10.112 8.262 299 2HZ LYS 38 2HZ LYS 38 16.149 9.820 8.201 300 H GLY 39 H GLY 39 15.327 4.570 1.357 301 1HA GLY 39 1HA GLY 39 15.751 2.219 1.169 302 2HA GLY 39 2HA GLY 39 17.338 2.513 1.842 303 H ASP 40 H ASP 40 14.142 2.890 3.277 304 HA ASP 40 HA ASP 40 14.719 0.749 5.387 305 1HB ASP 40 1HB ASP 40 13.093 3.149 6.081 306 2HB ASP 40 2HB ASP 40 13.725 1.927 7.125 307 HD1 ASP 40 HD2 ASP 40 17.006 3.170 7.200 308 H LYS 41 H LYS 41 13.327 -0.653 5.967 309 HA LYS 41 HA LYS 41 10.730 -0.922 4.442 310 1HB LYS 41 2HB LYS 41 11.714 -2.816 6.639 311 2HB LYS 41 1HB LYS 41 10.351 -3.056 5.548 312 1HG LYS 41 1HG LYS 41 12.172 -2.919 3.612 313 2HG LYS 41 2HG LYS 41 13.346 -3.170 4.894 314 1HD LYS 41 1HD LYS 41 12.170 -5.308 5.570 315 2HD LYS 41 2HD LYS 41 10.935 -5.027 4.336 316 1HE LYS 41 1HE LYS 41 12.708 -5.147 2.523 317 2HE LYS 41 2HE LYS 41 13.940 -5.468 3.757 318 1HZ LYS 41 1HZ LYS 41 11.546 -7.156 3.272 319 2HZ LYS 41 2HZ LYS 41 12.709 -7.462 4.379 320 H VAL 42 H VAL 42 8.765 -0.331 5.361 321 HA VAL 42 HA VAL 42 8.487 0.879 7.911 322 HB VAL 42 HB VAL 42 6.604 0.063 5.628 323 1HG1 VAL 42 3HG2 VAL 42 5.452 1.054 7.650 324 2HG1 VAL 42 1HG2 VAL 42 6.513 2.483 7.480 325 3HG1 VAL 42 2HG2 VAL 42 5.348 2.079 6.197 326 1HG2 VAL 42 2HG1 VAL 42 8.666 1.582 4.848 327 2HG2 VAL 42 3HG1 VAL 42 7.058 2.187 4.532 328 3HG2 VAL 42 1HG1 VAL 42 7.978 2.828 5.911 329 H GLN 43 H GLN 43 5.895 -0.521 7.859 330 HA GLN 43 HA GLN 43 5.304 -2.704 8.070 331 1HB GLN 43 1HB GLN 43 7.305 -3.375 10.129 332 2HB GLN 43 2HB GLN 43 5.823 -4.326 10.082 333 1HG GLN 43 1HG GLN 43 6.103 -4.888 7.749 334 2HG GLN 43 2HG GLN 43 7.464 -3.826 7.543 335 1HE2 GLN 43 2HE2 GLN 43 9.771 -6.388 8.585 336 2HE2 GLN 43 1HE2 GLN 43 9.457 -4.802 7.722 337 H LEU 44 H LEU 44 3.632 -3.771 8.694 338 HA LEU 44 HA LEU 44 1.928 -2.606 10.930 339 1HB LEU 44 2HB LEU 44 0.793 -3.415 8.193 340 2HB LEU 44 1HB LEU 44 -0.074 -2.733 9.561 341 HG LEU 44 HG LEU 44 1.787 -0.731 9.100 342 1HD1 LEU 44 1HD1 LEU 44 2.793 -1.844 7.074 343 2HD1 LEU 44 2HD1 LEU 44 1.201 -1.855 6.291 344 3HD1 LEU 44 3HD1 LEU 44 2.014 -0.310 6.650 345 1HD2 LEU 44 2HD2 LEU 44 -0.685 -0.382 9.282 346 2HD2 LEU 44 3HD2 LEU 44 -0.026 0.512 7.898 347 3HD2 LEU 44 1HD2 LEU 44 -0.921 -1.005 7.629 348 H ILE 45 H ILE 45 1.434 -4.330 12.291 349 HA ILE 45 HA ILE 45 2.212 -6.985 11.383 350 HB ILE 45 HB ILE 45 2.906 -5.900 13.552 351 1HG1 ILE 45 1HG1 ILE 45 1.906 -8.761 14.002 352 2HG1 ILE 45 2HG1 ILE 45 3.289 -8.369 12.993 353 1HG2 ILE 45 1HG2 ILE 45 0.660 -5.154 14.306 354 2HG2 ILE 45 2HG2 ILE 45 0.183 -6.841 14.618 355 3HG2 ILE 45 3HG2 ILE 45 1.495 -6.077 15.567 356 1HD1 ILE 45 3HD1 ILE 45 4.468 -7.298 14.961 357 2HD1 ILE 45 1HD1 ILE 45 3.101 -7.757 16.012 358 3HD1 ILE 45 2HD1 ILE 45 4.083 -9.015 15.229 359 H GLY 46 H GLY 46 -0.603 -5.952 11.489 360 1HA GLY 46 1HA GLY 46 -1.809 -8.764 10.917 361 2HA GLY 46 2HA GLY 46 -2.829 -7.624 11.774 362 H PHE 47 H PHE 47 -0.686 -6.470 9.231 363 HA PHE 47 HA PHE 47 -2.774 -6.666 7.050 364 1HB PHE 47 2HB PHE 47 -2.922 -4.607 8.637 365 2HB PHE 47 1HB PHE 47 -1.413 -4.042 8.009 366 HD1 PHE 47 HD2 PHE 47 -1.297 -3.850 5.244 367 HD2 PHE 47 HD1 PHE 47 -4.903 -3.666 7.594 368 HE1 PHE 47 HE2 PHE 47 -2.445 -2.749 3.402 369 HE2 PHE 47 HE1 PHE 47 -5.979 -2.405 5.760 370 HZ PHE 47 HZ PHE 47 -4.779 -1.977 3.666 371 H GLY 48 H GLY 48 0.728 -5.882 7.818 372 1HA GLY 48 1HA GLY 48 1.374 -5.887 5.000 373 2HA GLY 48 2HA GLY 48 1.128 -4.284 5.610 374 H ASN 49 H ASN 49 2.869 -4.657 4.259 375 HA ASN 49 HA ASN 49 5.281 -3.794 5.856 376 1HB ASN 49 1HB ASN 49 5.665 -6.299 5.737 377 2HB ASN 49 2HB ASN 49 5.656 -6.230 3.985 378 1HD2 ASN 49 1HD2 ASN 49 9.218 -6.386 4.891 379 2HD2 ASN 49 2HD2 ASN 49 7.704 -7.421 4.849 380 H PHE 50 H PHE 50 5.705 -1.841 4.817 381 HA PHE 50 HA PHE 50 5.724 -1.807 1.747 382 1HB PHE 50 1HB PHE 50 6.152 0.215 3.494 383 2HB PHE 50 2HB PHE 50 6.380 1.037 2.809 384 HD1 PHE 50 HD1 PHE 50 4.251 0.607 4.739 385 HD2 PHE 50 HD2 PHE 50 4.489 1.484 0.547 386 HE1 PHE 50 HE1 PHE 50 2.186 1.987 4.897 387 HE2 PHE 50 HE2 PHE 50 2.465 2.879 0.750 388 HZ PHE 50 HZ PHE 50 1.284 3.024 2.871 389 H GLU 51 H GLU 51 7.560 -1.193 0.639 390 HA GLU 51 HA GLU 51 10.052 -0.522 1.936 391 1HB GLU 51 1HB GLU 51 11.437 -2.567 1.439 392 2HB GLU 51 2HB GLU 51 10.148 -3.013 2.514 393 1HG GLU 51 1HG GLU 51 10.068 -3.535 -0.534 394 2HG GLU 51 2HG GLU 51 10.741 -4.656 0.630 395 HE1 GLU 51 HE2 GLU 51 7.738 -5.790 1.908 396 H VAL 52 H VAL 52 12.032 -0.467 0.368 397 HA VAL 52 HA VAL 52 11.016 0.270 -2.317 398 HB VAL 52 HB VAL 52 12.151 1.707 -0.120 399 1HG1 VAL 52 1HG2 VAL 52 14.409 1.120 -2.062 400 2HG1 VAL 52 2HG2 VAL 52 14.367 2.457 -0.858 401 3HG1 VAL 52 3HG2 VAL 52 14.311 0.737 -0.339 402 1HG2 VAL 52 3HG1 VAL 52 12.012 2.547 -3.020 403 2HG2 VAL 52 1HG1 VAL 52 10.754 2.676 -1.748 404 3HG2 VAL 52 2HG1 VAL 52 12.248 3.586 -1.608 405 NH1 ARG 53 NH2 ARG 53 14.517 -4.161 -9.617 406 NH2 ARG 53 NH1 ARG 53 14.856 -6.410 -9.541 407 H ARG 53 H ARG 53 12.465 0.024 -4.148 408 HA ARG 53 HA ARG 53 14.321 -2.437 -3.886 409 1HB ARG 53 1HB ARG 53 12.025 -2.882 -5.015 410 2HB ARG 53 2HB ARG 53 12.572 -1.835 -6.316 411 1HG ARG 53 1HG ARG 53 14.575 -3.315 -6.694 412 2HG ARG 53 2HG ARG 53 13.993 -4.410 -5.434 413 1HD ARG 53 1HD ARG 53 11.889 -4.835 -6.750 414 2HD ARG 53 2HD ARG 53 12.370 -3.674 -7.978 415 1HH1 ARG 53 2HH2 ARG 53 14.063 -3.341 -9.200 416 2HH1 ARG 53 1HH2 ARG 53 15.134 -4.172 -10.437 417 1HH2 ARG 53 1HH1 ARG 53 14.662 -7.300 -9.070 418 2HH2 ARG 53 2HH1 ARG 53 15.449 -6.267 -10.366 419 H GLU 54 H GLU 54 16.224 -1.317 -3.821 420 HA GLU 54 HA GLU 54 16.933 0.841 -5.741 421 1HB GLU 54 1HB GLU 54 17.955 0.631 -3.460 422 2HB GLU 54 2HB GLU 54 18.827 -0.811 -3.977 423 1HG GLU 54 1HG GLU 54 19.995 0.584 -5.775 424 2HG GLU 54 2HG GLU 54 19.093 2.004 -5.259 425 HE1 GLU 54 HE2 GLU 54 20.996 2.633 -2.449 426 NH1 ARG 55 NH2 ARG 55 14.974 1.567 -14.354 427 NH2 ARG 55 NH1 ARG 55 13.130 1.158 -13.086 428 H ARG 55 H ARG 55 17.068 0.408 -7.814 429 HA ARG 55 HA ARG 55 17.180 -2.245 -8.975 430 1HB ARG 55 1HB ARG 55 16.059 -0.173 -9.933 431 2HB ARG 55 2HB ARG 55 17.636 0.460 -10.376 432 1HG ARG 55 1HG ARG 55 17.980 -1.615 -11.849 433 2HG ARG 55 2HG ARG 55 16.353 -2.142 -11.446 434 1HD ARG 55 1HD ARG 55 17.104 0.507 -12.856 435 2HD ARG 55 2HD ARG 55 16.574 -0.966 -13.676 436 1HH1 ARG 55 2HH2 ARG 55 15.961 1.356 -14.538 437 2HH1 ARG 55 1HH2 ARG 55 14.382 2.232 -14.864 438 1HH2 ARG 55 1HH1 ARG 55 12.711 0.636 -12.309 439 2HH2 ARG 55 2HH1 ARG 55 12.665 1.851 -13.683 440 H ALA 56 H ALA 56 18.764 -3.400 -9.889 441 HA ALA 56 HA ALA 56 21.656 -2.676 -9.300 442 1HB ALA 56 3HB ALA 56 20.430 -5.316 -10.314 443 2HB ALA 56 1HB ALA 56 22.138 -5.044 -9.896 444 3HB ALA 56 2HB ALA 56 20.892 -4.928 -8.638 445 H ALA 57 H ALA 57 21.673 -0.968 -10.803 446 HA ALA 57 HA ALA 57 21.377 -0.231 -13.139 447 1HB ALA 57 3HB ALA 57 23.361 0.610 -11.863 448 2HB ALA 57 1HB ALA 57 24.344 -0.763 -12.440 449 3HB ALA 57 2HB ALA 57 23.763 0.470 -13.579 450 NH1 ARG 58 NH2 ARG 58 18.857 -6.058 -12.922 451 NH2 ARG 58 NH1 ARG 58 17.235 -4.972 -11.764 452 H ARG 58 H ARG 58 21.003 -0.510 -15.096 453 HA ARG 58 HA ARG 58 21.466 -3.276 -16.079 454 1HB ARG 58 2HB ARG 58 19.412 -1.280 -17.147 455 2HB ARG 58 1HB ARG 58 19.467 -2.993 -17.528 456 1HG ARG 58 1HG ARG 58 18.804 -1.735 -14.806 457 2HG ARG 58 2HG ARG 58 17.650 -2.365 -15.965 458 1HD ARG 58 1HD ARG 58 18.481 -4.698 -15.671 459 2HD ARG 58 2HD ARG 58 19.835 -4.137 -14.679 460 1HH1 ARG 58 2HH2 ARG 58 19.463 -6.079 -13.751 461 2HH1 ARG 58 1HH2 ARG 58 18.827 -6.750 -12.165 462 1HH2 ARG 58 1HH1 ARG 58 16.602 -4.167 -11.704 463 2HH2 ARG 58 2HH1 ARG 58 17.317 -5.740 -11.090 464 H LYS 59 H LYS 59 20.983 -2.887 -18.821 465 HA LYS 59 HA LYS 59 23.039 -0.950 -19.831 466 1HB LYS 59 1HB LYS 59 24.332 -2.455 -21.198 467 2HB LYS 59 2HB LYS 59 24.490 -2.841 -19.500 468 1HG LYS 59 1HG LYS 59 22.940 -4.824 -19.790 469 2HG LYS 59 2HG LYS 59 22.749 -4.426 -21.500 470 1HD LYS 59 1HD LYS 59 25.244 -4.709 -21.848 471 2HD LYS 59 2HD LYS 59 25.427 -5.138 -20.143 472 1HE LYS 59 1HE LYS 59 23.893 -7.140 -20.482 473 2HE LYS 59 2HE LYS 59 23.704 -6.707 -22.188 474 1HZ LYS 59 1HZ LYS 59 26.261 -7.409 -20.855 475 2HZ LYS 59 2HZ LYS 59 25.394 -8.388 -21.836 476 H GLY 60 H GLY 60 22.439 0.002 -21.628 477 1HA GLY 60 1HA GLY 60 20.110 -1.139 -23.300 478 2HA GLY 60 2HA GLY 60 20.141 0.538 -22.770 479 NH1 ARG 61 NH2 ARG 61 21.755 -3.873 -30.939 480 NH2 ARG 61 NH1 ARG 61 22.975 -5.190 -29.542 481 H ARG 61 H ARG 61 20.174 1.298 -24.856 482 HA ARG 61 HA ARG 61 22.852 1.240 -26.266 483 1HB ARG 61 1HB ARG 61 20.194 0.321 -27.595 484 2HB ARG 61 2HB ARG 61 21.556 0.864 -28.546 485 1HG ARG 61 1HG ARG 61 23.035 -0.901 -27.440 486 2HG ARG 61 2HG ARG 61 21.584 -1.566 -26.684 487 1HD ARG 61 1HD ARG 61 20.560 -1.959 -28.964 488 2HD ARG 61 2HD ARG 61 22.007 -1.270 -29.729 489 1HH1 ARG 61 2HH2 ARG 61 21.267 -2.982 -31.080 490 2HH1 ARG 61 1HH2 ARG 61 21.843 -4.639 -31.615 491 1HH2 ARG 61 1HH1 ARG 61 23.416 -5.305 -28.623 492 2HH2 ARG 61 2HH1 ARG 61 22.975 -5.867 -30.313 493 H ASN 62 H ASN 62 22.692 2.441 -28.309 494 HA ASN 62 HA ASN 62 23.213 5.064 -27.548 495 1HB ASN 62 1HB ASN 62 23.485 5.555 -29.960 496 2HB ASN 62 2HB ASN 62 24.317 4.131 -29.395 497 1HD2 ASN 62 2HD2 ASN 62 21.867 3.619 -32.545 498 2HD2 ASN 62 1HD2 ASN 62 22.081 5.255 -31.740 499 HA PRO 63 HA PRO 63 19.188 7.298 -28.075 500 1HB PRO 63 1HB PRO 63 20.900 9.651 -27.167 501 2HB PRO 63 2HB PRO 63 19.273 9.182 -26.635 502 1HG PRO 63 1HG PRO 63 21.429 8.632 -25.057 503 2HG PRO 63 2HG PRO 63 20.147 7.412 -25.233 504 1HD PRO 63 1HD PRO 63 22.842 7.522 -26.698 505 2HD PRO 63 2HD PRO 63 22.063 6.131 -25.886 506 H GLN 64 H GLN 64 22.365 8.587 -29.152 507 HA GLN 64 HA GLN 64 21.320 9.097 -31.907 508 1HB GLN 64 1HB GLN 64 23.536 10.858 -30.673 509 2HB GLN 64 2HB GLN 64 22.945 10.904 -32.314 510 1HG GLN 64 1HG GLN 64 21.367 11.691 -29.781 511 2HG GLN 64 2HG GLN 64 22.308 12.766 -30.792 512 1HE2 GLN 64 2HE2 GLN 64 18.497 11.929 -31.985 513 2HE2 GLN 64 1HE2 GLN 64 19.226 11.326 -30.412 514 H THR 65 H THR 65 24.597 9.385 -30.492 515 HA THR 65 HA THR 65 25.163 6.461 -30.887 516 HB THR 65 HB THR 65 27.215 6.887 -31.703 517 HG1 THR 65 HG1 THR 65 27.796 8.688 -30.451 518 1HG2 THR 65 2HG2 THR 65 25.249 7.379 -33.328 519 2HG2 THR 65 3HG2 THR 65 25.414 9.101 -32.944 520 3HG2 THR 65 1HG2 THR 65 26.747 8.287 -33.802 521 H GLY 66 H GLY 66 24.252 7.022 -28.420 522 1HA GLY 66 1HA GLY 66 26.275 7.580 -26.365 523 2HA GLY 66 2HA GLY 66 24.902 6.495 -26.142 524 H GLU 67 H GLU 67 25.862 4.791 -28.354 525 HA GLU 67 HA GLU 67 26.481 3.213 -28.849 526 1HB GLU 67 2HB GLU 67 28.296 3.510 -29.495 527 2HB GLU 67 1HB GLU 67 28.772 4.318 -28.062 528 1HG GLU 67 1HG GLU 67 29.421 2.063 -26.992 529 2HG GLU 67 2HG GLU 67 28.967 1.258 -28.492 530 HE1 GLU 67 HE2 GLU 67 32.413 3.349 -28.156 531 H GLU 68 H GLU 68 27.153 2.258 -26.063 532 HA GLU 68 HA GLU 68 24.829 0.469 -25.860 533 1HB GLU 68 1HB GLU 68 26.481 -1.142 -26.952 534 2HB GLU 68 2HB GLU 68 27.530 -1.013 -25.543 535 1HG GLU 68 1HG GLU 68 25.619 -1.924 -24.092 536 2HG GLU 68 2HG GLU 68 24.600 -2.036 -25.524 537 HE1 GLU 68 HE2 GLU 68 26.043 -4.896 -26.795 538 H MET 69 H MET 69 24.208 1.680 -24.183 539 HA MET 69 HA MET 69 26.131 2.936 -22.285 540 1HB MET 69 1HB MET 69 24.219 4.256 -21.519 541 2HB MET 69 2HB MET 69 24.284 4.250 -23.264 542 1HG MET 69 1HG MET 69 22.419 2.585 -23.368 543 2HG MET 69 2HG MET 69 22.379 2.462 -21.600 544 1HE MET 69 2HE MET 69 19.897 2.778 -21.821 545 2HE MET 69 1HE MET 69 19.063 4.268 -22.344 546 3HE MET 69 3HE MET 69 19.841 3.191 -23.549 547 H GLU 70 H GLU 70 25.762 3.079 -19.966 548 HA GLU 70 HA GLU 70 24.774 0.535 -18.654 549 1HB GLU 70 2HB GLU 70 27.280 1.773 -18.528 550 2HB GLU 70 1HB GLU 70 26.525 2.569 -17.202 551 1HG GLU 70 1HG GLU 70 26.742 -0.514 -17.712 552 2HG GLU 70 2HG GLU 70 27.906 0.413 -16.778 553 HE2 GLU 70 HE2 GLU 70 25.015 -1.229 -14.845 554 H ILE 71 H ILE 71 22.672 0.829 -17.916 555 HA ILE 71 HA ILE 71 21.532 3.502 -17.576 556 HB ILE 71 HB ILE 71 20.300 0.715 -17.090 557 1HG1 ILE 71 1HG1 ILE 71 20.127 2.462 -19.638 558 2HG1 ILE 71 2HG1 ILE 71 21.130 1.034 -19.517 559 1HG2 ILE 71 2HG2 ILE 71 19.065 2.624 -16.035 560 2HG2 ILE 71 3HG2 ILE 71 18.971 3.431 -17.632 561 3HG2 ILE 71 1HG2 ILE 71 18.137 1.871 -17.345 562 1HD1 ILE 71 2HD1 ILE 71 18.054 0.964 -19.366 563 2HD1 ILE 71 3HD1 ILE 71 19.069 0.487 -20.731 564 3HD1 ILE 71 1HD1 ILE 71 19.136 -0.449 -19.228 565 HA PRO 72 HA PRO 72 22.854 3.304 -13.133 566 1HB PRO 72 1HB PRO 72 21.859 5.730 -12.201 567 2HB PRO 72 2HB PRO 72 23.243 5.578 -13.292 568 1HG PRO 72 1HG PRO 72 20.335 6.165 -14.052 569 2HG PRO 72 2HG PRO 72 21.794 7.053 -14.556 570 1HD PRO 72 1HD PRO 72 20.642 5.120 -16.156 571 2HD PRO 72 2HD PRO 72 22.419 5.334 -16.125 572 H ALA 73 H ALA 73 22.006 3.338 -10.944 573 HA ALA 73 HA ALA 73 19.645 1.631 -10.583 574 1HB ALA 73 1HB ALA 73 21.585 1.695 -8.901 575 2HB ALA 73 2HB ALA 73 21.075 3.347 -8.407 576 3HB ALA 73 3HB ALA 73 20.018 1.966 -8.115 577 H SER 74 H SER 74 17.910 2.019 -9.198 578 HA SER 74 HA SER 74 17.510 4.519 -8.005 579 1HB SER 74 1HB SER 74 16.573 5.224 -10.350 580 2HB SER 74 2HB SER 74 15.265 4.054 -10.150 581 HG SER 74 HG SER 74 14.712 6.171 -9.558 582 H LYS 75 H LYS 75 15.978 4.625 -6.420 583 HA LYS 75 HA LYS 75 15.056 1.975 -5.360 584 1HB LYS 75 2HB LYS 75 14.207 4.281 -3.722 585 2HB LYS 75 1HB LYS 75 14.788 2.698 -3.322 586 1HG LYS 75 1HG LYS 75 17.156 3.411 -3.937 587 2HG LYS 75 2HG LYS 75 16.544 5.042 -4.235 588 1HD LYS 75 1HD LYS 75 15.748 5.161 -1.813 589 2HD LYS 75 2HD LYS 75 16.424 3.550 -1.536 590 1HE LYS 75 1HE LYS 75 18.735 4.426 -2.213 591 2HE LYS 75 2HE LYS 75 18.044 6.040 -2.423 592 1HZ LYS 75 1HZ LYS 75 19.051 5.802 -0.280 593 2HZ LYS 75 2HZ LYS 75 17.445 6.049 -0.097 594 H VAL 76 H VAL 76 13.005 1.067 -5.898 595 HA VAL 76 HA VAL 76 10.949 2.808 -6.990 596 HB VAL 76 HB VAL 76 12.448 0.292 -7.458 597 1HG1 VAL 76 2HG2 VAL 76 10.691 -0.901 -6.459 598 2HG1 VAL 76 3HG2 VAL 76 9.525 -0.164 -7.597 599 3HG1 VAL 76 1HG2 VAL 76 10.905 -1.220 -8.187 600 1HG2 VAL 76 2HG1 VAL 76 12.286 2.101 -9.031 601 2HG2 VAL 76 3HG1 VAL 76 11.777 0.528 -9.690 602 3HG2 VAL 76 1HG1 VAL 76 10.530 1.754 -9.243 603 HA PRO 77 HA PRO 77 8.908 1.671 -3.063 604 1HB PRO 77 1HB PRO 77 6.529 3.132 -3.305 605 2HB PRO 77 2HB PRO 77 8.108 3.902 -3.147 606 1HG PRO 77 1HG PRO 77 6.511 3.422 -5.693 607 2HG PRO 77 2HG PRO 77 7.367 4.889 -5.208 608 1HD PRO 77 1HD PRO 77 8.450 2.819 -6.972 609 2HD PRO 77 2HD PRO 77 9.464 3.986 -6.091 610 H ALA 78 H ALA 78 7.834 0.322 -2.273 611 HA ALA 78 HA ALA 78 5.817 -1.459 -3.710 612 1HB ALA 78 2HB ALA 78 8.165 -2.397 -3.746 613 2HB ALA 78 3HB ALA 78 8.252 -2.276 -1.969 614 3HB ALA 78 1HB ALA 78 7.077 -3.384 -2.728 615 H PHE 79 H PHE 79 4.735 -2.792 -2.110 616 HA PHE 79 HA PHE 79 4.103 -1.351 0.552 617 1HB PHE 79 2HB PHE 79 2.327 -0.380 0.034 618 2HB PHE 79 1HB PHE 79 2.858 -0.365 -1.610 619 HD1 PHE 79 HD1 PHE 79 2.308 -2.858 -2.823 620 HD2 PHE 79 HD2 PHE 79 0.092 -0.988 0.294 621 HE1 PHE 79 HE1 PHE 79 0.334 -4.281 -3.387 622 HE2 PHE 79 HE2 PHE 79 -1.862 -2.463 -0.190 623 HZ PHE 79 HZ PHE 79 -1.723 -4.101 -2.020 624 H LYS 80 H LYS 80 3.172 -2.422 1.828 625 HA LYS 80 HA LYS 80 2.692 -4.815 2.701 626 1HB LYS 80 2HB LYS 80 0.677 -3.032 3.996 627 2HB LYS 80 1HB LYS 80 2.378 -2.866 4.286 628 1HG LYS 80 1HG LYS 80 1.897 -0.808 4.200 629 2HG LYS 80 2HG LYS 80 2.293 -0.955 2.518 630 1HD LYS 80 1HD LYS 80 0.300 0.116 2.232 631 2HD LYS 80 2HD LYS 80 -0.386 -1.514 2.338 632 1HE LYS 80 1HE LYS 80 -0.733 -1.120 4.869 633 2HE LYS 80 2HE LYS 80 -0.146 0.537 4.650 634 1HZ LYS 80 1HZ LYS 80 -2.546 0.372 4.494 635 2HZ LYS 80 2HZ LYS 80 -2.458 -0.684 3.249 636 HA PRO 81 HA PRO 81 -1.030 -6.789 1.920 637 1HB PRO 81 1HB PRO 81 0.659 -8.830 0.381 638 2HB PRO 81 2HB PRO 81 -1.052 -8.414 0.124 639 1HG PRO 81 1HG PRO 81 0.862 -7.400 -1.552 640 2HG PRO 81 2HG PRO 81 -0.464 -6.336 -0.988 641 1HD PRO 81 1HD PRO 81 2.394 -6.480 0.065 642 2HD PRO 81 2HD PRO 81 1.384 -5.052 -0.381 643 H GLY 82 H GLY 82 1.319 -6.828 3.760 644 1HA GLY 82 1HA GLY 82 3.064 -8.535 4.708 645 2HA GLY 82 2HA GLY 82 1.779 -7.917 5.700 646 H LYS 83 H LYS 83 1.065 -9.976 3.526 647 HA LYS 83 HA LYS 83 0.449 -12.447 3.356 648 1HB LYS 83 2HB LYS 83 2.055 -12.575 5.892 649 2HB LYS 83 1HB LYS 83 0.683 -13.608 5.961 650 1HG LYS 83 1HG LYS 83 2.524 -14.919 5.126 651 2HG LYS 83 2HG LYS 83 1.391 -14.735 3.793 652 1HD LYS 83 1HD LYS 83 2.848 -12.894 2.819 653 2HD LYS 83 2HD LYS 83 3.969 -13.066 4.174 654 1HE LYS 83 1HE LYS 83 4.439 -15.467 3.485 655 2HE LYS 83 2HE LYS 83 3.293 -15.311 2.145 656 1HZ LYS 83 1HZ LYS 83 5.767 -13.712 2.504 657 2HZ LYS 83 2HZ LYS 83 5.568 -14.951 1.456 658 H ALA 84 H ALA 84 -0.252 -10.868 6.320 659 HA ALA 84 HA ALA 84 -2.779 -11.984 7.151 660 1HB ALA 84 2HB ALA 84 -1.208 -10.581 8.499 661 2HB ALA 84 3HB ALA 84 -1.489 -9.190 7.415 662 3HB ALA 84 1HB ALA 84 -2.823 -9.797 8.434 663 H LEU 85 H LEU 85 -2.149 -9.012 5.085 664 HA LEU 85 HA LEU 85 -5.015 -8.506 4.665 665 1HB LEU 85 2HB LEU 85 -3.382 -6.663 4.545 666 2HB LEU 85 1HB LEU 85 -2.528 -7.459 3.237 667 HG LEU 85 HG LEU 85 -4.783 -7.473 2.033 668 1HD1 LEU 85 1HD1 LEU 85 -6.262 -6.669 3.864 669 2HD1 LEU 85 2HD1 LEU 85 -5.371 -5.131 3.928 670 3HD1 LEU 85 3HD1 LEU 85 -6.344 -5.548 2.491 671 1HD2 LEU 85 3HD2 LEU 85 -3.123 -4.892 2.260 672 2HD2 LEU 85 1HD2 LEU 85 -2.954 -6.208 1.073 673 3HD2 LEU 85 2HD2 LEU 85 -4.364 -5.152 1.005 674 H LYS 86 H LYS 86 -2.428 -10.268 2.931 675 HA LYS 86 HA LYS 86 -3.977 -10.996 0.576 676 1HB LYS 86 1HB LYS 86 -1.457 -11.235 0.851 677 2HB LYS 86 2HB LYS 86 -1.721 -12.631 1.882 678 1HG LYS 86 1HG LYS 86 -2.802 -13.855 -0.045 679 2HG LYS 86 2HG LYS 86 -2.633 -12.417 -1.045 680 1HD LYS 86 1HD LYS 86 -0.862 -13.912 -1.661 681 2HD LYS 86 2HD LYS 86 -0.119 -12.545 -0.842 682 1HE LYS 86 1HE LYS 86 0.093 -13.952 1.286 683 2HE LYS 86 2HE LYS 86 -0.682 -15.308 0.457 684 1HZ LYS 86 1HZ LYS 86 1.717 -15.462 0.441 685 2HZ LYS 86 2HZ LYS 86 1.879 -14.023 -0.317 686 H ASP 87 H ASP 87 -4.225 -12.256 3.890 687 HA ASP 87 HA ASP 87 -5.995 -14.527 3.165 688 1HB ASP 87 1HB ASP 87 -4.345 -13.679 5.408 689 2HB ASP 87 2HB ASP 87 -5.942 -13.445 5.969 690 HD1 ASP 87 HD2 ASP 87 -4.437 -17.146 5.166 691 H ALA 88 H ALA 88 -6.406 -11.216 4.539 692 HA ALA 88 HA ALA 88 -9.289 -11.097 4.872 693 1HB ALA 88 1HB ALA 88 -7.675 -9.187 5.523 694 2HB ALA 88 2HB ALA 88 -7.415 -8.840 3.808 695 3HB ALA 88 3HB ALA 88 -9.010 -8.596 4.490 696 H VAL 89 H VAL 89 -7.283 -10.318 2.024 697 HA VAL 89 HA VAL 89 -9.530 -9.713 0.251 698 HB VAL 89 HB VAL 89 -7.027 -8.664 0.932 699 1HG1 VAL 89 2HG2 VAL 89 -5.936 -10.819 -0.042 700 2HG1 VAL 89 3HG2 VAL 89 -6.231 -10.086 -1.622 701 3HG1 VAL 89 1HG2 VAL 89 -5.247 -9.219 -0.400 702 1HG2 VAL 89 1HG1 VAL 89 -8.234 -8.432 -1.773 703 2HG2 VAL 89 2HG1 VAL 89 -8.656 -7.550 -0.252 704 3HG2 VAL 89 3HG1 VAL 89 -7.025 -7.359 -0.947 705 H LYS 90 H LYS 90 -8.305 -12.713 1.018 706 HA LYS 90 HA LYS 90 -7.809 -13.951 -1.539 707 1HB LYS 90 1HB LYS 90 -7.233 -14.617 0.983 708 2HB LYS 90 2HB LYS 90 -8.781 -15.412 1.002 709 1HG LYS 90 1HG LYS 90 -8.028 -16.986 -0.774 710 2HG LYS 90 2HG LYS 90 -6.626 -15.986 -1.124 711 1HD LYS 90 1HD LYS 90 -5.771 -17.798 0.108 712 2HD LYS 90 2HD LYS 90 -5.676 -16.433 1.189 713 1HE LYS 90 1HE LYS 90 -7.968 -18.529 1.296 714 2HE LYS 90 2HE LYS 90 -6.443 -18.725 2.155 715 1HZ LYS 90 1HZ LYS 90 -8.301 -16.458 2.568 716 2HZ LYS 90 2HZ LYS 90 -6.881 -16.668 3.349 717 1H MET 1 1H MET 91 9.628 1.181 10.337 718 2H MET 1 2H MET 91 10.328 -0.212 10.966 719 HA MET 1 HA MET 91 9.157 0.583 12.655 720 1HB MET 1 1HB MET 91 6.829 1.451 12.553 721 2HB MET 1 2HB MET 91 8.065 2.402 11.745 722 1HG MET 1 1HG MET 91 7.148 1.399 9.530 723 2HG MET 1 2HG MET 91 5.787 0.805 10.490 724 1HE MET 1 3HE MET 91 7.822 3.563 8.984 725 2HE MET 1 2HE MET 91 6.482 4.637 8.525 726 3HE MET 1 1HE MET 91 7.449 4.998 9.978 727 H ASN 2 H ASN 92 6.192 -0.756 11.754 728 HA ASN 2 HA ASN 92 6.224 -3.371 11.975 729 1HB ASN 2 1HB ASN 92 6.236 -4.468 14.037 730 2HB ASN 2 2HB ASN 92 7.727 -3.599 13.858 731 1HD2 ASN 2 1HD2 ASN 92 7.355 -1.935 16.999 732 2HD2 ASN 2 2HD2 ASN 92 8.389 -2.263 15.520 733 H LYS 3 H LYS 93 4.857 -0.740 13.565 734 HA LYS 3 HA LYS 93 2.400 -0.274 12.883 735 1HB LYS 3 1HB LYS 93 1.697 -2.825 13.059 736 2HB LYS 3 2HB LYS 93 1.714 -2.619 14.785 737 1HG LYS 3 1HG LYS 93 -0.081 -0.719 14.399 738 2HG LYS 3 2HG LYS 93 0.019 -1.077 12.686 739 1HD LYS 3 1HD LYS 93 -1.933 -2.203 13.408 740 2HD LYS 3 2HD LYS 93 -0.749 -3.470 13.187 741 1HE LYS 3 1HE LYS 93 -1.933 -3.986 15.224 742 2HE LYS 3 2HE LYS 93 -0.334 -3.463 15.742 743 1HZ LYS 3 1HZ LYS 93 -2.772 -1.763 15.710 744 2HZ LYS 3 2HZ LYS 93 -1.293 -1.256 16.187 745 H THR 4 H THR 94 4.361 -0.973 15.780 746 HA THR 4 HA THR 94 2.890 0.830 17.495 747 HB THR 4 HB THR 94 5.293 -1.087 17.769 748 HG1 THR 4 HG1 THR 94 2.599 -1.242 18.693 749 1HG2 THR 4 3HG2 THR 94 3.717 0.573 19.750 750 2HG2 THR 4 1HG2 THR 94 4.869 -0.777 20.179 751 3HG2 THR 4 2HG2 THR 94 5.463 0.701 19.322 752 H GLU 5 H GLU 95 5.875 0.629 15.585 753 HA GLU 5 HA GLU 95 6.963 3.222 16.668 754 1HB GLU 5 1HB GLU 95 8.027 2.275 14.039 755 2HB GLU 5 2HB GLU 95 8.788 3.198 15.266 756 1HG GLU 5 1HG GLU 95 8.254 0.169 15.314 757 2HG GLU 5 2HG GLU 95 9.764 0.928 14.895 758 HE2 GLU 5 HE2 GLU 95 8.758 0.353 18.740 759 H LEU 6 H LEU 96 4.515 2.161 14.623 760 HA LEU 6 HA LEU 96 4.140 4.495 12.822 761 1HB LEU 6 2HB LEU 96 3.053 1.851 13.025 762 2HB LEU 6 1HB LEU 96 1.741 2.787 13.687 763 HG LEU 6 HG LEU 96 2.973 3.271 10.955 764 1HD1 LEU 6 3HD1 LEU 96 0.338 1.926 11.680 765 2HD1 LEU 6 1HD1 LEU 96 0.869 2.340 10.032 766 3HD1 LEU 6 2HD1 LEU 96 1.767 1.142 10.980 767 1HD2 LEU 6 1HD2 LEU 96 1.021 4.936 12.479 768 2HD2 LEU 6 2HD2 LEU 96 2.280 5.392 11.333 769 3HD2 LEU 6 3HD2 LEU 96 0.757 4.687 10.747 770 H ILE 7 H ILE 97 2.788 3.290 15.897 771 HA ILE 7 HA ILE 97 0.924 5.408 16.457 772 HB ILE 7 HB ILE 97 2.432 3.755 18.595 773 1HG1 ILE 7 1HG1 ILE 97 -0.066 2.889 17.035 774 2HG1 ILE 7 2HG1 ILE 97 1.513 2.261 16.825 775 1HG2 ILE 7 2HG2 ILE 97 0.971 5.650 19.459 776 2HG2 ILE 7 3HG2 ILE 97 -0.409 4.921 18.635 777 3HG2 ILE 7 1HG2 ILE 97 0.388 4.053 19.962 778 1HD1 ILE 7 3HD1 ILE 97 1.627 1.340 19.139 779 2HD1 ILE 7 1HD1 ILE 97 -0.030 1.858 19.419 780 3HD1 ILE 7 2HD1 ILE 97 0.310 0.667 18.141 781 H ASN 8 H ASN 98 4.266 4.962 17.611 782 HA ASN 8 HA ASN 98 4.403 7.622 18.914 783 1HB ASN 8 1HB ASN 98 6.758 5.805 18.013 784 2HB ASN 8 2HB ASN 98 6.931 7.225 19.018 785 1HD2 ASN 8 2HD2 ASN 98 6.062 3.776 20.909 786 2HD2 ASN 8 1HD2 ASN 98 6.476 3.895 19.125 787 H ALA 9 H ALA 99 4.594 6.848 15.558 788 HA ALA 9 HA ALA 99 6.094 9.329 14.744 789 1HB ALA 9 2HB ALA 99 5.680 7.207 13.122 790 2HB ALA 9 3HB ALA 99 3.978 7.669 13.107 791 3HB ALA 9 1HB ALA 99 5.121 8.787 12.441 792 H VAL 10 H VAL 100 2.666 8.266 15.057 793 HA VAL 10 HA VAL 100 1.637 10.640 13.939 794 HB VAL 10 HB VAL 100 -0.090 8.844 15.651 795 1HG1 VAL 10 3HG2 VAL 100 -0.862 10.921 14.147 796 2HG1 VAL 10 1HG2 VAL 100 -0.924 9.636 12.900 797 3HG1 VAL 10 2HG2 VAL 100 -1.855 9.447 14.392 798 1HG2 VAL 10 1HG1 VAL 100 1.265 8.082 13.064 799 2HG2 VAL 10 2HG1 VAL 100 1.116 7.257 14.651 800 3HG2 VAL 10 3HG1 VAL 100 -0.314 7.323 13.576 801 H ALA 11 H ALA 101 1.665 9.306 17.071 802 HA ALA 11 HA ALA 101 0.664 11.647 18.264 803 1HB ALA 11 2HB ALA 101 0.532 9.358 19.371 804 2HB ALA 11 3HB ALA 101 2.299 9.344 19.585 805 3HB ALA 11 1HB ALA 101 1.286 10.495 20.515 806 H GLU 12 H GLU 102 3.959 10.971 17.339 807 HA GLU 12 HA GLU 102 5.013 13.264 18.974 808 1HB GLU 12 1HB GLU 102 6.525 11.297 18.518 809 2HB GLU 12 2HB GLU 102 6.437 11.626 16.795 810 1HG GLU 12 1HG GLU 102 8.551 12.452 17.605 811 2HG GLU 12 2HG GLU 102 7.593 13.848 17.155 812 HE1 GLU 12 HE2 GLU 102 8.668 13.132 21.002 813 H THR 13 H THR 103 4.287 12.642 15.462 814 HA THR 13 HA THR 103 4.611 15.623 15.046 815 HB THR 13 HB THR 103 5.636 13.724 13.658 816 HG1 THR 13 HG1 THR 103 5.778 15.216 11.962 817 1HG2 THR 13 1HG2 THR 103 3.654 12.593 12.783 818 2HG2 THR 13 2HG2 THR 103 3.134 14.090 11.963 819 3HG2 THR 13 3HG2 THR 103 4.649 13.276 11.482 820 H SER 14 H SER 104 2.282 14.269 16.142 821 HA SER 14 HA SER 104 0.306 16.412 15.102 822 1HB SER 14 1HB SER 104 -0.688 13.585 15.814 823 2HB SER 14 2HB SER 104 -1.656 14.933 15.251 824 HG SER 14 HG SER 104 -1.106 13.532 13.592 825 H GLY 15 H GLY 105 1.256 14.538 18.023 826 1HA GLY 15 1HA GLY 105 0.772 14.938 20.301 827 2HA GLY 15 2HA GLY 105 0.312 16.580 19.865 828 H LEU 16 H LEU 106 -0.935 13.349 19.378 829 HA LEU 16 HA LEU 106 -3.656 13.946 20.571 830 1HB LEU 16 1HB LEU 106 -4.532 12.154 19.226 831 2HB LEU 16 2HB LEU 106 -4.062 13.618 18.385 832 HG LEU 16 HG LEU 106 -2.137 12.726 17.528 833 1HD1 LEU 16 2HD1 LEU 106 -1.348 11.304 19.482 834 2HD1 LEU 16 3HD1 LEU 106 -2.565 10.106 18.941 835 3HD1 LEU 16 1HD1 LEU 106 -1.147 10.574 17.893 836 1HD2 LEU 16 2HD2 LEU 106 -3.592 12.380 15.974 837 2HD2 LEU 16 3HD2 LEU 106 -2.160 11.318 15.972 838 3HD2 LEU 16 1HD2 LEU 106 -3.702 10.659 16.490 839 H SER 17 H SER 107 -3.308 11.011 20.544 840 HA SER 17 HA SER 107 -1.942 10.552 23.243 841 1HB SER 17 1HB SER 107 -4.593 9.154 22.710 842 2HB SER 17 2HB SER 107 -3.578 9.064 24.126 843 HG SER 17 HG SER 107 -4.863 11.402 23.179 844 H LYS 18 H LYS 108 -1.207 8.421 23.557 845 HA LYS 18 HA LYS 108 -0.181 7.020 21.101 846 1HB LYS 18 1HB LYS 108 1.098 7.212 23.346 847 2HB LYS 18 2HB LYS 108 -0.016 6.033 24.028 848 1HG LYS 18 1HG LYS 108 0.752 4.334 22.331 849 2HG LYS 18 2HG LYS 108 1.768 5.556 21.553 850 1HD LYS 18 1HD LYS 108 3.142 5.803 23.622 851 2HD LYS 18 2HD LYS 108 2.145 4.599 24.450 852 1HE LYS 18 1HE LYS 108 2.829 2.846 22.742 853 2HE LYS 18 2HE LYS 108 3.794 4.051 21.880 854 1HZ LYS 18 1HZ LYS 108 5.161 2.763 23.335 855 2HZ LYS 18 2HZ LYS 108 5.159 4.316 23.848 856 H LYS 19 H LYS 109 -2.756 6.399 23.450 857 HA LYS 19 HA LYS 109 -3.825 4.040 22.012 858 1HB LYS 19 2HB LYS 109 -4.403 4.663 24.453 859 2HB LYS 19 1HB LYS 109 -5.340 6.027 23.850 860 1HG LYS 19 1HG LYS 109 -7.025 4.527 24.167 861 2HG LYS 19 2HG LYS 109 -6.720 4.153 22.493 862 1HD LYS 19 1HD LYS 109 -5.696 2.592 24.957 863 2HD LYS 19 2HD LYS 109 -7.091 2.158 24.000 864 1HE LYS 19 1HE LYS 109 -4.165 2.088 23.005 865 2HE LYS 19 2HE LYS 109 -5.119 0.713 23.532 866 1HZ LYS 19 1HZ LYS 109 -5.091 0.908 21.148 867 2HZ LYS 19 2HZ LYS 109 -5.733 2.411 21.185 868 H ASP 20 H ASP 110 -4.442 7.635 21.650 869 HA ASP 20 HA ASP 110 -6.517 7.120 19.542 870 1HB ASP 20 1HB ASP 110 -5.100 9.673 20.563 871 2HB ASP 20 2HB ASP 110 -5.929 9.753 19.043 872 HD2 ASP 20 HD2 ASP 110 -6.247 9.412 22.334 873 H ALA 21 H ALA 111 -3.063 7.424 19.397 874 HA ALA 21 HA ALA 111 -2.938 7.775 16.428 875 1HB ALA 21 1HB ALA 111 -0.854 7.193 18.635 876 2HB ALA 21 2HB ALA 111 -0.442 7.137 16.900 877 3HB ALA 21 3HB ALA 111 -1.049 8.603 17.617 878 H THR 22 H THR 112 -2.681 4.923 18.633 879 HA THR 22 HA THR 112 -2.298 3.143 16.330 880 HB THR 22 HB THR 112 -1.618 2.843 18.549 881 HG1 THR 22 HG1 THR 112 -1.442 0.549 18.042 882 1HG2 THR 22 3HG2 THR 112 -3.118 2.551 20.191 883 2HG2 THR 22 1HG2 THR 112 -3.778 1.044 19.386 884 3HG2 THR 22 2HG2 THR 112 -2.102 1.120 19.973 885 H LYS 23 H LYS 113 -5.055 4.046 18.078 886 HA LYS 23 HA LYS 113 -7.231 2.566 16.812 887 1HB LYS 23 2HB LYS 113 -6.420 5.303 18.068 888 2HB LYS 23 1HB LYS 113 -8.079 5.232 17.450 889 1HG LYS 23 1HG LYS 113 -7.149 3.275 19.631 890 2HG LYS 23 2HG LYS 113 -7.930 4.822 19.942 891 1HD LYS 23 1HD LYS 113 -9.939 4.103 18.591 892 2HD LYS 23 2HD LYS 113 -9.213 2.531 18.304 893 1HE LYS 23 1HE LYS 113 -9.890 3.666 21.111 894 2HE LYS 23 2HE LYS 113 -10.956 2.622 20.173 895 1HZ LYS 23 1HZ LYS 113 -8.241 1.857 21.084 896 2HZ LYS 23 2HZ LYS 113 -9.244 0.905 20.212 897 H ALA 24 H ALA 114 -5.670 5.692 16.066 898 HA ALA 24 HA ALA 114 -7.175 6.322 13.675 899 1HB ALA 24 3HB ALA 114 -4.521 7.326 14.773 900 2HB ALA 24 1HB ALA 114 -5.425 8.080 13.416 901 3HB ALA 24 2HB ALA 114 -6.165 7.987 15.033 902 H VAL 25 H VAL 115 -3.995 4.688 14.018 903 HA VAL 25 HA VAL 115 -3.486 4.054 11.165 904 HB VAL 25 HB VAL 115 -2.860 3.045 14.108 905 1HG1 VAL 25 2HG2 VAL 115 -2.030 1.333 11.699 906 2HG1 VAL 25 3HG2 VAL 115 -1.399 1.186 13.373 907 3HG1 VAL 25 1HG2 VAL 115 -3.089 0.852 13.032 908 1HG2 VAL 25 1HG1 VAL 115 -1.560 4.915 13.238 909 2HG2 VAL 25 2HG1 VAL 115 -0.543 3.497 13.534 910 3HG2 VAL 25 3HG1 VAL 115 -1.037 3.920 11.855 911 H ASP 26 H ASP 116 -5.136 2.070 13.729 912 HA ASP 26 HA ASP 116 -6.487 0.394 11.597 913 1HB ASP 26 1HB ASP 116 -6.950 0.597 14.645 914 2HB ASP 26 2HB ASP 116 -7.772 -0.566 13.614 915 HD1 ASP 26 HD2 ASP 116 -5.084 -2.713 13.156 916 H ALA 27 H ALA 117 -6.938 3.196 11.869 917 HA ALA 27 HA ALA 117 -9.900 3.351 11.237 918 1HB ALA 27 3HB ALA 117 -8.682 4.889 13.165 919 2HB ALA 27 1HB ALA 117 -8.362 5.875 11.759 920 3HB ALA 27 2HB ALA 117 -10.016 5.446 12.253 921 H VAL 28 H VAL 118 -6.739 4.385 10.115 922 HA VAL 28 HA VAL 118 -7.602 5.048 7.344 923 HB VAL 28 HB VAL 118 -4.726 4.105 8.140 924 1HG1 VAL 28 1HG2 VAL 118 -6.001 5.273 5.691 925 2HG1 VAL 28 2HG2 VAL 118 -4.408 5.922 6.125 926 3HG1 VAL 28 3HG2 VAL 118 -4.604 4.171 5.916 927 1HG2 VAL 28 3HG1 VAL 118 -5.790 6.876 8.446 928 2HG2 VAL 28 1HG1 VAL 118 -4.896 5.787 9.576 929 3HG2 VAL 28 2HG1 VAL 118 -4.043 6.452 8.177 930 H PHE 29 H PHE 119 -5.662 2.509 8.689 931 HA PHE 29 HA PHE 119 -5.881 0.629 6.377 932 1HB PHE 29 2HB PHE 119 -4.544 0.036 9.076 933 2HB PHE 29 1HB PHE 119 -4.217 -0.733 7.522 934 HD1 PHE 29 HD1 PHE 119 -3.610 1.036 5.549 935 HD2 PHE 29 HD2 PHE 119 -2.885 1.621 9.728 936 HE1 PHE 29 HE1 PHE 119 -1.956 2.787 5.018 937 HE2 PHE 29 HE2 PHE 119 -1.257 3.366 9.211 938 HZ PHE 29 HZ PHE 119 -0.802 3.950 6.818 939 H ASP 30 H ASP 120 -8.192 1.111 8.749 940 HA ASP 30 HA ASP 120 -9.119 -1.790 8.529 941 1HB ASP 30 1HB ASP 120 -9.273 -0.379 10.714 942 2HB ASP 30 2HB ASP 120 -10.538 0.568 9.965 943 HD1 ASP 30 HD2 ASP 120 -9.622 -2.678 10.616 944 H SER 31 H SER 121 -10.080 1.430 7.664 945 HA SER 31 HA SER 121 -12.368 0.662 5.888 946 1HB SER 31 2HB SER 121 -10.731 3.281 5.890 947 2HB SER 31 1HB SER 121 -12.232 3.007 4.979 948 HG SER 31 HG SER 121 -13.271 2.582 6.958 949 H ILE 32 H ILE 122 -8.773 1.035 5.132 950 HA ILE 32 HA ILE 122 -8.919 0.595 2.330 951 HB ILE 32 HB ILE 122 -6.682 -0.041 4.219 952 1HG1 ILE 32 1HG1 ILE 122 -7.603 2.521 2.865 953 2HG1 ILE 32 2HG1 ILE 122 -7.582 2.157 4.549 954 1HG2 ILE 32 3HG2 ILE 122 -6.875 0.523 1.169 955 2HG2 ILE 32 1HG2 ILE 122 -5.354 0.337 2.043 956 3HG2 ILE 32 2HG2 ILE 122 -6.510 -1.021 1.887 957 1HD1 ILE 32 1HD1 ILE 122 -4.949 2.388 3.160 958 2HD1 ILE 32 2HD1 ILE 122 -5.852 3.709 3.993 959 3HD1 ILE 32 3HD1 ILE 122 -5.364 2.263 4.911 960 H THR 33 H THR 123 -8.208 -1.737 4.908 961 HA THR 33 HA THR 123 -8.245 -4.037 3.062 962 HB THR 33 HB THR 123 -7.090 -4.316 5.102 963 HG1 THR 33 HG1 THR 123 -9.483 -5.742 5.507 964 1HG2 THR 33 3HG2 THR 123 -8.277 -2.536 6.473 965 2HG2 THR 33 1HG2 THR 123 -9.579 -3.644 6.808 966 3HG2 THR 33 2HG2 THR 123 -7.902 -3.959 7.421 967 H GLU 34 H GLU 124 -10.880 -2.444 4.738 968 HA GLU 34 HA GLU 124 -12.922 -4.477 3.827 969 1HB GLU 34 1HB GLU 124 -13.188 -1.800 5.327 970 2HB GLU 34 2HB GLU 124 -14.556 -2.473 4.479 971 1HG GLU 34 1HG GLU 124 -14.806 -3.189 6.719 972 2HG GLU 34 2HG GLU 124 -14.432 -4.610 5.771 973 HE2 GLU 34 HE2 GLU 124 -12.117 -3.430 8.820 974 H ALA 35 H ALA 125 -11.492 -1.432 2.621 975 HA ALA 35 HA ALA 125 -13.249 -1.233 0.299 976 1HB ALA 35 2HB ALA 125 -11.427 0.742 0.980 977 2HB ALA 35 3HB ALA 125 -10.195 -0.340 0.435 978 3HB ALA 35 1HB ALA 125 -11.312 0.271 -0.716 979 H LEU 36 H LEU 126 -9.986 -2.692 0.626 980 HA LEU 36 HA LEU 126 -9.769 -3.762 -2.087 981 1HB LEU 36 2HB LEU 126 -8.342 -4.687 0.356 982 2HB LEU 36 1HB LEU 126 -7.785 -4.733 -1.306 983 HG LEU 36 HG LEU 126 -7.726 -2.365 0.556 984 1HD1 LEU 36 3HD2 LEU 126 -5.649 -3.496 -0.018 985 2HD1 LEU 36 1HD2 LEU 126 -5.869 -2.971 -1.744 986 3HD1 LEU 36 2HD2 LEU 126 -5.675 -1.760 -0.439 987 1HD2 LEU 36 2HD1 LEU 126 -7.955 -1.874 -2.480 988 2HD2 LEU 36 3HD1 LEU 126 -9.098 -1.281 -1.260 989 3HD2 LEU 36 1HD1 LEU 126 -7.478 -0.650 -1.250 990 NH1 ARG 37 NH2 ARG 127 -11.477 -8.373 6.503 991 NH2 ARG 37 NH1 ARG 127 -12.046 -10.499 5.934 992 H ARG 37 H ARG 127 -10.736 -5.319 1.038 993 HA ARG 37 HA ARG 127 -11.107 -7.821 -0.242 994 1HB ARG 37 1HB ARG 127 -11.904 -8.825 1.629 995 2HB ARG 37 2HB ARG 127 -10.872 -7.567 2.254 996 1HG ARG 37 1HG ARG 127 -13.196 -6.182 2.389 997 2HG ARG 37 2HG ARG 127 -13.951 -7.760 2.254 998 1HD ARG 37 1HD ARG 127 -11.971 -6.801 4.357 999 2HD ARG 37 2HD ARG 127 -13.738 -6.946 4.541 1000 1HH1 ARG 37 2HH2 ARG 127 -11.517 -7.375 6.270 1001 2HH1 ARG 37 1HH2 ARG 127 -11.023 -8.796 7.320 1002 1HH2 ARG 37 1HH1 ARG 127 -12.518 -11.123 5.270 1003 2HH2 ARG 37 2HH1 ARG 127 -11.554 -10.772 6.792 1004 H LYS 38 H LYS 128 -13.189 -4.957 -0.161 1005 HA LYS 38 HA LYS 128 -15.638 -6.551 -0.998 1006 1HB LYS 38 1HB LYS 128 -15.495 -3.663 -0.032 1007 2HB LYS 38 2HB LYS 128 -16.956 -4.441 -0.600 1008 1HG LYS 38 1HG LYS 128 -16.926 -6.106 1.227 1009 2HG LYS 38 2HG LYS 128 -15.381 -5.499 1.809 1010 1HD LYS 38 1HD LYS 128 -16.494 -3.184 2.123 1011 2HD LYS 38 2HD LYS 128 -18.045 -3.939 1.793 1012 1HE LYS 38 1HE LYS 128 -16.100 -4.768 4.064 1013 2HE LYS 38 2HE LYS 128 -17.438 -3.640 4.265 1014 1HZ LYS 38 1HZ LYS 128 -18.060 -5.825 4.974 1015 2HZ LYS 38 2HZ LYS 128 -18.984 -5.388 3.699 1016 H GLY 39 H GLY 129 -13.155 -5.322 -2.699 1017 1HA GLY 39 1HA GLY 129 -12.947 -4.663 -5.006 1018 2HA GLY 39 2HA GLY 129 -14.675 -4.820 -5.202 1019 H ASP 40 H ASP 130 -13.017 -2.673 -2.945 1020 HA ASP 40 HA ASP 130 -13.906 -0.179 -4.474 1021 1HB ASP 40 1HB ASP 130 -13.535 -0.284 -1.500 1022 2HB ASP 40 2HB ASP 130 -14.035 1.080 -2.446 1023 HD2 ASP 40 HD2 ASP 130 -16.656 -1.734 -1.356 1024 H LYS 41 H LYS 131 -12.627 1.363 -4.994 1025 HA LYS 41 HA LYS 131 -9.654 0.981 -4.692 1026 1HB LYS 41 2HB LYS 131 -10.963 3.316 -6.139 1027 2HB LYS 41 1HB LYS 131 -9.299 2.749 -6.274 1028 1HG LYS 41 1HG LYS 131 -10.257 0.560 -7.307 1029 2HG LYS 41 2HG LYS 131 -11.824 1.357 -7.352 1030 1HD LYS 41 1HD LYS 131 -10.814 3.239 -8.733 1031 2HD LYS 41 2HD LYS 131 -9.267 2.407 -8.750 1032 1HE LYS 41 1HE LYS 131 -11.901 1.275 -9.929 1033 2HE LYS 41 2HE LYS 131 -10.667 2.128 -10.853 1034 1HZ LYS 41 1HZ LYS 131 -10.399 -0.218 -11.079 1035 2HZ LYS 41 2HZ LYS 131 -9.086 0.400 -10.326 1036 H VAL 42 H VAL 132 -8.480 2.076 -3.145 1037 HA VAL 42 HA VAL 132 -9.686 4.172 -1.471 1038 HB VAL 42 HB VAL 132 -7.277 2.273 -1.435 1039 1HG1 VAL 42 3HG2 VAL 132 -6.743 4.231 -0.183 1040 2HG1 VAL 42 1HG2 VAL 132 -8.249 3.958 0.826 1041 3HG1 VAL 42 2HG2 VAL 132 -6.912 2.717 0.774 1042 1HG2 VAL 42 2HG1 VAL 132 -9.849 2.400 0.195 1043 2HG2 VAL 42 3HG1 VAL 132 -9.438 1.208 -1.095 1044 3HG2 VAL 42 1HG1 VAL 132 -8.549 1.233 0.422 1045 H GLN 43 H GLN 133 -9.291 5.872 -1.915 1046 HA GLN 43 HA GLN 133 -7.593 6.731 -4.265 1047 1HB GLN 43 1HB GLN 133 -10.085 8.015 -3.202 1048 2HB GLN 43 2HB GLN 133 -9.177 8.718 -4.517 1049 1HG GLN 43 1HG GLN 133 -10.392 5.891 -4.604 1050 2HG GLN 43 2HG GLN 133 -11.132 7.340 -5.238 1051 1HE2 GLN 43 2HE2 GLN 133 -8.322 5.513 -7.559 1052 2HE2 GLN 43 1HE2 GLN 133 -8.821 4.866 -5.917 1053 H LEU 44 H LEU 134 -5.776 6.910 -2.044 1054 HA LEU 44 HA LEU 134 -5.649 9.646 -1.087 1055 1HB LEU 44 2HB LEU 134 -3.394 7.602 -1.127 1056 2HB LEU 44 1HB LEU 134 -3.259 9.208 -0.426 1057 HG LEU 44 HG LEU 134 -5.275 8.516 1.069 1058 1HD1 LEU 44 2HD1 LEU 134 -4.344 5.698 0.224 1059 2HD1 LEU 44 3HD1 LEU 134 -5.377 6.046 1.635 1060 3HD1 LEU 44 1HD1 LEU 134 -5.971 6.374 0.004 1061 1HD2 LEU 44 1HD2 LEU 134 -2.454 7.258 1.385 1062 2HD2 LEU 44 2HD2 LEU 134 -2.963 8.873 1.937 1063 3HD2 LEU 44 3HD2 LEU 134 -3.628 7.421 2.704 1064 H ILE 45 H ILE 135 -5.124 11.397 -2.072 1065 HA ILE 45 HA ILE 135 -3.646 11.394 -4.661 1066 HB ILE 45 HB ILE 135 -5.690 12.790 -4.312 1067 1HG1 ILE 45 1HG1 ILE 135 -3.244 14.401 -5.246 1068 2HG1 ILE 45 2HG1 ILE 135 -3.972 13.101 -6.172 1069 1HG2 ILE 45 3HG2 ILE 135 -5.128 13.684 -2.015 1070 2HG2 ILE 45 1HG2 ILE 135 -3.845 14.688 -2.739 1071 3HG2 ILE 45 2HG2 ILE 135 -5.557 14.973 -3.172 1072 1HD1 ILE 45 1HD1 ILE 135 -6.172 14.351 -6.273 1073 2HD1 ILE 45 2HD1 ILE 135 -5.417 15.715 -5.405 1074 3HD1 ILE 45 3HD1 ILE 135 -4.820 15.243 -7.011 1075 H GLY 46 H GLY 136 -1.761 12.395 -4.994 1076 1HA GLY 46 1HA GLY 136 0.555 12.680 -4.619 1077 2HA GLY 46 2HA GLY 136 0.142 13.400 -3.086 1078 H PHE 47 H PHE 137 -0.864 10.191 -2.838 1079 HA PHE 47 HA PHE 137 1.804 8.994 -2.169 1080 1HB PHE 47 2HB PHE 137 0.550 10.342 -0.284 1081 2HB PHE 47 1HB PHE 137 -0.611 9.054 -0.229 1082 HD1 PHE 47 HD1 PHE 137 0.242 6.641 0.403 1083 HD2 PHE 47 HD2 PHE 137 2.833 10.071 0.634 1084 HE1 PHE 47 HE1 PHE 137 1.999 5.260 1.424 1085 HE2 PHE 47 HE2 PHE 137 4.522 8.689 1.756 1086 HZ PHE 47 HZ PHE 137 4.186 6.265 2.009 1087 H GLY 48 H GLY 138 -1.831 8.066 -2.330 1088 1HA GLY 48 1HA GLY 138 -0.890 5.217 -2.892 1089 2HA GLY 48 2HA GLY 138 -1.727 5.555 -1.432 1090 H ASN 49 H ASN 139 -2.122 5.636 -4.968 1091 HA ASN 49 HA ASN 139 -5.150 5.472 -4.596 1092 1HB ASN 49 1HB ASN 139 -3.672 5.673 -7.257 1093 2HB ASN 49 2HB ASN 139 -5.379 5.435 -7.049 1094 1HD2 ASN 49 1HD2 ASN 139 -5.963 8.935 -6.487 1095 2HD2 ASN 49 2HD2 ASN 139 -6.647 7.241 -6.655 1096 H PHE 50 H PHE 140 -5.282 3.530 -3.563 1097 HA PHE 50 HA PHE 140 -3.937 1.032 -4.586 1098 1HB PHE 50 2HB PHE 140 -6.008 1.177 -2.359 1099 2HB PHE 50 1HB PHE 140 -5.173 -0.206 -2.697 1100 HD1 PHE 50 HD2 PHE 140 -4.893 3.250 -1.334 1101 HD2 PHE 50 HD1 PHE 140 -3.449 -0.795 -1.247 1102 HE1 PHE 50 HE2 PHE 140 -3.823 3.624 0.908 1103 HE2 PHE 50 HE1 PHE 140 -2.396 -0.336 0.959 1104 HZ PHE 50 HZ PHE 140 -2.318 1.970 1.756 1105 H GLU 51 H GLU 141 -5.081 -0.742 -5.229 1106 HA GLU 51 HA GLU 141 -7.951 -0.836 -5.344 1107 1HB GLU 51 1HB GLU 141 -8.410 -0.782 -7.822 1108 2HB GLU 51 2HB GLU 141 -7.838 0.764 -7.269 1109 1HG GLU 51 1HG GLU 141 -6.035 -1.275 -8.742 1110 2HG GLU 51 2HG GLU 141 -6.989 -0.047 -9.546 1111 HE2 GLU 51 HE2 GLU 141 -3.463 0.871 -7.950 1112 H VAL 52 H VAL 142 -8.912 -2.859 -5.903 1113 HA VAL 52 HA VAL 142 -6.889 -4.988 -5.791 1114 HB VAL 52 HB VAL 142 -9.248 -4.197 -4.353 1115 1HG1 VAL 52 1HG2 VAL 142 -10.057 -6.431 -6.232 1116 2HG1 VAL 52 2HG2 VAL 142 -10.857 -6.010 -4.677 1117 3HG1 VAL 52 3HG2 VAL 142 -10.764 -4.825 -6.025 1118 1HG2 VAL 52 1HG1 VAL 142 -7.739 -6.821 -4.305 1119 2HG2 VAL 52 2HG1 VAL 142 -7.436 -5.319 -3.387 1120 3HG2 VAL 52 3HG1 VAL 142 -8.896 -6.244 -3.099 1121 NH1 ARG 53 NH2 ARG 143 -1.957 -8.546 -12.406 1122 NH2 ARG 53 NH1 ARG 143 -2.316 -10.412 -11.157 1123 H ARG 53 H ARG 143 -7.150 -6.920 -7.026 1124 HA ARG 53 HA ARG 143 -8.233 -6.455 -9.878 1125 1HB ARG 53 1HB ARG 143 -5.695 -6.135 -9.637 1126 2HB ARG 53 2HB ARG 143 -5.571 -7.807 -9.161 1127 1HG ARG 53 1HG ARG 143 -6.694 -8.456 -11.426 1128 2HG ARG 53 2HG ARG 143 -6.652 -6.751 -11.844 1129 1HD ARG 53 1HD ARG 143 -4.757 -7.702 -12.923 1130 2HD ARG 53 2HD ARG 143 -4.091 -6.786 -11.568 1131 1HH1 ARG 53 2HH2 ARG 143 -2.334 -7.665 -12.773 1132 2HH1 ARG 53 1HH2 ARG 143 -1.017 -8.926 -12.565 1133 1HH2 ARG 53 1HH1 ARG 143 -2.963 -10.955 -10.576 1134 2HH2 ARG 53 2HH1 ARG 143 -1.351 -10.661 -11.401 1135 H GLU 54 H GLU 144 -10.079 -7.599 -9.500 1136 HA GLU 54 HA GLU 144 -10.161 -10.216 -8.155 1137 1HB GLU 54 1HB GLU 144 -12.032 -8.547 -8.173 1138 2HB GLU 54 2HB GLU 144 -12.356 -8.929 -9.862 1139 1HG GLU 54 1HG GLU 144 -12.857 -11.336 -9.210 1140 2HG GLU 54 2HG GLU 144 -12.436 -10.984 -7.539 1141 HE2 GLU 54 HE2 GLU 144 -16.013 -9.982 -9.072 1142 NH1 ARG 55 NH2 ARG 145 -6.107 -16.946 -7.750 1143 NH2 ARG 55 NH1 ARG 145 -8.045 -17.946 -7.122 1144 H ARG 55 H ARG 145 -9.808 -12.139 -8.901 1145 HA ARG 55 HA ARG 145 -9.124 -12.691 -11.769 1146 1HB ARG 55 1HB ARG 145 -7.791 -13.621 -9.869 1147 2HB ARG 55 2HB ARG 145 -9.192 -14.502 -9.285 1148 1HG ARG 55 1HG ARG 145 -9.210 -15.903 -11.394 1149 2HG ARG 55 2HG ARG 145 -7.838 -14.985 -11.998 1150 1HD ARG 55 1HD ARG 145 -6.999 -17.068 -11.103 1151 2HD ARG 55 2HD ARG 145 -6.430 -15.758 -10.074 1152 1HH1 ARG 55 2HH2 ARG 145 -5.588 -16.443 -8.479 1153 2HH1 ARG 55 1HH2 ARG 145 -5.763 -17.205 -6.819 1154 1HH2 ARG 55 1HH1 ARG 145 -9.006 -18.207 -7.366 1155 2HH2 ARG 55 2HH1 ARG 145 -7.563 -18.134 -6.236 1156 H ALA 56 H ALA 146 -10.301 -13.979 -13.124 1157 HA ALA 56 HA ALA 146 -13.271 -13.986 -12.720 1158 1HB ALA 56 3HB ALA 146 -12.371 -13.270 -14.888 1159 2HB ALA 56 1HB ALA 146 -11.600 -14.853 -15.151 1160 3HB ALA 56 2HB ALA 146 -13.374 -14.718 -15.101 1161 H ALA 57 H ALA 147 -13.744 -15.550 -11.211 1162 HA ALA 57 HA ALA 147 -13.029 -18.251 -11.078 1163 1HB ALA 57 1HB ALA 147 -14.543 -17.088 -9.398 1164 2HB ALA 57 2HB ALA 147 -15.886 -17.141 -10.562 1165 3HB ALA 57 3HB ALA 147 -15.231 -18.647 -9.882 1166 NH1 ARG 58 NH2 ARG 148 -12.410 -16.745 -17.712 1167 NH2 ARG 58 NH1 ARG 148 -10.201 -16.349 -17.348 1168 H ARG 58 H ARG 148 -13.258 -20.084 -11.931 1169 HA ARG 58 HA ARG 148 -14.688 -20.102 -14.553 1170 1HB ARG 58 2HB ARG 148 -12.307 -21.864 -13.817 1171 2HB ARG 58 1HB ARG 148 -13.034 -21.752 -15.409 1172 1HG ARG 58 1HG ARG 148 -11.439 -19.563 -13.965 1173 2HG ARG 58 2HG ARG 148 -10.864 -20.625 -15.238 1174 1HD ARG 58 1HD ARG 148 -12.572 -19.624 -16.856 1175 2HD ARG 58 2HD ARG 148 -13.106 -18.518 -15.574 1176 1HH1 ARG 58 2HH2 ARG 148 -13.226 -17.336 -17.519 1177 2HH1 ARG 58 1HH2 ARG 148 -12.382 -15.913 -18.311 1178 1HH2 ARG 58 1HH1 ARG 148 -9.334 -16.635 -16.880 1179 2HH2 ARG 58 2HH1 ARG 148 -10.325 -15.545 -17.973 1180 H LYS 59 H LYS 149 -14.619 -22.855 -15.059 1181 HA LYS 59 HA LYS 149 -15.992 -24.288 -12.795 1182 1HB LYS 59 1HB LYS 149 -17.900 -23.209 -14.034 1183 2HB LYS 59 2HB LYS 149 -17.398 -23.990 -15.520 1184 1HG LYS 59 1HG LYS 149 -19.274 -25.208 -14.618 1185 2HG LYS 59 2HG LYS 149 -17.869 -26.256 -14.518 1186 1HD LYS 59 1HD LYS 149 -17.624 -25.677 -12.066 1187 2HD LYS 59 2HD LYS 149 -19.034 -24.636 -12.143 1188 1HE LYS 59 1HE LYS 149 -19.022 -27.693 -12.673 1189 2HE LYS 59 2HE LYS 149 -19.417 -26.938 -11.134 1190 1HZ LYS 59 1HZ LYS 149 -20.925 -26.569 -13.658 1191 2HZ LYS 59 2HZ LYS 149 -21.384 -27.488 -12.386 1192 H GLY 60 H GLY 150 -15.047 -26.194 -12.653 1193 1HA GLY 60 1HA GLY 150 -13.634 -27.463 -15.086 1194 2HA GLY 60 2HA GLY 150 -12.899 -27.465 -13.492 1195 NH1 ARG 61 NH2 ARG 151 -21.348 -32.100 -16.396 1196 NH2 ARG 61 NH1 ARG 151 -23.041 -31.938 -14.889 1197 H ARG 61 H ARG 151 -14.819 -29.210 -15.477 1198 HA ARG 61 HA ARG 151 -16.288 -30.665 -13.217 1199 1HB ARG 61 1HB ARG 151 -17.547 -28.817 -14.211 1200 2HB ARG 61 2HB ARG 151 -17.390 -29.521 -15.819 1201 1HG ARG 61 1HG ARG 151 -18.774 -31.553 -14.872 1202 2HG ARG 61 2HG ARG 151 -18.947 -30.617 -13.383 1203 1HD ARG 61 1HD ARG 151 -20.061 -28.754 -14.734 1204 2HD ARG 61 2HD ARG 151 -19.937 -29.734 -16.187 1205 1HH1 ARG 61 2HH2 ARG 151 -20.450 -31.734 -16.731 1206 2HH1 ARG 61 1HH2 ARG 151 -21.877 -32.886 -16.790 1207 1HH2 ARG 61 1HH1 ARG 151 -23.436 -31.451 -14.076 1208 2HH2 ARG 61 2HH1 ARG 151 -23.453 -32.733 -15.389 1209 H ASN 62 H ASN 152 -16.899 -32.726 -13.527 1210 HA ASN 62 HA ASN 152 -15.041 -34.289 -14.705 1211 1HB ASN 62 1HB ASN 152 -16.044 -36.279 -13.786 1212 2HB ASN 62 2HB ASN 152 -16.247 -34.895 -12.724 1213 1HD2 ASN 62 1HD2 ASN 152 -19.372 -36.632 -12.517 1214 2HD2 ASN 62 2HD2 ASN 152 -17.606 -36.928 -12.160 1215 HA PRO 63 HA PRO 153 -16.438 -35.940 -18.696 1216 1HB PRO 63 1HB PRO 153 -17.189 -33.268 -19.946 1217 2HB PRO 63 2HB PRO 153 -17.893 -34.883 -20.220 1218 1HG PRO 63 1HG PRO 153 -19.244 -33.153 -18.563 1219 2HG PRO 63 2HG PRO 153 -18.983 -34.843 -17.951 1220 1HD PRO 63 1HD PRO 153 -17.327 -32.366 -17.366 1221 2HD PRO 63 2HD PRO 153 -18.267 -33.437 -16.262 1222 H GLN 64 H GLN 154 -14.918 -32.818 -18.093 1223 HA GLN 64 HA GLN 154 -12.556 -33.364 -19.920 1224 1HB GLN 64 1HB GLN 154 -13.614 -31.098 -19.959 1225 2HB GLN 64 2HB GLN 154 -13.378 -30.894 -18.226 1226 1HG GLN 64 1HG GLN 154 -10.986 -30.708 -18.414 1227 2HG GLN 64 2HG GLN 154 -10.988 -31.392 -20.012 1228 1HE2 GLN 64 2HE2 GLN 154 -11.686 -27.348 -19.596 1229 2HE2 GLN 64 1HE2 GLN 154 -11.594 -28.480 -18.155 1230 H THR 65 H THR 155 -13.052 -32.339 -16.568 1231 HA THR 65 HA THR 155 -10.222 -32.986 -15.857 1232 HB THR 65 HB THR 155 -10.534 -31.591 -13.922 1233 HG1 THR 65 HG1 THR 155 -12.615 -32.273 -13.376 1234 1HG2 THR 65 1HG2 THR 155 -10.281 -30.368 -16.144 1235 2HG2 THR 65 2HG2 THR 155 -12.048 -30.211 -16.224 1236 3HG2 THR 65 3HG2 THR 155 -11.161 -29.422 -14.906 1237 H GLY 66 H GLY 156 -13.244 -34.555 -15.087 1238 1HA GLY 66 1HA GLY 156 -13.485 -36.617 -13.830 1239 2HA GLY 66 2HA GLY 156 -11.886 -36.450 -13.148 1240 H GLU 67 H GLU 157 -13.089 -33.479 -12.370 1241 HA GLU 67 HA GLU 157 -14.636 -34.380 -9.896 1242 1HB GLU 67 2HB GLU 157 -12.063 -33.834 -9.694 1243 2HB GLU 67 1HB GLU 157 -12.489 -32.151 -9.975 1244 1HG GLU 67 1HG GLU 157 -14.071 -32.260 -7.944 1245 2HG GLU 67 2HG GLU 157 -13.547 -33.918 -7.664 1246 HE2 GLU 67 HE2 GLU 157 -11.245 -30.757 -6.674 1247 H GLU 68 H GLU 158 -16.352 -33.147 -9.458 1248 HA GLU 68 HA GLU 158 -17.143 -30.881 -11.338 1249 1HB GLU 68 1HB GLU 158 -18.884 -32.339 -9.281 1250 2HB GLU 68 2HB GLU 158 -19.406 -31.081 -10.394 1251 1HG GLU 68 1HG GLU 158 -18.714 -32.608 -12.361 1252 2HG GLU 68 2HG GLU 158 -18.353 -33.864 -11.191 1253 HE1 GLU 68 HE2 GLU 158 -22.174 -32.823 -12.057 1254 H MET 69 H MET 159 -16.311 -28.919 -10.693 1255 HA MET 69 HA MET 159 -17.283 -27.776 -8.167 1256 1HB MET 69 1HB MET 159 -15.319 -27.314 -6.943 1257 2HB MET 69 2HB MET 159 -15.285 -29.027 -7.254 1258 1HG MET 69 1HG MET 159 -13.544 -26.882 -8.627 1259 2HG MET 69 2HG MET 159 -13.026 -28.047 -7.411 1260 1HE MET 69 2HE MET 159 -13.301 -27.303 -11.129 1261 2HE MET 69 1HE MET 159 -11.676 -27.602 -10.472 1262 3HE MET 69 3HE MET 159 -12.371 -28.702 -11.703 1263 H GLU 70 H GLU 160 -17.325 -25.616 -8.188 1264 HA GLU 70 HA GLU 160 -16.545 -24.127 -10.660 1265 1HB GLU 70 2HB GLU 160 -17.638 -22.229 -9.862 1266 2HB GLU 70 1HB GLU 160 -18.701 -23.601 -9.591 1267 1HG GLU 70 1HG GLU 160 -17.093 -22.079 -7.431 1268 2HG GLU 70 2HG GLU 160 -18.785 -21.865 -7.802 1269 HE2 GLU 70 HE2 GLU 160 -17.601 -24.746 -5.328 1270 H ILE 71 H ILE 161 -14.509 -23.257 -10.968 1271 HA ILE 71 HA ILE 161 -12.490 -23.554 -8.885 1272 HB ILE 71 HB ILE 161 -12.285 -22.326 -11.697 1273 1HG1 ILE 71 1HG1 ILE 161 -11.600 -25.228 -10.850 1274 2HG1 ILE 71 2HG1 ILE 161 -13.079 -24.812 -11.681 1275 1HG2 ILE 71 2HG2 ILE 161 -10.410 -21.753 -10.141 1276 2HG2 ILE 71 3HG2 ILE 161 -10.147 -23.498 -9.827 1277 3HG2 ILE 71 1HG2 ILE 161 -9.865 -22.816 -11.459 1278 1HD1 ILE 71 2HD1 ILE 161 -10.291 -24.419 -12.931 1279 2HD1 ILE 71 3HD1 ILE 161 -11.430 -25.729 -13.265 1280 3HD1 ILE 71 1HD1 ILE 161 -11.858 -24.068 -13.711 1281 HA PRO 72 HA PRO 162 -13.880 -19.494 -7.356 1282 1HB PRO 72 1HB PRO 162 -12.230 -19.142 -5.137 1283 2HB PRO 72 2HB PRO 162 -13.500 -20.368 -5.250 1284 1HG PRO 72 1HG PRO 162 -10.507 -20.737 -5.810 1285 2HG PRO 72 2HG PRO 162 -11.544 -21.718 -4.743 1286 1HD PRO 72 1HD PRO 162 -11.005 -22.488 -7.340 1287 2HD PRO 72 2HD PRO 162 -12.609 -22.806 -6.609 1288 H ALA 73 H ALA 163 -13.399 -17.368 -6.910 1289 HA ALA 73 HA ALA 163 -11.340 -16.037 -8.681 1290 1HB ALA 73 2HB ALA 163 -13.699 -15.032 -8.423 1291 2HB ALA 73 3HB ALA 163 -13.384 -14.796 -6.667 1292 3HB ALA 73 1HB ALA 163 -12.453 -13.905 -7.863 1293 H SER 74 H SER 164 -10.298 -14.147 -7.760 1294 HA SER 74 HA SER 164 -10.219 -13.758 -5.011 1295 1HB SER 74 1HB SER 164 -8.457 -15.628 -4.881 1296 2HB SER 74 2HB SER 164 -7.397 -14.719 -5.969 1297 HG SER 74 HG SER 164 -6.866 -14.480 -3.789 1298 H LYS 75 H LYS 165 -9.604 -11.867 -4.379 1299 HA LYS 75 HA LYS 165 -8.961 -9.749 -6.468 1300 1HB LYS 75 2HB LYS 165 -9.468 -8.920 -3.639 1301 2HB LYS 75 1HB LYS 165 -9.552 -8.064 -5.125 1302 1HG LYS 75 1HG LYS 165 -11.799 -8.247 -4.726 1303 2HG LYS 75 2HG LYS 165 -11.579 -9.652 -5.750 1304 1HD LYS 75 1HD LYS 165 -11.350 -11.054 -3.551 1305 2HD LYS 75 2HD LYS 165 -11.761 -9.605 -2.653 1306 1HE LYS 75 1HE LYS 165 -13.555 -10.974 -4.781 1307 2HE LYS 75 2HE LYS 165 -13.696 -11.198 -3.040 1308 1HZ LYS 75 1HZ LYS 165 -14.237 -8.873 -2.792 1309 2HZ LYS 75 2HZ LYS 165 -15.282 -9.609 -3.810 1310 H VAL 76 H VAL 166 -6.766 -8.960 -6.724 1311 HA VAL 76 HA VAL 166 -4.779 -9.697 -4.770 1312 HB VAL 76 HB VAL 166 -5.412 -9.464 -7.701 1313 1HG1 VAL 76 1HG2 VAL 166 -2.691 -8.821 -6.828 1314 2HG1 VAL 76 2HG2 VAL 166 -3.260 -9.342 -8.501 1315 3HG1 VAL 76 3HG2 VAL 166 -3.872 -7.844 -7.777 1316 1HG2 VAL 76 3HG1 VAL 166 -5.334 -11.653 -6.560 1317 2HG2 VAL 76 1HG1 VAL 166 -4.177 -11.513 -7.894 1318 3HG2 VAL 76 2HG1 VAL 166 -3.599 -11.385 -6.197 1319 HA PRO 77 HA PRO 167 -5.158 -5.125 -4.054 1320 1HB PRO 77 1HB PRO 167 -3.775 -4.985 -1.638 1321 2HB PRO 77 2HB PRO 167 -5.320 -5.829 -1.773 1322 1HG PRO 77 1HG PRO 167 -2.517 -7.070 -1.870 1323 2HG PRO 77 2HG PRO 167 -3.891 -7.581 -0.873 1324 1HD PRO 77 1HD PRO 167 -3.270 -8.741 -3.435 1325 2HD PRO 77 2HD PRO 167 -4.950 -8.691 -2.826 1326 H ALA 78 H ALA 168 -4.269 -3.549 -4.653 1327 HA ALA 78 HA ALA 168 -1.268 -3.355 -5.231 1328 1HB ALA 78 3HB ALA 168 -2.869 -3.998 -7.179 1329 2HB ALA 78 1HB ALA 168 -3.575 -2.373 -7.026 1330 3HB ALA 78 2HB ALA 168 -1.859 -2.560 -7.450 1331 H PHE 79 H PHE 169 -0.694 -1.139 -5.728 1332 HA PHE 79 HA PHE 169 -1.920 1.152 -4.006 1333 1HB PHE 79 2HB PHE 169 -0.965 0.146 -2.346 1334 2HB PHE 79 1HB PHE 169 0.530 -0.254 -3.276 1335 HD1 PHE 79 HD1 PHE 169 2.322 1.368 -3.656 1336 HD2 PHE 79 HD2 PHE 169 -1.117 2.412 -1.292 1337 HE1 PHE 79 HE1 PHE 169 3.505 3.339 -2.800 1338 HE2 PHE 79 HE2 PHE 169 0.109 4.348 -0.395 1339 HZ PHE 79 HZ PHE 169 2.405 4.836 -1.182 1340 H LYS 80 H LYS 170 -1.633 2.620 -5.397 1341 HA LYS 80 HA LYS 170 0.628 3.036 -7.537 1342 1HB LYS 80 2HB LYS 170 -1.910 4.610 -7.038 1343 2HB LYS 80 1HB LYS 170 -0.657 5.146 -8.125 1344 1HG LYS 80 1HG LYS 170 -2.310 2.564 -8.447 1345 2HG LYS 80 2HG LYS 170 -2.599 4.068 -9.290 1346 1HD LYS 80 1HD LYS 170 -0.095 2.292 -9.604 1347 2HD LYS 80 2HD LYS 170 -1.467 2.355 -10.698 1348 1HE LYS 80 1HE LYS 170 -0.961 4.794 -11.225 1349 2HE LYS 80 2HE LYS 170 0.439 4.732 -10.145 1350 1HZ LYS 80 1HZ LYS 170 1.055 4.367 -12.426 1351 2HZ LYS 80 2HZ LYS 170 0.051 3.086 -12.577 1352 HA PRO 81 HA PRO 171 2.457 5.599 -4.219 1353 1HB PRO 81 1HB PRO 171 4.746 6.429 -5.517 1354 2HB PRO 81 2HB PRO 171 4.483 4.745 -5.061 1355 1HG PRO 81 1HG PRO 171 3.950 6.021 -7.799 1356 2HG PRO 81 2HG PRO 171 4.956 4.589 -7.446 1357 1HD PRO 81 1HD PRO 171 2.307 4.395 -8.225 1358 2HD PRO 81 2HD PRO 171 3.008 3.220 -7.064 1359 H GLY 82 H GLY 172 0.206 6.723 -5.557 1360 1HA GLY 82 1HA GLY 172 -0.780 8.594 -6.706 1361 2HA GLY 82 2HA GLY 172 0.019 9.423 -5.394 1362 H LYS 83 H LYS 173 2.109 8.086 -7.738 1363 HA LYS 83 HA LYS 173 3.571 8.978 -9.373 1364 1HB LYS 83 2HB LYS 173 1.353 10.929 -9.732 1365 2HB LYS 83 1HB LYS 173 2.846 11.743 -9.922 1366 1HG LYS 83 1HG LYS 173 1.947 9.245 -11.500 1367 2HG LYS 83 2HG LYS 173 1.930 10.892 -12.095 1368 1HD LYS 83 1HD LYS 173 4.456 9.245 -11.429 1369 2HD LYS 83 2HD LYS 173 3.806 9.561 -13.028 1370 1HE LYS 83 1HE LYS 173 4.241 12.047 -12.740 1371 2HE LYS 83 2HE LYS 173 4.903 11.744 -11.127 1372 1HZ LYS 83 1HZ LYS 173 5.980 10.643 -13.659 1373 2HZ LYS 83 2HZ LYS 173 6.610 11.893 -12.815 1374 H ALA 84 H ALA 174 2.581 11.197 -7.087 1375 HA ALA 84 HA ALA 174 4.820 13.023 -6.707 1376 1HB ALA 84 2HB ALA 174 2.429 13.332 -6.008 1377 2HB ALA 84 3HB ALA 174 2.574 11.928 -4.919 1378 3HB ALA 84 1HB ALA 174 3.488 13.413 -4.554 1379 H LEU 85 H LEU 175 3.914 9.986 -4.757 1380 HA LEU 85 HA LEU 175 6.359 10.069 -3.167 1381 1HB LEU 85 2HB LEU 175 4.385 8.815 -2.371 1382 2HB LEU 85 1HB LEU 175 4.433 7.774 -3.776 1383 HG LEU 85 HG LEU 175 6.817 7.249 -3.114 1384 1HD1 LEU 85 1HD1 LEU 175 7.165 8.909 -1.296 1385 2HD1 LEU 85 2HD1 LEU 175 5.873 8.146 -0.339 1386 3HD1 LEU 85 3HD1 LEU 175 7.389 7.264 -0.668 1387 1HD2 LEU 85 2HD2 LEU 175 4.903 5.582 -2.995 1388 2HD2 LEU 85 3HD2 LEU 175 6.074 5.286 -1.710 1389 3HD2 LEU 85 1HD2 LEU 175 4.534 6.112 -1.342 1390 H LYS 86 H LYS 176 5.512 8.646 -6.307 1391 HA LYS 86 HA LYS 176 8.018 7.224 -6.781 1392 1HB LYS 86 1HB LYS 176 5.782 7.195 -8.231 1393 2HB LYS 86 2HB LYS 176 6.529 8.493 -9.136 1394 1HG LYS 86 1HG LYS 176 8.518 6.982 -9.612 1395 2HG LYS 86 2HG LYS 176 7.754 5.698 -8.673 1396 1HD LYS 86 1HD LYS 176 5.765 5.741 -10.247 1397 2HD LYS 86 2HD LYS 176 6.542 6.981 -11.219 1398 1HE LYS 86 1HE LYS 176 7.704 4.146 -10.725 1399 2HE LYS 86 2HE LYS 176 6.723 4.595 -12.118 1400 1HZ LYS 86 1HZ LYS 176 9.066 4.669 -12.613 1401 2HZ LYS 86 2HZ LYS 176 9.358 5.766 -11.436 1402 H ASP 87 H ASP 177 7.406 10.700 -6.933 1403 HA ASP 87 HA ASP 177 10.076 11.298 -8.133 1404 1HB ASP 87 1HB ASP 177 7.499 12.619 -7.886 1405 2HB ASP 87 2HB ASP 177 8.475 13.441 -6.742 1406 HD1 ASP 87 HD2 ASP 177 9.110 13.661 -10.764 1407 H ALA 88 H ALA 178 8.546 11.391 -4.883 1408 HA ALA 88 HA ALA 178 10.691 12.451 -3.242 1409 1HB ALA 88 3HB ALA 178 8.333 11.754 -2.370 1410 2HB ALA 88 1HB ALA 178 8.805 10.062 -2.542 1411 3HB ALA 88 2HB ALA 178 9.655 11.058 -1.386 1412 H VAL 89 H VAL 179 10.121 9.107 -4.417 1413 HA VAL 89 HA VAL 179 12.263 7.913 -2.821 1414 HB VAL 89 HB VAL 179 9.616 7.462 -3.214 1415 1HG1 VAL 89 2HG2 VAL 179 9.936 7.374 -5.782 1416 2HG1 VAL 89 3HG2 VAL 179 10.634 5.758 -5.538 1417 3HG1 VAL 89 1HG2 VAL 179 8.965 6.135 -4.983 1418 1HG2 VAL 89 1HG1 VAL 179 10.958 6.184 -1.834 1419 2HG2 VAL 89 2HG1 VAL 179 9.748 5.264 -2.762 1420 3HG2 VAL 89 3HG1 VAL 179 11.492 5.172 -3.252 1421 H LYS 90 H LYS 180 12.059 9.091 -6.052 1422 HA LYS 90 HA LYS 180 13.719 7.176 -7.477 1423 1HB LYS 90 1HB LYS 180 12.472 9.891 -7.953 1424 2HB LYS 90 2HB LYS 180 13.975 9.703 -8.806 1425 1HG LYS 90 1HG LYS 180 13.195 7.642 -9.942 1426 2HG LYS 90 2HG LYS 180 11.715 7.629 -8.987 1427 1HD LYS 90 1HD LYS 180 11.100 9.917 -9.976 1428 2HD LYS 90 2HD LYS 180 12.540 9.829 -10.997 1429 1HE LYS 90 1HE LYS 180 11.641 7.710 -12.078 1430 2HE LYS 90 2HE LYS 180 10.220 7.776 -11.025 1431 1HZ LYS 90 1HZ LYS 180 9.738 8.729 -13.146 1432 2HZ LYS 90 2HZ LYS 180 9.630 9.893 -12.003 Start of MODEL 21 Raw file had 1432 H/Q atoms Start of MODEL 21 1 1H MET 1 1H MET 1 -11.778 5.271 -2.217 2 2H MET 1 2H MET 1 -13.304 5.702 -2.615 3 HA MET 1 HA MET 1 -13.702 6.669 -0.494 4 1HB MET 1 1HB MET 1 -10.767 5.940 0.148 5 2HB MET 1 2HB MET 1 -11.785 6.980 1.105 6 1HG MET 1 1HG MET 1 -13.413 4.852 1.286 7 2HG MET 1 2HG MET 1 -11.964 3.952 0.804 8 1HE MET 1 2HE MET 1 -10.501 2.977 2.742 9 2HE MET 1 1HE MET 1 -10.825 3.401 4.438 10 3HE MET 1 3HE MET 1 -12.143 2.745 3.419 11 H ASN 2 H ASN 2 -10.500 7.780 -0.735 12 HA ASN 2 HA ASN 2 -10.075 9.171 -2.904 13 1HB ASN 2 1HB ASN 2 -10.820 11.435 -3.119 14 2HB ASN 2 2HB ASN 2 -12.174 10.364 -3.076 15 1HD2 ASN 2 1HD2 ASN 2 -13.617 11.855 -0.098 16 2HD2 ASN 2 2HD2 ASN 2 -13.538 10.315 -1.092 17 H LYS 3 H LYS 3 -10.113 9.741 0.400 18 HA LYS 3 HA LYS 3 -7.813 9.858 1.575 19 1HB LYS 3 1HB LYS 3 -6.631 11.022 -0.389 20 2HB LYS 3 2HB LYS 3 -7.400 12.521 0.067 21 1HG LYS 3 1HG LYS 3 -6.175 12.422 2.296 22 2HG LYS 3 2HG LYS 3 -5.613 10.790 1.933 23 1HD LYS 3 1HD LYS 3 -4.324 11.707 -0.059 24 2HD LYS 3 2HD LYS 3 -4.813 13.343 0.407 25 1HE LYS 3 1HE LYS 3 -3.642 13.026 2.657 26 2HE LYS 3 2HE LYS 3 -3.150 11.399 2.156 27 1HZ LYS 3 1HZ LYS 3 -2.407 13.904 0.751 28 2HZ LYS 3 2HZ LYS 3 -1.957 12.400 0.293 29 H THR 4 H THR 4 -10.680 12.057 0.932 30 HA THR 4 HA THR 4 -10.478 13.217 3.571 31 HB THR 4 HB THR 4 -12.455 13.309 1.198 32 HG1 THR 4 HG1 THR 4 -10.389 14.236 0.766 33 1HG2 THR 4 3HG2 THR 4 -12.154 14.958 3.723 34 2HG2 THR 4 1HG2 THR 4 -13.211 15.389 2.297 35 3HG2 THR 4 2HG2 THR 4 -13.522 13.886 3.249 36 H GLU 5 H GLU 5 -12.171 10.525 1.847 37 HA GLU 5 HA GLU 5 -14.149 10.017 3.984 38 1HB GLU 5 1HB GLU 5 -14.800 9.591 1.713 39 2HB GLU 5 2HB GLU 5 -13.254 8.890 1.269 40 1HG GLU 5 1HG GLU 5 -14.744 7.195 1.257 41 2HG GLU 5 2HG GLU 5 -13.626 6.941 2.595 42 HE1 GLU 5 HE2 GLU 5 -17.623 7.571 3.211 43 H LEU 6 H LEU 6 -10.799 9.690 3.494 44 HA LEU 6 HA LEU 6 -10.098 7.295 5.079 45 1HB LEU 6 2HB LEU 6 -8.892 9.236 3.194 46 2HB LEU 6 1HB LEU 6 -8.084 9.544 4.687 47 HG LEU 6 HG LEU 6 -7.725 6.962 4.655 48 1HD1 LEU 6 2HD1 LEU 6 -9.420 6.227 3.066 49 2HD1 LEU 6 3HD1 LEU 6 -8.673 7.171 1.761 50 3HD1 LEU 6 1HD1 LEU 6 -7.828 5.754 2.455 51 1HD2 LEU 6 1HD2 LEU 6 -5.922 8.580 4.106 52 2HD2 LEU 6 2HD2 LEU 6 -5.729 7.020 3.302 53 3HD2 LEU 6 3HD2 LEU 6 -6.320 8.429 2.380 54 H ILE 7 H ILE 7 -10.163 10.878 5.407 55 HA ILE 7 HA ILE 7 -9.266 11.105 8.145 56 HB ILE 7 HB ILE 7 -11.162 13.032 6.652 57 1HG1 ILE 7 1HG1 ILE 7 -8.108 13.211 6.749 58 2HG1 ILE 7 2HG1 ILE 7 -8.922 12.454 5.440 59 1HG2 ILE 7 2HG2 ILE 7 -10.996 13.548 9.134 60 2HG2 ILE 7 3HG2 ILE 7 -9.240 13.651 8.969 61 3HG2 ILE 7 1HG2 ILE 7 -10.275 14.831 8.151 62 1HD1 ILE 7 3HD1 ILE 7 -10.242 14.638 5.034 63 2HD1 ILE 7 1HD1 ILE 7 -9.010 15.411 6.022 64 3HD1 ILE 7 2HD1 ILE 7 -8.526 14.524 4.554 65 H ASN 8 H ASN 8 -12.586 11.029 6.829 66 HA ASN 8 HA ASN 8 -13.841 10.897 9.519 67 1HB ASN 8 1HB ASN 8 -15.055 10.163 6.750 68 2HB ASN 8 2HB ASN 8 -15.977 10.213 8.235 69 1HD2 ASN 8 2HD2 ASN 8 -15.411 13.734 6.315 70 2HD2 ASN 8 1HD2 ASN 8 -14.797 12.131 5.667 71 H ALA 9 H ALA 9 -12.215 8.420 7.797 72 HA ALA 9 HA ALA 9 -13.635 6.116 9.139 73 1HB ALA 9 2HB ALA 9 -12.129 5.775 6.971 74 2HB ALA 9 3HB ALA 9 -10.732 6.248 7.953 75 3HB ALA 9 1HB ALA 9 -11.580 4.800 8.393 76 H VAL 10 H VAL 10 -10.569 8.027 9.548 77 HA VAL 10 HA VAL 10 -9.684 6.460 11.701 78 HB VAL 10 HB VAL 10 -8.671 9.291 11.270 79 1HG1 VAL 10 3HG2 VAL 10 -7.696 7.435 12.966 80 2HG1 VAL 10 1HG2 VAL 10 -6.756 7.018 11.498 81 3HG1 VAL 10 2HG2 VAL 10 -6.693 8.666 12.131 82 1HG2 VAL 10 1HG1 VAL 10 -8.432 6.971 9.354 83 2HG2 VAL 10 2HG1 VAL 10 -8.872 8.697 9.147 84 3HG2 VAL 10 3HG1 VAL 10 -7.157 8.274 9.426 85 H ALA 11 H ALA 11 -10.952 9.605 11.456 86 HA ALA 11 HA ALA 11 -11.131 9.925 14.243 87 1HB ALA 11 2HB ALA 11 -11.101 11.888 12.631 88 2HB ALA 11 3HB ALA 11 -12.713 11.435 12.025 89 3HB ALA 11 1HB ALA 11 -12.518 12.055 13.697 90 H GLU 12 H GLU 12 -13.360 8.280 12.149 91 HA GLU 12 HA GLU 12 -15.540 8.224 14.212 92 1HB GLU 12 1HB GLU 12 -16.182 8.116 11.818 93 2HB GLU 12 2HB GLU 12 -15.223 6.652 11.580 94 1HG GLU 12 1HG GLU 12 -16.753 5.377 13.117 95 2HG GLU 12 2HG GLU 12 -17.678 6.842 13.441 96 HE1 GLU 12 HE2 GLU 12 -18.049 4.791 9.963 97 H THR 13 H THR 13 -13.072 5.866 12.955 98 HA THR 13 HA THR 13 -13.764 4.111 15.316 99 HB THR 13 HB THR 13 -13.544 3.413 12.867 100 HG1 THR 13 HG1 THR 13 -12.396 1.894 14.959 101 1HG2 THR 13 3HG2 THR 13 -11.209 4.064 12.402 102 2HG2 THR 13 1HG2 THR 13 -10.644 2.882 13.611 103 3HG2 THR 13 2HG2 THR 13 -11.510 2.330 12.146 104 H SER 14 H SER 14 -12.036 6.465 15.326 105 HA SER 14 HA SER 14 -10.290 5.433 17.663 106 1HB SER 14 1HB SER 14 -9.225 7.601 15.752 107 2HB SER 14 2HB SER 14 -8.392 6.905 17.127 108 HG SER 14 HG SER 14 -9.285 5.489 14.841 109 H GLY 15 H GLY 15 -12.157 8.278 16.497 110 1HA GLY 15 1HA GLY 15 -12.901 10.191 17.667 111 2HA GLY 15 2HA GLY 15 -12.650 9.302 19.166 112 H LEU 16 H LEU 16 -10.624 10.668 16.656 113 HA LEU 16 HA LEU 16 -8.991 12.379 18.548 114 1HB LEU 16 1HB LEU 16 -7.252 12.376 16.899 115 2HB LEU 16 2HB LEU 16 -7.549 10.868 17.741 116 HG LEU 16 HG LEU 16 -8.591 9.869 15.973 117 1HD1 LEU 16 2HD1 LEU 16 -9.953 11.810 15.042 118 2HD1 LEU 16 3HD1 LEU 16 -8.424 12.339 14.276 119 3HD1 LEU 16 1HD1 LEU 16 -9.209 10.759 13.832 120 1HD2 LEU 16 3HD2 LEU 16 -6.506 9.327 15.738 121 2HD2 LEU 16 1HD2 LEU 16 -7.529 9.247 14.280 122 3HD2 LEU 16 2HD2 LEU 16 -6.364 10.552 14.425 123 H SER 17 H SER 17 -8.689 13.525 15.848 124 HA SER 17 HA SER 17 -11.016 15.515 15.776 125 1HB SER 17 1HB SER 17 -8.180 16.553 15.390 126 2HB SER 17 2HB SER 17 -9.677 17.451 15.356 127 HG SER 17 HG SER 17 -8.652 16.062 17.600 128 H LYS 18 H LYS 18 -11.335 16.476 13.719 129 HA LYS 18 HA LYS 18 -10.798 14.683 11.366 130 1HB LYS 18 1HB LYS 18 -12.148 17.446 11.414 131 2HB LYS 18 2HB LYS 18 -11.760 16.570 9.941 132 1HG LYS 18 1HG LYS 18 -13.129 14.560 10.821 133 2HG LYS 18 2HG LYS 18 -13.625 15.569 12.168 134 1HD LYS 18 1HD LYS 18 -15.405 15.631 10.594 135 2HD LYS 18 2HD LYS 18 -14.661 17.225 10.525 136 1HE LYS 18 1HE LYS 18 -13.453 16.575 8.384 137 2HE LYS 18 2HE LYS 18 -14.104 14.936 8.498 138 1HZ LYS 18 1HZ LYS 18 -16.323 15.838 8.282 139 2HZ LYS 18 2HZ LYS 18 -15.394 16.275 7.010 140 H LYS 19 H LYS 19 -9.540 17.813 12.483 141 HA LYS 19 HA LYS 19 -7.406 18.065 10.468 142 1HB LYS 19 2HB LYS 19 -8.201 19.944 11.965 143 2HB LYS 19 1HB LYS 19 -7.440 19.166 13.358 144 1HG LYS 19 1HG LYS 19 -5.182 19.394 12.197 145 2HG LYS 19 2HG LYS 19 -5.976 20.157 10.818 146 1HD LYS 19 1HD LYS 19 -6.778 22.033 12.312 147 2HD LYS 19 2HD LYS 19 -6.021 21.253 13.707 148 1HE LYS 19 1HE LYS 19 -3.741 21.475 12.595 149 2HE LYS 19 2HE LYS 19 -4.498 22.263 11.202 150 1HZ LYS 19 1HZ LYS 19 -3.630 23.873 12.728 151 2HZ LYS 19 2HZ LYS 19 -5.256 24.026 12.655 152 H ASP 20 H ASP 20 -7.507 16.251 13.642 153 HA ASP 20 HA ASP 20 -4.602 15.474 13.396 154 1HB ASP 20 1HB ASP 20 -6.863 14.631 15.315 155 2HB ASP 20 2HB ASP 20 -5.449 13.624 15.210 156 HD2 ASP 20 HD2 ASP 20 -5.244 17.170 17.063 157 H ALA 21 H ALA 21 -7.616 14.052 12.284 158 HA ALA 21 HA ALA 21 -6.430 11.442 11.472 159 1HB ALA 21 2HB ALA 21 -9.162 12.785 10.987 160 2HB ALA 21 3HB ALA 21 -8.696 11.228 10.245 161 3HB ALA 21 1HB ALA 21 -8.749 11.402 11.975 162 H THR 22 H THR 22 -7.131 14.536 9.727 163 HA THR 22 HA THR 22 -6.200 13.739 7.100 164 HB THR 22 HB THR 22 -5.873 16.569 8.321 165 HG1 THR 22 HG1 THR 22 -7.921 15.820 8.851 166 1HG2 THR 22 3HG2 THR 22 -6.654 15.516 5.541 167 2HG2 THR 22 1HG2 THR 22 -6.654 17.240 6.017 168 3HG2 THR 22 2HG2 THR 22 -5.117 16.306 5.984 169 H LYS 23 H LYS 23 -4.519 15.183 9.766 170 HA LYS 23 HA LYS 23 -1.797 15.269 8.649 171 1HB LYS 23 2HB LYS 23 -2.977 14.935 11.524 172 2HB LYS 23 1HB LYS 23 -1.280 15.085 11.314 173 1HG LYS 23 1HG LYS 23 -3.038 17.352 10.196 174 2HG LYS 23 2HG LYS 23 -2.816 17.200 11.923 175 1HD LYS 23 1HD LYS 23 -1.212 18.801 11.103 176 2HD LYS 23 2HD LYS 23 -0.384 17.409 11.760 177 1HE LYS 23 1HE LYS 23 0.814 18.120 9.771 178 2HE LYS 23 2HE LYS 23 0.098 16.553 9.419 179 1HZ LYS 23 1HZ LYS 23 -0.187 18.119 7.615 180 2HZ LYS 23 2HZ LYS 23 -0.959 19.198 8.568 181 H ALA 24 H ALA 24 -3.285 12.966 10.829 182 HA ALA 24 HA ALA 24 -1.125 11.136 11.088 183 1HB ALA 24 2HB ALA 24 -2.888 11.268 12.658 184 2HB ALA 24 3HB ALA 24 -4.096 10.677 11.472 185 3HB ALA 24 1HB ALA 24 -2.788 9.595 12.059 186 H VAL 25 H VAL 25 -3.719 11.015 8.672 187 HA VAL 25 HA VAL 25 -2.773 8.622 7.119 188 HB VAL 25 HB VAL 25 -4.439 11.306 6.820 189 1HG1 VAL 25 1HG2 VAL 25 -3.813 9.560 4.367 190 2HG1 VAL 25 2HG2 VAL 25 -5.069 10.843 4.447 191 3HG1 VAL 25 3HG2 VAL 25 -3.373 11.253 4.613 192 1HG2 VAL 25 3HG1 VAL 25 -5.568 9.368 7.863 193 2HG2 VAL 25 1HG1 VAL 25 -6.364 9.897 6.377 194 3HG2 VAL 25 2HG1 VAL 25 -5.355 8.414 6.368 195 H ASP 26 H ASP 26 -2.185 12.173 6.583 196 HA ASP 26 HA ASP 26 0.249 11.604 4.907 197 1HB ASP 26 1HB ASP 26 -1.408 13.631 4.788 198 2HB ASP 26 2HB ASP 26 -0.586 14.261 6.213 199 HD1 ASP 26 HD2 ASP 26 1.186 14.183 2.528 200 H ALA 27 H ALA 27 0.051 10.866 7.700 201 HA ALA 27 HA ALA 27 2.864 11.453 8.681 202 1HB ALA 27 2HB ALA 27 0.720 11.996 10.242 203 2HB ALA 27 3HB ALA 27 0.798 10.265 10.514 204 3HB ALA 27 1HB ALA 27 2.157 11.322 10.913 205 H VAL 28 H VAL 28 0.531 8.842 8.272 206 HA VAL 28 HA VAL 28 2.480 6.631 8.375 207 HB VAL 28 HB VAL 28 -0.129 6.683 6.665 208 1HG1 VAL 28 2HG2 VAL 28 1.944 4.699 6.853 209 2HG1 VAL 28 3HG2 VAL 28 0.556 4.028 7.717 210 3HG1 VAL 28 1HG2 VAL 28 0.352 4.640 6.053 211 1HG2 VAL 28 2HG1 VAL 28 0.090 5.626 9.446 212 2HG2 VAL 28 3HG1 VAL 28 -0.855 7.058 8.832 213 3HG2 VAL 28 1HG1 VAL 28 -1.274 5.426 8.254 214 H PHE 29 H PHE 29 0.761 8.104 5.758 215 HA PHE 29 HA PHE 29 2.308 7.040 3.521 216 1HB PHE 29 2HB PHE 29 0.227 9.250 3.433 217 2HB PHE 29 1HB PHE 29 0.812 8.364 2.037 218 HD1 PHE 29 HD1 PHE 29 0.835 5.553 2.597 219 HD2 PHE 29 HD2 PHE 29 -1.946 8.491 4.031 220 HE1 PHE 29 HE1 PHE 29 -0.745 3.774 3.167 221 HE2 PHE 29 HE2 PHE 29 -3.507 6.697 4.653 222 HZ PHE 29 HZ PHE 29 -2.861 4.329 4.273 223 H ASP 30 H ASP 30 3.036 9.837 5.369 224 HA ASP 30 HA ASP 30 4.821 10.929 3.212 225 1HB ASP 30 1HB ASP 30 3.611 12.245 5.187 226 2HB ASP 30 2HB ASP 30 4.934 11.739 6.196 227 HD2 ASP 30 HD2 ASP 30 5.362 14.674 3.473 228 H SER 31 H SER 31 5.146 9.070 6.100 229 HA SER 31 HA SER 31 8.156 8.811 6.039 230 1HB SER 31 1HB SER 31 6.226 6.977 7.547 231 2HB SER 31 2HB SER 31 7.974 7.083 7.765 232 HG SER 31 HG SER 31 6.868 8.307 9.298 233 H ILE 32 H ILE 32 5.375 6.704 4.741 234 HA ILE 32 HA ILE 32 6.884 4.573 3.741 235 HB ILE 32 HB ILE 32 4.473 5.695 2.357 236 1HG1 ILE 32 1HG1 ILE 32 4.682 4.640 5.150 237 2HG1 ILE 32 2HG1 ILE 32 3.810 5.924 4.366 238 1HG2 ILE 32 2HG2 ILE 32 6.062 3.572 1.660 239 2HG2 ILE 32 3HG2 ILE 32 5.158 2.798 2.958 240 3HG2 ILE 32 1HG2 ILE 32 4.297 3.432 1.539 241 1HD1 ILE 32 3HD1 ILE 32 2.545 3.731 3.279 242 2HD1 ILE 32 1HD1 ILE 32 2.934 3.250 4.994 243 3HD1 ILE 32 2HD1 ILE 32 2.031 4.765 4.643 244 H THR 33 H THR 33 5.823 7.548 2.043 245 HA THR 33 HA THR 33 7.422 6.895 -0.370 246 HB THR 33 HB THR 33 5.596 8.528 -0.577 247 HG1 THR 33 HG1 THR 33 8.050 9.835 -0.992 248 1HG2 THR 33 3HG2 THR 33 5.772 9.593 1.706 249 2HG2 THR 33 1HG2 THR 33 7.136 10.553 1.151 250 3HG2 THR 33 2HG2 THR 33 5.508 10.764 0.409 251 H GLU 34 H GLU 34 8.394 8.501 2.641 252 HA GLU 34 HA GLU 34 11.118 9.170 1.592 253 1HB GLU 34 1HB GLU 34 10.052 10.335 3.632 254 2HB GLU 34 2HB GLU 34 10.186 8.828 4.531 255 1HG GLU 34 1HG GLU 34 12.736 8.934 4.235 256 2HG GLU 34 2HG GLU 34 12.554 10.456 3.369 257 HE1 GLU 34 HE2 GLU 34 11.890 12.370 6.187 258 H ALA 35 H ALA 35 9.645 6.285 3.194 259 HA ALA 35 HA ALA 35 12.119 4.743 3.219 260 1HB ALA 35 1HB ALA 35 9.770 3.904 4.352 261 2HB ALA 35 2HB ALA 35 9.272 3.526 2.713 262 3HB ALA 35 3HB ALA 35 10.589 2.648 3.411 263 H LEU 36 H LEU 36 9.493 4.820 0.779 264 HA LEU 36 HA LEU 36 10.685 3.036 -1.141 265 1HB LEU 36 2HB LEU 36 8.684 5.155 -1.713 266 2HB LEU 36 1HB LEU 36 8.954 3.664 -2.584 267 HG LEU 36 HG LEU 36 7.759 3.800 0.233 268 1HD1 LEU 36 1HD2 LEU 36 6.136 3.990 -1.503 269 2HD1 LEU 36 2HD2 LEU 36 6.708 2.420 -2.231 270 3HD1 LEU 36 3HD2 LEU 36 5.969 2.463 -0.595 271 1HD2 LEU 36 1HD1 LEU 36 8.735 1.257 -1.143 272 2HD2 LEU 36 2HD1 LEU 36 9.375 1.964 0.374 273 3HD2 LEU 36 3HD1 LEU 36 7.736 1.339 0.353 274 NH1 ARG 37 NH2 ARG 37 11.640 14.019 -2.025 275 NH2 ARG 37 NH1 ARG 37 13.087 14.409 -3.734 276 H ARG 37 H ARG 37 10.598 6.647 -1.044 277 HA ARG 37 HA ARG 37 12.112 6.943 -3.420 278 1HB ARG 37 1HB ARG 37 10.740 8.762 -2.398 279 2HB ARG 37 2HB ARG 37 11.842 8.848 -1.018 280 1HG ARG 37 1HG ARG 37 13.677 9.663 -2.632 281 2HG ARG 37 2HG ARG 37 12.468 9.660 -3.916 282 1HD ARG 37 1HD ARG 37 11.024 11.202 -2.371 283 2HD ARG 37 2HD ARG 37 12.402 11.246 -1.257 284 1HH1 ARG 37 2HH2 ARG 37 11.177 13.328 -1.424 285 2HH1 ARG 37 1HH2 ARG 37 11.526 15.038 -1.990 286 1HH2 ARG 37 1HH1 ARG 37 13.726 14.019 -4.437 287 2HH2 ARG 37 2HH1 ARG 37 12.874 15.401 -3.581 288 H LYS 38 H LYS 38 13.187 6.157 -0.101 289 HA LYS 38 HA LYS 38 16.033 7.087 -0.699 290 1HB LYS 38 1HB LYS 38 14.809 7.881 1.384 291 2HB LYS 38 2HB LYS 38 14.834 6.223 1.985 292 1HG LYS 38 1HG LYS 38 17.333 6.317 2.147 293 2HG LYS 38 2HG LYS 38 17.353 7.859 1.301 294 1HD LYS 38 1HD LYS 38 17.674 8.303 3.642 295 2HD LYS 38 2HD LYS 38 16.100 8.945 3.190 296 1HE LYS 38 1HE LYS 38 14.983 6.882 4.228 297 2HE LYS 38 2HE LYS 38 16.579 6.261 4.674 298 1HZ LYS 38 1HZ LYS 38 15.571 7.406 6.498 299 2HZ LYS 38 2HZ LYS 38 16.910 8.223 6.038 300 H GLY 39 H GLY 39 14.468 4.324 -1.427 301 1HA GLY 39 1HA GLY 39 15.189 2.041 -1.753 302 2HA GLY 39 2HA GLY 39 16.817 2.512 -1.306 303 H ASP 40 H ASP 40 13.820 2.714 0.526 304 HA ASP 40 HA ASP 40 14.748 0.725 2.653 305 1HB ASP 40 1HB ASP 40 13.743 3.541 3.043 306 2HB ASP 40 2HB ASP 40 13.652 2.355 4.328 307 HD1 ASP 40 HD2 ASP 40 17.029 2.384 5.036 308 H LYS 41 H LYS 41 13.456 -0.479 3.684 309 HA LYS 41 HA LYS 41 10.739 -1.002 2.455 310 1HB LYS 41 2HB LYS 41 12.080 -2.663 4.656 311 2HB LYS 41 1HB LYS 41 10.641 -3.078 3.721 312 1HG LYS 41 1HG LYS 41 12.227 -2.970 1.609 313 2HG LYS 41 2HG LYS 41 13.556 -2.978 2.757 314 1HD LYS 41 1HD LYS 41 12.714 -5.153 3.737 315 2HD LYS 41 2HD LYS 41 11.341 -5.130 2.623 316 1HE LYS 41 1HE LYS 41 12.935 -5.228 0.644 317 2HE LYS 41 2HE LYS 41 14.311 -5.272 1.758 318 1HZ LYS 41 1HZ LYS 41 13.653 -7.465 1.017 319 2HZ LYS 41 2HZ LYS 41 12.136 -7.287 1.601 320 H VAL 42 H VAL 42 8.829 -0.534 3.535 321 HA VAL 42 HA VAL 42 8.671 0.875 6.006 322 HB VAL 42 HB VAL 42 6.688 -0.346 4.005 323 1HG1 VAL 42 3HG2 VAL 42 5.758 0.873 6.128 324 2HG1 VAL 42 1HG2 VAL 42 6.394 2.356 5.394 325 3HG1 VAL 42 2HG2 VAL 42 5.198 1.378 4.509 326 1HG2 VAL 42 2HG1 VAL 42 8.486 1.231 2.831 327 2HG2 VAL 42 3HG1 VAL 42 6.818 1.683 2.645 328 3HG2 VAL 42 1HG1 VAL 42 7.814 2.529 3.844 329 H GLN 43 H GLN 43 6.214 -0.628 6.368 330 HA GLN 43 HA GLN 43 5.705 -2.820 6.599 331 1HB GLN 43 1HB GLN 43 7.918 -3.535 8.375 332 2HB GLN 43 2HB GLN 43 6.411 -4.458 8.474 333 1HG GLN 43 1HG GLN 43 6.451 -4.864 6.046 334 2HG GLN 43 2HG GLN 43 7.894 -3.929 5.833 335 1HE2 GLN 43 2HE2 GLN 43 9.623 -7.074 6.034 336 2HE2 GLN 43 1HE2 GLN 43 9.108 -5.630 5.028 337 H LEU 44 H LEU 44 4.083 -3.884 7.499 338 HA LEU 44 HA LEU 44 2.637 -2.515 9.779 339 1HB LEU 44 2HB LEU 44 1.265 -2.891 7.050 340 2HB LEU 44 1HB LEU 44 0.469 -2.353 8.513 341 HG LEU 44 HG LEU 44 2.717 -0.748 7.141 342 1HD1 LEU 44 1HD1 LEU 44 0.897 -1.065 5.501 343 2HD1 LEU 44 2HD1 LEU 44 -0.314 -0.498 6.675 344 3HD1 LEU 44 3HD1 LEU 44 0.934 0.617 6.061 345 1HD2 LEU 44 2HD2 LEU 44 2.286 -0.065 9.522 346 2HD2 LEU 44 3HD2 LEU 44 1.759 1.197 8.392 347 3HD2 LEU 44 1HD2 LEU 44 0.552 0.142 9.167 348 H ILE 45 H ILE 45 2.514 -4.383 11.008 349 HA ILE 45 HA ILE 45 2.368 -7.047 9.760 350 HB ILE 45 HB ILE 45 3.693 -6.592 11.798 351 1HG1 ILE 45 1HG1 ILE 45 1.741 -8.942 12.144 352 2HG1 ILE 45 2HG1 ILE 45 3.017 -8.906 10.940 353 1HG2 ILE 45 1HG2 ILE 45 2.050 -5.259 13.105 354 2HG2 ILE 45 2HG2 ILE 45 1.001 -6.689 13.291 355 3HG2 ILE 45 3HG2 ILE 45 2.624 -6.653 14.043 356 1HD1 ILE 45 2HD1 ILE 45 4.774 -8.692 12.747 357 2HD1 ILE 45 3HD1 ILE 45 3.494 -8.814 13.984 358 3HD1 ILE 45 1HD1 ILE 45 3.799 -10.175 12.884 359 H GLY 46 H GLY 46 0.737 -8.540 9.967 360 1HA GLY 46 1HA GLY 46 -1.518 -9.283 9.645 361 2HA GLY 46 2HA GLY 46 -2.036 -7.982 10.681 362 H PHE 47 H PHE 47 -0.609 -6.372 8.121 363 HA PHE 47 HA PHE 47 -2.998 -6.448 6.280 364 1HB PHE 47 2HB PHE 47 -3.051 -4.738 8.164 365 2HB PHE 47 1HB PHE 47 -1.612 -3.968 7.553 366 HD1 PHE 47 HD1 PHE 47 -5.228 -4.639 6.724 367 HD2 PHE 47 HD2 PHE 47 -1.627 -2.630 5.469 368 HE1 PHE 47 HE1 PHE 47 -6.410 -3.626 4.792 369 HE2 PHE 47 HE2 PHE 47 -2.826 -1.721 3.530 370 HZ PHE 47 HZ PHE 47 -5.207 -2.334 3.165 371 H GLY 48 H GLY 48 0.503 -5.352 6.441 372 1HA GLY 48 1HA GLY 48 0.649 -5.436 3.498 373 2HA GLY 48 2HA GLY 48 0.487 -3.801 4.073 374 H ASN 49 H ASN 49 2.700 -5.468 2.759 375 HA ASN 49 HA ASN 49 4.961 -4.226 4.445 376 1HB ASN 49 1HB ASN 49 5.196 -6.883 2.919 377 2HB ASN 49 2HB ASN 49 6.476 -6.051 3.764 378 1HD2 ASN 49 1HD2 ASN 49 5.368 -8.820 5.969 379 2HD2 ASN 49 2HD2 ASN 49 6.038 -8.624 4.272 380 H PHE 50 H PHE 50 5.301 -2.405 3.271 381 HA PHE 50 HA PHE 50 5.296 -2.480 0.238 382 1HB PHE 50 2HB PHE 50 5.955 -0.090 1.992 383 2HB PHE 50 1HB PHE 50 5.959 -0.039 0.269 384 HD1 PHE 50 HD1 PHE 50 3.896 -0.413 3.318 385 HD2 PHE 50 HD2 PHE 50 4.095 0.898 -0.757 386 HE1 PHE 50 HE1 PHE 50 1.688 0.721 3.566 387 HE2 PHE 50 HE2 PHE 50 1.916 2.041 -0.476 388 HZ PHE 50 HZ PHE 50 0.673 1.775 1.611 389 H GLU 51 H GLU 51 7.052 -2.078 -0.949 390 HA GLU 51 HA GLU 51 9.563 -1.155 0.038 391 1HB GLU 51 1HB GLU 51 11.062 -3.159 -0.298 392 2HB GLU 51 2HB GLU 51 9.926 -3.479 0.981 393 1HG GLU 51 1HG GLU 51 9.623 -4.551 -1.908 394 2HG GLU 51 2HG GLU 51 10.434 -5.416 -0.618 395 HE1 GLU 51 HE2 GLU 51 7.531 -6.218 1.173 396 H VAL 52 H VAL 52 11.272 -0.853 -1.566 397 HA VAL 52 HA VAL 52 9.995 -0.485 -4.203 398 HB VAL 52 HB VAL 52 11.275 1.149 -2.235 399 1HG1 VAL 52 1HG2 VAL 52 13.374 0.577 -4.346 400 2HG1 VAL 52 2HG2 VAL 52 13.337 1.968 -3.206 401 3HG1 VAL 52 3HG2 VAL 52 13.456 0.285 -2.600 402 1HG2 VAL 52 3HG1 VAL 52 10.772 1.759 -5.154 403 2HG2 VAL 52 1HG1 VAL 52 9.656 1.923 -3.771 404 3HG2 VAL 52 2HG1 VAL 52 11.099 2.921 -3.866 405 NH1 ARG 53 NH2 ARG 53 9.898 -6.313 -11.656 406 NH2 ARG 53 NH1 ARG 53 11.894 -7.299 -12.115 407 H ARG 53 H ARG 53 11.258 -0.706 -6.133 408 HA ARG 53 HA ARG 53 13.100 -3.181 -6.103 409 1HB ARG 53 1HB ARG 53 10.801 -3.603 -7.021 410 2HB ARG 53 2HB ARG 53 11.038 -2.358 -8.223 411 1HG ARG 53 1HG ARG 53 13.024 -3.666 -9.160 412 2HG ARG 53 2HG ARG 53 12.722 -4.929 -7.961 413 1HD ARG 53 1HD ARG 53 10.396 -5.280 -8.925 414 2HD ARG 53 2HD ARG 53 10.697 -3.997 -10.112 415 1HH1 ARG 53 2HH2 ARG 53 9.375 -5.647 -11.077 416 2HH1 ARG 53 1HH2 ARG 53 9.526 -6.885 -12.423 417 1HH2 ARG 53 1HH1 ARG 53 12.891 -7.388 -11.888 418 2HH2 ARG 53 2HH1 ARG 53 11.384 -7.803 -12.848 419 H GLU 54 H GLU 54 14.967 -2.051 -5.977 420 HA GLU 54 HA GLU 54 15.561 0.401 -7.481 421 1HB GLU 54 1HB GLU 54 16.509 -0.188 -5.238 422 2HB GLU 54 2HB GLU 54 17.508 -1.437 -5.976 423 1HG GLU 54 1HG GLU 54 18.686 0.349 -7.359 424 2HG GLU 54 2HG GLU 54 17.634 1.579 -6.673 425 HE2 GLU 54 HE2 GLU 54 20.780 0.119 -4.637 426 NH1 ARG 55 NH2 ARG 55 19.933 3.227 -14.209 427 NH2 ARG 55 NH1 ARG 55 18.156 4.645 -14.173 428 H ARG 55 H ARG 55 16.161 0.603 -9.477 429 HA ARG 55 HA ARG 55 16.931 -1.682 -11.253 430 1HB ARG 55 1HB ARG 55 15.382 0.055 -12.015 431 2HB ARG 55 2HB ARG 55 16.553 1.331 -11.789 432 1HG ARG 55 1HG ARG 55 17.127 -0.980 -13.735 433 2HG ARG 55 2HG ARG 55 16.012 0.285 -14.193 434 1HD ARG 55 1HD ARG 55 18.956 0.783 -13.407 435 2HD ARG 55 2HD ARG 55 18.351 0.647 -15.054 436 1HH1 ARG 55 2HH2 ARG 55 20.265 2.256 -14.189 437 2HH1 ARG 55 1HH2 ARG 55 20.511 4.073 -14.272 438 1HH2 ARG 55 1HH1 ARG 55 17.138 4.758 -14.126 439 2HH2 ARG 55 2HH1 ARG 55 18.856 5.393 -14.236 440 H ALA 56 H ALA 56 18.932 -2.174 -11.881 441 HA ALA 56 HA ALA 56 21.242 -1.308 -10.360 442 1HB ALA 56 2HB ALA 56 21.039 -3.591 -11.277 443 2HB ALA 56 3HB ALA 56 21.173 -2.983 -12.947 444 3HB ALA 56 1HB ALA 56 22.549 -2.841 -11.827 445 H ALA 57 H ALA 57 21.975 0.701 -10.561 446 HA ALA 57 HA ALA 57 22.268 2.476 -12.622 447 1HB ALA 57 3HB ALA 57 22.987 2.937 -10.240 448 2HB ALA 57 1HB ALA 57 24.436 1.924 -10.457 449 3HB ALA 57 2HB ALA 57 24.270 3.446 -11.348 450 NH1 ARG 58 NH2 ARG 58 21.315 -2.597 -16.050 451 NH2 ARG 58 NH1 ARG 58 19.181 -1.884 -16.371 452 H ARG 58 H ARG 58 23.308 3.058 -14.285 453 HA ARG 58 HA ARG 58 24.886 0.892 -15.557 454 1HB ARG 58 2HB ARG 58 23.685 3.282 -17.021 455 2HB ARG 58 1HB ARG 58 24.313 1.821 -17.759 456 1HG ARG 58 1HG ARG 58 21.780 2.080 -16.051 457 2HG ARG 58 2HG ARG 58 21.856 1.965 -17.799 458 1HD ARG 58 1HD ARG 58 22.781 -0.380 -17.655 459 2HD ARG 58 2HD ARG 58 22.820 -0.268 -15.888 460 1HH1 ARG 58 2HH2 ARG 58 22.315 -2.369 -16.066 461 2HH1 ARG 58 1HH2 ARG 58 20.894 -3.500 -15.805 462 1HH2 ARG 58 1HH1 ARG 58 18.552 -1.117 -16.630 463 2HH2 ARG 58 2HH1 ARG 58 18.911 -2.837 -16.103 464 H LYS 59 H LYS 59 26.222 2.376 -17.547 465 HA LYS 59 HA LYS 59 27.967 4.437 -16.227 466 1HB LYS 59 1HB LYS 59 29.073 2.246 -15.615 467 2HB LYS 59 2HB LYS 59 29.275 1.870 -17.322 468 1HG LYS 59 1HG LYS 59 30.742 3.931 -17.587 469 2HG LYS 59 2HG LYS 59 30.454 4.354 -15.909 470 1HD LYS 59 1HD LYS 59 32.643 3.359 -16.032 471 2HD LYS 59 2HD LYS 59 31.603 2.281 -15.131 472 1HE LYS 59 1HE LYS 59 33.016 0.925 -16.552 473 2HE LYS 59 2HE LYS 59 31.379 0.774 -17.177 474 1HZ LYS 59 1HZ LYS 59 32.956 1.090 -18.938 475 2HZ LYS 59 2HZ LYS 59 31.941 2.371 -18.904 476 H GLY 60 H GLY 60 28.236 6.006 -17.633 477 1HA GLY 60 1HA GLY 60 27.957 5.471 -20.681 478 2HA GLY 60 2HA GLY 60 27.284 6.892 -19.914 479 NH1 ARG 61 NH2 ARG 61 36.592 4.529 -15.601 480 NH2 ARG 61 NH1 ARG 61 38.249 5.737 -16.585 481 H ARG 61 H ARG 61 30.269 5.103 -20.178 482 HA ARG 61 HA ARG 61 31.921 7.650 -19.939 483 1HB ARG 61 1HB ARG 61 32.140 6.003 -18.147 484 2HB ARG 61 2HB ARG 61 32.517 4.705 -19.277 485 1HG ARG 61 1HG ARG 61 34.686 5.850 -19.878 486 2HG ARG 61 2HG ARG 61 34.269 7.185 -18.804 487 1HD ARG 61 1HD ARG 61 34.223 5.597 -16.825 488 2HD ARG 61 2HD ARG 61 34.686 4.262 -17.898 489 1HH1 ARG 61 2HH2 ARG 61 35.614 4.220 -15.628 490 2HH1 ARG 61 1HH2 ARG 61 37.293 4.290 -14.890 491 1HH2 ARG 61 1HH1 ARG 61 38.536 6.345 -17.359 492 2HH2 ARG 61 2HH1 ARG 61 38.834 5.416 -15.806 493 H ASN 62 H ASN 62 32.575 8.422 -21.746 494 HA ASN 62 HA ASN 62 33.215 6.612 -24.134 495 1HB ASN 62 1HB ASN 62 31.123 8.093 -24.244 496 2HB ASN 62 2HB ASN 62 32.173 9.493 -24.216 497 1HD2 ASN 62 2HD2 ASN 62 31.613 7.655 -27.761 498 2HD2 ASN 62 1HD2 ASN 62 30.778 7.114 -26.219 499 HA PRO 63 HA PRO 63 37.361 8.633 -23.614 500 1HB PRO 63 1HB PRO 63 38.755 7.392 -25.658 501 2HB PRO 63 2HB PRO 63 38.278 6.593 -24.152 502 1HG PRO 63 1HG PRO 63 36.849 6.476 -26.853 503 2HG PRO 63 2HG PRO 63 37.276 5.120 -25.784 504 1HD PRO 63 1HD PRO 63 34.747 6.267 -25.811 505 2HD PRO 63 2HD PRO 63 35.437 5.576 -24.310 506 H GLN 64 H GLN 64 35.710 8.797 -26.797 507 HA GLN 64 HA GLN 64 37.425 10.875 -27.984 508 1HB GLN 64 1HB GLN 64 35.748 9.238 -29.215 509 2HB GLN 64 2HB GLN 64 34.465 10.267 -28.664 510 1HG GLN 64 1HG GLN 64 34.856 10.930 -30.863 511 2HG GLN 64 2HG GLN 64 35.511 12.238 -29.889 512 1HE2 GLN 64 2HE2 GLN 64 38.807 11.876 -31.291 513 2HE2 GLN 64 1HE2 GLN 64 37.657 12.799 -30.199 514 H THR 65 H THR 65 34.104 11.088 -26.896 515 HA THR 65 HA THR 65 33.904 13.947 -26.862 516 HB THR 65 HB THR 65 31.650 13.638 -26.004 517 HG1 THR 65 HG1 THR 65 30.952 11.592 -25.398 518 1HG2 THR 65 2HG2 THR 65 32.116 12.917 -28.451 519 2HG2 THR 65 3HG2 THR 65 32.283 11.252 -27.886 520 3HG2 THR 65 1HG2 THR 65 30.721 12.066 -27.716 521 H GLY 66 H GLY 66 34.470 11.822 -24.059 522 1HA GLY 66 1HA GLY 66 35.698 12.569 -22.081 523 2HA GLY 66 2HA GLY 66 35.351 14.241 -22.433 524 H GLU 67 H GLU 67 32.577 12.011 -22.423 525 HA GLU 67 HA GLU 67 31.660 13.217 -19.766 526 1HB GLU 67 2HB GLU 67 30.115 13.252 -21.891 527 2HB GLU 67 1HB GLU 67 29.952 11.503 -21.623 528 1HG GLU 67 1HG GLU 67 29.137 12.015 -19.243 529 2HG GLU 67 2HG GLU 67 29.210 13.732 -19.615 530 HE1 GLU 67 HE2 GLU 67 26.370 13.773 -21.613 531 H GLU 68 H GLU 68 32.186 11.975 -18.209 532 HA GLU 68 HA GLU 68 32.544 8.936 -18.445 533 1HB GLU 68 1HB GLU 68 34.703 10.729 -17.198 534 2HB GLU 68 2HB GLU 68 34.684 8.973 -17.231 535 1HG GLU 68 1HG GLU 68 34.700 9.119 -19.844 536 2HG GLU 68 2HG GLU 68 34.938 10.845 -19.673 537 HE2 GLU 68 HE2 GLU 68 37.960 8.281 -19.202 538 H MET 69 H MET 69 30.788 8.432 -17.197 539 HA MET 69 HA MET 69 31.072 8.794 -14.269 540 1HB MET 69 1HB MET 69 29.163 10.100 -13.728 541 2HB MET 69 2HB MET 69 30.005 11.022 -14.940 542 1HG MET 69 1HG MET 69 27.417 9.384 -15.356 543 2HG MET 69 2HG MET 69 27.544 11.137 -15.265 544 1HE MET 69 3HE MET 69 26.231 9.265 -17.636 545 2HE MET 69 2HE MET 69 27.263 9.045 -19.075 546 3HE MET 69 1HE MET 69 27.565 8.081 -17.606 547 H GLU 70 H GLU 70 29.491 7.740 -13.030 548 HA GLU 70 HA GLU 70 28.214 5.319 -14.292 549 1HB GLU 70 2HB GLU 70 27.908 4.374 -12.186 550 2HB GLU 70 1HB GLU 70 29.538 5.035 -12.215 551 1HG GLU 70 1HG GLU 70 28.852 5.537 -10.054 552 2HG GLU 70 2HG GLU 70 28.590 7.071 -10.857 553 HE2 GLU 70 HE2 GLU 70 25.353 7.185 -9.748 554 H ILE 71 H ILE 71 26.009 5.267 -14.787 555 HA ILE 71 HA ILE 71 24.435 7.762 -14.465 556 HB ILE 71 HB ILE 71 23.882 5.093 -15.894 557 1HG1 ILE 71 1HG1 ILE 71 24.607 7.831 -17.139 558 2HG1 ILE 71 2HG1 ILE 71 25.816 6.600 -16.841 559 1HG2 ILE 71 2HG2 ILE 71 21.784 6.259 -15.275 560 2HG2 ILE 71 3HG2 ILE 71 22.379 7.761 -16.056 561 3HG2 ILE 71 1HG2 ILE 71 22.043 6.295 -17.033 562 1HD1 ILE 71 3HD1 ILE 71 23.451 6.228 -18.769 563 2HD1 ILE 71 1HD1 ILE 71 25.139 6.554 -19.190 564 3HD1 ILE 71 2HD1 ILE 71 24.713 5.012 -18.409 565 HA PRO 72 HA PRO 72 23.150 5.760 -10.499 566 1HB PRO 72 1HB PRO 72 21.386 7.693 -9.496 567 2HB PRO 72 2HB PRO 72 23.150 7.825 -9.503 568 1HG PRO 72 1HG PRO 72 21.189 8.986 -11.545 569 2HG PRO 72 2HG PRO 72 22.522 9.824 -10.714 570 1HD PRO 72 1HD PRO 72 22.819 8.828 -13.260 571 2HD PRO 72 2HD PRO 72 24.187 8.765 -12.105 572 H ALA 73 H ALA 73 21.413 4.854 -9.403 573 HA ALA 73 HA ALA 73 19.660 3.175 -10.917 574 1HB ALA 73 1HB ALA 73 20.391 2.837 -8.447 575 2HB ALA 73 2HB ALA 73 19.251 4.145 -7.972 576 3HB ALA 73 3HB ALA 73 18.643 2.643 -8.653 577 H SER 74 H SER 74 17.386 2.845 -10.390 578 HA SER 74 HA SER 74 15.939 5.061 -9.340 579 1HB SER 74 1HB SER 74 15.737 5.779 -11.780 580 2HB SER 74 2HB SER 74 14.936 4.242 -12.179 581 HG SER 74 HG SER 74 13.296 4.846 -10.688 582 H LYS 75 H LYS 75 14.224 4.609 -8.295 583 HA LYS 75 HA LYS 75 13.727 1.643 -7.714 584 1HB LYS 75 2HB LYS 75 12.922 3.880 -5.878 585 2HB LYS 75 1HB LYS 75 12.937 2.179 -5.605 586 1HG LYS 75 1HG LYS 75 15.050 2.236 -4.792 587 2HG LYS 75 2HG LYS 75 15.655 2.731 -6.344 588 1HD LYS 75 1HD LYS 75 15.193 5.172 -5.721 589 2HD LYS 75 2HD LYS 75 14.656 4.627 -4.126 590 1HE LYS 75 1HE LYS 75 16.948 3.588 -3.715 591 2HE LYS 75 2HE LYS 75 17.483 4.139 -5.309 592 1HZ LYS 75 1HZ LYS 75 17.105 6.414 -4.605 593 2HZ LYS 75 2HZ LYS 75 18.167 5.660 -3.616 594 H VAL 76 H VAL 76 11.628 0.622 -8.002 595 HA VAL 76 HA VAL 76 9.405 2.173 -8.952 596 HB VAL 76 HB VAL 76 10.965 -0.426 -9.209 597 1HG1 VAL 76 3HG2 VAL 76 8.115 -0.380 -9.846 598 2HG1 VAL 76 1HG2 VAL 76 9.398 -1.592 -10.386 599 3HG1 VAL 76 2HG2 VAL 76 9.033 -1.387 -8.657 600 1HG2 VAL 76 2HG1 VAL 76 11.382 1.447 -10.795 601 2HG2 VAL 76 3HG1 VAL 76 10.797 -0.024 -11.589 602 3HG2 VAL 76 1HG1 VAL 76 9.673 1.354 -11.324 603 HA PRO 77 HA PRO 77 7.847 0.873 -4.762 604 1HB PRO 77 1HB PRO 77 5.531 2.407 -4.684 605 2HB PRO 77 2HB PRO 77 7.132 3.161 -4.736 606 1HG PRO 77 1HG PRO 77 5.212 2.685 -7.065 607 2HG PRO 77 2HG PRO 77 6.073 4.174 -6.654 608 1HD PRO 77 1HD PRO 77 6.999 2.175 -8.570 609 2HD PRO 77 2HD PRO 77 8.105 3.305 -7.750 610 H ALA 78 H ALA 78 6.771 -0.455 -3.860 611 HA ALA 78 HA ALA 78 4.391 -1.894 -5.119 612 1HB ALA 78 2HB ALA 78 6.669 -2.930 -5.685 613 2HB ALA 78 3HB ALA 78 6.939 -3.213 -3.952 614 3HB ALA 78 1HB ALA 78 5.591 -4.025 -4.780 615 H PHE 79 H PHE 79 3.429 -3.323 -3.720 616 HA PHE 79 HA PHE 79 3.366 -2.764 -0.688 617 1HB PHE 79 2HB PHE 79 1.992 -1.140 -1.131 618 2HB PHE 79 1HB PHE 79 1.147 -2.014 -2.446 619 HD1 PHE 79 HD1 PHE 79 -0.642 -3.681 -1.959 620 HD2 PHE 79 HD2 PHE 79 1.323 -1.590 1.239 621 HE1 PHE 79 HE1 PHE 79 -2.336 -4.498 -0.377 622 HE2 PHE 79 HE2 PHE 79 -0.440 -2.321 2.787 623 HZ PHE 79 HZ PHE 79 -2.220 -3.856 2.004 624 H LYS 80 H LYS 80 3.250 -4.618 0.017 625 HA LYS 80 HA LYS 80 2.219 -7.297 -1.253 626 1HB LYS 80 2HB LYS 80 3.865 -6.843 1.260 627 2HB LYS 80 1HB LYS 80 3.125 -8.372 0.826 628 1HG LYS 80 1HG LYS 80 4.484 -8.535 -1.250 629 2HG LYS 80 2HG LYS 80 5.166 -6.941 -0.978 630 1HD LYS 80 1HD LYS 80 6.815 -8.605 -0.339 631 2HD LYS 80 2HD LYS 80 6.334 -7.679 1.060 632 1HE LYS 80 1HE LYS 80 6.586 -9.994 1.741 633 2HE LYS 80 2HE LYS 80 4.878 -9.596 1.866 634 1HZ LYS 80 1HZ LYS 80 5.260 -11.742 0.839 635 2HZ LYS 80 2HZ LYS 80 6.168 -11.092 -0.356 636 HA PRO 81 HA PRO 81 -1.302 -6.479 1.594 637 1HB PRO 81 1HB PRO 81 -2.777 -8.758 1.132 638 2HB PRO 81 2HB PRO 81 -2.496 -7.559 -0.136 639 1HG PRO 81 1HG PRO 81 -0.964 -10.173 0.327 640 2HG PRO 81 2HG PRO 81 -1.748 -9.629 -1.180 641 1HD PRO 81 1HD PRO 81 0.963 -9.216 -0.631 642 2HD PRO 81 2HD PRO 81 0.015 -8.078 -1.642 643 H GLY 82 H GLY 82 1.146 -7.160 2.859 644 1HA GLY 82 1HA GLY 82 2.360 -8.553 4.396 645 2HA GLY 82 2HA GLY 82 0.915 -8.179 5.309 646 H LYS 83 H LYS 83 0.443 -10.318 2.687 647 HA LYS 83 HA LYS 83 -0.196 -12.612 2.523 648 1HB LYS 83 2HB LYS 83 1.697 -12.859 4.849 649 2HB LYS 83 1HB LYS 83 0.414 -14.004 4.949 650 1HG LYS 83 1HG LYS 83 0.957 -14.800 2.586 651 2HG LYS 83 2HG LYS 83 2.259 -13.628 2.476 652 1HD LYS 83 1HD LYS 83 2.157 -15.907 4.580 653 2HD LYS 83 2HD LYS 83 2.884 -16.050 2.999 654 1HE LYS 83 1HE LYS 83 4.736 -15.650 4.379 655 2HE LYS 83 2HE LYS 83 4.486 -14.107 3.572 656 1HZ LYS 83 1HZ LYS 83 4.905 -13.811 5.898 657 2HZ LYS 83 2HZ LYS 83 3.382 -13.309 5.579 658 H ALA 84 H ALA 84 -0.638 -11.335 5.575 659 HA ALA 84 HA ALA 84 -2.937 -12.661 6.716 660 1HB ALA 84 2HB ALA 84 -1.212 -11.246 7.864 661 2HB ALA 84 3HB ALA 84 -1.720 -9.820 6.922 662 3HB ALA 84 1HB ALA 84 -2.840 -10.532 8.115 663 H LEU 85 H LEU 85 -2.812 -9.523 4.802 664 HA LEU 85 HA LEU 85 -5.710 -9.154 4.794 665 1HB LEU 85 2HB LEU 85 -4.207 -7.198 4.430 666 2HB LEU 85 1HB LEU 85 -3.517 -7.976 3.023 667 HG LEU 85 HG LEU 85 -5.860 -8.101 2.126 668 1HD1 LEU 85 3HD1 LEU 85 -7.209 -7.506 4.097 669 2HD1 LEU 85 1HD1 LEU 85 -6.420 -5.914 4.172 670 3HD1 LEU 85 2HD1 LEU 85 -7.498 -6.319 2.808 671 1HD2 LEU 85 1HD2 LEU 85 -4.067 -6.526 1.224 672 2HD2 LEU 85 2HD2 LEU 85 -5.659 -5.780 1.107 673 3HD2 LEU 85 3HD2 LEU 85 -4.543 -5.291 2.409 674 H LYS 86 H LYS 86 -3.384 -10.809 2.655 675 HA LYS 86 HA LYS 86 -5.291 -11.580 0.583 676 1HB LYS 86 1HB LYS 86 -2.686 -11.781 0.507 677 2HB LYS 86 2HB LYS 86 -2.882 -13.337 1.295 678 1HG LYS 86 1HG LYS 86 -4.397 -14.062 -0.626 679 2HG LYS 86 2HG LYS 86 -4.137 -12.508 -1.406 680 1HD LYS 86 1HD LYS 86 -1.940 -14.586 -0.760 681 2HD LYS 86 2HD LYS 86 -2.749 -14.408 -2.312 682 1HE LYS 86 1HE LYS 86 -1.830 -12.032 -2.525 683 2HE LYS 86 2HE LYS 86 -0.962 -12.251 -0.998 684 1HZ LYS 86 1HZ LYS 86 0.456 -12.714 -2.840 685 2HZ LYS 86 2HZ LYS 86 0.243 -14.083 -1.973 686 H ASP 87 H ASP 87 -4.950 -12.875 3.841 687 HA ASP 87 HA ASP 87 -6.700 -15.236 3.349 688 1HB ASP 87 1HB ASP 87 -4.722 -14.381 5.303 689 2HB ASP 87 2HB ASP 87 -6.206 -14.223 6.142 690 HD1 ASP 87 HD2 ASP 87 -6.872 -17.677 6.235 691 H ALA 88 H ALA 88 -6.978 -11.963 4.840 692 HA ALA 88 HA ALA 88 -9.725 -11.923 5.754 693 1HB ALA 88 1HB ALA 88 -8.030 -9.952 5.988 694 2HB ALA 88 2HB ALA 88 -8.219 -9.627 4.264 695 3HB ALA 88 3HB ALA 88 -9.597 -9.419 5.311 696 H VAL 89 H VAL 89 -8.391 -11.179 2.532 697 HA VAL 89 HA VAL 89 -10.969 -10.560 1.297 698 HB VAL 89 HB VAL 89 -8.495 -9.414 1.523 699 1HG1 VAL 89 2HG2 VAL 89 -7.407 -11.572 0.601 700 2HG1 VAL 89 3HG2 VAL 89 -7.910 -11.033 -0.999 701 3HG1 VAL 89 1HG2 VAL 89 -6.850 -10.004 0.024 702 1HG2 VAL 89 1HG1 VAL 89 -10.051 -9.383 -1.016 703 2HG2 VAL 89 2HG1 VAL 89 -10.200 -8.382 0.477 704 3HG2 VAL 89 3HG1 VAL 89 -8.714 -8.267 -0.492 705 H LYS 90 H LYS 90 -9.369 -13.539 1.559 706 HA LYS 90 HA LYS 90 -9.354 -14.566 -1.110 707 1HB LYS 90 1HB LYS 90 -8.331 -15.379 1.269 708 2HB LYS 90 2HB LYS 90 -9.770 -16.353 1.374 709 1HG LYS 90 1HG LYS 90 -9.121 -17.529 -0.761 710 2HG LYS 90 2HG LYS 90 -7.780 -16.402 -0.994 711 1HD LYS 90 1HD LYS 90 -6.786 -17.145 1.235 712 2HD LYS 90 2HD LYS 90 -8.050 -18.351 1.398 713 1HE LYS 90 1HE LYS 90 -5.971 -18.222 -0.897 714 2HE LYS 90 2HE LYS 90 -5.827 -19.222 0.547 715 1HZ LYS 90 1HZ LYS 90 -8.007 -19.469 -1.450 716 2HZ LYS 90 2HZ LYS 90 -7.854 -20.387 -0.106 717 1H MET 1 1H MET 91 10.535 0.734 8.246 718 2H MET 1 2H MET 91 11.317 -0.531 9.032 719 HA MET 1 HA MET 91 10.095 0.368 10.648 720 1HB MET 1 1HB MET 91 7.829 0.755 8.590 721 2HB MET 1 2HB MET 91 7.614 0.970 10.302 722 1HG MET 1 1HG MET 91 8.073 3.152 9.870 723 2HG MET 1 2HG MET 91 9.744 2.655 10.067 724 1HE MET 1 2HE MET 91 6.798 3.121 7.380 725 2HE MET 1 1HE MET 91 7.439 4.688 7.917 726 3HE MET 1 3HE MET 91 7.678 4.151 6.227 727 H ASN 2 H ASN 92 7.120 -1.024 10.150 728 HA ASN 2 HA ASN 92 7.185 -3.671 10.338 729 1HB ASN 2 1HB ASN 92 7.289 -4.609 12.600 730 2HB ASN 2 2HB ASN 92 8.801 -4.066 11.936 731 1HD2 ASN 2 1HD2 ASN 92 9.524 -2.331 14.961 732 2HD2 ASN 2 2HD2 ASN 92 10.096 -3.280 13.494 733 H LYS 3 H LYS 93 6.041 -1.088 12.233 734 HA LYS 3 HA LYS 93 3.492 -0.628 11.558 735 1HB LYS 3 1HB LYS 93 2.830 -3.130 11.993 736 2HB LYS 3 2HB LYS 93 3.000 -2.812 13.695 737 1HG LYS 3 1HG LYS 93 1.144 -1.040 13.462 738 2HG LYS 3 2HG LYS 93 1.119 -1.322 11.721 739 1HD LYS 3 1HD LYS 93 0.478 -3.783 12.214 740 2HD LYS 3 2HD LYS 93 0.388 -3.358 13.913 741 1HE LYS 3 1HE LYS 93 -1.867 -3.315 13.125 742 2HE LYS 3 2HE LYS 93 -1.435 -1.619 13.322 743 1HZ LYS 3 1HZ LYS 93 -1.450 -3.143 10.765 744 2HZ LYS 3 2HZ LYS 93 -2.588 -2.073 11.245 745 H THR 4 H THR 94 5.594 -1.138 14.349 746 HA THR 4 HA THR 94 4.266 0.865 16.002 747 HB THR 4 HB THR 94 6.485 -1.268 16.317 748 HG1 THR 4 HG1 THR 94 3.844 -1.078 17.395 749 1HG2 THR 4 3HG2 THR 94 5.246 0.681 18.256 750 2HG2 THR 4 1HG2 THR 94 6.220 -0.799 18.728 751 3HG2 THR 4 2HG2 THR 94 6.969 0.521 17.742 752 H GLU 5 H GLU 95 7.014 0.380 14.002 753 HA GLU 5 HA GLU 95 8.543 2.844 14.889 754 1HB GLU 5 1HB GLU 95 8.753 1.370 12.208 755 2HB GLU 5 2HB GLU 95 9.842 2.622 12.767 756 1HG GLU 5 1HG GLU 95 9.536 -0.209 13.914 757 2HG GLU 5 2HG GLU 95 10.803 0.313 12.835 758 HE1 GLU 5 HE2 GLU 95 12.710 1.935 15.242 759 H LEU 6 H LEU 96 5.685 1.941 12.992 760 HA LEU 6 HA LEU 96 5.472 4.435 11.511 761 1HB LEU 6 2HB LEU 96 4.233 1.726 11.657 762 2HB LEU 6 1HB LEU 96 2.965 2.791 12.133 763 HG LEU 6 HG LEU 96 2.813 2.786 9.848 764 1HD1 LEU 6 2HD1 LEU 96 2.968 5.181 10.200 765 2HD1 LEU 6 3HD1 LEU 96 4.675 5.151 9.674 766 3HD1 LEU 6 1HD1 LEU 96 3.408 4.672 8.549 767 1HD2 LEU 6 2HD2 LEU 96 4.710 1.265 9.374 768 2HD2 LEU 6 3HD2 LEU 96 4.574 2.489 8.098 769 3HD2 LEU 6 1HD2 LEU 96 5.817 2.651 9.371 770 H ILE 7 H ILE 97 4.216 3.033 14.575 771 HA ILE 7 HA ILE 97 2.295 5.112 15.240 772 HB ILE 7 HB ILE 97 3.918 3.308 17.113 773 1HG1 ILE 7 1HG1 ILE 97 1.030 3.007 16.097 774 2HG1 ILE 7 2HG1 ILE 97 2.326 2.291 15.251 775 1HG2 ILE 7 2HG2 ILE 97 2.930 5.264 18.398 776 2HG2 ILE 7 3HG2 ILE 97 1.341 4.879 17.733 777 3HG2 ILE 7 1HG2 ILE 97 2.137 3.741 18.832 778 1HD1 ILE 7 3HD1 ILE 97 3.032 1.149 17.537 779 2HD1 ILE 7 1HD1 ILE 97 1.355 1.396 17.911 780 3HD1 ILE 7 2HD1 ILE 97 1.785 0.475 16.439 781 H ASN 8 H ASN 98 5.731 4.810 16.115 782 HA ASN 8 HA ASN 98 5.832 7.610 17.189 783 1HB ASN 8 1HB ASN 98 8.220 5.861 16.222 784 2HB ASN 8 2HB ASN 98 8.389 7.387 17.058 785 1HD2 ASN 8 2HD2 ASN 98 7.896 4.095 19.350 786 2HD2 ASN 8 1HD2 ASN 98 8.054 4.042 17.522 787 H ALA 9 H ALA 99 5.649 6.600 13.959 788 HA ALA 9 HA ALA 99 6.907 9.062 12.740 789 1HB ALA 9 2HB ALA 99 6.375 6.711 11.356 790 2HB ALA 9 3HB ALA 99 4.699 7.202 11.436 791 3HB ALA 9 1HB ALA 99 5.764 8.237 10.591 792 H VAL 10 H VAL 100 3.644 7.829 13.593 793 HA VAL 10 HA VAL 100 2.353 9.982 12.304 794 HB VAL 10 HB VAL 100 0.884 8.226 14.301 795 1HG1 VAL 10 3HG2 VAL 100 -0.112 10.149 12.749 796 2HG1 VAL 10 1HG2 VAL 100 -0.128 8.819 11.542 797 3HG1 VAL 10 2HG2 VAL 100 -0.983 8.612 13.079 798 1HG2 VAL 10 1HG1 VAL 100 2.116 7.363 11.699 799 2HG2 VAL 10 2HG1 VAL 100 2.022 6.623 13.346 800 3HG2 VAL 10 3HG1 VAL 100 0.569 6.615 12.295 801 H ALA 11 H ALA 101 2.770 8.962 15.516 802 HA ALA 11 HA ALA 101 1.554 11.279 16.626 803 1HB ALA 11 2HB ALA 101 2.010 9.114 17.997 804 2HB ALA 11 3HB ALA 101 3.760 9.320 17.794 805 3HB ALA 11 1HB ALA 101 2.855 10.427 18.847 806 H GLU 12 H GLU 102 4.900 10.810 15.406 807 HA GLU 12 HA GLU 102 5.949 13.307 16.680 808 1HB GLU 12 1HB GLU 102 7.490 11.424 16.159 809 2HB GLU 12 2HB GLU 102 7.116 11.548 14.438 810 1HG GLU 12 1HG GLU 102 8.142 13.864 14.395 811 2HG GLU 12 2HG GLU 102 8.470 13.763 16.124 812 HE1 GLU 12 HE2 GLU 102 11.207 11.658 15.830 813 H THR 13 H THR 103 4.906 12.344 13.324 814 HA THR 13 HA THR 103 4.765 15.308 12.703 815 HB THR 13 HB THR 103 5.963 13.468 11.403 816 HG1 THR 13 HG1 THR 103 4.475 15.510 10.126 817 1HG2 THR 13 2HG2 THR 103 4.212 11.989 10.710 818 2HG2 THR 13 3HG2 THR 103 3.366 13.320 9.863 819 3HG2 THR 13 1HG2 THR 103 4.966 12.755 9.303 820 H SER 14 H SER 104 2.740 13.824 14.113 821 HA SER 14 HA SER 104 0.447 15.648 13.131 822 1HB SER 14 1HB SER 104 -0.029 13.284 12.388 823 2HB SER 14 2HB SER 104 -0.010 12.744 14.065 824 HG SER 14 HG SER 104 -1.742 14.687 12.976 825 H GLY 15 H GLY 105 2.118 14.430 15.986 826 1HA GLY 15 1HA GLY 105 1.944 15.187 18.265 827 2HA GLY 15 2HA GLY 105 0.662 16.322 17.809 828 H LEU 16 H LEU 106 0.957 12.802 17.587 829 HA LEU 16 HA LEU 106 -1.518 12.455 19.222 830 1HB LEU 16 1HB LEU 106 0.122 10.287 17.761 831 2HB LEU 16 2HB LEU 106 -1.497 10.156 18.299 832 HG LEU 16 HG LEU 106 -0.669 12.166 16.103 833 1HD1 LEU 16 2HD2 LEU 106 -0.323 9.858 15.225 834 2HD1 LEU 16 3HD2 LEU 106 -2.028 9.450 15.596 835 3HD1 LEU 16 1HD2 LEU 106 -1.636 10.726 14.426 836 1HD2 LEU 16 1HD1 LEU 106 -3.296 10.964 17.045 837 2HD2 LEU 16 2HD1 LEU 106 -2.705 12.650 17.347 838 3HD2 LEU 16 3HD1 LEU 106 -3.082 12.125 15.660 839 H SER 17 H SER 107 -1.603 10.806 20.383 840 HA SER 17 HA SER 107 0.525 10.119 22.503 841 1HB SER 17 1HB SER 107 -2.209 8.798 22.350 842 2HB SER 17 2HB SER 107 -1.024 8.671 23.640 843 HG SER 17 HG SER 107 -2.314 11.061 22.824 844 H LYS 18 H LYS 108 1.231 7.949 22.700 845 HA LYS 18 HA LYS 108 1.828 6.560 20.112 846 1HB LYS 18 1HB LYS 108 2.524 5.689 22.973 847 2HB LYS 18 2HB LYS 108 2.778 4.675 21.556 848 1HG LYS 18 1HG LYS 108 4.199 6.494 20.481 849 2HG LYS 18 2HG LYS 108 3.981 7.482 21.914 850 1HD LYS 18 1HD LYS 108 6.122 6.539 22.078 851 2HD LYS 18 2HD LYS 108 5.181 5.736 23.315 852 1HE LYS 18 1HE LYS 108 5.744 4.489 20.521 853 2HE LYS 18 2HE LYS 108 6.866 4.336 21.868 854 1HZ LYS 18 1HZ LYS 108 5.180 3.211 23.144 855 2HZ LYS 18 2HZ LYS 108 5.472 2.431 21.737 856 H LYS 19 H LYS 109 -0.335 5.940 22.877 857 HA LYS 19 HA LYS 109 -1.764 3.646 21.694 858 1HB LYS 19 2HB LYS 109 -2.780 5.728 23.715 859 2HB LYS 19 1HB LYS 109 -3.678 4.280 23.272 860 1HG LYS 19 1HG LYS 109 -0.929 4.303 24.669 861 2HG LYS 19 2HG LYS 109 -2.486 4.116 25.457 862 1HD LYS 19 1HD LYS 109 -2.910 1.984 24.149 863 2HD LYS 19 2HD LYS 109 -1.323 2.145 23.388 864 1HE LYS 19 1HE LYS 109 -0.205 2.016 25.664 865 2HE LYS 19 2HE LYS 109 -1.790 1.854 26.436 866 1HZ LYS 19 1HZ LYS 109 -0.617 -0.027 24.463 867 2HZ LYS 19 2HZ LYS 109 -0.728 -0.272 26.076 868 H ASP 20 H ASP 110 -2.229 7.235 21.235 869 HA ASP 20 HA ASP 110 -4.736 6.761 19.605 870 1HB ASP 20 1HB ASP 110 -3.088 9.324 20.025 871 2HB ASP 20 2HB ASP 110 -4.440 9.235 18.905 872 HD1 ASP 20 HD2 ASP 110 -6.975 9.012 21.246 873 H ALA 21 H ALA 111 -1.342 7.281 18.824 874 HA ALA 21 HA ALA 111 -1.669 7.209 15.889 875 1HB ALA 21 1HB ALA 111 0.759 6.991 17.771 876 2HB ALA 21 2HB ALA 111 0.899 6.890 16.002 877 3HB ALA 21 3HB ALA 111 0.243 8.334 16.766 878 H THR 22 H THR 112 -1.135 4.562 18.291 879 HA THR 22 HA THR 112 -0.831 2.349 16.430 880 HB THR 22 HB THR 112 -2.220 2.310 19.189 881 HG1 THR 22 HG1 THR 112 -0.213 1.961 20.062 882 1HG2 THR 22 2HG2 THR 112 -0.479 0.276 17.627 883 2HG2 THR 22 3HG2 THR 112 -0.973 0.059 19.324 884 3HG2 THR 22 1HG2 THR 112 -2.205 0.105 18.012 885 H LYS 23 H LYS 113 -3.679 3.695 17.966 886 HA LYS 23 HA LYS 113 -5.724 2.075 16.638 887 1HB LYS 23 2HB LYS 113 -5.605 4.994 17.766 888 2HB LYS 23 1HB LYS 113 -7.097 4.371 17.184 889 1HG LYS 23 1HG LYS 113 -7.236 2.589 18.906 890 2HG LYS 23 2HG LYS 113 -5.578 2.856 19.403 891 1HD LYS 23 1HD LYS 113 -6.939 3.772 21.107 892 2HD LYS 23 2HD LYS 113 -6.141 5.116 20.310 893 1HE LYS 23 1HE LYS 113 -8.266 5.637 19.038 894 2HE LYS 23 2HE LYS 113 -9.075 4.259 19.799 895 1HZ LYS 23 1HZ LYS 113 -8.734 5.300 21.945 896 2HZ LYS 23 2HZ LYS 113 -9.567 6.291 20.947 897 H ALA 24 H ALA 114 -4.598 5.294 15.882 898 HA ALA 24 HA ALA 114 -6.162 5.843 13.565 899 1HB ALA 24 2HB ALA 114 -5.049 7.490 14.898 900 2HB ALA 24 3HB ALA 114 -3.436 6.888 14.389 901 3HB ALA 24 1HB ALA 114 -4.546 7.655 13.192 902 H VAL 25 H VAL 115 -2.974 4.265 13.632 903 HA VAL 25 HA VAL 115 -2.753 3.726 10.694 904 HB VAL 25 HB VAL 115 -1.716 2.656 13.482 905 1HG1 VAL 25 2HG2 VAL 115 -1.061 1.186 10.855 906 2HG1 VAL 25 3HG2 VAL 115 -0.248 0.926 12.439 907 3HG1 VAL 25 1HG2 VAL 115 -1.947 0.538 12.242 908 1HG2 VAL 25 3HG1 VAL 115 -0.617 4.660 12.549 909 2HG2 VAL 25 1HG1 VAL 115 0.501 3.310 12.767 910 3HG2 VAL 25 2HG1 VAL 115 -0.074 3.730 11.121 911 H ASP 26 H ASP 116 -3.909 1.590 13.385 912 HA ASP 26 HA ASP 116 -5.479 -0.100 11.427 913 1HB ASP 26 1HB ASP 116 -4.315 -0.819 13.668 914 2HB ASP 26 2HB ASP 116 -5.697 -0.094 14.486 915 HD1 ASP 26 HD2 ASP 116 -5.947 -3.596 12.402 916 H ALA 27 H ALA 117 -6.061 2.641 11.865 917 HA ALA 27 HA ALA 117 -9.099 2.645 11.868 918 1HB ALA 27 1HB ALA 117 -7.714 4.269 13.479 919 2HB ALA 27 2HB ALA 117 -7.499 5.195 12.002 920 3HB ALA 27 3HB ALA 117 -9.109 4.861 12.676 921 H VAL 28 H VAL 118 -6.344 3.920 10.058 922 HA VAL 28 HA VAL 118 -7.749 4.441 7.486 923 HB VAL 28 HB VAL 118 -4.771 3.741 8.149 924 1HG1 VAL 28 2HG2 VAL 118 -5.941 4.773 5.492 925 2HG1 VAL 28 3HG2 VAL 118 -4.208 4.758 5.928 926 3HG1 VAL 28 1HG2 VAL 118 -5.058 3.226 5.801 927 1HG2 VAL 28 1HG1 VAL 118 -5.490 5.841 9.058 928 2HG2 VAL 28 2HG1 VAL 118 -4.266 6.002 7.749 929 3HG2 VAL 28 3HG1 VAL 118 -6.025 6.363 7.396 930 H PHE 29 H PHE 119 -5.520 2.034 8.479 931 HA PHE 29 HA PHE 119 -5.957 0.051 6.346 932 1HB PHE 29 2HB PHE 119 -4.505 -0.452 8.993 933 2HB PHE 29 1HB PHE 119 -4.374 -1.459 7.562 934 HD1 PHE 29 HD1 PHE 119 -3.911 0.115 5.255 935 HD2 PHE 29 HD2 PHE 119 -2.571 0.904 9.254 936 HE1 PHE 29 HE1 PHE 119 -2.441 1.877 4.409 937 HE2 PHE 29 HE2 PHE 119 -1.156 2.720 8.415 938 HZ PHE 29 HZ PHE 119 -1.208 3.274 5.991 939 H ASP 30 H ASP 120 -7.710 0.350 9.329 940 HA ASP 30 HA ASP 120 -8.806 -2.426 9.073 941 1HB ASP 30 1HB ASP 120 -8.614 -0.997 11.257 942 2HB ASP 30 2HB ASP 120 -10.065 -0.164 10.762 943 HD2 ASP 30 HD2 ASP 120 -10.190 -3.878 12.302 944 H SER 31 H SER 121 -9.796 0.754 8.284 945 HA SER 31 HA SER 121 -12.489 0.057 7.097 946 1HB SER 31 2HB SER 121 -10.868 2.654 6.827 947 2HB SER 31 1HB SER 121 -12.488 2.394 6.144 948 HG SER 31 HG SER 121 -12.546 3.349 8.189 949 H ILE 32 H ILE 122 -9.106 0.386 5.618 950 HA ILE 32 HA ILE 122 -9.819 -0.074 2.963 951 HB ILE 32 HB ILE 122 -7.250 -0.947 4.239 952 1HG1 ILE 32 1HG1 ILE 122 -8.411 1.787 3.815 953 2HG1 ILE 32 2HG1 ILE 122 -7.554 1.001 5.129 954 1HG2 ILE 32 2HG2 ILE 122 -8.028 -0.068 1.388 955 2HG2 ILE 32 3HG2 ILE 122 -6.379 -0.400 1.919 956 3HG2 ILE 32 1HG2 ILE 122 -7.627 -1.676 1.918 957 1HD1 ILE 32 3HD1 ILE 122 -6.079 1.906 2.692 958 2HD1 ILE 32 1HD1 ILE 122 -6.410 2.876 4.165 959 3HD1 ILE 32 2HD1 ILE 122 -5.458 1.362 4.314 960 H THR 33 H THR 123 -8.666 -2.418 5.365 961 HA THR 33 HA THR 123 -9.133 -4.741 3.606 962 HB THR 33 HB THR 123 -7.728 -5.023 5.581 963 HG1 THR 33 HG1 THR 123 -10.064 -6.546 5.943 964 1HG2 THR 33 3HG2 THR 123 -8.964 -3.390 7.098 965 2HG2 THR 33 1HG2 THR 123 -10.073 -4.666 7.528 966 3HG2 THR 33 2HG2 THR 123 -8.308 -4.801 7.907 967 H GLU 34 H GLU 124 -11.398 -3.068 5.683 968 HA GLU 34 HA GLU 124 -13.667 -4.971 5.128 969 1HB GLU 34 1HB GLU 124 -13.632 -2.072 6.232 970 2HB GLU 34 2HB GLU 124 -15.116 -2.960 5.974 971 1HG GLU 34 1HG GLU 124 -12.888 -3.769 7.945 972 2HG GLU 34 2HG GLU 124 -14.391 -2.971 8.358 973 HE2 GLU 34 HE2 GLU 124 -14.209 -6.883 8.288 974 H ALA 35 H ALA 125 -12.350 -2.070 3.564 975 HA ALA 35 HA ALA 125 -14.420 -1.937 1.479 976 1HB ALA 35 2HB ALA 125 -12.493 0.030 1.860 977 2HB ALA 35 3HB ALA 125 -11.384 -1.095 1.135 978 3HB ALA 35 1HB ALA 125 -12.672 -0.468 0.175 979 H LEU 36 H LEU 126 -11.130 -3.410 1.463 980 HA LEU 36 HA LEU 126 -11.240 -4.613 -1.196 981 1HB LEU 36 2HB LEU 126 -9.548 -5.473 1.083 982 2HB LEU 36 1HB LEU 126 -9.208 -5.594 -0.626 983 HG LEU 36 HG LEU 126 -9.076 -3.037 1.008 984 1HD1 LEU 36 3HD2 LEU 126 -7.005 -4.164 0.717 985 2HD1 LEU 36 1HD2 LEU 126 -7.185 -4.069 -1.096 986 3HD1 LEU 36 2HD2 LEU 126 -7.012 -2.588 -0.104 987 1HD2 LEU 36 2HD1 LEU 126 -9.304 -3.010 -2.045 988 2HD2 LEU 36 3HD1 LEU 126 -10.468 -2.292 -0.897 989 3HD2 LEU 36 1HD1 LEU 126 -8.861 -1.612 -0.996 990 NH1 ARG 37 NH2 ARG 127 -11.623 -8.894 7.541 991 NH2 ARG 37 NH1 ARG 127 -12.310 -11.033 7.198 992 H ARG 37 H ARG 127 -11.904 -6.026 2.090 993 HA ARG 37 HA ARG 127 -12.419 -8.573 0.915 994 1HB ARG 37 1HB ARG 127 -12.976 -9.530 2.898 995 2HB ARG 37 2HB ARG 127 -11.834 -8.287 3.335 996 1HG ARG 37 1HG ARG 127 -14.105 -6.842 3.772 997 2HG ARG 37 2HG ARG 127 -14.873 -8.421 3.820 998 1HD ARG 37 1HD ARG 127 -12.568 -7.394 5.530 999 2HD ARG 37 2HD ARG 127 -14.275 -7.535 6.016 1000 1HH1 ARG 37 2HH2 ARG 127 -11.706 -7.906 7.276 1001 2HH1 ARG 37 1HH2 ARG 127 -11.002 -9.289 8.256 1002 1HH2 ARG 37 1HH1 ARG 127 -12.916 -11.678 6.678 1003 2HH2 ARG 37 2HH1 ARG 127 -11.644 -11.279 7.938 1004 H LYS 38 H LYS 128 -14.415 -5.680 1.210 1005 HA LYS 38 HA LYS 128 -16.993 -7.212 0.812 1006 1HB LYS 38 1HB LYS 128 -16.797 -5.531 2.657 1007 2HB LYS 38 2HB LYS 128 -16.620 -4.254 1.456 1008 1HG LYS 38 1HG LYS 128 -18.964 -4.658 0.668 1009 2HG LYS 38 2HG LYS 128 -19.077 -6.101 1.667 1010 1HD LYS 38 1HD LYS 128 -20.284 -4.356 2.781 1011 2HD LYS 38 2HD LYS 128 -18.857 -4.700 3.750 1012 1HE LYS 38 1HE LYS 128 -17.714 -2.627 2.779 1013 2HE LYS 38 2HE LYS 128 -19.149 -2.306 1.795 1014 1HZ LYS 38 1HZ LYS 128 -19.113 -2.431 4.761 1015 2HZ LYS 38 2HZ LYS 128 -20.433 -2.115 3.849 1016 H GLY 39 H GLY 129 -14.701 -6.070 -1.280 1017 1HA GLY 39 1HA GLY 129 -14.794 -5.668 -3.653 1018 2HA GLY 39 2HA GLY 129 -16.539 -5.802 -3.621 1019 H ASP 40 H ASP 130 -14.562 -3.566 -1.759 1020 HA ASP 40 HA ASP 130 -15.578 -1.126 -3.310 1021 1HB ASP 40 1HB ASP 130 -14.892 -1.173 -0.388 1022 2HB ASP 40 2HB ASP 130 -15.385 0.215 -1.310 1023 HD1 ASP 40 HD2 ASP 130 -18.070 -2.483 -0.017 1024 H LYS 41 H LYS 131 -14.261 0.145 -4.284 1025 HA LYS 41 HA LYS 131 -11.284 -0.261 -4.093 1026 1HB LYS 41 2HB LYS 131 -12.636 1.943 -5.699 1027 2HB LYS 41 1HB LYS 131 -10.962 1.414 -5.812 1028 1HG LYS 41 1HG LYS 131 -11.855 -0.882 -6.623 1029 2HG LYS 41 2HG LYS 131 -13.454 -0.147 -6.725 1030 1HD LYS 41 1HD LYS 131 -12.567 1.609 -8.313 1031 2HD LYS 41 2HD LYS 131 -10.944 0.922 -8.184 1032 1HE LYS 41 1HE LYS 131 -11.792 -1.267 -9.156 1033 2HE LYS 41 2HE LYS 131 -13.411 -0.562 -9.313 1034 1HZ LYS 41 1HZ LYS 131 -10.956 0.473 -10.624 1035 2HZ LYS 41 2HZ LYS 131 -12.441 1.142 -10.763 1036 H VAL 42 H VAL 132 -10.063 0.893 -2.678 1037 HA VAL 42 HA VAL 132 -11.041 3.248 -1.243 1038 HB VAL 42 HB VAL 132 -8.693 1.250 -1.150 1039 1HG1 VAL 42 1HG2 VAL 132 -9.385 3.358 0.856 1040 2HG1 VAL 42 2HG2 VAL 132 -8.185 2.011 1.055 1041 3HG1 VAL 42 3HG2 VAL 132 -7.890 3.256 -0.204 1042 1HG2 VAL 42 1HG1 VAL 132 -11.162 1.680 0.606 1043 2HG2 VAL 42 2HG1 VAL 132 -10.709 0.250 -0.433 1044 3HG2 VAL 42 3HG1 VAL 132 -9.841 0.617 1.046 1045 H GLN 43 H GLN 133 -9.996 5.005 -1.262 1046 HA GLN 43 HA GLN 133 -8.008 5.694 -3.455 1047 1HB GLN 43 1HB GLN 133 -10.639 7.113 -3.519 1048 2HB GLN 43 2HB GLN 133 -9.197 7.614 -4.391 1049 1HG GLN 43 1HG GLN 133 -9.167 5.353 -5.525 1050 2HG GLN 43 2HG GLN 133 -10.632 4.905 -4.658 1051 1HE2 GLN 43 2HE2 GLN 133 -12.050 5.857 -7.841 1052 2HE2 GLN 43 1HE2 GLN 133 -11.271 4.479 -6.917 1053 H LEU 44 H LEU 134 -6.541 7.021 -3.292 1054 HA LEU 44 HA LEU 134 -6.375 8.998 -0.992 1055 1HB LEU 44 2HB LEU 134 -3.983 7.265 -1.871 1056 2HB LEU 44 1HB LEU 134 -4.087 8.386 -0.522 1057 HG LEU 44 HG LEU 134 -6.043 6.656 0.239 1058 1HD1 LEU 44 1HD1 LEU 134 -5.809 5.140 -1.808 1059 2HD1 LEU 44 2HD1 LEU 134 -4.157 4.748 -1.293 1060 3HD1 LEU 44 3HD1 LEU 134 -5.555 4.318 -0.271 1061 1HD2 LEU 44 2HD2 LEU 134 -3.977 7.224 1.578 1062 2HD2 LEU 44 3HD2 LEU 134 -4.343 5.490 1.674 1063 3HD2 LEU 44 1HD2 LEU 134 -3.023 6.066 0.624 1064 H ILE 45 H ILE 135 -5.973 11.008 -1.913 1065 HA ILE 45 HA ILE 135 -4.905 11.199 -4.688 1066 HB ILE 45 HB ILE 135 -6.798 12.611 -3.919 1067 1HG1 ILE 45 1HG1 ILE 135 -4.461 14.232 -5.089 1068 2HG1 ILE 45 2HG1 ILE 135 -5.371 13.035 -5.994 1069 1HG2 ILE 45 2HG2 ILE 135 -5.895 13.292 -1.686 1070 2HG2 ILE 45 3HG2 ILE 135 -4.653 14.290 -2.483 1071 3HG2 ILE 45 1HG2 ILE 135 -6.386 14.701 -2.656 1072 1HD1 ILE 45 2HD1 ILE 135 -7.511 14.347 -5.647 1073 2HD1 ILE 45 3HD1 ILE 135 -6.574 15.613 -4.807 1074 3HD1 ILE 45 1HD1 ILE 135 -6.255 15.258 -6.519 1075 H GLY 46 H GLY 136 -3.057 12.224 -5.281 1076 1HA GLY 46 1HA GLY 136 -0.679 12.465 -5.284 1077 2HA GLY 46 2HA GLY 136 -0.833 13.014 -3.638 1078 H PHE 47 H PHE 137 -1.847 9.762 -3.684 1079 HA PHE 47 HA PHE 137 0.904 8.571 -3.370 1080 1HB PHE 47 2HB PHE 137 -0.222 9.619 -1.249 1081 2HB PHE 47 1HB PHE 137 -1.398 8.336 -1.298 1082 HD1 PHE 47 HD2 PHE 137 2.261 9.076 -0.834 1083 HD2 PHE 47 HD1 PHE 137 -0.733 5.982 -0.720 1084 HE1 PHE 47 HE2 PHE 137 3.917 7.457 0.019 1085 HE2 PHE 47 HE1 PHE 137 0.965 4.389 0.075 1086 HZ PHE 47 HZ PHE 137 3.324 5.115 0.311 1087 H GLY 48 H GLY 138 -2.633 7.750 -3.755 1088 1HA GLY 48 1HA GLY 138 -2.031 5.324 -5.107 1089 2HA GLY 48 2HA GLY 138 -2.210 4.861 -3.427 1090 H ASN 49 H ASN 139 -3.502 3.556 -5.047 1091 HA ASN 49 HA ASN 139 -6.378 4.123 -4.390 1092 1HB ASN 49 1HB ASN 139 -6.245 5.258 -6.556 1093 2HB ASN 49 2HB ASN 139 -5.482 3.884 -7.326 1094 1HD2 ASN 49 1HD2 ASN 139 -8.927 3.696 -8.525 1095 2HD2 ASN 49 2HD2 ASN 139 -7.374 4.650 -8.735 1096 H PHE 50 H PHE 140 -6.535 2.322 -3.175 1097 HA PHE 50 HA PHE 140 -5.362 -0.297 -4.062 1098 1HB PHE 50 2HB PHE 140 -7.246 0.059 -1.694 1099 2HB PHE 50 1HB PHE 140 -6.509 -1.402 -2.078 1100 HD1 PHE 50 HD2 PHE 140 -5.961 2.088 -0.990 1101 HD2 PHE 50 HD1 PHE 140 -4.548 -1.960 -0.862 1102 HE1 PHE 50 HE2 PHE 140 -4.332 2.699 0.796 1103 HE2 PHE 50 HE1 PHE 140 -2.956 -1.320 0.933 1104 HZ PHE 50 HZ PHE 140 -2.793 1.035 1.606 1105 H GLU 51 H GLU 141 -6.527 -1.986 -4.777 1106 HA GLU 51 HA GLU 141 -9.465 -1.991 -4.736 1107 1HB GLU 51 1HB GLU 141 -9.949 -1.995 -7.204 1108 2HB GLU 51 2HB GLU 141 -9.303 -0.468 -6.645 1109 1HG GLU 51 1HG GLU 141 -6.995 -1.156 -7.589 1110 2HG GLU 51 2HG GLU 141 -7.751 -2.606 -8.242 1111 HE1 GLU 51 HE2 GLU 141 -8.458 1.077 -9.810 1112 H VAL 52 H VAL 142 -10.523 -3.964 -5.235 1113 HA VAL 52 HA VAL 142 -8.695 -6.231 -4.872 1114 HB VAL 52 HB VAL 142 -11.200 -5.263 -3.800 1115 1HG1 VAL 52 1HG2 VAL 142 -11.885 -7.450 -5.779 1116 2HG1 VAL 52 2HG2 VAL 142 -12.883 -6.913 -4.384 1117 3HG1 VAL 52 3HG2 VAL 142 -12.463 -5.782 -5.716 1118 1HG2 VAL 52 1HG1 VAL 142 -9.695 -7.857 -3.512 1119 2HG2 VAL 52 2HG1 VAL 142 -9.867 -6.458 -2.440 1120 3HG2 VAL 52 3HG1 VAL 142 -11.239 -7.539 -2.703 1121 NH1 ARG 53 NH2 ARG 143 -7.516 -4.139 -11.181 1122 NH2 ARG 53 NH1 ARG 143 -5.637 -4.067 -9.908 1123 H ARG 53 H ARG 143 -8.984 -8.263 -6.226 1124 HA ARG 53 HA ARG 143 -9.813 -7.604 -9.109 1125 1HB ARG 53 1HB ARG 143 -7.151 -7.838 -8.131 1126 2HB ARG 53 2HB ARG 143 -7.581 -9.469 -8.278 1127 1HG ARG 53 1HG ARG 143 -6.526 -8.910 -10.355 1128 2HG ARG 53 2HG ARG 143 -8.223 -9.131 -10.736 1129 1HD ARG 53 1HD ARG 143 -7.380 -7.175 -11.953 1130 2HD ARG 53 2HD ARG 143 -8.586 -6.646 -10.785 1131 1HH1 ARG 53 2HH2 ARG 143 -8.246 -4.714 -11.615 1132 2HH1 ARG 53 1HH2 ARG 143 -7.426 -3.118 -11.236 1133 1HH2 ARG 53 1HH1 ARG 143 -4.934 -4.584 -9.368 1134 2HH2 ARG 53 2HH1 ARG 143 -5.677 -3.051 -10.051 1135 H GLU 54 H GLU 144 -11.773 -8.701 -9.091 1136 HA GLU 54 HA GLU 144 -12.167 -11.329 -7.812 1137 1HB GLU 54 1HB GLU 144 -13.991 -9.655 -8.258 1138 2HB GLU 54 2HB GLU 144 -13.958 -10.081 -9.967 1139 1HG GLU 54 1HG GLU 144 -14.553 -12.484 -9.352 1140 2HG GLU 54 2HG GLU 144 -14.517 -12.060 -7.644 1141 HE1 GLU 54 HE2 GLU 144 -15.981 -10.738 -6.855 1142 NH1 ARG 55 NH2 ARG 145 -3.247 -14.256 -10.009 1143 NH2 ARG 55 NH1 ARG 145 -3.185 -15.959 -11.514 1144 H ARG 55 H ARG 145 -10.549 -12.615 -8.480 1145 HA ARG 55 HA ARG 145 -10.122 -13.333 -11.360 1146 1HB ARG 55 1HB ARG 145 -8.283 -12.585 -9.921 1147 2HB ARG 55 2HB ARG 145 -8.565 -13.870 -8.751 1148 1HG ARG 55 1HG ARG 145 -7.869 -15.600 -10.338 1149 2HG ARG 55 2HG ARG 145 -7.792 -14.440 -11.669 1150 1HD ARG 55 1HD ARG 145 -5.942 -13.184 -10.460 1151 2HD ARG 55 2HD ARG 145 -6.032 -14.348 -9.122 1152 1HH1 ARG 55 2HH2 ARG 145 -3.822 -13.601 -9.468 1153 2HH1 ARG 55 1HH2 ARG 145 -2.224 -14.330 -9.999 1154 1HH2 ARG 55 1HH1 ARG 145 -3.708 -16.600 -12.122 1155 2HH2 ARG 55 2HH1 ARG 145 -2.166 -15.913 -11.401 1156 H ALA 56 H ALA 146 -10.137 -15.302 -12.174 1157 HA ALA 56 HA ALA 146 -11.233 -17.294 -12.743 1158 1HB ALA 56 3HB ALA 146 -8.904 -17.660 -12.082 1159 2HB ALA 56 1HB ALA 146 -9.404 -18.048 -10.416 1160 3HB ALA 56 2HB ALA 146 -9.890 -19.102 -11.773 1161 H ALA 57 H ALA 147 -13.383 -16.264 -11.572 1162 HA ALA 57 HA ALA 147 -14.634 -18.572 -10.048 1163 1HB ALA 57 2HB ALA 147 -15.977 -15.965 -11.022 1164 2HB ALA 57 3HB ALA 147 -16.712 -17.206 -9.972 1165 3HB ALA 57 1HB ALA 147 -15.338 -16.255 -9.385 1166 NH1 ARG 58 NH2 ARG 148 -11.969 -18.156 -16.511 1167 NH2 ARG 58 NH1 ARG 148 -13.283 -16.822 -15.218 1168 H ARG 58 H ARG 148 -14.821 -20.287 -11.044 1169 HA ARG 58 HA ARG 148 -15.473 -20.165 -13.943 1170 1HB ARG 58 2HB ARG 148 -14.180 -22.537 -12.522 1171 2HB ARG 58 1HB ARG 148 -14.327 -22.352 -14.258 1172 1HG ARG 58 1HG ARG 148 -12.537 -20.656 -12.408 1173 2HG ARG 58 2HG ARG 148 -12.059 -22.057 -13.323 1174 1HD ARG 58 1HD ARG 148 -11.264 -20.266 -14.628 1175 2HD ARG 58 2HD ARG 148 -12.684 -20.838 -15.510 1176 1HH1 ARG 58 2HH2 ARG 148 -11.541 -19.078 -16.645 1177 2HH1 ARG 58 1HH2 ARG 148 -11.882 -17.342 -17.130 1178 1HH2 ARG 58 1HH1 ARG 148 -13.853 -16.727 -14.370 1179 2HH2 ARG 58 2HH1 ARG 148 -13.105 -16.099 -15.924 1180 H LYS 59 H LYS 149 -16.240 -22.809 -14.405 1181 HA LYS 59 HA LYS 149 -18.543 -23.523 -12.665 1182 1HB LYS 59 1HB LYS 149 -20.342 -23.466 -14.216 1183 2HB LYS 59 2HB LYS 149 -19.724 -21.856 -13.986 1184 1HG LYS 59 1HG LYS 149 -19.240 -23.603 -16.492 1185 2HG LYS 59 2HG LYS 149 -20.498 -22.398 -16.307 1186 1HD LYS 59 1HD LYS 149 -18.718 -20.594 -15.993 1187 2HD LYS 59 2HD LYS 149 -17.476 -21.809 -16.316 1188 1HE LYS 59 1HE LYS 149 -18.485 -22.251 -18.603 1189 2HE LYS 59 2HE LYS 149 -19.721 -21.022 -18.293 1190 1HZ LYS 59 1HZ LYS 149 -17.983 -19.372 -18.087 1191 2HZ LYS 59 2HZ LYS 149 -17.905 -20.116 -19.541 1192 H GLY 60 H GLY 150 -18.518 -25.630 -12.508 1193 1HA GLY 60 1HA GLY 150 -17.536 -27.405 -14.815 1194 2HA GLY 60 2HA GLY 150 -16.627 -27.439 -13.309 1195 NH1 ARG 61 NH2 ARG 151 -23.786 -33.979 -15.334 1196 NH2 ARG 61 NH1 ARG 151 -24.540 -31.872 -14.939 1197 H ARG 61 H ARG 151 -17.078 -29.479 -12.753 1198 HA ARG 61 HA ARG 151 -19.814 -30.168 -11.746 1199 1HB ARG 61 1HB ARG 151 -19.963 -30.855 -14.114 1200 2HB ARG 61 2HB ARG 151 -18.535 -31.869 -13.987 1201 1HG ARG 61 1HG ARG 151 -19.635 -33.504 -12.642 1202 2HG ARG 61 2HG ARG 151 -20.900 -32.424 -12.111 1203 1HD ARG 61 1HD ARG 151 -20.666 -33.357 -15.051 1204 2HD ARG 61 2HD ARG 151 -21.536 -34.255 -13.804 1205 1HH1 ARG 61 2HH2 ARG 151 -23.013 -34.649 -15.257 1206 2HH1 ARG 61 1HH2 ARG 151 -24.713 -34.152 -15.737 1207 1HH2 ARG 61 1HH1 ARG 151 -24.347 -30.937 -14.564 1208 2HH2 ARG 61 2HH1 ARG 151 -25.414 -32.193 -15.371 1209 H ASN 62 H ASN 152 -19.811 -31.524 -10.106 1210 HA ASN 62 HA ASN 152 -17.321 -31.871 -8.613 1211 1HB ASN 62 1HB ASN 152 -19.592 -31.348 -7.619 1212 2HB ASN 62 2HB ASN 152 -20.085 -33.014 -7.939 1213 1HD2 ASN 62 2HD2 ASN 152 -18.515 -34.110 -4.897 1214 2HD2 ASN 62 1HD2 ASN 152 -19.598 -34.486 -6.330 1215 HA PRO 63 HA PRO 153 -16.171 -35.964 -10.413 1216 1HB PRO 63 1HB PRO 153 -14.620 -36.243 -7.785 1217 2HB PRO 63 2HB PRO 153 -14.090 -36.613 -9.439 1218 1HG PRO 63 1HG PRO 153 -13.333 -34.277 -8.282 1219 2HG PRO 63 2HG PRO 153 -13.861 -34.265 -9.982 1220 1HD PRO 63 1HD PRO 153 -15.463 -33.414 -7.512 1221 2HD PRO 63 2HD PRO 153 -15.358 -32.654 -9.130 1222 H GLN 64 H GLN 154 -17.332 -36.030 -7.010 1223 HA GLN 64 HA GLN 154 -17.794 -38.981 -7.017 1224 1HB GLN 64 1HB GLN 154 -17.194 -37.494 -4.956 1225 2HB GLN 64 2HB GLN 154 -18.827 -36.905 -4.944 1226 1HG GLN 64 1HG GLN 154 -18.138 -39.895 -4.800 1227 2HG GLN 64 2HG GLN 154 -18.141 -38.837 -3.390 1228 1HE2 GLN 64 2HE2 GLN 154 -21.698 -38.933 -2.990 1229 2HE2 GLN 64 1HE2 GLN 154 -20.099 -38.204 -2.465 1230 H THR 65 H THR 155 -20.044 -36.575 -6.164 1231 HA THR 65 HA THR 155 -22.433 -37.800 -6.840 1232 HB THR 65 HB THR 155 -23.577 -35.709 -6.376 1233 HG1 THR 65 HG1 THR 155 -22.292 -34.384 -7.681 1234 1HG2 THR 65 1HG2 THR 155 -22.409 -36.825 -4.398 1235 2HG2 THR 65 2HG2 THR 155 -21.000 -35.786 -4.660 1236 3HG2 THR 65 3HG2 THR 155 -22.542 -35.049 -4.198 1237 H GLY 66 H GLY 156 -20.787 -35.590 -9.090 1238 1HA GLY 66 1HA GLY 156 -21.109 -35.378 -11.467 1239 2HA GLY 66 2HA GLY 156 -22.394 -36.567 -11.421 1240 H GLU 67 H GLU 157 -22.261 -33.548 -9.498 1241 HA GLU 67 HA GLU 157 -24.607 -32.408 -11.085 1242 1HB GLU 67 2HB GLU 157 -24.936 -33.142 -8.638 1243 2HB GLU 67 1HB GLU 157 -23.821 -31.867 -8.151 1244 1HG GLU 67 1HG GLU 157 -26.082 -31.067 -7.821 1245 2HG GLU 67 2HG GLU 157 -25.360 -30.121 -9.105 1246 HE1 GLU 67 HE2 GLU 157 -28.523 -32.568 -9.766 1247 H GLU 68 H GLU 158 -24.385 -30.486 -11.905 1248 HA GLU 68 HA GLU 158 -21.727 -29.283 -12.153 1249 1HB GLU 68 1HB GLU 158 -22.632 -27.667 -13.733 1250 2HB GLU 68 2HB GLU 158 -23.059 -29.317 -14.123 1251 1HG GLU 68 1HG GLU 158 -25.413 -28.920 -13.206 1252 2HG GLU 68 2HG GLU 158 -24.974 -27.256 -12.836 1253 HE1 GLU 68 HE2 GLU 158 -25.781 -28.445 -16.605 1254 H MET 69 H MET 159 -20.825 -27.560 -11.224 1255 HA MET 69 HA MET 159 -22.476 -25.698 -9.482 1256 1HB MET 69 1HB MET 159 -21.315 -26.032 -7.489 1257 2HB MET 69 2HB MET 159 -21.666 -27.645 -8.046 1258 1HG MET 69 1HG MET 159 -18.928 -26.215 -8.150 1259 2HG MET 69 2HG MET 159 -19.400 -27.491 -7.029 1260 1HE MET 69 2HE MET 159 -16.784 -27.573 -8.573 1261 2HE MET 69 1HE MET 159 -16.706 -28.647 -10.001 1262 3HE MET 69 3HE MET 159 -17.289 -26.973 -10.180 1263 H GLU 70 H GLU 160 -21.651 -23.736 -9.012 1264 HA GLU 70 HA GLU 160 -19.683 -22.541 -10.850 1265 1HB GLU 70 2HB GLU 160 -21.962 -21.612 -9.591 1266 2HB GLU 70 1HB GLU 160 -20.825 -21.024 -8.445 1267 1HG GLU 70 1HG GLU 160 -20.865 -20.530 -11.528 1268 2HG GLU 70 2HG GLU 160 -21.620 -19.477 -10.347 1269 HE1 GLU 70 HE2 GLU 160 -18.246 -18.606 -9.049 1270 H ILE 71 H ILE 161 -17.510 -22.506 -10.462 1271 HA ILE 71 HA ILE 161 -16.383 -23.358 -7.872 1272 HB ILE 71 HB ILE 161 -15.125 -22.608 -10.580 1273 1HG1 ILE 71 1HG1 ILE 161 -15.495 -25.424 -9.338 1274 2HG1 ILE 71 2HG1 ILE 161 -16.633 -24.757 -10.486 1275 1HG2 ILE 71 2HG2 ILE 161 -13.504 -22.302 -8.726 1276 2HG2 ILE 71 3HG2 ILE 161 -13.820 -23.972 -8.161 1277 3HG2 ILE 71 1HG2 ILE 161 -13.058 -23.678 -9.755 1278 1HD1 ILE 71 1HD1 ILE 161 -13.698 -25.324 -11.186 1279 2HD1 ILE 71 2HD1 ILE 161 -15.118 -26.300 -11.618 1280 3HD1 ILE 71 3HD1 ILE 161 -14.943 -24.667 -12.289 1281 HA PRO 72 HA PRO 162 -16.382 -18.978 -6.633 1282 1HB PRO 72 1HB PRO 162 -14.931 -19.061 -4.252 1283 2HB PRO 72 2HB PRO 162 -16.542 -19.758 -4.468 1284 1HG PRO 72 1HG PRO 162 -13.850 -21.211 -4.645 1285 2HG PRO 72 2HG PRO 162 -15.281 -21.678 -3.692 1286 1HD PRO 72 1HD PRO 162 -14.777 -22.780 -6.169 1287 2HD PRO 72 2HD PRO 162 -16.458 -22.451 -5.648 1288 H ALA 73 H ALA 163 -15.216 -17.122 -6.248 1289 HA ALA 73 HA ALA 163 -12.803 -16.691 -7.972 1290 1HB ALA 73 2HB ALA 163 -14.803 -14.983 -7.637 1291 2HB ALA 73 3HB ALA 163 -14.204 -14.733 -5.969 1292 3HB ALA 73 1HB ALA 163 -13.203 -14.284 -7.340 1293 H SER 74 H SER 164 -11.273 -15.070 -7.142 1294 HA SER 74 HA SER 164 -11.029 -14.881 -4.241 1295 1HB SER 74 1HB SER 164 -8.401 -15.335 -5.914 1296 2HB SER 74 2HB SER 164 -8.388 -14.758 -4.255 1297 HG SER 74 HG SER 164 -8.104 -17.003 -4.401 1298 H LYS 75 H LYS 165 -11.185 -12.848 -3.736 1299 HA LYS 75 HA LYS 165 -10.832 -10.730 -5.864 1300 1HB LYS 75 2HB LYS 165 -11.502 -9.808 -3.124 1301 2HB LYS 75 1HB LYS 165 -11.887 -9.189 -4.704 1302 1HG LYS 75 1HG LYS 165 -13.607 -10.994 -5.037 1303 2HG LYS 75 2HG LYS 165 -13.224 -11.644 -3.437 1304 1HD LYS 75 1HD LYS 165 -13.870 -9.420 -2.383 1305 2HD LYS 75 2HD LYS 165 -14.299 -8.800 -3.981 1306 1HE LYS 75 1HE LYS 165 -16.068 -10.604 -4.218 1307 2HE LYS 75 2HE LYS 165 -15.634 -11.243 -2.624 1308 1HZ LYS 75 1HZ LYS 165 -16.623 -8.492 -3.143 1309 2HZ LYS 75 2HZ LYS 165 -16.221 -9.082 -1.672 1310 H VAL 76 H VAL 166 -8.824 -10.220 -6.189 1311 HA VAL 76 HA VAL 166 -6.809 -10.503 -4.140 1312 HB VAL 76 HB VAL 166 -5.269 -10.924 -5.449 1313 1HG1 VAL 76 3HG2 VAL 166 -7.212 -12.530 -5.463 1314 2HG1 VAL 76 1HG2 VAL 166 -7.620 -11.874 -7.069 1315 3HG1 VAL 76 2HG2 VAL 166 -6.075 -12.765 -6.850 1316 1HG2 VAL 76 3HG1 VAL 166 -5.509 -9.098 -7.344 1317 2HG2 VAL 76 1HG1 VAL 166 -4.447 -10.525 -7.372 1318 3HG2 VAL 76 2HG1 VAL 166 -5.955 -10.607 -8.232 1319 HA PRO 77 HA PRO 167 -6.764 -6.071 -3.611 1320 1HB PRO 77 1HB PRO 167 -5.352 -5.883 -1.210 1321 2HB PRO 77 2HB PRO 167 -6.953 -6.645 -1.299 1322 1HG PRO 77 1HG PRO 167 -4.221 -8.043 -1.410 1323 2HG PRO 77 2HG PRO 167 -5.566 -8.409 -0.324 1324 1HD PRO 77 1HD PRO 167 -5.134 -9.783 -2.764 1325 2HD PRO 77 2HD PRO 167 -6.794 -9.504 -2.184 1326 H ALA 78 H ALA 168 -5.814 -4.758 -4.539 1327 HA ALA 78 HA ALA 168 -2.808 -4.717 -5.107 1328 1HB ALA 78 3HB ALA 168 -4.499 -5.297 -6.948 1329 2HB ALA 78 1HB ALA 168 -5.243 -3.698 -6.739 1330 3HB ALA 78 2HB ALA 168 -3.558 -3.833 -7.301 1331 H PHE 79 H PHE 169 -2.162 -2.531 -5.696 1332 HA PHE 79 HA PHE 169 -3.214 -0.136 -4.073 1333 1HB PHE 79 2HB PHE 169 -2.235 -0.958 -2.309 1334 2HB PHE 79 1HB PHE 169 -0.788 -1.510 -3.213 1335 HD1 PHE 79 HD2 PHE 169 -2.473 1.544 -1.835 1336 HD2 PHE 79 HD1 PHE 169 1.057 0.020 -3.766 1337 HE1 PHE 79 HE2 PHE 169 -1.366 3.722 -1.561 1338 HE2 PHE 79 HE1 PHE 169 2.119 2.221 -3.548 1339 HZ PHE 79 HZ PHE 169 0.905 4.081 -2.496 1340 H LYS 80 H LYS 170 -2.967 1.187 -5.528 1341 HA LYS 80 HA LYS 170 -0.994 1.388 -7.975 1342 1HB LYS 80 2HB LYS 170 -3.561 2.869 -7.309 1343 2HB LYS 80 1HB LYS 170 -2.355 3.569 -8.368 1344 1HG LYS 80 1HG LYS 170 -3.824 2.577 -9.857 1345 2HG LYS 80 2HG LYS 170 -2.458 1.480 -9.837 1346 1HD LYS 80 1HD LYS 170 -3.809 -0.015 -8.202 1347 2HD LYS 80 2HD LYS 170 -5.177 1.069 -8.412 1348 1HE LYS 80 1HE LYS 170 -3.805 -0.528 -10.684 1349 2HE LYS 80 2HE LYS 170 -5.252 -1.038 -9.820 1350 1HZ LYS 80 1HZ LYS 170 -6.383 0.954 -10.624 1351 2HZ LYS 80 2HZ LYS 170 -5.050 1.436 -11.439 1352 HA PRO 81 HA PRO 171 1.256 4.407 -5.378 1353 1HB PRO 81 1HB PRO 171 3.265 5.073 -7.138 1354 2HB PRO 81 2HB PRO 171 3.139 3.442 -6.469 1355 1HG PRO 81 1HG PRO 171 2.149 4.404 -9.206 1356 2HG PRO 81 2HG PRO 171 3.196 3.004 -8.856 1357 1HD PRO 81 1HD PRO 171 0.412 2.821 -9.151 1358 2HD PRO 81 2HD PRO 171 1.343 1.690 -8.116 1359 H GLY 82 H GLY 172 -1.220 5.195 -6.585 1360 1HA GLY 82 1HA GLY 172 -2.472 6.807 -7.870 1361 2HA GLY 82 2HA GLY 172 -1.622 7.803 -6.708 1362 H LYS 83 H LYS 173 0.295 6.422 -9.160 1363 HA LYS 83 HA LYS 173 1.597 7.383 -10.966 1364 1HB LYS 83 2HB LYS 173 -0.843 9.093 -11.214 1365 2HB LYS 83 1HB LYS 173 0.566 9.998 -11.592 1366 1HG LYS 83 1HG LYS 173 -0.248 9.072 -13.663 1367 2HG LYS 83 2HG LYS 173 1.259 8.239 -13.306 1368 1HD LYS 83 1HD LYS 173 -0.075 6.272 -12.382 1369 2HD LYS 83 2HD LYS 173 -1.576 7.095 -12.771 1370 1HE LYS 83 1HE LYS 173 0.585 6.285 -14.847 1371 2HE LYS 83 2HE LYS 173 -0.821 5.307 -14.436 1372 1HZ LYS 83 1HZ LYS 173 -0.925 8.021 -15.621 1373 2HZ LYS 83 2HZ LYS 173 -1.177 6.616 -16.417 1374 H ALA 84 H ALA 174 0.568 9.588 -8.697 1375 HA ALA 84 HA ALA 174 2.577 11.672 -8.563 1376 1HB ALA 84 2HB ALA 174 0.243 11.713 -7.647 1377 2HB ALA 84 3HB ALA 174 0.632 10.389 -6.520 1378 3HB ALA 84 1HB ALA 174 1.413 11.979 -6.312 1379 H LEU 85 H LEU 175 2.268 8.646 -6.488 1380 HA LEU 85 HA LEU 175 4.822 9.065 -5.124 1381 1HB LEU 85 2HB LEU 175 3.069 7.670 -4.072 1382 2HB LEU 85 1HB LEU 175 3.082 6.576 -5.441 1383 HG LEU 85 HG LEU 175 5.543 6.282 -5.012 1384 1HD1 LEU 85 1HD1 LEU 175 5.964 8.074 -3.340 1385 2HD1 LEU 85 2HD1 LEU 175 4.854 7.284 -2.199 1386 3HD1 LEU 85 3HD1 LEU 175 6.386 6.493 -2.654 1387 1HD2 LEU 85 3HD2 LEU 175 3.774 4.494 -4.555 1388 2HD2 LEU 85 1HD2 LEU 175 5.099 4.373 -3.402 1389 3HD2 LEU 85 2HD2 LEU 175 3.556 5.120 -2.908 1390 H LYS 86 H LYS 176 3.807 7.355 -8.085 1391 HA LYS 86 HA LYS 176 6.421 6.227 -8.753 1392 1HB LYS 86 1HB LYS 176 4.210 5.531 -9.773 1393 2HB LYS 86 2HB LYS 176 4.192 7.007 -10.720 1394 1HG LYS 86 1HG LYS 176 6.278 6.287 -11.913 1395 2HG LYS 86 2HG LYS 176 6.389 4.868 -10.876 1396 1HD LYS 86 1HD LYS 176 5.466 4.166 -13.011 1397 2HD LYS 86 2HD LYS 176 4.246 3.971 -11.774 1398 1HE LYS 86 1HE LYS 176 3.159 4.812 -13.773 1399 2HE LYS 86 2HE LYS 176 3.074 6.084 -12.564 1400 1HZ LYS 86 1HZ LYS 176 5.054 5.945 -14.777 1401 2HZ LYS 86 2HZ LYS 176 4.997 7.134 -13.657 1402 H ASP 87 H ASP 177 5.370 9.575 -8.956 1403 HA ASP 87 HA ASP 177 7.747 10.444 -10.548 1404 1HB ASP 87 1HB ASP 177 5.067 11.432 -9.893 1405 2HB ASP 87 2HB ASP 177 6.113 12.433 -8.993 1406 HD1 ASP 87 HD2 ASP 177 5.992 12.509 -13.057 1407 H ALA 88 H ALA 178 6.621 10.497 -7.118 1408 HA ALA 88 HA ALA 178 8.767 11.893 -5.771 1409 1HB ALA 88 3HB ALA 178 6.658 10.904 -4.585 1410 2HB ALA 88 1HB ALA 178 7.345 9.293 -4.776 1411 3HB ALA 88 2HB ALA 178 8.182 10.438 -3.767 1412 H VAL 89 H VAL 179 8.460 8.433 -6.581 1413 HA VAL 89 HA VAL 179 11.007 7.616 -5.423 1414 HB VAL 89 HB VAL 179 8.411 6.797 -5.393 1415 1HG1 VAL 89 2HG2 VAL 179 8.378 6.705 -7.986 1416 2HG1 VAL 89 3HG2 VAL 179 9.260 5.169 -7.826 1417 3HG1 VAL 89 1HG2 VAL 179 7.661 5.405 -7.040 1418 1HG2 VAL 89 3HG1 VAL 179 10.584 4.790 -5.641 1419 2HG2 VAL 89 1HG1 VAL 179 10.045 5.745 -4.195 1420 3HG2 VAL 89 2HG1 VAL 179 8.907 4.619 -4.973 1421 H LYS 90 H LYS 180 10.299 8.814 -8.522 1422 HA LYS 90 HA LYS 180 11.761 7.061 -10.286 1423 1HB LYS 90 1HB LYS 180 9.933 8.925 -10.680 1424 2HB LYS 90 2HB LYS 180 11.232 10.093 -10.631 1425 1HG LYS 90 1HG LYS 180 12.260 8.979 -12.665 1426 2HG LYS 90 2HG LYS 180 11.003 7.734 -12.614 1427 1HD LYS 90 1HD LYS 180 9.225 9.573 -12.815 1428 2HD LYS 90 2HD LYS 180 10.494 10.768 -13.005 1429 1HE LYS 90 1HE LYS 180 9.982 8.371 -14.896 1430 2HE LYS 90 2HE LYS 180 9.386 10.012 -15.148 1431 1HZ LYS 90 1HZ LYS 180 12.257 9.275 -15.007 1432 2HZ LYS 90 2HZ LYS 180 11.686 10.789 -15.240 Start of MODEL 22 Raw file had 1432 H/Q atoms Start of MODEL 22 1 1H MET 1 1H MET 1 -12.485 5.096 -1.373 2 2H MET 1 2H MET 1 -11.256 5.472 -2.384 3 HA MET 1 HA MET 1 -12.716 7.383 -0.668 4 1HB MET 1 1HB MET 1 -9.920 6.121 -0.346 5 2HB MET 1 2HB MET 1 -10.469 7.473 0.593 6 1HG MET 1 1HG MET 1 -12.326 6.055 1.581 7 2HG MET 1 2HG MET 1 -11.694 4.660 0.666 8 1HE MET 1 3HE MET 1 -11.775 4.090 3.619 9 2HE MET 1 2HE MET 1 -10.795 3.051 2.543 10 3HE MET 1 1HE MET 1 -10.095 3.659 4.067 11 H ASN 2 H ASN 2 -9.484 8.022 -1.295 12 HA ASN 2 HA ASN 2 -8.900 9.029 -3.510 13 1HB ASN 2 1HB ASN 2 -9.381 11.503 -3.893 14 2HB ASN 2 2HB ASN 2 -10.644 10.338 -4.136 15 1HD2 ASN 2 1HD2 ASN 2 -12.871 12.365 -2.243 16 2HD2 ASN 2 2HD2 ASN 2 -12.517 11.275 -3.676 17 H LYS 3 H LYS 3 -8.965 10.129 -0.365 18 HA LYS 3 HA LYS 3 -6.652 9.980 0.831 19 1HB LYS 3 1HB LYS 3 -5.302 10.727 -1.171 20 2HB LYS 3 2HB LYS 3 -5.819 12.375 -0.900 21 1HG LYS 3 1HG LYS 3 -4.624 12.377 1.310 22 2HG LYS 3 2HG LYS 3 -4.405 10.629 1.244 23 1HD LYS 3 1HD LYS 3 -2.903 10.896 -0.784 24 2HD LYS 3 2HD LYS 3 -3.064 12.652 -0.656 25 1HE LYS 3 1HE LYS 3 -2.048 12.570 1.681 26 2HE LYS 3 2HE LYS 3 -1.917 10.810 1.565 27 1HZ LYS 3 1HZ LYS 3 -0.431 11.073 -0.306 28 2HZ LYS 3 2HZ LYS 3 0.146 11.852 1.010 29 H THR 4 H THR 4 -9.154 12.305 0.093 30 HA THR 4 HA THR 4 -8.883 13.781 2.601 31 HB THR 4 HB THR 4 -10.418 14.045 -0.065 32 HG1 THR 4 HG1 THR 4 -8.511 15.703 1.259 33 1HG2 THR 4 3HG2 THR 4 -10.624 15.660 2.470 34 2HG2 THR 4 1HG2 THR 4 -11.209 16.196 0.823 35 3HG2 THR 4 2HG2 THR 4 -11.899 14.726 1.608 36 H GLU 5 H GLU 5 -10.725 11.317 0.871 37 HA GLU 5 HA GLU 5 -12.981 11.104 2.876 38 1HB GLU 5 1HB GLU 5 -11.977 8.988 0.917 39 2HB GLU 5 2HB GLU 5 -13.416 8.838 1.902 40 1HG GLU 5 1HG GLU 5 -12.964 10.826 -0.402 41 2HG GLU 5 2HG GLU 5 -13.912 9.362 -0.476 42 HE2 GLU 5 HE2 GLU 5 -15.445 12.765 0.992 43 H LEU 6 H LEU 6 -9.710 10.374 2.700 44 HA LEU 6 HA LEU 6 -9.356 8.315 4.805 45 1HB LEU 6 2HB LEU 6 -7.678 9.546 2.838 46 2HB LEU 6 1HB LEU 6 -7.126 10.340 4.284 47 HG LEU 6 HG LEU 6 -7.175 7.363 3.866 48 1HD1 LEU 6 2HD1 LEU 6 -5.351 8.636 2.635 49 2HD1 LEU 6 3HD1 LEU 6 -4.820 9.311 4.165 50 3HD1 LEU 6 1HD1 LEU 6 -4.696 7.562 3.893 51 1HD2 LEU 6 3HD2 LEU 6 -6.737 8.911 6.425 52 2HD2 LEU 6 1HD2 LEU 6 -7.546 7.361 6.159 53 3HD2 LEU 6 2HD2 LEU 6 -5.773 7.466 6.109 54 H ILE 7 H ILE 7 -9.043 11.894 4.577 55 HA ILE 7 HA ILE 7 -8.383 12.460 7.333 56 HB ILE 7 HB ILE 7 -9.888 14.315 5.383 57 1HG1 ILE 7 1HG1 ILE 7 -6.840 14.144 5.748 58 2HG1 ILE 7 2HG1 ILE 7 -7.651 13.327 4.465 59 1HG2 ILE 7 2HG2 ILE 7 -9.856 15.161 7.777 60 2HG2 ILE 7 3HG2 ILE 7 -8.100 15.109 7.745 61 3HG2 ILE 7 1HG2 ILE 7 -8.966 16.219 6.673 62 1HD1 ILE 7 3HD1 ILE 7 -8.621 15.560 3.642 63 2HD1 ILE 7 1HD1 ILE 7 -7.458 16.342 4.704 64 3HD1 ILE 7 2HD1 ILE 7 -6.882 15.245 3.418 65 H ASN 8 H ASN 8 -11.547 12.497 5.708 66 HA ASN 8 HA ASN 8 -13.061 12.927 8.223 67 1HB ASN 8 1HB ASN 8 -14.117 11.738 5.554 68 2HB ASN 8 2HB ASN 8 -15.130 12.229 6.892 69 1HD2 ASN 8 2HD2 ASN 8 -14.137 15.097 4.252 70 2HD2 ASN 8 1HD2 ASN 8 -13.780 13.313 4.017 71 H ALA 9 H ALA 9 -11.625 10.022 7.034 72 HA ALA 9 HA ALA 9 -13.315 8.105 8.615 73 1HB ALA 9 2HB ALA 9 -11.602 7.359 6.664 74 2HB ALA 9 3HB ALA 9 -10.299 7.786 7.770 75 3HB ALA 9 1HB ALA 9 -11.364 6.499 8.236 76 H VAL 10 H VAL 10 -10.234 9.867 9.043 77 HA VAL 10 HA VAL 10 -9.577 8.599 11.499 78 HB VAL 10 HB VAL 10 -8.180 11.149 10.830 79 1HG1 VAL 10 3HG2 VAL 10 -7.661 9.389 12.720 80 2HG1 VAL 10 1HG2 VAL 10 -6.933 8.467 11.376 81 3HG1 VAL 10 2HG2 VAL 10 -6.332 10.104 11.738 82 1HG2 VAL 10 1HG1 VAL 10 -8.140 8.645 9.099 83 2HG2 VAL 10 2HG1 VAL 10 -8.389 10.371 8.688 84 3HG2 VAL 10 3HG1 VAL 10 -6.747 9.807 9.143 85 H ALA 11 H ALA 11 -10.543 11.687 10.641 86 HA ALA 11 HA ALA 11 -10.927 12.494 13.321 87 1HB ALA 11 2HB ALA 11 -10.600 14.176 11.465 88 2HB ALA 11 3HB ALA 11 -12.178 13.743 10.761 89 3HB ALA 11 1HB ALA 11 -12.093 14.593 12.338 90 H GLU 12 H GLU 12 -13.102 10.659 11.308 91 HA GLU 12 HA GLU 12 -15.420 11.067 13.172 92 1HB GLU 12 1HB GLU 12 -15.859 10.641 10.731 93 2HB GLU 12 2HB GLU 12 -15.116 9.056 10.866 94 1HG GLU 12 1HG GLU 12 -17.521 8.785 10.855 95 2HG GLU 12 2HG GLU 12 -16.948 8.324 12.445 96 HE1 GLU 12 HE2 GLU 12 -19.317 11.571 11.879 97 H THR 13 H THR 13 -13.073 8.376 12.485 98 HA THR 13 HA THR 13 -14.038 6.852 14.799 99 HB THR 13 HB THR 13 -11.957 5.396 14.523 100 HG1 THR 13 HG1 THR 13 -10.654 7.183 14.100 101 1HG2 THR 13 3HG2 THR 13 -13.089 5.994 11.737 102 2HG2 THR 13 1HG2 THR 13 -12.029 4.648 12.194 103 3HG2 THR 13 2HG2 THR 13 -13.671 4.751 12.881 104 H SER 14 H SER 14 -12.188 9.364 14.906 105 HA SER 14 HA SER 14 -10.890 8.629 17.633 106 1HB SER 14 1HB SER 14 -9.521 10.473 15.597 107 2HB SER 14 2HB SER 14 -8.855 9.896 17.123 108 HG SER 14 HG SER 14 -8.989 7.777 16.273 109 H GLY 15 H GLY 15 -12.355 11.353 15.821 110 1HA GLY 15 1HA GLY 15 -13.061 13.489 16.568 111 2HA GLY 15 2HA GLY 15 -13.019 12.893 18.228 112 H LEU 16 H LEU 16 -10.517 13.372 15.783 113 HA LEU 16 HA LEU 16 -8.886 15.277 17.464 114 1HB LEU 16 1HB LEU 16 -7.047 14.874 15.989 115 2HB LEU 16 2HB LEU 16 -7.547 13.542 17.008 116 HG LEU 16 HG LEU 16 -8.553 12.392 15.325 117 1HD1 LEU 16 2HD1 LEU 16 -9.615 14.268 14.007 118 2HD1 LEU 16 3HD1 LEU 16 -7.979 14.574 13.337 119 3HD1 LEU 16 1HD1 LEU 16 -8.873 13.020 13.006 120 1HD2 LEU 16 3HD2 LEU 16 -6.576 11.528 15.334 121 2HD2 LEU 16 1HD2 LEU 16 -7.480 11.382 13.809 122 3HD2 LEU 16 2HD2 LEU 16 -6.154 12.519 13.895 123 H SER 17 H SER 17 -8.347 15.971 14.631 124 HA SER 17 HA SER 17 -10.530 18.043 14.093 125 1HB SER 17 1HB SER 17 -7.603 18.875 13.847 126 2HB SER 17 2HB SER 17 -9.022 19.828 13.489 127 HG SER 17 HG SER 17 -8.198 20.284 15.537 128 H LYS 18 H LYS 18 -10.580 18.762 11.898 129 HA LYS 18 HA LYS 18 -10.030 16.623 9.850 130 1HB LYS 18 1HB LYS 18 -12.069 18.209 9.808 131 2HB LYS 18 2HB LYS 18 -10.992 19.500 9.287 132 1HG LYS 18 1HG LYS 18 -10.403 18.186 7.225 133 2HG LYS 18 2HG LYS 18 -11.326 16.801 7.823 134 1HD LYS 18 1HD LYS 18 -13.447 18.090 7.742 135 2HD LYS 18 2HD LYS 18 -12.583 19.522 7.162 136 1HE LYS 18 1HE LYS 18 -11.857 18.250 5.085 137 2HE LYS 18 2HE LYS 18 -12.681 16.800 5.674 138 1HZ LYS 18 1HZ LYS 18 -14.012 19.388 5.097 139 2HZ LYS 18 2HZ LYS 18 -14.769 18.041 5.631 140 H LYS 19 H LYS 19 -8.650 19.797 10.622 141 HA LYS 19 HA LYS 19 -6.303 19.618 8.832 142 1HB LYS 19 2HB LYS 19 -6.640 21.179 11.463 143 2HB LYS 19 1HB LYS 19 -5.207 21.294 10.432 144 1HG LYS 19 1HG LYS 19 -6.641 22.107 8.516 145 2HG LYS 19 2HG LYS 19 -8.067 22.040 9.554 146 1HD LYS 19 1HD LYS 19 -6.999 23.706 11.135 147 2HD LYS 19 2HD LYS 19 -5.573 23.779 10.092 148 1HE LYS 19 1HE LYS 19 -7.024 24.635 8.178 149 2HE LYS 19 2HE LYS 19 -8.444 24.572 9.233 150 1HZ LYS 19 1HZ LYS 19 -6.017 26.207 9.733 151 2HZ LYS 19 2HZ LYS 19 -7.321 26.145 10.716 152 H ASP 20 H ASP 20 -6.849 18.332 12.205 153 HA ASP 20 HA ASP 20 -3.999 17.382 12.424 154 1HB ASP 20 1HB ASP 20 -6.486 16.844 14.145 155 2HB ASP 20 2HB ASP 20 -5.049 15.881 14.362 156 HD1 ASP 20 HD2 ASP 20 -3.055 18.312 15.777 157 H ALA 21 H ALA 21 -6.966 15.967 11.189 158 HA ALA 21 HA ALA 21 -5.890 13.207 10.909 159 1HB ALA 21 2HB ALA 21 -8.448 14.582 9.898 160 2HB ALA 21 3HB ALA 21 -8.003 12.897 9.485 161 3HB ALA 21 1HB ALA 21 -8.240 13.370 11.140 162 H THR 22 H THR 22 -6.204 16.019 8.642 163 HA THR 22 HA THR 22 -5.003 14.819 6.325 164 HB THR 22 HB THR 22 -4.549 17.755 7.181 165 HG1 THR 22 HG1 THR 22 -6.893 16.661 6.063 166 1HG2 THR 22 3HG2 THR 22 -5.102 16.354 4.496 167 2HG2 THR 22 1HG2 THR 22 -4.994 18.125 4.715 168 3HG2 THR 22 2HG2 THR 22 -3.557 17.080 5.010 169 H LYS 23 H LYS 23 -3.458 16.525 8.939 170 HA LYS 23 HA LYS 23 -0.642 16.157 8.193 171 1HB LYS 23 2HB LYS 23 -2.103 16.312 10.950 172 2HB LYS 23 1HB LYS 23 -0.374 16.267 10.871 173 1HG LYS 23 1HG LYS 23 -0.278 18.447 9.606 174 2HG LYS 23 2HG LYS 23 -2.037 18.524 9.577 175 1HD LYS 23 1HD LYS 23 -2.045 18.521 12.142 176 2HD LYS 23 2HD LYS 23 -0.281 18.555 12.118 177 1HE LYS 23 1HE LYS 23 -0.344 20.768 10.865 178 2HE LYS 23 2HE LYS 23 -2.114 20.718 10.864 179 1HZ LYS 23 1HZ LYS 23 -0.381 20.816 13.271 180 2HZ LYS 23 2HZ LYS 23 -1.245 22.060 12.656 181 H ALA 24 H ALA 24 -2.580 14.346 10.472 182 HA ALA 24 HA ALA 24 -0.786 12.285 11.219 183 1HB ALA 24 2HB ALA 24 -2.783 12.833 12.423 184 2HB ALA 24 3HB ALA 24 -3.820 12.246 11.082 185 3HB ALA 24 1HB ALA 24 -2.806 11.097 12.018 186 H VAL 25 H VAL 25 -2.952 12.245 8.456 187 HA VAL 25 HA VAL 25 -2.229 9.575 7.332 188 HB VAL 25 HB VAL 25 -3.434 12.371 6.472 189 1HG1 VAL 25 1HG2 VAL 25 -2.709 10.247 4.379 190 2HG1 VAL 25 2HG2 VAL 25 -3.829 11.627 4.117 191 3HG1 VAL 25 3HG2 VAL 25 -2.130 11.915 4.466 192 1HG2 VAL 25 2HG1 VAL 25 -4.564 9.547 6.406 193 2HG2 VAL 25 3HG1 VAL 25 -4.928 10.805 7.600 194 3HG2 VAL 25 1HG1 VAL 25 -5.442 11.045 5.922 195 H ASP 26 H ASP 26 -1.032 12.879 6.465 196 HA ASP 26 HA ASP 26 1.534 11.681 5.348 197 1HB ASP 26 1HB ASP 26 0.690 14.600 5.883 198 2HB ASP 26 2HB ASP 26 2.212 14.145 5.127 199 HD2 ASP 26 HD2 ASP 26 -1.137 14.311 2.963 200 H ALA 27 H ALA 27 0.814 11.454 8.075 201 HA ALA 27 HA ALA 27 3.494 11.881 9.421 202 1HB ALA 27 2HB ALA 27 1.193 12.848 10.470 203 2HB ALA 27 3HB ALA 27 1.069 11.190 11.039 204 3HB ALA 27 1HB ALA 27 2.441 12.231 11.476 205 H VAL 28 H VAL 28 0.937 9.459 9.108 206 HA VAL 28 HA VAL 28 2.578 7.075 9.740 207 HB VAL 28 HB VAL 28 0.063 7.394 7.909 208 1HG1 VAL 28 2HG2 VAL 28 1.314 4.797 9.004 209 2HG1 VAL 28 3HG2 VAL 28 -0.297 4.934 8.246 210 3HG1 VAL 28 1HG2 VAL 28 1.123 5.302 7.281 211 1HG2 VAL 28 3HG1 VAL 28 -0.377 7.896 10.214 212 2HG2 VAL 28 1HG1 VAL 28 -1.210 6.421 9.605 213 3HG2 VAL 28 2HG1 VAL 28 0.267 6.256 10.673 214 H PHE 29 H PHE 29 1.315 8.316 6.808 215 HA PHE 29 HA PHE 29 2.936 6.758 4.907 216 1HB PHE 29 2HB PHE 29 1.195 9.169 4.234 217 2HB PHE 29 1HB PHE 29 1.815 7.987 3.090 218 HD1 PHE 29 HD2 PHE 29 1.375 5.366 3.927 219 HD2 PHE 29 HD1 PHE 29 -1.116 8.764 4.734 220 HE1 PHE 29 HE2 PHE 29 -0.418 3.873 4.656 221 HE2 PHE 29 HE1 PHE 29 -2.871 7.279 5.556 222 HZ PHE 29 HZ PHE 29 -2.463 4.824 5.622 223 H ASP 30 H ASP 30 3.745 9.790 6.389 224 HA ASP 30 HA ASP 30 5.816 10.409 4.325 225 1HB ASP 30 1HB ASP 30 4.632 12.058 5.986 226 2HB ASP 30 2HB ASP 30 5.776 11.539 7.199 227 HD2 ASP 30 HD2 ASP 30 7.126 14.564 5.961 228 H SER 31 H SER 31 5.726 8.871 7.384 229 HA SER 31 HA SER 31 8.687 8.293 7.622 230 1HB SER 31 1HB SER 31 6.462 6.838 9.136 231 2HB SER 31 2HB SER 31 8.193 6.807 9.495 232 HG SER 31 HG SER 31 7.080 8.286 10.787 233 H ILE 32 H ILE 32 5.794 6.325 6.351 234 HA ILE 32 HA ILE 32 7.180 3.998 5.621 235 HB ILE 32 HB ILE 32 4.850 5.130 4.077 236 1HG1 ILE 32 1HG1 ILE 32 5.041 4.314 6.955 237 2HG1 ILE 32 2HG1 ILE 32 4.206 5.585 6.096 238 1HG2 ILE 32 3HG2 ILE 32 6.289 2.889 3.550 239 2HG2 ILE 32 1HG2 ILE 32 5.420 2.242 4.914 240 3HG2 ILE 32 2HG2 ILE 32 4.510 2.804 3.516 241 1HD1 ILE 32 3HD1 ILE 32 3.230 2.739 6.080 242 2HD1 ILE 32 1HD1 ILE 32 2.811 3.999 7.280 243 3HD1 ILE 32 2HD1 ILE 32 2.375 4.259 5.555 244 H THR 33 H THR 33 6.368 6.808 3.594 245 HA THR 33 HA THR 33 8.029 5.841 1.327 246 HB THR 33 HB THR 33 6.355 7.597 0.918 247 HG1 THR 33 HG1 THR 33 8.930 8.626 0.458 248 1HG2 THR 33 3HG2 THR 33 6.749 8.830 3.165 249 2HG2 THR 33 1HG2 THR 33 8.032 9.714 2.382 250 3HG2 THR 33 2HG2 THR 33 6.329 9.840 1.782 251 H GLU 34 H GLU 34 8.974 7.700 4.191 252 HA GLU 34 HA GLU 34 11.792 8.063 3.241 253 1HB GLU 34 1HB GLU 34 10.778 9.596 4.993 254 2HB GLU 34 2HB GLU 34 10.620 8.244 6.097 255 1HG GLU 34 1HG GLU 34 12.537 9.596 6.741 256 2HG GLU 34 2HG GLU 34 13.102 8.014 6.247 257 HE1 GLU 34 HE2 GLU 34 14.068 11.370 4.188 258 H ALA 35 H ALA 35 10.019 5.500 5.063 259 HA ALA 35 HA ALA 35 12.368 3.820 5.457 260 1HB ALA 35 3HB ALA 35 9.898 3.338 6.549 261 2HB ALA 35 1HB ALA 35 9.413 2.808 4.959 262 3HB ALA 35 2HB ALA 35 10.616 1.905 5.810 263 H LEU 36 H LEU 36 9.895 3.752 2.843 264 HA LEU 36 HA LEU 36 11.091 1.683 1.196 265 1HB LEU 36 2HB LEU 36 9.299 3.851 0.265 266 2HB LEU 36 1HB LEU 36 9.500 2.243 -0.396 267 HG LEU 36 HG LEU 36 8.110 2.860 2.253 268 1HD1 LEU 36 1HD2 LEU 36 6.659 2.869 0.380 269 2HD1 LEU 36 2HD2 LEU 36 7.172 1.174 -0.054 270 3HD1 LEU 36 3HD2 LEU 36 6.306 1.513 1.484 271 1HD2 LEU 36 2HD1 LEU 36 9.607 0.946 2.796 272 2HD2 LEU 36 3HD1 LEU 36 7.916 0.501 2.813 273 3HD2 LEU 36 1HD1 LEU 36 8.940 0.046 1.402 274 NH1 ARG 37 NH2 ARG 37 12.411 11.263 -2.654 275 NH2 ARG 37 NH1 ARG 37 14.506 12.133 -2.767 276 H ARG 37 H ARG 37 11.273 5.261 0.926 277 HA ARG 37 HA ARG 37 12.968 5.201 -1.341 278 1HB ARG 37 1HB ARG 37 11.688 7.228 -0.620 279 2HB ARG 37 2HB ARG 37 12.657 7.335 0.853 280 1HG ARG 37 1HG ARG 37 14.708 7.835 -0.681 281 2HG ARG 37 2HG ARG 37 13.564 7.942 -2.018 282 1HD ARG 37 1HD ARG 37 12.242 9.674 -0.541 283 2HD ARG 37 2HD ARG 37 13.566 9.573 0.606 284 1HH1 ARG 37 2HH2 ARG 37 11.775 10.595 -2.205 285 2HH1 ARG 37 1HH2 ARG 37 12.183 11.914 -3.413 286 1HH2 ARG 37 1HH1 ARG 37 15.467 12.133 -2.406 287 2HH2 ARG 37 2HH1 ARG 37 14.132 12.724 -3.517 288 H LYS 38 H LYS 38 13.719 4.728 2.105 289 HA LYS 38 HA LYS 38 16.699 5.113 1.567 290 1HB LYS 38 1HB LYS 38 15.570 6.694 3.264 291 2HB LYS 38 2HB LYS 38 15.399 5.301 4.315 292 1HG LYS 38 1HG LYS 38 17.949 5.068 4.337 293 2HG LYS 38 2HG LYS 38 18.052 6.393 3.193 294 1HD LYS 38 1HD LYS 38 18.586 7.306 5.293 295 2HD LYS 38 2HD LYS 38 17.009 7.958 4.922 296 1HE LYS 38 1HE LYS 38 17.441 5.499 6.776 297 2HE LYS 38 2HE LYS 38 17.512 7.158 7.361 298 1HZ LYS 38 1HZ LYS 38 15.144 5.962 6.050 299 2HZ LYS 38 2HZ LYS 38 15.240 7.494 6.611 300 H GLY 39 H GLY 39 14.831 2.640 1.251 301 1HA GLY 39 1HA GLY 39 15.132 0.272 1.430 302 2HA GLY 39 2HA GLY 39 16.795 0.567 1.873 303 H ASP 40 H ASP 40 13.876 1.455 3.633 304 HA ASP 40 HA ASP 40 14.595 -0.401 5.951 305 1HB ASP 40 1HB ASP 40 12.950 2.071 6.366 306 2HB ASP 40 2HB ASP 40 13.605 0.999 7.552 307 HD2 ASP 40 HD2 ASP 40 15.830 3.939 6.002 308 H LYS 41 H LYS 41 13.232 -1.662 6.973 309 HA LYS 41 HA LYS 41 10.684 -2.388 5.536 310 1HB LYS 41 2HB LYS 41 11.654 -3.707 8.085 311 2HB LYS 41 1HB LYS 41 10.408 -4.294 6.992 312 1HG LYS 41 1HG LYS 41 12.180 -4.651 5.202 313 2HG LYS 41 2HG LYS 41 13.416 -4.147 6.362 314 1HD LYS 41 1HD LYS 41 12.713 -6.051 7.912 315 2HD LYS 41 2HD LYS 41 11.504 -6.534 6.734 316 1HE LYS 41 1HE LYS 41 13.360 -8.022 6.423 317 2HE LYS 41 2HE LYS 41 13.349 -6.963 5.016 318 1HZ LYS 41 1HZ LYS 41 15.119 -6.704 7.391 319 2HZ LYS 41 2HZ LYS 41 15.556 -7.278 5.924 320 H VAL 42 H VAL 42 8.824 -1.413 6.138 321 HA VAL 42 HA VAL 42 8.331 -0.124 8.692 322 HB VAL 42 HB VAL 42 6.730 -0.673 6.089 323 1HG1 VAL 42 3HG2 VAL 42 5.292 0.025 7.914 324 2HG1 VAL 42 1HG2 VAL 42 6.360 1.479 8.184 325 3HG1 VAL 42 2HG2 VAL 42 5.424 1.283 6.661 326 1HG2 VAL 42 3HG1 VAL 42 8.247 1.843 6.967 327 2HG2 VAL 42 1HG1 VAL 42 8.742 0.716 5.637 328 3HG2 VAL 42 2HG1 VAL 42 7.288 1.691 5.471 329 H GLN 43 H GLN 43 6.706 -0.748 9.790 330 HA GLN 43 HA GLN 43 5.466 -3.503 9.589 331 1HB GLN 43 1HB GLN 43 7.328 -3.188 11.884 332 2HB GLN 43 2HB GLN 43 6.128 -4.473 11.693 333 1HG GLN 43 1HG GLN 43 7.280 -5.061 9.501 334 2HG GLN 43 2HG GLN 43 8.463 -3.795 9.819 335 1HE2 GLN 43 1HE2 GLN 43 10.401 -6.614 10.853 336 2HE2 GLN 43 2HE2 GLN 43 9.841 -5.640 9.411 337 H LEU 44 H LEU 44 3.589 -3.778 10.089 338 HA LEU 44 HA LEU 44 2.118 -2.149 12.195 339 1HB LEU 44 2HB LEU 44 0.992 -2.674 9.390 340 2HB LEU 44 1HB LEU 44 0.052 -2.037 10.711 341 HG LEU 44 HG LEU 44 2.519 -0.502 9.707 342 1HD1 LEU 44 1HD1 LEU 44 1.217 -1.011 7.658 343 2HD1 LEU 44 2HD1 LEU 44 -0.274 -0.388 8.406 344 3HD1 LEU 44 3HD1 LEU 44 1.090 0.710 8.067 345 1HD2 LEU 44 1HD2 LEU 44 -0.149 0.428 10.977 346 2HD2 LEU 44 2HD2 LEU 44 1.430 0.346 11.795 347 3HD2 LEU 44 3HD2 LEU 44 1.183 1.492 10.465 348 H ILE 45 H ILE 45 1.629 -3.859 13.531 349 HA ILE 45 HA ILE 45 1.694 -6.552 12.502 350 HB ILE 45 HB ILE 45 2.757 -5.907 14.668 351 1HG1 ILE 45 1HG1 ILE 45 2.209 -7.935 16.037 352 2HG1 ILE 45 2HG1 ILE 45 0.872 -8.313 14.964 353 1HG2 ILE 45 1HG2 ILE 45 0.918 -4.509 15.602 354 2HG2 ILE 45 2HG2 ILE 45 -0.080 -5.964 15.852 355 3HG2 ILE 45 3HG2 ILE 45 1.446 -5.751 16.756 356 1HD1 ILE 45 1HD1 ILE 45 3.854 -8.181 14.114 357 2HD1 ILE 45 2HD1 ILE 45 2.932 -9.666 14.454 358 3HD1 ILE 45 3HD1 ILE 45 2.502 -8.663 13.052 359 H GLY 46 H GLY 46 -0.811 -4.928 13.108 360 1HA GLY 46 1HA GLY 46 -2.827 -7.284 12.831 361 2HA GLY 46 2HA GLY 46 -3.326 -5.683 13.320 362 H PHE 47 H PHE 47 -1.174 -5.230 10.709 363 HA PHE 47 HA PHE 47 -3.299 -5.547 8.583 364 1HB PHE 47 2HB PHE 47 -3.399 -3.385 10.026 365 2HB PHE 47 1HB PHE 47 -1.898 -2.876 9.321 366 HD1 PHE 47 HD2 PHE 47 -5.497 -3.676 8.501 367 HD2 PHE 47 HD1 PHE 47 -1.787 -2.121 6.958 368 HE1 PHE 47 HE2 PHE 47 -6.594 -3.046 6.365 369 HE2 PHE 47 HE1 PHE 47 -2.916 -1.572 4.844 370 HZ PHE 47 HZ PHE 47 -5.302 -2.159 4.537 371 H GLY 48 H GLY 48 0.233 -4.663 9.000 372 1HA GLY 48 1HA GLY 48 0.751 -5.468 6.271 373 2HA GLY 48 2HA GLY 48 0.568 -3.742 6.287 374 H ASN 49 H ASN 49 2.755 -5.815 5.864 375 HA ASN 49 HA ASN 49 4.962 -4.233 7.289 376 1HB ASN 49 1HB ASN 49 4.937 -6.542 8.024 377 2HB ASN 49 2HB ASN 49 4.980 -7.160 6.389 378 1HD2 ASN 49 1HD2 ASN 49 8.422 -7.510 7.711 379 2HD2 ASN 49 2HD2 ASN 49 6.734 -8.139 8.060 380 H PHE 50 H PHE 50 5.263 -2.608 5.825 381 HA PHE 50 HA PHE 50 5.436 -3.164 2.864 382 1HB PHE 50 2HB PHE 50 6.152 -0.478 4.158 383 2HB PHE 50 1HB PHE 50 6.083 -0.776 2.493 384 HD1 PHE 50 HD1 PHE 50 4.067 -0.735 5.632 385 HD2 PHE 50 HD2 PHE 50 4.210 0.095 1.422 386 HE1 PHE 50 HE1 PHE 50 1.919 0.507 5.785 387 HE2 PHE 50 HE2 PHE 50 2.078 1.341 1.624 388 HZ PHE 50 HZ PHE 50 0.897 1.364 3.764 389 H GLU 51 H GLU 51 7.317 -3.125 1.705 390 HA GLU 51 HA GLU 51 9.794 -2.120 2.724 391 1HB GLU 51 1HB GLU 51 11.229 -4.206 2.936 392 2HB GLU 51 2HB GLU 51 9.979 -4.142 4.154 393 1HG GLU 51 1HG GLU 51 8.568 -5.788 2.773 394 2HG GLU 51 2HG GLU 51 9.903 -5.917 1.633 395 HE1 GLU 51 HE2 GLU 51 10.002 -7.691 5.266 396 H VAL 52 H VAL 52 11.519 -1.952 1.177 397 HA VAL 52 HA VAL 52 10.321 -1.985 -1.463 398 HB VAL 52 HB VAL 52 11.765 -0.192 0.217 399 1HG1 VAL 52 1HG2 VAL 52 13.778 -1.199 -1.814 400 2HG1 VAL 52 2HG2 VAL 52 13.897 0.289 -0.806 401 3HG1 VAL 52 3HG2 VAL 52 13.857 -1.336 -0.048 402 1HG2 VAL 52 1HG1 VAL 52 10.207 0.444 -1.474 403 2HG2 VAL 52 2HG1 VAL 52 11.701 1.360 -1.567 404 3HG2 VAL 52 3HG1 VAL 52 11.405 0.095 -2.762 405 NH1 ARG 53 NH2 ARG 53 11.812 -10.195 -4.148 406 NH2 ARG 53 NH1 ARG 53 13.900 -11.081 -4.293 407 H ARG 53 H ARG 53 11.549 -2.579 -3.397 408 HA ARG 53 HA ARG 53 13.614 -4.828 -2.931 409 1HB ARG 53 1HB ARG 53 11.114 -5.553 -3.762 410 2HB ARG 53 2HB ARG 53 11.720 -5.045 -5.306 411 1HG ARG 53 1HG ARG 53 12.112 -7.330 -5.291 412 2HG ARG 53 2HG ARG 53 13.693 -6.581 -5.146 413 1HD ARG 53 1HD ARG 53 13.650 -7.065 -2.626 414 2HD ARG 53 2HD ARG 53 12.076 -7.823 -2.797 415 1HH1 ARG 53 2HH2 ARG 53 11.234 -9.372 -3.944 416 2HH1 ARG 53 1HH2 ARG 53 11.481 -11.124 -4.432 417 1HH2 ARG 53 1HH1 ARG 53 14.911 -10.940 -4.198 418 2HH2 ARG 53 2HH1 ARG 53 13.424 -11.949 -4.565 419 H GLU 54 H GLU 54 15.457 -3.812 -3.499 420 HA GLU 54 HA GLU 54 15.803 -1.966 -5.721 421 1HB GLU 54 1HB GLU 54 17.336 -2.192 -3.756 422 2HB GLU 54 2HB GLU 54 17.969 -3.700 -4.413 423 1HG GLU 54 1HG GLU 54 18.772 -2.438 -6.475 424 2HG GLU 54 2HG GLU 54 18.077 -0.950 -5.840 425 HE1 GLU 54 HE2 GLU 54 21.527 -2.484 -4.371 426 NH1 ARG 55 NH2 ARG 55 13.228 -9.913 -7.904 427 NH2 ARG 55 NH1 ARG 55 15.456 -10.360 -7.939 428 H ARG 55 H ARG 55 15.187 -2.512 -7.665 429 HA ARG 55 HA ARG 55 16.292 -4.633 -9.343 430 1HB ARG 55 1HB ARG 55 15.064 -6.231 -8.023 431 2HB ARG 55 2HB ARG 55 13.547 -5.347 -8.162 432 1HG ARG 55 1HG ARG 55 13.370 -5.747 -10.528 433 2HG ARG 55 2HG ARG 55 15.031 -6.261 -10.694 434 1HD ARG 55 1HD ARG 55 12.733 -7.756 -9.337 435 2HD ARG 55 2HD ARG 55 13.454 -8.116 -10.919 436 1HH1 ARG 55 2HH2 ARG 55 12.454 -9.346 -8.266 437 2HH1 ARG 55 1HH2 ARG 55 13.166 -10.669 -7.213 438 1HH2 ARG 55 1HH1 ARG 55 16.380 -10.135 -8.324 439 2HH2 ARG 55 2HH1 ARG 55 15.238 -11.083 -7.245 440 H ALA 56 H ALA 56 15.995 -3.853 -11.280 441 HA ALA 56 HA ALA 56 13.527 -3.594 -12.690 442 1HB ALA 56 3HB ALA 56 15.150 -1.043 -12.157 443 2HB ALA 56 1HB ALA 56 13.919 -1.178 -13.453 444 3HB ALA 56 2HB ALA 56 13.434 -1.368 -11.741 445 H ALA 57 H ALA 57 15.915 -5.115 -12.782 446 HA ALA 57 HA ALA 57 17.518 -4.266 -15.158 447 1HB ALA 57 3HB ALA 57 18.648 -5.405 -13.338 448 2HB ALA 57 1HB ALA 57 17.713 -6.894 -13.655 449 3HB ALA 57 2HB ALA 57 18.850 -6.254 -14.878 450 NH1 ARG 58 NH2 ARG 58 11.226 -8.103 -15.646 451 NH2 ARG 58 NH1 ARG 58 13.284 -8.443 -14.742 452 H ARG 58 H ARG 58 16.171 -3.795 -16.620 453 HA ARG 58 HA ARG 58 14.932 -6.124 -18.020 454 1HB ARG 58 2HB ARG 58 14.094 -3.189 -18.348 455 2HB ARG 58 1HB ARG 58 13.195 -4.561 -18.961 456 1HG ARG 58 1HG ARG 58 13.475 -3.804 -15.984 457 2HG ARG 58 2HG ARG 58 12.179 -3.358 -17.054 458 1HD ARG 58 1HD ARG 58 11.237 -5.147 -15.890 459 2HD ARG 58 2HD ARG 58 11.671 -5.878 -17.436 460 1HH1 ARG 58 2HH2 ARG 58 10.601 -7.472 -16.160 461 2HH1 ARG 58 1HH2 ARG 58 11.003 -9.045 -15.306 462 1HH2 ARG 58 1HH1 ARG 58 14.226 -8.076 -14.566 463 2HH2 ARG 58 2HH1 ARG 58 12.921 -9.362 -14.465 464 H LYS 59 H LYS 59 14.388 -5.044 -20.453 465 HA LYS 59 HA LYS 59 16.895 -3.955 -21.700 466 1HB LYS 59 1HB LYS 59 17.138 -5.616 -23.462 467 2HB LYS 59 2HB LYS 59 17.497 -6.250 -21.873 468 1HG LYS 59 1HG LYS 59 15.233 -7.427 -21.842 469 2HG LYS 59 2HG LYS 59 14.922 -6.828 -23.473 470 1HD LYS 59 1HD LYS 59 16.982 -8.027 -24.315 471 2HD LYS 59 2HD LYS 59 17.297 -8.632 -22.683 472 1HE LYS 59 1HE LYS 59 15.068 -9.855 -22.700 473 2HE LYS 59 2HE LYS 59 14.744 -9.246 -24.331 474 1HZ LYS 59 1HZ LYS 59 17.060 -10.945 -23.581 475 2HZ LYS 59 2HZ LYS 59 16.751 -10.389 -25.087 476 H GLY 60 H GLY 60 16.104 -2.239 -22.651 477 1HA GLY 60 1HA GLY 60 13.410 -2.340 -24.137 478 2HA GLY 60 2HA GLY 60 13.664 -1.112 -22.904 479 NH1 ARG 61 NH2 ARG 61 12.902 -3.497 -29.288 480 NH2 ARG 61 NH1 ARG 61 14.407 -4.026 -30.907 481 H ARG 61 H ARG 61 13.181 0.255 -24.731 482 HA ARG 61 HA ARG 61 15.657 0.967 -26.397 483 1HB ARG 61 1HB ARG 61 12.748 0.804 -27.403 484 2HB ARG 61 2HB ARG 61 13.982 1.740 -28.233 485 1HG ARG 61 1HG ARG 61 15.426 -0.259 -28.532 486 2HG ARG 61 2HG ARG 61 14.266 -1.269 -27.667 487 1HD ARG 61 1HD ARG 61 12.516 -0.780 -29.460 488 2HD ARG 61 2HD ARG 61 13.681 0.238 -30.298 489 1HH1 ARG 61 2HH2 ARG 61 12.452 -2.761 -28.732 490 2HH1 ARG 61 1HH2 ARG 61 12.722 -4.505 -29.233 491 1HH2 ARG 61 1HH1 ARG 61 15.103 -3.698 -31.586 492 2HH2 ARG 61 2HH1 ARG 61 14.121 -4.997 -30.740 493 H ASN 62 H ASN 62 16.050 3.030 -26.782 494 HA ASN 62 HA ASN 62 15.255 4.955 -24.731 495 1HB ASN 62 1HB ASN 62 17.552 4.708 -25.828 496 2HB ASN 62 2HB ASN 62 16.899 5.433 -27.287 497 1HD2 ASN 62 2HD2 ASN 62 18.079 7.910 -24.324 498 2HD2 ASN 62 1HD2 ASN 62 18.139 6.085 -24.144 499 HA PRO 63 HA PRO 63 11.651 6.669 -27.010 500 1HB PRO 63 1HB PRO 63 11.183 9.034 -25.606 501 2HB PRO 63 2HB PRO 63 10.826 7.407 -25.007 502 1HG PRO 63 1HG PRO 63 13.312 9.097 -24.430 503 2HG PRO 63 2HG PRO 63 12.276 8.245 -23.260 504 1HD PRO 63 1HD PRO 63 14.627 7.143 -24.159 505 2HD PRO 63 2HD PRO 63 13.210 6.095 -23.849 506 H GLN 64 H GLN 64 14.591 8.703 -26.912 507 HA GLN 64 HA GLN 64 13.523 10.519 -29.115 508 1HB GLN 64 1HB GLN 64 16.213 10.687 -27.635 509 2HB GLN 64 2HB GLN 64 15.596 11.845 -28.786 510 1HG GLN 64 1HG GLN 64 14.336 11.236 -26.028 511 2HG GLN 64 2HG GLN 64 15.559 12.442 -26.375 512 1HE2 GLN 64 2HE2 GLN 64 13.129 14.813 -27.646 513 2HE2 GLN 64 1HE2 GLN 64 14.884 14.422 -27.282 514 H THR 65 H THR 65 16.647 9.083 -28.485 515 HA THR 65 HA THR 65 17.466 8.707 -31.185 516 HB THR 65 HB THR 65 19.365 7.406 -30.437 517 HG1 THR 65 HG1 THR 65 18.276 6.039 -29.023 518 1HG2 THR 65 2HG2 THR 65 19.399 9.878 -29.855 519 2HG2 THR 65 3HG2 THR 65 18.744 9.485 -28.246 520 3HG2 THR 65 1HG2 THR 65 20.347 8.876 -28.717 521 H GLY 66 H GLY 66 15.898 6.164 -29.241 522 1HA GLY 66 1HA GLY 66 14.787 4.168 -30.022 523 2HA GLY 66 2HA GLY 66 15.167 4.588 -31.679 524 H GLU 67 H GLU 67 17.486 4.175 -28.983 525 HA GLU 67 HA GLU 67 18.814 1.854 -30.452 526 1HB GLU 67 2HB GLU 67 20.100 4.033 -30.035 527 2HB GLU 67 1HB GLU 67 19.984 3.729 -28.300 528 1HG GLU 67 1HG GLU 67 22.175 3.048 -29.051 529 2HG GLU 67 2HG GLU 67 21.310 1.605 -28.565 530 HE2 GLU 67 HE2 GLU 67 21.470 0.088 -31.648 531 H GLU 68 H GLU 68 18.989 -0.018 -29.443 532 HA GLU 68 HA GLU 68 17.266 -0.521 -27.102 533 1HB GLU 68 1HB GLU 68 17.452 -2.045 -29.149 534 2HB GLU 68 2HB GLU 68 18.987 -2.629 -28.548 535 1HG GLU 68 1HG GLU 68 16.254 -2.845 -27.098 536 2HG GLU 68 2HG GLU 68 16.948 -4.090 -28.110 537 HE1 GLU 68 HE2 GLU 68 19.342 -5.176 -25.824 538 H MET 69 H MET 69 17.897 -0.395 -25.066 539 HA MET 69 HA MET 69 20.777 -0.938 -24.244 540 1HB MET 69 1HB MET 69 21.048 1.011 -22.993 541 2HB MET 69 2HB MET 69 20.422 1.573 -24.520 542 1HG MET 69 1HG MET 69 18.865 1.358 -21.859 543 2HG MET 69 2HG MET 69 19.468 2.839 -22.600 544 1HE MET 69 3HE MET 69 16.595 2.514 -21.579 545 2HE MET 69 2HE MET 69 15.320 2.249 -22.805 546 3HE MET 69 1HE MET 69 16.208 0.858 -22.133 547 H GLU 70 H GLU 70 21.105 -1.710 -22.187 548 HA GLU 70 HA GLU 70 18.870 -3.162 -20.938 549 1HB GLU 70 2HB GLU 70 21.604 -3.660 -21.315 550 2HB GLU 70 1HB GLU 70 21.633 -3.104 -19.680 551 1HG GLU 70 1HG GLU 70 19.816 -4.945 -19.212 552 2HG GLU 70 2HG GLU 70 19.883 -5.376 -20.920 553 HE1 GLU 70 HE2 GLU 70 22.791 -6.457 -18.316 554 H ILE 71 H ILE 71 17.594 -2.263 -19.437 555 HA ILE 71 HA ILE 71 18.160 0.333 -18.185 556 HB ILE 71 HB ILE 71 15.802 -1.655 -17.981 557 1HG1 ILE 71 1HG1 ILE 71 15.942 0.976 -19.607 558 2HG1 ILE 71 2HG1 ILE 71 16.275 -0.585 -20.324 559 1HG2 ILE 71 2HG2 ILE 71 15.848 -0.141 -16.018 560 2HG2 ILE 71 3HG2 ILE 71 15.934 1.283 -17.098 561 3HG2 ILE 71 1HG2 ILE 71 14.481 0.235 -17.078 562 1HD1 ILE 71 2HD1 ILE 71 13.973 -1.405 -19.865 563 2HD1 ILE 71 3HD1 ILE 71 13.547 0.166 -19.128 564 3HD1 ILE 71 1HD1 ILE 71 13.985 0.079 -20.844 565 HA PRO 72 HA PRO 72 19.783 -2.072 -14.486 566 1HB PRO 72 1HB PRO 72 21.113 -0.044 -13.168 567 2HB PRO 72 2HB PRO 72 21.627 -0.615 -14.758 568 1HG PRO 72 1HG PRO 72 19.894 1.840 -14.136 569 2HG PRO 72 2HG PRO 72 21.366 1.774 -15.136 570 1HD PRO 72 1HD PRO 72 18.793 1.610 -16.217 571 2HD PRO 72 2HD PRO 72 20.198 0.798 -16.973 572 H ALA 73 H ALA 73 19.908 -1.298 -11.904 573 HA ALA 73 HA ALA 73 17.442 -2.084 -10.831 574 1HB ALA 73 1HB ALA 73 19.600 -2.006 -9.466 575 2HB ALA 73 2HB ALA 73 19.376 -0.224 -9.278 576 3HB ALA 73 3HB ALA 73 18.214 -1.349 -8.585 577 H SER 74 H SER 74 15.969 -1.270 -9.493 578 HA SER 74 HA SER 74 15.972 1.490 -8.698 579 1HB SER 74 1HB SER 74 13.717 0.314 -10.535 580 2HB SER 74 2HB SER 74 13.220 1.551 -9.427 581 HG SER 74 HG SER 74 15.296 1.800 -11.351 582 H LYS 75 H LYS 75 15.015 1.764 -6.667 583 HA LYS 75 HA LYS 75 14.150 -0.675 -5.224 584 1HB LYS 75 2HB LYS 75 13.491 1.813 -3.773 585 2HB LYS 75 1HB LYS 75 14.106 0.273 -3.257 586 1HG LYS 75 1HG LYS 75 16.402 0.873 -4.146 587 2HG LYS 75 2HG LYS 75 15.779 2.458 -4.623 588 1HD LYS 75 1HD LYS 75 15.136 2.925 -2.212 589 2HD LYS 75 2HD LYS 75 15.795 1.374 -1.720 590 1HE LYS 75 1HE LYS 75 17.443 3.652 -3.022 591 2HE LYS 75 2HE LYS 75 17.305 3.369 -1.288 592 1HZ LYS 75 1HZ LYS 75 19.306 2.411 -2.193 593 2HZ LYS 75 2HZ LYS 75 18.475 1.471 -3.240 594 H VAL 76 H VAL 76 12.168 -1.619 -5.538 595 HA VAL 76 HA VAL 76 9.954 -0.085 -6.533 596 HB VAL 76 HB VAL 76 11.293 -2.478 -7.061 597 1HG1 VAL 76 2HG2 VAL 76 10.257 -3.599 -5.081 598 2HG1 VAL 76 3HG2 VAL 76 8.675 -3.427 -5.858 599 3HG1 VAL 76 1HG2 VAL 76 9.992 -4.392 -6.652 600 1HG2 VAL 76 2HG1 VAL 76 10.097 -1.223 -8.586 601 2HG2 VAL 76 3HG1 VAL 76 9.714 -2.977 -8.645 602 3HG2 VAL 76 1HG1 VAL 76 8.533 -1.826 -7.883 603 HA PRO 77 HA PRO 77 8.199 -0.463 -2.320 604 1HB PRO 77 1HB PRO 77 5.950 1.191 -2.607 605 2HB PRO 77 2HB PRO 77 7.586 1.851 -2.721 606 1HG PRO 77 1HG PRO 77 5.731 1.022 -5.005 607 2HG PRO 77 2HG PRO 77 6.651 2.527 -4.866 608 1HD PRO 77 1HD PRO 77 7.481 0.149 -6.323 609 2HD PRO 77 2HD PRO 77 8.639 1.367 -5.733 610 H ALA 78 H ALA 78 7.084 -1.704 -1.311 611 HA ALA 78 HA ALA 78 4.720 -3.223 -2.497 612 1HB ALA 78 2HB ALA 78 6.938 -4.345 -2.982 613 2HB ALA 78 3HB ALA 78 7.272 -4.427 -1.242 614 3HB ALA 78 1HB ALA 78 5.898 -5.334 -1.921 615 H PHE 79 H PHE 79 3.720 -4.479 -0.986 616 HA PHE 79 HA PHE 79 3.494 -3.472 1.946 617 1HB PHE 79 2HB PHE 79 2.230 -1.915 1.143 618 2HB PHE 79 1HB PHE 79 1.499 -2.946 -0.121 619 HD1 PHE 79 HD2 PHE 79 1.298 -2.079 3.495 620 HD2 PHE 79 HD1 PHE 79 -0.422 -4.405 0.309 621 HE1 PHE 79 HE2 PHE 79 -0.630 -2.625 4.909 622 HE2 PHE 79 HE1 PHE 79 -2.297 -5.016 1.775 623 HZ PHE 79 HZ PHE 79 -2.383 -4.171 4.091 624 H LYS 80 H LYS 80 3.348 -5.202 2.884 625 HA LYS 80 HA LYS 80 2.298 -8.052 2.038 626 1HB LYS 80 2HB LYS 80 3.779 -7.222 4.548 627 2HB LYS 80 1HB LYS 80 3.068 -8.803 4.258 628 1HG LYS 80 1HG LYS 80 4.577 -9.232 2.336 629 2HG LYS 80 2HG LYS 80 5.228 -7.604 2.419 630 1HD LYS 80 1HD LYS 80 6.845 -9.104 3.357 631 2HD LYS 80 2HD LYS 80 6.269 -8.037 4.624 632 1HE LYS 80 1HE LYS 80 4.781 -9.900 5.523 633 2HE LYS 80 2HE LYS 80 5.313 -10.961 4.210 634 1HZ LYS 80 1HZ LYS 80 7.563 -10.808 5.049 635 2HZ LYS 80 2HZ LYS 80 6.551 -11.368 6.204 636 HA PRO 81 HA PRO 81 -1.423 -6.737 4.332 637 1HB PRO 81 1HB PRO 81 -2.876 -9.068 4.214 638 2HB PRO 81 2HB PRO 81 -2.486 -8.150 2.758 639 1HG PRO 81 1HG PRO 81 -1.001 -10.602 3.854 640 2HG PRO 81 2HG PRO 81 -1.660 -10.378 2.212 641 1HD PRO 81 1HD PRO 81 0.997 -9.832 2.881 642 2HD PRO 81 2HD PRO 81 0.139 -8.915 1.601 643 H GLY 82 H GLY 82 0.914 -7.201 5.896 644 1HA GLY 82 1HA GLY 82 1.953 -8.270 7.791 645 2HA GLY 82 2HA GLY 82 0.473 -7.627 8.471 646 H LYS 83 H LYS 83 0.110 -10.285 6.371 647 HA LYS 83 HA LYS 83 -0.689 -12.531 6.693 648 1HB LYS 83 2HB LYS 83 0.944 -12.299 9.183 649 2HB LYS 83 1HB LYS 83 -0.435 -13.264 9.484 650 1HG LYS 83 1HG LYS 83 1.471 -13.812 7.088 651 2HG LYS 83 2HG LYS 83 1.801 -14.372 8.711 652 1HD LYS 83 1HD LYS 83 0.883 -16.237 7.637 653 2HD LYS 83 2HD LYS 83 -0.363 -15.687 8.747 654 1HE LYS 83 1HE LYS 83 -1.629 -14.640 6.816 655 2HE LYS 83 2HE LYS 83 -0.330 -15.089 5.702 656 1HZ LYS 83 1HZ LYS 83 -2.163 -16.644 5.669 657 2HZ LYS 83 2HZ LYS 83 -2.021 -16.962 7.266 658 H ALA 84 H ALA 84 -1.330 -10.492 9.264 659 HA ALA 84 HA ALA 84 -3.812 -11.373 10.445 660 1HB ALA 84 2HB ALA 84 -2.121 -9.779 11.382 661 2HB ALA 84 3HB ALA 84 -2.441 -8.619 10.065 662 3HB ALA 84 1HB ALA 84 -3.716 -8.959 11.267 663 H LEU 85 H LEU 85 -3.297 -8.839 7.847 664 HA LEU 85 HA LEU 85 -6.163 -8.400 7.409 665 1HB LEU 85 2HB LEU 85 -4.552 -6.603 6.868 666 2HB LEU 85 1HB LEU 85 -3.710 -7.650 5.749 667 HG LEU 85 HG LEU 85 -5.917 -7.947 4.576 668 1HD1 LEU 85 2HD1 LEU 85 -7.495 -6.928 6.187 669 2HD1 LEU 85 3HD1 LEU 85 -6.697 -5.356 6.006 670 3HD1 LEU 85 1HD1 LEU 85 -7.585 -6.073 4.636 671 1HD2 LEU 85 2HD2 LEU 85 -3.949 -6.613 3.650 672 2HD2 LEU 85 3HD2 LEU 85 -5.495 -5.978 3.093 673 3HD2 LEU 85 1HD2 LEU 85 -4.606 -5.141 4.396 674 H LYS 86 H LYS 86 -3.658 -10.518 6.035 675 HA LYS 86 HA LYS 86 -5.268 -11.685 3.909 676 1HB LYS 86 1HB LYS 86 -2.714 -12.034 4.302 677 2HB LYS 86 2HB LYS 86 -3.155 -13.337 5.391 678 1HG LYS 86 1HG LYS 86 -4.409 -14.468 3.504 679 2HG LYS 86 2HG LYS 86 -3.992 -13.128 2.432 680 1HD LYS 86 1HD LYS 86 -1.530 -13.643 2.750 681 2HD LYS 86 2HD LYS 86 -1.953 -14.984 3.822 682 1HE LYS 86 1HE LYS 86 -3.208 -16.116 1.924 683 2HE LYS 86 2HE LYS 86 -2.790 -14.776 0.846 684 1HZ LYS 86 1HZ LYS 86 -0.861 -16.581 2.199 685 2HZ LYS 86 2HZ LYS 86 -1.285 -16.641 0.622 686 H ASP 87 H ASP 87 -5.461 -12.262 7.415 687 HA ASP 87 HA ASP 87 -7.335 -14.568 7.106 688 1HB ASP 87 1HB ASP 87 -5.593 -13.488 9.160 689 2HB ASP 87 2HB ASP 87 -7.153 -13.033 9.702 690 HD1 ASP 87 HD2 ASP 87 -5.910 -16.911 9.542 691 H ALA 88 H ALA 88 -7.586 -11.062 7.850 692 HA ALA 88 HA ALA 88 -10.435 -10.746 8.295 693 1HB ALA 88 1HB ALA 88 -8.651 -8.850 8.435 694 2HB ALA 88 2HB ALA 88 -8.558 -8.858 6.671 695 3HB ALA 88 3HB ALA 88 -10.058 -8.384 7.434 696 H VAL 89 H VAL 89 -8.586 -10.865 5.227 697 HA VAL 89 HA VAL 89 -10.882 -10.219 3.521 698 HB VAL 89 HB VAL 89 -8.337 -9.267 3.891 699 1HG1 VAL 89 2HG2 VAL 89 -7.359 -11.619 3.494 700 2HG1 VAL 89 3HG2 VAL 89 -7.669 -11.357 1.772 701 3HG1 VAL 89 1HG2 VAL 89 -6.619 -10.230 2.694 702 1HG2 VAL 89 1HG1 VAL 89 -9.521 -9.586 1.188 703 2HG2 VAL 89 2HG1 VAL 89 -9.855 -8.339 2.459 704 3HG2 VAL 89 3HG1 VAL 89 -8.218 -8.452 1.759 705 H LYS 90 H LYS 90 -9.462 -13.148 4.569 706 HA LYS 90 HA LYS 90 -9.768 -14.753 2.098 707 1HB LYS 90 1HB LYS 90 -8.763 -15.171 4.918 708 2HB LYS 90 2HB LYS 90 -9.567 -16.569 4.267 709 1HG LYS 90 1HG LYS 90 -8.079 -16.609 2.259 710 2HG LYS 90 2HG LYS 90 -7.321 -15.110 2.764 711 1HD LYS 90 1HD LYS 90 -5.801 -16.837 3.354 712 2HD LYS 90 2HD LYS 90 -6.459 -16.236 4.869 713 1HE LYS 90 1HE LYS 90 -8.033 -18.246 4.972 714 2HE LYS 90 2HE LYS 90 -7.372 -18.832 3.437 715 1HZ LYS 90 1HZ LYS 90 -5.805 -18.396 5.921 716 2HZ LYS 90 2HZ LYS 90 -5.183 -18.929 4.507 717 1H MET 1 1H MET 91 9.105 -0.165 10.750 718 2H MET 1 2H MET 91 10.318 -0.631 11.818 719 HA MET 1 HA MET 91 9.276 0.432 13.359 720 1HB MET 1 1HB MET 91 6.903 0.513 11.379 721 2HB MET 1 2HB MET 91 6.784 1.142 12.994 722 1HG MET 1 1HG MET 91 7.334 3.098 11.997 723 2HG MET 1 2HG MET 91 8.982 2.582 12.334 724 1HE MET 1 3HE MET 91 7.566 4.612 9.983 725 2HE MET 1 2HE MET 91 7.551 3.893 8.344 726 3HE MET 1 1HE MET 91 6.310 3.428 9.533 727 H ASN 2 H ASN 92 6.214 -1.013 12.892 728 HA ASN 2 HA ASN 92 6.066 -3.441 13.645 729 1HB ASN 2 1HB ASN 92 5.948 -4.138 15.868 730 2HB ASN 2 2HB ASN 92 7.494 -3.394 15.636 731 1HD2 ASN 2 1HD2 ASN 92 5.001 -1.846 18.475 732 2HD2 ASN 2 2HD2 ASN 92 4.416 -2.992 17.164 733 H LYS 3 H LYS 93 4.889 -0.460 14.640 734 HA LYS 3 HA LYS 93 2.524 0.087 13.703 735 1HB LYS 3 1HB LYS 93 1.586 -2.291 14.304 736 2HB LYS 3 2HB LYS 93 1.578 -1.803 15.977 737 1HG LYS 3 1HG LYS 93 -0.133 -0.004 15.373 738 2HG LYS 3 2HG LYS 93 0.080 -0.372 13.662 739 1HD LYS 3 1HD LYS 93 -0.758 -2.784 14.151 740 2HD LYS 3 2HD LYS 93 -1.094 -2.257 15.791 741 1HE LYS 3 1HE LYS 93 -3.188 -2.141 14.634 742 2HE LYS 3 2HE LYS 93 -2.692 -0.462 14.841 743 1HZ LYS 3 1HZ LYS 93 -1.913 -0.470 12.546 744 2HZ LYS 3 2HZ LYS 93 -3.495 -0.870 12.628 745 H THR 4 H THR 94 4.261 -0.171 16.758 746 HA THR 4 HA THR 94 2.954 2.154 17.931 747 HB THR 4 HB THR 94 5.010 0.014 18.810 748 HG1 THR 4 HG1 THR 94 2.257 0.359 19.501 749 1HG2 THR 4 3HG2 THR 94 3.525 2.204 20.267 750 2HG2 THR 4 1HG2 THR 94 4.416 0.824 21.076 751 3HG2 THR 4 2HG2 THR 94 5.304 2.012 20.036 752 H GLU 5 H GLU 95 5.885 1.189 16.333 753 HA GLU 5 HA GLU 95 7.462 3.660 17.091 754 1HB GLU 5 1HB GLU 95 8.027 2.001 14.608 755 2HB GLU 5 2HB GLU 95 9.072 3.166 15.368 756 1HG GLU 5 1HG GLU 95 8.340 0.363 16.385 757 2HG GLU 5 2HG GLU 95 9.849 0.841 15.662 758 HE2 GLU 5 HE2 GLU 95 9.134 1.440 19.568 759 H LEU 6 H LEU 96 4.754 2.727 14.993 760 HA LEU 6 HA LEU 96 4.923 4.988 13.177 761 1HB LEU 6 2HB LEU 96 3.497 2.378 13.567 762 2HB LEU 6 1HB LEU 96 2.270 3.562 13.698 763 HG LEU 6 HG LEU 96 2.283 3.450 11.474 764 1HD1 LEU 6 2HD1 LEU 96 3.263 5.686 11.402 765 2HD1 LEU 6 3HD1 LEU 96 4.843 4.969 10.993 766 3HD1 LEU 6 1HD1 LEU 96 3.473 4.770 9.890 767 1HD2 LEU 6 3HD2 LEU 96 3.641 1.336 11.461 768 2HD2 LEU 6 1HD2 LEU 96 3.897 2.252 9.965 769 3HD2 LEU 6 2HD2 LEU 96 5.117 2.297 11.262 770 H ILE 7 H ILE 97 3.275 4.129 16.242 771 HA ILE 7 HA ILE 97 1.481 6.434 16.397 772 HB ILE 7 HB ILE 97 2.663 4.771 18.680 773 1HG1 ILE 7 1HG1 ILE 97 -0.073 4.531 17.280 774 2HG1 ILE 7 2HG1 ILE 97 1.267 3.603 16.766 775 1HG2 ILE 7 2HG2 ILE 97 1.665 6.968 19.536 776 2HG2 ILE 7 3HG2 ILE 97 0.144 6.537 18.769 777 3HG2 ILE 7 1HG2 ILE 97 0.764 5.552 20.094 778 1HD1 ILE 7 2HD1 ILE 97 1.526 2.705 19.201 779 2HD1 ILE 7 3HD1 ILE 97 -0.121 3.239 19.378 780 3HD1 ILE 7 1HD1 ILE 97 0.283 2.060 18.085 781 H ASN 8 H ASN 98 4.720 5.918 17.731 782 HA ASN 8 HA ASN 98 5.092 8.788 18.501 783 1HB ASN 8 1HB ASN 98 7.305 6.682 17.905 784 2HB ASN 8 2HB ASN 98 7.587 8.244 18.639 785 1HD2 ASN 8 2HD2 ASN 98 6.601 5.231 21.121 786 2HD2 ASN 8 1HD2 ASN 98 6.935 5.016 19.330 787 H ALA 9 H ALA 99 5.033 7.424 15.381 788 HA ALA 9 HA ALA 99 6.773 9.492 14.035 789 1HB ALA 9 2HB ALA 99 6.039 7.110 12.883 790 2HB ALA 9 3HB ALA 99 4.440 7.818 12.726 791 3HB ALA 9 1HB ALA 99 5.724 8.588 11.887 792 H VAL 10 H VAL 100 3.294 8.864 14.583 793 HA VAL 10 HA VAL 100 2.448 11.071 13.050 794 HB VAL 10 HB VAL 100 0.600 9.782 15.081 795 1HG1 VAL 10 3HG2 VAL 100 0.027 11.642 13.229 796 2HG1 VAL 10 1HG2 VAL 100 -0.200 10.170 12.231 797 3HG1 VAL 10 2HG2 VAL 100 -1.113 10.350 13.737 798 1HG2 VAL 10 1HG1 VAL 100 1.818 8.446 12.662 799 2HG2 VAL 10 2HG1 VAL 100 1.593 7.927 14.369 800 3HG2 VAL 10 3HG1 VAL 100 0.171 7.972 13.280 801 H ALA 11 H ALA 101 2.459 10.318 16.375 802 HA ALA 11 HA ALA 101 1.671 12.922 17.127 803 1HB ALA 11 2HB ALA 101 1.420 10.890 18.648 804 2HB ALA 11 3HB ALA 101 3.190 10.797 18.832 805 3HB ALA 11 1HB ALA 101 2.279 12.173 19.539 806 H GLU 12 H GLU 102 4.862 11.816 16.273 807 HA GLU 12 HA GLU 102 6.170 14.281 17.389 808 1HB GLU 12 1HB GLU 102 7.498 12.169 17.247 809 2HB GLU 12 2HB GLU 102 7.277 12.110 15.497 810 1HG GLU 12 1HG GLU 102 8.608 14.256 15.264 811 2HG GLU 12 2HG GLU 102 8.794 14.333 17.015 812 HE1 GLU 12 HE2 GLU 102 10.926 11.746 14.740 813 H THR 13 H THR 103 5.304 13.074 14.064 814 HA THR 13 HA THR 103 5.721 15.918 13.115 815 HB THR 13 HB THR 103 6.656 13.761 12.121 816 HG1 THR 13 HG1 THR 103 6.831 14.885 10.157 817 1HG2 THR 13 2HG2 THR 103 4.638 12.549 11.501 818 2HG2 THR 13 3HG2 THR 103 4.171 13.863 10.386 819 3HG2 THR 13 1HG2 THR 103 5.654 12.911 10.092 820 H SER 14 H SER 104 3.365 14.952 14.475 821 HA SER 14 HA SER 104 1.481 16.954 13.067 822 1HB SER 14 1HB SER 104 0.688 14.578 12.595 823 2HB SER 14 2HB SER 104 0.385 14.364 14.324 824 HG SER 14 HG SER 104 -0.737 16.364 12.668 825 H GLY 15 H GLY 105 2.474 15.649 16.273 826 1HA GLY 15 1HA GLY 105 2.077 16.484 18.443 827 2HA GLY 15 2HA GLY 105 1.673 18.033 17.711 828 H LEU 16 H LEU 106 0.264 14.833 17.923 829 HA LEU 16 HA LEU 106 -2.359 15.813 19.073 830 1HB LEU 16 1HB LEU 106 -3.415 13.897 18.082 831 2HB LEU 16 2HB LEU 106 -2.875 15.153 16.986 832 HG LEU 16 HG LEU 106 -1.067 13.985 16.237 833 1HD1 LEU 16 2HD1 LEU 106 -0.265 12.875 18.374 834 2HD1 LEU 16 3HD1 LEU 106 -1.582 11.691 18.118 835 3HD1 LEU 16 1HD1 LEU 106 -0.199 11.851 16.940 836 1HD2 LEU 16 2HD2 LEU 106 -2.644 13.460 14.847 837 2HD2 LEU 16 3HD2 LEU 106 -1.254 12.347 14.961 838 3HD2 LEU 16 1HD2 LEU 106 -2.787 11.860 15.665 839 H SER 17 H SER 107 -2.187 12.897 19.509 840 HA SER 17 HA SER 107 -0.836 12.797 22.258 841 1HB SER 17 1HB SER 107 -3.652 11.673 21.900 842 2HB SER 17 2HB SER 107 -2.652 11.589 23.333 843 HG SER 17 HG SER 107 -3.532 13.983 22.104 844 H LYS 18 H LYS 108 -0.432 10.695 23.029 845 HA LYS 18 HA LYS 108 0.613 8.688 21.054 846 1HB LYS 18 1HB LYS 108 1.554 9.152 23.464 847 2HB LYS 18 2HB LYS 108 0.125 8.375 24.094 848 1HG LYS 18 1HG LYS 108 1.643 6.653 24.202 849 2HG LYS 18 2HG LYS 108 0.863 6.255 22.681 850 1HD LYS 18 1HD LYS 108 2.820 7.375 21.437 851 2HD LYS 18 2HD LYS 108 3.518 7.816 22.982 852 1HE LYS 18 1HE LYS 108 4.731 5.885 22.272 853 2HE LYS 18 2HE LYS 108 3.726 5.352 23.612 854 1HZ LYS 18 1HZ LYS 108 2.148 4.467 21.965 855 2HZ LYS 18 2HZ LYS 108 3.098 4.968 20.732 856 H LYS 19 H LYS 109 -2.122 8.764 23.285 857 HA LYS 19 HA LYS 109 -3.568 6.404 22.252 858 1HB LYS 19 2HB LYS 109 -4.656 8.873 23.734 859 2HB LYS 19 1HB LYS 109 -5.655 7.479 23.301 860 1HG LYS 19 1HG LYS 109 -4.185 5.970 24.681 861 2HG LYS 19 2HG LYS 109 -3.190 7.353 25.147 862 1HD LYS 19 1HD LYS 109 -5.203 8.462 26.198 863 2HD LYS 19 2HD LYS 109 -6.211 7.089 25.729 864 1HE LYS 19 1HE LYS 109 -4.790 5.546 27.164 865 2HE LYS 19 2HE LYS 109 -3.770 6.915 27.631 866 1HZ LYS 19 1HZ LYS 109 -5.480 6.433 29.258 867 2HZ LYS 19 2HZ LYS 109 -6.678 6.659 28.169 868 H ASP 20 H ASP 110 -3.616 9.897 21.181 869 HA ASP 20 HA ASP 110 -5.832 9.348 19.211 870 1HB ASP 20 1HB ASP 110 -3.988 11.779 19.598 871 2HB ASP 20 2HB ASP 110 -4.967 11.641 18.162 872 HD1 ASP 20 HD2 ASP 110 -8.044 12.167 19.624 873 H ALA 21 H ALA 111 -2.323 9.241 19.052 874 HA ALA 21 HA ALA 111 -2.193 8.826 16.108 875 1HB ALA 21 1HB ALA 111 -0.126 8.668 18.380 876 2HB ALA 21 2HB ALA 111 0.249 8.259 16.676 877 3HB ALA 21 3HB ALA 111 -0.315 9.847 17.108 878 H THR 22 H THR 112 -2.155 6.564 18.941 879 HA THR 22 HA THR 112 -2.031 4.077 17.507 880 HB THR 22 HB THR 112 -3.766 4.548 20.029 881 HG1 THR 22 HG1 THR 112 -1.915 4.247 21.221 882 1HG2 THR 22 3HG2 THR 112 -2.017 2.218 19.031 883 2HG2 THR 22 1HG2 THR 112 -2.751 2.302 20.657 884 3HG2 THR 22 2HG2 THR 112 -3.788 2.241 19.187 885 H LYS 23 H LYS 113 -4.838 5.934 18.395 886 HA LYS 23 HA LYS 113 -6.904 4.313 17.057 887 1HB LYS 23 2HB LYS 113 -6.582 7.357 17.737 888 2HB LYS 23 1HB LYS 113 -8.049 6.781 17.048 889 1HG LYS 23 1HG LYS 113 -8.555 5.311 19.013 890 2HG LYS 23 2HG LYS 113 -7.013 5.727 19.756 891 1HD LYS 23 1HD LYS 113 -7.723 8.179 19.811 892 2HD LYS 23 2HD LYS 113 -9.289 7.721 19.138 893 1HE LYS 23 1HE LYS 113 -9.734 6.258 21.169 894 2HE LYS 23 2HE LYS 113 -8.150 6.695 21.832 895 1HZ LYS 23 1HZ LYS 113 -9.916 8.043 22.743 896 2HZ LYS 23 2HZ LYS 113 -10.376 8.573 21.267 897 H ALA 24 H ALA 114 -5.274 7.219 16.035 898 HA ALA 24 HA ALA 114 -6.524 7.561 13.506 899 1HB ALA 24 3HB ALA 114 -3.849 8.545 14.510 900 2HB ALA 24 1HB ALA 114 -4.681 9.142 13.030 901 3HB ALA 24 2HB ALA 114 -5.467 9.327 14.623 902 H VAL 25 H VAL 115 -3.529 5.749 14.162 903 HA VAL 25 HA VAL 115 -3.091 4.730 11.338 904 HB VAL 25 HB VAL 115 -2.451 4.069 14.395 905 1HG1 VAL 25 2HG2 VAL 115 -1.641 2.124 12.160 906 2HG1 VAL 25 3HG2 VAL 115 -1.041 2.099 13.857 907 3HG1 VAL 25 1HG2 VAL 115 -2.736 1.800 13.514 908 1HG2 VAL 25 1HG1 VAL 115 -1.064 5.808 13.267 909 2HG2 VAL 25 2HG1 VAL 115 -0.121 4.442 13.874 910 3HG2 VAL 25 3HG1 VAL 115 -0.455 4.578 12.119 911 H ASP 26 H ASP 116 -4.699 3.182 14.230 912 HA ASP 26 HA ASP 116 -6.207 1.296 12.432 913 1HB ASP 26 1HB ASP 116 -5.365 0.941 14.896 914 2HB ASP 26 2HB ASP 116 -6.760 1.898 15.389 915 HD1 ASP 26 HD2 ASP 116 -7.088 -1.905 13.933 916 H ALA 27 H ALA 117 -6.573 4.124 12.326 917 HA ALA 27 HA ALA 117 -9.583 4.422 11.920 918 1HB ALA 27 2HB ALA 117 -8.549 6.225 13.337 919 2HB ALA 27 3HB ALA 117 -7.519 6.616 11.943 920 3HB ALA 27 1HB ALA 117 -9.250 6.741 11.799 921 H VAL 28 H VAL 118 -6.496 5.099 10.356 922 HA VAL 28 HA VAL 118 -7.477 5.321 7.580 923 HB VAL 28 HB VAL 118 -4.651 4.212 8.353 924 1HG1 VAL 28 1HG2 VAL 118 -6.012 5.094 5.847 925 2HG1 VAL 28 2HG2 VAL 118 -4.378 5.708 6.050 926 3HG1 VAL 28 3HG2 VAL 118 -4.631 3.957 6.168 927 1HG2 VAL 28 3HG1 VAL 118 -5.402 7.088 8.207 928 2HG2 VAL 28 1HG1 VAL 118 -4.532 6.108 9.469 929 3HG2 VAL 28 2HG1 VAL 118 -3.730 6.424 7.931 930 H PHE 29 H PHE 119 -5.664 2.839 9.186 931 HA PHE 29 HA PHE 119 -6.124 0.631 7.320 932 1HB PHE 29 2HB PHE 119 -4.928 0.523 10.132 933 2HB PHE 29 1HB PHE 119 -4.763 -0.719 8.903 934 HD1 PHE 29 HD1 PHE 119 -4.060 0.486 6.420 935 HD2 PHE 29 HD2 PHE 119 -2.835 1.684 10.351 936 HE1 PHE 29 HE1 PHE 119 -2.249 1.810 5.441 937 HE2 PHE 29 HE2 PHE 119 -1.021 3.020 9.367 938 HZ PHE 29 HZ PHE 119 -0.814 3.146 6.875 939 H ASP 30 H ASP 120 -8.195 1.655 9.872 940 HA ASP 30 HA ASP 120 -9.574 -1.016 9.970 941 1HB ASP 30 1HB ASP 120 -9.476 0.775 11.867 942 2HB ASP 30 2HB ASP 120 -10.703 1.672 11.009 943 HD2 ASP 30 HD2 ASP 120 -13.328 -0.237 12.070 944 H SER 31 H SER 121 -10.030 2.073 8.498 945 HA SER 31 HA SER 121 -12.609 1.439 7.068 946 1HB SER 31 2HB SER 121 -10.639 3.744 6.534 947 2HB SER 31 1HB SER 121 -12.239 3.550 5.785 948 HG SER 31 HG SER 121 -11.698 3.765 8.560 949 H ILE 32 H ILE 122 -9.046 1.280 6.021 950 HA ILE 32 HA ILE 122 -9.437 0.353 3.415 951 HB ILE 32 HB ILE 122 -7.155 -0.498 5.174 952 1HG1 ILE 32 1HG1 ILE 122 -7.991 2.247 4.362 953 2HG1 ILE 32 2HG1 ILE 122 -7.274 1.540 5.793 954 1HG2 ILE 32 3HG2 ILE 122 -7.632 -1.242 2.626 955 2HG2 ILE 32 1HG2 ILE 122 -7.134 0.372 2.230 956 3HG2 ILE 32 2HG2 ILE 122 -5.992 -0.684 3.043 957 1HD1 ILE 32 2HD1 ILE 122 -5.635 2.065 3.337 958 2HD1 ILE 32 3HD1 ILE 122 -5.993 3.252 4.620 959 3HD1 ILE 32 1HD1 ILE 122 -5.110 1.757 5.052 960 H THR 33 H THR 123 -8.845 -1.549 6.366 961 HA THR 33 HA THR 123 -9.241 -4.146 4.991 962 HB THR 33 HB THR 123 -8.125 -4.138 7.184 963 HG1 THR 33 HG1 THR 123 -10.565 -5.518 7.384 964 1HG2 THR 33 3HG2 THR 123 -9.551 -2.263 8.194 965 2HG2 THR 33 1HG2 THR 123 -10.747 -3.458 8.629 966 3HG2 THR 33 2HG2 THR 123 -9.074 -3.539 9.311 967 H GLU 34 H GLU 124 -11.648 -1.962 6.315 968 HA GLU 34 HA GLU 124 -13.938 -3.857 5.826 969 1HB GLU 34 1HB GLU 124 -13.770 -0.880 6.606 970 2HB GLU 34 2HB GLU 124 -15.214 -1.431 5.809 971 1HG GLU 34 1HG GLU 124 -15.669 -1.520 8.136 972 2HG GLU 34 2HG GLU 124 -15.648 -3.159 7.530 973 HE2 GLU 34 HE2 GLU 124 -13.194 -1.960 10.452 974 H ALA 35 H ALA 125 -12.253 -1.370 3.934 975 HA ALA 35 HA ALA 125 -13.932 -1.690 1.552 976 1HB ALA 35 2HB ALA 125 -12.035 0.289 1.854 977 2HB ALA 35 3HB ALA 125 -10.851 -0.960 1.580 978 3HB ALA 35 1HB ALA 125 -11.926 -0.539 0.297 979 H LEU 36 H LEU 126 -10.771 -3.191 2.394 980 HA LEU 36 HA LEU 126 -10.544 -4.908 0.079 981 1HB LEU 36 2HB LEU 126 -9.280 -5.380 2.712 982 2HB LEU 36 1HB LEU 126 -8.723 -5.873 1.131 983 HG LEU 36 HG LEU 126 -8.691 -3.017 2.174 984 1HD1 LEU 36 3HD2 LEU 126 -6.689 -4.203 2.615 985 2HD1 LEU 36 1HD2 LEU 126 -6.502 -4.615 0.849 986 3HD1 LEU 36 2HD2 LEU 126 -6.400 -2.918 1.418 987 1HD2 LEU 36 2HD1 LEU 126 -8.297 -3.734 -0.779 988 2HD2 LEU 36 3HD1 LEU 126 -9.633 -2.752 -0.112 989 3HD2 LEU 36 1HD1 LEU 126 -8.000 -2.127 -0.024 990 NH1 ARG 37 NH2 ARG 127 -17.297 -7.385 6.816 991 NH2 ARG 37 NH1 ARG 127 -17.440 -5.408 7.925 992 H ARG 37 H ARG 127 -11.806 -5.615 3.400 993 HA ARG 37 HA ARG 127 -12.288 -8.342 2.666 994 1HB ARG 37 1HB ARG 127 -13.379 -8.786 4.704 995 2HB ARG 37 2HB ARG 127 -12.148 -7.606 5.096 996 1HG ARG 37 1HG ARG 127 -14.012 -5.792 4.971 997 2HG ARG 37 2HG ARG 127 -15.176 -7.086 4.738 998 1HD ARG 37 1HD ARG 127 -14.638 -8.110 6.894 999 2HD ARG 37 2HD ARG 127 -13.384 -6.881 7.182 1000 1HH1 ARG 37 2HH2 ARG 127 -16.694 -8.084 6.368 1001 2HH1 ARG 37 1HH2 ARG 127 -18.319 -7.418 6.900 1002 1HH2 ARG 37 1HH1 ARG 127 -16.951 -4.600 8.326 1003 2HH2 ARG 37 2HH1 ARG 127 -18.451 -5.580 7.932 1004 H LYS 38 H LYS 128 -14.143 -5.389 2.076 1005 HA LYS 38 HA LYS 128 -16.666 -7.000 1.513 1006 1HB LYS 38 1HB LYS 128 -16.464 -3.991 1.983 1007 2HB LYS 38 2HB LYS 128 -17.916 -4.816 1.468 1008 1HG LYS 38 1HG LYS 128 -17.883 -6.266 3.526 1009 2HG LYS 38 2HG LYS 128 -16.502 -5.371 4.137 1010 1HD LYS 38 1HD LYS 128 -19.216 -4.069 3.459 1011 2HD LYS 38 2HD LYS 128 -18.795 -4.711 5.042 1012 1HE LYS 38 1HE LYS 128 -16.848 -3.108 5.216 1013 2HE LYS 38 2HE LYS 128 -17.264 -2.416 3.641 1014 1HZ LYS 38 1HZ LYS 128 -19.055 -2.454 6.008 1015 2HZ LYS 38 2HZ LYS 128 -19.429 -1.802 4.556 1016 H GLY 39 H GLY 129 -14.137 -6.339 -0.340 1017 1HA GLY 39 1HA GLY 129 -13.844 -6.138 -2.718 1018 2HA GLY 39 2HA GLY 129 -15.571 -6.281 -2.918 1019 H ASP 40 H ASP 130 -13.879 -3.725 -1.150 1020 HA ASP 40 HA ASP 130 -14.740 -1.619 -3.182 1021 1HB ASP 40 1HB ASP 130 -14.195 -0.911 -0.328 1022 2HB ASP 40 2HB ASP 130 -14.911 0.055 -1.568 1023 HD1 ASP 40 HD2 ASP 130 -18.084 -1.381 -1.415 1024 H LYS 41 H LYS 131 -13.466 -0.138 -3.985 1025 HA LYS 41 HA LYS 131 -10.490 -0.555 -3.734 1026 1HB LYS 41 2HB LYS 131 -11.794 1.584 -5.447 1027 2HB LYS 41 1HB LYS 131 -10.126 1.028 -5.516 1028 1HG LYS 41 1HG LYS 131 -11.005 -1.268 -6.298 1029 2HG LYS 41 2HG LYS 131 -12.616 -0.559 -6.395 1030 1HD LYS 41 1HD LYS 131 -11.745 1.198 -7.997 1031 2HD LYS 41 2HD LYS 131 -10.137 0.497 -7.927 1032 1HE LYS 41 1HE LYS 131 -12.657 -0.978 -8.962 1033 2HE LYS 41 2HE LYS 131 -11.501 -0.121 -9.980 1034 1HZ LYS 41 1HZ LYS 131 -10.825 -2.441 -8.260 1035 2HZ LYS 41 2HZ LYS 131 -9.762 -1.627 -9.198 1036 H VAL 42 H VAL 132 -9.346 0.623 -2.279 1037 HA VAL 42 HA VAL 132 -10.248 3.090 -1.059 1038 HB VAL 42 HB VAL 132 -7.786 1.232 -0.864 1039 1HG1 VAL 42 3HG2 VAL 132 -7.348 3.399 0.126 1040 2HG1 VAL 42 1HG2 VAL 132 -8.865 3.231 1.135 1041 3HG1 VAL 42 2HG2 VAL 132 -7.471 2.123 1.363 1042 1HG2 VAL 42 1HG1 VAL 132 -10.300 1.446 0.877 1043 2HG2 VAL 42 2HG1 VAL 132 -9.845 0.060 -0.198 1044 3HG2 VAL 42 3HG1 VAL 132 -8.910 0.405 1.252 1045 H GLN 43 H GLN 133 -9.247 4.741 -1.330 1046 HA GLN 43 HA GLN 133 -7.253 5.262 -3.629 1047 1HB GLN 43 1HB GLN 133 -9.616 6.988 -3.640 1048 2HB GLN 43 2HB GLN 133 -8.318 6.927 -4.787 1049 1HG GLN 43 1HG GLN 133 -10.468 4.759 -4.273 1050 2HG GLN 43 2HG GLN 133 -10.578 6.026 -5.460 1051 1HE2 GLN 43 2HE2 GLN 133 -9.300 3.671 -7.831 1052 2HE2 GLN 43 1HE2 GLN 133 -10.592 4.876 -7.345 1053 H LEU 44 H LEU 134 -5.466 6.014 -2.920 1054 HA LEU 44 HA LEU 134 -5.558 8.523 -1.203 1055 1HB LEU 44 2HB LEU 134 -3.154 6.798 -0.712 1056 2HB LEU 44 1HB LEU 134 -3.885 8.028 0.297 1057 HG LEU 44 HG LEU 134 -4.784 5.097 -0.036 1058 1HD1 LEU 44 2HD1 LEU 134 -3.388 6.541 2.292 1059 2HD1 LEU 44 3HD1 LEU 134 -3.961 4.856 2.316 1060 3HD1 LEU 44 1HD1 LEU 134 -2.673 5.338 1.197 1061 1HD2 LEU 44 1HD2 LEU 134 -6.346 7.315 1.239 1062 2HD2 LEU 44 2HD2 LEU 134 -6.855 5.741 0.619 1063 3HD2 LEU 44 3HD2 LEU 134 -6.158 5.841 2.227 1064 H ILE 45 H ILE 135 -5.007 9.928 -2.811 1065 HA ILE 45 HA ILE 135 -3.587 9.033 -5.121 1066 HB ILE 45 HB ILE 135 -5.477 10.573 -5.220 1067 1HG1 ILE 45 1HG1 ILE 135 -4.051 10.202 -7.210 1068 2HG1 ILE 45 2HG1 ILE 135 -5.043 11.648 -7.187 1069 1HG2 ILE 45 3HG2 ILE 135 -4.901 12.141 -3.402 1070 2HG2 ILE 45 1HG2 ILE 135 -3.581 12.828 -4.377 1071 3HG2 ILE 45 2HG2 ILE 135 -5.276 12.997 -4.915 1072 1HD1 ILE 45 2HD1 ILE 135 -3.003 13.079 -6.740 1073 2HD1 ILE 45 3HD1 ILE 135 -1.977 11.625 -6.813 1074 3HD1 ILE 45 1HD1 ILE 135 -2.883 12.144 -8.244 1075 H GLY 46 H GLY 136 -2.466 11.034 -3.034 1076 1HA GLY 46 1HA GLY 136 0.312 11.444 -4.258 1077 2HA GLY 46 2HA GLY 136 -0.122 12.018 -2.667 1078 H PHE 47 H PHE 137 -0.891 8.716 -2.673 1079 HA PHE 47 HA PHE 137 1.897 7.746 -2.027 1080 1HB PHE 47 2HB PHE 137 0.634 8.866 -0.087 1081 2HB PHE 47 1HB PHE 137 -0.547 7.595 -0.110 1082 HD1 PHE 47 HD2 PHE 137 3.131 8.232 0.483 1083 HD2 PHE 47 HD1 PHE 137 -0.019 5.297 0.663 1084 HE1 PHE 47 HE2 PHE 137 4.668 6.582 1.499 1085 HE2 PHE 47 HE1 PHE 137 1.571 3.667 1.580 1086 HZ PHE 47 HZ PHE 137 3.947 4.303 1.887 1087 H GLY 48 H GLY 138 -1.556 6.625 -2.342 1088 1HA GLY 48 1HA GLY 138 -0.682 4.061 -3.351 1089 2HA GLY 48 2HA GLY 138 -1.052 3.881 -1.656 1090 H ASN 49 H ASN 139 -2.267 3.004 -4.341 1091 HA ASN 49 HA ASN 139 -5.199 3.554 -3.549 1092 1HB ASN 49 1HB ASN 139 -4.069 3.107 -6.368 1093 2HB ASN 49 2HB ASN 139 -5.760 3.018 -5.957 1094 1HD2 ASN 49 1HD2 ASN 139 -5.898 6.509 -6.796 1095 2HD2 ASN 49 2HD2 ASN 139 -6.507 4.799 -7.059 1096 H PHE 50 H PHE 140 -5.624 1.859 -2.273 1097 HA PHE 50 HA PHE 140 -4.551 -0.910 -2.854 1098 1HB PHE 50 2HB PHE 140 -6.477 -0.236 -0.563 1099 2HB PHE 50 1HB PHE 140 -5.773 -1.743 -0.814 1100 HD1 PHE 50 HD2 PHE 140 -5.099 1.834 -0.063 1101 HD2 PHE 50 HD1 PHE 140 -4.004 -2.257 0.631 1102 HE1 PHE 50 HE2 PHE 140 -3.590 2.539 1.784 1103 HE2 PHE 50 HE1 PHE 140 -2.530 -1.521 2.484 1104 HZ PHE 50 HZ PHE 140 -2.232 0.873 2.903 1105 H GLU 51 H GLU 141 -5.920 -2.656 -3.151 1106 HA GLU 51 HA GLU 141 -8.742 -2.549 -3.160 1107 1HB GLU 51 1HB GLU 141 -9.399 -2.763 -5.577 1108 2HB GLU 51 2HB GLU 141 -8.741 -1.187 -5.262 1109 1HG GLU 51 1HG GLU 141 -7.146 -3.457 -6.629 1110 2HG GLU 51 2HG GLU 141 -8.098 -2.260 -7.483 1111 HE2 GLU 51 HE2 GLU 141 -4.403 -1.422 -6.319 1112 H VAL 52 H VAL 142 -9.799 -4.611 -3.477 1113 HA VAL 52 HA VAL 142 -7.834 -6.769 -3.196 1114 HB VAL 52 HB VAL 142 -10.189 -5.773 -1.858 1115 1HG1 VAL 52 1HG2 VAL 142 -11.005 -8.257 -3.354 1116 2HG1 VAL 52 2HG2 VAL 142 -11.869 -7.478 -1.974 1117 3HG1 VAL 52 3HG2 VAL 142 -11.663 -6.610 -3.526 1118 1HG2 VAL 52 2HG1 VAL 142 -8.835 -8.458 -1.517 1119 2HG2 VAL 52 3HG1 VAL 142 -8.372 -6.888 -0.792 1120 3HG2 VAL 52 1HG1 VAL 142 -9.897 -7.643 -0.370 1121 NH1 ARG 53 NH2 ARG 143 -5.302 -14.378 -8.158 1122 NH2 ARG 53 NH1 ARG 143 -6.881 -14.968 -6.631 1123 H ARG 53 H ARG 143 -8.160 -8.800 -4.308 1124 HA ARG 53 HA ARG 143 -9.114 -8.462 -7.226 1125 1HB ARG 53 1HB ARG 143 -6.630 -8.951 -6.902 1126 2HB ARG 53 2HB ARG 143 -7.069 -10.405 -6.047 1127 1HG ARG 53 1HG ARG 143 -8.492 -10.844 -8.414 1128 2HG ARG 53 2HG ARG 143 -7.241 -9.781 -9.007 1129 1HD ARG 53 1HD ARG 143 -6.447 -12.020 -9.351 1130 2HD ARG 53 2HD ARG 143 -5.474 -11.387 -8.016 1131 1HH1 ARG 53 2HH2 ARG 143 -4.921 -13.647 -8.769 1132 2HH1 ARG 53 1HH2 ARG 143 -4.952 -15.337 -8.054 1133 1HH2 ARG 53 1HH1 ARG 143 -7.699 -14.691 -6.078 1134 2HH2 ARG 53 2HH1 ARG 143 -6.422 -15.886 -6.632 1135 H GLU 54 H GLU 144 -11.209 -8.699 -6.455 1136 HA GLU 54 HA GLU 144 -11.993 -10.587 -4.477 1137 1HB GLU 54 1HB GLU 144 -14.252 -9.875 -4.676 1138 2HB GLU 54 2HB GLU 144 -13.112 -8.556 -4.611 1139 1HG GLU 54 1HG GLU 144 -13.368 -8.287 -7.174 1140 2HG GLU 54 2HG GLU 144 -14.630 -9.515 -7.116 1141 HE1 GLU 54 HE2 GLU 144 -15.228 -5.772 -5.656 1142 NH1 ARG 55 NH2 ARG 145 -16.598 -14.425 -1.241 1143 NH2 ARG 55 NH1 ARG 145 -14.901 -14.595 0.260 1144 H ARG 55 H ARG 145 -11.757 -12.846 -4.966 1145 HA ARG 55 HA ARG 145 -12.470 -14.425 -6.499 1146 1HB ARG 55 1HB ARG 145 -11.940 -15.079 -4.395 1147 2HB ARG 55 2HB ARG 145 -13.096 -14.190 -3.505 1148 1HG ARG 55 1HG ARG 145 -14.066 -16.681 -4.990 1149 2HG ARG 55 2HG ARG 145 -13.058 -16.878 -3.581 1150 1HD ARG 55 1HD ARG 145 -15.697 -15.282 -3.609 1151 2HD ARG 55 2HD ARG 145 -15.546 -16.965 -3.112 1152 1HH1 ARG 55 2HH2 ARG 145 -16.954 -14.660 -2.175 1153 2HH1 ARG 55 1HH2 ARG 145 -17.080 -13.877 -0.520 1154 1HH2 ARG 55 1HH1 ARG 145 -13.964 -14.955 0.474 1155 2HH2 ARG 55 2HH1 ARG 145 -15.499 -14.035 0.877 1156 H ALA 56 H ALA 146 -13.725 -15.080 -7.875 1157 HA ALA 56 HA ALA 146 -16.447 -16.077 -7.189 1158 1HB ALA 56 3HB ALA 146 -16.720 -13.803 -8.379 1159 2HB ALA 56 1HB ALA 146 -15.724 -14.406 -9.728 1160 3HB ALA 56 2HB ALA 146 -17.326 -15.127 -9.406 1161 H ALA 57 H ALA 147 -13.869 -17.416 -7.448 1162 HA ALA 57 HA ALA 147 -12.597 -18.892 -8.782 1163 1HB ALA 57 1HB ALA 147 -13.945 -20.144 -7.185 1164 2HB ALA 57 2HB ALA 147 -15.253 -20.348 -8.384 1165 3HB ALA 57 3HB ALA 147 -13.651 -21.116 -8.644 1166 NH1 ARG 58 NH2 ARG 148 -9.448 -15.046 -9.127 1167 NH2 ARG 58 NH1 ARG 148 -10.320 -13.058 -8.466 1168 H ARG 58 H ARG 148 -11.787 -18.394 -10.526 1169 HA ARG 58 HA ARG 148 -13.581 -17.801 -12.750 1170 1HB ARG 58 2HB ARG 148 -10.595 -17.215 -12.827 1171 2HB ARG 58 1HB ARG 148 -11.868 -16.390 -13.705 1172 1HG ARG 58 1HG ARG 148 -12.707 -15.419 -11.531 1173 2HG ARG 58 2HG ARG 148 -11.449 -16.302 -10.664 1174 1HD ARG 58 1HD ARG 148 -9.648 -15.032 -11.928 1175 2HD ARG 58 2HD ARG 148 -10.907 -14.073 -12.702 1176 1HH1 ARG 58 2HH2 ARG 148 -9.336 -15.734 -9.880 1177 2HH1 ARG 58 1HH2 ARG 148 -9.072 -15.111 -8.175 1178 1HH2 ARG 58 1HH1 ARG 148 -10.874 -12.228 -8.708 1179 2HH2 ARG 58 2HH1 ARG 148 -9.884 -13.263 -7.560 1180 H LYS 59 H LYS 149 -12.093 -18.014 -15.030 1181 HA LYS 59 HA LYS 149 -10.954 -20.748 -15.374 1182 1HB LYS 59 1HB LYS 149 -13.411 -21.208 -15.627 1183 2HB LYS 59 2HB LYS 149 -13.503 -20.082 -16.976 1184 1HG LYS 59 1HG LYS 149 -11.920 -21.498 -18.306 1185 2HG LYS 59 2HG LYS 149 -11.647 -22.560 -16.924 1186 1HD LYS 59 1HD LYS 149 -14.042 -23.258 -16.922 1187 2HD LYS 59 2HD LYS 149 -14.416 -22.177 -18.254 1188 1HE LYS 59 1HE LYS 149 -12.368 -24.500 -18.461 1189 2HE LYS 59 2HE LYS 149 -14.083 -24.674 -18.829 1190 1HZ LYS 59 1HZ LYS 149 -12.218 -22.838 -20.216 1191 2HZ LYS 59 2HZ LYS 149 -12.790 -24.254 -20.799 1192 H GLY 60 H GLY 150 -9.130 -20.086 -16.227 1193 1HA GLY 60 1HA GLY 150 -9.043 -17.639 -18.116 1194 2HA GLY 60 2HA GLY 150 -7.765 -18.092 -17.018 1195 NH1 ARG 61 NH2 ARG 151 -3.099 -19.372 -25.226 1196 NH2 ARG 61 NH1 ARG 151 -3.808 -20.941 -26.711 1197 H ARG 61 H ARG 151 -6.155 -18.500 -18.346 1198 HA ARG 61 HA ARG 151 -6.178 -20.893 -20.112 1199 1HB ARG 61 1HB ARG 151 -7.097 -19.024 -21.614 1200 2HB ARG 61 2HB ARG 151 -5.551 -18.196 -21.472 1201 1HG ARG 61 1HG ARG 151 -4.408 -20.212 -22.525 1202 2HG ARG 61 2HG ARG 151 -5.957 -21.056 -22.597 1203 1HD ARG 61 1HD ARG 151 -6.876 -19.257 -24.118 1204 2HD ARG 61 2HD ARG 151 -5.359 -18.376 -24.045 1205 1HH1 ARG 61 2HH2 ARG 151 -3.327 -18.778 -24.421 1206 2HH1 ARG 61 1HH2 ARG 151 -2.200 -19.424 -25.717 1207 1HH2 ARG 61 1HH1 ARG 151 -4.572 -21.541 -27.040 1208 2HH2 ARG 61 2HH1 ARG 151 -2.860 -20.883 -27.099 1209 H ASN 62 H ASN 152 -4.269 -21.817 -20.090 1210 HA ASN 62 HA ASN 152 -2.124 -20.809 -18.370 1211 1HB ASN 62 1HB ASN 152 -2.853 -23.243 -18.653 1212 2HB ASN 62 2HB ASN 152 -2.070 -23.261 -20.224 1213 1HD2 ASN 62 2HD2 ASN 152 0.247 -23.831 -16.967 1214 2HD2 ASN 62 1HD2 ASN 152 -1.558 -23.525 -16.840 1215 HA PRO 63 HA PRO 153 0.060 -18.545 -21.727 1216 1HB PRO 63 1HB PRO 153 2.478 -17.939 -20.488 1217 2HB PRO 63 2HB PRO 153 0.928 -17.176 -20.107 1218 1HG PRO 63 1HG PRO 153 2.265 -19.504 -18.638 1219 2HG PRO 63 2HG PRO 153 1.583 -18.018 -17.934 1220 1HD PRO 63 1HD PRO 153 0.157 -20.375 -18.003 1221 2HD PRO 63 2HD PRO 153 -0.680 -18.807 -18.213 1222 H GLN 64 H GLN 154 1.646 -21.506 -20.486 1223 HA GLN 64 HA GLN 154 3.601 -21.565 -22.818 1224 1HB GLN 64 1HB GLN 154 3.319 -23.568 -20.500 1225 2HB GLN 64 2HB GLN 154 4.569 -23.571 -21.719 1226 1HG GLN 64 1HG GLN 154 4.156 -21.363 -19.593 1227 2HG GLN 64 2HG GLN 154 5.159 -22.793 -19.442 1228 1HE2 GLN 64 2HE2 GLN 154 7.880 -21.303 -21.318 1229 2HE2 GLN 64 1HE2 GLN 154 7.224 -22.757 -20.411 1230 H THR 65 H THR 155 1.668 -24.018 -21.247 1231 HA THR 65 HA THR 155 1.173 -25.663 -23.520 1232 HB THR 65 HB THR 155 -0.437 -26.946 -22.247 1233 HG1 THR 65 HG1 THR 155 -0.403 -24.818 -20.390 1234 1HG2 THR 65 2HG2 THR 155 1.993 -27.165 -21.533 1235 2HG2 THR 65 3HG2 THR 155 1.714 -25.931 -20.280 1236 3HG2 THR 65 1HG2 THR 155 0.843 -27.478 -20.200 1237 H GLY 66 H GLY 156 -1.057 -23.125 -22.391 1238 1HA GLY 66 1HA GLY 156 -2.777 -22.011 -23.652 1239 2HA GLY 66 2HA GLY 156 -2.444 -23.023 -25.040 1240 H GLU 67 H GLU 157 -3.309 -24.180 -21.776 1241 HA GLU 67 HA GLU 157 -5.938 -25.325 -22.845 1242 1HB GLU 67 2HB GLU 157 -4.057 -26.886 -22.011 1243 2HB GLU 67 1HB GLU 157 -4.307 -26.233 -20.386 1244 1HG GLU 67 1HG GLU 157 -6.734 -27.033 -20.486 1245 2HG GLU 67 2HG GLU 157 -6.441 -27.690 -22.094 1246 HE1 GLU 67 HE2 GLU 157 -4.595 -30.431 -21.017 1247 H GLU 68 H GLU 158 -7.759 -24.741 -21.843 1248 HA GLU 68 HA GLU 158 -7.700 -22.369 -20.046 1249 1HB GLU 68 1HB GLU 158 -10.149 -23.846 -21.163 1250 2HB GLU 68 2HB GLU 158 -10.210 -22.407 -20.152 1251 1HG GLU 68 1HG GLU 158 -8.808 -21.150 -21.915 1252 2HG GLU 68 2HG GLU 158 -8.928 -22.564 -22.953 1253 HE1 GLU 68 HE2 GLU 158 -12.063 -20.081 -22.354 1254 H MET 69 H MET 159 -7.383 -22.581 -17.979 1255 HA MET 69 HA MET 159 -8.369 -25.056 -16.477 1256 1HB MET 69 1HB MET 159 -6.508 -25.059 -15.102 1257 2HB MET 69 2HB MET 159 -5.868 -24.830 -16.706 1258 1HG MET 69 1HG MET 159 -6.104 -22.697 -14.486 1259 2HG MET 69 2HG MET 159 -4.627 -23.491 -15.030 1260 1HE MET 69 3HE MET 159 -4.960 -20.400 -14.708 1261 2HE MET 69 2HE MET 159 -5.198 -19.461 -16.213 1262 3HE MET 69 1HE MET 159 -6.597 -20.197 -15.392 1263 H GLU 70 H GLU 160 -9.431 -24.876 -14.643 1264 HA GLU 70 HA GLU 160 -10.808 -22.397 -13.922 1265 1HB GLU 70 2HB GLU 160 -11.996 -23.529 -12.239 1266 2HB GLU 70 1HB GLU 160 -11.975 -24.533 -13.675 1267 1HG GLU 70 1HG GLU 160 -10.316 -24.995 -11.104 1268 2HG GLU 70 2HG GLU 160 -11.810 -25.801 -11.521 1269 HE1 GLU 70 HE2 GLU 160 -10.449 -27.978 -13.864 1270 H ILE 71 H ILE 161 -10.179 -20.773 -12.569 1271 HA ILE 71 HA ILE 161 -7.565 -20.969 -11.176 1272 HB ILE 71 HB ILE 161 -9.483 -18.644 -11.778 1273 1HG1 ILE 71 1HG1 ILE 161 -6.758 -19.383 -13.063 1274 2HG1 ILE 71 2HG1 ILE 161 -8.301 -19.728 -13.814 1275 1HG2 ILE 71 2HG2 ILE 161 -8.145 -18.145 -9.767 1276 2HG2 ILE 71 3HG2 ILE 161 -6.637 -18.533 -10.653 1277 3HG2 ILE 71 1HG2 ILE 161 -7.653 -17.130 -11.127 1278 1HD1 ILE 71 3HD1 ILE 161 -7.296 -16.863 -13.293 1279 2HD1 ILE 71 1HD1 ILE 161 -7.237 -17.744 -14.823 1280 3HD1 ILE 71 2HD1 ILE 161 -8.810 -17.322 -14.122 1281 HA PRO 72 HA PRO 162 -10.139 -21.490 -7.283 1282 1HB PRO 72 1HB PRO 162 -8.129 -22.165 -5.515 1283 2HB PRO 72 2HB PRO 162 -8.828 -23.280 -6.702 1284 1HG PRO 72 1HG PRO 162 -6.212 -21.713 -6.931 1285 2HG PRO 72 2HG PRO 162 -6.495 -23.426 -7.315 1286 1HD PRO 72 1HD PRO 162 -6.468 -21.416 -9.249 1287 2HD PRO 72 2HD PRO 162 -7.469 -22.889 -9.431 1288 H ALA 73 H ALA 163 -10.831 -19.714 -6.490 1289 HA ALA 73 HA ALA 163 -9.205 -17.139 -6.285 1290 1HB ALA 73 1HB ALA 163 -11.409 -17.195 -7.478 1291 2HB ALA 73 2HB ALA 163 -12.202 -17.508 -5.888 1292 3HB ALA 73 3HB ALA 163 -11.246 -16.042 -6.171 1293 H SER 74 H SER 164 -9.767 -15.762 -4.845 1294 HA SER 74 HA SER 164 -11.102 -15.976 -2.573 1295 1HB SER 74 1HB SER 164 -9.153 -17.337 -1.499 1296 2HB SER 74 2HB SER 164 -8.096 -15.933 -1.672 1297 HG SER 74 HG SER 164 -9.018 -16.092 0.380 1298 H LYS 75 H LYS 165 -11.110 -13.774 -1.283 1299 HA LYS 75 HA LYS 165 -10.477 -11.611 -3.241 1300 1HB LYS 75 2HB LYS 165 -11.208 -10.522 -0.590 1301 2HB LYS 75 1HB LYS 165 -11.502 -9.968 -2.206 1302 1HG LYS 75 1HG LYS 165 -13.245 -11.818 -2.514 1303 2HG LYS 75 2HG LYS 165 -13.038 -12.230 -0.807 1304 1HD LYS 75 1HD LYS 165 -13.692 -9.860 -0.166 1305 2HD LYS 75 2HD LYS 165 -13.870 -9.446 -1.874 1306 1HE LYS 75 1HE LYS 165 -15.701 -11.215 -2.100 1307 2HE LYS 75 2HE LYS 165 -15.547 -11.571 -0.372 1308 1HZ LYS 75 1HZ LYS 165 -17.321 -10.014 -0.835 1309 2HZ LYS 75 2HZ LYS 165 -16.303 -8.953 -1.547 1310 H VAL 76 H VAL 166 -8.362 -10.961 -3.490 1311 HA VAL 76 HA VAL 166 -6.454 -11.509 -1.401 1312 HB VAL 76 HB VAL 166 -7.126 -11.863 -4.297 1313 1HG1 VAL 76 1HG2 VAL 166 -4.299 -11.286 -3.656 1314 2HG1 VAL 76 2HG2 VAL 166 -5.022 -12.016 -5.183 1315 3HG1 VAL 76 3HG2 VAL 166 -5.418 -10.352 -4.706 1316 1HG2 VAL 76 3HG1 VAL 166 -7.110 -13.649 -2.585 1317 2HG2 VAL 76 1HG1 VAL 166 -6.175 -13.950 -4.056 1318 3HG2 VAL 76 2HG1 VAL 166 -5.332 -13.503 -2.522 1319 HA PRO 77 HA PRO 167 -6.161 -6.919 -1.379 1320 1HB PRO 77 1HB PRO 167 -4.588 -6.620 0.914 1321 2HB PRO 77 2HB PRO 167 -6.253 -7.222 0.982 1322 1HG PRO 77 1HG PRO 167 -3.676 -8.875 0.955 1323 2HG PRO 77 2HG PRO 167 -5.042 -9.015 2.075 1324 1HD PRO 77 1HD PRO 167 -4.733 -10.629 -0.297 1325 2HD PRO 77 2HD PRO 167 -6.355 -10.241 0.342 1326 H ALA 78 H ALA 168 -5.102 -5.489 -2.129 1327 HA ALA 78 HA ALA 168 -2.152 -5.734 -2.857 1328 1HB ALA 78 3HB ALA 168 -3.783 -6.633 -4.648 1329 2HB ALA 78 1HB ALA 168 -4.451 -4.996 -4.792 1330 3HB ALA 78 2HB ALA 168 -2.748 -5.294 -5.201 1331 H PHE 79 H PHE 169 -1.391 -3.773 -3.719 1332 HA PHE 79 HA PHE 169 -2.426 -1.094 -2.542 1333 1HB PHE 79 2HB PHE 169 -1.539 -1.733 -0.677 1334 2HB PHE 79 1HB PHE 169 -0.125 -2.522 -1.450 1335 HD1 PHE 79 HD2 PHE 169 -1.483 0.770 -0.367 1336 HD2 PHE 79 HD1 PHE 169 1.880 -1.256 -2.123 1337 HE1 PHE 79 HE2 PHE 169 -0.091 2.768 -0.043 1338 HE2 PHE 79 HE1 PHE 169 3.226 0.786 -1.887 1339 HZ PHE 79 HZ PHE 169 2.236 2.812 -0.879 1340 H LYS 80 H LYS 170 -2.100 0.023 -4.127 1341 HA LYS 80 HA LYS 170 0.048 -0.023 -6.432 1342 1HB LYS 80 2HB LYS 170 -2.390 1.752 -6.120 1343 2HB LYS 80 1HB LYS 170 -1.147 1.936 -7.351 1344 1HG LYS 80 1HG LYS 170 -1.668 -0.305 -8.307 1345 2HG LYS 80 2HG LYS 170 -2.885 -0.595 -7.062 1346 1HD LYS 80 1HD LYS 170 -4.245 1.336 -7.864 1347 2HD LYS 80 2HD LYS 170 -3.020 1.741 -9.074 1348 1HE LYS 80 1HE LYS 170 -3.395 -0.482 -10.223 1349 2HE LYS 80 2HE LYS 170 -4.583 -0.934 -8.992 1350 1HZ LYS 80 1HZ LYS 170 -5.944 0.934 -9.662 1351 2HZ LYS 80 2HZ LYS 170 -5.657 -0.060 -10.928 1352 HA PRO 81 HA PRO 171 2.022 3.172 -3.833 1353 1HB PRO 81 1HB PRO 171 4.140 3.825 -5.457 1354 2HB PRO 81 2HB PRO 171 3.962 2.214 -4.761 1355 1HG PRO 81 1HG PRO 171 3.145 3.122 -7.582 1356 2HG PRO 81 2HG PRO 171 4.209 1.753 -7.157 1357 1HD PRO 81 1HD PRO 171 1.463 1.490 -7.629 1358 2HD PRO 81 2HD PRO 171 2.341 0.413 -6.494 1359 H GLY 82 H GLY 172 -0.386 3.954 -5.163 1360 1HA GLY 82 1HA GLY 172 -1.548 5.606 -6.493 1361 2HA GLY 82 2HA GLY 172 -0.652 6.616 -5.372 1362 H LYS 83 H LYS 173 1.261 5.016 -7.696 1363 HA LYS 83 HA LYS 173 2.612 5.787 -9.528 1364 1HB LYS 83 2HB LYS 173 0.264 7.570 -9.939 1365 2HB LYS 83 1HB LYS 173 1.686 8.447 -10.314 1366 1HG LYS 83 1HG LYS 173 1.039 5.675 -11.534 1367 2HG LYS 83 2HG LYS 173 0.564 7.205 -12.263 1368 1HD LYS 83 1HD LYS 173 2.956 7.924 -12.464 1369 2HD LYS 83 2HD LYS 173 3.497 6.437 -11.686 1370 1HE LYS 83 1HE LYS 173 2.494 5.073 -13.587 1371 2HE LYS 83 2HE LYS 173 1.955 6.566 -14.371 1372 1HZ LYS 83 1HZ LYS 173 4.054 5.772 -15.242 1373 2HZ LYS 83 2HZ LYS 173 4.770 5.838 -13.774 1374 H ALA 84 H ALA 174 1.661 8.206 -7.433 1375 HA ALA 84 HA ALA 174 3.782 10.179 -7.420 1376 1HB ALA 84 2HB ALA 174 1.451 10.396 -6.525 1377 2HB ALA 84 3HB ALA 174 1.775 9.138 -5.303 1378 3HB ALA 84 1HB ALA 174 2.633 10.700 -5.206 1379 H LEU 85 H LEU 175 3.298 7.318 -5.171 1380 HA LEU 85 HA LEU 175 5.828 7.745 -3.754 1381 1HB LEU 85 2HB LEU 175 3.946 6.590 -2.640 1382 2HB LEU 85 1HB LEU 175 3.924 5.360 -3.884 1383 HG LEU 85 HG LEU 175 6.358 4.957 -3.320 1384 1HD1 LEU 85 1HD1 LEU 175 6.845 6.873 -1.842 1385 2HD1 LEU 85 2HD1 LEU 175 5.612 6.328 -0.688 1386 3HD1 LEU 85 3HD1 LEU 175 7.092 5.362 -0.944 1387 1HD2 LEU 85 3HD2 LEU 175 4.456 3.341 -2.783 1388 2HD2 LEU 85 1HD2 LEU 175 5.709 3.264 -1.543 1389 3HD2 LEU 85 2HD2 LEU 175 4.199 4.156 -1.225 1390 H LYS 86 H LYS 176 4.782 5.870 -6.584 1391 HA LYS 86 HA LYS 176 7.276 4.450 -7.080 1392 1HB LYS 86 1HB LYS 176 5.001 4.089 -8.276 1393 2HB LYS 86 2HB LYS 176 5.461 5.384 -9.362 1394 1HG LYS 86 1HG LYS 176 7.492 4.089 -10.072 1395 2HG LYS 86 2HG LYS 176 7.155 2.864 -8.854 1396 1HD LYS 86 1HD LYS 176 6.461 1.971 -10.962 1397 2HD LYS 86 2HD LYS 176 5.013 2.243 -10.001 1398 1HE LYS 86 1HE LYS 176 4.540 4.370 -11.311 1399 2HE LYS 86 2HE LYS 176 6.025 4.137 -12.244 1400 1HZ LYS 86 1HZ LYS 176 4.079 3.324 -13.396 1401 2HZ LYS 86 2HZ LYS 176 3.695 2.298 -12.182 1402 H ASP 87 H ASP 177 6.564 7.890 -7.527 1403 HA ASP 87 HA ASP 177 9.111 8.382 -9.014 1404 1HB ASP 87 1HB ASP 177 6.550 9.691 -8.761 1405 2HB ASP 87 2HB ASP 177 7.558 10.649 -7.755 1406 HD1 ASP 87 HD2 ASP 177 8.025 10.448 -11.806 1407 H ALA 88 H ALA 178 7.866 8.782 -5.676 1408 HA ALA 88 HA ALA 178 10.158 10.060 -4.410 1409 1HB ALA 88 3HB ALA 178 7.938 9.472 -3.186 1410 2HB ALA 88 1HB ALA 178 8.405 7.766 -3.232 1411 3HB ALA 88 2HB ALA 178 9.373 8.887 -2.299 1412 H VAL 89 H VAL 179 9.559 6.584 -5.197 1413 HA VAL 89 HA VAL 179 11.853 5.644 -3.620 1414 HB VAL 89 HB VAL 179 9.196 5.154 -3.646 1415 1HG1 VAL 89 2HG2 VAL 179 9.227 4.754 -6.212 1416 2HG1 VAL 89 3HG2 VAL 179 9.926 3.168 -5.856 1417 3HG1 VAL 89 1HG2 VAL 179 8.337 3.641 -5.170 1418 1HG2 VAL 89 1HG1 VAL 179 10.683 4.045 -2.270 1419 2HG2 VAL 89 2HG1 VAL 179 9.411 2.999 -2.955 1420 3HG2 VAL 89 3HG1 VAL 179 11.100 2.873 -3.595 1421 H LYS 90 H LYS 180 11.289 6.264 -6.985 1422 HA LYS 90 HA LYS 180 12.517 4.089 -8.282 1423 1HB LYS 90 1HB LYS 180 12.455 5.405 -10.229 1424 2HB LYS 90 2HB LYS 180 11.093 5.860 -9.249 1425 1HG LYS 90 1HG LYS 180 12.342 7.959 -8.506 1426 2HG LYS 90 2HG LYS 180 13.658 7.536 -9.596 1427 1HD LYS 90 1HD LYS 180 12.125 7.641 -11.569 1428 2HD LYS 90 2HD LYS 180 10.739 7.945 -10.522 1429 1HE LYS 90 1HE LYS 180 11.776 10.123 -9.743 1430 2HE LYS 90 2HE LYS 180 13.184 9.829 -10.777 1431 1HZ LYS 90 1HZ LYS 180 11.679 9.814 -12.693 1432 2HZ LYS 90 2HZ LYS 180 10.386 10.097 -11.734 Start of MODEL 23 Raw file had 1432 H/Q atoms Start of MODEL 23 1 1H MET 1 1H MET 1 -12.169 6.207 -3.541 2 2H MET 1 2H MET 1 -12.017 5.039 -2.407 3 HA MET 1 HA MET 1 -12.655 7.097 -1.420 4 1HB MET 1 1HB MET 1 -9.844 6.089 -0.632 5 2HB MET 1 2HB MET 1 -10.729 7.260 0.291 6 1HG MET 1 1HG MET 1 -12.706 5.373 0.218 7 2HG MET 1 2HG MET 1 -11.328 4.297 -0.040 8 1HE MET 1 3HE MET 1 -11.075 2.974 2.082 9 2HE MET 1 2HE MET 1 -9.480 3.788 2.186 10 3HE MET 1 1HE MET 1 -10.505 3.673 3.626 11 H ASN 2 H ASN 2 -9.377 8.132 -1.465 12 HA ASN 2 HA ASN 2 -8.752 9.540 -3.483 13 1HB ASN 2 1HB ASN 2 -9.419 11.751 -3.872 14 2HB ASN 2 2HB ASN 2 -10.823 10.735 -3.927 15 1HD2 ASN 2 1HD2 ASN 2 -10.719 13.745 -1.161 16 2HD2 ASN 2 2HD2 ASN 2 -9.207 13.140 -2.011 17 H LYS 3 H LYS 3 -9.232 10.134 -0.216 18 HA LYS 3 HA LYS 3 -6.925 10.124 1.146 19 1HB LYS 3 1HB LYS 3 -5.667 11.645 -0.479 20 2HB LYS 3 2HB LYS 3 -6.849 12.907 -0.232 21 1HG LYS 3 1HG LYS 3 -4.949 13.609 0.965 22 2HG LYS 3 2HG LYS 3 -6.047 13.071 2.204 23 1HD LYS 3 1HD LYS 3 -3.979 12.230 2.890 24 2HD LYS 3 2HD LYS 3 -4.767 10.802 2.211 25 1HE LYS 3 1HE LYS 3 -3.410 11.055 0.097 26 2HE LYS 3 2HE LYS 3 -2.682 12.542 0.717 27 1HZ LYS 3 1HZ LYS 3 -2.407 9.835 1.903 28 2HZ LYS 3 2HZ LYS 3 -1.270 10.624 1.034 29 H THR 4 H THR 4 -9.772 12.151 0.500 30 HA THR 4 HA THR 4 -10.002 13.034 3.269 31 HB THR 4 HB THR 4 -11.420 13.610 0.583 32 HG1 THR 4 HG1 THR 4 -9.567 15.184 2.092 33 1HG2 THR 4 3HG2 THR 4 -11.570 14.840 3.343 34 2HG2 THR 4 1HG2 THR 4 -12.233 15.611 1.819 35 3HG2 THR 4 2HG2 THR 4 -12.867 14.016 2.397 36 H GLU 5 H GLU 5 -11.318 10.753 1.021 37 HA GLU 5 HA GLU 5 -13.755 10.118 2.717 38 1HB GLU 5 1HB GLU 5 -12.614 8.158 0.704 39 2HB GLU 5 2HB GLU 5 -14.187 8.144 1.441 40 1HG GLU 5 1HG GLU 5 -13.154 10.075 -0.710 41 2HG GLU 5 2HG GLU 5 -14.254 8.748 -0.961 42 HE1 GLU 5 HE2 GLU 5 -17.093 10.363 0.247 43 H LEU 6 H LEU 6 -10.237 9.613 2.715 44 HA LEU 6 HA LEU 6 -10.260 7.368 4.560 45 1HB LEU 6 2HB LEU 6 -8.414 8.932 2.784 46 2HB LEU 6 1HB LEU 6 -7.829 9.189 4.375 47 HG LEU 6 HG LEU 6 -6.800 7.232 3.964 48 1HD1 LEU 6 2HD1 LEU 6 -8.132 6.288 5.745 49 2HD1 LEU 6 3HD1 LEU 6 -9.211 5.522 4.550 50 3HD1 LEU 6 1HD1 LEU 6 -7.518 5.048 4.624 51 1HD2 LEU 6 1HD2 LEU 6 -7.403 7.196 1.534 52 2HD2 LEU 6 2HD2 LEU 6 -7.241 5.543 2.157 53 3HD2 LEU 6 3HD2 LEU 6 -8.854 6.255 1.908 54 H ILE 7 H ILE 7 -10.000 10.958 4.700 55 HA ILE 7 HA ILE 7 -9.315 11.148 7.531 56 HB ILE 7 HB ILE 7 -10.816 13.197 5.806 57 1HG1 ILE 7 1HG1 ILE 7 -7.842 13.159 6.544 58 2HG1 ILE 7 2HG1 ILE 7 -8.351 12.309 5.162 59 1HG2 ILE 7 2HG2 ILE 7 -11.013 13.702 8.322 60 2HG2 ILE 7 3HG2 ILE 7 -9.254 13.695 8.417 61 3HG2 ILE 7 1HG2 ILE 7 -10.075 14.929 7.454 62 1HD1 ILE 7 3HD1 ILE 7 -9.491 14.597 4.389 63 2HD1 ILE 7 1HD1 ILE 7 -8.268 15.273 5.433 64 3HD1 ILE 7 2HD1 ILE 7 -7.774 14.184 4.099 65 H ASN 8 H ASN 8 -12.472 11.259 5.899 66 HA ASN 8 HA ASN 8 -14.036 11.005 8.438 67 1HB ASN 8 1HB ASN 8 -14.912 10.268 5.537 68 2HB ASN 8 2HB ASN 8 -15.991 10.304 6.910 69 1HD2 ASN 8 2HD2 ASN 8 -15.368 13.801 4.994 70 2HD2 ASN 8 1HD2 ASN 8 -14.647 12.207 4.440 71 H ALA 9 H ALA 9 -12.120 8.651 6.886 72 HA ALA 9 HA ALA 9 -13.664 6.244 7.842 73 1HB ALA 9 2HB ALA 9 -11.781 6.106 5.883 74 2HB ALA 9 3HB ALA 9 -10.591 6.409 7.143 75 3HB ALA 9 1HB ALA 9 -11.514 4.970 7.261 76 H VAL 10 H VAL 10 -10.785 8.142 8.802 77 HA VAL 10 HA VAL 10 -10.145 6.475 10.980 78 HB VAL 10 HB VAL 10 -9.084 9.313 10.790 79 1HG1 VAL 10 3HG2 VAL 10 -8.368 7.385 12.523 80 2HG1 VAL 10 1HG2 VAL 10 -7.226 7.021 11.189 81 3HG1 VAL 10 2HG2 VAL 10 -7.256 8.644 11.886 82 1HG2 VAL 10 1HG1 VAL 10 -8.581 7.079 8.827 83 2HG2 VAL 10 2HG1 VAL 10 -8.954 8.829 8.644 84 3HG2 VAL 10 3HG1 VAL 10 -7.313 8.345 9.159 85 H ALA 11 H ALA 11 -11.368 9.642 10.639 86 HA ALA 11 HA ALA 11 -11.909 9.903 13.403 87 1HB ALA 11 2HB ALA 11 -11.653 11.895 11.837 88 2HB ALA 11 3HB ALA 11 -13.176 11.465 11.019 89 3HB ALA 11 1HB ALA 11 -13.196 12.051 12.715 90 H GLU 12 H GLU 12 -13.849 8.326 10.952 91 HA GLU 12 HA GLU 12 -16.271 8.223 12.731 92 1HB GLU 12 1HB GLU 12 -16.626 8.201 10.271 93 2HB GLU 12 2HB GLU 12 -15.663 6.728 10.107 94 1HG GLU 12 1HG GLU 12 -17.365 5.432 11.404 95 2HG GLU 12 2HG GLU 12 -18.306 6.894 11.694 96 HE1 GLU 12 HE2 GLU 12 -19.721 7.017 8.534 97 H THR 13 H THR 13 -13.684 5.880 11.683 98 HA THR 13 HA THR 13 -14.674 4.077 13.902 99 HB THR 13 HB THR 13 -14.172 3.459 11.473 100 HG1 THR 13 HG1 THR 13 -13.341 1.823 13.626 101 1HG2 THR 13 1HG2 THR 13 -11.764 4.035 11.351 102 2HG2 THR 13 2HG2 THR 13 -11.419 2.772 12.558 103 3HG2 THR 13 3HG2 THR 13 -12.105 2.334 10.966 104 H SER 14 H SER 14 -12.957 6.404 14.229 105 HA SER 14 HA SER 14 -11.583 5.264 16.753 106 1HB SER 14 1HB SER 14 -10.157 7.422 15.081 107 2HB SER 14 2HB SER 14 -9.576 6.648 16.548 108 HG SER 14 HG SER 14 -9.649 4.651 15.444 109 H GLY 15 H GLY 15 -13.179 8.186 15.405 110 1HA GLY 15 1HA GLY 15 -14.027 10.096 16.501 111 2HA GLY 15 2HA GLY 15 -13.976 9.187 18.007 112 H LEU 16 H LEU 16 -11.686 10.624 15.772 113 HA LEU 16 HA LEU 16 -10.292 12.274 17.895 114 1HB LEU 16 1HB LEU 16 -8.339 12.258 16.503 115 2HB LEU 16 2HB LEU 16 -8.771 10.748 17.280 116 HG LEU 16 HG LEU 16 -9.571 9.780 15.386 117 1HD1 LEU 16 2HD1 LEU 16 -10.778 11.744 14.292 118 2HD1 LEU 16 3HD1 LEU 16 -9.158 12.258 13.734 119 3HD1 LEU 16 1HD1 LEU 16 -9.898 10.686 13.186 120 1HD2 LEU 16 3HD2 LEU 16 -7.464 9.234 15.408 121 2HD2 LEU 16 1HD2 LEU 16 -8.323 9.150 13.850 122 3HD2 LEU 16 2HD2 LEU 16 -7.174 10.450 14.109 123 H SER 17 H SER 17 -9.604 13.416 15.261 124 HA SER 17 HA SER 17 -11.834 15.495 14.920 125 1HB SER 17 1HB SER 17 -8.922 16.397 14.981 126 2HB SER 17 2HB SER 17 -10.344 17.380 14.716 127 HG SER 17 HG SER 17 -11.080 16.810 16.793 128 H LYS 18 H LYS 18 -11.800 16.589 12.906 129 HA LYS 18 HA LYS 18 -11.137 14.901 10.509 130 1HB LYS 18 1HB LYS 18 -12.146 17.807 10.708 131 2HB LYS 18 2HB LYS 18 -11.750 17.061 9.183 132 1HG LYS 18 1HG LYS 18 -13.897 15.997 11.121 133 2HG LYS 18 2HG LYS 18 -14.216 17.060 9.770 134 1HD LYS 18 1HD LYS 18 -13.088 14.199 9.538 135 2HD LYS 18 2HD LYS 18 -14.762 14.633 9.322 136 1HE LYS 18 1HE LYS 18 -12.480 15.686 7.508 137 2HE LYS 18 2HE LYS 18 -13.446 14.262 7.169 138 1HZ LYS 18 1HZ LYS 18 -14.309 16.149 6.020 139 2HZ LYS 18 2HZ LYS 18 -15.421 15.632 7.100 140 H LYS 19 H LYS 19 -9.786 17.886 11.884 141 HA LYS 19 HA LYS 19 -7.386 17.961 10.183 142 1HB LYS 19 2HB LYS 19 -8.209 19.938 11.460 143 2HB LYS 19 1HB LYS 19 -7.811 19.164 12.992 144 1HG LYS 19 1HG LYS 19 -6.128 20.839 12.404 145 2HG LYS 19 2HG LYS 19 -5.404 19.251 12.479 146 1HD LYS 19 1HD LYS 19 -4.425 20.451 10.632 147 2HD LYS 19 2HD LYS 19 -5.340 19.105 9.976 148 1HE LYS 19 1HE LYS 19 -7.244 20.705 9.379 149 2HE LYS 19 2HE LYS 19 -6.317 22.050 10.063 150 1HZ LYS 19 1HZ LYS 19 -5.430 20.338 7.804 151 2HZ LYS 19 2HZ LYS 19 -4.573 21.581 8.432 152 H ASP 20 H ASP 20 -8.058 16.144 13.271 153 HA ASP 20 HA ASP 20 -5.186 15.244 13.476 154 1HB ASP 20 1HB ASP 20 -7.747 14.354 14.943 155 2HB ASP 20 2HB ASP 20 -6.284 13.423 15.103 156 HD1 ASP 20 HD2 ASP 20 -4.458 15.752 16.923 157 H ALA 21 H ALA 21 -8.069 13.929 11.956 158 HA ALA 21 HA ALA 21 -6.880 11.313 11.214 159 1HB ALA 21 2HB ALA 21 -9.437 12.835 10.403 160 2HB ALA 21 3HB ALA 21 -8.982 11.246 9.717 161 3HB ALA 21 1HB ALA 21 -9.251 11.438 11.428 162 H THR 22 H THR 22 -7.267 14.437 9.434 163 HA THR 22 HA THR 22 -5.969 13.693 6.964 164 HB THR 22 HB THR 22 -5.790 16.485 8.305 165 HG1 THR 22 HG1 THR 22 -7.770 16.925 7.399 166 1HG2 THR 22 3HG2 THR 22 -6.064 15.515 5.398 167 2HG2 THR 22 1HG2 THR 22 -6.198 17.224 5.907 168 3HG2 THR 22 2HG2 THR 22 -4.657 16.323 6.132 169 H LYS 23 H LYS 23 -4.601 15.050 9.868 170 HA LYS 23 HA LYS 23 -1.773 15.025 9.040 171 1HB LYS 23 2HB LYS 23 -3.260 14.723 11.787 172 2HB LYS 23 1HB LYS 23 -1.538 14.718 11.751 173 1HG LYS 23 1HG LYS 23 -1.410 17.040 10.836 174 2HG LYS 23 2HG LYS 23 -3.169 17.137 10.746 175 1HD LYS 23 1HD LYS 23 -3.350 16.845 13.234 176 2HD LYS 23 2HD LYS 23 -1.598 16.656 13.366 177 1HE LYS 23 1HE LYS 23 -1.249 19.006 12.515 178 2HE LYS 23 2HE LYS 23 -2.995 19.214 12.324 179 1HZ LYS 23 1HZ LYS 23 -2.171 20.121 14.401 180 2HZ LYS 23 2HZ LYS 23 -1.590 18.670 14.881 181 H ALA 24 H ALA 24 -3.578 12.729 10.980 182 HA ALA 24 HA ALA 24 -1.497 10.852 11.445 183 1HB ALA 24 2HB ALA 24 -3.442 11.038 12.789 184 2HB ALA 24 3HB ALA 24 -4.509 10.505 11.446 185 3HB ALA 24 1HB ALA 24 -3.320 9.365 12.182 186 H VAL 25 H VAL 25 -3.809 10.810 8.750 187 HA VAL 25 HA VAL 25 -2.675 8.396 7.310 188 HB VAL 25 HB VAL 25 -4.336 11.078 6.816 189 1HG1 VAL 25 1HG2 VAL 25 -3.487 9.239 4.498 190 2HG1 VAL 25 2HG2 VAL 25 -4.731 10.538 4.432 191 3HG1 VAL 25 3HG2 VAL 25 -3.044 10.938 4.727 192 1HG2 VAL 25 3HG1 VAL 25 -5.545 9.100 7.769 193 2HG2 VAL 25 1HG1 VAL 25 -6.217 9.716 6.253 194 3HG2 VAL 25 2HG1 VAL 25 -5.246 8.214 6.238 195 H ASP 26 H ASP 26 -2.087 11.970 6.823 196 HA ASP 26 HA ASP 26 0.515 11.414 5.415 197 1HB ASP 26 1HB ASP 26 -1.138 13.418 5.106 198 2HB ASP 26 2HB ASP 26 -0.469 14.074 6.598 199 HD2 ASP 26 HD2 ASP 26 2.232 15.465 4.988 200 H ALA 27 H ALA 27 0.035 10.685 8.170 201 HA ALA 27 HA ALA 27 2.714 11.307 9.458 202 1HB ALA 27 2HB ALA 27 0.398 11.751 10.757 203 2HB ALA 27 3HB ALA 27 0.490 10.017 11.022 204 3HB ALA 27 1HB ALA 27 1.761 11.121 11.586 205 H VAL 28 H VAL 28 0.515 8.677 8.682 206 HA VAL 28 HA VAL 28 2.462 6.461 9.017 207 HB VAL 28 HB VAL 28 0.088 6.437 6.976 208 1HG1 VAL 28 1HG2 VAL 28 2.074 4.454 7.975 209 2HG1 VAL 28 2HG2 VAL 28 0.418 3.869 7.996 210 3HG1 VAL 28 3HG2 VAL 28 1.053 4.521 6.479 211 1HG2 VAL 28 2HG1 VAL 28 -0.143 5.743 9.863 212 2HG2 VAL 28 3HG1 VAL 28 -1.071 6.912 8.824 213 3HG2 VAL 28 1HG1 VAL 28 -1.233 5.176 8.523 214 H PHE 29 H PHE 29 1.008 7.908 6.211 215 HA PHE 29 HA PHE 29 2.857 6.949 4.158 216 1HB PHE 29 2HB PHE 29 0.699 9.105 3.924 217 2HB PHE 29 1HB PHE 29 1.441 8.283 2.566 218 HD1 PHE 29 HD2 PHE 29 1.501 5.473 3.057 219 HD2 PHE 29 HD1 PHE 29 -1.525 8.278 4.225 220 HE1 PHE 29 HE2 PHE 29 -0.055 3.622 3.436 221 HE2 PHE 29 HE1 PHE 29 -3.088 6.418 4.605 222 HZ PHE 29 HZ PHE 29 -2.282 4.068 4.308 223 H ASP 30 H ASP 30 3.269 9.706 6.160 224 HA ASP 30 HA ASP 30 5.212 10.944 4.226 225 1HB ASP 30 1HB ASP 30 3.789 12.155 6.094 226 2HB ASP 30 2HB ASP 30 4.999 11.635 7.236 227 HD2 ASP 30 HD2 ASP 30 7.434 13.880 6.261 228 H SER 31 H SER 31 5.323 8.996 7.073 229 HA SER 31 HA SER 31 8.335 8.797 7.252 230 1HB SER 31 1HB SER 31 6.342 6.871 8.535 231 2HB SER 31 2HB SER 31 8.060 7.029 8.911 232 HG SER 31 HG SER 31 7.689 9.171 9.558 233 H ILE 32 H ILE 32 5.716 6.643 5.687 234 HA ILE 32 HA ILE 32 7.382 4.630 4.727 235 HB ILE 32 HB ILE 32 4.970 5.670 3.251 236 1HG1 ILE 32 1HG1 ILE 32 5.198 4.464 5.984 237 2HG1 ILE 32 2HG1 ILE 32 4.233 5.750 5.294 238 1HG2 ILE 32 1HG2 ILE 32 6.683 3.684 2.510 239 2HG2 ILE 32 2HG2 ILE 32 5.806 2.761 3.695 240 3HG2 ILE 32 3HG2 ILE 32 4.930 3.459 2.327 241 1HD1 ILE 32 1HD1 ILE 32 3.569 2.901 4.643 242 2HD1 ILE 32 2HD1 ILE 32 3.086 3.710 6.158 243 3HD1 ILE 32 3HD1 ILE 32 2.546 4.398 4.597 244 H THR 33 H THR 33 6.286 7.578 3.042 245 HA THR 33 HA THR 33 8.037 7.120 0.693 246 HB THR 33 HB THR 33 6.231 8.771 0.489 247 HG1 THR 33 HG1 THR 33 8.041 9.138 -0.768 248 1HG2 THR 33 3HG2 THR 33 6.320 9.625 2.878 249 2HG2 THR 33 1HG2 THR 33 7.623 10.701 2.427 250 3HG2 THR 33 2HG2 THR 33 5.988 10.863 1.672 251 H GLU 34 H GLU 34 8.821 8.573 3.788 252 HA GLU 34 HA GLU 34 11.613 9.343 2.984 253 1HB GLU 34 1HB GLU 34 10.328 8.941 5.776 254 2HB GLU 34 2HB GLU 34 12.014 9.385 5.560 255 1HG GLU 34 1HG GLU 34 11.426 11.525 4.476 256 2HG GLU 34 2HG GLU 34 9.718 11.127 4.462 257 HE2 GLU 34 HE2 GLU 34 11.473 12.616 7.734 258 H ALA 35 H ALA 35 10.095 6.417 4.424 259 HA ALA 35 HA ALA 35 12.592 4.910 4.540 260 1HB ALA 35 3HB ALA 35 10.207 4.048 5.589 261 2HB ALA 35 1HB ALA 35 9.715 3.733 3.943 262 3HB ALA 35 2HB ALA 35 11.011 2.808 4.617 263 H LEU 36 H LEU 36 10.091 5.034 1.961 264 HA LEU 36 HA LEU 36 11.385 3.232 0.091 265 1HB LEU 36 2HB LEU 36 9.442 5.357 -0.612 266 2HB LEU 36 1HB LEU 36 9.753 3.846 -1.435 267 HG LEU 36 HG LEU 36 8.352 4.076 1.258 268 1HD1 LEU 36 2HD2 LEU 36 7.495 2.685 -1.271 269 2HD1 LEU 36 3HD2 LEU 36 6.628 2.663 0.299 270 3HD1 LEU 36 1HD2 LEU 36 6.844 4.220 -0.532 271 1HD2 LEU 36 2HD1 LEU 36 9.946 2.203 1.575 272 2HD2 LEU 36 3HD1 LEU 36 8.287 1.641 1.513 273 3HD2 LEU 36 1HD1 LEU 36 9.344 1.445 0.069 274 NH1 ARG 37 NH2 ARG 37 11.943 13.735 1.212 275 NH2 ARG 37 NH1 ARG 37 13.082 13.412 3.153 276 H ARG 37 H ARG 37 11.373 6.878 0.248 277 HA ARG 37 HA ARG 37 13.057 6.998 -2.061 278 1HB ARG 37 1HB ARG 37 13.349 9.329 -1.801 279 2HB ARG 37 2HB ARG 37 11.729 8.999 -1.231 280 1HG ARG 37 1HG ARG 37 12.718 9.019 1.190 281 2HG ARG 37 2HG ARG 37 14.243 9.550 0.499 282 1HD ARG 37 1HD ARG 37 13.189 11.558 -0.467 283 2HD ARG 37 2HD ARG 37 11.604 11.057 0.203 284 1HH1 ARG 37 2HH2 ARG 37 11.643 13.346 0.311 285 2HH1 ARG 37 1HH2 ARG 37 11.735 14.670 1.578 286 1HH2 ARG 37 1HH1 ARG 37 13.648 12.783 3.733 287 2HH2 ARG 37 2HH1 ARG 37 12.794 14.369 3.385 288 H LYS 38 H LYS 38 13.809 6.360 1.319 289 HA LYS 38 HA LYS 38 16.729 7.084 0.908 290 1HB LYS 38 1HB LYS 38 15.392 8.164 2.786 291 2HB LYS 38 2HB LYS 38 15.340 6.596 3.575 292 1HG LYS 38 1HG LYS 38 17.874 6.648 3.777 293 2HG LYS 38 2HG LYS 38 17.910 8.132 2.839 294 1HD LYS 38 1HD LYS 38 18.177 8.735 5.138 295 2HD LYS 38 2HD LYS 38 16.594 9.318 4.639 296 1HE LYS 38 1HE LYS 38 15.496 7.333 5.798 297 2HE LYS 38 2HE LYS 38 17.089 6.711 6.252 298 1HZ LYS 38 1HZ LYS 38 15.992 9.346 7.073 299 2HZ LYS 38 2HZ LYS 38 17.456 8.761 7.506 300 H GLY 39 H GLY 39 15.158 4.397 0.221 301 1HA GLY 39 1HA GLY 39 15.765 2.087 0.075 302 2HA GLY 39 2HA GLY 39 17.369 2.512 0.627 303 H ASP 40 H ASP 40 14.317 2.861 2.359 304 HA ASP 40 HA ASP 40 15.141 0.779 4.446 305 1HB ASP 40 1HB ASP 40 13.375 3.110 5.102 306 2HB ASP 40 2HB ASP 40 13.964 1.889 6.177 307 HD2 ASP 40 HD2 ASP 40 16.243 5.030 5.207 308 H LYS 41 H LYS 41 13.901 -0.775 5.095 309 HA LYS 41 HA LYS 41 11.385 -1.342 3.534 310 1HB LYS 41 2HB LYS 41 12.502 -3.141 5.697 311 2HB LYS 41 1HB LYS 41 11.281 -3.542 4.497 312 1HG LYS 41 1HG LYS 41 13.109 -3.214 2.683 313 2HG LYS 41 2HG LYS 41 14.282 -3.092 3.993 314 1HD LYS 41 1HD LYS 41 13.596 -5.407 4.810 315 2HD LYS 41 2HD LYS 41 12.402 -5.492 3.524 316 1HE LYS 41 1HE LYS 41 14.272 -6.790 2.775 317 2HE LYS 41 2HE LYS 41 14.255 -5.337 1.778 318 1HZ LYS 41 1HZ LYS 41 15.994 -5.771 4.153 319 2HZ LYS 41 2HZ LYS 41 15.997 -4.422 3.231 320 H VAL 42 H VAL 42 9.490 -0.662 4.333 321 HA VAL 42 HA VAL 42 8.951 0.045 7.082 322 HB VAL 42 HB VAL 42 7.343 -0.106 4.440 323 1HG1 VAL 42 1HG2 VAL 42 6.872 1.582 6.908 324 2HG1 VAL 42 2HG2 VAL 42 5.935 1.641 5.376 325 3HG1 VAL 42 3HG2 VAL 42 5.887 0.147 6.350 326 1HG2 VAL 42 1HG1 VAL 42 8.754 2.273 5.766 327 2HG2 VAL 42 2HG1 VAL 42 9.233 1.484 4.209 328 3HG2 VAL 42 3HG1 VAL 42 7.732 2.398 4.318 329 H GLN 43 H GLN 43 7.421 -0.870 8.064 330 HA GLN 43 HA GLN 43 6.450 -3.704 7.509 331 1HB GLN 43 1HB GLN 43 8.270 -3.464 9.847 332 2HB GLN 43 2HB GLN 43 7.237 -4.838 9.451 333 1HG GLN 43 1HG GLN 43 8.473 -4.953 7.194 334 2HG GLN 43 2HG GLN 43 9.533 -3.672 7.770 335 1HE2 GLN 43 2HE2 GLN 43 11.496 -6.682 8.360 336 2HE2 GLN 43 1HE2 GLN 43 10.871 -5.620 7.006 337 H LEU 44 H LEU 44 4.483 -3.976 7.797 338 HA LEU 44 HA LEU 44 3.101 -2.846 10.261 339 1HB LEU 44 2HB LEU 44 1.418 -2.938 7.752 340 2HB LEU 44 1HB LEU 44 1.193 -2.017 9.214 341 HG LEU 44 HG LEU 44 3.004 -1.385 6.810 342 1HD1 LEU 44 2HD1 LEU 44 0.464 -0.034 7.893 343 2HD1 LEU 44 3HD1 LEU 44 1.427 0.544 6.515 344 3HD1 LEU 44 1HD1 LEU 44 0.603 -1.023 6.422 345 1HD2 LEU 44 2HD2 LEU 44 3.258 -0.156 9.524 346 2HD2 LEU 44 3HD2 LEU 44 4.377 -0.200 8.161 347 3HD2 LEU 44 1HD2 LEU 44 3.098 1.008 8.181 348 H ILE 45 H ILE 45 2.820 -4.825 11.287 349 HA ILE 45 HA ILE 45 2.460 -7.324 9.741 350 HB ILE 45 HB ILE 45 3.846 -7.196 11.798 351 1HG1 ILE 45 1HG1 ILE 45 1.729 -9.419 11.900 352 2HG1 ILE 45 2HG1 ILE 45 3.005 -9.341 10.698 353 1HG2 ILE 45 1HG2 ILE 45 2.236 -5.901 13.249 354 2HG2 ILE 45 2HG2 ILE 45 1.187 -7.333 13.345 355 3HG2 ILE 45 3HG2 ILE 45 2.837 -7.378 14.037 356 1HD1 ILE 45 1HD1 ILE 45 4.770 -9.466 12.506 357 2HD1 ILE 45 2HD1 ILE 45 3.481 -9.624 13.731 358 3HD1 ILE 45 3HD1 ILE 45 3.683 -10.876 12.486 359 H GLY 46 H GLY 46 0.687 -8.690 9.832 360 1HA GLY 46 1HA GLY 46 -1.675 -9.182 9.697 361 2HA GLY 46 2HA GLY 46 -2.027 -7.774 10.654 362 H PHE 47 H PHE 47 -0.468 -6.245 8.279 363 HA PHE 47 HA PHE 47 -2.682 -6.224 6.226 364 1HB PHE 47 2HB PHE 47 -2.791 -4.469 8.097 365 2HB PHE 47 1HB PHE 47 -1.308 -3.753 7.522 366 HD1 PHE 47 HD1 PHE 47 -4.898 -4.361 6.615 367 HD2 PHE 47 HD2 PHE 47 -1.201 -2.562 5.320 368 HE1 PHE 47 HE1 PHE 47 -6.017 -3.373 4.639 369 HE2 PHE 47 HE2 PHE 47 -2.345 -1.674 3.338 370 HZ PHE 47 HZ PHE 47 -4.741 -2.225 2.956 371 H GLY 48 H GLY 48 0.801 -5.171 6.747 372 1HA GLY 48 1HA GLY 48 1.590 -5.905 4.164 373 2HA GLY 48 2HA GLY 48 1.062 -4.255 3.955 374 H ASN 49 H ASN 49 3.594 -5.559 3.542 375 HA ASN 49 HA ASN 49 5.395 -3.767 5.286 376 1HB ASN 49 1HB ASN 49 6.090 -6.519 4.097 377 2HB ASN 49 2HB ASN 49 7.245 -5.409 4.810 378 1HD2 ASN 49 1HD2 ASN 49 6.663 -7.712 7.558 379 2HD2 ASN 49 2HD2 ASN 49 7.552 -7.536 5.963 380 H PHE 50 H PHE 50 5.864 -2.075 4.050 381 HA PHE 50 HA PHE 50 6.021 -2.272 1.034 382 1HB PHE 50 2HB PHE 50 6.595 0.297 2.610 383 2HB PHE 50 1HB PHE 50 6.512 0.171 0.925 384 HD1 PHE 50 HD1 PHE 50 4.576 -0.268 4.071 385 HD2 PHE 50 HD2 PHE 50 4.557 1.046 -0.011 386 HE1 PHE 50 HE1 PHE 50 2.257 0.582 4.350 387 HE2 PHE 50 HE2 PHE 50 2.255 1.935 0.315 388 HZ PHE 50 HZ PHE 50 1.110 1.531 2.440 389 H GLU 51 H GLU 51 7.849 -1.687 -0.062 390 HA GLU 51 HA GLU 51 10.286 -0.793 1.140 391 1HB GLU 51 1HB GLU 51 11.835 -2.732 0.828 392 2HB GLU 51 2HB GLU 51 10.650 -3.101 2.043 393 1HG GLU 51 1HG GLU 51 10.520 -4.165 -0.858 394 2HG GLU 51 2HG GLU 51 11.279 -5.003 0.480 395 HE2 GLU 51 HE2 GLU 51 7.363 -5.276 -0.086 396 H VAL 52 H VAL 52 12.103 -0.459 -0.445 397 HA VAL 52 HA VAL 52 10.929 0.126 -3.084 398 HB VAL 52 HB VAL 52 12.729 1.356 -1.100 399 1HG1 VAL 52 3HG2 VAL 52 14.518 -0.163 -1.769 400 2HG1 VAL 52 1HG2 VAL 52 14.414 0.409 -3.433 401 3HG1 VAL 52 2HG2 VAL 52 14.882 1.555 -2.133 402 1HG2 VAL 52 3HG1 VAL 52 11.930 2.086 -3.925 403 2HG2 VAL 52 1HG1 VAL 52 11.354 2.677 -2.361 404 3HG2 VAL 52 2HG1 VAL 52 12.990 3.080 -2.900 405 NH1 ARG 53 NH2 ARG 53 16.311 -5.768 -7.165 406 NH2 ARG 53 NH1 ARG 53 15.748 -7.344 -8.703 407 H ARG 53 H ARG 53 12.395 -0.595 -5.098 408 HA ARG 53 HA ARG 53 13.466 -3.378 -4.612 409 1HB ARG 53 1HB ARG 53 11.716 -2.831 -6.335 410 2HB ARG 53 2HB ARG 53 12.827 -1.702 -7.038 411 1HG ARG 53 1HG ARG 53 12.754 -3.849 -8.314 412 2HG ARG 53 2HG ARG 53 14.373 -3.498 -7.765 413 1HD ARG 53 1HD ARG 53 13.999 -5.187 -5.817 414 2HD ARG 53 2HD ARG 53 12.422 -5.537 -6.507 415 1HH1 ARG 53 2HH2 ARG 53 15.991 -5.054 -6.501 416 2HH1 ARG 53 1HH2 ARG 53 17.283 -6.029 -7.365 417 1HH2 ARG 53 1HH1 ARG 53 15.004 -7.832 -9.213 418 2HH2 ARG 53 2HH1 ARG 53 16.759 -7.496 -8.795 419 H GLU 54 H GLU 54 14.780 -1.433 -6.510 420 HA GLU 54 HA GLU 54 16.920 -0.191 -6.263 421 1HB GLU 54 1HB GLU 54 17.883 -1.489 -4.349 422 2HB GLU 54 2HB GLU 54 18.237 -2.848 -5.411 423 1HG GLU 54 1HG GLU 54 19.832 -1.334 -6.723 424 2HG GLU 54 2HG GLU 54 19.417 0.012 -5.666 425 HE1 GLU 54 HE2 GLU 54 21.321 -1.049 -2.977 426 NH1 ARG 55 NH2 ARG 55 18.703 2.046 -14.906 427 NH2 ARG 55 NH1 ARG 55 16.896 3.412 -14.681 428 H ARG 55 H ARG 55 16.415 0.046 -8.550 429 HA ARG 55 HA ARG 55 16.914 -2.256 -10.396 430 1HB ARG 55 1HB ARG 55 15.105 -0.647 -10.854 431 2HB ARG 55 2HB ARG 55 16.247 0.649 -11.131 432 1HG ARG 55 1HG ARG 55 16.446 -1.955 -12.755 433 2HG ARG 55 2HG ARG 55 15.181 -0.812 -13.134 434 1HD ARG 55 1HD ARG 55 18.189 -0.099 -13.171 435 2HD ARG 55 2HD ARG 55 17.268 -0.632 -14.571 436 1HH1 ARG 55 2HH2 ARG 55 19.112 1.119 -14.741 437 2HH1 ARG 55 1HH2 ARG 55 19.158 2.845 -15.360 438 1HH2 ARG 55 1HH1 ARG 55 15.933 3.526 -14.349 439 2HH2 ARG 55 2HH1 ARG 55 17.472 4.118 -15.153 440 H ALA 56 H ALA 56 18.827 -2.779 -11.157 441 HA ALA 56 HA ALA 56 21.258 -1.453 -10.352 442 1HB ALA 56 2HB ALA 56 21.157 -3.890 -10.725 443 2HB ALA 56 3HB ALA 56 20.917 -3.659 -12.476 444 3HB ALA 56 1HB ALA 56 22.449 -3.179 -11.708 445 H ALA 57 H ALA 57 21.836 0.462 -11.088 446 HA ALA 57 HA ALA 57 21.468 1.735 -13.531 447 1HB ALA 57 3HB ALA 57 22.500 2.826 -11.476 448 2HB ALA 57 1HB ALA 57 24.026 1.963 -11.771 449 3HB ALA 57 2HB ALA 57 23.464 3.196 -12.916 450 NH1 ARG 58 NH2 ARG 58 20.350 -4.102 -15.363 451 NH2 ARG 58 NH1 ARG 58 18.157 -3.502 -15.393 452 H ARG 58 H ARG 58 22.106 1.868 -15.458 453 HA ARG 58 HA ARG 58 23.724 -0.428 -16.388 454 1HB ARG 58 2HB ARG 58 22.087 1.379 -18.224 455 2HB ARG 58 1HB ARG 58 22.718 -0.208 -18.616 456 1HG ARG 58 1HG ARG 58 20.453 0.428 -16.642 457 2HG ARG 58 2HG ARG 58 20.270 -0.165 -18.282 458 1HD ARG 58 1HD ARG 58 21.361 -2.345 -17.692 459 2HD ARG 58 2HD ARG 58 21.709 -1.755 -16.057 460 1HH1 ARG 58 2HH2 ARG 58 21.311 -3.879 -15.642 461 2HH1 ARG 58 1HH2 ARG 58 20.039 -4.918 -14.824 462 1HH2 ARG 58 1HH1 ARG 58 17.447 -2.826 -15.695 463 2HH2 ARG 58 2HH1 ARG 58 18.000 -4.360 -14.853 464 H LYS 59 H LYS 59 24.655 0.438 -18.872 465 HA LYS 59 HA LYS 59 26.125 2.994 -18.611 466 1HB LYS 59 1HB LYS 59 27.616 1.345 -17.317 467 2HB LYS 59 2HB LYS 59 27.952 0.520 -18.834 468 1HG LYS 59 1HG LYS 59 28.938 2.647 -19.775 469 2HG LYS 59 2HG LYS 59 28.433 3.536 -18.341 470 1HD LYS 59 1HD LYS 59 29.947 2.021 -16.912 471 2HD LYS 59 2HD LYS 59 30.499 1.259 -18.396 472 1HE LYS 59 1HE LYS 59 32.172 2.886 -17.784 473 2HE LYS 59 2HE LYS 59 31.371 3.514 -19.220 474 1HZ LYS 59 1HZ LYS 59 30.073 4.979 -17.807 475 2HZ LYS 59 2HZ LYS 59 31.674 5.218 -17.574 476 H GLY 60 H GLY 60 25.895 3.856 -20.491 477 1HA GLY 60 1HA GLY 60 25.857 2.175 -23.071 478 2HA GLY 60 2HA GLY 60 24.571 3.328 -22.743 479 NH1 ARG 61 NH2 ARG 61 32.450 6.582 -26.637 480 NH2 ARG 61 NH1 ARG 61 32.486 7.810 -28.548 481 H ARG 61 H ARG 61 25.075 4.562 -24.488 482 HA ARG 61 HA ARG 61 27.303 6.553 -24.264 483 1HB ARG 61 1HB ARG 61 28.417 4.527 -25.322 484 2HB ARG 61 2HB ARG 61 27.264 4.572 -26.652 485 1HG ARG 61 1HG ARG 61 28.163 6.808 -27.364 486 2HG ARG 61 2HG ARG 61 29.218 6.853 -25.960 487 1HD ARG 61 1HD ARG 61 30.456 4.799 -26.822 488 2HD ARG 61 2HD ARG 61 29.388 4.767 -28.221 489 1HH1 ARG 61 2HH2 ARG 61 31.957 5.892 -26.061 490 2HH1 ARG 61 1HH2 ARG 61 33.346 7.035 -26.423 491 1HH2 ARG 61 1HH1 ARG 61 32.021 8.060 -29.427 492 2HH2 ARG 61 2HH1 ARG 61 33.378 8.176 -28.198 493 H ASN 62 H ASN 62 27.084 8.234 -25.743 494 HA ASN 62 HA ASN 62 25.675 10.021 -26.441 495 1HB ASN 62 1HB ASN 62 25.667 9.876 -28.812 496 2HB ASN 62 2HB ASN 62 27.034 9.151 -28.053 497 1HD2 ASN 62 1HD2 ASN 62 26.407 6.764 -30.547 498 2HD2 ASN 62 2HD2 ASN 62 27.536 7.981 -29.792 499 HA PRO 63 HA PRO 63 21.464 11.607 -27.095 500 1HB PRO 63 1HB PRO 63 20.543 8.734 -26.783 501 2HB PRO 63 2HB PRO 63 19.752 10.113 -27.600 502 1HG PRO 63 1HG PRO 63 21.799 8.261 -28.657 503 2HG PRO 63 2HG PRO 63 21.027 9.607 -29.567 504 1HD PRO 63 1HD PRO 63 23.646 9.609 -29.079 505 2HD PRO 63 2HD PRO 63 22.780 11.147 -28.930 506 H GLN 64 H GLN 64 23.283 11.591 -25.243 507 HA GLN 64 HA GLN 64 21.703 12.790 -23.068 508 1HB GLN 64 1HB GLN 64 21.814 10.264 -22.351 509 2HB GLN 64 2HB GLN 64 23.547 10.433 -22.277 510 1HG GLN 64 1HG GLN 64 22.883 10.641 -20.057 511 2HG GLN 64 2HG GLN 64 23.211 12.300 -20.514 512 1HE2 GLN 64 2HE2 GLN 64 19.367 11.346 -19.440 513 2HE2 GLN 64 1HE2 GLN 64 20.675 10.071 -19.611 514 H THR 65 H THR 65 24.951 11.426 -23.442 515 HA THR 65 HA THR 65 26.191 14.158 -22.964 516 HB THR 65 HB THR 65 27.951 13.056 -21.826 517 HG1 THR 65 HG1 THR 65 28.096 10.814 -21.736 518 1HG2 THR 65 2HG2 THR 65 25.680 13.126 -20.596 519 2HG2 THR 65 3HG2 THR 65 25.455 11.435 -21.055 520 3HG2 THR 65 1HG2 THR 65 26.818 11.856 -19.996 521 H GLY 66 H GLY 66 26.107 11.712 -25.405 522 1HA GLY 66 1HA GLY 66 27.258 11.771 -27.571 523 2HA GLY 66 2HA GLY 66 28.365 12.994 -26.996 524 H GLU 67 H GLU 67 29.145 11.224 -24.556 525 HA GLU 67 HA GLU 67 31.089 9.361 -25.964 526 1HB GLU 67 1HB GLU 67 31.913 11.127 -25.275 527 2HB GLU 67 2HB GLU 67 31.950 11.763 -24.385 528 1HG GLU 67 1HG GLU 67 33.195 9.034 -24.559 529 2HG GLU 67 2HG GLU 67 33.934 10.618 -24.450 530 HE2 GLU 67 HE2 GLU 67 33.695 8.397 -21.237 531 H GLU 68 H GLU 68 31.804 7.780 -24.090 532 HA GLU 68 HA GLU 68 29.471 6.238 -23.414 533 1HB GLU 68 1HB GLU 68 31.802 5.316 -23.938 534 2HB GLU 68 2HB GLU 68 32.341 5.815 -22.338 535 1HG GLU 68 1HG GLU 68 30.582 4.228 -21.325 536 2HG GLU 68 2HG GLU 68 30.110 3.762 -22.956 537 HE1 GLU 68 HE2 GLU 68 33.618 2.494 -21.358 538 H MET 69 H MET 69 28.201 6.226 -21.709 539 HA MET 69 HA MET 69 28.906 7.789 -19.175 540 1HB MET 69 1HB MET 69 26.787 9.054 -19.345 541 2HB MET 69 2HB MET 69 27.838 9.337 -20.703 542 1HG MET 69 1HG MET 69 25.714 9.210 -21.734 543 2HG MET 69 2HG MET 69 26.331 7.585 -22.033 544 1HE MET 69 3HE MET 69 23.709 7.676 -22.653 545 2HE MET 69 2HE MET 69 23.979 6.000 -22.076 546 3HE MET 69 1HE MET 69 22.558 6.926 -21.521 547 H GLU 70 H GLU 70 27.854 7.275 -17.355 548 HA GLU 70 HA GLU 70 26.534 4.592 -17.180 549 1HB GLU 70 2HB GLU 70 26.711 4.613 -14.867 550 2HB GLU 70 1HB GLU 70 28.236 5.197 -15.507 551 1HG GLU 70 1HG GLU 70 27.917 6.545 -13.628 552 2HG GLU 70 2HG GLU 70 27.416 7.612 -14.924 553 HE1 GLU 70 HE2 GLU 70 24.630 5.974 -12.400 554 H ILE 71 H ILE 71 24.364 4.182 -16.884 555 HA ILE 71 HA ILE 71 22.447 6.488 -17.101 556 HB ILE 71 HB ILE 71 22.217 3.466 -17.635 557 1HG1 ILE 71 1HG1 ILE 71 22.246 5.773 -19.680 558 2HG1 ILE 71 2HG1 ILE 71 23.695 4.873 -19.301 559 1HG2 ILE 71 2HG2 ILE 71 20.041 4.479 -16.977 560 2HG2 ILE 71 3HG2 ILE 71 20.237 5.734 -18.241 561 3HG2 ILE 71 1HG2 ILE 71 20.043 4.012 -18.694 562 1HD1 ILE 71 2HD1 ILE 71 22.708 2.746 -20.145 563 2HD1 ILE 71 3HD1 ILE 71 21.213 3.619 -20.603 564 3HD1 ILE 71 1HD1 ILE 71 22.755 4.025 -21.376 565 HA PRO 72 HA PRO 72 22.375 5.495 -12.559 566 1HB PRO 72 1HB PRO 72 20.663 7.512 -11.644 567 2HB PRO 72 2HB PRO 72 22.358 7.734 -12.100 568 1HG PRO 72 1HG PRO 72 19.885 8.240 -13.827 569 2HG PRO 72 2HG PRO 72 21.270 9.326 -13.558 570 1HD PRO 72 1HD PRO 72 21.099 7.739 -15.796 571 2HD PRO 72 2HD PRO 72 22.689 8.040 -15.031 572 H ALA 73 H ALA 73 21.043 4.732 -10.908 573 HA ALA 73 HA ALA 73 19.146 2.691 -11.639 574 1HB ALA 73 1HB ALA 73 20.482 2.760 -9.415 575 2HB ALA 73 2HB ALA 73 19.388 4.082 -8.848 576 3HB ALA 73 3HB ALA 73 18.765 2.475 -9.134 577 H SER 74 H SER 74 17.186 2.348 -10.437 578 HA SER 74 HA SER 74 15.778 4.679 -9.464 579 1HB SER 74 1HB SER 74 14.185 2.798 -11.422 580 2HB SER 74 2HB SER 74 13.395 3.971 -10.378 581 HG SER 74 HG SER 74 14.620 5.617 -11.405 582 H LYS 75 H LYS 75 15.136 4.290 -7.503 583 HA LYS 75 HA LYS 75 15.090 1.446 -6.474 584 1HB LYS 75 2HB LYS 75 14.318 3.729 -4.678 585 2HB LYS 75 1HB LYS 75 15.028 2.172 -4.321 586 1HG LYS 75 1HG LYS 75 17.242 2.918 -5.217 587 2HG LYS 75 2HG LYS 75 16.556 4.508 -5.579 588 1HD LYS 75 1HD LYS 75 15.973 4.821 -3.130 589 2HD LYS 75 2HD LYS 75 16.674 3.243 -2.762 590 1HE LYS 75 1HE LYS 75 18.940 4.055 -3.584 591 2HE LYS 75 2HE LYS 75 18.236 5.637 -3.954 592 1HZ LYS 75 1HZ LYS 75 19.311 5.593 -1.802 593 2HZ LYS 75 2HZ LYS 75 18.360 4.375 -1.271 594 H VAL 76 H VAL 76 13.266 0.422 -6.859 595 HA VAL 76 HA VAL 76 10.864 1.874 -7.500 596 HB VAL 76 HB VAL 76 10.164 0.490 -8.873 597 1HG1 VAL 76 2HG2 VAL 76 12.379 1.570 -9.375 598 2HG1 VAL 76 3HG2 VAL 76 13.137 0.000 -8.987 599 3HG1 VAL 76 1HG2 VAL 76 12.045 0.128 -10.412 600 1HG2 VAL 76 2HG1 VAL 76 10.353 -1.817 -7.707 601 2HG2 VAL 76 3HG1 VAL 76 10.226 -1.598 -9.470 602 3HG2 VAL 76 1HG1 VAL 76 11.789 -1.932 -8.798 603 HA PRO 77 HA PRO 77 8.938 0.880 -3.612 604 1HB PRO 77 1HB PRO 77 6.680 2.515 -3.732 605 2HB PRO 77 2HB PRO 77 8.328 3.158 -3.593 606 1HG PRO 77 1HG PRO 77 6.695 2.784 -6.160 607 2HG PRO 77 2HG PRO 77 7.498 4.258 -5.600 608 1HD PRO 77 1HD PRO 77 8.679 2.463 -7.422 609 2HD PRO 77 2HD PRO 77 9.704 3.323 -6.245 610 H ALA 78 H ALA 78 7.886 -0.533 -2.899 611 HA ALA 78 HA ALA 78 5.615 -1.971 -4.352 612 1HB ALA 78 2HB ALA 78 7.955 -2.890 -4.794 613 2HB ALA 78 3HB ALA 78 8.172 -3.186 -3.066 614 3HB ALA 78 1HB ALA 78 6.915 -4.065 -3.969 615 H PHE 79 H PHE 79 4.689 -3.557 -2.920 616 HA PHE 79 HA PHE 79 4.192 -2.772 0.038 617 1HB PHE 79 2HB PHE 79 2.917 -1.183 -0.690 618 2HB PHE 79 1HB PHE 79 2.227 -2.156 -2.031 619 HD1 PHE 79 HD1 PHE 79 2.063 -1.615 1.666 620 HD2 PHE 79 HD2 PHE 79 0.340 -3.699 -1.677 621 HE1 PHE 79 HE1 PHE 79 0.185 -2.345 3.074 622 HE2 PHE 79 HE2 PHE 79 -1.482 -4.495 -0.234 623 HZ PHE 79 HZ PHE 79 -1.545 -3.858 2.146 624 H LYS 80 H LYS 80 4.105 -4.597 0.778 625 HA LYS 80 HA LYS 80 3.271 -7.381 -0.435 626 1HB LYS 80 2HB LYS 80 4.629 -6.748 2.219 627 2HB LYS 80 1HB LYS 80 4.011 -8.329 1.741 628 1HG LYS 80 1HG LYS 80 5.551 -8.380 -0.237 629 2HG LYS 80 2HG LYS 80 6.192 -6.793 0.192 630 1HD LYS 80 1HD LYS 80 7.062 -7.675 2.360 631 2HD LYS 80 2HD LYS 80 6.358 -9.264 2.033 632 1HE LYS 80 1HE LYS 80 7.838 -9.517 -0.008 633 2HE LYS 80 2HE LYS 80 8.525 -7.912 0.276 634 1HZ LYS 80 1HZ LYS 80 8.687 -10.195 2.164 635 2HZ LYS 80 2HZ LYS 80 9.308 -8.709 2.442 636 HA PRO 81 HA PRO 81 -0.590 -6.594 1.908 637 1HB PRO 81 1HB PRO 81 -1.996 -8.844 1.204 638 2HB PRO 81 2HB PRO 81 -1.555 -7.616 0.012 639 1HG PRO 81 1HG PRO 81 -0.097 -10.256 0.588 640 2HG PRO 81 2HG PRO 81 -0.671 -9.657 -0.989 641 1HD PRO 81 1HD PRO 81 1.946 -9.281 -0.051 642 2HD PRO 81 2HD PRO 81 1.154 -8.124 -1.169 643 H GLY 82 H GLY 82 1.682 -7.383 3.435 644 1HA GLY 82 1HA GLY 82 2.690 -8.879 5.039 645 2HA GLY 82 2HA GLY 82 1.176 -8.420 5.790 646 H LYS 83 H LYS 83 0.893 -10.519 3.125 647 HA LYS 83 HA LYS 83 0.112 -12.786 2.888 648 1HB LYS 83 2HB LYS 83 1.712 -13.142 5.421 649 2HB LYS 83 1HB LYS 83 0.355 -14.189 5.358 650 1HG LYS 83 1HG LYS 83 2.277 -15.363 4.423 651 2HG LYS 83 2HG LYS 83 1.139 -15.097 3.121 652 1HD LYS 83 1HD LYS 83 3.375 -14.701 2.262 653 2HD LYS 83 2HD LYS 83 2.507 -13.186 2.254 654 1HE LYS 83 1HE LYS 83 4.767 -12.717 2.967 655 2HE LYS 83 2HE LYS 83 3.738 -12.460 4.371 656 1HZ LYS 83 1HZ LYS 83 5.735 -13.690 4.904 657 2HZ LYS 83 2HZ LYS 83 5.392 -14.868 3.825 658 H ALA 84 H ALA 84 -0.574 -11.436 5.857 659 HA ALA 84 HA ALA 84 -3.061 -12.601 6.761 660 1HB ALA 84 2HB ALA 84 -1.372 -11.304 8.087 661 2HB ALA 84 3HB ALA 84 -1.678 -9.851 7.100 662 3HB ALA 84 1HB ALA 84 -2.964 -10.476 8.169 663 H LEU 85 H LEU 85 -2.534 -9.457 4.899 664 HA LEU 85 HA LEU 85 -5.388 -8.955 4.536 665 1HB LEU 85 2HB LEU 85 -3.766 -7.063 4.336 666 2HB LEU 85 1HB LEU 85 -2.949 -7.892 3.023 667 HG LEU 85 HG LEU 85 -5.198 -7.928 1.871 668 1HD1 LEU 85 1HD1 LEU 85 -6.704 -7.232 3.677 669 2HD1 LEU 85 2HD1 LEU 85 -5.854 -5.680 3.835 670 3HD1 LEU 85 3HD1 LEU 85 -6.798 -6.043 2.363 671 1HD2 LEU 85 1HD2 LEU 85 -3.246 -6.463 1.138 672 2HD2 LEU 85 2HD2 LEU 85 -4.769 -5.612 0.861 673 3HD2 LEU 85 3HD2 LEU 85 -3.757 -5.189 2.266 674 H LYS 86 H LYS 86 -2.894 -10.719 2.710 675 HA LYS 86 HA LYS 86 -4.534 -11.416 0.397 676 1HB LYS 86 1HB LYS 86 -1.948 -11.692 0.678 677 2HB LYS 86 2HB LYS 86 -2.303 -13.260 1.383 678 1HG LYS 86 1HG LYS 86 -3.490 -13.941 -0.735 679 2HG LYS 86 2HG LYS 86 -3.233 -12.327 -1.408 680 1HD LYS 86 1HD LYS 86 -0.727 -12.660 -1.257 681 2HD LYS 86 2HD LYS 86 -0.983 -14.282 -0.601 682 1HE LYS 86 1HE LYS 86 -2.181 -14.963 -2.737 683 2HE LYS 86 2HE LYS 86 -1.947 -13.335 -3.392 684 1HZ LYS 86 1HZ LYS 86 0.454 -13.675 -3.195 685 2HZ LYS 86 2HZ LYS 86 0.239 -15.178 -2.591 686 H ASP 87 H ASP 87 -4.748 -12.663 3.663 687 HA ASP 87 HA ASP 87 -6.576 -14.894 2.855 688 1HB ASP 87 1HB ASP 87 -4.753 -14.400 5.035 689 2HB ASP 87 2HB ASP 87 -6.282 -14.060 5.747 690 HD1 ASP 87 HD2 ASP 87 -7.811 -15.675 5.668 691 H ALA 88 H ALA 88 -6.785 -11.655 4.390 692 HA ALA 88 HA ALA 88 -9.627 -11.492 4.992 693 1HB ALA 88 1HB ALA 88 -7.925 -9.588 5.476 694 2HB ALA 88 2HB ALA 88 -7.836 -9.261 3.739 695 3HB ALA 88 3HB ALA 88 -9.346 -8.992 4.571 696 H VAL 89 H VAL 89 -7.859 -10.979 1.885 697 HA VAL 89 HA VAL 89 -10.180 -9.850 0.506 698 HB VAL 89 HB VAL 89 -7.654 -9.068 0.994 699 1HG1 VAL 89 2HG2 VAL 89 -6.705 -11.350 0.197 700 2HG1 VAL 89 3HG2 VAL 89 -6.992 -10.780 -1.455 701 3HG1 VAL 89 1HG2 VAL 89 -5.942 -9.850 -0.339 702 1HG2 VAL 89 2HG1 VAL 89 -9.072 -7.858 -0.339 703 2HG2 VAL 89 3HG1 VAL 89 -7.403 -7.918 -0.955 704 3HG2 VAL 89 1HG1 VAL 89 -8.685 -8.892 -1.785 705 H LYS 90 H LYS 90 -8.769 -13.002 0.668 706 HA LYS 90 HA LYS 90 -8.939 -13.845 -2.051 707 1HB LYS 90 1HB LYS 90 -8.324 -15.939 -1.305 708 2HB LYS 90 2HB LYS 90 -7.602 -14.828 -0.176 709 1HG LYS 90 1HG LYS 90 -9.453 -15.352 1.497 710 2HG LYS 90 2HG LYS 90 -10.110 -16.544 0.395 711 1HD LYS 90 1HD LYS 90 -7.259 -16.619 1.571 712 2HD LYS 90 2HD LYS 90 -8.625 -17.466 2.257 713 1HE LYS 90 1HE LYS 90 -7.454 -18.009 -0.560 714 2HE LYS 90 2HE LYS 90 -7.082 -18.928 0.894 715 1HZ LYS 90 1HZ LYS 90 -9.381 -19.592 1.058 716 2HZ LYS 90 2HZ LYS 90 -8.753 -20.026 -0.388 717 1H MET 1 1H MET 91 9.932 -0.205 9.221 718 2H MET 1 2H MET 91 10.949 -0.942 10.338 719 HA MET 1 HA MET 91 9.668 0.124 11.761 720 1HB MET 1 1HB MET 91 7.395 -0.131 9.694 721 2HB MET 1 2HB MET 91 7.145 0.532 11.272 722 1HG MET 1 1HG MET 91 8.806 2.387 10.777 723 2HG MET 1 2HG MET 91 8.995 1.724 9.132 724 1HE MET 1 2HE MET 91 8.039 3.584 7.651 725 2HE MET 1 1HE MET 91 6.585 4.542 8.040 726 3HE MET 1 3HE MET 91 8.034 4.653 9.087 727 H ASN 2 H ASN 92 6.871 -1.649 11.152 728 HA ASN 2 HA ASN 92 6.967 -4.117 11.574 729 1HB ASN 2 1HB ASN 92 7.009 -5.155 13.709 730 2HB ASN 2 2HB ASN 92 8.478 -4.244 13.495 731 1HD2 ASN 2 1HD2 ASN 92 8.011 -2.441 16.557 732 2HD2 ASN 2 2HD2 ASN 92 9.076 -2.818 15.111 733 H LYS 3 H LYS 93 5.456 -1.525 13.152 734 HA LYS 3 HA LYS 93 2.924 -1.238 12.352 735 1HB LYS 3 1HB LYS 93 2.257 -3.625 12.451 736 2HB LYS 3 2HB LYS 93 2.715 -3.751 14.137 737 1HG LYS 3 1HG LYS 93 0.297 -3.791 13.923 738 2HG LYS 3 2HG LYS 93 0.789 -2.371 14.814 739 1HD LYS 3 1HD LYS 93 -0.914 -1.560 13.430 740 2HD LYS 3 2HD LYS 93 0.540 -1.002 12.640 741 1HE LYS 3 1HE LYS 93 -0.741 -1.735 10.818 742 2HE LYS 3 2HE LYS 93 0.304 -3.134 11.067 743 1HZ LYS 3 1HZ LYS 93 -2.486 -2.820 12.047 744 2HZ LYS 3 2HZ LYS 93 -2.011 -3.736 10.779 745 H THR 4 H THR 94 4.924 -1.585 15.243 746 HA THR 4 HA THR 94 3.357 0.281 16.852 747 HB THR 4 HB THR 94 5.784 -1.604 17.246 748 HG1 THR 4 HG1 THR 94 3.721 -2.624 17.109 749 1HG2 THR 4 3HG2 THR 94 4.267 0.212 19.134 750 2HG2 THR 4 1HG2 THR 94 5.418 -1.113 19.642 751 3HG2 THR 4 2HG2 THR 94 6.003 0.284 18.657 752 H GLU 5 H GLU 95 6.260 -0.054 14.880 753 HA GLU 5 HA GLU 95 7.504 2.585 15.701 754 1HB GLU 5 1HB GLU 95 8.029 1.005 13.154 755 2HB GLU 5 2HB GLU 95 8.925 2.412 13.678 756 1HG GLU 5 1HG GLU 95 8.894 -0.364 14.986 757 2HG GLU 5 2HG GLU 95 10.170 0.289 13.996 758 HE1 GLU 5 HE2 GLU 95 11.596 2.275 16.461 759 H LEU 6 H LEU 96 4.888 1.415 13.900 760 HA LEU 6 HA LEU 96 4.330 3.696 12.087 761 1HB LEU 6 2HB LEU 96 3.264 1.052 12.452 762 2HB LEU 6 1HB LEU 96 1.989 2.041 13.118 763 HG LEU 6 HG LEU 96 3.071 2.293 10.321 764 1HD1 LEU 6 2HD1 LEU 96 1.544 0.318 10.765 765 2HD1 LEU 6 3HD1 LEU 96 0.315 1.437 11.331 766 3HD1 LEU 6 1HD1 LEU 96 0.832 1.494 9.635 767 1HD2 LEU 6 2HD2 LEU 96 1.299 4.215 11.834 768 2HD2 LEU 6 3HD2 LEU 96 2.575 4.536 10.652 769 3HD2 LEU 6 1HD2 LEU 96 1.000 3.916 10.119 770 H ILE 7 H ILE 97 3.169 2.559 15.305 771 HA ILE 7 HA ILE 97 1.347 4.741 15.865 772 HB ILE 7 HB ILE 97 2.863 3.041 17.945 773 1HG1 ILE 7 1HG1 ILE 97 0.112 2.358 16.744 774 2HG1 ILE 7 2HG1 ILE 97 1.566 1.669 16.124 775 1HG2 ILE 7 2HG2 ILE 97 1.630 5.033 18.919 776 2HG2 ILE 7 3HG2 ILE 97 0.139 4.421 18.222 777 3HG2 ILE 7 1HG2 ILE 97 0.970 3.490 19.481 778 1HD1 ILE 7 3HD1 ILE 97 2.114 0.725 18.451 779 2HD1 ILE 7 1HD1 ILE 97 0.444 1.097 18.876 780 3HD1 ILE 7 2HD1 ILE 97 0.788 -0.002 17.512 781 H ASN 8 H ASN 98 4.728 4.287 16.889 782 HA ASN 8 HA ASN 98 4.944 7.009 18.049 783 1HB ASN 8 1HB ASN 98 7.243 5.136 17.119 784 2HB ASN 8 2HB ASN 98 7.470 6.602 18.045 785 1HD2 ASN 8 2HD2 ASN 98 6.701 3.255 20.145 786 2HD2 ASN 8 1HD2 ASN 98 7.024 3.284 18.339 787 H ALA 9 H ALA 99 4.961 6.073 14.739 788 HA ALA 9 HA ALA 99 6.467 8.466 13.701 789 1HB ALA 9 2HB ALA 99 5.935 6.272 12.214 790 2HB ALA 9 3HB ALA 99 4.243 6.766 12.256 791 3HB ALA 9 1HB ALA 99 5.370 7.823 11.476 792 H VAL 10 H VAL 100 3.049 7.500 14.243 793 HA VAL 10 HA VAL 100 1.993 9.819 13.035 794 HB VAL 10 HB VAL 100 0.330 8.153 14.936 795 1HG1 VAL 10 3HG2 VAL 100 -0.461 10.165 13.330 796 2HG1 VAL 10 1HG2 VAL 100 -0.632 8.794 12.190 797 3HG1 VAL 10 2HG2 VAL 100 -1.478 8.745 13.742 798 1HG2 VAL 10 1HG1 VAL 100 1.553 7.212 12.339 799 2HG2 VAL 10 2HG1 VAL 100 1.439 6.482 13.975 800 3HG2 VAL 10 3HG1 VAL 100 -0.024 6.530 12.946 801 H ALA 11 H ALA 101 2.177 8.662 16.231 802 HA ALA 11 HA ALA 101 1.271 11.093 17.331 803 1HB ALA 11 2HB ALA 101 1.169 8.875 18.592 804 2HB ALA 11 3HB ALA 101 2.944 8.841 18.704 805 3HB ALA 11 1HB ALA 101 2.007 10.063 19.620 806 H GLU 12 H GLU 102 4.502 10.303 16.293 807 HA GLU 12 HA GLU 102 5.671 12.674 17.725 808 1HB GLU 12 1HB GLU 102 7.130 10.659 17.324 809 2HB GLU 12 2HB GLU 102 6.952 10.868 15.589 810 1HG GLU 12 1HG GLU 102 9.121 11.702 16.229 811 2HG GLU 12 2HG GLU 102 8.165 13.076 15.716 812 HE1 GLU 12 HE2 GLU 102 9.467 12.675 19.531 813 H THR 13 H THR 103 4.761 11.856 14.296 814 HA THR 13 HA THR 103 5.145 14.788 13.671 815 HB THR 13 HB THR 103 6.026 12.771 12.343 816 HG1 THR 13 HG1 THR 103 6.270 14.976 11.880 817 1HG2 THR 13 3HG2 THR 103 3.905 11.672 11.712 818 2HG2 THR 13 1HG2 THR 103 3.431 13.117 10.784 819 3HG2 THR 13 2HG2 THR 103 4.865 12.168 10.301 820 H SER 14 H SER 104 2.821 13.545 14.947 821 HA SER 14 HA SER 104 0.829 15.651 13.842 822 1HB SER 14 1HB SER 104 -0.179 12.948 14.908 823 2HB SER 14 2HB SER 104 -1.123 14.233 14.171 824 HG SER 14 HG SER 104 0.092 13.929 12.258 825 H GLY 15 H GLY 105 1.925 14.039 16.859 826 1HA GLY 15 1HA GLY 105 1.555 14.618 19.117 827 2HA GLY 15 2HA GLY 105 1.059 16.221 18.580 828 H LEU 16 H LEU 106 -0.237 12.968 18.305 829 HA LEU 16 HA LEU 106 -2.870 13.650 19.636 830 1HB LEU 16 1HB LEU 106 -3.836 11.786 18.487 831 2HB LEU 16 2HB LEU 106 -3.392 13.167 17.506 832 HG LEU 16 HG LEU 106 -1.544 12.175 16.611 833 1HD1 LEU 16 2HD1 LEU 106 -0.648 10.901 18.617 834 2HD1 LEU 16 3HD1 LEU 106 -1.927 9.695 18.260 835 3HD1 LEU 16 1HD1 LEU 106 -0.569 10.016 17.090 836 1HD2 LEU 16 2HD2 LEU 106 -3.107 11.703 15.185 837 2HD2 LEU 16 3HD2 LEU 106 -1.673 10.645 15.183 838 3HD2 LEU 16 1HD2 LEU 106 -3.172 10.031 15.852 839 H SER 17 H SER 107 -2.518 10.726 19.808 840 HA SER 17 HA SER 107 -1.018 10.444 22.459 841 1HB SER 17 1HB SER 107 -3.749 9.122 22.149 842 2HB SER 17 2HB SER 107 -2.658 9.025 23.510 843 HG SER 17 HG SER 107 -4.280 10.558 23.838 844 H LYS 18 H LYS 108 -0.364 8.289 22.906 845 HA LYS 18 HA LYS 108 0.566 6.712 20.513 846 1HB LYS 18 1HB LYS 108 1.888 6.972 22.726 847 2HB LYS 18 2HB LYS 108 0.758 5.844 23.467 848 1HG LYS 18 1HG LYS 108 1.423 4.083 21.789 849 2HG LYS 18 2HG LYS 108 2.450 5.254 20.950 850 1HD LYS 18 1HD LYS 108 3.896 5.517 22.942 851 2HD LYS 18 2HD LYS 108 2.921 4.375 23.860 852 1HE LYS 18 1HE LYS 108 4.462 3.697 21.251 853 2HE LYS 18 2HE LYS 108 5.085 3.425 22.875 854 1HZ LYS 18 1HZ LYS 108 3.214 1.927 23.286 855 2HZ LYS 18 2HZ LYS 108 2.634 2.166 21.777 856 H LYS 19 H LYS 109 -1.890 6.249 23.034 857 HA LYS 19 HA LYS 109 -3.186 3.891 21.830 858 1HB LYS 19 2HB LYS 109 -3.516 4.688 24.216 859 2HB LYS 19 1HB LYS 109 -4.451 6.069 23.628 860 1HG LYS 19 1HG LYS 109 -6.141 4.447 22.637 861 2HG LYS 19 2HG LYS 109 -5.177 3.089 23.222 862 1HD LYS 19 1HD LYS 109 -5.485 3.914 25.605 863 2HD LYS 19 2HD LYS 109 -6.450 5.269 25.007 864 1HE LYS 19 1HE LYS 109 -8.150 3.637 24.047 865 2HE LYS 19 2HE LYS 109 -7.183 2.280 24.644 866 1HZ LYS 19 1HZ LYS 109 -8.930 2.804 26.168 867 2HZ LYS 19 2HZ LYS 109 -7.494 3.100 26.891 868 H ASP 20 H ASP 110 -3.616 7.459 21.177 869 HA ASP 20 HA ASP 110 -5.917 6.979 19.297 870 1HB ASP 20 1HB ASP 110 -4.109 9.432 19.763 871 2HB ASP 20 2HB ASP 110 -5.291 9.421 18.484 872 HD2 ASP 20 HD2 ASP 110 -6.561 10.942 21.634 873 H ALA 21 H ALA 111 -2.435 7.102 18.911 874 HA ALA 21 HA ALA 111 -2.434 7.124 15.938 875 1HB ALA 21 1HB ALA 111 -0.259 6.641 18.073 876 2HB ALA 21 2HB ALA 111 0.046 6.499 16.319 877 3HB ALA 21 3HB ALA 111 -0.489 8.009 17.006 878 H THR 22 H THR 112 -2.128 4.503 18.425 879 HA THR 22 HA THR 112 -1.940 2.273 16.626 880 HB THR 22 HB THR 112 -3.489 2.217 19.305 881 HG1 THR 22 HG1 THR 112 -1.584 3.371 19.605 882 1HG2 THR 22 2HG2 THR 112 -1.569 0.276 17.882 883 2HG2 THR 22 3HG2 THR 112 -2.242 0.023 19.519 884 3HG2 THR 22 1HG2 THR 112 -3.329 0.061 18.084 885 H LYS 23 H LYS 113 -4.797 3.774 17.941 886 HA LYS 23 HA LYS 113 -6.868 2.201 16.563 887 1HB LYS 23 2HB LYS 113 -6.712 5.178 17.506 888 2HB LYS 23 1HB LYS 113 -8.179 4.558 16.835 889 1HG LYS 23 1HG LYS 113 -8.430 2.855 18.663 890 2HG LYS 23 2HG LYS 113 -6.906 3.373 19.384 891 1HD LYS 23 1HD LYS 113 -7.841 5.696 19.730 892 2HD LYS 23 2HD LYS 113 -9.372 5.198 19.001 893 1HE LYS 23 1HE LYS 113 -9.720 3.498 20.840 894 2HE LYS 23 2HE LYS 113 -8.161 3.930 21.554 895 1HZ LYS 23 1HZ LYS 113 -9.922 5.076 22.656 896 2HZ LYS 23 2HZ LYS 113 -8.982 6.174 21.893 897 H ALA 24 H ALA 114 -5.570 5.343 15.744 898 HA ALA 24 HA ALA 114 -6.892 5.810 13.262 899 1HB ALA 24 2HB ALA 114 -5.845 7.513 14.606 900 2HB ALA 24 3HB ALA 114 -4.215 6.839 14.285 901 3HB ALA 24 1HB ALA 114 -5.181 7.566 12.951 902 H VAL 25 H VAL 115 -3.833 4.121 13.744 903 HA VAL 25 HA VAL 115 -3.208 3.458 10.916 904 HB VAL 25 HB VAL 115 -2.664 2.483 13.869 905 1HG1 VAL 25 2HG2 VAL 115 -1.858 0.767 11.457 906 2HG1 VAL 25 3HG2 VAL 115 -1.136 0.662 13.101 907 3HG1 VAL 25 1HG2 VAL 115 -2.839 0.293 12.849 908 1HG2 VAL 25 3HG1 VAL 115 -0.800 3.402 11.646 909 2HG2 VAL 25 1HG1 VAL 115 -1.332 4.358 13.043 910 3HG2 VAL 25 2HG1 VAL 115 -0.303 2.943 13.313 911 H ASP 26 H ASP 116 -4.900 1.497 13.467 912 HA ASP 26 HA ASP 116 -6.222 -0.165 11.294 913 1HB ASP 26 1HB ASP 116 -5.455 -0.957 13.659 914 2HB ASP 26 2HB ASP 116 -6.868 -0.112 14.298 915 HD2 ASP 26 HD2 ASP 116 -8.938 -2.785 13.685 916 H ALA 27 H ALA 117 -6.705 2.586 11.605 917 HA ALA 27 HA ALA 117 -9.685 2.708 11.088 918 1HB ALA 27 2HB ALA 117 -8.398 4.270 12.931 919 2HB ALA 27 3HB ALA 117 -8.088 5.222 11.498 920 3HB ALA 27 1HB ALA 117 -9.747 4.869 12.046 921 H VAL 28 H VAL 118 -6.624 3.906 9.803 922 HA VAL 28 HA VAL 118 -7.560 4.451 7.039 923 HB VAL 28 HB VAL 118 -4.722 3.677 8.103 924 1HG1 VAL 28 1HG2 VAL 118 -5.456 4.904 5.366 925 2HG1 VAL 28 2HG2 VAL 118 -3.815 4.729 6.025 926 3HG1 VAL 28 3HG2 VAL 118 -4.744 3.275 5.687 927 1HG2 VAL 28 3HG1 VAL 118 -5.501 5.760 8.983 928 2HG2 VAL 28 1HG1 VAL 118 -4.123 5.947 7.841 929 3HG2 VAL 28 2HG1 VAL 118 -5.826 6.340 7.293 930 H PHE 29 H PHE 119 -5.587 1.984 8.381 931 HA PHE 29 HA PHE 119 -5.718 0.040 6.154 932 1HB PHE 29 2HB PHE 119 -4.640 -0.525 8.946 933 2HB PHE 29 1HB PHE 119 -4.340 -1.488 7.507 934 HD1 PHE 29 HD2 PHE 119 -3.557 0.068 5.325 935 HD2 PHE 29 HD1 PHE 119 -2.811 0.917 9.468 936 HE1 PHE 29 HE2 PHE 119 -1.924 1.765 4.680 937 HE2 PHE 29 HE1 PHE 119 -1.264 2.687 8.821 938 HZ PHE 29 HZ PHE 119 -0.902 3.177 6.409 939 H ASP 30 H ASP 120 -7.915 0.363 8.833 940 HA ASP 30 HA ASP 120 -9.033 -2.376 8.328 941 1HB ASP 30 1HB ASP 120 -9.089 -0.961 10.574 942 2HB ASP 30 2HB ASP 120 -10.467 -0.137 9.901 943 HD2 ASP 30 HD2 ASP 120 -10.744 -3.889 11.339 944 H SER 31 H SER 121 -9.706 0.850 7.465 945 HA SER 31 HA SER 121 -12.272 0.312 5.941 946 1HB SER 31 2HB SER 121 -10.580 2.871 6.012 947 2HB SER 31 1HB SER 121 -12.106 2.681 5.121 948 HG SER 31 HG SER 121 -11.725 2.284 7.906 949 H ILE 32 H ILE 122 -8.704 0.666 4.901 950 HA ILE 32 HA ILE 122 -9.079 0.244 2.160 951 HB ILE 32 HB ILE 122 -6.725 -0.822 3.702 952 1HG1 ILE 32 1HG1 ILE 122 -7.725 1.971 3.553 953 2HG1 ILE 32 2HG1 ILE 122 -6.879 1.021 4.750 954 1HG2 ILE 32 2HG2 ILE 122 -7.186 -1.099 1.091 955 2HG2 ILE 32 3HG2 ILE 122 -6.802 0.594 0.986 956 3HG2 ILE 32 1HG2 ILE 122 -5.583 -0.523 1.604 957 1HD1 ILE 32 2HD1 ILE 122 -5.461 2.183 2.365 958 2HD1 ILE 32 3HD1 ILE 122 -5.801 3.058 3.878 959 3HD1 ILE 32 1HD1 ILE 122 -4.779 1.573 3.947 960 H THR 33 H THR 123 -8.314 -2.155 4.680 961 HA THR 33 HA THR 123 -8.630 -4.434 2.809 962 HB THR 33 HB THR 123 -7.475 -4.777 4.968 963 HG1 THR 33 HG1 THR 123 -9.794 -6.353 4.822 964 1HG2 THR 33 2HG2 THR 123 -8.985 -3.297 6.371 965 2HG2 THR 33 3HG2 THR 123 -10.159 -4.596 6.453 966 3HG2 THR 33 1HG2 THR 123 -8.515 -4.806 7.168 967 H GLU 34 H GLU 124 -11.078 -2.706 4.665 968 HA GLU 34 HA GLU 124 -13.326 -4.517 3.846 969 1HB GLU 34 1HB GLU 124 -13.326 -1.626 4.928 970 2HB GLU 34 2HB GLU 124 -14.799 -2.447 4.438 971 1HG GLU 34 1HG GLU 124 -14.510 -4.224 6.141 972 2HG GLU 34 2HG GLU 124 -12.942 -3.593 6.617 973 HE2 GLU 34 HE2 GLU 124 -16.341 -1.970 7.988 974 H ALA 35 H ALA 125 -11.744 -1.651 2.412 975 HA ALA 35 HA ALA 125 -13.534 -1.552 0.102 976 1HB ALA 35 2HB ALA 125 -11.637 0.385 0.713 977 2HB ALA 35 3HB ALA 125 -10.465 -0.753 0.111 978 3HB ALA 35 1HB ALA 125 -11.623 -0.094 -0.987 979 H LEU 36 H LEU 126 -10.292 -3.074 0.482 980 HA LEU 36 HA LEU 126 -10.118 -4.338 -2.124 981 1HB LEU 36 2HB LEU 126 -8.749 -5.214 0.350 982 2HB LEU 36 1HB LEU 126 -8.232 -5.402 -1.309 983 HG LEU 36 HG LEU 126 -8.249 -2.768 0.220 984 1HD1 LEU 36 3HD2 LEU 126 -6.207 -4.004 0.369 985 2HD1 LEU 36 1HD2 LEU 126 -6.055 -3.989 -1.447 986 3HD1 LEU 36 2HD2 LEU 126 -6.008 -2.463 -0.502 987 1HD2 LEU 36 3HD1 LEU 126 -9.278 -2.160 -1.958 988 2HD2 LEU 36 1HD1 LEU 126 -7.672 -1.485 -1.789 989 3HD2 LEU 36 2HD1 LEU 126 -7.921 -2.942 -2.818 990 NH1 ARG 37 NH2 ARG 127 -12.508 -8.821 7.005 991 NH2 ARG 37 NH1 ARG 127 -10.636 -7.544 6.954 992 H ARG 37 H ARG 127 -11.212 -5.663 1.059 993 HA ARG 37 HA ARG 127 -11.647 -8.239 -0.126 994 1HB ARG 37 1HB ARG 127 -12.467 -9.141 1.815 995 2HB ARG 37 2HB ARG 127 -11.205 -8.029 2.297 996 1HG ARG 37 1HG ARG 127 -13.152 -6.331 2.840 997 2HG ARG 37 2HG ARG 127 -14.253 -7.629 2.497 998 1HD ARG 37 1HD ARG 127 -14.054 -7.606 4.810 999 2HD ARG 37 2HD ARG 127 -13.198 -9.061 4.238 1000 1HH1 ARG 37 2HH2 ARG 127 -13.348 -9.149 6.515 1001 2HH1 ARG 37 1HH2 ARG 127 -12.212 -9.073 7.954 1002 1HH2 ARG 37 1HH1 ARG 127 -10.037 -6.898 6.428 1003 2HH2 ARG 37 2HH1 ARG 127 -10.479 -7.892 7.906 1004 H LYS 38 H LYS 128 -13.588 -5.297 -0.114 1005 HA LYS 38 HA LYS 128 -16.122 -6.854 -0.835 1006 1HB LYS 38 1HB LYS 128 -15.938 -3.941 0.051 1007 2HB LYS 38 2HB LYS 128 -17.411 -4.774 -0.390 1008 1HG LYS 38 1HG LYS 128 -17.229 -6.336 1.529 1009 2HG LYS 38 2HG LYS 128 -15.667 -5.660 1.977 1010 1HD LYS 38 1HD LYS 128 -16.843 -3.348 2.199 1011 2HD LYS 38 2HD LYS 128 -18.378 -4.189 2.061 1012 1HE LYS 38 1HE LYS 128 -16.209 -4.729 4.215 1013 2HE LYS 38 2HE LYS 128 -17.602 -3.676 4.437 1014 1HZ LYS 38 1HZ LYS 128 -17.766 -6.582 3.865 1015 2HZ LYS 38 2HZ LYS 128 -19.052 -5.594 4.062 1016 H GLY 39 H GLY 129 -13.669 -5.798 -2.631 1017 1HA GLY 39 1HA GLY 129 -13.508 -5.236 -4.957 1018 2HA GLY 39 2HA GLY 129 -15.246 -5.357 -5.094 1019 H ASP 40 H ASP 130 -13.431 -3.151 -3.027 1020 HA ASP 40 HA ASP 130 -14.297 -0.711 -4.660 1021 1HB ASP 40 1HB ASP 130 -13.838 -0.618 -1.699 1022 2HB ASP 40 2HB ASP 130 -14.385 0.661 -2.729 1023 HD2 ASP 40 HD2 ASP 130 -16.939 -2.052 -1.286 1024 H LYS 41 H LYS 131 -12.952 0.730 -5.335 1025 HA LYS 41 HA LYS 131 -9.989 0.269 -4.978 1026 1HB LYS 41 2HB LYS 131 -11.196 2.508 -6.630 1027 2HB LYS 41 1HB LYS 131 -9.544 1.906 -6.679 1028 1HG LYS 41 1HG LYS 131 -10.514 -0.347 -7.540 1029 2HG LYS 41 2HG LYS 131 -12.069 0.473 -7.699 1030 1HD LYS 41 1HD LYS 131 -10.996 2.181 -9.238 1031 2HD LYS 41 2HD LYS 131 -9.463 1.332 -9.127 1032 1HE LYS 41 1HE LYS 131 -12.085 0.129 -10.262 1033 2HE LYS 41 2HE LYS 131 -10.793 0.834 -11.229 1034 1HZ LYS 41 1HZ LYS 131 -10.598 -1.531 -11.171 1035 2HZ LYS 41 2HZ LYS 131 -9.291 -0.867 -10.448 1036 H VAL 42 H VAL 132 -8.925 1.345 -3.396 1037 HA VAL 42 HA VAL 132 -9.925 3.681 -2.000 1038 HB VAL 42 HB VAL 132 -7.468 1.816 -1.871 1039 1HG1 VAL 42 1HG2 VAL 132 -8.594 3.692 0.190 1040 2HG1 VAL 42 2HG2 VAL 132 -7.334 2.459 0.519 1041 3HG1 VAL 42 3HG2 VAL 132 -6.959 3.762 -0.637 1042 1HG2 VAL 42 1HG1 VAL 132 -10.021 1.848 -0.168 1043 2HG2 VAL 42 2HG1 VAL 132 -9.562 0.602 -1.406 1044 3HG2 VAL 42 3HG1 VAL 132 -8.638 0.755 0.080 1045 H GLN 43 H GLN 133 -8.748 5.355 -1.845 1046 HA GLN 43 HA GLN 133 -6.573 6.099 -3.822 1047 1HB GLN 43 1HB GLN 133 -9.178 7.547 -4.122 1048 2HB GLN 43 2HB GLN 133 -7.641 8.078 -4.814 1049 1HG GLN 43 1HG GLN 133 -7.534 5.845 -6.021 1050 2HG GLN 43 2HG GLN 133 -9.093 5.419 -5.321 1051 1HE2 GLN 43 2HE2 GLN 133 -10.254 6.439 -8.545 1052 2HE2 GLN 43 1HE2 GLN 133 -9.568 5.054 -7.566 1053 H LEU 44 H LEU 134 -5.196 7.581 -3.491 1054 HA LEU 44 HA LEU 134 -5.246 9.314 -0.987 1055 1HB LEU 44 2HB LEU 134 -3.030 7.272 -1.649 1056 2HB LEU 44 1HB LEU 134 -2.817 8.550 -0.468 1057 HG LEU 44 HG LEU 134 -4.990 6.392 -0.187 1058 1HD1 LEU 44 1HD1 LEU 134 -2.789 5.248 -0.313 1059 2HD1 LEU 44 2HD1 LEU 134 -2.120 6.318 0.944 1060 3HD1 LEU 44 3HD1 LEU 134 -3.430 5.179 1.339 1061 1HD2 LEU 44 2HD2 LEU 134 -5.339 8.425 1.258 1062 2HD2 LEU 44 3HD2 LEU 134 -4.910 7.018 2.250 1063 3HD2 LEU 44 1HD2 LEU 134 -3.691 8.268 1.914 1064 H ILE 45 H ILE 135 -4.744 11.313 -1.836 1065 HA ILE 45 HA ILE 135 -3.400 11.559 -4.455 1066 HB ILE 45 HB ILE 135 -5.318 12.993 -3.737 1067 1HG1 ILE 45 1HG1 ILE 135 -2.892 14.590 -4.740 1068 2HG1 ILE 45 2HG1 ILE 135 -3.788 13.446 -5.724 1069 1HG2 ILE 45 3HG2 ILE 135 -4.458 13.572 -1.427 1070 2HG2 ILE 45 1HG2 ILE 135 -3.223 14.615 -2.169 1071 3HG2 ILE 45 2HG2 ILE 135 -4.960 15.001 -2.366 1072 1HD1 ILE 45 2HD1 ILE 135 -5.909 14.802 -5.432 1073 2HD1 ILE 45 3HD1 ILE 135 -4.983 16.014 -4.504 1074 3HD1 ILE 45 1HD1 ILE 135 -4.592 15.711 -6.211 1075 H GLY 46 H GLY 136 -1.507 12.573 -4.898 1076 1HA GLY 46 1HA GLY 136 0.869 12.791 -4.741 1077 2HA GLY 46 2HA GLY 136 0.610 13.310 -3.098 1078 H PHE 47 H PHE 137 -0.437 10.104 -3.203 1079 HA PHE 47 HA PHE 137 2.275 8.854 -2.759 1080 1HB PHE 47 2HB PHE 137 1.118 9.915 -0.704 1081 2HB PHE 47 1HB PHE 137 -0.157 8.737 -0.817 1082 HD1 PHE 47 HD1 PHE 137 3.579 9.042 -0.267 1083 HD2 PHE 47 HD2 PHE 137 0.182 6.392 -0.168 1084 HE1 PHE 47 HE1 PHE 137 5.001 7.159 0.532 1085 HE2 PHE 47 HE2 PHE 137 1.643 4.575 0.605 1086 HZ PHE 47 HZ PHE 137 4.086 4.983 0.851 1087 H GLY 48 H GLY 138 -1.244 8.057 -3.315 1088 1HA GLY 48 1HA GLY 138 -0.455 5.412 -4.314 1089 2HA GLY 48 2HA GLY 138 -1.109 5.277 -2.701 1090 H ASN 49 H ASN 139 -2.046 3.838 -4.600 1091 HA ASN 49 HA ASN 139 -4.946 4.501 -4.456 1092 1HB ASN 49 1HB ASN 139 -4.487 5.695 -6.524 1093 2HB ASN 49 2HB ASN 139 -3.626 4.354 -7.231 1094 1HD2 ASN 49 1HD2 ASN 139 -6.889 4.354 -8.914 1095 2HD2 ASN 49 2HD2 ASN 139 -5.357 5.357 -8.793 1096 H PHE 50 H PHE 140 -5.228 2.688 -3.242 1097 HA PHE 50 HA PHE 140 -4.077 0.034 -4.087 1098 1HB PHE 50 2HB PHE 140 -6.137 0.382 -1.857 1099 2HB PHE 50 1HB PHE 140 -5.405 -1.074 -2.258 1100 HD1 PHE 50 HD1 PHE 140 -4.853 2.364 -0.990 1101 HD2 PHE 50 HD2 PHE 140 -3.574 -1.732 -0.918 1102 HE1 PHE 50 HE1 PHE 140 -3.370 2.846 0.951 1103 HE2 PHE 50 HE2 PHE 140 -2.122 -1.219 1.026 1104 HZ PHE 50 HZ PHE 140 -1.934 1.100 1.803 1105 H GLU 51 H GLU 141 -5.256 -1.596 -4.980 1106 HA GLU 51 HA GLU 141 -8.134 -1.506 -5.186 1107 1HB GLU 51 1HB GLU 141 -8.423 -1.330 -7.727 1108 2HB GLU 51 2HB GLU 141 -7.889 0.163 -6.986 1109 1HG GLU 51 1HG GLU 141 -5.507 -0.285 -7.756 1110 2HG GLU 51 2HG GLU 141 -6.036 -1.783 -8.509 1111 HE1 GLU 51 HE2 GLU 141 -6.901 1.834 -10.128 1112 H VAL 52 H VAL 142 -9.113 -3.445 -5.725 1113 HA VAL 52 HA VAL 142 -7.200 -5.638 -5.582 1114 HB VAL 52 HB VAL 142 -9.556 -4.812 -4.239 1115 1HG1 VAL 52 1HG2 VAL 142 -10.445 -6.954 -6.191 1116 2HG1 VAL 52 2HG2 VAL 142 -11.299 -6.428 -4.694 1117 3HG1 VAL 52 3HG2 VAL 142 -11.027 -5.286 -6.051 1118 1HG2 VAL 52 2HG1 VAL 142 -7.824 -6.184 -3.325 1119 2HG2 VAL 52 3HG1 VAL 142 -9.421 -6.841 -3.024 1120 3HG2 VAL 52 1HG1 VAL 142 -8.407 -7.604 -4.250 1121 NH1 ARG 53 NH2 ARG 143 -6.406 -4.256 -10.163 1122 NH2 ARG 53 NH1 ARG 143 -4.254 -4.058 -10.858 1123 H ARG 53 H ARG 143 -7.473 -7.612 -6.811 1124 HA ARG 53 HA ARG 143 -8.529 -7.116 -9.676 1125 1HB ARG 53 1HB ARG 143 -5.857 -7.145 -9.236 1126 2HB ARG 53 2HB ARG 143 -6.090 -8.866 -9.213 1127 1HG ARG 53 1HG ARG 143 -5.544 -8.474 -11.447 1128 2HG ARG 53 2HG ARG 143 -7.276 -8.712 -11.495 1129 1HD ARG 53 1HD ARG 143 -6.781 -6.868 -12.958 1130 2HD ARG 53 2HD ARG 143 -7.605 -6.159 -11.588 1131 1HH1 ARG 53 2HH2 ARG 143 -7.289 -4.776 -10.219 1132 2HH1 ARG 53 1HH2 ARG 143 -6.216 -3.428 -9.587 1133 1HH2 ARG 53 1HH1 ARG 143 -3.494 -4.423 -11.442 1134 2HH2 ARG 53 2HH1 ARG 143 -4.214 -3.246 -10.232 1135 H GLU 54 H GLU 144 -10.428 -8.156 -9.457 1136 HA GLU 54 HA GLU 144 -10.769 -10.756 -8.128 1137 1HB GLU 54 1HB GLU 144 -13.036 -10.820 -8.890 1138 2HB GLU 54 2HB GLU 144 -12.609 -9.320 -8.100 1139 1HG GLU 54 1HG GLU 144 -12.495 -8.150 -10.354 1140 2HG GLU 54 2HG GLU 144 -12.941 -9.653 -11.157 1141 HE1 GLU 54 HE2 GLU 144 -16.284 -9.567 -10.265 1142 NH1 ARG 55 NH2 ARG 145 -4.850 -16.934 -11.030 1143 NH2 ARG 55 NH1 ARG 145 -5.351 -19.005 -11.823 1144 H ARG 55 H ARG 145 -9.976 -12.577 -8.763 1145 HA ARG 55 HA ARG 145 -9.034 -13.199 -11.438 1146 1HB ARG 55 1HB ARG 145 -8.177 -14.183 -9.272 1147 2HB ARG 55 2HB ARG 145 -9.645 -15.141 -9.126 1148 1HG ARG 55 1HG ARG 145 -9.066 -16.343 -11.279 1149 2HG ARG 55 2HG ARG 145 -7.608 -15.355 -11.433 1150 1HD ARG 55 1HD ARG 145 -6.763 -16.294 -9.213 1151 2HD ARG 55 2HD ARG 145 -8.237 -17.246 -9.073 1152 1HH1 ARG 55 2HH2 ARG 145 -5.158 -16.114 -10.497 1153 2HH1 ARG 55 1HH2 ARG 145 -3.940 -17.065 -11.486 1154 1HH2 ARG 55 1HH1 ARG 145 -6.039 -19.763 -11.897 1155 2HH2 ARG 55 2HH1 ARG 145 -4.408 -18.990 -12.225 1156 H ALA 56 H ALA 146 -9.824 -14.554 -13.003 1157 HA ALA 56 HA ALA 146 -12.747 -14.408 -13.459 1158 1HB ALA 56 3HB ALA 146 -11.154 -14.024 -15.305 1159 2HB ALA 56 1HB ALA 146 -10.577 -15.708 -15.213 1160 3HB ALA 56 2HB ALA 146 -12.256 -15.357 -15.688 1161 H ALA 57 H ALA 147 -13.770 -15.741 -12.012 1162 HA ALA 57 HA ALA 147 -13.511 -18.418 -11.410 1163 1HB ALA 57 1HB ALA 147 -15.333 -16.908 -10.491 1164 2HB ALA 57 2HB ALA 147 -16.209 -16.996 -12.037 1165 3HB ALA 57 3HB ALA 147 -16.039 -18.442 -11.027 1166 NH1 ARG 58 NH2 ARG 148 -10.634 -19.087 -18.002 1167 NH2 ARG 58 NH1 ARG 148 -12.377 -17.789 -17.333 1168 H ARG 58 H ARG 148 -13.597 -20.319 -12.108 1169 HA ARG 58 HA ARG 148 -13.970 -20.596 -15.032 1170 1HB ARG 58 2HB ARG 148 -12.607 -22.588 -13.168 1171 2HB ARG 58 1HB ARG 148 -12.597 -22.698 -14.912 1172 1HG ARG 58 1HG ARG 148 -11.259 -20.397 -13.346 1173 2HG ARG 58 2HG ARG 148 -10.483 -21.885 -13.815 1174 1HD ARG 58 1HD ARG 148 -9.803 -20.283 -15.435 1175 2HD ARG 58 2HD ARG 148 -10.894 -21.396 -16.263 1176 1HH1 ARG 58 2HH2 ARG 148 -10.004 -19.867 -17.786 1177 2HH1 ARG 58 1HH2 ARG 148 -10.632 -18.513 -18.853 1178 1HH2 ARG 58 1HH1 ARG 148 -13.074 -17.579 -16.610 1179 2HH2 ARG 58 2HH1 ARG 148 -12.254 -17.304 -18.229 1180 H LYS 59 H LYS 149 -14.357 -23.358 -15.245 1181 HA LYS 59 HA LYS 149 -17.044 -23.990 -13.973 1182 1HB LYS 59 1HB LYS 149 -16.670 -23.917 -17.036 1183 2HB LYS 59 2HB LYS 149 -17.976 -24.766 -16.221 1184 1HG LYS 59 1HG LYS 149 -18.755 -22.605 -15.162 1185 2HG LYS 59 2HG LYS 149 -17.494 -21.732 -16.035 1186 1HD LYS 59 1HD LYS 149 -18.475 -22.495 -18.237 1187 2HD LYS 59 2HD LYS 149 -19.736 -23.382 -17.371 1188 1HE LYS 59 1HE LYS 149 -20.563 -21.203 -16.344 1189 2HE LYS 59 2HE LYS 149 -19.305 -20.316 -17.218 1190 1HZ LYS 59 1HZ LYS 149 -21.420 -20.282 -18.365 1191 2HZ LYS 59 2HZ LYS 149 -21.479 -21.913 -18.454 1192 H GLY 60 H GLY 150 -17.018 -26.005 -13.301 1193 1HA GLY 60 1HA GLY 150 -15.640 -28.237 -14.757 1194 2HA GLY 60 2HA GLY 150 -14.816 -27.780 -13.265 1195 NH1 ARG 61 NH2 ARG 151 -18.766 -36.222 -13.643 1196 NH2 ARG 61 NH1 ARG 151 -19.667 -35.367 -15.547 1197 H ARG 61 H ARG 151 -15.469 -28.971 -11.586 1198 HA ARG 61 HA ARG 151 -18.359 -29.794 -11.178 1199 1HB ARG 61 1HB ARG 151 -16.047 -31.829 -11.477 1200 2HB ARG 61 2HB ARG 151 -17.535 -32.213 -10.635 1201 1HG ARG 61 1HG ARG 151 -18.879 -31.666 -12.720 1202 2HG ARG 61 2HG ARG 151 -17.362 -31.502 -13.612 1203 1HD ARG 61 1HD ARG 151 -16.754 -33.889 -13.044 1204 2HD ARG 61 2HD ARG 151 -18.219 -34.034 -12.058 1205 1HH1 ARG 61 2HH2 ARG 151 -18.236 -36.046 -12.782 1206 2HH1 ARG 61 1HH2 ARG 151 -19.142 -37.122 -13.960 1207 1HH2 ARG 61 1HH1 ARG 151 -19.827 -34.544 -16.138 1208 2HH2 ARG 61 2HH1 ARG 151 -19.981 -36.326 -15.731 1209 H ASN 62 H ASN 152 -18.807 -30.704 -9.182 1210 HA ASN 62 HA ASN 152 -17.455 -29.462 -6.871 1211 1HB ASN 62 1HB ASN 152 -19.938 -29.776 -7.090 1212 2HB ASN 62 2HB ASN 152 -19.734 -31.516 -6.981 1213 1HD2 ASN 62 2HD2 ASN 152 -19.861 -29.433 -3.523 1214 2HD2 ASN 62 1HD2 ASN 152 -19.921 -28.599 -5.156 1215 HA PRO 63 HA PRO 153 -14.370 -32.869 -6.407 1216 1HB PRO 63 1HB PRO 153 -14.395 -31.981 -3.473 1217 2HB PRO 63 2HB PRO 153 -13.004 -32.359 -4.513 1218 1HG PRO 63 1HG PRO 153 -13.693 -29.767 -4.097 1219 2HG PRO 63 2HG PRO 153 -13.253 -30.287 -5.743 1220 1HD PRO 63 1HD PRO 153 -16.063 -29.820 -4.609 1221 2HD PRO 63 2HD PRO 153 -15.383 -29.382 -6.208 1222 H GLN 64 H GLN 154 -17.113 -32.900 -4.104 1223 HA GLN 64 HA GLN 154 -16.528 -35.774 -3.291 1224 1HB GLN 64 1HB GLN 154 -18.786 -33.932 -2.313 1225 2HB GLN 64 2HB GLN 154 -18.402 -35.515 -1.683 1226 1HG GLN 64 1HG GLN 154 -16.581 -33.022 -1.500 1227 2HG GLN 64 2HG GLN 154 -17.769 -33.547 -0.332 1228 1HE2 GLN 64 2HE2 GLN 154 -14.103 -35.406 -0.343 1229 2HE2 GLN 64 1HE2 GLN 154 -14.566 -34.110 -1.556 1230 H THR 65 H THR 155 -19.489 -34.092 -4.032 1231 HA THR 65 HA THR 155 -20.971 -36.267 -5.047 1232 HB THR 65 HB THR 155 -22.680 -34.734 -5.861 1233 HG1 THR 65 HG1 THR 155 -22.290 -32.531 -5.879 1234 1HG2 THR 65 1HG2 THR 155 -22.460 -34.947 -3.342 1235 2HG2 THR 65 2HG2 THR 155 -21.418 -33.503 -3.331 1236 3HG2 THR 65 3HG2 THR 155 -23.110 -33.364 -3.856 1237 H GLY 66 H GLY 156 -19.088 -34.130 -7.185 1238 1HA GLY 66 1HA GLY 156 -18.405 -34.537 -9.466 1239 2HA GLY 66 2HA GLY 156 -19.220 -36.090 -9.453 1240 H GLU 67 H GLU 157 -20.610 -32.879 -8.755 1241 HA GLU 67 HA GLU 157 -22.503 -33.087 -11.149 1242 1HB GLU 67 2HB GLU 157 -23.412 -33.240 -8.725 1243 2HB GLU 67 1HB GLU 157 -22.936 -31.571 -8.472 1244 1HG GLU 67 1HG GLU 157 -24.904 -32.534 -10.663 1245 2HG GLU 67 2HG GLU 157 -25.393 -32.049 -9.052 1246 HE1 GLU 67 HE2 GLU 157 -24.703 -28.612 -9.511 1247 H GLU 68 H GLU 158 -22.539 -31.355 -12.464 1248 HA GLU 68 HA GLU 158 -20.218 -29.763 -12.744 1249 1HB GLU 68 1HB GLU 158 -22.955 -29.240 -14.075 1250 2HB GLU 68 2HB GLU 158 -21.492 -28.369 -14.472 1251 1HG GLU 68 1HG GLU 158 -21.577 -29.958 -16.157 1252 2HG GLU 68 2HG GLU 158 -20.346 -30.593 -15.085 1253 HE2 GLU 68 HE2 GLU 158 -22.038 -33.526 -14.428 1254 H MET 69 H MET 159 -19.488 -28.052 -11.849 1255 HA MET 69 HA MET 159 -21.242 -25.991 -10.421 1256 1HB MET 69 1HB MET 159 -20.621 -27.788 -8.792 1257 2HB MET 69 2HB MET 159 -18.930 -27.648 -9.246 1258 1HG MET 69 1HG MET 159 -19.206 -25.120 -8.273 1259 2HG MET 69 2HG MET 159 -20.576 -25.853 -7.438 1260 1HE MET 69 3HE MET 159 -16.874 -27.066 -8.612 1261 2HE MET 69 2HE MET 159 -16.613 -25.540 -7.729 1262 3HE MET 69 1HE MET 159 -16.054 -27.093 -7.036 1263 H GLU 70 H GLU 160 -20.333 -24.083 -10.283 1264 HA GLU 70 HA GLU 160 -18.069 -23.363 -12.130 1265 1HB GLU 70 2HB GLU 160 -18.620 -21.091 -11.948 1266 2HB GLU 70 1HB GLU 160 -20.112 -21.993 -12.170 1267 1HG GLU 70 1HG GLU 160 -20.757 -20.372 -10.637 1268 2HG GLU 70 2HG GLU 160 -20.486 -21.745 -9.583 1269 HE1 GLU 70 HE2 GLU 160 -17.945 -18.536 -9.591 1270 H ILE 71 H ILE 161 -15.982 -22.841 -11.520 1271 HA ILE 71 HA ILE 161 -15.153 -23.335 -8.731 1272 HB ILE 71 HB ILE 161 -13.503 -22.494 -11.173 1273 1HG1 ILE 71 1HG1 ILE 161 -14.511 -24.470 -11.995 1274 2HG1 ILE 71 2HG1 ILE 161 -12.853 -24.826 -11.593 1275 1HG2 ILE 71 2HG2 ILE 161 -12.347 -22.200 -9.040 1276 2HG2 ILE 71 3HG2 ILE 161 -12.685 -23.897 -8.590 1277 3HG2 ILE 71 1HG2 ILE 161 -11.610 -23.524 -9.980 1278 1HD1 ILE 71 1HD1 ILE 161 -13.644 -25.968 -9.444 1279 2HD1 ILE 71 2HD1 ILE 161 -15.328 -25.619 -9.931 1280 3HD1 ILE 71 3HD1 ILE 161 -14.321 -26.697 -10.928 1281 HA PRO 72 HA PRO 162 -16.017 -18.819 -8.295 1282 1HB PRO 72 1HB PRO 162 -15.459 -18.427 -5.578 1283 2HB PRO 72 2HB PRO 162 -16.884 -19.262 -6.211 1284 1HG PRO 72 1HG PRO 162 -14.274 -20.522 -5.224 1285 2HG PRO 72 2HG PRO 162 -15.939 -20.959 -4.766 1286 1HD PRO 72 1HD PRO 162 -14.561 -22.358 -6.702 1287 2HD PRO 72 2HD PRO 162 -16.325 -22.090 -6.859 1288 H ALA 73 H ALA 163 -15.149 -16.799 -7.833 1289 HA ALA 73 HA ALA 163 -12.451 -16.282 -8.884 1290 1HB ALA 73 2HB ALA 163 -14.446 -14.629 -9.025 1291 2HB ALA 73 3HB ALA 163 -14.315 -14.378 -7.247 1292 3HB ALA 73 1HB ALA 163 -13.011 -13.872 -8.311 1293 H SER 74 H SER 164 -11.078 -14.681 -7.832 1294 HA SER 74 HA SER 164 -11.358 -14.309 -5.023 1295 1HB SER 74 1HB SER 164 -8.641 -15.668 -5.801 1296 2HB SER 74 2HB SER 164 -8.881 -14.855 -4.252 1297 HG SER 74 HG SER 164 -10.597 -16.277 -3.829 1298 H LYS 75 H LYS 165 -10.931 -12.388 -4.434 1299 HA LYS 75 HA LYS 165 -9.806 -10.382 -6.332 1300 1HB LYS 75 2HB LYS 165 -10.409 -9.455 -3.569 1301 2HB LYS 75 1HB LYS 165 -10.608 -8.696 -5.112 1302 1HG LYS 75 1HG LYS 165 -12.603 -10.180 -5.613 1303 2HG LYS 75 2HG LYS 165 -12.447 -10.882 -4.000 1304 1HD LYS 75 1HD LYS 165 -12.753 -8.580 -2.982 1305 2HD LYS 75 2HD LYS 165 -12.994 -7.898 -4.584 1306 1HE LYS 75 1HE LYS 165 -14.787 -10.098 -3.345 1307 2HE LYS 75 2HE LYS 165 -15.124 -8.372 -3.261 1308 1HZ LYS 75 1HZ LYS 165 -14.924 -9.950 -5.761 1309 2HZ LYS 75 2HZ LYS 165 -16.306 -9.429 -5.059 1310 H VAL 76 H VAL 166 -7.573 -9.781 -6.484 1311 HA VAL 76 HA VAL 166 -5.798 -10.678 -4.375 1312 HB VAL 76 HB VAL 166 -6.163 -10.744 -7.260 1313 1HG1 VAL 76 3HG2 VAL 166 -4.968 -8.672 -7.451 1314 2HG1 VAL 76 1HG2 VAL 166 -3.557 -9.419 -6.662 1315 3HG1 VAL 76 2HG2 VAL 166 -4.206 -10.059 -8.248 1316 1HG2 VAL 76 3HG1 VAL 166 -5.591 -12.591 -5.913 1317 2HG2 VAL 76 1HG1 VAL 166 -4.476 -12.336 -7.279 1318 3HG2 VAL 76 2HG1 VAL 166 -3.960 -11.882 -5.604 1319 HA PRO 77 HA PRO 167 -5.446 -6.189 -3.574 1320 1HB PRO 77 1HB PRO 167 -3.840 -6.266 -1.273 1321 2HB PRO 77 2HB PRO 167 -5.467 -6.955 -1.281 1322 1HG PRO 77 1HG PRO 167 -2.811 -8.412 -1.641 1323 2HG PRO 77 2HG PRO 167 -4.165 -8.875 -0.602 1324 1HD PRO 77 1HD PRO 167 -3.665 -9.883 -3.298 1325 2HD PRO 77 2HD PRO 167 -5.260 -9.933 -2.519 1326 H ALA 78 H ALA 168 -4.443 -4.631 -4.116 1327 HA ALA 78 HA ALA 168 -1.444 -4.603 -4.689 1328 1HB ALA 78 3HB ALA 168 -2.892 -5.364 -6.668 1329 2HB ALA 78 1HB ALA 168 -3.706 -3.792 -6.635 1330 3HB ALA 78 2HB ALA 168 -1.968 -3.878 -6.997 1331 H PHE 79 H PHE 169 -0.739 -2.527 -5.261 1332 HA PHE 79 HA PHE 169 -1.975 -0.047 -3.879 1333 1HB PHE 79 2HB PHE 169 -1.126 -0.785 -2.027 1334 2HB PHE 79 1HB PHE 169 0.376 -1.388 -2.784 1335 HD1 PHE 79 HD2 PHE 169 -1.344 1.739 -1.640 1336 HD2 PHE 79 HD1 PHE 169 2.299 0.064 -3.200 1337 HE1 PHE 79 HE2 PHE 169 -0.175 3.866 -1.234 1338 HE2 PHE 79 HE1 PHE 169 3.430 2.214 -2.853 1339 HZ PHE 79 HZ PHE 169 2.194 4.128 -1.924 1340 H LYS 80 H LYS 170 -1.523 1.397 -5.210 1341 HA LYS 80 HA LYS 170 0.612 1.545 -7.512 1342 1HB LYS 80 2HB LYS 170 -1.974 3.040 -7.003 1343 2HB LYS 80 1HB LYS 170 -0.688 3.851 -7.849 1344 1HG LYS 80 1HG LYS 170 -2.140 2.965 -9.488 1345 2HG LYS 80 2HG LYS 170 -0.614 2.103 -9.597 1346 1HD LYS 80 1HD LYS 170 -1.653 0.133 -8.375 1347 2HD LYS 80 2HD LYS 170 -3.183 1.014 -8.263 1348 1HE LYS 80 1HE LYS 170 -3.346 1.101 -10.782 1349 2HE LYS 80 2HE LYS 170 -1.781 0.283 -10.927 1350 1HZ LYS 80 1HZ LYS 170 -4.220 -0.838 -9.672 1351 2HZ LYS 80 2HZ LYS 170 -3.616 -1.240 -11.137 1352 HA PRO 81 HA PRO 171 2.675 4.527 -4.677 1353 1HB PRO 81 1HB PRO 171 4.802 5.233 -6.273 1354 2HB PRO 81 2HB PRO 171 4.631 3.593 -5.637 1355 1HG PRO 81 1HG PRO 171 3.846 4.593 -8.427 1356 2HG PRO 81 2HG PRO 171 4.875 3.195 -8.024 1357 1HD PRO 81 1HD PRO 171 2.127 2.999 -8.536 1358 2HD PRO 81 2HD PRO 171 2.977 1.860 -7.442 1359 H GLY 82 H GLY 172 0.264 5.354 -5.948 1360 1HA GLY 82 1HA GLY 172 -0.933 6.981 -7.248 1361 2HA GLY 82 2HA GLY 172 -0.101 7.977 -6.075 1362 H LYS 83 H LYS 173 1.876 6.592 -8.478 1363 HA LYS 83 HA LYS 173 3.186 7.512 -10.272 1364 1HB LYS 83 2HB LYS 173 0.767 9.282 -10.564 1365 2HB LYS 83 1HB LYS 173 2.219 10.103 -10.996 1366 1HG LYS 83 1HG LYS 173 2.783 8.195 -12.624 1367 2HG LYS 83 2HG LYS 173 1.297 7.373 -12.140 1368 1HD LYS 83 1HD LYS 173 -0.054 9.391 -12.970 1369 2HD LYS 83 2HD LYS 173 1.449 10.161 -13.455 1370 1HE LYS 83 1HE LYS 173 0.511 9.227 -15.455 1371 2HE LYS 83 2HE LYS 173 1.911 8.229 -15.071 1372 1HZ LYS 83 1HZ LYS 173 -0.915 7.551 -14.434 1373 2HZ LYS 83 2HZ LYS 173 0.371 6.609 -14.072 1374 H ALA 84 H ALA 174 2.129 9.796 -8.075 1375 HA ALA 84 HA ALA 174 4.170 11.841 -7.948 1376 1HB ALA 84 2HB ALA 174 1.816 11.939 -7.099 1377 2HB ALA 84 3HB ALA 174 2.152 10.632 -5.934 1378 3HB ALA 84 1HB ALA 174 2.955 12.213 -5.736 1379 H LEU 85 H LEU 175 3.758 8.865 -5.813 1380 HA LEU 85 HA LEU 175 6.254 9.315 -4.360 1381 1HB LEU 85 2HB LEU 175 4.452 7.911 -3.331 1382 2HB LEU 85 1HB LEU 175 4.537 6.804 -4.684 1383 HG LEU 85 HG LEU 175 6.987 6.558 -4.146 1384 1HD1 LEU 85 2HD1 LEU 175 7.338 8.380 -2.505 1385 2HD1 LEU 85 3HD1 LEU 175 6.166 7.638 -1.399 1386 3HD1 LEU 85 1HD1 LEU 175 7.712 6.820 -1.748 1387 1HD2 LEU 85 3HD2 LEU 175 5.190 4.776 -3.740 1388 2HD2 LEU 85 1HD2 LEU 175 6.543 4.660 -2.623 1389 3HD2 LEU 85 2HD2 LEU 175 4.996 5.374 -2.079 1390 H LYS 86 H LYS 176 5.332 7.558 -7.319 1391 HA LYS 86 HA LYS 176 7.925 6.338 -7.870 1392 1HB LYS 86 1HB LYS 176 5.649 5.875 -9.076 1393 2HB LYS 86 2HB LYS 176 6.064 7.210 -10.137 1394 1HG LYS 86 1HG LYS 176 8.210 6.008 -10.767 1395 2HG LYS 86 2HG LYS 176 7.792 4.698 -9.658 1396 1HD LYS 86 1HD LYS 176 5.681 4.249 -10.992 1397 2HD LYS 86 2HD LYS 176 6.114 5.552 -12.106 1398 1HE LYS 86 1HE LYS 176 8.261 4.311 -12.710 1399 2HE LYS 86 2HE LYS 176 7.809 3.005 -11.604 1400 1HZ LYS 86 1HZ LYS 176 6.274 3.873 -13.990 1401 2HZ LYS 86 2HZ LYS 176 7.198 2.530 -13.879 1402 H ASP 87 H ASP 177 7.012 9.717 -8.133 1403 HA ASP 87 HA ASP 177 9.507 10.460 -9.613 1404 1HB ASP 87 1HB ASP 177 6.862 11.568 -9.340 1405 2HB ASP 87 2HB ASP 177 7.784 12.545 -8.260 1406 HD2 ASP 87 HD2 ASP 177 9.277 14.339 -10.817 1407 H ALA 88 H ALA 178 8.195 10.646 -6.285 1408 HA ALA 88 HA ALA 178 10.347 12.019 -4.890 1409 1HB ALA 88 3HB ALA 178 8.107 11.216 -3.819 1410 2HB ALA 88 1HB ALA 178 8.710 9.557 -3.894 1411 3HB ALA 88 2HB ALA 178 9.532 10.711 -2.867 1412 H VAL 89 H VAL 179 10.040 8.561 -5.871 1413 HA VAL 89 HA VAL 179 12.374 7.699 -4.311 1414 HB VAL 89 HB VAL 179 9.738 7.017 -4.459 1415 1HG1 VAL 89 2HG2 VAL 179 9.886 6.756 -7.024 1416 2HG1 VAL 89 3HG2 VAL 179 10.724 5.224 -6.731 1417 3HG1 VAL 89 1HG2 VAL 179 9.072 5.509 -6.082 1418 1HG2 VAL 89 3HG1 VAL 179 11.898 4.980 -4.337 1419 2HG2 VAL 89 1HG1 VAL 179 11.179 6.014 -3.041 1420 3HG2 VAL 89 2HG1 VAL 179 10.148 4.818 -3.867 1421 H LYS 90 H LYS 180 11.886 8.565 -7.615 1422 HA LYS 90 HA LYS 180 13.342 6.526 -8.977 1423 1HB LYS 90 1HB LYS 180 13.067 7.811 -10.890 1424 2HB LYS 90 2HB LYS 180 11.697 8.199 -9.891 1425 1HG LYS 90 1HG LYS 180 12.858 10.384 -9.206 1426 2HG LYS 90 2HG LYS 180 14.158 10.004 -10.332 1427 1HD LYS 90 1HD LYS 180 12.486 9.920 -12.233 1428 2HD LYS 90 2HD LYS 180 11.188 10.346 -11.134 1429 1HE LYS 90 1HE LYS 180 13.658 12.120 -11.737 1430 2HE LYS 90 2HE LYS 180 12.084 12.278 -12.513 1431 1HZ LYS 90 1HZ LYS 180 11.096 12.805 -10.394 1432 2HZ LYS 90 2HZ LYS 180 12.310 13.844 -10.742 Start of MODEL 24 Raw file had 1432 H/Q atoms Start of MODEL 24 1 1H MET 1 1H MET 1 -12.977 7.191 -1.114 2 2H MET 1 2H MET 1 -13.134 8.453 -2.141 3 HA MET 1 HA MET 1 -13.191 9.222 0.086 4 1HB MET 1 1HB MET 1 -10.408 7.924 0.354 5 2HB MET 1 2HB MET 1 -11.075 9.031 1.509 6 1HG MET 1 1HG MET 1 -12.970 7.409 1.995 7 2HG MET 1 2HG MET 1 -12.239 6.261 0.847 8 1HE MET 1 2HE MET 1 -12.641 5.225 3.745 9 2HE MET 1 1HE MET 1 -11.697 4.308 2.533 10 3HE MET 1 3HE MET 1 -11.024 4.578 4.162 11 H ASN 2 H ASN 2 -9.909 9.837 -0.259 12 HA ASN 2 HA ASN 2 -9.208 11.336 -2.195 13 1HB ASN 2 1HB ASN 2 -9.589 13.698 -2.248 14 2HB ASN 2 2HB ASN 2 -11.099 12.852 -2.333 15 1HD2 ASN 2 1HD2 ASN 2 -12.464 14.545 0.540 16 2HD2 ASN 2 2HD2 ASN 2 -12.696 13.247 -0.736 17 H LYS 3 H LYS 3 -9.363 11.523 1.115 18 HA LYS 3 HA LYS 3 -7.144 11.144 2.371 19 1HB LYS 3 1HB LYS 3 -5.654 12.346 0.757 20 2HB LYS 3 2HB LYS 3 -6.338 13.887 1.223 21 1HG LYS 3 1HG LYS 3 -5.364 13.738 3.455 22 2HG LYS 3 2HG LYS 3 -5.104 12.010 3.339 23 1HD LYS 3 1HD LYS 3 -3.513 14.043 1.653 24 2HD LYS 3 2HD LYS 3 -3.052 13.525 3.269 25 1HE LYS 3 1HE LYS 3 -3.024 11.077 2.453 26 2HE LYS 3 2HE LYS 3 -3.304 11.674 0.813 27 1HZ LYS 3 1HZ LYS 3 -0.985 11.348 1.209 28 2HZ LYS 3 2HZ LYS 3 -1.258 12.942 0.973 29 H THR 4 H THR 4 -9.719 13.556 2.040 30 HA THR 4 HA THR 4 -9.549 14.384 4.835 31 HB THR 4 HB THR 4 -11.226 15.162 2.350 32 HG1 THR 4 HG1 THR 4 -9.055 16.476 3.659 33 1HG2 THR 4 3HG2 THR 4 -10.906 16.328 5.128 34 2HG2 THR 4 1HG2 THR 4 -11.712 17.163 3.718 35 3HG2 THR 4 2HG2 THR 4 -12.384 15.617 4.378 36 H GLU 5 H GLU 5 -11.411 12.328 2.632 37 HA GLU 5 HA GLU 5 -13.590 11.725 4.635 38 1HB GLU 5 1HB GLU 5 -12.901 9.837 2.368 39 2HB GLU 5 2HB GLU 5 -14.373 9.927 3.288 40 1HG GLU 5 1HG GLU 5 -13.390 11.901 1.145 41 2HG GLU 5 2HG GLU 5 -14.654 10.717 0.962 42 HE2 GLU 5 HE2 GLU 5 -15.404 14.308 2.580 43 H LEU 6 H LEU 6 -10.330 11.037 4.129 44 HA LEU 6 HA LEU 6 -9.956 8.548 5.705 45 1HB LEU 6 2HB LEU 6 -8.341 10.135 3.935 46 2HB LEU 6 1HB LEU 6 -7.659 10.537 5.484 47 HG LEU 6 HG LEU 6 -7.910 7.726 4.418 48 1HD1 LEU 6 1HD1 LEU 6 -5.457 9.518 4.722 49 2HD1 LEU 6 2HD1 LEU 6 -5.434 7.805 4.240 50 3HD1 LEU 6 3HD1 LEU 6 -6.210 9.011 3.196 51 1HD2 LEU 6 3HD2 LEU 6 -7.202 8.673 7.181 52 2HD2 LEU 6 1HD2 LEU 6 -8.045 7.215 6.650 53 3HD2 LEU 6 2HD2 LEU 6 -6.279 7.337 6.479 54 H ILE 7 H ILE 7 -9.527 12.110 6.248 55 HA ILE 7 HA ILE 7 -8.702 11.977 9.027 56 HB ILE 7 HB ILE 7 -10.179 14.296 7.635 57 1HG1 ILE 7 1HG1 ILE 7 -7.145 13.999 7.963 58 2HG1 ILE 7 2HG1 ILE 7 -7.937 13.432 6.551 59 1HG2 ILE 7 2HG2 ILE 7 -10.098 14.575 10.173 60 2HG2 ILE 7 3HG2 ILE 7 -8.340 14.421 10.101 61 3HG2 ILE 7 1HG2 ILE 7 -9.137 15.805 9.344 62 1HD1 ILE 7 3HD1 ILE 7 -8.901 15.809 6.164 63 2HD1 ILE 7 1HD1 ILE 7 -7.708 16.344 7.336 64 3HD1 ILE 7 2HD1 ILE 7 -7.176 15.499 5.855 65 H ASN 8 H ASN 8 -11.933 12.540 7.645 66 HA ASN 8 HA ASN 8 -13.279 12.396 10.292 67 1HB ASN 8 1HB ASN 8 -14.517 12.062 7.458 68 2HB ASN 8 2HB ASN 8 -15.461 12.133 8.928 69 1HD2 ASN 8 2HD2 ASN 8 -14.335 15.668 7.309 70 2HD2 ASN 8 1HD2 ASN 8 -13.939 14.049 6.544 71 H ALA 9 H ALA 9 -12.058 9.830 8.362 72 HA ALA 9 HA ALA 9 -13.823 7.673 9.504 73 1HB ALA 9 2HB ALA 9 -12.270 7.350 7.320 74 2HB ALA 9 3HB ALA 9 -10.881 7.454 8.403 75 3HB ALA 9 1HB ALA 9 -11.975 6.128 8.622 76 H VAL 10 H VAL 10 -10.590 9.097 10.171 77 HA VAL 10 HA VAL 10 -9.951 7.191 12.151 78 HB VAL 10 HB VAL 10 -8.483 9.834 12.042 79 1HG1 VAL 10 3HG2 VAL 10 -7.910 7.647 13.487 80 2HG1 VAL 10 1HG2 VAL 10 -7.057 7.208 11.973 81 3HG1 VAL 10 2HG2 VAL 10 -6.663 8.730 12.785 82 1HG2 VAL 10 1HG1 VAL 10 -8.585 7.764 9.839 83 2HG2 VAL 10 2HG1 VAL 10 -8.747 9.552 9.847 84 3HG2 VAL 10 3HG1 VAL 10 -7.126 8.827 10.081 85 H ALA 11 H ALA 11 -10.714 10.506 12.192 86 HA ALA 11 HA ALA 11 -10.921 10.574 15.005 87 1HB ALA 11 2HB ALA 11 -10.548 12.659 13.591 88 2HB ALA 11 3HB ALA 11 -12.194 12.518 12.925 89 3HB ALA 11 1HB ALA 11 -11.951 12.937 14.654 90 H GLU 12 H GLU 12 -13.324 9.508 12.721 91 HA GLU 12 HA GLU 12 -15.504 9.595 14.790 92 1HB GLU 12 1HB GLU 12 -16.127 9.894 12.371 93 2HB GLU 12 2HB GLU 12 -15.515 8.289 12.004 94 1HG GLU 12 1HG GLU 12 -17.930 8.197 12.099 95 2HG GLU 12 2HG GLU 12 -17.302 7.251 13.431 96 HE1 GLU 12 HE2 GLU 12 -19.458 10.631 14.036 97 H THR 13 H THR 13 -13.432 7.027 13.260 98 HA THR 13 HA THR 13 -14.453 5.162 15.414 99 HB THR 13 HB THR 13 -14.299 4.714 12.876 100 HG1 THR 13 HG1 THR 13 -13.607 2.789 14.830 101 1HG2 THR 13 1HG2 THR 13 -11.898 4.858 12.477 102 2HG2 THR 13 2HG2 THR 13 -11.596 3.533 13.631 103 3HG2 THR 13 3HG2 THR 13 -12.518 3.231 12.133 104 H SER 14 H SER 14 -12.352 7.174 15.670 105 HA SER 14 HA SER 14 -10.807 5.584 17.835 106 1HB SER 14 1HB SER 14 -9.408 7.853 16.303 107 2HB SER 14 2HB SER 14 -8.711 6.749 17.479 108 HG SER 14 HG SER 14 -9.824 6.036 14.970 109 H GLY 15 H GLY 15 -12.223 8.797 17.086 110 1HA GLY 15 1HA GLY 15 -12.724 10.609 18.510 111 2HA GLY 15 2HA GLY 15 -12.553 9.524 19.887 112 H LEU 16 H LEU 16 -10.396 10.902 17.478 113 HA LEU 16 HA LEU 16 -8.607 12.236 19.525 114 1HB LEU 16 1HB LEU 16 -6.837 12.153 17.913 115 2HB LEU 16 2HB LEU 16 -7.340 10.623 18.602 116 HG LEU 16 HG LEU 16 -8.461 9.939 16.732 117 1HD1 LEU 16 2HD1 LEU 16 -9.508 12.115 15.962 118 2HD1 LEU 16 3HD1 LEU 16 -7.891 12.520 15.301 119 3HD1 LEU 16 1HD1 LEU 16 -8.858 11.115 14.660 120 1HD2 LEU 16 3HD2 LEU 16 -6.483 9.110 16.465 121 2HD2 LEU 16 1HD2 LEU 16 -7.460 9.330 14.989 122 3HD2 LEU 16 2HD2 LEU 16 -6.119 10.422 15.285 123 H SER 17 H SER 17 -8.138 13.563 16.931 124 HA SER 17 HA SER 17 -10.231 15.797 16.996 125 1HB SER 17 1HB SER 17 -7.273 16.526 16.830 126 2HB SER 17 2HB SER 17 -8.647 17.605 16.784 127 HG SER 17 HG SER 17 -7.954 15.930 18.958 128 H LYS 18 H LYS 18 -10.306 17.037 15.028 129 HA LYS 18 HA LYS 18 -9.879 15.428 12.512 130 1HB LYS 18 1HB LYS 18 -10.885 18.318 12.818 131 2HB LYS 18 2HB LYS 18 -10.506 17.575 11.272 132 1HG LYS 18 1HG LYS 18 -12.160 15.666 11.825 133 2HG LYS 18 2HG LYS 18 -12.626 16.571 13.256 134 1HD LYS 18 1HD LYS 18 -14.267 17.027 11.587 135 2HD LYS 18 2HD LYS 18 -13.349 18.516 11.781 136 1HE LYS 18 1HE LYS 18 -12.058 18.012 9.653 137 2HE LYS 18 2HE LYS 18 -12.879 16.454 9.505 138 1HZ LYS 18 1HZ LYS 18 -14.970 17.618 9.269 139 2HZ LYS 18 2HZ LYS 18 -13.905 18.106 8.130 140 H LYS 19 H LYS 19 -8.337 18.248 14.013 141 HA LYS 19 HA LYS 19 -6.052 18.448 12.151 142 1HB LYS 19 2HB LYS 19 -6.213 19.231 15.123 143 2HB LYS 19 1HB LYS 19 -4.819 19.579 14.092 144 1HG LYS 19 1HG LYS 19 -6.293 20.937 12.554 145 2HG LYS 19 2HG LYS 19 -7.667 20.668 13.614 146 1HD LYS 19 1HD LYS 19 -5.049 22.096 14.403 147 2HD LYS 19 2HD LYS 19 -6.515 22.910 13.908 148 1HE LYS 19 1HE LYS 19 -6.262 21.166 16.455 149 2HE LYS 19 2HE LYS 19 -6.128 22.918 16.404 150 1HZ LYS 19 1HZ LYS 19 -8.546 21.414 15.584 151 2HZ LYS 19 2HZ LYS 19 -8.399 23.042 15.587 152 H ASP 20 H ASP 20 -6.574 16.332 15.076 153 HA ASP 20 HA ASP 20 -3.772 15.231 14.890 154 1HB ASP 20 1HB ASP 20 -6.232 14.364 16.531 155 2HB ASP 20 2HB ASP 20 -4.822 13.339 16.445 156 HD1 ASP 20 HD2 ASP 20 -2.685 15.347 18.296 157 H ALA 21 H ALA 21 -6.862 14.324 13.501 158 HA ALA 21 HA ALA 21 -5.958 11.681 12.467 159 1HB ALA 21 2HB ALA 21 -8.483 13.380 12.015 160 2HB ALA 21 3HB ALA 21 -8.164 11.844 11.155 161 3HB ALA 21 1HB ALA 21 -8.282 11.883 12.890 162 H THR 22 H THR 22 -6.155 15.008 11.048 163 HA THR 22 HA THR 22 -5.190 14.354 8.400 164 HB THR 22 HB THR 22 -4.576 16.979 9.915 165 HG1 THR 22 HG1 THR 22 -7.007 16.268 8.675 166 1HG2 THR 22 3HG2 THR 22 -5.324 16.297 7.008 167 2HG2 THR 22 1HG2 THR 22 -5.113 17.953 7.646 168 3HG2 THR 22 2HG2 THR 22 -3.719 16.815 7.588 169 H LYS 23 H LYS 23 -3.414 15.331 11.255 170 HA LYS 23 HA LYS 23 -0.673 15.057 10.247 171 1HB LYS 23 2HB LYS 23 -2.000 14.584 13.040 172 2HB LYS 23 1HB LYS 23 -0.283 14.512 12.859 173 1HG LYS 23 1HG LYS 23 -0.136 16.917 12.158 174 2HG LYS 23 2HG LYS 23 -1.890 17.064 12.224 175 1HD LYS 23 1HD LYS 23 -1.814 16.439 14.710 176 2HD LYS 23 2HD LYS 23 -0.051 16.400 14.617 177 1HE LYS 23 1HE LYS 23 -0.044 18.857 13.937 178 2HE LYS 23 2HE LYS 23 -1.813 18.883 14.031 179 1HZ LYS 23 1HZ LYS 23 -0.774 19.694 16.045 180 2HZ LYS 23 2HZ LYS 23 0.035 18.293 16.277 181 H ALA 24 H ALA 24 -2.584 12.811 12.094 182 HA ALA 24 HA ALA 24 -0.830 10.564 12.142 183 1HB ALA 24 3HB ALA 24 -2.678 10.845 13.657 184 2HB ALA 24 1HB ALA 24 -3.871 10.698 12.321 185 3HB ALA 24 2HB ALA 24 -2.881 9.286 12.809 186 H VAL 25 H VAL 25 -3.176 11.329 9.639 187 HA VAL 25 HA VAL 25 -2.615 8.976 7.887 188 HB VAL 25 HB VAL 25 -3.814 11.910 7.821 189 1HG1 VAL 25 1HG2 VAL 25 -3.303 10.378 5.203 190 2HG1 VAL 25 2HG2 VAL 25 -4.344 11.830 5.414 191 3HG1 VAL 25 3HG2 VAL 25 -2.610 11.937 5.672 192 1HG2 VAL 25 3HG1 VAL 25 -5.226 10.079 8.608 193 2HG2 VAL 25 1HG1 VAL 25 -5.865 10.788 7.114 194 3HG2 VAL 25 2HG1 VAL 25 -4.986 9.212 7.075 195 H ASP 26 H ASP 26 -1.345 12.367 7.763 196 HA ASP 26 HA ASP 26 1.055 11.389 6.182 197 1HB ASP 26 1HB ASP 26 -0.166 13.686 5.956 198 2HB ASP 26 2HB ASP 26 0.645 14.151 7.455 199 HD1 ASP 26 HD2 ASP 26 2.659 13.733 3.917 200 H ALA 27 H ALA 27 0.570 10.543 8.759 201 HA ALA 27 HA ALA 27 3.334 10.536 10.037 202 1HB ALA 27 2HB ALA 27 1.419 11.103 11.548 203 2HB ALA 27 3HB ALA 27 0.696 9.533 11.122 204 3HB ALA 27 1HB ALA 27 2.247 9.578 11.913 205 H VAL 28 H VAL 28 0.723 8.319 9.212 206 HA VAL 28 HA VAL 28 2.279 5.794 9.114 207 HB VAL 28 HB VAL 28 -0.433 6.566 7.772 208 1HG1 VAL 28 1HG2 VAL 28 0.620 3.756 8.454 209 2HG1 VAL 28 2HG2 VAL 28 -0.991 4.179 7.807 210 3HG1 VAL 28 3HG2 VAL 28 0.443 4.454 6.805 211 1HG2 VAL 28 3HG1 VAL 28 -0.456 6.749 10.251 212 2HG2 VAL 28 1HG1 VAL 28 -1.597 5.580 9.519 213 3HG2 VAL 28 2HG1 VAL 28 -0.068 5.003 10.333 214 H PHE 29 H PHE 29 0.744 7.771 6.778 215 HA PHE 29 HA PHE 29 2.188 6.737 4.366 216 1HB PHE 29 2HB PHE 29 0.442 9.233 4.357 217 2HB PHE 29 1HB PHE 29 0.935 8.295 2.954 218 HD1 PHE 29 HD1 PHE 29 0.446 5.530 3.355 219 HD2 PHE 29 HD2 PHE 29 -1.801 8.796 5.012 220 HE1 PHE 29 HE1 PHE 29 -1.304 3.974 4.047 221 HE2 PHE 29 HE2 PHE 29 -3.514 7.219 5.772 222 HZ PHE 29 HZ PHE 29 -3.197 4.794 5.379 223 H ASP 30 H ASP 30 3.106 9.319 6.558 224 HA ASP 30 HA ASP 30 5.164 10.374 4.665 225 1HB ASP 30 1HB ASP 30 4.195 11.543 6.776 226 2HB ASP 30 2HB ASP 30 5.286 10.578 7.742 227 HD2 ASP 30 HD2 ASP 30 8.118 12.375 6.979 228 H SER 31 H SER 31 5.009 8.034 7.250 229 HA SER 31 HA SER 31 7.853 7.135 7.132 230 1HB SER 31 1HB SER 31 5.561 5.484 8.254 231 2HB SER 31 2HB SER 31 7.283 5.252 8.521 232 HG SER 31 HG SER 31 5.818 7.550 9.287 233 H ILE 32 H ILE 32 4.862 5.944 5.340 234 HA ILE 32 HA ILE 32 6.189 3.655 4.095 235 HB ILE 32 HB ILE 32 3.937 5.466 3.023 236 1HG1 ILE 32 1HG1 ILE 32 2.350 3.844 2.926 237 2HG1 ILE 32 2HG1 ILE 32 3.370 2.560 3.563 238 1HG2 ILE 32 1HG2 ILE 32 5.534 3.061 2.000 239 2HG2 ILE 32 2HG2 ILE 32 3.895 3.143 1.369 240 3HG2 ILE 32 3HG2 ILE 32 5.070 4.467 1.096 241 1HD1 ILE 32 2HD1 ILE 32 2.980 3.586 5.913 242 2HD1 ILE 32 3HD1 ILE 32 1.844 4.712 5.097 243 3HD1 ILE 32 1HD1 ILE 32 1.545 3.000 5.058 244 H THR 33 H THR 33 5.629 7.131 3.123 245 HA THR 33 HA THR 33 7.141 6.937 0.657 246 HB THR 33 HB THR 33 7.344 9.289 0.528 247 HG1 THR 33 HG1 THR 33 6.561 10.621 2.206 248 1HG2 THR 33 2HG2 THR 33 4.640 8.191 1.430 249 2HG2 THR 33 3HG2 THR 33 4.764 9.911 1.054 250 3HG2 THR 33 1HG2 THR 33 5.157 8.676 -0.173 251 H GLU 34 H GLU 34 8.296 7.308 3.810 252 HA GLU 34 HA GLU 34 11.160 7.895 3.059 253 1HB GLU 34 1HB GLU 34 9.840 7.241 5.799 254 2HB GLU 34 2HB GLU 34 11.576 7.409 5.611 255 1HG GLU 34 1HG GLU 34 11.405 9.782 4.997 256 2HG GLU 34 2HG GLU 34 9.649 9.719 4.940 257 HE2 GLU 34 HE2 GLU 34 11.593 10.177 8.404 258 H ALA 35 H ALA 35 9.043 5.069 3.857 259 HA ALA 35 HA ALA 35 11.317 3.226 3.797 260 1HB ALA 35 3HB ALA 35 8.943 2.500 4.773 261 2HB ALA 35 1HB ALA 35 8.335 2.623 3.121 262 3HB ALA 35 2HB ALA 35 9.493 1.382 3.510 263 H LEU 36 H LEU 36 8.768 3.883 1.216 264 HA LEU 36 HA LEU 36 10.245 2.322 -0.763 265 1HB LEU 36 2HB LEU 36 8.208 4.486 -1.026 266 2HB LEU 36 1HB LEU 36 8.661 3.406 -2.311 267 HG LEU 36 HG LEU 36 7.338 2.958 -0.176 268 1HD1 LEU 36 1HD2 LEU 36 9.073 0.578 -0.480 269 2HD1 LEU 36 2HD2 LEU 36 8.344 1.303 0.976 270 3HD1 LEU 36 3HD2 LEU 36 7.442 0.148 0.030 271 1HD2 LEU 36 2HD1 LEU 36 5.507 2.956 -0.925 272 2HD2 LEU 36 3HD1 LEU 36 5.744 1.218 -1.260 273 3HD2 LEU 36 1HD1 LEU 36 5.847 1.756 0.400 274 NH1 ARG 37 NH2 ARG 37 10.273 11.995 2.218 275 NH2 ARG 37 NH1 ARG 37 12.160 12.062 3.484 276 H ARG 37 H ARG 37 10.378 5.873 0.029 277 HA ARG 37 HA ARG 37 11.836 6.297 -2.404 278 1HB ARG 37 1HB ARG 37 12.152 8.555 -1.964 279 2HB ARG 37 2HB ARG 37 10.610 8.189 -1.244 280 1HG ARG 37 1HG ARG 37 12.075 7.934 1.033 281 2HG ARG 37 2HG ARG 37 13.317 8.776 0.116 282 1HD ARG 37 1HD ARG 37 11.653 10.629 -0.350 283 2HD ARG 37 2HD ARG 37 10.468 9.756 0.660 284 1HH1 ARG 37 2HH2 ARG 37 9.784 11.582 1.417 285 2HH1 ARG 37 1HH2 ARG 37 9.913 12.716 2.854 286 1HH2 ARG 37 1HH1 ARG 37 13.107 11.704 3.650 287 2HH2 ARG 37 2HH1 ARG 37 11.668 12.778 4.031 288 H LYS 38 H LYS 38 12.790 5.116 0.826 289 HA LYS 38 HA LYS 38 15.633 6.045 0.408 290 1HB LYS 38 1HB LYS 38 14.375 6.559 2.573 291 2HB LYS 38 2HB LYS 38 14.484 4.844 2.967 292 1HG LYS 38 1HG LYS 38 17.023 5.057 2.989 293 2HG LYS 38 2HG LYS 38 16.876 6.722 2.452 294 1HD LYS 38 1HD LYS 38 17.302 6.781 4.801 295 2HD LYS 38 2HD LYS 38 15.639 7.307 4.581 296 1HE LYS 38 1HE LYS 38 14.824 4.985 5.278 297 2HE LYS 38 2HE LYS 38 16.503 4.457 5.461 298 1HZ LYS 38 1HZ LYS 38 15.241 6.676 6.976 299 2HZ LYS 38 2HZ LYS 38 16.790 6.183 7.149 300 H GLY 39 H GLY 39 14.002 3.395 -0.608 301 1HA GLY 39 1HA GLY 39 14.639 1.129 -1.174 302 2HA GLY 39 2HA GLY 39 16.261 1.439 -0.576 303 H ASP 40 H ASP 40 13.157 1.680 1.045 304 HA ASP 40 HA ASP 40 13.752 -0.569 3.029 305 1HB ASP 40 1HB ASP 40 13.097 2.323 3.556 306 2HB ASP 40 2HB ASP 40 12.594 1.101 4.717 307 HD1 ASP 40 HD2 ASP 40 15.782 0.527 5.911 308 H LYS 41 H LYS 41 12.268 -1.694 3.929 309 HA LYS 41 HA LYS 41 9.712 -1.982 2.311 310 1HB LYS 41 2HB LYS 41 10.715 -3.935 4.421 311 2HB LYS 41 1HB LYS 41 9.436 -4.213 3.257 312 1HG LYS 41 1HG LYS 41 11.194 -4.031 1.378 313 2HG LYS 41 2HG LYS 41 12.440 -3.937 2.620 314 1HD LYS 41 1HD LYS 41 11.689 -6.181 3.542 315 2HD LYS 41 2HD LYS 41 10.457 -6.276 2.279 316 1HE LYS 41 1HE LYS 41 12.304 -6.180 0.503 317 2HE LYS 41 2HE LYS 41 13.516 -6.143 1.792 318 1HZ LYS 41 1HZ LYS 41 11.557 -8.320 1.304 319 2HZ LYS 41 2HZ LYS 41 13.151 -8.362 0.943 320 H VAL 42 H VAL 42 7.774 -1.350 3.188 321 HA VAL 42 HA VAL 42 7.374 -0.573 5.890 322 HB VAL 42 HB VAL 42 5.444 -1.075 3.545 323 1HG1 VAL 42 3HG2 VAL 42 4.348 -0.524 5.661 324 2HG1 VAL 42 1HG2 VAL 42 5.389 0.954 5.791 325 3HG1 VAL 42 2HG2 VAL 42 4.192 0.806 4.465 326 1HG2 VAL 42 2HG1 VAL 42 7.305 0.504 2.817 327 2HG2 VAL 42 3HG1 VAL 42 5.706 1.277 2.927 328 3HG2 VAL 42 1HG1 VAL 42 6.898 1.518 4.251 329 H GLN 43 H GLN 43 5.872 -1.478 7.015 330 HA GLN 43 HA GLN 43 4.877 -4.288 6.646 331 1HB GLN 43 1HB GLN 43 6.865 -4.211 8.804 332 2HB GLN 43 2HB GLN 43 5.748 -5.520 8.418 333 1HG GLN 43 1HG GLN 43 6.876 -5.528 6.091 334 2HG GLN 43 2HG GLN 43 8.024 -4.356 6.718 335 1HE2 GLN 43 2HE2 GLN 43 9.784 -7.554 6.990 336 2HE2 GLN 43 1HE2 GLN 43 9.128 -6.411 5.718 337 H LEU 44 H LEU 44 2.941 -4.287 6.926 338 HA LEU 44 HA LEU 44 1.697 -3.451 9.596 339 1HB LEU 44 2HB LEU 44 0.482 -3.077 6.798 340 2HB LEU 44 1HB LEU 44 -0.488 -3.004 8.244 341 HG LEU 44 HG LEU 44 1.892 -1.099 7.950 342 1HD1 LEU 44 1HD1 LEU 44 0.673 -0.907 5.798 343 2HD1 LEU 44 2HD1 LEU 44 -0.869 -0.656 6.647 344 3HD1 LEU 44 3HD1 LEU 44 0.437 0.555 6.774 345 1HD2 LEU 44 1HD2 LEU 44 -0.874 -0.856 9.342 346 2HD2 LEU 44 2HD2 LEU 44 0.692 -1.104 10.150 347 3HD2 LEU 44 3HD2 LEU 44 0.360 0.419 9.302 348 H ILE 45 H ILE 45 1.193 -5.469 10.428 349 HA ILE 45 HA ILE 45 1.032 -7.816 8.684 350 HB ILE 45 HB ILE 45 2.099 -7.866 10.935 351 1HG1 ILE 45 1HG1 ILE 45 1.322 -10.157 11.615 352 2HG1 ILE 45 2HG1 ILE 45 -0.004 -10.063 10.472 353 1HG2 ILE 45 1HG2 ILE 45 0.367 -6.659 12.237 354 2HG2 ILE 45 2HG2 ILE 45 -0.766 -8.020 12.031 355 3HG2 ILE 45 3HG2 ILE 45 0.746 -8.241 12.963 356 1HD1 ILE 45 1HD1 ILE 45 3.004 -9.944 9.720 357 2HD1 ILE 45 2HD1 ILE 45 1.965 -11.385 9.613 358 3HD1 ILE 45 3HD1 ILE 45 1.650 -9.993 8.557 359 H GLY 46 H GLY 46 -0.614 -9.161 8.359 360 1HA GLY 46 1HA GLY 46 -2.716 -9.657 7.417 361 2HA GLY 46 2HA GLY 46 -3.409 -8.864 8.814 362 H PHE 47 H PHE 47 -1.737 -6.585 6.874 363 HA PHE 47 HA PHE 47 -4.002 -6.005 4.988 364 1HB PHE 47 2HB PHE 47 -4.038 -4.921 7.432 365 2HB PHE 47 1HB PHE 47 -2.750 -3.897 6.891 366 HD1 PHE 47 HD2 PHE 47 -3.284 -2.457 4.593 367 HD2 PHE 47 HD1 PHE 47 -6.310 -4.462 6.916 368 HE1 PHE 47 HE2 PHE 47 -5.041 -1.400 3.242 369 HE2 PHE 47 HE1 PHE 47 -8.016 -3.267 5.682 370 HZ PHE 47 HZ PHE 47 -7.424 -1.890 3.710 371 H GLY 48 H GLY 48 -0.631 -4.916 5.894 372 1HA GLY 48 1HA GLY 48 -0.267 -3.915 3.015 373 2HA GLY 48 2HA GLY 48 -0.228 -2.759 4.293 374 H ASN 49 H ASN 49 1.406 -5.549 2.946 375 HA ASN 49 HA ASN 49 4.018 -4.645 4.278 376 1HB ASN 49 1HB ASN 49 3.305 -7.103 4.464 377 2HB ASN 49 2HB ASN 49 3.619 -7.290 2.761 378 1HD2 ASN 49 1HD2 ASN 49 7.278 -6.985 3.301 379 2HD2 ASN 49 2HD2 ASN 49 5.986 -6.367 2.153 380 H PHE 50 H PHE 50 4.267 -2.799 3.034 381 HA PHE 50 HA PHE 50 4.164 -2.903 0.014 382 1HB PHE 50 2HB PHE 50 5.174 -0.502 1.635 383 2HB PHE 50 1HB PHE 50 4.925 -0.491 -0.005 384 HD1 PHE 50 HD2 PHE 50 3.135 -1.090 3.193 385 HD2 PHE 50 HD1 PHE 50 3.244 0.998 -0.529 386 HE1 PHE 50 HE2 PHE 50 1.155 0.237 3.886 387 HE2 PHE 50 HE1 PHE 50 1.278 2.342 0.196 388 HZ PHE 50 HZ PHE 50 0.259 1.884 2.391 389 H GLU 51 H GLU 51 5.945 -2.435 -1.261 390 HA GLU 51 HA GLU 51 8.431 -1.705 -0.216 391 1HB GLU 51 1HB GLU 51 9.967 -3.746 -0.564 392 2HB GLU 51 2HB GLU 51 8.781 -4.060 0.670 393 1HG GLU 51 1HG GLU 51 7.363 -5.346 -1.053 394 2HG GLU 51 2HG GLU 51 8.635 -5.083 -2.241 395 HE1 GLU 51 HE2 GLU 51 9.027 -7.777 0.752 396 H VAL 52 H VAL 52 10.355 -1.543 -1.650 397 HA VAL 52 HA VAL 52 9.312 -0.738 -4.263 398 HB VAL 52 HB VAL 52 10.917 0.354 -2.114 399 1HG1 VAL 52 1HG2 VAL 52 12.787 -0.445 -4.350 400 2HG1 VAL 52 2HG2 VAL 52 13.086 0.810 -3.090 401 3HG1 VAL 52 3HG2 VAL 52 12.825 -0.910 -2.641 402 1HG2 VAL 52 3HG1 VAL 52 10.458 1.361 -4.933 403 2HG2 VAL 52 1HG1 VAL 52 9.526 1.674 -3.445 404 3HG2 VAL 52 2HG1 VAL 52 11.185 2.265 -3.588 405 NH1 ARG 53 NH2 ARG 53 12.466 -4.592 -11.466 406 NH2 ARG 53 NH1 ARG 53 11.475 -2.710 -12.267 407 H ARG 53 H ARG 53 10.432 -1.235 -6.158 408 HA ARG 53 HA ARG 53 11.942 -3.930 -6.212 409 1HB ARG 53 1HB ARG 53 9.473 -4.100 -6.942 410 2HB ARG 53 2HB ARG 53 9.842 -2.995 -8.230 411 1HG ARG 53 1HG ARG 53 11.846 -4.920 -8.657 412 2HG ARG 53 2HG ARG 53 10.613 -5.897 -7.896 413 1HD ARG 53 1HD ARG 53 10.340 -6.059 -10.315 414 2HD ARG 53 2HD ARG 53 8.955 -5.195 -9.676 415 1HH1 ARG 53 2HH2 ARG 53 12.395 -5.414 -10.857 416 2HH1 ARG 53 1HH2 ARG 53 13.263 -4.331 -12.058 417 1HH2 ARG 53 1HH1 ARG 53 10.651 -2.098 -12.271 418 2HH2 ARG 53 2HH1 ARG 53 12.340 -2.580 -12.803 419 H GLU 54 H GLU 54 13.894 -2.859 -6.287 420 HA GLU 54 HA GLU 54 14.521 -0.710 -8.205 421 1HB GLU 54 1HB GLU 54 16.781 -0.762 -7.497 422 2HB GLU 54 2HB GLU 54 15.696 -0.694 -6.140 423 1HG GLU 54 1HG GLU 54 17.223 -3.233 -7.034 424 2HG GLU 54 2HG GLU 54 17.781 -2.102 -5.822 425 HE1 GLU 54 HE2 GLU 54 15.533 -3.057 -3.327 426 NH1 ARG 55 NH2 ARG 55 14.769 0.745 -17.640 427 NH2 ARG 55 NH1 ARG 55 16.110 -0.708 -18.758 428 H ARG 55 H ARG 55 15.045 -0.801 -10.243 429 HA ARG 55 HA ARG 55 15.261 -3.401 -11.710 430 1HB ARG 55 1HB ARG 55 14.039 -1.471 -12.685 431 2HB ARG 55 2HB ARG 55 15.503 -0.511 -12.673 432 1HG ARG 55 1HG ARG 55 16.584 -2.032 -14.319 433 2HG ARG 55 2HG ARG 55 15.094 -2.989 -14.417 434 1HD ARG 55 1HD ARG 55 13.845 -1.069 -15.341 435 2HD ARG 55 2HD ARG 55 15.168 0.049 -14.951 436 1HH1 ARG 55 2HH2 ARG 55 14.278 0.972 -16.768 437 2HH1 ARG 55 1HH2 ARG 55 14.777 1.300 -18.503 438 1HH2 ARG 55 1HH1 ARG 55 16.643 -1.584 -18.743 439 2HH2 ARG 55 2HH1 ARG 55 16.026 -0.052 -19.543 440 H ALA 56 H ALA 56 17.062 -4.138 -12.775 441 HA ALA 56 HA ALA 56 19.627 -3.762 -11.296 442 1HB ALA 56 2HB ALA 56 18.904 -6.032 -11.908 443 2HB ALA 56 3HB ALA 56 18.980 -5.643 -13.645 444 3HB ALA 56 1HB ALA 56 20.464 -5.660 -12.665 445 H ALA 57 H ALA 57 20.267 -1.635 -11.875 446 HA ALA 57 HA ALA 57 21.063 -0.837 -14.506 447 1HB ALA 57 3HB ALA 57 20.903 0.778 -12.586 448 2HB ALA 57 1HB ALA 57 22.356 0.068 -11.844 449 3HB ALA 57 2HB ALA 57 22.465 0.924 -13.402 450 NH1 ARG 58 NH2 ARG 58 22.747 -8.057 -14.339 451 NH2 ARG 58 NH1 ARG 58 20.526 -8.532 -14.446 452 H ARG 58 H ARG 58 22.215 -1.592 -15.862 453 HA ARG 58 HA ARG 58 24.744 -2.976 -15.092 454 1HB ARG 58 2HB ARG 58 23.155 -3.655 -17.630 455 2HB ARG 58 1HB ARG 58 24.513 -4.563 -16.962 456 1HG ARG 58 1HG ARG 58 22.982 -5.030 -14.899 457 2HG ARG 58 2HG ARG 58 21.671 -4.340 -15.863 458 1HD ARG 58 1HD ARG 58 22.092 -6.056 -17.680 459 2HD ARG 58 2HD ARG 58 23.359 -6.793 -16.711 460 1HH1 ARG 58 2HH2 ARG 58 23.538 -7.530 -14.725 461 2HH1 ARG 58 1HH2 ARG 58 22.771 -8.713 -13.551 462 1HH2 ARG 58 1HH1 ARG 58 19.626 -8.371 -14.911 463 2HH2 ARG 58 2HH1 ARG 58 20.705 -9.156 -13.652 464 H LYS 59 H LYS 59 25.935 -3.309 -17.584 465 HA LYS 59 HA LYS 59 26.079 -0.738 -19.046 466 1HB LYS 59 1HB LYS 59 28.458 -0.245 -18.835 467 2HB LYS 59 2HB LYS 59 27.564 -0.002 -17.352 468 1HG LYS 59 1HG LYS 59 28.489 -2.188 -16.432 469 2HG LYS 59 2HG LYS 59 29.430 -2.396 -17.911 470 1HD LYS 59 1HD LYS 59 30.620 -0.206 -17.467 471 2HD LYS 59 2HD LYS 59 29.681 0.002 -15.984 472 1HE LYS 59 1HE LYS 59 30.677 -2.145 -15.050 473 2HE LYS 59 2HE LYS 59 31.618 -2.354 -16.535 474 1HZ LYS 59 1HZ LYS 59 31.823 -0.060 -14.663 475 2HZ LYS 59 2HZ LYS 59 32.883 -1.299 -14.776 476 H GLY 60 H GLY 60 25.854 -1.439 -21.059 477 1HA GLY 60 1HA GLY 60 27.720 -3.022 -22.508 478 2HA GLY 60 2HA GLY 60 26.589 -4.213 -21.868 479 NH1 ARG 61 NH2 ARG 61 26.198 -6.928 -29.846 480 NH2 ARG 61 NH1 ARG 61 27.921 -5.465 -30.088 481 H ARG 61 H ARG 61 24.431 -4.169 -22.610 482 HA ARG 61 HA ARG 61 23.707 -2.390 -24.987 483 1HB ARG 61 1HB ARG 61 23.854 -5.487 -25.143 484 2HB ARG 61 2HB ARG 61 22.932 -4.499 -26.266 485 1HG ARG 61 1HG ARG 61 24.996 -3.253 -26.955 486 2HG ARG 61 2HG ARG 61 25.970 -4.247 -25.868 487 1HD ARG 61 1HD ARG 61 25.281 -6.327 -27.141 488 2HD ARG 61 2HD ARG 61 24.309 -5.329 -28.241 489 1HH1 ARG 61 2HH2 ARG 61 25.349 -7.187 -29.331 490 2HH1 ARG 61 1HH2 ARG 61 26.613 -7.431 -30.638 491 1HH2 ARG 61 1HH1 ARG 61 28.387 -4.611 -29.761 492 2HH2 ARG 61 2HH1 ARG 61 28.218 -6.069 -30.863 493 H ASN 62 H ASN 62 21.759 -2.336 -25.498 494 HA ASN 62 HA ASN 62 19.933 -1.769 -23.540 495 1HB ASN 62 1HB ASN 62 18.312 -1.395 -25.360 496 2HB ASN 62 2HB ASN 62 19.904 -0.827 -25.744 497 1HD2 ASN 62 2HD2 ASN 62 18.280 -3.518 -28.299 498 2HD2 ASN 62 1HD2 ASN 62 17.426 -3.038 -26.747 499 HA PRO 63 HA PRO 63 16.528 -4.667 -23.793 500 1HB PRO 63 1HB PRO 63 15.618 -4.743 -21.155 501 2HB PRO 63 2HB PRO 63 17.066 -5.650 -21.642 502 1HG PRO 63 1HG PRO 63 16.932 -2.964 -20.214 503 2HG PRO 63 2HG PRO 63 18.032 -4.318 -19.895 504 1HD PRO 63 1HD PRO 63 18.645 -2.024 -21.479 505 2HD PRO 63 2HD PRO 63 19.543 -3.563 -21.526 506 H GLN 64 H GLN 64 16.698 -1.431 -22.449 507 HA GLN 64 HA GLN 64 14.322 -0.646 -23.922 508 1HB GLN 64 1HB GLN 64 14.624 0.107 -20.948 509 2HB GLN 64 2HB GLN 64 13.992 1.264 -22.091 510 1HG GLN 64 1HG GLN 64 12.004 0.225 -22.472 511 2HG GLN 64 2HG GLN 64 12.689 -1.378 -22.453 512 1HE2 GLN 64 2HE2 GLN 64 10.932 -0.053 -19.015 513 2HE2 GLN 64 1HE2 GLN 64 10.972 0.920 -20.571 514 H THR 65 H THR 65 15.194 0.851 -24.843 515 HA THR 65 HA THR 65 16.000 2.374 -25.683 516 HB THR 65 HB THR 65 18.016 3.721 -25.287 517 HG1 THR 65 HG1 THR 65 19.330 2.110 -24.458 518 1HG2 THR 65 1HG2 THR 65 15.670 3.936 -24.271 519 2HG2 THR 65 2HG2 THR 65 16.148 2.987 -22.905 520 3HG2 THR 65 3HG2 THR 65 16.962 4.530 -23.159 521 H GLY 66 H GLY 66 17.329 -0.372 -26.603 522 1HA GLY 66 1HA GLY 66 17.993 -0.939 -28.904 523 2HA GLY 66 2HA GLY 66 17.388 0.611 -29.408 524 H GLU 67 H GLU 67 19.945 0.556 -26.914 525 HA GLU 67 HA GLU 67 22.070 1.298 -28.984 526 1HB GLU 67 2HB GLU 67 20.595 3.183 -27.946 527 2HB GLU 67 1HB GLU 67 21.297 2.829 -26.384 528 1HG GLU 67 1HG GLU 67 23.609 3.394 -27.319 529 2HG GLU 67 2HG GLU 67 22.881 3.739 -28.887 530 HE1 GLU 67 HE2 GLU 67 21.582 6.816 -27.979 531 H GLU 68 H GLU 68 24.156 1.076 -28.311 532 HA GLU 68 HA GLU 68 24.760 -0.804 -26.060 533 1HB GLU 68 1HB GLU 68 25.853 -0.976 -28.333 534 2HB GLU 68 2HB GLU 68 26.662 0.556 -28.096 535 1HG GLU 68 1HG GLU 68 27.096 -1.991 -26.392 536 2HG GLU 68 2HG GLU 68 28.063 -1.534 -27.771 537 HE1 GLU 68 HE2 GLU 68 29.794 1.061 -26.205 538 H MET 69 H MET 69 24.727 0.146 -24.047 539 HA MET 69 HA MET 69 26.155 2.612 -23.334 540 1HB MET 69 1HB MET 69 24.185 4.115 -22.858 541 2HB MET 69 2HB MET 69 24.416 3.798 -24.549 542 1HG MET 69 1HG MET 69 22.032 3.799 -24.083 543 2HG MET 69 2HG MET 69 22.497 2.171 -24.561 544 1HE MET 69 1HE MET 69 20.855 0.538 -23.570 545 2HE MET 69 3HE MET 69 22.404 0.000 -22.854 546 3HE MET 69 2HE MET 69 20.936 0.106 -21.843 547 H GLU 70 H GLU 70 25.052 3.462 -21.088 548 HA GLU 70 HA GLU 70 25.191 1.135 -19.225 549 1HB GLU 70 2HB GLU 70 25.307 2.660 -17.414 550 2HB GLU 70 1HB GLU 70 26.471 3.094 -18.672 551 1HG GLU 70 1HG GLU 70 24.907 4.987 -19.408 552 2HG GLU 70 2HG GLU 70 23.815 4.567 -18.092 553 HE1 GLU 70 HE2 GLU 70 27.295 6.498 -17.405 554 H ILE 71 H ILE 71 23.444 -0.038 -18.632 555 HA ILE 71 HA ILE 71 20.720 0.692 -19.301 556 HB ILE 71 HB ILE 71 21.897 -1.626 -17.657 557 1HG1 ILE 71 1HG1 ILE 71 21.278 -3.079 -19.591 558 2HG1 ILE 71 2HG1 ILE 71 20.798 -1.684 -20.535 559 1HG2 ILE 71 2HG2 ILE 71 19.564 -1.262 -16.975 560 2HG2 ILE 71 3HG2 ILE 71 19.040 -1.262 -18.685 561 3HG2 ILE 71 1HG2 ILE 71 19.706 -2.749 -17.932 562 1HD1 ILE 71 2HD1 ILE 71 23.687 -2.134 -19.540 563 2HD1 ILE 71 3HD1 ILE 71 23.069 -2.708 -21.103 564 3HD1 ILE 71 1HD1 ILE 71 23.128 -0.977 -20.776 565 HA PRO 72 HA PRO 72 20.325 2.987 -15.286 566 1HB PRO 72 1HB PRO 72 17.883 4.199 -15.658 567 2HB PRO 72 2HB PRO 72 19.302 4.591 -16.638 568 1HG PRO 72 1HG PRO 72 17.012 2.689 -17.365 569 2HG PRO 72 2HG PRO 72 17.677 4.016 -18.348 570 1HD PRO 72 1HD PRO 72 18.479 1.360 -18.655 571 2HD PRO 72 2HD PRO 72 19.590 2.728 -18.970 572 H ALA 73 H ALA 73 19.239 2.986 -13.321 573 HA ALA 73 HA ALA 73 17.604 0.522 -12.608 574 1HB ALA 73 1HB ALA 73 19.391 1.266 -10.929 575 2HB ALA 73 2HB ALA 73 18.492 2.814 -10.707 576 3HB ALA 73 3HB ALA 73 17.762 1.279 -10.242 577 H SER 74 H SER 74 15.838 0.807 -11.216 578 HA SER 74 HA SER 74 14.769 3.299 -10.610 579 1HB SER 74 1HB SER 74 12.447 3.355 -11.795 580 2HB SER 74 2HB SER 74 13.782 3.501 -12.931 581 HG SER 74 HG SER 74 13.612 1.243 -13.298 582 H LYS 75 H LYS 75 13.759 3.158 -8.754 583 HA LYS 75 HA LYS 75 12.866 0.504 -7.669 584 1HB LYS 75 2HB LYS 75 12.341 2.761 -5.849 585 2HB LYS 75 1HB LYS 75 12.964 1.160 -5.612 586 1HG LYS 75 1HG LYS 75 15.236 1.902 -6.430 587 2HG LYS 75 2HG LYS 75 14.592 3.522 -6.714 588 1HD LYS 75 1HD LYS 75 14.013 3.703 -4.232 589 2HD LYS 75 2HD LYS 75 14.768 2.125 -3.971 590 1HE LYS 75 1HE LYS 75 16.976 3.033 -4.846 591 2HE LYS 75 2HE LYS 75 16.221 4.611 -5.114 592 1HZ LYS 75 1HZ LYS 75 16.433 3.252 -2.485 593 2HZ LYS 75 2HZ LYS 75 15.739 4.711 -2.734 594 H VAL 76 H VAL 76 10.684 -0.273 -7.938 595 HA VAL 76 HA VAL 76 8.610 1.594 -8.665 596 HB VAL 76 HB VAL 76 9.879 -1.059 -9.270 597 1HG1 VAL 76 3HG2 VAL 76 6.973 -0.844 -9.534 598 2HG1 VAL 76 1HG2 VAL 76 8.111 -2.064 -10.321 599 3HG1 VAL 76 2HG2 VAL 76 7.966 -1.985 -8.557 600 1HG2 VAL 76 2HG1 VAL 76 10.239 0.889 -10.734 601 2HG2 VAL 76 3HG1 VAL 76 9.473 -0.472 -11.565 602 3HG2 VAL 76 1HG1 VAL 76 8.482 0.944 -11.079 603 HA PRO 77 HA PRO 77 7.161 0.310 -4.440 604 1HB PRO 77 1HB PRO 77 5.206 2.259 -4.080 605 2HB PRO 77 2HB PRO 77 6.930 2.659 -4.145 606 1HG PRO 77 1HG PRO 77 4.899 2.814 -6.431 607 2HG PRO 77 2HG PRO 77 6.020 4.078 -5.899 608 1HD PRO 77 1HD PRO 77 6.567 2.230 -8.044 609 2HD PRO 77 2HD PRO 77 7.899 2.905 -7.062 610 H ALA 78 H ALA 78 6.007 -1.038 -3.767 611 HA ALA 78 HA ALA 78 3.390 -1.969 -5.069 612 1HB ALA 78 2HB ALA 78 5.541 -3.284 -5.537 613 2HB ALA 78 3HB ALA 78 5.700 -3.597 -3.792 614 3HB ALA 78 1HB ALA 78 4.305 -4.246 -4.689 615 H PHE 79 H PHE 79 2.241 -3.431 -3.614 616 HA PHE 79 HA PHE 79 2.093 -2.726 -0.593 617 1HB PHE 79 2HB PHE 79 0.927 -0.982 -1.203 618 2HB PHE 79 1HB PHE 79 0.111 -1.841 -2.552 619 HD1 PHE 79 HD2 PHE 79 0.067 -1.475 1.188 620 HD2 PHE 79 HD1 PHE 79 -1.950 -3.069 -2.261 621 HE1 PHE 79 HE2 PHE 79 -1.891 -2.040 2.572 622 HE2 PHE 79 HE1 PHE 79 -3.869 -3.674 -0.855 623 HZ PHE 79 HZ PHE 79 -3.837 -3.183 1.565 624 H LYS 80 H LYS 80 1.869 -4.617 0.074 625 HA LYS 80 HA LYS 80 0.536 -7.120 -1.259 626 1HB LYS 80 2HB LYS 80 2.124 -6.913 1.312 627 2HB LYS 80 1HB LYS 80 1.267 -8.354 0.841 628 1HG LYS 80 1HG LYS 80 3.547 -7.084 -0.799 629 2HG LYS 80 2HG LYS 80 3.749 -8.383 0.353 630 1HD LYS 80 1HD LYS 80 2.109 -8.528 -2.251 631 2HD LYS 80 2HD LYS 80 3.714 -9.177 -2.019 632 1HE LYS 80 1HE LYS 80 1.169 -10.192 -0.577 633 2HE LYS 80 2HE LYS 80 1.927 -10.936 -1.977 634 1HZ LYS 80 1HZ LYS 80 3.904 -11.354 -0.670 635 2HZ LYS 80 2HZ LYS 80 2.588 -12.051 0.007 636 HA PRO 81 HA PRO 81 -3.046 -6.061 1.430 637 1HB PRO 81 1HB PRO 81 -4.786 -8.022 0.605 638 2HB PRO 81 2HB PRO 81 -4.287 -6.675 -0.423 639 1HG PRO 81 1HG PRO 81 -3.138 -9.518 -0.398 640 2HG PRO 81 2HG PRO 81 -3.775 -8.619 -1.801 641 1HD PRO 81 1HD PRO 81 -1.073 -8.699 -1.144 642 2HD PRO 81 2HD PRO 81 -1.802 -7.257 -1.923 643 H GLY 82 H GLY 82 -0.802 -7.308 2.654 644 1HA GLY 82 1HA GLY 82 0.076 -9.036 4.076 645 2HA GLY 82 2HA GLY 82 -1.321 -8.565 5.005 646 H LYS 83 H LYS 83 -1.995 -10.234 2.108 647 HA LYS 83 HA LYS 83 -2.819 -12.391 1.555 648 1HB LYS 83 2HB LYS 83 -1.183 -13.207 3.953 649 2HB LYS 83 1HB LYS 83 -2.598 -14.179 3.770 650 1HG LYS 83 1HG LYS 83 -1.909 -14.678 1.345 651 2HG LYS 83 2HG LYS 83 -0.475 -13.670 1.567 652 1HD LYS 83 1HD LYS 83 0.316 -15.209 3.422 653 2HD LYS 83 2HD LYS 83 -1.121 -16.213 3.199 654 1HE LYS 83 1HE LYS 83 -0.405 -16.698 0.801 655 2HE LYS 83 2HE LYS 83 1.040 -15.702 1.036 656 1HZ LYS 83 1HZ LYS 83 0.364 -18.124 2.613 657 2HZ LYS 83 2HZ LYS 83 1.696 -17.204 2.836 658 H ALA 84 H ALA 84 -3.380 -11.523 4.740 659 HA ALA 84 HA ALA 84 -5.949 -12.686 5.445 660 1HB ALA 84 2HB ALA 84 -4.176 -11.716 6.965 661 2HB ALA 84 3HB ALA 84 -4.455 -10.118 6.232 662 3HB ALA 84 1HB ALA 84 -5.741 -10.858 7.213 663 H LEU 85 H LEU 85 -5.189 -9.272 4.152 664 HA LEU 85 HA LEU 85 -8.013 -8.568 3.940 665 1HB LEU 85 2HB LEU 85 -6.249 -6.822 4.055 666 2HB LEU 85 1HB LEU 85 -5.543 -7.403 2.560 667 HG LEU 85 HG LEU 85 -7.812 -7.069 1.522 668 1HD1 LEU 85 1HD1 LEU 85 -8.222 -5.319 3.990 669 2HD1 LEU 85 2HD1 LEU 85 -9.222 -5.161 2.512 670 3HD1 LEU 85 3HD1 LEU 85 -9.251 -6.663 3.457 671 1HD2 LEU 85 1HD2 LEU 85 -5.799 -5.630 0.991 672 2HD2 LEU 85 2HD2 LEU 85 -7.276 -4.670 0.930 673 3HD2 LEU 85 3HD2 LEU 85 -6.192 -4.549 2.344 674 H LYS 86 H LYS 86 -5.718 -10.159 1.760 675 HA LYS 86 HA LYS 86 -7.449 -10.333 -0.579 676 1HB LYS 86 1HB LYS 86 -4.873 -10.924 -0.360 677 2HB LYS 86 2HB LYS 86 -5.424 -12.552 -0.031 678 1HG LYS 86 1HG LYS 86 -6.612 -12.614 -2.248 679 2HG LYS 86 2HG LYS 86 -6.239 -10.910 -2.517 680 1HD LYS 86 1HD LYS 86 -3.735 -11.476 -2.454 681 2HD LYS 86 2HD LYS 86 -4.160 -13.170 -2.264 682 1HE LYS 86 1HE LYS 86 -3.621 -12.839 -4.591 683 2HE LYS 86 2HE LYS 86 -5.355 -13.123 -4.513 684 1HZ LYS 86 1HZ LYS 86 -5.707 -10.737 -4.716 685 2HZ LYS 86 2HZ LYS 86 -4.846 -11.315 -5.979 686 H ASP 87 H ASP 87 -7.675 -12.106 2.435 687 HA ASP 87 HA ASP 87 -9.604 -14.129 1.406 688 1HB ASP 87 1HB ASP 87 -7.803 -13.838 3.657 689 2HB ASP 87 2HB ASP 87 -9.343 -13.578 4.360 690 HD1 ASP 87 HD2 ASP 87 -10.436 -16.884 3.925 691 H ALA 88 H ALA 88 -9.704 -11.077 3.357 692 HA ALA 88 HA ALA 88 -12.535 -10.826 3.938 693 1HB ALA 88 1HB ALA 88 -10.747 -9.087 4.677 694 2HB ALA 88 2HB ALA 88 -10.630 -8.530 3.002 695 3HB ALA 88 3HB ALA 88 -12.131 -8.308 3.862 696 H VAL 89 H VAL 89 -10.709 -9.825 1.039 697 HA VAL 89 HA VAL 89 -13.035 -8.726 -0.361 698 HB VAL 89 HB VAL 89 -10.555 -7.891 0.348 699 1HG1 VAL 89 2HG2 VAL 89 -9.518 -10.020 -0.693 700 2HG1 VAL 89 3HG2 VAL 89 -9.718 -9.250 -2.260 701 3HG1 VAL 89 1HG2 VAL 89 -8.743 -8.463 -0.970 702 1HG2 VAL 89 1HG1 VAL 89 -11.602 -7.398 -2.396 703 2HG2 VAL 89 2HG1 VAL 89 -11.992 -6.574 -0.836 704 3HG2 VAL 89 3HG1 VAL 89 -10.332 -6.481 -1.476 705 H LYS 90 H LYS 90 -11.786 -11.890 -0.427 706 HA LYS 90 HA LYS 90 -11.531 -12.405 -3.249 707 1HB LYS 90 1HB LYS 90 -10.913 -13.791 -0.912 708 2HB LYS 90 2HB LYS 90 -12.321 -14.697 -1.371 709 1HG LYS 90 1HG LYS 90 -11.234 -15.205 -3.620 710 2HG LYS 90 2HG LYS 90 -9.908 -14.126 -3.212 711 1HD LYS 90 1HD LYS 90 -8.969 -16.191 -2.754 712 2HD LYS 90 2HD LYS 90 -9.409 -15.633 -1.150 713 1HE LYS 90 1HE LYS 90 -11.486 -17.101 -1.206 714 2HE LYS 90 2HE LYS 90 -11.101 -17.602 -2.860 715 1HZ LYS 90 1HZ LYS 90 -9.411 -18.096 -0.471 716 2HZ LYS 90 2HZ LYS 90 -10.357 -19.200 -1.219 717 1H MET 1 1H MET 91 8.513 -1.068 8.233 718 2H MET 1 2H MET 91 9.607 -2.173 8.874 719 HA MET 1 HA MET 91 9.036 -1.238 10.746 720 1HB MET 1 1HB MET 91 6.285 -0.621 9.486 721 2HB MET 1 2HB MET 91 6.673 -0.300 11.158 722 1HG MET 1 1HG MET 91 7.058 1.789 10.247 723 2HG MET 1 2HG MET 91 8.699 1.151 10.247 724 1HE MET 1 2HE MET 91 6.469 3.231 8.440 725 2HE MET 1 1HE MET 91 6.531 2.842 6.698 726 3HE MET 1 3HE MET 91 5.469 1.917 7.792 727 H ASN 2 H ASN 92 5.813 -2.491 10.391 728 HA ASN 2 HA ASN 92 5.793 -5.060 10.560 729 1HB ASN 2 1HB ASN 92 5.771 -6.218 12.628 730 2HB ASN 2 2HB ASN 92 7.316 -5.465 12.376 731 1HD2 ASN 2 1HD2 ASN 92 7.184 -3.637 15.468 732 2HD2 ASN 2 2HD2 ASN 92 8.083 -3.947 13.899 733 H LYS 3 H LYS 93 4.539 -2.515 12.439 734 HA LYS 3 HA LYS 93 2.079 -1.920 11.703 735 1HB LYS 3 1HB LYS 93 1.264 -4.328 11.644 736 2HB LYS 3 2HB LYS 93 1.429 -4.434 13.381 737 1HG LYS 3 1HG LYS 93 -0.382 -2.691 13.638 738 2HG LYS 3 2HG LYS 93 -0.363 -2.373 11.903 739 1HD LYS 3 1HD LYS 93 -1.117 -4.752 11.464 740 2HD LYS 3 2HD LYS 93 -1.203 -5.037 13.207 741 1HE LYS 3 1HE LYS 93 -2.955 -3.216 13.423 742 2HE LYS 3 2HE LYS 93 -2.844 -2.888 11.687 743 1HZ LYS 3 1HZ LYS 93 -3.573 -5.141 11.247 744 2HZ LYS 3 2HZ LYS 93 -4.670 -4.342 12.159 745 H THR 4 H THR 94 3.918 -2.908 14.563 746 HA THR 4 HA THR 94 2.569 -1.054 16.349 747 HB THR 4 HB THR 94 4.741 -3.242 16.568 748 HG1 THR 4 HG1 THR 94 2.599 -4.028 16.205 749 1HG2 THR 4 3HG2 THR 94 3.301 -1.551 18.618 750 2HG2 THR 4 1HG2 THR 94 4.278 -3.054 18.995 751 3HG2 THR 4 2HG2 THR 94 5.063 -1.612 18.239 752 H GLU 5 H GLU 95 5.567 -1.488 14.410 753 HA GLU 5 HA GLU 95 7.129 0.658 15.731 754 1HB GLU 5 1HB GLU 95 8.267 -1.273 14.798 755 2HB GLU 5 2HB GLU 95 7.296 -1.268 13.332 756 1HG GLU 5 1HG GLU 95 9.381 -0.603 12.763 757 2HG GLU 5 2HG GLU 95 8.281 0.770 12.566 758 HE1 GLU 5 HE2 GLU 95 11.376 0.839 15.239 759 H LEU 6 H LEU 96 4.293 0.295 13.589 760 HA LEU 6 HA LEU 96 4.544 2.864 12.250 761 1HB LEU 6 2HB LEU 96 3.007 0.328 12.106 762 2HB LEU 6 1HB LEU 96 1.837 1.458 12.634 763 HG LEU 6 HG LEU 96 1.686 1.856 10.440 764 1HD1 LEU 6 2HD1 LEU 96 2.576 4.084 10.856 765 2HD1 LEU 6 3HD1 LEU 96 4.172 3.564 10.248 766 3HD1 LEU 6 1HD1 LEU 96 2.778 3.560 9.167 767 1HD2 LEU 6 2HD2 LEU 96 3.109 -0.128 9.826 768 2HD2 LEU 6 3HD2 LEU 96 3.225 1.138 8.589 769 3HD2 LEU 6 1HD2 LEU 96 4.537 0.929 9.781 770 H ILE 7 H ILE 97 2.983 1.471 15.136 771 HA ILE 7 HA ILE 97 1.306 3.740 15.900 772 HB ILE 7 HB ILE 97 2.558 1.596 17.700 773 1HG1 ILE 7 1HG1 ILE 97 -0.231 1.664 16.377 774 2HG1 ILE 7 2HG1 ILE 97 1.085 0.806 15.678 775 1HG2 ILE 7 2HG2 ILE 97 1.684 3.542 19.052 776 2HG2 ILE 7 3HG2 ILE 97 0.111 3.333 18.301 777 3HG2 ILE 7 1HG2 ILE 97 0.764 2.059 19.337 778 1HD1 ILE 7 3HD1 ILE 97 1.373 -0.517 17.870 779 2HD1 ILE 7 1HD1 ILE 97 -0.244 0.033 18.235 780 3HD1 ILE 7 2HD1 ILE 97 0.042 -0.903 16.731 781 H ASN 8 H ASN 98 4.597 2.827 16.852 782 HA ASN 8 HA ASN 98 5.203 5.418 18.205 783 1HB ASN 8 1HB ASN 98 7.188 3.389 16.905 784 2HB ASN 8 2HB ASN 98 7.687 4.762 17.862 785 1HD2 ASN 8 2HD2 ASN 98 6.511 1.412 19.871 786 2HD2 ASN 8 1HD2 ASN 98 6.361 1.547 18.047 787 H ALA 9 H ALA 99 4.897 4.766 14.835 788 HA ALA 9 HA ALA 99 6.559 7.076 13.863 789 1HB ALA 9 2HB ALA 99 5.627 5.047 12.268 790 2HB ALA 9 3HB ALA 99 4.059 5.826 12.402 791 3HB ALA 9 1HB ALA 99 5.322 6.724 11.664 792 H VAL 10 H VAL 100 3.147 6.422 14.586 793 HA VAL 10 HA VAL 100 2.216 8.955 13.701 794 HB VAL 10 HB VAL 100 0.390 7.382 15.445 795 1HG1 VAL 10 3HG2 VAL 100 -0.106 9.520 14.046 796 2HG1 VAL 10 1HG2 VAL 100 -0.082 8.407 12.651 797 3HG1 VAL 10 2HG2 VAL 100 -1.248 8.128 13.976 798 1HG2 VAL 10 1HG1 VAL 100 1.503 6.388 12.790 799 2HG2 VAL 10 2HG1 VAL 100 1.370 5.592 14.392 800 3HG2 VAL 10 3HG1 VAL 100 -0.116 5.862 13.420 801 H ALA 11 H ALA 101 2.507 7.485 16.689 802 HA ALA 11 HA ALA 101 1.897 9.862 18.097 803 1HB ALA 11 2HB ALA 101 1.654 7.594 19.168 804 2HB ALA 11 3HB ALA 101 3.423 7.375 19.164 805 3HB ALA 11 1HB ALA 101 2.666 8.613 20.220 806 H GLU 12 H GLU 102 4.952 8.898 16.702 807 HA GLU 12 HA GLU 102 6.494 11.001 18.197 808 1HB GLU 12 1HB GLU 102 7.651 8.909 17.441 809 2HB GLU 12 2HB GLU 102 7.331 9.320 15.754 810 1HG GLU 12 1HG GLU 102 8.780 11.409 16.041 811 2HG GLU 12 2HG GLU 102 9.079 10.959 17.717 812 HE1 GLU 12 HE2 GLU 102 11.357 8.454 16.998 813 H THR 13 H THR 103 5.252 10.607 14.801 814 HA THR 13 HA THR 103 5.850 13.405 14.168 815 HB THR 13 HB THR 103 4.363 13.077 12.102 816 HG1 THR 13 HG1 THR 103 3.829 10.622 13.390 817 1HG2 THR 13 3HG2 THR 103 6.096 10.575 12.471 818 2HG2 THR 13 1HG2 THR 103 5.329 11.133 10.974 819 3HG2 THR 13 2HG2 THR 103 6.602 12.121 11.730 820 H SER 14 H SER 104 3.494 12.456 15.964 821 HA SER 14 HA SER 104 1.724 14.951 15.427 822 1HB SER 14 1HB SER 104 0.489 12.251 16.208 823 2HB SER 14 2HB SER 104 -0.358 13.721 15.734 824 HG SER 14 HG SER 104 -0.198 12.211 14.072 825 H GLY 15 H GLY 105 2.811 12.727 18.027 826 1HA GLY 15 1HA GLY 105 2.636 12.920 20.382 827 2HA GLY 15 2HA GLY 105 2.319 14.643 20.181 828 H LEU 16 H LEU 106 0.583 11.702 19.311 829 HA LEU 16 HA LEU 106 -1.927 12.434 20.827 830 1HB LEU 16 1HB LEU 106 -3.097 10.826 19.497 831 2HB LEU 16 2HB LEU 106 -2.537 12.269 18.680 832 HG LEU 16 HG LEU 106 -0.824 11.224 17.612 833 1HD1 LEU 16 2HD1 LEU 106 -0.006 9.641 19.413 834 2HD1 LEU 16 3HD1 LEU 106 -1.394 8.600 18.964 835 3HD1 LEU 16 1HD1 LEU 106 -0.041 8.948 17.793 836 1HD2 LEU 16 2HD2 LEU 106 -2.421 11.106 16.166 837 2HD2 LEU 16 3HD2 LEU 106 -1.124 9.898 15.999 838 3HD2 LEU 16 1HD2 LEU 106 -2.679 9.385 16.617 839 H SER 17 H SER 107 -1.862 9.479 20.635 840 HA SER 17 HA SER 107 -0.370 8.747 23.205 841 1HB SER 17 1HB SER 107 -3.234 7.771 22.797 842 2HB SER 17 2HB SER 107 -2.150 7.374 24.110 843 HG SER 17 HG SER 107 -3.067 9.978 23.481 844 H LYS 18 H LYS 108 0.029 6.500 23.427 845 HA LYS 18 HA LYS 108 0.803 5.061 20.902 846 1HB LYS 18 1HB LYS 108 1.891 4.906 23.425 847 2HB LYS 18 2HB LYS 108 0.697 3.661 23.629 848 1HG LYS 18 1HG LYS 108 2.655 2.510 22.960 849 2HG LYS 18 2HG LYS 108 1.661 2.505 21.523 850 1HD LYS 18 1HD LYS 108 3.900 2.998 20.781 851 2HD LYS 18 2HD LYS 108 3.014 4.493 20.621 852 1HE LYS 18 1HE LYS 108 5.169 5.074 21.490 853 2HE LYS 18 2HE LYS 108 4.041 5.340 22.809 854 1HZ LYS 18 1HZ LYS 108 4.708 3.202 23.742 855 2HZ LYS 18 2HZ LYS 108 5.987 4.207 23.575 856 H LYS 19 H LYS 109 -1.697 4.660 23.350 857 HA LYS 19 HA LYS 109 -3.313 2.601 21.978 858 1HB LYS 19 2HB LYS 109 -4.198 4.761 23.987 859 2HB LYS 19 1HB LYS 109 -5.262 3.480 23.392 860 1HG LYS 19 1HG LYS 109 -3.743 1.730 24.366 861 2HG LYS 19 2HG LYS 109 -2.658 2.987 24.966 862 1HD LYS 19 1HD LYS 109 -4.545 3.958 26.346 863 2HD LYS 19 2HD LYS 109 -5.621 2.679 25.806 864 1HE LYS 19 1HE LYS 109 -2.994 2.218 27.391 865 2HE LYS 19 2HE LYS 109 -4.592 2.350 28.121 866 1HZ LYS 19 1HZ LYS 109 -5.301 0.406 26.910 867 2HZ LYS 19 2HZ LYS 109 -3.993 0.073 27.832 868 H ASP 20 H ASP 110 -3.314 6.247 21.683 869 HA ASP 20 HA ASP 110 -5.652 6.197 19.787 870 1HB ASP 20 1HB ASP 110 -3.671 8.424 20.546 871 2HB ASP 20 2HB ASP 110 -4.761 8.637 19.204 872 HD2 ASP 20 HD2 ASP 110 -6.080 9.532 22.719 873 H ALA 21 H ALA 111 -2.174 5.995 19.370 874 HA ALA 21 HA ALA 111 -2.232 6.255 16.405 875 1HB ALA 21 1HB ALA 111 -0.049 5.514 18.444 876 2HB ALA 21 2HB ALA 111 0.210 5.520 16.671 877 3HB ALA 21 3HB ALA 111 -0.265 6.969 17.508 878 H THR 22 H THR 112 -2.162 3.423 18.662 879 HA THR 22 HA THR 112 -2.210 1.309 16.713 880 HB THR 22 HB THR 112 -3.788 1.258 19.379 881 HG1 THR 22 HG1 THR 112 -1.755 2.120 19.775 882 1HG2 THR 22 2HG2 THR 112 -2.195 -0.841 17.789 883 2HG2 THR 22 3HG2 THR 112 -2.847 -1.098 19.432 884 3HG2 THR 22 1HG2 THR 112 -3.954 -0.795 18.046 885 H LYS 23 H LYS 113 -4.862 3.027 18.174 886 HA LYS 23 HA LYS 113 -7.101 1.832 16.683 887 1HB LYS 23 2HB LYS 113 -6.557 4.653 17.938 888 2HB LYS 23 1HB LYS 113 -8.089 4.306 17.237 889 1HG LYS 23 1HG LYS 113 -8.577 2.479 18.889 890 2HG LYS 23 2HG LYS 113 -6.987 2.686 19.621 891 1HD LYS 23 1HD LYS 113 -7.587 5.095 20.203 892 2HD LYS 23 2HD LYS 113 -9.193 4.849 19.514 893 1HE LYS 23 1HE LYS 113 -9.643 3.022 21.225 894 2HE LYS 23 2HE LYS 113 -8.023 3.255 21.901 895 1HZ LYS 23 1HZ LYS 113 -8.613 5.520 22.453 896 2HZ LYS 23 2HZ LYS 113 -9.652 4.466 23.148 897 H ALA 24 H ALA 114 -5.365 4.826 16.168 898 HA ALA 24 HA ALA 114 -6.727 5.763 13.858 899 1HB ALA 24 2HB ALA 114 -5.442 7.177 15.252 900 2HB ALA 24 3HB ALA 114 -3.914 6.336 14.827 901 3HB ALA 24 1HB ALA 114 -4.806 7.295 13.592 902 H VAL 25 H VAL 115 -3.821 3.701 13.904 903 HA VAL 25 HA VAL 115 -3.608 3.275 10.917 904 HB VAL 25 HB VAL 115 -2.836 1.945 13.709 905 1HG1 VAL 25 2HG2 VAL 115 -2.340 0.471 11.059 906 2HG1 VAL 25 3HG2 VAL 115 -1.608 0.056 12.652 907 3HG1 VAL 25 1HG2 VAL 115 -3.343 -0.069 12.415 908 1HG2 VAL 25 1HG1 VAL 115 -1.412 3.797 12.892 909 2HG2 VAL 25 2HG1 VAL 115 -0.518 2.284 13.063 910 3HG2 VAL 25 3HG1 VAL 115 -0.988 2.860 11.430 911 H ASP 26 H ASP 116 -5.181 1.244 13.499 912 HA ASP 26 HA ASP 116 -6.929 -0.142 11.459 913 1HB ASP 26 1HB ASP 116 -7.012 -0.052 14.543 914 2HB ASP 26 2HB ASP 116 -8.092 -1.041 13.575 915 HD2 ASP 26 HD2 ASP 116 -4.385 -2.294 14.344 916 H ALA 27 H ALA 117 -7.063 2.715 11.951 917 HA ALA 27 HA ALA 117 -10.059 3.230 11.804 918 1HB ALA 27 1HB ALA 117 -8.504 4.524 13.560 919 2HB ALA 27 2HB ALA 117 -8.112 5.490 12.145 920 3HB ALA 27 3HB ALA 117 -9.776 5.332 12.736 921 H VAL 28 H VAL 118 -7.031 4.107 10.256 922 HA VAL 28 HA VAL 118 -8.147 4.979 7.655 923 HB VAL 28 HB VAL 118 -5.354 3.621 8.075 924 1HG1 VAL 28 1HG2 VAL 118 -6.728 5.044 5.827 925 2HG1 VAL 28 2HG2 VAL 118 -5.046 5.497 6.091 926 3HG1 VAL 28 3HG2 VAL 118 -5.435 3.783 5.856 927 1HG2 VAL 28 3HG1 VAL 118 -5.994 6.511 8.508 928 2HG2 VAL 28 1HG1 VAL 118 -5.164 5.295 9.557 929 3HG2 VAL 28 2HG1 VAL 118 -4.352 5.848 8.094 930 H PHE 29 H PHE 119 -6.453 2.135 8.657 931 HA PHE 29 HA PHE 119 -7.233 0.393 6.374 932 1HB PHE 29 2HB PHE 119 -5.721 -0.410 8.916 933 2HB PHE 29 1HB PHE 119 -5.744 -1.328 7.432 934 HD1 PHE 29 HD1 PHE 119 -5.171 0.486 5.221 935 HD2 PHE 29 HD2 PHE 119 -3.589 0.549 9.218 936 HE1 PHE 29 HE1 PHE 119 -3.340 1.936 4.479 937 HE2 PHE 29 HE2 PHE 119 -1.776 2.019 8.468 938 HZ PHE 29 HZ PHE 119 -1.712 2.779 6.113 939 H ASP 30 H ASP 120 -9.187 1.171 8.843 940 HA ASP 30 HA ASP 120 -10.692 -1.460 8.562 941 1HB ASP 30 1HB ASP 120 -10.329 -0.229 10.857 942 2HB ASP 30 2HB ASP 120 -11.527 0.935 10.345 943 HD1 ASP 30 HD2 ASP 120 -12.569 -2.796 11.505 944 H SER 31 H SER 121 -11.153 1.966 8.091 945 HA SER 31 HA SER 121 -13.708 1.732 6.553 946 1HB SER 31 2HB SER 121 -11.677 4.052 6.586 947 2HB SER 31 1HB SER 121 -13.268 4.107 5.795 948 HG SER 31 HG SER 121 -13.314 4.940 7.888 949 H ILE 32 H ILE 122 -10.209 1.632 5.364 950 HA ILE 32 HA ILE 122 -10.743 1.521 2.599 951 HB ILE 32 HB ILE 122 -8.469 0.312 4.172 952 1HG1 ILE 32 1HG1 ILE 122 -8.968 3.043 2.929 953 2HG1 ILE 32 2HG1 ILE 122 -8.957 2.687 4.614 954 1HG2 ILE 32 1HG2 ILE 122 -8.914 0.936 1.169 955 2HG2 ILE 32 2HG2 ILE 122 -7.312 0.626 1.858 956 3HG2 ILE 32 3HG2 ILE 122 -8.595 -0.615 1.902 957 1HD1 ILE 32 2HD1 ILE 122 -6.422 2.340 3.040 958 2HD1 ILE 32 3HD1 ILE 122 -6.922 3.789 3.977 959 3HD1 ILE 32 1HD1 ILE 122 -6.711 2.216 4.814 960 H THR 33 H THR 123 -10.272 -1.160 4.864 961 HA THR 33 HA THR 123 -10.796 -3.234 2.848 962 HB THR 33 HB THR 123 -9.660 -3.985 4.744 963 HG1 THR 33 HG1 THR 123 -10.912 -5.499 5.800 964 1HG2 THR 33 2HG2 THR 123 -10.151 -2.091 6.318 965 2HG2 THR 33 3HG2 THR 123 -11.704 -2.807 6.707 966 3HG2 THR 33 1HG2 THR 123 -10.155 -3.629 7.153 967 H GLU 34 H GLU 124 -13.082 -1.383 4.800 968 HA GLU 34 HA GLU 124 -15.416 -3.002 3.811 969 1HB GLU 34 1HB GLU 124 -15.542 -1.717 6.021 970 2HB GLU 34 2HB GLU 124 -15.415 -0.209 5.136 971 1HG GLU 34 1HG GLU 124 -17.743 -0.579 5.730 972 2HG GLU 34 2HG GLU 124 -17.614 -0.676 3.986 973 HE1 GLU 34 HE2 GLU 124 -18.709 -3.859 6.229 974 H ALA 35 H ALA 125 -13.576 -0.182 2.694 975 HA ALA 35 HA ALA 125 -15.327 0.432 0.423 976 1HB ALA 35 2HB ALA 125 -13.168 2.014 1.240 977 2HB ALA 35 3HB ALA 125 -12.181 0.828 0.447 978 3HB ALA 35 1HB ALA 125 -13.261 1.763 -0.508 979 H LEU 36 H LEU 126 -12.317 -1.494 0.607 980 HA LEU 36 HA LEU 126 -12.234 -2.501 -2.132 981 1HB LEU 36 2HB LEU 126 -11.009 -3.745 0.266 982 2HB LEU 36 1HB LEU 126 -10.463 -3.809 -1.396 983 HG LEU 36 HG LEU 126 -10.222 -1.382 0.434 984 1HD1 LEU 36 3HD2 LEU 126 -8.327 -2.834 0.400 985 2HD1 LEU 36 1HD2 LEU 126 -8.179 -2.613 -1.402 986 3HD1 LEU 36 2HD2 LEU 126 -7.960 -1.231 -0.286 987 1HD2 LEU 36 3HD1 LEU 126 -11.177 -0.396 -1.647 988 2HD2 LEU 36 1HD1 LEU 126 -9.511 0.075 -1.396 989 3HD2 LEU 36 2HD1 LEU 126 -9.902 -1.202 -2.606 990 NH1 ARG 37 NH2 ARG 127 -14.162 -7.607 5.956 991 NH2 ARG 37 NH1 ARG 127 -15.130 -9.537 5.246 992 H ARG 37 H ARG 127 -13.391 -4.092 0.939 993 HA ARG 37 HA ARG 127 -14.216 -6.368 -0.554 994 1HB ARG 37 1HB ARG 127 -15.039 -7.419 1.270 995 2HB ARG 37 2HB ARG 127 -13.819 -6.371 1.942 996 1HG ARG 37 1HG ARG 127 -15.917 -4.702 2.342 997 2HG ARG 37 2HG ARG 127 -16.894 -6.140 2.097 998 1HD ARG 37 1HD ARG 127 -14.689 -5.701 4.146 999 2HD ARG 37 2HD ARG 127 -16.448 -5.626 4.441 1000 1HH1 ARG 37 2HH2 ARG 127 -14.071 -6.592 5.840 1001 2HH1 ARG 37 1HH2 ARG 127 -13.674 -8.194 6.642 1002 1HH2 ARG 37 1HH1 ARG 127 -15.777 -9.995 4.594 1003 2HH2 ARG 37 2HH1 ARG 127 -14.573 -9.990 5.979 1004 H LYS 38 H LYS 128 -15.789 -3.238 -0.189 1005 HA LYS 38 HA LYS 128 -18.483 -4.393 -0.971 1006 1HB LYS 38 1HB LYS 128 -18.287 -3.090 1.194 1007 2HB LYS 38 2HB LYS 128 -18.016 -1.643 0.227 1008 1HG LYS 38 1HG LYS 128 -20.322 -1.839 -0.734 1009 2HG LYS 38 2HG LYS 128 -20.526 -3.412 0.023 1010 1HD LYS 38 1HD LYS 128 -21.736 -1.779 1.320 1011 2HD LYS 38 2HD LYS 128 -20.407 -2.384 2.299 1012 1HE LYS 38 1HE LYS 128 -19.074 -0.268 1.796 1013 2HE LYS 38 2HE LYS 128 -20.398 0.324 0.782 1014 1HZ LYS 38 1HZ LYS 128 -21.834 0.268 2.736 1015 2HZ LYS 38 2HZ LYS 128 -20.631 -0.325 3.670 1016 H GLY 39 H GLY 129 -16.019 -3.508 -2.763 1017 1HA GLY 39 1HA GLY 129 -15.783 -2.650 -4.984 1018 2HA GLY 39 2HA GLY 129 -17.525 -2.550 -5.098 1019 H ASP 40 H ASP 130 -15.399 -0.828 -2.872 1020 HA ASP 40 HA ASP 130 -16.027 1.870 -4.180 1021 1HB ASP 40 1HB ASP 130 -15.497 1.603 -1.249 1022 2HB ASP 40 2HB ASP 130 -15.950 3.021 -2.128 1023 HD2 ASP 40 HD2 ASP 130 -16.950 0.190 -0.743 1024 H LYS 41 H LYS 131 -14.548 3.216 -4.754 1025 HA LYS 41 HA LYS 131 -11.647 2.433 -4.527 1026 1HB LYS 41 2HB LYS 131 -12.672 5.000 -5.800 1027 2HB LYS 41 1HB LYS 131 -11.038 4.354 -5.889 1028 1HG LYS 41 1HG LYS 131 -11.954 2.332 -7.159 1029 2HG LYS 41 2HG LYS 131 -13.535 3.118 -7.193 1030 1HD LYS 41 1HD LYS 131 -12.537 5.099 -8.421 1031 2HD LYS 41 2HD LYS 131 -10.943 4.367 -8.312 1032 1HE LYS 41 1HE LYS 131 -11.722 3.978 -10.544 1033 2HE LYS 41 2HE LYS 131 -11.710 2.414 -9.729 1034 1HZ LYS 41 1HZ LYS 131 -14.092 4.126 -10.220 1035 2HZ LYS 41 2HZ LYS 131 -13.706 2.759 -11.030 1036 H VAL 42 H VAL 132 -10.403 3.169 -2.906 1037 HA VAL 42 HA VAL 132 -11.102 5.390 -1.127 1038 HB VAL 42 HB VAL 132 -8.995 3.138 -1.367 1039 1HG1 VAL 42 3HG2 VAL 132 -8.119 4.937 0.031 1040 2HG1 VAL 42 1HG2 VAL 132 -9.581 4.742 1.113 1041 3HG1 VAL 42 2HG2 VAL 132 -8.420 3.368 0.856 1042 1HG2 VAL 42 2HG1 VAL 132 -11.498 3.511 0.363 1043 2HG2 VAL 42 3HG1 VAL 132 -11.127 2.212 -0.858 1044 3HG2 VAL 42 1HG1 VAL 132 -10.303 2.266 0.700 1045 H GLN 43 H GLN 133 -9.813 6.951 -0.939 1046 HA GLN 43 HA GLN 133 -7.682 7.627 -3.020 1047 1HB GLN 43 1HB GLN 133 -10.119 9.366 -2.979 1048 2HB GLN 43 2HB GLN 133 -8.596 9.771 -3.764 1049 1HG GLN 43 1HG GLN 133 -8.785 7.641 -5.118 1050 2HG GLN 43 2HG GLN 133 -10.325 7.293 -4.339 1051 1HE2 GLN 43 1HE2 GLN 133 -11.461 8.595 -7.495 1052 2HE2 GLN 43 2HE2 GLN 133 -10.768 7.118 -6.668 1053 H LEU 44 H LEU 134 -6.077 8.719 -2.671 1054 HA LEU 44 HA LEU 134 -5.703 10.387 -0.155 1055 1HB LEU 44 2HB LEU 134 -3.591 8.392 -1.200 1056 2HB LEU 44 1HB LEU 134 -3.505 9.387 0.241 1057 HG LEU 44 HG LEU 134 -5.784 7.949 0.808 1058 1HD1 LEU 44 2HD1 LEU 134 -5.633 6.558 -1.319 1059 2HD1 LEU 44 3HD1 LEU 134 -4.082 5.903 -0.755 1060 3HD1 LEU 44 1HD1 LEU 134 -5.583 5.599 0.161 1061 1HD2 LEU 44 2HD2 LEU 134 -3.753 8.149 2.304 1062 2HD2 LEU 44 3HD2 LEU 134 -4.418 6.504 2.290 1063 3HD2 LEU 44 1HD2 LEU 134 -2.943 6.869 1.370 1064 H ILE 45 H ILE 135 -5.071 12.411 -0.891 1065 HA ILE 45 HA ILE 135 -4.160 12.764 -3.672 1066 HB ILE 45 HB ILE 135 -5.776 14.289 -2.545 1067 1HG1 ILE 45 1HG1 ILE 135 -3.406 15.767 -3.824 1068 2HG1 ILE 45 2HG1 ILE 135 -4.540 14.777 -4.725 1069 1HG2 ILE 45 3HG2 ILE 135 -4.538 14.601 -0.380 1070 2HG2 ILE 45 1HG2 ILE 135 -3.300 15.560 -1.229 1071 3HG2 ILE 45 2HG2 ILE 135 -4.986 16.152 -1.133 1072 1HD1 ILE 45 2HD1 ILE 135 -6.464 16.254 -4.007 1073 2HD1 ILE 45 3HD1 ILE 135 -5.310 17.315 -3.153 1074 3HD1 ILE 45 1HD1 ILE 135 -5.209 17.128 -4.917 1075 H GLY 46 H GLY 136 -2.285 13.639 -4.383 1076 1HA GLY 46 1HA GLY 136 0.089 13.422 -4.719 1077 2HA GLY 46 2HA GLY 136 0.192 14.114 -3.116 1078 H PHE 47 H PHE 137 -1.185 10.931 -3.216 1079 HA PHE 47 HA PHE 137 1.386 9.445 -2.851 1080 1HB PHE 47 2HB PHE 137 0.463 10.590 -0.746 1081 2HB PHE 47 1HB PHE 137 -0.984 9.633 -0.833 1082 HD1 PHE 47 HD2 PHE 137 2.788 8.984 -0.947 1083 HD2 PHE 47 HD1 PHE 137 -1.067 7.566 0.329 1084 HE1 PHE 47 HE2 PHE 137 3.774 6.827 -0.271 1085 HE2 PHE 47 HE1 PHE 137 -0.038 5.449 1.032 1086 HZ PHE 47 HZ PHE 137 2.404 5.095 0.694 1087 H GLY 48 H GLY 138 -2.209 9.060 -3.297 1088 1HA GLY 48 1HA GLY 138 -1.908 6.601 -4.651 1089 2HA GLY 48 2HA GLY 138 -2.112 6.125 -2.972 1090 H ASN 49 H ASN 139 -3.516 5.032 -4.670 1091 HA ASN 49 HA ASN 139 -6.322 5.828 -3.941 1092 1HB ASN 49 1HB ASN 139 -6.037 7.059 -6.042 1093 2HB ASN 49 2HB ASN 139 -5.405 5.656 -6.875 1094 1HD2 ASN 49 2HD2 ASN 139 -8.814 5.940 -8.160 1095 2HD2 ASN 49 1HD2 ASN 139 -7.171 6.753 -8.255 1096 H PHE 50 H PHE 140 -6.745 3.954 -2.854 1097 HA PHE 50 HA PHE 140 -5.840 1.304 -3.929 1098 1HB PHE 50 2HB PHE 140 -7.788 1.566 -1.587 1099 2HB PHE 50 1HB PHE 140 -7.102 0.107 -2.151 1100 HD1 PHE 50 HD1 PHE 140 -6.242 3.469 -0.744 1101 HD2 PHE 50 HD2 PHE 140 -5.448 -0.747 -0.749 1102 HE1 PHE 50 HE1 PHE 140 -4.696 3.740 1.194 1103 HE2 PHE 50 HE2 PHE 140 -3.957 -0.435 1.213 1104 HZ PHE 50 HZ PHE 140 -3.439 1.825 1.979 1105 H GLU 51 H GLU 141 -7.147 -0.196 -4.829 1106 HA GLU 51 HA GLU 141 -10.050 0.103 -4.921 1107 1HB GLU 51 1HB GLU 141 -10.486 0.456 -7.344 1108 2HB GLU 51 2HB GLU 141 -9.627 1.801 -6.656 1109 1HG GLU 51 1HG GLU 141 -8.629 1.579 -8.752 1110 2HG GLU 51 2HG GLU 141 -7.435 0.866 -7.688 1111 HE1 GLU 51 HE2 GLU 141 -9.579 -1.386 -10.331 1112 H VAL 52 H VAL 142 -11.277 -1.683 -5.845 1113 HA VAL 52 HA VAL 142 -9.702 -4.156 -5.581 1114 HB VAL 52 HB VAL 142 -12.221 -3.063 -4.636 1115 1HG1 VAL 52 1HG2 VAL 142 -12.852 -4.974 -6.894 1116 2HG1 VAL 52 2HG2 VAL 142 -13.961 -4.472 -5.566 1117 3HG1 VAL 52 3HG2 VAL 142 -13.291 -3.272 -6.725 1118 1HG2 VAL 52 1HG1 VAL 142 -10.974 -5.809 -4.514 1119 2HG2 VAL 52 2HG1 VAL 142 -11.098 -4.511 -3.315 1120 3HG2 VAL 52 3HG1 VAL 142 -12.544 -5.413 -3.783 1121 NH1 ARG 53 NH2 ARG 143 -9.693 -4.179 -13.639 1122 NH2 ARG 53 NH1 ARG 143 -10.487 -2.371 -12.513 1123 H ARG 53 H ARG 143 -9.974 -5.938 -7.224 1124 HA ARG 53 HA ARG 143 -10.392 -4.808 -10.053 1125 1HB ARG 53 1HB ARG 143 -7.896 -5.468 -8.908 1126 2HB ARG 53 2HB ARG 143 -8.498 -7.015 -9.230 1127 1HG ARG 53 1HG ARG 143 -7.249 -6.593 -11.151 1128 2HG ARG 53 2HG ARG 143 -8.869 -6.317 -11.743 1129 1HD ARG 53 1HD ARG 143 -6.835 -4.147 -10.876 1130 2HD ARG 53 2HD ARG 143 -7.145 -4.619 -12.530 1131 1HH1 ARG 53 2HH2 ARG 143 -9.003 -4.937 -13.682 1132 2HH1 ARG 53 1HH2 ARG 143 -10.442 -3.991 -14.315 1133 1HH2 ARG 53 1HH1 ARG 143 -10.403 -1.750 -11.701 1134 2HH2 ARG 53 2HH1 ARG 143 -11.180 -2.309 -13.267 1135 H GLU 54 H GLU 144 -12.483 -5.698 -10.392 1136 HA GLU 54 HA GLU 144 -13.149 -8.485 -9.819 1137 1HB GLU 54 1HB GLU 144 -14.821 -6.656 -10.277 1138 2HB GLU 54 2HB GLU 144 -14.423 -6.716 -11.991 1139 1HG GLU 54 1HG GLU 144 -15.170 -9.163 -12.043 1140 2HG GLU 54 2HG GLU 144 -15.540 -9.081 -10.324 1141 HE1 GLU 54 HE2 GLU 144 -17.130 -7.834 -9.653 1142 NH1 ARG 55 NH2 ARG 145 -7.188 -12.339 -15.613 1143 NH2 ARG 55 NH1 ARG 145 -5.164 -13.108 -14.925 1144 H ARG 55 H ARG 145 -11.582 -9.881 -10.455 1145 HA ARG 55 HA ARG 145 -10.188 -9.713 -13.046 1146 1HB ARG 55 1HB ARG 145 -9.136 -10.245 -10.828 1147 2HB ARG 55 2HB ARG 145 -10.054 -11.733 -10.720 1148 1HG ARG 55 1HG ARG 145 -7.810 -12.248 -11.299 1149 2HG ARG 55 2HG ARG 145 -8.812 -12.679 -12.676 1150 1HD ARG 55 1HD ARG 145 -8.052 -10.525 -13.852 1151 2HD ARG 55 2HD ARG 145 -7.099 -10.110 -12.434 1152 1HH1 ARG 55 2HH2 ARG 145 -8.021 -11.782 -15.396 1153 2HH1 ARG 55 1HH2 ARG 145 -7.003 -12.857 -16.480 1154 1HH2 ARG 55 1HH1 ARG 145 -4.453 -13.139 -14.186 1155 2HH2 ARG 55 2HH1 ARG 145 -5.121 -13.571 -15.840 1156 H ALA 56 H ALA 146 -10.253 -11.041 -14.762 1157 HA ALA 56 HA ALA 146 -12.573 -13.001 -15.086 1158 1HB ALA 56 1HB ALA 146 -10.616 -11.873 -17.187 1159 2HB ALA 56 2HB ALA 146 -11.998 -12.948 -17.504 1160 3HB ALA 56 3HB ALA 146 -12.279 -11.312 -16.876 1161 H ALA 57 H ALA 147 -11.835 -14.688 -13.796 1162 HA ALA 57 HA ALA 147 -10.535 -16.244 -12.786 1163 1HB ALA 57 1HB ALA 147 -11.628 -17.291 -14.716 1164 2HB ALA 57 2HB ALA 147 -10.240 -16.914 -15.770 1165 3HB ALA 57 3HB ALA 147 -10.062 -18.093 -14.440 1166 NH1 ARG 58 NH2 ARG 148 -7.518 -14.705 -5.195 1167 NH2 ARG 58 NH1 ARG 148 -7.625 -16.972 -5.230 1168 H ARG 58 H ARG 148 -8.874 -16.764 -11.689 1169 HA ARG 58 HA ARG 148 -6.442 -15.259 -12.377 1170 1HB ARG 58 2HB ARG 148 -6.529 -16.899 -9.823 1171 2HB ARG 58 1HB ARG 148 -5.569 -15.481 -10.186 1172 1HG ARG 58 1HG ARG 148 -7.717 -14.102 -10.149 1173 2HG ARG 58 2HG ARG 148 -8.607 -15.527 -9.651 1174 1HD ARG 58 1HD ARG 148 -6.264 -14.293 -8.048 1175 2HD ARG 58 2HD ARG 148 -7.968 -13.916 -7.802 1176 1HH1 ARG 58 2HH2 ARG 148 -7.431 -13.834 -5.730 1177 2HH1 ARG 58 1HH2 ARG 148 -7.600 -14.794 -4.176 1178 1HH2 ARG 58 1HH1 ARG 148 -7.621 -17.833 -5.789 1179 2HH2 ARG 58 2HH1 ARG 148 -7.698 -16.902 -4.209 1180 H LYS 59 H LYS 149 -4.317 -16.692 -11.555 1181 HA LYS 59 HA LYS 149 -4.377 -19.506 -12.673 1182 1HB LYS 59 1HB LYS 149 -2.546 -17.365 -13.941 1183 2HB LYS 59 2HB LYS 149 -2.296 -19.099 -14.093 1184 1HG LYS 59 1HG LYS 149 -4.582 -19.350 -15.161 1185 2HG LYS 59 2HG LYS 149 -4.792 -17.598 -15.091 1186 1HD LYS 59 1HD LYS 149 -2.750 -17.279 -16.538 1187 2HD LYS 59 2HD LYS 149 -2.523 -19.031 -16.610 1188 1HE LYS 59 1HE LYS 149 -4.805 -19.282 -17.716 1189 2HE LYS 59 2HE LYS 149 -5.027 -17.527 -17.649 1190 1HZ LYS 59 1HZ LYS 149 -2.871 -18.948 -19.112 1191 2HZ LYS 59 2HZ LYS 149 -4.200 -18.272 -19.782 1192 H GLY 60 H GLY 150 -3.374 -20.692 -11.160 1193 1HA GLY 60 1HA GLY 150 -0.761 -19.992 -10.019 1194 2HA GLY 60 2HA GLY 150 -2.011 -19.487 -8.878 1195 NH1 ARG 61 NH2 ARG 151 3.710 -23.777 -7.152 1196 NH2 ARG 61 NH1 ARG 151 4.103 -24.088 -4.935 1197 H ARG 61 H ARG 151 -1.277 -20.911 -7.368 1198 HA ARG 61 HA ARG 151 -2.114 -23.790 -7.710 1199 1HB ARG 61 1HB ARG 151 0.308 -23.655 -8.411 1200 2HB ARG 61 2HB ARG 151 0.731 -23.095 -6.794 1201 1HG ARG 61 1HG ARG 151 -0.274 -25.333 -5.897 1202 2HG ARG 61 2HG ARG 151 -0.538 -25.805 -7.545 1203 1HD ARG 61 1HD ARG 151 1.468 -26.891 -6.900 1204 2HD ARG 61 2HD ARG 151 1.989 -25.629 -7.992 1205 1HH1 ARG 61 2HH2 ARG 151 3.156 -24.034 -7.976 1206 2HH1 ARG 61 1HH2 ARG 151 4.471 -23.090 -7.112 1207 1HH2 ARG 61 1HH1 ARG 151 3.851 -24.576 -4.069 1208 2HH2 ARG 61 2HH1 ARG 151 4.840 -23.382 -5.051 1209 H ASN 62 H ASN 152 -3.218 -24.342 -6.126 1210 HA ASN 62 HA ASN 152 -4.331 -24.479 -4.202 1211 1HB ASN 62 1HB ASN 152 -3.103 -25.273 -2.242 1212 2HB ASN 62 2HB ASN 152 -2.655 -25.965 -3.775 1213 1HD2 ASN 62 2HD2 ASN 152 0.216 -23.946 -1.697 1214 2HD2 ASN 62 1HD2 ASN 152 -1.561 -23.521 -1.475 1215 HA PRO 63 HA PRO 153 -4.848 -20.733 -1.758 1216 1HB PRO 63 1HB PRO 153 -6.481 -19.009 -3.193 1217 2HB PRO 63 2HB PRO 153 -4.718 -19.032 -3.388 1218 1HG PRO 63 1HG PRO 153 -6.807 -20.377 -5.177 1219 2HG PRO 63 2HG PRO 153 -5.374 -19.440 -5.660 1220 1HD PRO 63 1HD PRO 153 -5.463 -22.250 -5.551 1221 2HD PRO 63 2HD PRO 153 -3.965 -21.277 -5.411 1222 H GLN 64 H GLN 154 -7.572 -21.536 -3.887 1223 HA GLN 64 HA GLN 154 -9.335 -22.210 -1.534 1224 1HB GLN 64 1HB GLN 154 -11.035 -22.709 -3.569 1225 2HB GLN 64 2HB GLN 154 -10.779 -21.129 -2.886 1226 1HG GLN 64 1HG GLN 154 -9.356 -20.430 -4.790 1227 2HG GLN 64 2HG GLN 154 -9.378 -22.057 -5.454 1228 1HE2 GLN 64 2HE2 GLN 154 -12.612 -19.639 -6.166 1229 2HE2 GLN 64 1HE2 GLN 154 -11.230 -19.124 -5.076 1230 H THR 65 H THR 155 -7.881 -23.988 -4.315 1231 HA THR 65 HA THR 155 -9.384 -26.457 -3.450 1232 HB THR 65 HB THR 155 -9.151 -27.176 -5.742 1233 HG1 THR 65 HG1 THR 155 -8.089 -25.881 -7.237 1234 1HG2 THR 65 1HG2 THR 155 -10.956 -25.403 -5.220 1235 2HG2 THR 65 2HG2 THR 155 -9.845 -24.177 -5.843 1236 3HG2 THR 65 3HG2 THR 155 -10.430 -25.440 -6.938 1237 H GLY 66 H GLY 156 -5.995 -25.550 -3.218 1238 1HA GLY 66 1HA GLY 156 -4.219 -27.077 -2.525 1239 2HA GLY 66 2HA GLY 156 -5.340 -28.377 -2.534 1240 H GLU 67 H GLU 157 -5.151 -26.836 -5.676 1241 HA GLU 67 HA GLU 157 -3.047 -28.799 -6.701 1242 1HB GLU 67 2HB GLU 157 -5.600 -29.451 -6.765 1243 2HB GLU 67 1HB GLU 157 -5.835 -28.172 -7.947 1244 1HG GLU 67 1HG GLU 157 -4.234 -29.349 -9.528 1245 2HG GLU 67 2HG GLU 157 -3.913 -30.574 -8.305 1246 HE1 GLU 67 HE2 GLU 157 -7.368 -30.508 -10.432 1247 H GLU 68 H GLU 158 -2.475 -28.267 -9.026 1248 HA GLU 68 HA GLU 158 -2.089 -25.285 -9.381 1249 1HB GLU 68 1HB GLU 158 -0.464 -25.674 -11.067 1250 2HB GLU 68 2HB GLU 158 -0.041 -26.549 -9.628 1251 1HG GLU 68 1HG GLU 158 -1.147 -27.806 -12.221 1252 2HG GLU 68 2HG GLU 158 0.530 -27.740 -11.738 1253 HE1 GLU 68 HE2 GLU 158 0.356 -30.254 -9.336 1254 H MET 69 H MET 159 -3.605 -24.176 -10.490 1255 HA MET 69 HA MET 159 -4.778 -25.107 -13.003 1256 1HB MET 69 1HB MET 159 -7.079 -25.548 -12.442 1257 2HB MET 69 2HB MET 159 -6.114 -26.624 -11.478 1258 1HG MET 69 1HG MET 159 -7.454 -24.043 -10.401 1259 2HG MET 69 2HG MET 159 -8.108 -25.674 -10.276 1260 1HE MET 69 3HE MET 159 -6.819 -23.218 -8.028 1261 2HE MET 69 2HE MET 159 -5.340 -23.831 -7.242 1262 3HE MET 69 1HE MET 159 -5.251 -23.199 -8.904 1263 H GLU 70 H GLU 160 -6.354 -23.710 -13.911 1264 HA GLU 70 HA GLU 160 -6.119 -20.854 -13.203 1265 1HB GLU 70 2HB GLU 160 -7.501 -20.301 -15.061 1266 2HB GLU 70 1HB GLU 160 -6.213 -21.413 -15.533 1267 1HG GLU 70 1HG GLU 160 -7.912 -23.316 -15.597 1268 2HG GLU 70 2HG GLU 160 -9.185 -22.181 -15.157 1269 HE1 GLU 70 HE2 GLU 160 -7.634 -22.263 -18.885 1270 H ILE 71 H ILE 161 -7.222 -19.879 -11.707 1271 HA ILE 71 HA ILE 161 -9.369 -21.201 -10.111 1272 HB ILE 71 HB ILE 161 -7.747 -18.614 -9.891 1273 1HG1 ILE 71 1HG1 ILE 161 -7.231 -20.924 -7.943 1274 2HG1 ILE 71 2HG1 ILE 161 -6.646 -21.176 -9.559 1275 1HG2 ILE 71 3HG2 ILE 161 -9.510 -19.903 -7.769 1276 2HG2 ILE 71 1HG2 ILE 161 -8.329 -18.595 -7.461 1277 3HG2 ILE 71 2HG2 ILE 161 -9.707 -18.298 -8.533 1278 1HD1 ILE 71 1HD1 ILE 161 -5.871 -18.734 -7.858 1279 2HD1 ILE 71 2HD1 ILE 161 -4.873 -20.181 -8.163 1280 3HD1 ILE 71 3HD1 ILE 161 -5.287 -19.088 -9.504 1281 HA PRO 72 HA PRO 162 -12.744 -18.445 -11.865 1282 1HB PRO 72 1HB PRO 162 -13.765 -18.441 -8.970 1283 2HB PRO 72 2HB PRO 162 -14.677 -18.717 -10.467 1284 1HG PRO 72 1HG PRO 162 -13.989 -20.833 -8.920 1285 2HG PRO 72 2HG PRO 162 -13.794 -20.968 -10.685 1286 1HD PRO 72 1HD PRO 162 -11.630 -20.386 -8.594 1287 2HD PRO 72 2HD PRO 162 -11.576 -21.492 -10.000 1288 H ALA 73 H ALA 163 -13.987 -16.245 -10.922 1289 HA ALA 73 HA ALA 163 -11.955 -14.162 -10.883 1290 1HB ALA 73 2HB ALA 163 -14.381 -13.645 -11.541 1291 2HB ALA 73 3HB ALA 163 -14.847 -13.775 -9.801 1292 3HB ALA 73 1HB ALA 163 -13.744 -12.516 -10.339 1293 H SER 74 H SER 164 -11.616 -12.538 -9.406 1294 HA SER 74 HA SER 164 -12.820 -12.650 -6.814 1295 1HB SER 74 1HB SER 164 -9.657 -12.689 -6.916 1296 2HB SER 74 2HB SER 164 -10.528 -12.320 -5.441 1297 HG SER 74 HG SER 164 -9.886 -14.491 -5.590 1298 H LYS 75 H LYS 165 -12.659 -10.663 -5.615 1299 HA LYS 75 HA LYS 165 -12.058 -8.257 -7.366 1300 1HB LYS 75 2HB LYS 165 -12.858 -7.627 -4.580 1301 2HB LYS 75 1HB LYS 165 -13.152 -6.848 -6.113 1302 1HG LYS 75 1HG LYS 165 -14.961 -8.512 -6.641 1303 2HG LYS 75 2HG LYS 165 -14.630 -9.356 -5.121 1304 1HD LYS 75 1HD LYS 165 -15.171 -7.242 -3.823 1305 2HD LYS 75 2HD LYS 165 -15.536 -6.410 -5.337 1306 1HE LYS 75 1HE LYS 165 -17.411 -8.062 -5.797 1307 2HE LYS 75 2HE LYS 165 -17.039 -8.906 -4.285 1308 1HZ LYS 75 1HZ LYS 165 -18.836 -7.321 -4.036 1309 2HZ LYS 75 2HZ LYS 165 -17.897 -6.072 -4.521 1310 H VAL 76 H VAL 166 -9.983 -7.864 -7.436 1311 HA VAL 76 HA VAL 166 -8.217 -8.602 -5.260 1312 HB VAL 76 HB VAL 166 -6.591 -9.006 -6.460 1313 1HG1 VAL 76 3HG2 VAL 166 -8.645 -10.415 -6.833 1314 2HG1 VAL 76 1HG2 VAL 166 -8.847 -9.550 -8.378 1315 3HG1 VAL 76 2HG2 VAL 166 -7.407 -10.602 -8.140 1316 1HG2 VAL 76 3HG1 VAL 166 -6.469 -6.977 -8.131 1317 2HG2 VAL 76 1HG1 VAL 166 -5.565 -8.504 -8.268 1318 3HG2 VAL 76 2HG1 VAL 166 -6.992 -8.305 -9.238 1319 HA PRO 77 HA PRO 167 -7.831 -4.293 -4.166 1320 1HB PRO 77 1HB PRO 167 -6.673 -4.540 -1.625 1321 2HB PRO 77 2HB PRO 167 -8.322 -5.100 -1.969 1322 1HG PRO 77 1HG PRO 167 -5.747 -6.767 -2.013 1323 2HG PRO 77 2HG PRO 167 -7.216 -7.103 -1.094 1324 1HD PRO 77 1HD PRO 167 -6.681 -8.236 -3.632 1325 2HD PRO 77 2HD PRO 167 -8.358 -7.832 -3.188 1326 H ALA 78 H ALA 168 -6.662 -3.014 -4.865 1327 HA ALA 78 HA ALA 168 -3.632 -3.258 -5.194 1328 1HB ALA 78 3HB ALA 168 -5.182 -3.396 -7.222 1329 2HB ALA 78 1HB ALA 168 -5.829 -1.787 -6.827 1330 3HB ALA 78 2HB ALA 168 -4.117 -1.972 -7.285 1331 H PHE 79 H PHE 169 -2.689 -1.156 -5.440 1332 HA PHE 79 HA PHE 169 -3.677 1.216 -3.761 1333 1HB PHE 79 2HB PHE 169 -2.852 0.240 -1.975 1334 2HB PHE 79 1HB PHE 169 -1.426 -0.400 -2.847 1335 HD1 PHE 79 HD2 PHE 169 -2.888 2.792 -1.496 1336 HD2 PHE 79 HD1 PHE 169 0.602 0.887 -3.142 1337 HE1 PHE 79 HE2 PHE 169 -1.573 4.836 -1.113 1338 HE2 PHE 79 HE1 PHE 169 1.879 2.958 -2.817 1339 HZ PHE 79 HZ PHE 169 0.790 4.943 -1.856 1340 H LYS 80 H LYS 170 -3.240 2.592 -5.120 1341 HA LYS 80 HA LYS 170 -1.250 2.695 -7.543 1342 1HB LYS 80 2HB LYS 170 -3.393 4.653 -6.668 1343 2HB LYS 80 1HB LYS 170 -2.285 4.931 -7.981 1344 1HG LYS 80 1HG LYS 170 -4.355 2.645 -7.865 1345 2HG LYS 80 2HG LYS 170 -4.581 4.183 -8.676 1346 1HD LYS 80 1HD LYS 170 -2.650 3.673 -10.221 1347 2HD LYS 80 2HD LYS 170 -2.421 2.110 -9.452 1348 1HE LYS 80 1HE LYS 170 -5.016 2.986 -10.900 1349 2HE LYS 80 2HE LYS 170 -3.723 2.045 -11.637 1350 1HZ LYS 80 1HZ LYS 170 -5.517 0.657 -10.855 1351 2HZ LYS 80 2HZ LYS 170 -5.351 1.183 -9.315 1352 HA PRO 81 HA PRO 171 1.389 5.213 -4.756 1353 1HB PRO 81 1HB PRO 171 3.521 5.612 -6.449 1354 2HB PRO 81 2HB PRO 171 3.129 4.009 -5.813 1355 1HG PRO 81 1HG PRO 171 2.357 5.146 -8.556 1356 2HG PRO 81 2HG PRO 171 3.195 3.610 -8.217 1357 1HD PRO 81 1HD PRO 171 0.430 3.818 -8.580 1358 2HD PRO 81 2HD PRO 171 1.155 2.562 -7.524 1359 H GLY 82 H GLY 172 -0.903 6.356 -6.028 1360 1HA GLY 82 1HA GLY 172 -1.892 8.189 -7.223 1361 2HA GLY 82 2HA GLY 172 -0.955 9.004 -5.991 1362 H LYS 83 H LYS 173 0.796 7.514 -8.498 1363 HA LYS 83 HA LYS 173 2.219 8.384 -10.260 1364 1HB LYS 83 2HB LYS 173 0.070 10.478 -10.355 1365 2HB LYS 83 1HB LYS 173 1.609 11.148 -10.727 1366 1HG LYS 83 1HG LYS 173 1.929 9.348 -12.536 1367 2HG LYS 83 2HG LYS 173 0.355 8.670 -12.110 1368 1HD LYS 83 1HD LYS 173 -0.749 10.893 -12.738 1369 2HD LYS 83 2HD LYS 173 0.832 11.533 -13.158 1370 1HE LYS 83 1HE LYS 173 -0.207 10.909 -15.230 1371 2HE LYS 83 2HE LYS 173 1.081 9.738 -14.960 1372 1HZ LYS 83 1HZ LYS 173 -1.814 9.316 -14.424 1373 2HZ LYS 83 2HZ LYS 173 -0.977 8.714 -15.693 1374 H ALA 84 H ALA 174 1.522 10.566 -7.839 1375 HA ALA 84 HA ALA 174 3.818 12.316 -7.599 1376 1HB ALA 84 2HB ALA 174 1.507 12.667 -6.702 1377 2HB ALA 84 3HB ALA 174 1.674 11.244 -5.642 1378 3HB ALA 84 1HB ALA 174 2.679 12.688 -5.342 1379 H LEU 85 H LEU 175 3.023 9.284 -5.644 1380 HA LEU 85 HA LEU 175 5.654 9.234 -4.341 1381 1HB LEU 85 2HB LEU 175 3.751 8.043 -3.241 1382 2HB LEU 85 1HB LEU 175 3.551 7.030 -4.653 1383 HG LEU 85 HG LEU 175 5.963 6.388 -4.380 1384 1HD1 LEU 85 1HD1 LEU 175 6.611 8.100 -2.576 1385 2HD1 LEU 85 2HD1 LEU 175 5.738 7.072 -1.414 1386 3HD1 LEU 85 3HD1 LEU 175 7.138 6.431 -2.286 1387 1HD2 LEU 85 3HD2 LEU 175 4.096 4.784 -3.926 1388 2HD2 LEU 85 1HD2 LEU 175 5.417 4.485 -2.788 1389 3HD2 LEU 85 2HD2 LEU 175 3.957 5.362 -2.255 1390 H LYS 86 H LYS 176 4.264 7.859 -7.299 1391 HA LYS 86 HA LYS 176 6.570 6.291 -8.149 1392 1HB LYS 86 1HB LYS 176 4.153 6.321 -9.184 1393 2HB LYS 86 2HB LYS 176 4.741 7.609 -10.216 1394 1HG LYS 86 1HG LYS 176 6.563 6.082 -11.074 1395 2HG LYS 86 2HG LYS 176 6.029 4.815 -9.966 1396 1HD LYS 86 1HD LYS 176 3.764 4.775 -11.102 1397 2HD LYS 86 2HD LYS 176 4.307 6.029 -12.224 1398 1HE LYS 86 1HE LYS 176 6.141 4.479 -13.068 1399 2HE LYS 86 2HE LYS 176 5.606 3.227 -11.937 1400 1HZ LYS 86 1HZ LYS 176 3.932 4.406 -14.086 1401 2HZ LYS 86 2HZ LYS 176 3.439 3.249 -13.041 1402 H ASP 87 H ASP 177 6.202 9.784 -8.153 1403 HA ASP 87 HA ASP 177 8.684 10.207 -9.779 1404 1HB ASP 87 1HB ASP 177 6.265 11.701 -9.249 1405 2HB ASP 87 2HB ASP 177 7.414 12.464 -8.223 1406 HD1 ASP 87 HD2 ASP 177 7.621 12.606 -12.299 1407 H ALA 88 H ALA 178 7.645 10.356 -6.357 1408 HA ALA 88 HA ALA 178 10.081 11.299 -5.065 1409 1HB ALA 88 3HB ALA 178 7.827 10.762 -3.857 1410 2HB ALA 88 1HB ALA 178 8.168 9.041 -4.070 1411 3HB ALA 88 2HB ALA 178 9.230 9.996 -3.060 1412 H VAL 89 H VAL 179 9.178 8.006 -6.249 1413 HA VAL 89 HA VAL 179 11.453 6.702 -4.929 1414 HB VAL 89 HB VAL 179 8.754 6.438 -4.867 1415 1HG1 VAL 89 2HG2 VAL 179 8.629 6.335 -7.457 1416 2HG1 VAL 89 3HG2 VAL 179 9.229 4.677 -7.318 1417 3HG1 VAL 89 1HG2 VAL 179 7.707 5.165 -6.505 1418 1HG2 VAL 89 3HG1 VAL 179 10.530 4.075 -5.148 1419 2HG2 VAL 89 1HG1 VAL 179 10.194 5.106 -3.699 1420 3HG2 VAL 89 2HG1 VAL 179 8.857 4.184 -4.447 1421 H LYS 90 H LYS 180 10.823 7.812 -8.128 1422 HA LYS 90 HA LYS 180 11.865 5.645 -9.683 1423 1HB LYS 90 1HB LYS 180 11.604 6.997 -11.554 1424 2HB LYS 90 2HB LYS 180 10.325 7.384 -10.442 1425 1HG LYS 90 1HG LYS 180 11.562 9.506 -9.771 1426 2HG LYS 90 2HG LYS 180 12.805 9.141 -10.963 1427 1HD LYS 90 1HD LYS 180 11.104 9.238 -12.822 1428 2HD LYS 90 2HD LYS 180 9.818 9.471 -11.653 1429 1HE LYS 90 1HE LYS 180 10.260 11.638 -12.568 1430 2HE LYS 90 2HE LYS 180 10.871 11.676 -10.917 1431 1HZ LYS 90 1HZ LYS 180 12.496 11.298 -13.378 1432 2HZ LYS 90 2HZ LYS 180 12.392 12.673 -12.501 Start of MODEL 25 Raw file had 1432 H/Q atoms Start of MODEL 25 1 1H MET 1 1H MET 1 -10.478 5.493 -2.119 2 2H MET 1 2H MET 1 -11.906 5.326 -1.342 3 HA MET 1 HA MET 1 -11.989 7.641 -0.810 4 1HB MET 1 1HB MET 1 -9.404 6.321 0.219 5 2HB MET 1 2HB MET 1 -10.289 7.631 0.972 6 1HG MET 1 1HG MET 1 -12.352 5.951 1.036 7 2HG MET 1 2HG MET 1 -11.153 4.693 0.754 8 1HE MET 1 2HE MET 1 -9.827 3.617 2.496 9 2HE MET 1 1HE MET 1 -8.645 4.961 2.710 10 3HE MET 1 3HE MET 1 -9.440 4.242 4.117 11 H ASN 2 H ASN 2 -8.823 8.582 -0.545 12 HA ASN 2 HA ASN 2 -8.109 9.655 -2.868 13 1HB ASN 2 1HB ASN 2 -8.877 11.837 -3.395 14 2HB ASN 2 2HB ASN 2 -10.227 10.747 -3.386 15 1HD2 ASN 2 1HD2 ASN 2 -10.382 13.949 -0.928 16 2HD2 ASN 2 2HD2 ASN 2 -8.882 13.459 -1.866 17 H LYS 3 H LYS 3 -8.636 10.841 0.336 18 HA LYS 3 HA LYS 3 -6.280 10.970 1.623 19 1HB LYS 3 1HB LYS 3 -5.160 12.298 -0.354 20 2HB LYS 3 2HB LYS 3 -6.190 13.636 0.036 21 1HG LYS 3 1HG LYS 3 -4.088 14.145 0.921 22 2HG LYS 3 2HG LYS 3 -4.977 13.699 2.359 23 1HD LYS 3 1HD LYS 3 -3.853 11.509 2.478 24 2HD LYS 3 2HD LYS 3 -3.218 11.666 0.842 25 1HE LYS 3 1HE LYS 3 -1.747 13.578 1.513 26 2HE LYS 3 2HE LYS 3 -2.354 13.493 3.168 27 1HZ LYS 3 1HZ LYS 3 -1.474 11.249 3.329 28 2HZ LYS 3 2HZ LYS 3 -0.293 12.313 2.947 29 H THR 4 H THR 4 -9.125 12.946 0.769 30 HA THR 4 HA THR 4 -9.234 14.298 3.348 31 HB THR 4 HB THR 4 -10.778 14.358 0.668 32 HG1 THR 4 HG1 THR 4 -8.655 15.265 0.623 33 1HG2 THR 4 3HG2 THR 4 -10.983 16.053 3.157 34 2HG2 THR 4 1HG2 THR 4 -11.708 16.463 1.528 35 3HG2 THR 4 2HG2 THR 4 -12.228 14.979 2.416 36 H GLU 5 H GLU 5 -10.765 11.592 1.464 37 HA GLU 5 HA GLU 5 -13.016 11.154 3.329 38 1HB GLU 5 1HB GLU 5 -13.232 10.642 0.948 39 2HB GLU 5 2HB GLU 5 -11.672 9.831 0.886 40 1HG GLU 5 1HG GLU 5 -13.298 8.239 0.747 41 2HG GLU 5 2HG GLU 5 -12.425 8.045 2.274 42 HE2 GLU 5 HE2 GLU 5 -15.279 8.210 4.226 43 H LEU 6 H LEU 6 -9.591 10.791 3.194 44 HA LEU 6 HA LEU 6 -9.157 8.606 5.144 45 1HB LEU 6 2HB LEU 6 -7.519 10.131 3.383 46 2HB LEU 6 1HB LEU 6 -7.127 10.866 4.915 47 HG LEU 6 HG LEU 6 -6.810 7.941 4.264 48 1HD1 LEU 6 3HD1 LEU 6 -4.838 10.225 4.695 49 2HD1 LEU 6 1HD1 LEU 6 -4.363 8.518 4.618 50 3HD1 LEU 6 2HD1 LEU 6 -5.109 9.321 3.209 51 1HD2 LEU 6 1HD2 LEU 6 -6.696 9.310 6.968 52 2HD2 LEU 6 2HD2 LEU 6 -7.356 7.728 6.531 53 3HD2 LEU 6 3HD2 LEU 6 -5.602 7.975 6.607 54 H ILE 7 H ILE 7 -9.228 12.212 5.233 55 HA ILE 7 HA ILE 7 -8.716 12.610 8.049 56 HB ILE 7 HB ILE 7 -10.361 14.440 6.189 57 1HG1 ILE 7 1HG1 ILE 7 -7.341 14.621 6.718 58 2HG1 ILE 7 2HG1 ILE 7 -7.967 13.783 5.348 59 1HG2 ILE 7 2HG2 ILE 7 -10.556 15.112 8.627 60 2HG2 ILE 7 3HG2 ILE 7 -8.794 15.212 8.714 61 3HG2 ILE 7 1HG2 ILE 7 -9.695 16.330 7.679 62 1HD1 ILE 7 3HD1 ILE 7 -9.188 15.934 4.612 63 2HD1 ILE 7 1HD1 ILE 7 -8.136 16.774 5.745 64 3HD1 ILE 7 2HD1 ILE 7 -7.420 15.813 4.424 65 H ASN 8 H ASN 8 -11.816 12.425 6.311 66 HA ASN 8 HA ASN 8 -13.465 12.461 8.768 67 1HB ASN 8 1HB ASN 8 -14.234 11.341 5.964 68 2HB ASN 8 2HB ASN 8 -15.365 11.577 7.272 69 1HD2 ASN 8 2HD2 ASN 8 -14.463 14.816 4.974 70 2HD2 ASN 8 1HD2 ASN 8 -13.640 13.193 4.738 71 H ALA 9 H ALA 9 -11.656 9.845 7.416 72 HA ALA 9 HA ALA 9 -13.156 7.619 8.769 73 1HB ALA 9 2HB ALA 9 -11.326 7.193 6.846 74 2HB ALA 9 3HB ALA 9 -10.103 7.730 8.000 75 3HB ALA 9 1HB ALA 9 -10.992 6.297 8.378 76 H VAL 10 H VAL 10 -10.323 9.682 9.459 77 HA VAL 10 HA VAL 10 -9.598 8.287 11.830 78 HB VAL 10 HB VAL 10 -8.472 11.018 11.437 79 1HG1 VAL 10 3HG2 VAL 10 -7.826 9.177 13.187 80 2HG1 VAL 10 1HG2 VAL 10 -6.992 8.423 11.802 81 3HG1 VAL 10 2HG2 VAL 10 -6.538 10.072 12.299 82 1HG2 VAL 10 1HG1 VAL 10 -8.102 8.705 9.490 83 2HG2 VAL 10 2HG1 VAL 10 -8.531 10.424 9.223 84 3HG2 VAL 10 3HG1 VAL 10 -6.851 10.003 9.695 85 H ALA 11 H ALA 11 -10.884 11.312 11.187 86 HA ALA 11 HA ALA 11 -11.439 11.835 13.911 87 1HB ALA 11 2HB ALA 11 -11.248 13.694 12.218 88 2HB ALA 11 3HB ALA 11 -12.750 13.153 11.426 89 3HB ALA 11 1HB ALA 11 -12.800 13.864 13.073 90 H GLU 12 H GLU 12 -13.318 9.946 11.666 91 HA GLU 12 HA GLU 12 -15.744 9.932 13.435 92 1HB GLU 12 1HB GLU 12 -16.008 9.656 10.960 93 2HB GLU 12 2HB GLU 12 -15.090 8.150 11.011 94 1HG GLU 12 1HG GLU 12 -16.909 7.142 12.494 95 2HG GLU 12 2HG GLU 12 -17.794 8.664 12.435 96 HE1 GLU 12 HE2 GLU 12 -19.031 8.221 9.237 97 H THR 13 H THR 13 -13.072 7.588 12.662 98 HA THR 13 HA THR 13 -13.929 5.794 14.824 99 HB THR 13 HB THR 13 -11.689 4.607 14.511 100 HG1 THR 13 HG1 THR 13 -10.269 5.541 13.057 101 1HG2 THR 13 3HG2 THR 13 -12.814 5.286 11.740 102 2HG2 THR 13 1HG2 THR 13 -11.652 4.008 12.142 103 3HG2 THR 13 2HG2 THR 13 -13.314 3.922 12.779 104 H SER 14 H SER 14 -12.419 8.486 15.199 105 HA SER 14 HA SER 14 -11.150 7.714 17.929 106 1HB SER 14 1HB SER 14 -9.918 9.820 16.063 107 2HB SER 14 2HB SER 14 -9.263 9.259 17.598 108 HG SER 14 HG SER 14 -9.701 7.685 15.278 109 H GLY 15 H GLY 15 -12.810 10.393 16.205 110 1HA GLY 15 1HA GLY 15 -13.778 12.389 17.047 111 2HA GLY 15 2HA GLY 15 -13.770 11.679 18.661 112 H LEU 16 H LEU 16 -11.216 12.600 16.409 113 HA LEU 16 HA LEU 16 -9.863 14.504 18.320 114 1HB LEU 16 1HB LEU 16 -7.928 14.399 16.914 115 2HB LEU 16 2HB LEU 16 -8.339 12.948 17.802 116 HG LEU 16 HG LEU 16 -9.142 11.846 15.989 117 1HD1 LEU 16 2HD1 LEU 16 -10.344 13.714 14.767 118 2HD1 LEU 16 3HD1 LEU 16 -8.722 14.220 14.192 119 3HD1 LEU 16 1HD1 LEU 16 -9.449 12.618 13.715 120 1HD2 LEU 16 3HD2 LEU 16 -7.079 11.201 16.021 121 2HD2 LEU 16 1HD2 LEU 16 -7.914 11.072 14.455 122 3HD2 LEU 16 2HD2 LEU 16 -6.725 12.335 14.674 123 H SER 17 H SER 17 -9.256 15.474 15.584 124 HA SER 17 HA SER 17 -11.578 17.407 15.102 125 1HB SER 17 1HB SER 17 -8.718 18.472 15.077 126 2HB SER 17 2HB SER 17 -10.190 19.347 14.728 127 HG SER 17 HG SER 17 -9.574 18.119 17.202 128 H LYS 18 H LYS 18 -11.580 18.319 12.968 129 HA LYS 18 HA LYS 18 -10.763 16.403 10.791 130 1HB LYS 18 1HB LYS 18 -11.960 19.211 10.455 131 2HB LYS 18 2HB LYS 18 -11.617 18.093 9.149 132 1HG LYS 18 1HG LYS 18 -13.656 17.625 11.406 133 2HG LYS 18 2HG LYS 18 -14.029 18.147 9.773 134 1HD LYS 18 1HD LYS 18 -13.196 15.987 8.825 135 2HD LYS 18 2HD LYS 18 -12.723 15.415 10.414 136 1HE LYS 18 1HE LYS 18 -15.630 16.055 9.579 137 2HE LYS 18 2HE LYS 18 -14.895 14.452 9.591 138 1HZ LYS 18 1HZ LYS 18 -16.185 14.855 11.565 139 2HZ LYS 18 2HZ LYS 18 -15.289 16.160 11.976 140 H LYS 19 H LYS 19 -9.665 19.595 11.881 141 HA LYS 19 HA LYS 19 -7.248 19.717 10.201 142 1HB LYS 19 2HB LYS 19 -8.204 21.713 11.333 143 2HB LYS 19 1HB LYS 19 -7.821 21.057 12.923 144 1HG LYS 19 1HG LYS 19 -6.214 22.784 12.301 145 2HG LYS 19 2HG LYS 19 -5.403 21.249 12.482 146 1HD LYS 19 1HD LYS 19 -4.435 22.417 10.585 147 2HD LYS 19 2HD LYS 19 -5.230 20.974 10.012 148 1HE LYS 19 1HE LYS 19 -5.689 22.731 8.418 149 2HE LYS 19 2HE LYS 19 -7.214 22.373 9.219 150 1HZ LYS 19 1HZ LYS 19 -6.807 24.739 8.998 151 2HZ LYS 19 2HZ LYS 19 -5.406 24.652 9.836 152 H ASP 20 H ASP 20 -7.841 18.121 13.435 153 HA ASP 20 HA ASP 20 -4.938 17.363 13.716 154 1HB ASP 20 1HB ASP 20 -7.451 16.477 15.252 155 2HB ASP 20 2HB ASP 20 -5.938 15.639 15.475 156 HD1 ASP 20 HD2 ASP 20 -4.253 18.159 17.143 157 H ALA 21 H ALA 21 -7.733 15.845 12.226 158 HA ALA 21 HA ALA 21 -6.437 13.203 11.773 159 1HB ALA 21 2HB ALA 21 -9.052 14.481 10.772 160 2HB ALA 21 3HB ALA 21 -8.471 12.878 10.227 161 3HB ALA 21 1HB ALA 21 -8.805 13.177 11.905 162 H THR 22 H THR 22 -6.888 16.162 9.732 163 HA THR 22 HA THR 22 -5.506 15.244 7.374 164 HB THR 22 HB THR 22 -5.383 18.145 8.444 165 HG1 THR 22 HG1 THR 22 -7.488 17.412 8.690 166 1HG2 THR 22 3HG2 THR 22 -5.725 16.889 5.656 167 2HG2 THR 22 1HG2 THR 22 -5.784 18.643 5.999 168 3HG2 THR 22 2HG2 THR 22 -4.266 17.713 6.271 169 H LYS 23 H LYS 23 -4.240 16.902 10.175 170 HA LYS 23 HA LYS 23 -1.383 16.880 9.513 171 1HB LYS 23 2HB LYS 23 -2.941 16.675 12.213 172 2HB LYS 23 1HB LYS 23 -1.211 16.772 12.207 173 1HG LYS 23 1HG LYS 23 -1.210 19.025 11.122 174 2HG LYS 23 2HG LYS 23 -2.969 19.009 11.009 175 1HD LYS 23 1HD LYS 23 -3.159 18.892 13.517 176 2HD LYS 23 2HD LYS 23 -1.399 18.839 13.667 177 1HE LYS 23 1HE LYS 23 -1.221 21.135 12.613 178 2HE LYS 23 2HE LYS 23 -2.979 21.194 12.420 179 1HZ LYS 23 1HZ LYS 23 -3.188 20.995 14.834 180 2HZ LYS 23 2HZ LYS 23 -1.565 20.928 15.016 181 H ALA 24 H ALA 24 -3.190 14.694 11.559 182 HA ALA 24 HA ALA 24 -1.203 12.776 12.219 183 1HB ALA 24 2HB ALA 24 -3.277 13.022 13.382 184 2HB ALA 24 3HB ALA 24 -4.212 12.455 11.960 185 3HB ALA 24 1HB ALA 24 -3.115 11.331 12.837 186 H VAL 25 H VAL 25 -3.278 12.745 9.377 187 HA VAL 25 HA VAL 25 -2.246 10.276 8.069 188 HB VAL 25 HB VAL 25 -3.723 12.984 7.390 189 1HG1 VAL 25 1HG2 VAL 25 -2.711 11.087 5.188 190 2HG1 VAL 25 2HG2 VAL 25 -3.920 12.399 4.967 191 3HG1 VAL 25 3HG2 VAL 25 -2.266 12.780 5.414 192 1HG2 VAL 25 2HG1 VAL 25 -4.541 10.081 7.039 193 2HG2 VAL 25 3HG1 VAL 25 -5.059 11.176 8.337 194 3HG2 VAL 25 1HG1 VAL 25 -5.551 11.528 6.673 195 H ASP 26 H ASP 26 -1.381 13.738 7.513 196 HA ASP 26 HA ASP 26 1.323 12.939 6.380 197 1HB ASP 26 1HB ASP 26 0.165 15.683 7.164 198 2HB ASP 26 2HB ASP 26 1.730 15.464 6.389 199 HD1 ASP 26 HD2 ASP 26 0.517 14.691 3.212 200 H ALA 27 H ALA 27 0.562 12.404 9.077 201 HA ALA 27 HA ALA 27 3.146 12.994 10.526 202 1HB ALA 27 2HB ALA 27 0.721 13.609 11.584 203 2HB ALA 27 3HB ALA 27 0.769 11.906 12.006 204 3HB ALA 27 1HB ALA 27 2.002 13.050 12.585 205 H VAL 28 H VAL 28 0.901 10.349 9.882 206 HA VAL 28 HA VAL 28 2.791 8.106 10.372 207 HB VAL 28 HB VAL 28 0.297 8.362 8.499 208 1HG1 VAL 28 2HG2 VAL 28 1.820 5.807 9.311 209 2HG1 VAL 28 3HG2 VAL 28 0.200 5.858 8.559 210 3HG1 VAL 28 1HG2 VAL 28 1.562 6.482 7.654 211 1HG2 VAL 28 3HG1 VAL 28 -0.232 8.555 10.839 212 2HG2 VAL 28 1HG1 VAL 28 -0.896 7.082 10.048 213 3HG2 VAL 28 2HG1 VAL 28 0.572 6.949 11.131 214 H PHE 29 H PHE 29 1.482 9.458 7.498 215 HA PHE 29 HA PHE 29 3.339 8.269 5.549 216 1HB PHE 29 2HB PHE 29 1.387 10.543 4.973 217 2HB PHE 29 1HB PHE 29 2.162 9.531 3.764 218 HD1 PHE 29 HD1 PHE 29 1.937 6.814 4.319 219 HD2 PHE 29 HD2 PHE 29 -0.869 9.885 5.367 220 HE1 PHE 29 HE1 PHE 29 0.283 5.103 4.896 221 HE2 PHE 29 HE2 PHE 29 -2.491 8.177 6.017 222 HZ PHE 29 HZ PHE 29 -1.860 5.780 5.884 223 H ASP 30 H ASP 30 3.718 11.278 7.278 224 HA ASP 30 HA ASP 30 5.787 12.240 5.333 225 1HB ASP 30 1HB ASP 30 4.320 13.679 6.971 226 2HB ASP 30 2HB ASP 30 5.449 13.263 8.235 227 HD2 ASP 30 HD2 ASP 30 7.982 15.354 7.195 228 H SER 31 H SER 31 5.748 10.590 8.310 229 HA SER 31 HA SER 31 8.753 10.393 8.689 230 1HB SER 31 1HB SER 31 6.622 8.692 10.070 231 2HB SER 31 2HB SER 31 8.335 8.754 10.485 232 HG SER 31 HG SER 31 6.552 10.956 10.550 233 H ILE 32 H ILE 32 6.201 8.169 7.140 234 HA ILE 32 HA ILE 32 7.901 6.073 6.496 235 HB ILE 32 HB ILE 32 5.618 6.923 4.797 236 1HG1 ILE 32 1HG1 ILE 32 5.631 5.982 7.634 237 2HG1 ILE 32 2HG1 ILE 32 4.778 7.235 6.758 238 1HG2 ILE 32 2HG2 ILE 32 6.948 4.223 5.466 239 2HG2 ILE 32 3HG2 ILE 32 5.455 4.376 4.527 240 3HG2 ILE 32 1HG2 ILE 32 6.978 5.083 3.944 241 1HD1 ILE 32 1HD1 ILE 32 4.017 4.361 6.360 242 2HD1 ILE 32 2HD1 ILE 32 3.410 5.436 7.657 243 3HD1 ILE 32 3HD1 ILE 32 3.132 5.892 5.939 244 H THR 33 H THR 33 7.001 8.835 4.474 245 HA THR 33 HA THR 33 8.950 8.146 2.353 246 HB THR 33 HB THR 33 7.215 9.733 1.805 247 HG1 THR 33 HG1 THR 33 8.359 11.404 0.873 248 1HG2 THR 33 1HG2 THR 33 6.980 10.829 4.084 249 2HG2 THR 33 2HG2 THR 33 8.363 11.841 3.730 250 3HG2 THR 33 3HG2 THR 33 6.853 11.963 2.745 251 H GLU 34 H GLU 34 9.500 9.779 5.369 252 HA GLU 34 HA GLU 34 12.357 10.480 4.721 253 1HB GLU 34 1HB GLU 34 11.043 11.831 6.419 254 2HB GLU 34 2HB GLU 34 10.863 10.405 7.436 255 1HG GLU 34 1HG GLU 34 13.365 10.330 7.785 256 2HG GLU 34 2HG GLU 34 13.574 11.713 6.718 257 HE2 GLU 34 HE2 GLU 34 12.960 13.617 7.360 258 H ALA 35 H ALA 35 10.635 7.749 6.306 259 HA ALA 35 HA ALA 35 13.063 6.203 6.837 260 1HB ALA 35 3HB ALA 35 10.602 5.490 7.764 261 2HB ALA 35 1HB ALA 35 10.177 5.119 6.119 262 3HB ALA 35 2HB ALA 35 11.376 4.155 6.901 263 H LEU 36 H LEU 36 10.817 6.092 4.029 264 HA LEU 36 HA LEU 36 12.276 4.066 2.508 265 1HB LEU 36 2HB LEU 36 10.358 6.038 1.401 266 2HB LEU 36 1HB LEU 36 10.705 4.409 0.853 267 HG LEU 36 HG LEU 36 8.931 5.180 3.152 268 1HD1 LEU 36 1HD2 LEU 36 7.876 4.444 1.110 269 2HD1 LEU 36 2HD2 LEU 36 8.663 2.814 1.295 270 3HD1 LEU 36 3HD2 LEU 36 7.487 3.409 2.499 271 1HD2 LEU 36 1HD1 LEU 36 10.327 2.433 3.133 272 2HD2 LEU 36 2HD1 LEU 36 10.419 3.646 4.430 273 3HD2 LEU 36 3HD1 LEU 36 8.900 2.857 4.144 274 NH1 ARG 37 NH2 ARG 37 11.979 13.901 3.407 275 NH2 ARG 37 NH1 ARG 37 13.516 14.113 5.065 276 H ARG 37 H ARG 37 12.241 7.736 2.258 277 HA ARG 37 HA ARG 37 14.063 7.620 0.078 278 1HB ARG 37 1HB ARG 37 14.442 9.944 0.169 279 2HB ARG 37 2HB ARG 37 12.783 9.718 0.668 280 1HG ARG 37 1HG ARG 37 13.676 9.877 3.141 281 2HG ARG 37 2HG ARG 37 15.226 10.361 2.462 282 1HD ARG 37 1HD ARG 37 14.225 12.299 1.350 283 2HD ARG 37 2HD ARG 37 12.602 11.806 1.919 284 1HH1 ARG 37 2HH2 ARG 37 11.700 13.428 2.541 285 2HH1 ARG 37 1HH2 ARG 37 11.462 14.639 3.899 286 1HH2 ARG 37 1HH1 ARG 37 14.408 13.806 5.467 287 2HH2 ARG 37 2HH1 ARG 37 12.890 14.836 5.437 288 H LYS 38 H LYS 38 14.587 7.272 3.587 289 HA LYS 38 HA LYS 38 17.542 7.796 3.313 290 1HB LYS 38 1HB LYS 38 15.873 7.472 5.854 291 2HB LYS 38 2HB LYS 38 17.616 7.619 5.848 292 1HG LYS 38 1HG LYS 38 17.514 9.880 4.782 293 2HG LYS 38 2HG LYS 38 15.766 9.781 4.706 294 1HD LYS 38 1HD LYS 38 16.220 11.139 6.601 295 2HD LYS 38 2HD LYS 38 15.626 9.613 7.213 296 1HE LYS 38 1HE LYS 38 17.431 10.312 8.656 297 2HE LYS 38 2HE LYS 38 18.020 8.908 7.775 298 1HZ LYS 38 1HZ LYS 38 18.625 11.751 7.149 299 2HZ LYS 38 2HZ LYS 38 19.638 10.692 7.874 300 H GLY 39 H GLY 39 15.773 5.127 2.735 301 1HA GLY 39 1HA GLY 39 16.386 2.823 2.573 302 2HA GLY 39 2HA GLY 39 17.948 3.176 3.287 303 H ASP 40 H ASP 40 14.762 3.724 4.639 304 HA ASP 40 HA ASP 40 15.140 1.595 6.819 305 1HB ASP 40 1HB ASP 40 13.703 4.216 7.185 306 2HB ASP 40 2HB ASP 40 13.887 2.963 8.375 307 HD2 ASP 40 HD2 ASP 40 16.815 5.600 7.659 308 H LYS 41 H LYS 41 13.678 0.175 7.266 309 HA LYS 41 HA LYS 41 11.242 -0.103 5.517 310 1HB LYS 41 2HB LYS 41 11.958 -1.917 7.877 311 2HB LYS 41 1HB LYS 41 10.808 -2.258 6.598 312 1HG LYS 41 1HG LYS 41 12.817 -2.202 4.940 313 2HG LYS 41 2HG LYS 41 13.873 -2.163 6.346 314 1HD LYS 41 1HD LYS 41 12.875 -4.318 7.196 315 2HD LYS 41 2HD LYS 41 11.750 -4.353 5.834 316 1HE LYS 41 1HE LYS 41 13.716 -4.486 4.218 317 2HE LYS 41 2HE LYS 41 14.834 -4.490 5.593 318 1HZ LYS 41 1HZ LYS 41 14.385 -6.708 4.851 319 2HZ LYS 41 2HZ LYS 41 13.808 -6.527 6.370 320 H VAL 42 H VAL 42 9.084 0.479 6.231 321 HA VAL 42 HA VAL 42 8.692 1.285 9.035 322 HB VAL 42 HB VAL 42 7.389 1.967 6.321 323 1HG1 VAL 42 1HG2 VAL 42 6.922 3.028 9.084 324 2HG1 VAL 42 2HG2 VAL 42 6.294 3.709 7.522 325 3HG1 VAL 42 3HG2 VAL 42 5.759 2.065 8.042 326 1HG2 VAL 42 1HG1 VAL 42 9.218 3.418 8.269 327 2HG2 VAL 42 2HG1 VAL 42 9.511 2.961 6.535 328 3HG2 VAL 42 3HG1 VAL 42 8.327 4.202 6.964 329 H GLN 43 H GLN 43 7.882 0.045 10.051 330 HA GLN 43 HA GLN 43 6.312 -2.422 9.116 331 1HB GLN 43 1HB GLN 43 8.119 -2.328 11.495 332 2HB GLN 43 2HB GLN 43 6.966 -3.632 11.217 333 1HG GLN 43 1HG GLN 43 7.984 -4.189 9.067 334 2HG GLN 43 2HG GLN 43 9.040 -2.781 9.115 335 1HE2 GLN 43 1HE2 GLN 43 11.402 -5.316 10.117 336 2HE2 GLN 43 2HE2 GLN 43 10.650 -4.431 8.698 337 H LEU 44 H LEU 44 4.497 -3.152 9.669 338 HA LEU 44 HA LEU 44 2.799 -1.785 11.786 339 1HB LEU 44 2HB LEU 44 1.691 -2.580 9.031 340 2HB LEU 44 1HB LEU 44 0.848 -1.774 10.343 341 HG LEU 44 HG LEU 44 2.887 0.035 9.906 342 1HD1 LEU 44 1HD1 LEU 44 3.865 -1.261 7.958 343 2HD1 LEU 44 2HD1 LEU 44 2.333 -1.074 7.077 344 3HD1 LEU 44 3HD1 LEU 44 3.305 0.356 7.508 345 1HD2 LEU 44 2HD2 LEU 44 0.442 0.590 9.949 346 2HD2 LEU 44 3HD2 LEU 44 1.249 1.395 8.589 347 3HD2 LEU 44 1HD2 LEU 44 0.246 -0.047 8.299 348 H ILE 45 H ILE 45 1.929 -3.336 13.144 349 HA ILE 45 HA ILE 45 2.114 -6.213 12.392 350 HB ILE 45 HB ILE 45 2.814 -5.299 14.604 351 1HG1 ILE 45 1HG1 ILE 45 2.622 -7.734 14.127 352 2HG1 ILE 45 2HG1 ILE 45 2.611 -7.224 15.794 353 1HG2 ILE 45 1HG2 ILE 45 0.912 -3.870 15.150 354 2HG2 ILE 45 2HG2 ILE 45 -0.167 -5.282 15.284 355 3HG2 ILE 45 3HG2 ILE 45 1.184 -5.075 16.442 356 1HD1 ILE 45 1HD1 ILE 45 0.126 -7.647 15.962 357 2HD1 ILE 45 2HD1 ILE 45 0.116 -8.217 14.276 358 3HD1 ILE 45 3HD1 ILE 45 1.052 -9.089 15.500 359 H GLY 46 H GLY 46 0.492 -7.604 12.288 360 1HA GLY 46 1HA GLY 46 -1.482 -8.450 11.212 361 2HA GLY 46 2HA GLY 46 -2.313 -7.264 12.187 362 H PHE 47 H PHE 47 -0.283 -5.811 9.806 363 HA PHE 47 HA PHE 47 -2.337 -5.714 7.620 364 1HB PHE 47 2HB PHE 47 -2.639 -4.007 9.568 365 2HB PHE 47 1HB PHE 47 -1.150 -3.242 9.093 366 HD1 PHE 47 HD2 PHE 47 -4.546 -4.229 7.653 367 HD2 PHE 47 HD1 PHE 47 -1.088 -1.696 7.223 368 HE1 PHE 47 HE2 PHE 47 -5.462 -3.256 5.565 369 HE2 PHE 47 HE1 PHE 47 -2.060 -0.743 5.180 370 HZ PHE 47 HZ PHE 47 -4.228 -1.587 4.334 371 H GLY 48 H GLY 48 1.091 -4.855 8.510 372 1HA GLY 48 1HA GLY 48 1.870 -5.059 5.729 373 2HA GLY 48 2HA GLY 48 1.681 -3.361 6.101 374 H ASN 49 H ASN 49 3.825 -4.338 5.000 375 HA ASN 49 HA ASN 49 5.919 -3.375 6.943 376 1HB ASN 49 1HB ASN 49 6.041 -5.786 7.334 377 2HB ASN 49 2HB ASN 49 6.169 -6.135 5.626 378 1HD2 ASN 49 1HD2 ASN 49 9.625 -6.478 6.773 379 2HD2 ASN 49 2HD2 ASN 49 8.007 -7.341 6.724 380 H PHE 50 H PHE 50 6.279 -1.629 5.817 381 HA PHE 50 HA PHE 50 6.549 -1.511 2.835 382 1HB PHE 50 2HB PHE 50 7.122 0.500 5.031 383 2HB PHE 50 1HB PHE 50 7.551 0.929 3.421 384 HD1 PHE 50 HD2 PHE 50 4.872 0.553 5.847 385 HD2 PHE 50 HD1 PHE 50 5.905 1.806 1.877 386 HE1 PHE 50 HE2 PHE 50 2.771 1.890 5.705 387 HE2 PHE 50 HE1 PHE 50 3.838 3.162 1.792 388 HZ PHE 50 HZ PHE 50 2.233 3.024 3.647 389 H GLU 51 H GLU 51 8.433 -1.317 1.771 390 HA GLU 51 HA GLU 51 10.958 -0.734 3.099 391 1HB GLU 51 1HB GLU 51 12.240 -2.823 2.742 392 2HB GLU 51 2HB GLU 51 10.919 -3.104 3.842 393 1HG GLU 51 1HG GLU 51 10.884 -3.934 0.876 394 2HG GLU 51 2HG GLU 51 11.424 -4.969 2.182 395 HE1 GLU 51 HE2 GLU 51 8.255 -5.592 3.504 396 H VAL 52 H VAL 52 12.772 -0.280 1.735 397 HA VAL 52 HA VAL 52 11.893 0.551 -0.938 398 HB VAL 52 HB VAL 52 13.435 1.578 1.317 399 1HG1 VAL 52 1HG2 VAL 52 15.367 0.795 -0.867 400 2HG1 VAL 52 2HG2 VAL 52 15.660 1.938 0.497 401 3HG1 VAL 52 3HG2 VAL 52 15.303 0.213 0.806 402 1HG2 VAL 52 2HG1 VAL 52 12.925 2.629 -1.472 403 2HG2 VAL 52 3HG1 VAL 52 12.269 3.095 0.111 404 3HG2 VAL 52 1HG1 VAL 52 13.952 3.458 -0.285 405 NH1 ARG 53 NH2 ARG 53 11.178 -4.236 -1.857 406 NH2 ARG 53 NH1 ARG 53 12.808 -5.390 -0.770 407 H ARG 53 H ARG 53 13.273 -0.020 -2.890 408 HA ARG 53 HA ARG 53 14.436 -2.857 -2.632 409 1HB ARG 53 1HB ARG 53 12.051 -2.224 -3.906 410 2HB ARG 53 2HB ARG 53 13.126 -1.501 -5.002 411 1HG ARG 53 1HG ARG 53 12.957 -3.549 -6.045 412 2HG ARG 53 2HG ARG 53 14.369 -3.923 -5.088 413 1HD ARG 53 1HD ARG 53 11.424 -4.672 -4.463 414 2HD ARG 53 2HD ARG 53 12.660 -5.741 -5.080 415 1HH1 ARG 53 2HH2 ARG 53 10.801 -3.910 -2.754 416 2HH1 ARG 53 1HH2 ARG 53 10.784 -4.063 -0.925 417 1HH2 ARG 53 1HH1 ARG 53 13.670 -5.941 -0.834 418 2HH2 ARG 53 2HH1 ARG 53 12.301 -5.138 0.086 419 H GLU 54 H GLU 54 16.667 -2.204 -2.506 420 HA GLU 54 HA GLU 54 17.817 -0.186 -4.314 421 1HB GLU 54 1HB GLU 54 18.836 -0.885 -2.111 422 2HB GLU 54 2HB GLU 54 19.313 -2.413 -2.823 423 1HG GLU 54 1HG GLU 54 21.245 -0.967 -2.824 424 2HG GLU 54 2HG GLU 54 20.769 -1.164 -4.500 425 HE1 GLU 54 HE2 GLU 54 20.651 2.425 -2.639 426 NH1 ARG 55 NH2 ARG 55 15.379 0.410 -12.652 427 NH2 ARG 55 NH1 ARG 55 14.384 2.105 -11.515 428 H ARG 55 H ARG 55 17.106 -0.622 -6.379 429 HA ARG 55 HA ARG 55 17.130 -3.188 -7.652 430 1HB ARG 55 1HB ARG 55 15.549 -1.332 -7.971 431 2HB ARG 55 2HB ARG 55 16.783 -0.297 -8.673 432 1HG ARG 55 1HG ARG 55 16.829 -1.485 -10.726 433 2HG ARG 55 2HG ARG 55 16.124 -2.940 -10.027 434 1HD ARG 55 1HD ARG 55 14.456 -1.900 -11.430 435 2HD ARG 55 2HD ARG 55 13.918 -1.864 -9.770 436 1HH1 ARG 55 2HH2 ARG 55 15.639 -0.582 -12.672 437 2HH1 ARG 55 1HH2 ARG 55 15.569 1.110 -13.377 438 1HH2 ARG 55 1HH1 ARG 55 13.885 2.408 -10.671 439 2HH2 ARG 55 2HH1 ARG 55 14.641 2.687 -12.320 440 H ALA 56 H ALA 56 18.241 -4.009 -9.354 441 HA ALA 56 HA ALA 56 21.032 -2.869 -10.009 442 1HB ALA 56 3HB ALA 56 20.157 -5.826 -9.903 443 2HB ALA 56 1HB ALA 56 21.756 -5.215 -10.392 444 3HB ALA 56 2HB ALA 56 21.194 -4.984 -8.723 445 H ALA 57 H ALA 57 19.891 -1.572 -11.488 446 HA ALA 57 HA ALA 57 18.474 -1.179 -13.368 447 1HB ALA 57 3HB ALA 57 20.821 -0.368 -13.636 448 2HB ALA 57 1HB ALA 57 21.289 -1.901 -14.419 449 3HB ALA 57 2HB ALA 57 20.153 -0.792 -15.220 450 NH1 ARG 58 NH2 ARG 58 10.412 -0.835 -14.038 451 NH2 ARG 58 NH1 ARG 58 10.869 -0.804 -11.811 452 H ARG 58 H ARG 58 16.982 -1.681 -14.607 453 HA ARG 58 HA ARG 58 16.676 -4.470 -15.302 454 1HB ARG 58 2HB ARG 58 14.747 -2.395 -16.416 455 2HB ARG 58 1HB ARG 58 14.417 -4.078 -16.061 456 1HG ARG 58 1HG ARG 58 14.508 -3.574 -13.597 457 2HG ARG 58 2HG ARG 58 14.904 -1.893 -13.968 458 1HD ARG 58 1HD ARG 58 12.733 -1.646 -15.253 459 2HD ARG 58 2HD ARG 58 12.278 -3.296 -14.791 460 1HH1 ARG 58 2HH2 ARG 58 10.694 -1.147 -14.974 461 2HH1 ARG 58 1HH2 ARG 58 9.584 -0.279 -13.799 462 1HH2 ARG 58 1HH1 ARG 58 11.495 -1.089 -11.049 463 2HH2 ARG 58 2HH1 ARG 58 10.010 -0.249 -11.726 464 H LYS 59 H LYS 59 15.550 -4.784 -17.700 465 HA LYS 59 HA LYS 59 17.042 -3.393 -19.903 466 1HB LYS 59 1HB LYS 59 17.469 -6.427 -19.525 467 2HB LYS 59 2HB LYS 59 17.672 -5.593 -21.061 468 1HG LYS 59 1HG LYS 59 19.407 -4.074 -20.058 469 2HG LYS 59 2HG LYS 59 19.280 -4.945 -18.527 470 1HD LYS 59 1HD LYS 59 20.000 -7.090 -19.694 471 2HD LYS 59 2HD LYS 59 20.092 -6.215 -21.215 472 1HE LYS 59 1HE LYS 59 22.349 -6.393 -20.401 473 2HE LYS 59 2HE LYS 59 21.897 -4.697 -20.252 474 1HZ LYS 59 1HZ LYS 59 21.944 -6.705 -18.060 475 2HZ LYS 59 2HZ LYS 59 23.037 -5.513 -18.301 476 H GLY 60 H GLY 60 15.438 -2.878 -21.186 477 1HA GLY 60 1HA GLY 60 13.493 -4.772 -22.302 478 2HA GLY 60 2HA GLY 60 12.688 -3.956 -20.962 479 NH1 ARG 61 NH2 ARG 61 15.815 0.480 -29.664 480 NH2 ARG 61 NH1 ARG 61 17.557 0.541 -28.205 481 H ARG 61 H ARG 61 13.680 -3.724 -24.137 482 HA ARG 61 HA ARG 61 13.675 -1.029 -24.648 483 1HB ARG 61 1HB ARG 61 14.747 -2.211 -26.133 484 2HB ARG 61 2HB ARG 61 13.361 -3.200 -26.583 485 1HG ARG 61 1HG ARG 61 13.950 -1.723 -28.379 486 2HG ARG 61 2HG ARG 61 12.396 -1.224 -27.770 487 1HD ARG 61 1HD ARG 61 13.560 0.818 -28.199 488 2HD ARG 61 2HD ARG 61 13.556 0.667 -26.459 489 1HH1 ARG 61 2HH2 ARG 61 14.801 0.404 -29.796 490 2HH1 ARG 61 1HH2 ARG 61 16.525 0.578 -30.397 491 1HH2 ARG 61 1HH1 ARG 61 17.873 0.513 -27.229 492 2HH2 ARG 61 2HH1 ARG 61 18.146 0.635 -29.040 493 H ASN 62 H ASN 62 11.544 -2.497 -26.284 494 HA ASN 62 HA ASN 62 8.855 -1.326 -25.344 495 1HB ASN 62 1HB ASN 62 10.212 0.179 -27.069 496 2HB ASN 62 2HB ASN 62 9.884 -1.047 -28.268 497 1HD2 ASN 62 2HD2 ASN 62 6.947 1.592 -27.377 498 2HD2 ASN 62 1HD2 ASN 62 8.488 1.486 -26.377 499 HA PRO 63 HA PRO 63 7.425 -5.474 -26.818 500 1HB PRO 63 1HB PRO 63 4.692 -5.008 -27.272 501 2HB PRO 63 2HB PRO 63 5.456 -5.239 -25.693 502 1HG PRO 63 1HG PRO 63 4.789 -2.590 -27.071 503 2HG PRO 63 2HG PRO 63 4.424 -3.074 -25.397 504 1HD PRO 63 1HD PRO 63 6.589 -1.506 -25.958 505 2HD PRO 63 2HD PRO 63 6.732 -2.772 -24.705 506 H GLN 64 H GLN 64 7.373 -2.784 -29.005 507 HA GLN 64 HA GLN 64 6.439 -4.305 -31.407 508 1HB GLN 64 1HB GLN 64 6.023 -1.822 -31.140 509 2HB GLN 64 2HB GLN 64 7.753 -1.508 -31.128 510 1HG GLN 64 1HG GLN 64 8.020 -2.211 -33.451 511 2HG GLN 64 2HG GLN 64 6.392 -2.867 -33.493 512 1HE2 GLN 64 2HE2 GLN 64 4.938 0.349 -34.285 513 2HE2 GLN 64 1HE2 GLN 64 4.687 -1.439 -33.961 514 H THR 65 H THR 65 9.418 -2.598 -30.759 515 HA THR 65 HA THR 65 10.928 -4.033 -32.792 516 HB THR 65 HB THR 65 12.696 -2.462 -32.381 517 HG1 THR 65 HG1 THR 65 11.270 -1.729 -30.049 518 1HG2 THR 65 2HG2 THR 65 10.572 -1.538 -33.512 519 2HG2 THR 65 3HG2 THR 65 10.049 -0.923 -31.938 520 3HG2 THR 65 1HG2 THR 65 11.534 -0.285 -32.665 521 H GLY 66 H GLY 66 11.015 -4.262 -29.260 522 1HA GLY 66 1HA GLY 66 12.143 -5.758 -27.789 523 2HA GLY 66 2HA GLY 66 12.178 -6.872 -29.136 524 H GLU 67 H GLU 67 13.964 -3.782 -28.855 525 HA GLU 67 HA GLU 67 16.648 -5.335 -28.897 526 1HB GLU 67 2HB GLU 67 15.923 -3.826 -30.878 527 2HB GLU 67 1HB GLU 67 16.044 -2.475 -29.723 528 1HG GLU 67 1HG GLU 67 18.536 -3.068 -29.419 529 2HG GLU 67 2HG GLU 67 18.339 -4.382 -30.573 530 HE2 GLU 67 HE2 GLU 67 18.637 -0.532 -31.750 531 H GLU 68 H GLU 68 15.675 -5.293 -26.685 532 HA GLU 68 HA GLU 68 15.401 -3.573 -24.735 533 1HB GLU 68 1HB GLU 68 16.165 -5.094 -22.968 534 2HB GLU 68 2HB GLU 68 15.236 -5.872 -24.222 535 1HG GLU 68 1HG GLU 68 17.399 -6.834 -25.197 536 2HG GLU 68 2HG GLU 68 18.307 -6.064 -23.902 537 HE2 GLU 68 HE2 GLU 68 17.852 -8.691 -21.787 538 H MET 69 H MET 69 16.049 -1.842 -24.119 539 HA MET 69 HA MET 69 18.988 -1.130 -23.805 540 1HB MET 69 1HB MET 69 18.321 1.215 -23.744 541 2HB MET 69 2HB MET 69 17.748 0.400 -25.177 542 1HG MET 69 1HG MET 69 15.923 1.779 -24.591 543 2HG MET 69 2HG MET 69 15.420 0.204 -23.972 544 1HE MET 69 1HE MET 69 13.658 1.207 -22.624 545 2HE MET 69 3HE MET 69 14.426 0.135 -21.423 546 3HE MET 69 2HE MET 69 13.928 1.784 -20.955 547 H GLU 70 H GLU 70 19.860 -0.460 -21.927 548 HA GLU 70 HA GLU 70 18.833 -1.592 -19.502 549 1HB GLU 70 2HB GLU 70 21.350 -1.083 -20.472 550 2HB GLU 70 1HB GLU 70 21.212 0.301 -19.446 551 1HG GLU 70 1HG GLU 70 20.606 -1.464 -17.546 552 2HG GLU 70 2HG GLU 70 20.868 -2.729 -18.737 553 HE1 GLU 70 HE2 GLU 70 24.332 -2.492 -18.746 554 H ILE 71 H ILE 71 17.686 -0.771 -17.916 555 HA ILE 71 HA ILE 71 16.896 2.133 -17.845 556 HB ILE 71 HB ILE 71 15.720 -0.475 -16.708 557 1HG1 ILE 71 1HG1 ILE 71 14.400 1.311 -18.843 558 2HG1 ILE 71 2HG1 ILE 71 15.586 0.143 -19.355 559 1HG2 ILE 71 2HG2 ILE 71 15.122 1.428 -15.255 560 2HG2 ILE 71 3HG2 ILE 71 14.512 2.341 -16.665 561 3HG2 ILE 71 1HG2 ILE 71 13.701 0.827 -16.142 562 1HD1 ILE 71 3HD1 ILE 71 13.047 -0.682 -17.837 563 2HD1 ILE 71 1HD1 ILE 71 13.279 -0.733 -19.597 564 3HD1 ILE 71 2HD1 ILE 71 14.280 -1.762 -18.560 565 HA PRO 72 HA PRO 72 20.006 1.998 -14.359 566 1HB PRO 72 1HB PRO 72 19.948 4.689 -13.574 567 2HB PRO 72 2HB PRO 72 20.804 4.046 -14.982 568 1HG PRO 72 1HG PRO 72 18.040 5.347 -14.918 569 2HG PRO 72 2HG PRO 72 19.386 5.693 -16.030 570 1HD PRO 72 1HD PRO 72 17.310 4.040 -16.750 571 2HD PRO 72 2HD PRO 72 18.974 3.680 -17.310 572 H ALA 73 H ALA 73 20.049 1.837 -12.167 573 HA ALA 73 HA ALA 73 17.761 0.921 -10.793 574 1HB ALA 73 1HB ALA 73 20.161 0.510 -9.983 575 2HB ALA 73 2HB ALA 73 20.187 2.184 -9.312 576 3HB ALA 73 3HB ALA 73 19.070 0.990 -8.676 577 H SER 74 H SER 74 16.867 1.454 -8.870 578 HA SER 74 HA SER 74 17.303 3.981 -7.632 579 1HB SER 74 1HB SER 74 14.435 3.379 -8.793 580 2HB SER 74 2HB SER 74 14.603 4.535 -7.480 581 HG SER 74 HG SER 74 16.042 5.730 -8.799 582 H LYS 75 H LYS 75 16.067 4.214 -5.515 583 HA LYS 75 HA LYS 75 15.824 1.497 -4.150 584 1HB LYS 75 2HB LYS 75 15.412 3.894 -2.454 585 2HB LYS 75 1HB LYS 75 16.000 2.297 -2.108 586 1HG LYS 75 1HG LYS 75 18.218 2.734 -2.970 587 2HG LYS 75 2HG LYS 75 17.725 4.215 -3.765 588 1HD LYS 75 1HD LYS 75 19.059 4.754 -1.820 589 2HD LYS 75 2HD LYS 75 17.448 5.425 -1.694 590 1HE LYS 75 1HE LYS 75 18.200 4.636 0.496 591 2HE LYS 75 2HE LYS 75 16.788 3.729 -0.010 592 1HZ LYS 75 1HZ LYS 75 18.498 2.322 0.945 593 2HZ LYS 75 2HZ LYS 75 19.611 2.800 -0.153 594 H VAL 76 H VAL 76 13.934 0.724 -4.593 595 HA VAL 76 HA VAL 76 11.654 2.415 -5.162 596 HB VAL 76 HB VAL 76 10.821 1.173 -6.572 597 1HG1 VAL 76 2HG2 VAL 76 13.123 2.046 -7.072 598 2HG1 VAL 76 3HG2 VAL 76 13.721 0.390 -6.791 599 3HG1 VAL 76 1HG2 VAL 76 12.614 0.710 -8.177 600 1HG2 VAL 76 2HG1 VAL 76 10.866 -1.225 -5.489 601 2HG2 VAL 76 3HG1 VAL 76 10.570 -0.878 -7.209 602 3HG2 VAL 76 1HG1 VAL 76 12.154 -1.409 -6.737 603 HA PRO 77 HA PRO 77 9.779 1.219 -1.271 604 1HB PRO 77 1HB PRO 77 7.821 3.193 -1.067 605 2HB PRO 77 2HB PRO 77 9.559 3.526 -0.920 606 1HG PRO 77 1HG PRO 77 7.812 3.861 -3.405 607 2HG PRO 77 2HG PRO 77 8.933 5.026 -2.676 608 1HD PRO 77 1HD PRO 77 9.657 3.325 -4.828 609 2HD PRO 77 2HD PRO 77 10.862 3.828 -3.611 610 H ALA 78 H ALA 78 8.685 -0.228 -0.895 611 HA ALA 78 HA ALA 78 6.175 -1.118 -2.403 612 1HB ALA 78 2HB ALA 78 8.350 -2.408 -2.724 613 2HB ALA 78 3HB ALA 78 8.458 -2.677 -0.971 614 3HB ALA 78 1HB ALA 78 7.120 -3.398 -1.903 615 H PHE 79 H PHE 79 4.955 -2.578 -1.029 616 HA PHE 79 HA PHE 79 4.670 -1.952 1.958 617 1HB PHE 79 2HB PHE 79 3.456 -0.235 1.539 618 2HB PHE 79 1HB PHE 79 2.706 -0.948 0.097 619 HD1 PHE 79 HD2 PHE 79 0.788 -2.532 0.263 620 HD2 PHE 79 HD1 PHE 79 2.485 -0.771 3.805 621 HE1 PHE 79 HE2 PHE 79 -1.057 -3.434 1.600 622 HE2 PHE 79 HE1 PHE 79 0.581 -1.618 5.115 623 HZ PHE 79 HZ PHE 79 -1.146 -3.024 4.022 624 H LYS 80 H LYS 80 4.403 -3.815 2.601 625 HA LYS 80 HA LYS 80 3.454 -6.452 1.179 626 1HB LYS 80 2HB LYS 80 4.826 -5.991 3.851 627 2HB LYS 80 1HB LYS 80 4.035 -7.495 3.428 628 1HG LYS 80 1HG LYS 80 5.504 -7.706 1.375 629 2HG LYS 80 2HG LYS 80 6.338 -6.217 1.816 630 1HD LYS 80 1HD LYS 80 7.134 -7.245 3.944 631 2HD LYS 80 2HD LYS 80 6.254 -8.731 3.620 632 1HE LYS 80 1HE LYS 80 8.535 -7.611 1.839 633 2HE LYS 80 2HE LYS 80 8.766 -8.787 3.130 634 1HZ LYS 80 1HZ LYS 80 7.102 -9.207 0.714 635 2HZ LYS 80 2HZ LYS 80 8.589 -9.832 0.978 636 HA PRO 81 HA PRO 81 -0.491 -5.745 3.386 637 1HB PRO 81 1HB PRO 81 -1.841 -8.017 2.597 638 2HB PRO 81 2HB PRO 81 -1.397 -6.746 1.450 639 1HG PRO 81 1HG PRO 81 0.097 -9.369 2.007 640 2HG PRO 81 2HG PRO 81 -0.442 -8.745 0.427 641 1HD PRO 81 1HD PRO 81 2.136 -8.356 1.438 642 2HD PRO 81 2HD PRO 81 1.355 -7.170 0.342 643 H GLY 82 H GLY 82 1.778 -6.584 4.900 644 1HA GLY 82 1HA GLY 82 2.697 -7.971 6.617 645 2HA GLY 82 2HA GLY 82 1.133 -7.575 7.297 646 H LYS 83 H LYS 83 1.042 -9.696 4.636 647 HA LYS 83 HA LYS 83 0.375 -12.003 4.416 648 1HB LYS 83 2HB LYS 83 1.918 -12.229 6.947 649 2HB LYS 83 1HB LYS 83 0.580 -13.292 7.014 650 1HG LYS 83 1HG LYS 83 2.648 -13.225 4.704 651 2HG LYS 83 2HG LYS 83 2.730 -14.306 6.091 652 1HD LYS 83 1HD LYS 83 0.546 -15.376 5.447 653 2HD LYS 83 2HD LYS 83 0.399 -14.289 4.065 654 1HE LYS 83 1HE LYS 83 2.553 -15.231 3.089 655 2HE LYS 83 2HE LYS 83 2.684 -16.339 4.464 656 1HZ LYS 83 1HZ LYS 83 1.659 -17.404 2.593 657 2HZ LYS 83 2HZ LYS 83 0.586 -17.327 3.823 658 H ALA 84 H ALA 84 -0.494 -10.589 7.293 659 HA ALA 84 HA ALA 84 -2.956 -11.847 8.162 660 1HB ALA 84 2HB ALA 84 -1.412 -10.397 9.503 661 2HB ALA 84 3HB ALA 84 -1.758 -9.005 8.445 662 3HB ALA 84 1HB ALA 84 -3.050 -9.663 9.485 663 H LEU 85 H LEU 85 -2.531 -8.730 6.222 664 HA LEU 85 HA LEU 85 -5.391 -8.502 5.663 665 1HB LEU 85 2HB LEU 85 -3.914 -6.492 5.574 666 2HB LEU 85 1HB LEU 85 -2.978 -7.218 4.284 667 HG LEU 85 HG LEU 85 -5.145 -7.463 3.017 668 1HD1 LEU 85 2HD1 LEU 85 -6.830 -6.956 4.763 669 2HD1 LEU 85 3HD1 LEU 85 -6.174 -5.323 4.968 670 3HD1 LEU 85 1HD1 LEU 85 -6.986 -5.781 3.447 671 1HD2 LEU 85 1HD2 LEU 85 -3.366 -5.800 2.368 672 2HD2 LEU 85 2HD2 LEU 85 -4.966 -5.111 2.046 673 3HD2 LEU 85 3HD2 LEU 85 -4.042 -4.592 3.483 674 H LYS 86 H LYS 86 -2.638 -10.028 3.988 675 HA LYS 86 HA LYS 86 -4.036 -10.942 1.600 676 1HB LYS 86 1HB LYS 86 -1.616 -10.888 1.791 677 2HB LYS 86 2HB LYS 86 -1.577 -12.155 2.982 678 1HG LYS 86 1HG LYS 86 -2.807 -12.656 0.216 679 2HG LYS 86 2HG LYS 86 -1.063 -12.560 0.416 680 1HD LYS 86 1HD LYS 86 -1.105 -14.431 2.119 681 2HD LYS 86 2HD LYS 86 -2.843 -14.551 1.952 682 1HE LYS 86 1HE LYS 86 -1.944 -16.325 0.632 683 2HE LYS 86 2HE LYS 86 -2.565 -15.145 -0.520 684 1HZ LYS 86 1HZ LYS 86 -0.387 -15.995 -1.122 685 2HZ LYS 86 2HZ LYS 86 0.280 -15.485 0.281 686 H ASP 87 H ASP 87 -4.345 -12.132 4.907 687 HA ASP 87 HA ASP 87 -5.906 -14.543 4.065 688 1HB ASP 87 1HB ASP 87 -4.301 -13.775 6.350 689 2HB ASP 87 2HB ASP 87 -5.905 -13.596 6.932 690 HD1 ASP 87 HD2 ASP 87 -4.302 -17.217 5.941 691 H ALA 88 H ALA 88 -6.529 -11.293 5.437 692 HA ALA 88 HA ALA 88 -9.410 -11.411 5.829 693 1HB ALA 88 1HB ALA 88 -7.928 -9.344 6.398 694 2HB ALA 88 2HB ALA 88 -7.769 -9.023 4.668 695 3HB ALA 88 3HB ALA 88 -9.347 -8.898 5.409 696 H VAL 89 H VAL 89 -7.472 -10.776 2.845 697 HA VAL 89 HA VAL 89 -9.807 -9.962 1.263 698 HB VAL 89 HB VAL 89 -7.423 -8.855 1.920 699 1HG1 VAL 89 2HG2 VAL 89 -6.166 -11.015 1.194 700 2HG1 VAL 89 3HG2 VAL 89 -6.396 -10.449 -0.475 701 3HG1 VAL 89 1HG2 VAL 89 -5.536 -9.437 0.737 702 1HG2 VAL 89 1HG1 VAL 89 -8.353 -8.832 -0.903 703 2HG2 VAL 89 2HG1 VAL 89 -8.936 -7.864 0.511 704 3HG2 VAL 89 3HG1 VAL 89 -7.246 -7.681 -0.034 705 H LYS 90 H LYS 90 -8.110 -12.931 1.661 706 HA LYS 90 HA LYS 90 -7.920 -13.835 -1.044 707 1HB LYS 90 1HB LYS 90 -7.199 -15.868 -0.181 708 2HB LYS 90 2HB LYS 90 -6.667 -14.646 0.936 709 1HG LYS 90 1HG LYS 90 -8.573 -15.264 2.508 710 2HG LYS 90 2HG LYS 90 -9.039 -16.559 1.412 711 1HD LYS 90 1HD LYS 90 -6.826 -17.672 1.682 712 2HD LYS 90 2HD LYS 90 -6.233 -16.343 2.681 713 1HE LYS 90 1HE LYS 90 -7.997 -16.844 4.432 714 2HE LYS 90 2HE LYS 90 -8.616 -18.172 3.436 715 1HZ LYS 90 1HZ LYS 90 -7.115 -18.986 5.090 716 2HZ LYS 90 2HZ LYS 90 -6.469 -19.252 3.612 717 1H MET 1 1H MET 91 9.750 0.915 10.747 718 2H MET 1 2H MET 91 10.859 0.366 11.886 719 HA MET 1 HA MET 91 9.670 1.343 13.376 720 1HB MET 1 1HB MET 91 7.387 1.466 11.305 721 2HB MET 1 2HB MET 91 7.255 2.092 12.918 722 1HG MET 1 1HG MET 91 9.415 3.553 12.349 723 2HG MET 1 2HG MET 91 9.038 3.145 10.664 724 1HE MET 1 1HE MET 91 7.904 5.080 9.424 725 2HE MET 1 3HE MET 91 6.924 6.340 10.205 726 3HE MET 1 2HE MET 91 8.662 6.188 10.609 727 H ASN 2 H ASN 92 6.685 -0.171 12.644 728 HA ASN 2 HA ASN 92 6.575 -2.648 13.171 729 1HB ASN 2 1HB ASN 92 6.480 -3.556 15.359 730 2HB ASN 2 2HB ASN 92 8.016 -2.836 15.061 731 1HD2 ASN 2 1HD2 ASN 92 5.816 -1.460 18.199 732 2HD2 ASN 2 2HD2 ASN 92 5.107 -2.482 16.848 733 H LYS 3 H LYS 93 5.297 0.154 14.390 734 HA LYS 3 HA LYS 93 2.888 0.763 13.673 735 1HB LYS 3 1HB LYS 93 2.095 -1.726 13.755 736 2HB LYS 3 2HB LYS 93 1.996 -1.591 15.487 737 1HG LYS 3 1HG LYS 93 0.201 0.190 15.201 738 2HG LYS 3 2HG LYS 93 0.518 0.251 13.467 739 1HD LYS 3 1HD LYS 93 -0.206 -2.196 13.285 740 2HD LYS 3 2HD LYS 93 -0.656 -2.151 14.995 741 1HE LYS 3 1HE LYS 93 -2.332 -0.311 14.513 742 2HE LYS 3 2HE LYS 93 -1.848 -0.305 12.809 743 1HZ LYS 3 1HZ LYS 93 -3.814 -1.625 13.176 744 2HZ LYS 3 2HZ LYS 93 -3.062 -2.586 14.264 745 H THR 4 H THR 94 4.757 0.102 16.743 746 HA THR 4 HA THR 94 3.287 2.167 18.136 747 HB THR 4 HB THR 94 5.712 0.334 18.686 748 HG1 THR 4 HG1 THR 94 4.200 -0.796 19.966 749 1HG2 THR 4 3HG2 THR 94 4.009 2.126 20.440 750 2HG2 THR 4 1HG2 THR 94 5.189 0.875 21.049 751 3HG2 THR 4 2HG2 THR 94 5.765 2.277 20.063 752 H GLU 5 H GLU 95 6.242 1.746 16.248 753 HA GLU 5 HA GLU 95 7.449 4.358 17.132 754 1HB GLU 5 1HB GLU 95 8.293 3.050 14.542 755 2HB GLU 5 2HB GLU 95 9.164 4.195 15.513 756 1HG GLU 5 1HG GLU 95 8.679 1.219 16.133 757 2HG GLU 5 2HG GLU 95 10.163 1.927 15.554 758 HE2 GLU 5 HE2 GLU 95 9.233 1.968 19.460 759 H LEU 6 H LEU 96 4.924 3.300 15.227 760 HA LEU 6 HA LEU 96 4.515 5.449 13.232 761 1HB LEU 6 2HB LEU 96 3.432 2.773 14.045 762 2HB LEU 6 1HB LEU 96 2.124 3.852 14.191 763 HG LEU 6 HG LEU 96 2.935 4.531 11.709 764 1HD1 LEU 6 2HD1 LEU 96 5.115 3.421 11.749 765 2HD1 LEU 6 3HD1 LEU 96 4.344 1.839 11.942 766 3HD1 LEU 6 1HD1 LEU 96 4.124 2.779 10.430 767 1HD2 LEU 6 2HD2 LEU 96 0.811 3.456 12.090 768 2HD2 LEU 6 3HD2 LEU 96 1.571 2.815 10.637 769 3HD2 LEU 6 1HD2 LEU 96 1.572 1.849 12.145 770 H ILE 7 H ILE 97 3.186 4.441 16.432 771 HA ILE 7 HA ILE 97 1.375 6.643 16.870 772 HB ILE 7 HB ILE 97 2.825 4.993 19.029 773 1HG1 ILE 7 1HG1 ILE 97 0.117 4.381 17.729 774 2HG1 ILE 7 2HG1 ILE 97 1.576 3.619 17.241 775 1HG2 ILE 7 2HG2 ILE 97 1.598 7.032 19.976 776 2HG2 ILE 7 3HG2 ILE 97 0.112 6.436 19.249 777 3HG2 ILE 7 1HG2 ILE 97 0.890 5.512 20.533 778 1HD1 ILE 7 3HD1 ILE 97 1.954 2.731 19.603 779 2HD1 ILE 7 1HD1 ILE 97 0.291 3.186 19.937 780 3HD1 ILE 7 2HD1 ILE 97 0.641 2.025 18.624 781 H ASN 8 H ASN 98 4.713 6.204 18.007 782 HA ASN 8 HA ASN 98 4.901 8.944 19.129 783 1HB ASN 8 1HB ASN 98 7.225 7.040 18.313 784 2HB ASN 8 2HB ASN 98 7.438 8.527 19.208 785 1HD2 ASN 8 2HD2 ASN 98 6.549 5.236 21.359 786 2HD2 ASN 8 1HD2 ASN 98 6.902 5.215 19.559 787 H ALA 9 H ALA 99 5.066 7.947 15.826 788 HA ALA 9 HA ALA 99 6.601 10.360 14.862 789 1HB ALA 9 2HB ALA 99 6.249 8.198 13.343 790 2HB ALA 9 3HB ALA 99 4.517 8.571 13.336 791 3HB ALA 9 1HB ALA 99 5.597 9.712 12.601 792 H VAL 10 H VAL 100 3.134 9.297 15.148 793 HA VAL 10 HA VAL 100 2.166 11.614 13.918 794 HB VAL 10 HB VAL 100 0.421 9.950 15.768 795 1HG1 VAL 10 3HG2 VAL 100 -0.363 11.947 14.152 796 2HG1 VAL 10 1HG2 VAL 100 -0.452 10.594 12.985 797 3HG1 VAL 10 2HG2 VAL 100 -1.361 10.497 14.498 798 1HG2 VAL 10 1HG1 VAL 100 1.772 9.038 13.226 799 2HG2 VAL 10 2HG1 VAL 100 1.581 8.305 14.852 800 3HG2 VAL 10 3HG1 VAL 100 0.174 8.332 13.748 801 H ALA 11 H ALA 101 2.197 10.542 17.138 802 HA ALA 11 HA ALA 101 1.197 12.976 18.116 803 1HB ALA 11 2HB ALA 101 1.048 10.810 19.433 804 2HB ALA 11 3HB ALA 101 2.815 10.811 19.664 805 3HB ALA 11 1HB ALA 101 1.795 12.049 20.471 806 H GLU 12 H GLU 102 4.487 12.230 17.298 807 HA GLU 12 HA GLU 102 5.527 14.653 18.737 808 1HB GLU 12 1HB GLU 102 7.028 12.638 18.454 809 2HB GLU 12 2HB GLU 102 6.962 12.833 16.711 810 1HG GLU 12 1HG GLU 102 9.072 13.695 17.495 811 2HG GLU 12 2HG GLU 102 8.146 15.058 16.903 812 HE2 GLU 12 HE2 GLU 102 8.004 16.701 19.936 813 H THR 13 H THR 103 4.794 13.753 15.290 814 HA THR 13 HA THR 103 5.150 16.690 14.632 815 HB THR 13 HB THR 103 6.197 14.648 13.435 816 HG1 THR 13 HG1 THR 103 6.470 16.850 12.970 817 1HG2 THR 13 2HG2 THR 103 4.205 13.497 12.619 818 2HG2 THR 13 3HG2 THR 103 3.755 14.927 11.649 819 3HG2 THR 13 1HG2 THR 103 5.257 14.032 11.291 820 H SER 14 H SER 104 2.790 15.412 15.767 821 HA SER 14 HA SER 104 0.829 17.444 14.496 822 1HB SER 14 1HB SER 104 0.194 15.088 13.789 823 2HB SER 14 2HB SER 104 -0.123 14.687 15.483 824 HG SER 14 HG SER 104 -1.964 15.342 14.378 825 H GLY 15 H GLY 105 1.816 15.919 17.597 826 1HA GLY 15 1HA GLY 105 1.347 16.556 19.820 827 2HA GLY 15 2HA GLY 105 0.838 18.130 19.214 828 H LEU 16 H LEU 106 -0.370 14.839 19.017 829 HA LEU 16 HA LEU 106 -3.064 15.512 20.219 830 1HB LEU 16 1HB LEU 106 -3.962 13.616 19.061 831 2HB LEU 16 2HB LEU 106 -3.497 14.990 18.077 832 HG LEU 16 HG LEU 106 -1.606 14.011 17.268 833 1HD1 LEU 16 2HD1 LEU 106 -0.746 12.799 19.324 834 2HD1 LEU 16 3HD1 LEU 106 -1.983 11.554 18.964 835 3HD1 LEU 16 1HD1 LEU 106 -0.606 11.885 17.820 836 1HD2 LEU 16 2HD2 LEU 106 -3.113 13.476 15.807 837 2HD2 LEU 16 3HD2 LEU 106 -1.655 12.452 15.877 838 3HD2 LEU 16 1HD2 LEU 106 -3.160 11.815 16.509 839 H SER 17 H SER 107 -2.657 12.589 20.430 840 HA SER 17 HA SER 107 -1.323 12.376 23.179 841 1HB SER 17 1HB SER 107 -4.048 11.081 22.695 842 2HB SER 17 2HB SER 107 -3.052 10.943 24.127 843 HG SER 17 HG SER 107 -3.196 13.200 24.395 844 H LYS 18 H LYS 108 -0.778 10.245 23.787 845 HA LYS 18 HA LYS 108 0.421 8.495 21.674 846 1HB LYS 18 1HB LYS 108 1.315 8.802 24.120 847 2HB LYS 18 2HB LYS 108 -0.066 7.887 24.669 848 1HG LYS 18 1HG LYS 108 1.571 6.271 24.658 849 2HG LYS 18 2HG LYS 108 0.810 5.933 23.114 850 1HD LYS 18 1HD LYS 108 2.684 7.238 21.943 851 2HD LYS 18 2HD LYS 108 3.353 7.650 23.507 852 1HE LYS 18 1HE LYS 108 4.702 5.854 22.695 853 2HE LYS 18 2HE LYS 108 3.750 5.183 24.012 854 1HZ LYS 18 1HZ LYS 108 3.835 3.730 22.098 855 2HZ LYS 18 2HZ LYS 108 3.199 4.866 21.109 856 H LYS 19 H LYS 109 -2.336 8.158 23.870 857 HA LYS 19 HA LYS 109 -3.574 5.813 22.594 858 1HB LYS 19 2HB LYS 109 -4.124 6.638 24.919 859 2HB LYS 19 1HB LYS 109 -4.978 8.024 24.231 860 1HG LYS 19 1HG LYS 109 -6.581 6.414 23.078 861 2HG LYS 19 2HG LYS 109 -5.690 5.052 23.756 862 1HD LYS 19 1HD LYS 109 -6.263 5.860 26.104 863 2HD LYS 19 2HD LYS 109 -7.103 7.239 25.410 864 1HE LYS 19 1HE LYS 109 -8.801 5.648 26.009 865 2HE LYS 19 2HE LYS 109 -8.743 5.669 24.248 866 1HZ LYS 19 1HZ LYS 109 -7.390 3.639 24.348 867 2HZ LYS 19 2HZ LYS 109 -7.431 3.639 25.982 868 H ASP 20 H ASP 110 -3.869 9.376 21.837 869 HA ASP 20 HA ASP 110 -6.031 8.877 19.805 870 1HB ASP 20 1HB ASP 110 -4.248 11.342 20.273 871 2HB ASP 20 2HB ASP 110 -5.358 11.258 18.929 872 HD2 ASP 20 HD2 ASP 110 -6.765 12.850 22.042 873 H ALA 21 H ALA 111 -2.522 9.025 19.661 874 HA ALA 21 HA ALA 111 -2.347 8.838 16.697 875 1HB ALA 21 1HB ALA 111 -0.280 8.606 18.973 876 2HB ALA 21 2HB ALA 111 0.121 8.368 17.246 877 3HB ALA 21 3HB ALA 111 -0.519 9.883 17.803 878 H THR 22 H THR 112 -2.212 6.396 19.372 879 HA THR 22 HA THR 112 -1.865 4.044 17.754 880 HB THR 22 HB THR 112 -3.626 4.171 20.291 881 HG1 THR 22 HG1 THR 112 -1.739 3.933 21.456 882 1HG2 THR 22 2HG2 THR 112 -1.631 2.114 19.162 883 2HG2 THR 22 3HG2 THR 112 -2.431 1.984 20.753 884 3HG2 THR 22 1HG2 THR 112 -3.401 1.934 19.237 885 H LYS 23 H LYS 113 -4.844 5.576 18.752 886 HA LYS 23 HA LYS 113 -6.722 3.869 17.243 887 1HB LYS 23 2HB LYS 113 -6.780 6.865 18.145 888 2HB LYS 23 1HB LYS 113 -8.151 6.146 17.378 889 1HG LYS 23 1HG LYS 113 -8.259 4.338 19.221 890 2HG LYS 23 2HG LYS 113 -7.032 5.222 20.105 891 1HD LYS 23 1HD LYS 113 -9.828 6.273 19.317 892 2HD LYS 23 2HD LYS 113 -9.372 5.636 20.891 893 1HE LYS 23 1HE LYS 113 -7.688 7.545 21.168 894 2HE LYS 23 2HE LYS 113 -8.232 8.214 19.622 895 1HZ LYS 23 1HZ LYS 113 -10.468 8.380 20.549 896 2HZ LYS 23 2HZ LYS 113 -9.974 7.755 21.977 897 H ALA 24 H ALA 114 -5.445 7.006 16.472 898 HA ALA 24 HA ALA 114 -6.631 7.391 13.911 899 1HB ALA 24 3HB ALA 114 -4.073 8.542 15.089 900 2HB ALA 24 1HB ALA 114 -4.921 9.188 13.646 901 3HB ALA 24 2HB ALA 114 -5.752 9.173 15.228 902 H VAL 25 H VAL 115 -3.531 5.833 14.574 903 HA VAL 25 HA VAL 115 -2.853 5.099 11.719 904 HB VAL 25 HB VAL 115 -2.246 4.281 14.735 905 1HG1 VAL 25 2HG2 VAL 115 -1.261 2.549 12.421 906 2HG1 VAL 25 3HG2 VAL 115 -0.586 2.543 14.089 907 3HG1 VAL 25 1HG2 VAL 115 -2.258 2.080 13.800 908 1HG2 VAL 25 1HG1 VAL 115 -1.096 6.257 13.817 909 2HG2 VAL 25 2HG1 VAL 115 0.049 4.980 14.244 910 3HG2 VAL 25 3HG1 VAL 115 -0.371 5.282 12.520 911 H ASP 26 H ASP 116 -4.406 3.163 14.397 912 HA ASP 26 HA ASP 116 -5.635 1.291 12.381 913 1HB ASP 26 1HB ASP 116 -4.897 0.772 14.822 914 2HB ASP 26 2HB ASP 116 -6.341 1.637 15.352 915 HD1 ASP 26 HD2 ASP 116 -6.570 -2.013 13.509 916 H ALA 27 H ALA 117 -6.252 4.067 12.450 917 HA ALA 27 HA ALA 117 -9.234 4.115 11.840 918 1HB ALA 27 2HB ALA 117 -8.391 5.875 13.436 919 2HB ALA 27 3HB ALA 117 -7.378 6.468 12.112 920 3HB ALA 27 1HB ALA 117 -9.110 6.440 11.917 921 H VAL 28 H VAL 118 -6.157 5.210 10.511 922 HA VAL 28 HA VAL 118 -6.982 5.465 7.692 923 HB VAL 28 HB VAL 118 -4.086 4.727 8.599 924 1HG1 VAL 28 2HG2 VAL 118 -5.377 5.581 6.070 925 2HG1 VAL 28 3HG2 VAL 118 -3.943 6.535 6.486 926 3HG1 VAL 28 1HG2 VAL 118 -3.801 4.774 6.442 927 1HG2 VAL 28 3HG1 VAL 118 -5.325 7.444 8.772 928 2HG2 VAL 28 1HG1 VAL 118 -4.294 6.479 9.908 929 3HG2 VAL 28 2HG1 VAL 118 -3.554 7.168 8.475 930 H PHE 29 H PHE 119 -4.982 3.155 9.305 931 HA PHE 29 HA PHE 119 -5.033 0.979 7.338 932 1HB PHE 29 2HB PHE 119 -3.976 0.739 10.138 933 2HB PHE 29 1HB PHE 119 -3.663 -0.350 8.783 934 HD1 PHE 29 HD1 PHE 119 -2.946 1.046 6.459 935 HD2 PHE 29 HD2 PHE 119 -2.205 2.329 10.485 936 HE1 PHE 29 HE1 PHE 119 -1.347 2.686 5.630 937 HE2 PHE 29 HE2 PHE 119 -0.635 4.014 9.644 938 HZ PHE 29 HZ PHE 119 -0.283 4.231 7.178 939 H ASP 30 H ASP 120 -7.396 1.671 9.727 940 HA ASP 30 HA ASP 120 -8.633 -1.044 9.450 941 1HB ASP 30 1HB ASP 120 -8.788 0.696 11.460 942 2HB ASP 30 2HB ASP 120 -10.067 1.452 10.563 943 HD2 ASP 30 HD2 ASP 120 -10.658 -1.982 12.551 944 H SER 31 H SER 121 -8.944 2.074 8.075 945 HA SER 31 HA SER 121 -11.526 1.566 6.565 946 1HB SER 31 2HB SER 121 -9.706 4.034 6.496 947 2HB SER 31 1HB SER 121 -11.204 3.838 5.553 948 HG SER 31 HG SER 121 -11.547 4.885 7.518 949 H ILE 32 H ILE 122 -7.946 1.622 5.734 950 HA ILE 32 HA ILE 122 -8.283 1.000 2.954 951 HB ILE 32 HB ILE 122 -6.156 -0.394 4.530 952 1HG1 ILE 32 1HG1 ILE 122 -6.024 1.368 5.697 953 2HG1 ILE 32 2HG1 ILE 122 -4.546 0.868 4.829 954 1HG2 ILE 32 2HG2 ILE 122 -6.597 -0.300 1.925 955 2HG2 ILE 32 3HG2 ILE 122 -5.590 1.170 2.046 956 3HG2 ILE 32 1HG2 ILE 122 -4.951 -0.425 2.557 957 1HD1 ILE 32 2HD1 ILE 122 -4.555 3.073 3.638 958 2HD1 ILE 32 3HD1 ILE 122 -5.939 3.573 4.707 959 3HD1 ILE 32 1HD1 ILE 122 -4.386 3.089 5.384 960 H THR 33 H THR 123 -7.937 -1.171 5.822 961 HA THR 33 HA THR 123 -8.270 -3.644 4.245 962 HB THR 33 HB THR 123 -7.275 -3.870 6.316 963 HG1 THR 33 HG1 THR 123 -9.684 -5.317 6.208 964 1HG2 THR 33 2HG2 THR 123 -8.542 -2.348 7.793 965 2HG2 THR 33 3HG2 THR 123 -9.965 -3.415 7.746 966 3HG2 THR 33 1HG2 THR 123 -8.445 -3.966 8.516 967 H GLU 34 H GLU 124 -10.653 -1.431 5.192 968 HA GLU 34 HA GLU 124 -12.918 -3.314 4.502 969 1HB GLU 34 1HB GLU 124 -13.246 -1.544 6.388 970 2HB GLU 34 2HB GLU 124 -13.092 -0.294 5.173 971 1HG GLU 34 1HG GLU 124 -15.435 -0.588 5.634 972 2HG GLU 34 2HG GLU 124 -15.180 -1.181 4.006 973 HE2 GLU 34 HE2 GLU 124 -16.044 -4.462 4.714 974 H ALA 35 H ALA 125 -10.841 -0.854 2.974 975 HA ALA 35 HA ALA 125 -12.476 -0.788 0.516 976 1HB ALA 35 2HB ALA 125 -10.698 1.128 0.971 977 2HB ALA 35 3HB ALA 125 -9.453 -0.118 0.814 978 3HB ALA 35 1HB ALA 125 -10.410 0.323 -0.579 979 H LEU 36 H LEU 126 -9.209 -2.419 1.230 980 HA LEU 36 HA LEU 126 -9.323 -3.991 -1.205 981 1HB LEU 36 2HB LEU 126 -7.932 -4.466 1.387 982 2HB LEU 36 1HB LEU 126 -7.524 -5.249 -0.107 983 HG LEU 36 HG LEU 126 -7.154 -2.842 0.643 984 1HD1 LEU 36 3HD2 LEU 126 -8.087 -2.536 -2.147 985 2HD1 LEU 36 1HD2 LEU 126 -8.135 -1.398 -0.781 986 3HD1 LEU 36 2HD2 LEU 126 -6.724 -1.478 -1.802 987 1HD2 LEU 36 3HD1 LEU 126 -5.210 -2.954 1.050 988 2HD2 LEU 36 1HD1 LEU 126 -4.923 -2.528 -0.660 989 3HD2 LEU 36 2HD1 LEU 126 -5.803 -1.396 0.331 990 NH1 ARG 37 NH2 ARG 127 -11.789 -10.094 6.961 991 NH2 ARG 37 NH1 ARG 127 -13.665 -11.349 6.708 992 H ARG 37 H ARG 127 -10.487 -4.793 2.144 993 HA ARG 37 HA ARG 127 -10.969 -7.489 1.390 994 1HB ARG 37 1HB ARG 127 -10.872 -6.773 3.793 995 2HB ARG 37 2HB ARG 127 -12.435 -5.962 3.614 996 1HG ARG 37 1HG ARG 127 -13.415 -8.335 3.068 997 2HG ARG 37 2HG ARG 127 -11.839 -8.972 3.536 998 1HD ARG 37 1HD ARG 127 -12.140 -7.743 5.812 999 2HD ARG 37 2HD ARG 127 -13.742 -7.266 5.271 1000 1HH1 ARG 37 2HH2 ARG 127 -11.288 -9.230 6.726 1001 2HH1 ARG 37 1HH2 ARG 127 -11.457 -10.853 7.566 1002 1HH2 ARG 37 1HH1 ARG 127 -14.595 -11.445 6.284 1003 2HH2 ARG 37 2HH1 ARG 127 -13.202 -12.019 7.331 1004 H LYS 38 H LYS 128 -12.889 -4.535 0.747 1005 HA LYS 38 HA LYS 128 -15.404 -6.192 0.173 1006 1HB LYS 38 1HB LYS 128 -15.439 -4.254 1.887 1007 2HB LYS 38 2HB LYS 128 -15.214 -3.155 0.531 1008 1HG LYS 38 1HG LYS 128 -17.442 -3.869 -0.405 1009 2HG LYS 38 2HG LYS 128 -17.566 -5.128 0.814 1010 1HD LYS 38 1HD LYS 128 -18.978 -3.296 1.481 1011 2HD LYS 38 2HD LYS 128 -17.658 -3.408 2.636 1012 1HE LYS 38 1HE LYS 128 -16.491 -1.448 1.477 1013 2HE LYS 38 2HE LYS 128 -17.817 -1.360 0.308 1014 1HZ LYS 38 1HZ LYS 128 -18.073 0.206 2.115 1015 2HZ LYS 38 2HZ LYS 128 -18.044 -0.976 3.244 1016 H GLY 39 H GLY 129 -12.905 -5.686 -1.664 1017 1HA GLY 39 1HA GLY 129 -12.546 -5.347 -4.024 1018 2HA GLY 39 2HA GLY 129 -14.278 -5.457 -4.262 1019 H ASP 40 H ASP 130 -12.334 -3.153 -2.422 1020 HA ASP 40 HA ASP 130 -13.209 -0.784 -4.140 1021 1HB ASP 40 1HB ASP 130 -13.555 -1.154 -1.166 1022 2HB ASP 40 2HB ASP 130 -13.420 0.457 -1.849 1023 HD1 ASP 40 HD2 ASP 130 -16.528 0.387 -3.409 1024 H LYS 41 H LYS 131 -12.098 0.921 -4.319 1025 HA LYS 41 HA LYS 131 -9.098 0.647 -3.987 1026 1HB LYS 41 2HB LYS 131 -10.568 2.977 -5.338 1027 2HB LYS 41 1HB LYS 131 -8.860 2.566 -5.478 1028 1HG LYS 41 1HG LYS 131 -9.520 0.456 -6.758 1029 2HG LYS 41 2HG LYS 131 -11.210 0.940 -6.627 1030 1HD LYS 41 1HD LYS 131 -10.573 3.162 -7.791 1031 2HD LYS 41 2HD LYS 131 -8.985 2.485 -8.107 1032 1HE LYS 41 1HE LYS 131 -11.685 1.317 -9.094 1033 2HE LYS 41 2HE LYS 131 -10.604 2.327 -10.048 1034 1HZ LYS 41 1HZ LYS 131 -8.898 0.609 -9.845 1035 2HZ LYS 41 2HZ LYS 131 -9.897 -0.339 -8.965 1036 H VAL 42 H VAL 132 -7.949 1.937 -2.444 1037 HA VAL 42 HA VAL 132 -9.238 3.758 -0.652 1038 HB VAL 42 HB VAL 132 -6.355 2.892 -1.237 1039 1HG1 VAL 42 2HG2 VAL 132 -6.509 4.659 0.503 1040 2HG1 VAL 42 3HG2 VAL 132 -7.744 3.659 1.340 1041 3HG1 VAL 42 1HG2 VAL 132 -6.048 3.098 1.205 1042 1HG2 VAL 42 3HG1 VAL 132 -8.013 0.834 -0.708 1043 2HG2 VAL 42 1HG1 VAL 132 -6.598 1.030 0.277 1044 3HG2 VAL 42 2HG1 VAL 132 -8.154 1.555 0.914 1045 H GLN 43 H GLN 133 -6.800 5.293 -0.800 1046 HA GLN 43 HA GLN 133 -5.707 6.373 -2.426 1047 1HB GLN 43 1HB GLN 133 -8.044 7.647 -3.657 1048 2HB GLN 43 2HB GLN 133 -6.498 8.502 -3.733 1049 1HG GLN 43 1HG GLN 133 -5.371 6.548 -4.654 1050 2HG GLN 43 2HG GLN 133 -6.778 5.551 -4.531 1051 1HE2 GLN 43 2HE2 GLN 133 -7.453 6.382 -7.955 1052 2HE2 GLN 43 1HE2 GLN 133 -7.081 5.119 -6.679 1053 H LEU 44 H LEU 134 -4.253 7.895 -2.380 1054 HA LEU 44 HA LEU 134 -4.381 9.852 -0.080 1055 1HB LEU 44 2HB LEU 134 -1.741 8.407 -0.290 1056 2HB LEU 44 1HB LEU 134 -2.460 9.173 1.100 1057 HG LEU 44 HG LEU 134 -3.330 6.406 0.026 1058 1HD1 LEU 44 1HD1 LEU 134 -1.123 7.068 2.083 1059 2HD1 LEU 44 2HD1 LEU 134 -1.761 5.439 1.777 1060 3HD1 LEU 44 3HD1 LEU 134 -0.916 6.302 0.489 1061 1HD2 LEU 44 3HD2 LEU 134 -4.910 7.507 1.739 1062 2HD2 LEU 44 1HD2 LEU 134 -4.220 5.955 2.248 1063 3HD2 LEU 44 2HD2 LEU 134 -3.554 7.469 2.893 1064 H ILE 45 H ILE 135 -4.006 11.705 -1.304 1065 HA ILE 45 HA ILE 135 -2.496 11.551 -3.851 1066 HB ILE 45 HB ILE 135 -4.566 12.928 -3.597 1067 1HG1 ILE 45 1HG1 ILE 135 -3.791 14.880 -4.987 1068 2HG1 ILE 45 2HG1 ILE 135 -2.121 14.410 -4.729 1069 1HG2 ILE 45 3HG2 ILE 135 -3.994 14.016 -1.403 1070 2HG2 ILE 45 1HG2 ILE 135 -2.755 14.991 -2.219 1071 3HG2 ILE 45 2HG2 ILE 135 -4.483 15.183 -2.657 1072 1HD1 ILE 45 3HD1 ILE 135 -4.265 12.660 -6.131 1073 2HD1 ILE 45 1HD1 ILE 135 -3.037 13.652 -6.952 1074 3HD1 ILE 45 2HD1 ILE 135 -2.534 12.250 -5.987 1075 H GLY 46 H GLY 136 -0.630 12.624 -4.317 1076 1HA GLY 46 1HA GLY 136 1.684 13.148 -3.976 1077 2HA GLY 46 2HA GLY 136 1.242 13.806 -2.426 1078 H PHE 47 H PHE 137 0.427 10.537 -2.241 1079 HA PHE 47 HA PHE 137 3.172 9.549 -1.482 1080 1HB PHE 47 2HB PHE 137 1.771 10.668 0.373 1081 2HB PHE 47 1HB PHE 137 0.602 9.382 0.267 1082 HD1 PHE 47 HD1 PHE 137 4.135 10.148 1.262 1083 HD2 PHE 47 HD2 PHE 137 1.177 7.035 0.950 1084 HE1 PHE 47 HE1 PHE 137 5.651 8.532 2.361 1085 HE2 PHE 47 HE2 PHE 137 2.741 5.455 1.986 1086 HZ PHE 47 HZ PHE 137 5.038 6.201 2.544 1087 H GLY 48 H GLY 138 -0.264 8.421 -2.156 1088 1HA GLY 48 1HA GLY 138 0.747 5.869 -3.083 1089 2HA GLY 48 2HA GLY 138 0.195 5.674 -1.446 1090 H ASN 49 H ASN 139 -0.706 4.640 -4.110 1091 HA ASN 49 HA ASN 139 -3.717 5.168 -3.697 1092 1HB ASN 49 1HB ASN 139 -2.344 4.732 -6.415 1093 2HB ASN 49 2HB ASN 139 -4.066 4.836 -6.133 1094 1HD2 ASN 49 1HD2 ASN 139 -3.156 8.128 -7.472 1095 2HD2 ASN 49 2HD2 ASN 139 -3.199 6.371 -7.998 1096 H PHE 50 H PHE 140 -4.242 3.349 -2.586 1097 HA PHE 50 HA PHE 140 -3.035 0.660 -3.313 1098 1HB PHE 50 2HB PHE 140 -5.212 1.157 -1.244 1099 2HB PHE 50 1HB PHE 140 -4.516 -0.362 -1.500 1100 HD1 PHE 50 HD1 PHE 140 -4.030 3.043 -0.280 1101 HD2 PHE 50 HD2 PHE 140 -3.000 -1.078 0.119 1102 HE1 PHE 50 HE1 PHE 140 -2.864 3.539 1.872 1103 HE2 PHE 50 HE2 PHE 140 -1.841 -0.561 2.264 1104 HZ PHE 50 HZ PHE 140 -1.677 1.766 3.008 1105 H GLU 51 H GLU 141 -4.258 -1.039 -3.931 1106 HA GLU 51 HA GLU 141 -7.022 -1.141 -3.864 1107 1HB GLU 51 1HB GLU 141 -7.791 -1.123 -6.323 1108 2HB GLU 51 2HB GLU 141 -7.181 0.439 -5.850 1109 1HG GLU 51 1HG GLU 141 -4.952 -0.072 -6.982 1110 2HG GLU 51 2HG GLU 141 -5.574 -1.642 -7.475 1111 HE1 GLU 51 HE2 GLU 141 -6.867 1.786 -9.236 1112 H VAL 52 H VAL 142 -8.117 -3.071 -4.774 1113 HA VAL 52 HA VAL 142 -6.251 -5.310 -4.434 1114 HB VAL 52 HB VAL 142 -8.782 -4.485 -3.391 1115 1HG1 VAL 52 1HG2 VAL 142 -9.391 -6.501 -5.563 1116 2HG1 VAL 52 2HG2 VAL 142 -10.418 -6.143 -4.133 1117 3HG1 VAL 52 3HG2 VAL 142 -10.030 -4.864 -5.336 1118 1HG2 VAL 52 1HG1 VAL 142 -7.523 -7.232 -3.316 1119 2HG2 VAL 52 2HG1 VAL 142 -7.269 -5.848 -2.221 1120 3HG2 VAL 52 3HG1 VAL 142 -8.849 -6.630 -2.301 1121 NH1 ARG 53 NH2 ARG 143 -2.231 -6.205 -12.100 1122 NH2 ARG 53 NH1 ARG 143 -3.149 -6.929 -14.050 1123 H ARG 53 H ARG 143 -6.414 -7.184 -5.846 1124 HA ARG 53 HA ARG 143 -6.926 -6.439 -8.791 1125 1HB ARG 53 1HB ARG 143 -4.415 -6.527 -8.076 1126 2HB ARG 53 2HB ARG 143 -4.644 -8.239 -7.835 1127 1HG ARG 53 1HG ARG 143 -3.691 -8.032 -9.977 1128 2HG ARG 53 2HG ARG 143 -5.364 -8.490 -10.264 1129 1HD ARG 53 1HD ARG 143 -5.935 -6.083 -10.813 1130 2HD ARG 53 2HD ARG 143 -4.294 -5.577 -10.448 1131 1HH1 ARG 53 2HH2 ARG 143 -2.374 -5.970 -11.111 1132 2HH1 ARG 53 1HH2 ARG 143 -1.350 -6.155 -12.622 1133 1HH2 ARG 53 1HH1 ARG 143 -3.987 -7.245 -14.550 1134 2HH2 ARG 53 2HH1 ARG 143 -2.204 -6.829 -14.436 1135 H GLU 54 H GLU 144 -8.880 -7.389 -8.879 1136 HA GLU 54 HA GLU 144 -9.482 -10.104 -7.844 1137 1HB GLU 54 1HB GLU 144 -11.232 -8.295 -8.117 1138 2HB GLU 54 2HB GLU 144 -11.049 -8.383 -9.857 1139 1HG GLU 54 1HG GLU 144 -13.008 -9.617 -9.391 1140 2HG GLU 54 2HG GLU 144 -11.823 -10.853 -9.757 1141 HE1 GLU 54 HE2 GLU 144 -11.712 -12.138 -6.493 1142 NH1 ARG 55 NH2 ARG 145 -6.877 -17.079 -7.761 1143 NH2 ARG 55 NH1 ARG 145 -4.893 -16.302 -6.978 1144 H ARG 55 H ARG 145 -8.629 -11.866 -8.734 1145 HA ARG 55 HA ARG 145 -7.248 -11.933 -11.322 1146 1HB ARG 55 1HB ARG 145 -6.712 -13.359 -9.251 1147 2HB ARG 55 2HB ARG 145 -8.134 -14.319 -9.599 1148 1HG ARG 55 1HG ARG 145 -7.027 -14.755 -11.965 1149 2HG ARG 55 2HG ARG 145 -5.566 -14.069 -11.273 1150 1HD ARG 55 1HD ARG 145 -7.127 -16.552 -10.298 1151 2HD ARG 55 2HD ARG 145 -5.620 -16.565 -11.189 1152 1HH1 ARG 55 2HH2 ARG 145 -7.512 -17.180 -8.561 1153 2HH1 ARG 55 1HH2 ARG 145 -7.037 -17.411 -6.804 1154 1HH2 ARG 55 1HH1 ARG 145 -4.013 -15.812 -7.174 1155 2HH2 ARG 55 2HH1 ARG 145 -5.192 -16.690 -6.076 1156 H ALA 56 H ALA 146 -7.982 -12.545 -13.277 1157 HA ALA 56 HA ALA 146 -10.912 -12.649 -13.775 1158 1HB ALA 56 3HB ALA 146 -9.451 -11.415 -15.322 1159 2HB ALA 56 1HB ALA 146 -8.563 -12.898 -15.750 1160 3HB ALA 56 2HB ALA 146 -10.277 -12.723 -16.190 1161 H ALA 57 H ALA 147 -11.517 -14.573 -12.695 1162 HA ALA 57 HA ALA 147 -10.799 -17.180 -13.077 1163 1HB ALA 57 1HB ALA 147 -12.706 -16.481 -11.588 1164 2HB ALA 57 2HB ALA 147 -13.746 -16.196 -13.004 1165 3HB ALA 57 3HB ALA 147 -13.222 -17.842 -12.596 1166 NH1 ARG 58 NH2 ARG 148 -8.484 -14.059 -18.902 1167 NH2 ARG 58 NH1 ARG 148 -6.490 -13.738 -17.857 1168 H ARG 58 H ARG 148 -10.504 -18.631 -14.437 1169 HA ARG 58 HA ARG 148 -11.281 -17.984 -17.228 1170 1HB ARG 58 2HB ARG 148 -9.108 -19.931 -16.336 1171 2HB ARG 58 1HB ARG 148 -9.382 -19.439 -17.995 1172 1HG ARG 58 1HG ARG 148 -8.357 -17.639 -15.732 1173 2HG ARG 58 2HG ARG 148 -7.404 -18.391 -16.997 1174 1HD ARG 58 1HD ARG 148 -8.662 -17.062 -18.767 1175 2HD ARG 58 2HD ARG 148 -9.605 -16.275 -17.487 1176 1HH1 ARG 58 2HH2 ARG 148 -9.276 -14.686 -19.079 1177 2HH1 ARG 58 1HH2 ARG 148 -8.352 -13.113 -19.277 1178 1HH2 ARG 58 1HH1 ARG 148 -5.763 -14.118 -17.241 1179 2HH2 ARG 58 2HH1 ARG 148 -6.496 -12.815 -18.305 1180 H LYS 59 H LYS 149 -10.926 -20.457 -18.429 1181 HA LYS 59 HA LYS 149 -12.792 -22.469 -17.208 1182 1HB LYS 59 1HB LYS 149 -14.262 -20.804 -18.525 1183 2HB LYS 59 2HB LYS 149 -13.518 -21.365 -20.004 1184 1HG LYS 59 1HG LYS 149 -15.014 -23.177 -17.978 1185 2HG LYS 59 2HG LYS 149 -15.795 -22.329 -19.302 1186 1HD LYS 59 1HD LYS 149 -14.332 -23.578 -20.969 1187 2HD LYS 59 2HD LYS 149 -13.653 -24.520 -19.635 1188 1HE LYS 59 1HE LYS 149 -15.939 -25.408 -19.051 1189 2HE LYS 59 2HE LYS 149 -16.674 -24.410 -20.314 1190 1HZ LYS 59 1HZ LYS 149 -16.319 -26.656 -21.052 1191 2HZ LYS 59 2HZ LYS 149 -14.713 -26.589 -20.748 1192 H GLY 60 H GLY 150 -11.347 -24.066 -17.231 1193 1HA GLY 60 1HA GLY 150 -9.291 -24.331 -19.509 1194 2HA GLY 60 2HA GLY 150 -9.005 -24.864 -17.866 1195 NH1 ARG 61 NH2 ARG 151 -11.043 -26.946 -24.883 1196 NH2 ARG 61 NH1 ARG 151 -9.799 -28.812 -25.230 1197 H ARG 61 H ARG 151 -9.482 -26.179 -20.654 1198 HA ARG 61 HA ARG 151 -11.165 -28.475 -19.595 1199 1HB ARG 61 1HB ARG 151 -12.691 -26.953 -20.513 1200 2HB ARG 61 2HB ARG 151 -11.812 -26.718 -21.999 1201 1HG ARG 61 1HG ARG 151 -12.774 -29.583 -21.500 1202 2HG ARG 61 2HG ARG 151 -14.027 -28.392 -21.557 1203 1HD ARG 61 1HD ARG 151 -13.820 -29.312 -23.757 1204 2HD ARG 61 2HD ARG 151 -13.370 -27.627 -23.832 1205 1HH1 ARG 61 2HH2 ARG 151 -11.894 -26.534 -24.484 1206 2HH1 ARG 61 1HH2 ARG 151 -10.304 -26.452 -25.397 1207 1HH2 ARG 61 1HH1 ARG 151 -9.694 -29.824 -25.096 1208 2HH2 ARG 61 2HH1 ARG 151 -9.148 -28.186 -25.717 1209 H ASN 62 H ASN 152 -11.083 -30.296 -20.458 1210 HA ASN 62 HA ASN 152 -8.559 -31.413 -20.844 1211 1HB ASN 62 1HB ASN 152 -9.746 -33.561 -21.143 1212 2HB ASN 62 2HB ASN 152 -10.321 -32.619 -19.799 1213 1HD2 ASN 62 2HD2 ASN 152 -13.094 -33.715 -22.520 1214 2HD2 ASN 62 1HD2 ASN 152 -11.314 -34.060 -22.809 1215 HA PRO 63 HA PRO 153 -8.000 -31.674 -25.435 1216 1HB PRO 63 1HB PRO 153 -5.461 -33.126 -24.555 1217 2HB PRO 63 2HB PRO 153 -5.667 -31.912 -25.835 1218 1HG PRO 63 1HG PRO 153 -4.612 -31.170 -23.436 1219 2HG PRO 63 2HG PRO 153 -5.798 -30.107 -24.227 1220 1HD PRO 63 1HD PRO 153 -6.288 -32.083 -21.934 1221 2HD PRO 63 2HD PRO 153 -6.854 -30.393 -22.105 1222 H GLN 64 H GLN 154 -7.000 -34.460 -23.363 1223 HA GLN 64 HA GLN 154 -9.191 -36.145 -24.598 1224 1HB GLN 64 1HB GLN 154 -6.741 -37.247 -24.821 1225 2HB GLN 64 2HB GLN 154 -6.863 -37.469 -23.092 1226 1HG GLN 64 1HG GLN 154 -7.605 -39.490 -23.888 1227 2HG GLN 64 2HG GLN 154 -9.111 -38.682 -23.474 1228 1HE2 GLN 64 2HE2 GLN 154 -10.343 -38.780 -26.867 1229 2HE2 GLN 64 1HE2 GLN 154 -10.611 -38.257 -25.129 1230 H THR 65 H THR 155 -7.126 -36.190 -21.599 1231 HA THR 65 HA THR 155 -9.490 -35.459 -19.927 1232 HB THR 65 HB THR 155 -9.025 -37.019 -18.442 1233 HG1 THR 65 HG1 THR 155 -6.616 -37.697 -19.811 1234 1HG2 THR 65 1HG2 THR 155 -9.935 -37.981 -20.738 1235 2HG2 THR 65 2HG2 THR 155 -8.274 -38.414 -21.146 1236 3HG2 THR 65 3HG2 THR 155 -9.057 -39.264 -19.798 1237 H GLY 66 H GLY 156 -7.603 -33.445 -20.684 1238 1HA GLY 66 1HA GLY 156 -5.571 -32.795 -18.704 1239 2HA GLY 66 2HA GLY 156 -6.561 -31.584 -19.515 1240 H GLU 67 H GLU 157 -8.971 -32.772 -18.124 1241 HA GLU 67 HA GLU 157 -10.316 -32.677 -16.860 1242 1HB GLU 67 2HB GLU 157 -8.899 -32.809 -15.174 1243 2HB GLU 67 1HB GLU 157 -8.452 -31.108 -15.369 1244 1HG GLU 67 1HG GLU 157 -9.700 -31.366 -13.207 1245 2HG GLU 67 2HG GLU 157 -10.690 -30.428 -14.306 1246 HE1 GLU 67 HE2 GLU 157 -11.703 -34.242 -13.290 1247 H GLU 68 H GLU 158 -12.236 -31.756 -16.710 1248 HA GLU 68 HA GLU 158 -12.551 -29.108 -18.154 1249 1HB GLU 68 1HB GLU 158 -14.956 -29.566 -18.486 1250 2HB GLU 68 2HB GLU 158 -13.841 -30.583 -19.347 1251 1HG GLU 68 1HG GLU 158 -14.251 -32.460 -17.633 1252 2HG GLU 68 2HG GLU 158 -15.436 -31.430 -16.839 1253 HE1 GLU 68 HE2 GLU 158 -16.228 -33.301 -20.329 1254 H MET 69 H MET 159 -12.546 -27.392 -16.764 1255 HA MET 69 HA MET 159 -14.514 -27.237 -14.565 1256 1HB MET 69 1HB MET 159 -13.114 -27.078 -12.638 1257 2HB MET 69 2HB MET 159 -12.723 -28.588 -13.410 1258 1HG MET 69 1HG MET 159 -10.995 -26.028 -13.439 1259 2HG MET 69 2HG MET 159 -10.702 -27.493 -12.503 1260 1HE MET 69 2HE MET 159 -10.035 -25.630 -15.766 1261 2HE MET 69 1HE MET 159 -8.592 -26.019 -14.795 1262 3HE MET 69 3HE MET 159 -8.793 -26.714 -16.431 1263 H GLU 70 H GLU 160 -14.837 -25.200 -13.771 1264 HA GLU 70 HA GLU 160 -13.656 -22.883 -15.249 1265 1HB GLU 70 2HB GLU 160 -15.232 -21.469 -14.171 1266 2HB GLU 70 1HB GLU 160 -16.039 -22.884 -14.862 1267 1HG GLU 70 1HG GLU 160 -16.203 -23.883 -12.506 1268 2HG GLU 70 2HG GLU 160 -15.476 -22.415 -11.859 1269 HE1 GLU 70 HE2 GLU 160 -19.315 -22.496 -13.101 1270 H ILE 71 H ILE 161 -11.748 -21.939 -14.622 1271 HA ILE 71 HA ILE 161 -10.445 -22.756 -12.146 1272 HB ILE 71 HB ILE 161 -9.519 -20.775 -14.308 1273 1HG1 ILE 71 1HG1 ILE 161 -9.002 -23.819 -14.133 1274 2HG1 ILE 71 2HG1 ILE 161 -10.030 -23.057 -15.327 1275 1HG2 ILE 71 2HG2 ILE 161 -8.276 -20.712 -12.114 1276 2HG2 ILE 71 3HG2 ILE 161 -7.926 -22.461 -12.292 1277 3HG2 ILE 71 1HG2 ILE 161 -7.263 -21.274 -13.460 1278 1HD1 ILE 71 2HD1 ILE 161 -8.074 -21.890 -16.375 1279 2HD1 ILE 71 3HD1 ILE 161 -6.980 -22.654 -15.191 1280 3HD1 ILE 71 1HD1 ILE 161 -7.878 -23.652 -16.337 1281 HA PRO 72 HA PRO 162 -12.516 -19.232 -10.087 1282 1HB PRO 72 1HB PRO 162 -11.635 -19.536 -7.465 1283 2HB PRO 72 2HB PRO 162 -12.719 -20.666 -8.287 1284 1HG PRO 72 1HG PRO 162 -9.677 -20.902 -7.983 1285 2HG PRO 72 2HG PRO 162 -10.908 -22.126 -7.583 1286 1HD PRO 72 1HD PRO 162 -9.571 -22.161 -9.998 1287 2HD PRO 72 2HD PRO 162 -11.292 -22.646 -9.901 1288 H ALA 73 H ALA 163 -12.320 -17.330 -8.886 1289 HA ALA 73 HA ALA 163 -9.938 -15.615 -9.623 1290 1HB ALA 73 2HB ALA 163 -12.354 -14.764 -9.967 1291 2HB ALA 73 3HB ALA 163 -12.586 -14.813 -8.184 1292 3HB ALA 73 1HB ALA 163 -11.405 -13.722 -8.901 1293 H SER 74 H SER 164 -9.376 -13.938 -8.114 1294 HA SER 74 HA SER 164 -10.204 -13.931 -5.487 1295 1HB SER 74 1HB SER 164 -8.550 -15.918 -5.057 1296 2HB SER 74 2HB SER 164 -7.203 -14.851 -5.454 1297 HG SER 74 HG SER 164 -7.543 -14.986 -3.251 1298 H LYS 75 H LYS 165 -9.637 -12.143 -4.248 1299 HA LYS 75 HA LYS 165 -8.499 -9.852 -5.837 1300 1HB LYS 75 2HB LYS 165 -9.314 -9.148 -3.067 1301 2HB LYS 75 1HB LYS 165 -9.379 -8.303 -4.568 1302 1HG LYS 75 1HG LYS 165 -11.594 -8.525 -4.152 1303 2HG LYS 75 2HG LYS 165 -11.360 -9.887 -5.230 1304 1HD LYS 75 1HD LYS 165 -11.245 -11.440 -3.230 1305 2HD LYS 75 2HD LYS 165 -11.371 -10.079 -2.130 1306 1HE LYS 75 1HE LYS 165 -13.563 -10.877 -4.169 1307 2HE LYS 75 2HE LYS 165 -13.525 -11.393 -2.485 1308 1HZ LYS 75 1HZ LYS 165 -13.664 -8.563 -3.360 1309 2HZ LYS 75 2HZ LYS 165 -13.636 -9.068 -1.806 1310 H VAL 76 H VAL 166 -6.209 -9.258 -5.674 1311 HA VAL 76 HA VAL 166 -4.706 -10.072 -3.360 1312 HB VAL 76 HB VAL 166 -4.761 -9.952 -6.352 1313 1HG1 VAL 76 1HG2 VAL 166 -2.190 -9.331 -5.073 1314 2HG1 VAL 76 2HG2 VAL 166 -2.508 -9.900 -6.795 1315 3HG1 VAL 76 3HG2 VAL 166 -3.165 -8.354 -6.229 1316 1HG2 VAL 76 3HG1 VAL 166 -4.955 -12.050 -5.106 1317 2HG2 VAL 76 1HG1 VAL 166 -3.571 -12.018 -6.216 1318 3HG2 VAL 76 2HG1 VAL 166 -3.304 -11.802 -4.448 1319 HA PRO 77 HA PRO 167 -4.721 -5.482 -2.698 1320 1HB PRO 77 1HB PRO 167 -3.650 -5.438 -0.131 1321 2HB PRO 77 2HB PRO 167 -5.250 -6.125 -0.464 1322 1HG PRO 77 1HG PRO 167 -2.596 -7.635 -0.223 1323 2HG PRO 77 2HG PRO 167 -4.109 -7.975 0.624 1324 1HD PRO 77 1HD PRO 167 -3.301 -9.261 -1.831 1325 2HD PRO 77 2HD PRO 167 -5.036 -9.016 -1.477 1326 H ALA 78 H ALA 168 -3.607 -3.990 -3.151 1327 HA ALA 78 HA ALA 168 -0.543 -4.049 -3.235 1328 1HB ALA 78 3HB ALA 168 -1.721 -4.709 -5.400 1329 2HB ALA 78 1HB ALA 168 -2.542 -3.129 -5.420 1330 3HB ALA 78 2HB ALA 168 -0.768 -3.212 -5.569 1331 H PHE 79 H PHE 169 0.327 -2.014 -3.724 1332 HA PHE 79 HA PHE 169 -1.010 0.550 -2.609 1333 1HB PHE 79 2HB PHE 169 -0.275 -0.166 -0.677 1334 2HB PHE 79 1HB PHE 169 1.267 -0.788 -1.354 1335 HD1 PHE 79 HD2 PHE 169 3.190 0.719 -1.806 1336 HD2 PHE 79 HD1 PHE 169 -0.460 2.285 -0.159 1337 HE1 PHE 79 HE2 PHE 169 4.301 2.865 -1.368 1338 HE2 PHE 79 HE1 PHE 169 0.694 4.394 0.361 1339 HZ PHE 79 HZ PHE 169 3.051 4.718 -0.335 1340 H LYS 80 H LYS 170 -0.458 1.848 -4.075 1341 HA LYS 80 HA LYS 170 1.936 1.820 -6.114 1342 1HB LYS 80 2HB LYS 170 -0.511 3.614 -6.056 1343 2HB LYS 80 1HB LYS 170 0.864 3.802 -7.134 1344 1HG LYS 80 1HG LYS 170 0.441 1.512 -8.112 1345 2HG LYS 80 2HG LYS 170 -0.959 1.315 -7.058 1346 1HD LYS 80 1HD LYS 170 -2.059 3.337 -8.143 1347 2HD LYS 80 2HD LYS 170 -0.647 3.541 -9.166 1348 1HE LYS 80 1HE LYS 170 -2.309 2.444 -10.511 1349 2HE LYS 80 2HE LYS 170 -1.069 1.234 -10.189 1350 1HZ LYS 80 1HZ LYS 170 -2.496 0.323 -8.450 1351 2HZ LYS 80 2HZ LYS 170 -3.248 0.319 -9.901 1352 HA PRO 81 HA PRO 171 3.645 4.990 -3.274 1353 1HB PRO 81 1HB PRO 171 5.903 5.686 -4.675 1354 2HB PRO 81 2HB PRO 171 5.691 4.057 -4.021 1355 1HG PRO 81 1HG PRO 171 5.159 4.985 -6.895 1356 2HG PRO 81 2HG PRO 171 6.167 3.613 -6.364 1357 1HD PRO 81 1HD PRO 171 3.482 3.349 -7.125 1358 2HD PRO 81 2HD PRO 171 4.247 2.259 -5.924 1359 H GLY 82 H GLY 172 1.342 5.747 -4.760 1360 1HA GLY 82 1HA GLY 172 0.238 7.317 -6.204 1361 2HA GLY 82 2HA GLY 172 0.982 8.368 -5.018 1362 H LYS 83 H LYS 173 3.143 6.874 -7.196 1363 HA LYS 83 HA LYS 173 4.602 7.715 -8.907 1364 1HB LYS 83 2HB LYS 173 2.194 9.426 -9.502 1365 2HB LYS 83 1HB LYS 173 3.664 10.250 -9.859 1366 1HG LYS 83 1HG LYS 173 4.392 8.269 -11.323 1367 2HG LYS 83 2HG LYS 173 2.880 7.446 -10.929 1368 1HD LYS 83 1HD LYS 173 1.572 9.348 -11.960 1369 2HD LYS 83 2HD LYS 173 3.062 10.182 -12.373 1370 1HE LYS 83 1HE LYS 173 2.259 7.385 -13.447 1371 2HE LYS 83 2HE LYS 173 1.957 8.904 -14.285 1372 1HZ LYS 83 1HZ LYS 173 4.344 9.304 -14.350 1373 2HZ LYS 83 2HZ LYS 173 4.652 7.907 -13.560 1374 H ALA 84 H ALA 174 3.351 10.101 -6.943 1375 HA ALA 84 HA ALA 174 5.355 12.180 -6.766 1376 1HB ALA 84 2HB ALA 174 2.934 12.273 -6.105 1377 2HB ALA 84 3HB ALA 174 3.206 11.044 -4.844 1378 3HB ALA 84 1HB ALA 174 3.960 12.653 -4.682 1379 H LEU 85 H LEU 175 4.812 9.312 -4.518 1380 HA LEU 85 HA LEU 175 7.171 9.880 -2.894 1381 1HB LEU 85 2HB LEU 175 5.263 8.556 -1.976 1382 2HB LEU 85 1HB LEU 175 5.496 7.342 -3.221 1383 HG LEU 85 HG LEU 175 7.861 7.148 -2.394 1384 1HD1 LEU 85 3HD1 LEU 175 8.060 9.100 -0.899 1385 2HD1 LEU 85 1HD1 LEU 175 6.732 8.492 0.114 1386 3HD1 LEU 85 2HD1 LEU 175 8.292 7.623 0.057 1387 1HD2 LEU 85 3HD2 LEU 175 6.074 5.375 -2.032 1388 2HD2 LEU 85 1HD2 LEU 175 7.152 5.439 -0.635 1389 3HD2 LEU 85 2HD2 LEU 175 5.537 6.190 -0.546 1390 H LYS 86 H LYS 176 6.547 7.903 -5.810 1391 HA LYS 86 HA LYS 176 9.212 6.729 -6.044 1392 1HB LYS 86 1HB LYS 176 7.325 5.834 -7.294 1393 2HB LYS 86 2HB LYS 176 7.125 7.311 -8.202 1394 1HG LYS 86 1HG LYS 176 8.105 5.691 -9.621 1395 2HG LYS 86 2HG LYS 176 9.290 6.962 -9.357 1396 1HD LYS 86 1HD LYS 176 10.480 5.468 -7.657 1397 2HD LYS 86 2HD LYS 176 9.275 4.207 -7.945 1398 1HE LYS 86 1HE LYS 176 9.975 4.130 -10.406 1399 2HE LYS 86 2HE LYS 176 11.191 5.377 -10.087 1400 1HZ LYS 86 1HZ LYS 176 12.159 3.209 -10.010 1401 2HZ LYS 86 2HZ LYS 176 12.255 3.887 -8.526 1402 H ASP 87 H ASP 177 8.198 10.072 -6.627 1403 HA ASP 87 HA ASP 177 10.724 10.845 -7.997 1404 1HB ASP 87 1HB ASP 177 8.024 11.881 -7.688 1405 2HB ASP 87 2HB ASP 177 8.965 12.917 -6.704 1406 HD1 ASP 87 HD2 ASP 177 9.333 12.818 -10.758 1407 H ALA 88 H ALA 178 9.310 11.133 -4.693 1408 HA ALA 88 HA ALA 178 11.395 12.554 -3.265 1409 1HB ALA 88 3HB ALA 178 9.136 11.751 -2.234 1410 2HB ALA 88 1HB ALA 178 9.761 10.100 -2.230 1411 3HB ALA 88 2HB ALA 178 10.540 11.299 -1.226 1412 H VAL 89 H VAL 179 11.051 9.064 -3.907 1413 HA VAL 89 HA VAL 179 13.509 8.291 -2.519 1414 HB VAL 89 HB VAL 179 10.857 7.586 -2.520 1415 1HG1 VAL 89 2HG2 VAL 179 11.032 7.151 -5.091 1416 2HG1 VAL 89 3HG2 VAL 179 11.735 5.591 -4.647 1417 3HG1 VAL 89 1HG2 VAL 179 10.100 6.070 -4.068 1418 1HG2 VAL 89 3HG1 VAL 179 13.058 5.586 -2.323 1419 2HG2 VAL 89 1HG1 VAL 179 12.376 6.699 -1.080 1420 3HG2 VAL 89 2HG1 VAL 179 11.331 5.436 -1.775 1421 H LYS 90 H LYS 180 13.045 9.112 -5.791 1422 HA LYS 90 HA LYS 180 14.235 6.931 -7.194 1423 1HB LYS 90 1HB LYS 180 12.939 9.304 -7.888 1424 2HB LYS 90 2HB LYS 180 14.554 9.759 -8.327 1425 1HG LYS 90 1HG LYS 180 14.695 7.770 -9.877 1426 2HG LYS 90 2HG LYS 180 13.135 7.183 -9.288 1427 1HD LYS 90 1HD LYS 180 12.049 9.354 -10.089 1428 2HD LYS 90 2HD LYS 180 13.576 9.842 -10.806 1429 1HE LYS 90 1HE LYS 180 11.966 7.299 -11.553 1430 2HE LYS 90 2HE LYS 180 11.903 8.829 -12.422 1431 1HZ LYS 90 1HZ LYS 180 14.342 7.170 -12.113 1432 2HZ LYS 90 2HZ LYS 180 14.276 8.599 -12.906 No H/Q in entry = 1432
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