NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
564626 | 2lx2 | 18657 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 0 HN MET 0 1.884 0.000 0.829 2 HA MET 0 HA MET 0 2.268 1.049 -1.470 3 HB2 MET 0 2HB MET 0 4.066 -0.544 -1.868 4 HB3 MET 0 3HB MET 0 3.857 -0.477 -0.130 5 HG2 MET 0 2HG MET 0 2.327 -2.516 -0.311 6 HG3 MET 0 3HG MET 0 2.753 -2.620 -2.008 7 HE1 MET 0 3HE MET 0 5.036 -2.632 -2.885 8 HE2 MET 0 1HE MET 0 6.106 -1.735 -1.781 9 HE3 MET 0 2HE MET 0 6.418 -3.454 -2.123 10 H ASN 1 HN ASN 1 -0.507 -0.159 -1.425 11 HA ASN 1 HA ASN 1 -0.313 -1.657 -3.917 12 HB2 ASN 1 2HB ASN 1 -2.609 -1.554 -1.889 13 HB3 ASN 1 3HB ASN 1 -2.590 -2.537 -3.340 14 HD21 ASN 1 1HD2 ASN 1 -2.172 -4.566 -2.980 15 HD22 ASN 1 2HD2 ASN 1 -1.103 -5.232 -1.791 16 H GLN 2 HN GLN 2 -0.283 0.259 -5.289 17 HA GLN 2 HA GLN 2 -2.548 2.042 -4.964 18 HB2 GLN 2 2HB GLN 2 -1.304 3.537 -6.525 19 HB3 GLN 2 3HB GLN 2 -0.365 3.135 -5.100 20 HG2 GLN 2 2HG GLN 2 1.260 2.173 -6.358 21 HG3 GLN 2 3HG GLN 2 0.102 1.122 -7.148 22 HE21 GLN 2 1HE2 GLN 2 -1.559 2.873 -8.410 23 HE22 GLN 2 2HE2 GLN 2 -0.722 3.748 -9.649 24 H GLU 3 HN GLU 3 -4.225 2.130 -6.444 25 HA GLU 3 HA GLU 3 -4.549 -0.005 -8.170 26 HB2 GLU 3 2HB GLU 3 -5.987 2.541 -7.565 27 HB3 GLU 3 3HB GLU 3 -6.345 1.830 -9.127 28 HG2 GLU 3 2HG GLU 3 -6.781 -0.384 -7.944 29 HG3 GLU 3 3HG GLU 3 -6.583 0.448 -6.414 30 HE2 GLU 3 HE2 GLU 3 -8.851 1.998 -5.970 31 H SER 4 HN SER 4 -4.189 -0.304 -10.379 32 HA SER 4 HA SER 4 -2.916 1.960 -11.709 33 HB2 SER 4 2HB SER 4 -2.263 -0.826 -12.600 34 HB3 SER 4 3HB SER 4 -1.248 0.602 -12.577 35 HG SER 4 HG SER 4 -1.297 -1.393 -10.785 36 H VAL 5 HN VAL 5 -3.464 2.286 -13.946 37 HA VAL 5 HA VAL 5 -6.057 1.670 -14.655 38 HB VAL 5 HB VAL 5 -3.651 2.450 -16.307 39 HG11 VAL 5 1HG1 VAL 5 -5.416 1.358 -17.692 40 HG12 VAL 5 2HG1 VAL 5 -6.572 2.585 -17.123 41 HG13 VAL 5 3HG1 VAL 5 -5.161 3.074 -18.091 42 HG21 VAL 5 3HG2 VAL 5 -4.978 3.884 -14.374 43 HG22 VAL 5 1HG2 VAL 5 -4.056 4.586 -15.726 44 HG23 VAL 5 2HG2 VAL 5 -5.821 4.390 -15.858 45 H VAL 6 HN VAL 6 -7.060 0.001 -15.738 46 HA VAL 6 HA VAL 6 -5.337 -2.050 -16.899 47 HB VAL 6 HB VAL 6 -7.433 -2.459 -14.765 48 HG11 VAL 6 1HG1 VAL 6 -7.377 -4.805 -15.140 49 HG12 VAL 6 2HG1 VAL 6 -7.649 -4.057 -16.732 50 HG13 VAL 6 3HG1 VAL 6 -6.033 -4.665 -16.299 51 HG21 VAL 6 3HG2 VAL 6 -5.533 -2.243 -13.540 52 HG22 VAL 6 1HG2 VAL 6 -5.304 -3.944 -14.014 53 HG23 VAL 6 2HG2 VAL 6 -4.471 -2.651 -14.909 54 H ALA 7 HN ALA 7 -6.023 -2.532 -18.920 55 HA ALA 7 HA ALA 7 -8.128 -1.264 -20.127 56 HB1 ALA 7 1HB ALA 7 -6.634 -2.182 -21.623 57 HB2 ALA 7 2HB ALA 7 -6.449 -3.683 -20.685 58 HB3 ALA 7 3HB ALA 7 -7.900 -3.431 -21.685 59 H ALA 8 HN ALA 8 -10.137 -1.263 -19.144 60 HA ALA 8 HA ALA 8 -11.242 -3.508 -17.883 61 HB1 ALA 8 1HB ALA 8 -11.792 -0.821 -18.050 62 HB2 ALA 8 2HB ALA 8 -13.107 -1.514 -19.029 63 HB3 ALA 8 3HB ALA 8 -12.884 -2.035 -17.342 64 H VAL 9 HN VAL 9 -10.687 -2.799 -21.201 65 HA VAL 9 HA VAL 9 -12.191 -5.136 -21.948 66 HB VAL 9 HB VAL 9 -13.431 -3.963 -23.727 67 HG11 VAL 9 1HG1 VAL 9 -15.203 -3.089 -22.312 68 HG12 VAL 9 2HG1 VAL 9 -14.489 -4.533 -21.555 69 HG13 VAL 9 3HG1 VAL 9 -14.070 -2.913 -20.950 70 HG21 VAL 9 3HG2 VAL 9 -11.997 -1.619 -22.596 71 HG22 VAL 9 1HG2 VAL 9 -12.544 -1.942 -24.259 72 HG23 VAL 9 2HG2 VAL 9 -13.703 -1.365 -23.037 73 H LEU 10 HN LEU 10 -11.842 -5.483 -24.455 74 HA LEU 10 HA LEU 10 -9.068 -5.520 -24.847 75 HB2 LEU 10 2HB LEU 10 -10.353 -7.226 -25.808 76 HB3 LEU 10 3HB LEU 10 -11.457 -6.101 -26.573 77 HG LEU 10 HG LEU 10 -9.206 -5.367 -27.840 78 HD11 LEU 10 1HD1 LEU 10 -8.389 -8.003 -28.284 79 HD12 LEU 10 2HD1 LEU 10 -7.488 -6.718 -27.444 80 HD13 LEU 10 3HD1 LEU 10 -8.504 -7.845 -26.514 81 HD21 LEU 10 3HD2 LEU 10 -11.542 -6.747 -28.471 82 HD22 LEU 10 1HD2 LEU 10 -10.360 -6.059 -29.610 83 HD23 LEU 10 2HD2 LEU 10 -10.234 -7.765 -29.118 84 H ILE 11 HN ILE 11 -7.893 -3.670 -25.009 85 HA ILE 11 HA ILE 11 -9.022 -1.518 -26.637 86 HB ILE 11 HB ILE 11 -6.554 -1.225 -24.985 87 HG12 ILE 11 2HG1 ILE 11 -9.336 -1.631 -23.920 88 HG13 ILE 11 3HG1 ILE 11 -7.817 -2.278 -23.334 89 HG21 ILE 11 1HG2 ILE 11 -7.163 1.032 -24.875 90 HG22 ILE 11 2HG2 ILE 11 -7.566 0.546 -26.539 91 HG23 ILE 11 3HG2 ILE 11 -8.854 0.697 -25.319 92 HD11 ILE 11 3HD1 ILE 11 -8.595 0.673 -23.236 93 HD12 ILE 11 1HD1 ILE 11 -8.696 -0.458 -21.866 94 HD13 ILE 11 2HD1 ILE 11 -7.111 -0.042 -22.562 95 HA PRO 12 HA PRO 12 -6.192 -2.996 -29.655 96 HB2 PRO 12 2HB PRO 12 -7.299 -1.689 -31.785 97 HB3 PRO 12 3HB PRO 12 -7.829 -3.272 -31.251 98 HG2 PRO 12 2HG PRO 12 -9.154 -0.654 -30.889 99 HG3 PRO 12 3HG PRO 12 -9.841 -2.261 -30.752 100 HD2 PRO 12 2HD PRO 12 -9.114 -0.516 -28.594 101 HD3 PRO 12 3HD PRO 12 -9.692 -2.165 -28.460 102 H ILE 13 HN ILE 13 -4.767 -1.970 -31.424 103 HA ILE 13 HA ILE 13 -3.340 0.065 -30.086 104 HB ILE 13 HB ILE 13 -2.233 -1.576 -31.445 105 HG12 ILE 13 2HG1 ILE 13 -1.881 1.017 -32.938 106 HG13 ILE 13 3HG1 ILE 13 -1.438 0.892 -31.247 107 HG21 ILE 13 1HG2 ILE 13 -3.511 -2.286 -33.179 108 HG22 ILE 13 2HG2 ILE 13 -4.154 -0.662 -33.523 109 HG23 ILE 13 3HG2 ILE 13 -2.516 -1.103 -34.062 110 HD11 ILE 13 3HD1 ILE 13 0.527 -0.031 -31.882 111 HD12 ILE 13 1HD1 ILE 13 -0.376 -1.442 -32.484 112 HD13 ILE 13 2HD1 ILE 13 -0.009 -0.086 -33.578 113 H ASN 14 HN ASN 14 -2.897 2.259 -30.894 114 HA ASN 14 HA ASN 14 -3.733 4.250 -31.259 115 HB2 ASN 14 2HB ASN 14 -4.735 3.099 -33.907 116 HB3 ASN 14 3HB ASN 14 -4.174 4.732 -33.609 117 HD21 ASN 14 1HD2 ASN 14 -3.231 2.939 -35.597 118 HD22 ASN 14 2HD2 ASN 14 -1.552 2.621 -35.315 119 H THR 15 HN THR 15 -5.551 3.048 -29.630 120 HA THR 15 HA THR 15 -8.157 3.636 -30.875 121 HB THR 15 HB THR 15 -7.356 1.486 -28.845 122 HG1 THR 15 HG1 THR 15 -6.957 0.968 -31.080 123 HG21 THR 15 3HG2 THR 15 -9.925 0.930 -29.747 124 HG22 THR 15 1HG2 THR 15 -9.553 1.654 -28.164 125 HG23 THR 15 2HG2 THR 15 -9.988 2.697 -29.539 126 H ALA 16 HN ALA 16 -9.117 5.393 -30.092 127 HA ALA 16 HA ALA 16 -8.094 6.930 -28.068 128 HB1 ALA 16 1HB ALA 16 -10.802 6.654 -29.371 129 HB2 ALA 16 2HB ALA 16 -10.579 7.783 -28.013 130 HB3 ALA 16 3HB ALA 16 -9.617 7.976 -29.499 131 H LEU 17 HN LEU 17 -8.103 6.857 -25.863 132 HA LEU 17 HA LEU 17 -9.386 4.571 -24.649 133 HB2 LEU 17 2HB LEU 17 -7.511 6.690 -23.599 134 HB3 LEU 17 3HB LEU 17 -8.178 5.403 -22.615 135 HG LEU 17 HG LEU 17 -6.501 4.925 -25.091 136 HD11 LEU 17 1HD1 LEU 17 -5.558 4.754 -22.222 137 HD12 LEU 17 2HD1 LEU 17 -4.595 4.593 -23.710 138 HD13 LEU 17 3HD1 LEU 17 -5.291 6.170 -23.268 139 HD21 LEU 17 3HD2 LEU 17 -7.676 3.141 -22.974 140 HD22 LEU 17 1HD2 LEU 17 -7.709 2.975 -24.746 141 HD23 LEU 17 2HD2 LEU 17 -6.201 2.668 -23.851 142 H THR 18 HN THR 18 -11.070 4.633 -23.143 143 HA THR 18 HA THR 18 -12.270 7.281 -22.702 144 HB THR 18 HB THR 18 -14.504 6.100 -23.056 145 HG1 THR 18 HG1 THR 18 -14.130 3.908 -23.050 146 HG21 THR 18 3HG2 THR 18 -12.499 6.017 -25.371 147 HG22 THR 18 1HG2 THR 18 -14.252 5.777 -25.564 148 HG23 THR 18 2HG2 THR 18 -13.626 7.342 -24.994 149 H VAL 19 HN VAL 19 -14.054 7.074 -20.920 150 HA VAL 19 HA VAL 19 -12.675 6.006 -18.650 151 HB VAL 19 HB VAL 19 -14.124 8.180 -18.988 152 HG11 VAL 19 1HG1 VAL 19 -16.402 7.889 -18.008 153 HG12 VAL 19 2HG1 VAL 19 -16.207 7.115 -19.599 154 HG13 VAL 19 3HG1 VAL 19 -16.185 6.126 -18.119 155 HG21 VAL 19 3HG2 VAL 19 -13.980 6.462 -16.498 156 HG22 VAL 19 1HG2 VAL 19 -12.931 7.821 -16.967 157 HG23 VAL 19 2HG2 VAL 19 -14.620 8.123 -16.491 158 H GLY 20 HN GLY 20 -14.895 4.802 -20.988 159 HA2 GLY 20 1HA GLY 20 -15.973 2.798 -19.120 160 HA3 GLY 20 2HA GLY 20 -16.606 3.202 -20.703 161 H MET 21 HN MET 21 -13.158 3.131 -20.706 162 HA MET 21 HA MET 21 -13.266 0.418 -21.778 163 HB2 MET 21 2HB MET 21 -11.992 2.973 -22.690 164 HB3 MET 21 3HB MET 21 -10.956 1.566 -22.824 165 HG2 MET 21 2HG MET 21 -13.351 0.585 -23.836 166 HG3 MET 21 3HG MET 21 -13.409 2.257 -24.360 167 HE1 MET 21 3HE MET 21 -9.752 2.274 -24.332 168 HE2 MET 21 1HE MET 21 -9.896 2.629 -26.070 169 HE3 MET 21 2HE MET 21 -11.023 3.376 -24.912 170 H MET 22 HN MET 22 -11.579 2.761 -19.686 171 HA MET 22 HA MET 22 -9.615 0.733 -19.033 172 HB2 MET 22 2HB MET 22 -9.911 3.710 -18.366 173 HB3 MET 22 3HB MET 22 -8.640 2.721 -17.673 174 HG2 MET 22 2HG MET 22 -7.649 2.293 -19.837 175 HG3 MET 22 3HG MET 22 -9.059 2.893 -20.687 176 HE1 MET 22 3HE MET 22 -9.965 5.453 -19.424 177 HE2 MET 22 1HE MET 22 -8.948 6.696 -20.190 178 HE3 MET 22 2HE MET 22 -9.584 5.345 -21.159 179 H THR 23 HN THR 23 -8.966 0.950 -16.479 180 HA THR 23 HA THR 23 -11.127 1.411 -14.702 181 HB THR 23 HB THR 23 -11.573 -0.872 -16.064 182 HG1 THR 23 HG1 THR 23 -12.955 -1.024 -14.324 183 HG21 THR 23 3HG2 THR 23 -9.266 -1.780 -15.240 184 HG22 THR 23 1HG2 THR 23 -10.017 -1.847 -13.628 185 HG23 THR 23 2HG2 THR 23 -10.687 -2.815 -14.962 186 H THR 24 HN THR 24 -10.540 0.474 -12.436 187 HA THR 24 HA THR 24 -7.620 0.764 -12.163 188 HB THR 24 HB THR 24 -8.094 1.922 -10.071 189 HG1 THR 24 HG1 THR 24 -10.887 1.314 -10.715 190 HG21 THR 24 3HG2 THR 24 -10.353 2.852 -11.897 191 HG22 THR 24 1HG2 THR 24 -9.379 3.828 -10.771 192 HG23 THR 24 2HG2 THR 24 -8.651 3.212 -12.274 193 H ARG 25 HN ARG 25 -6.464 -0.806 -11.189 194 HA ARG 25 HA ARG 25 -7.756 -2.584 -9.405 195 HB2 ARG 25 2HB ARG 25 -7.680 -3.306 -12.182 196 HB3 ARG 25 3HB ARG 25 -6.484 -4.306 -11.382 197 HG2 ARG 25 2HG ARG 25 -8.155 -5.637 -10.628 198 HG3 ARG 25 3HG ARG 25 -8.729 -4.308 -9.640 199 HD2 ARG 25 2HD ARG 25 -10.494 -3.871 -11.036 200 HD3 ARG 25 3HD ARG 25 -9.516 -4.034 -12.481 201 HE ARG 25 HE ARG 25 -9.704 -6.638 -11.673 202 HH11 ARG 25 2HH2 ARG 25 -12.176 -4.128 -12.055 203 HH12 ARG 25 1HH2 ARG 25 -13.438 -5.254 -12.428 204 HH22 ARG 25 HH1 ARG 25 -12.941 -7.598 -12.487 205 H VAL 26 HN VAL 26 -6.190 -3.756 -8.124 206 HA VAL 26 HA VAL 26 -3.562 -2.616 -8.239 207 HB VAL 26 HB VAL 26 -4.729 -4.747 -6.438 208 HG11 VAL 26 1HG1 VAL 26 -2.548 -2.933 -5.534 209 HG12 VAL 26 2HG1 VAL 26 -2.850 -4.646 -5.157 210 HG13 VAL 26 3HG1 VAL 26 -2.108 -4.194 -6.710 211 HG21 VAL 26 3HG2 VAL 26 -5.566 -3.132 -5.037 212 HG22 VAL 26 1HG2 VAL 26 -4.400 -1.899 -5.574 213 HG23 VAL 26 2HG2 VAL 26 -5.790 -2.318 -6.604 214 H VAL 27 HN VAL 27 -2.852 -3.382 -10.345 215 HA VAL 27 HA VAL 27 -2.349 -6.272 -10.400 216 HB VAL 27 HB VAL 27 -2.312 -6.132 -12.745 217 HG11 VAL 27 1HG1 VAL 27 -4.513 -5.599 -13.222 218 HG12 VAL 27 2HG1 VAL 27 -4.566 -5.759 -11.450 219 HG13 VAL 27 3HG1 VAL 27 -4.499 -4.144 -12.196 220 HG21 VAL 27 3HG2 VAL 27 -1.051 -4.305 -13.375 221 HG22 VAL 27 1HG2 VAL 27 -2.685 -3.748 -13.808 222 HG23 VAL 27 2HG2 VAL 27 -1.925 -3.189 -12.298 223 H SER 28 HN SER 28 -0.211 -6.957 -11.289 224 HA SER 28 HA SER 28 1.807 -4.922 -10.762 225 HB2 SER 28 2HB SER 28 1.390 -6.888 -8.992 226 HB3 SER 28 3HB SER 28 2.360 -7.816 -10.119 227 HG SER 28 HG SER 28 3.468 -6.556 -8.290 228 HA PRO 29 HA PRO 29 3.687 -4.665 -11.027 229 HB2 PRO 29 2HB PRO 29 5.124 -3.063 -12.711 230 HB3 PRO 29 3HB PRO 29 5.803 -4.466 -11.912 231 HG2 PRO 29 2HG PRO 29 5.002 -4.151 -14.740 232 HG3 PRO 29 3HG PRO 29 6.051 -5.358 -14.024 233 HD2 PRO 29 2HD PRO 29 3.327 -5.722 -14.843 234 HD3 PRO 29 3HD PRO 29 4.340 -6.893 -14.023 235 H THR 30 HN THR 30 3.203 -2.519 -10.363 236 HA THR 30 HA THR 30 0.698 -1.697 -11.385 237 HB THR 30 HB THR 30 1.239 0.293 -9.814 238 HG1 THR 30 HG1 THR 30 3.248 -0.400 -8.514 239 HG21 THR 30 3HG2 THR 30 1.668 -2.539 -8.722 240 HG22 THR 30 1HG2 THR 30 1.290 -1.105 -7.738 241 HG23 THR 30 2HG2 THR 30 0.093 -1.730 -8.897 242 H GLY 31 HN GLY 31 0.232 -0.654 -13.206 243 HA2 GLY 31 1HA GLY 31 2.396 0.780 -14.568 244 HA3 GLY 31 2HA GLY 31 0.875 0.249 -15.258 245 H ILE 32 HN ILE 32 0.354 2.335 -16.110 246 HA ILE 32 HA ILE 32 0.516 4.739 -14.935 247 HB ILE 32 HB ILE 32 -1.704 3.611 -16.636 248 HG12 ILE 32 2HG1 ILE 32 0.525 5.441 -17.514 249 HG13 ILE 32 3HG1 ILE 32 0.766 3.707 -17.427 250 HG21 ILE 32 1HG2 ILE 32 -1.133 6.550 -16.372 251 HG22 ILE 32 2HG2 ILE 32 -2.587 5.725 -16.982 252 HG23 ILE 32 3HG2 ILE 32 -2.234 5.732 -15.237 253 HD11 ILE 32 3HD1 ILE 32 -0.621 3.278 -19.216 254 HD12 ILE 32 1HD1 ILE 32 -1.744 4.593 -18.793 255 HD13 ILE 32 2HD1 ILE 32 -0.218 4.961 -19.632 256 HA PRO 33 HA PRO 33 -1.994 4.627 -11.419 257 HB2 PRO 33 2HB PRO 33 -2.204 7.302 -10.899 258 HB3 PRO 33 3HB PRO 33 -0.810 6.343 -10.442 259 HG2 PRO 33 2HG PRO 33 -1.076 8.290 -12.650 260 HG3 PRO 33 3HG PRO 33 0.383 7.653 -11.918 261 HD2 PRO 33 2HD PRO 33 -0.746 6.889 -14.442 262 HD3 PRO 33 3HD PRO 33 0.647 6.172 -13.657 263 H ALA 34 HN ALA 34 -4.107 4.821 -10.590 264 HA ALA 34 HA ALA 34 -6.023 4.868 -12.637 265 HB1 ALA 34 1HB ALA 34 -6.100 4.893 -9.609 266 HB2 ALA 34 2HB ALA 34 -7.593 4.960 -10.576 267 HB3 ALA 34 3HB ALA 34 -6.498 3.565 -10.725 268 H GLU 35 HN GLU 35 -4.323 7.392 -11.047 269 HA GLU 35 HA GLU 35 -6.473 9.262 -11.159 270 HB2 GLU 35 2HB GLU 35 -4.953 10.810 -10.187 271 HB3 GLU 35 3HB GLU 35 -4.521 9.265 -9.482 272 HG2 GLU 35 2HG GLU 35 -2.859 9.131 -11.575 273 HG3 GLU 35 3HG GLU 35 -3.050 10.873 -11.576 274 HE2 GLU 35 HE2 GLU 35 -2.356 10.323 -7.946 275 H ASP 36 HN ASP 36 -4.371 7.850 -13.432 276 HA ASP 36 HA ASP 36 -4.262 10.242 -15.051 277 HB2 ASP 36 2HB ASP 36 -2.841 7.617 -14.958 278 HB3 ASP 36 3HB ASP 36 -3.122 8.241 -16.572 279 HD2 ASP 36 HD2 ASP 36 -1.044 10.808 -14.342 280 H ILE 37 HN ILE 37 -6.377 7.716 -14.379 281 HA ILE 37 HA ILE 37 -7.103 6.649 -16.807 282 HB ILE 37 HB ILE 37 -8.328 7.023 -14.155 283 HG12 ILE 37 2HG1 ILE 37 -7.828 4.767 -16.087 284 HG13 ILE 37 3HG1 ILE 37 -7.174 5.008 -14.479 285 HG21 ILE 37 1HG2 ILE 37 -10.139 7.882 -15.555 286 HG22 ILE 37 2HG2 ILE 37 -10.063 6.419 -16.565 287 HG23 ILE 37 3HG2 ILE 37 -10.553 6.297 -14.858 288 HD11 ILE 37 3HD1 ILE 37 -9.518 4.734 -13.544 289 HD12 ILE 37 1HD1 ILE 37 -10.059 4.312 -15.187 290 HD13 ILE 37 2HD1 ILE 37 -8.879 3.279 -14.345 291 HA PRO 38 HA PRO 38 -9.858 10.452 -17.379 292 HB2 PRO 38 2HB PRO 38 -9.497 12.646 -15.790 293 HB3 PRO 38 3HB PRO 38 -10.719 11.429 -15.480 294 HG2 PRO 38 2HG PRO 38 -8.149 11.872 -14.087 295 HG3 PRO 38 3HG PRO 38 -9.550 10.968 -13.546 296 HD2 PRO 38 2HD PRO 38 -7.099 9.886 -14.571 297 HD3 PRO 38 3HD PRO 38 -8.542 8.989 -14.140 298 H ARG 39 HN ARG 39 -6.561 10.404 -16.983 299 HA ARG 39 HA ARG 39 -6.254 12.767 -18.616 300 HB2 ARG 39 2HB ARG 39 -4.101 10.970 -17.393 301 HB3 ARG 39 3HB ARG 39 -3.838 12.543 -18.118 302 HG2 ARG 39 2HG ARG 39 -5.329 13.573 -16.366 303 HG3 ARG 39 3HG ARG 39 -5.516 11.996 -15.624 304 HD2 ARG 39 2HD ARG 39 -3.754 13.308 -14.468 305 HD3 ARG 39 3HD ARG 39 -3.073 11.868 -15.200 306 HE ARG 39 HE ARG 39 -2.630 14.659 -16.063 307 HH11 ARG 39 2HH2 ARG 39 -2.243 11.226 -16.850 308 HH12 ARG 39 1HH2 ARG 39 -0.988 11.506 -18.010 309 HH22 ARG 39 HH1 ARG 39 -0.258 13.749 -18.431 310 H LEU 40 HN LEU 40 -6.504 9.329 -18.839 311 HA LEU 40 HA LEU 40 -4.872 9.145 -21.227 312 HB2 LEU 40 2HB LEU 40 -6.473 7.110 -19.673 313 HB3 LEU 40 3HB LEU 40 -5.566 6.749 -21.128 314 HG LEU 40 HG LEU 40 -4.223 7.974 -18.721 315 HD11 LEU 40 1HD1 LEU 40 -3.631 5.242 -18.691 316 HD12 LEU 40 2HD1 LEU 40 -4.618 6.149 -17.519 317 HD13 LEU 40 3HD1 LEU 40 -5.397 5.331 -18.895 318 HD21 LEU 40 3HD2 LEU 40 -3.056 6.132 -20.810 319 HD22 LEU 40 1HD2 LEU 40 -3.131 7.898 -21.020 320 HD23 LEU 40 2HD2 LEU 40 -2.210 7.200 -19.665 321 H ILE 41 HN ILE 41 -8.189 9.703 -20.239 322 HA ILE 41 HA ILE 41 -9.542 8.707 -22.436 323 HB ILE 41 HB ILE 41 -10.165 11.160 -20.788 324 HG12 ILE 41 2HG1 ILE 41 -10.451 8.226 -20.254 325 HG13 ILE 41 3HG1 ILE 41 -9.956 9.517 -19.177 326 HG21 ILE 41 1HG2 ILE 41 -12.463 10.818 -21.427 327 HG22 ILE 41 2HG2 ILE 41 -11.464 10.959 -22.893 328 HG23 ILE 41 3HG2 ILE 41 -12.033 9.361 -22.354 329 HD11 ILE 41 3HD1 ILE 41 -12.232 8.709 -18.614 330 HD12 ILE 41 1HD1 ILE 41 -12.277 10.408 -19.144 331 HD13 ILE 41 2HD1 ILE 41 -12.785 9.114 -20.257 332 H SER 42 HN SER 42 -9.918 9.403 -24.519 333 HA SER 42 HA SER 42 -9.917 10.761 -26.258 334 HB2 SER 42 2HB SER 42 -9.842 12.692 -24.431 335 HB3 SER 42 3HB SER 42 -8.171 12.845 -24.938 336 HG SER 42 HG SER 42 -9.933 12.670 -27.099 337 H MET 43 HN MET 43 -7.271 9.553 -24.477 338 HA MET 43 HA MET 43 -5.400 10.111 -26.625 339 HB2 MET 43 2HB MET 43 -4.817 8.639 -24.011 340 HB3 MET 43 3HB MET 43 -3.680 9.508 -25.024 341 HG2 MET 43 2HG MET 43 -5.419 11.545 -24.444 342 HG3 MET 43 3HG MET 43 -5.619 10.571 -23.000 343 HE1 MET 43 3HE MET 43 -1.948 9.557 -23.637 344 HE2 MET 43 1HE MET 43 -1.966 9.988 -21.910 345 HE3 MET 43 2HE MET 43 -3.331 9.091 -22.617 346 H GLN 44 HN GLN 44 -4.641 8.521 -28.011 347 HA GLN 44 HA GLN 44 -5.975 5.979 -27.772 348 HB2 GLN 44 2HB GLN 44 -4.172 7.004 -30.007 349 HB3 GLN 44 3HB GLN 44 -5.222 5.603 -30.080 350 HG2 GLN 44 2HG GLN 44 -7.220 6.995 -29.886 351 HG3 GLN 44 3HG GLN 44 -6.262 8.419 -29.534 352 HE21 GLN 44 1HE2 GLN 44 -6.974 5.969 -31.970 353 HE22 GLN 44 2HE2 GLN 44 -6.595 6.914 -33.371 354 H VAL 45 HN VAL 45 -4.764 3.916 -28.013 355 HA VAL 45 HA VAL 45 -2.291 4.065 -26.516 356 HB VAL 45 HB VAL 45 -2.556 1.550 -26.582 357 HG11 VAL 45 1HG1 VAL 45 -4.153 1.533 -24.808 358 HG12 VAL 45 2HG1 VAL 45 -3.295 3.090 -24.715 359 HG13 VAL 45 3HG1 VAL 45 -4.934 3.017 -25.406 360 HG21 VAL 45 3HG2 VAL 45 -4.296 0.513 -27.604 361 HG22 VAL 45 1HG2 VAL 45 -5.422 1.856 -27.293 362 HG23 VAL 45 2HG2 VAL 45 -4.265 1.959 -28.641 363 H ASN 46 HN ASN 46 -0.340 2.881 -27.234 364 HA ASN 46 HA ASN 46 -0.124 3.101 -30.125 365 HB2 ASN 46 2HB ASN 46 2.314 3.338 -29.740 366 HB3 ASN 46 3HB ASN 46 1.444 4.508 -28.767 367 HD21 ASN 46 1HD2 ASN 46 2.574 4.775 -26.991 368 HD22 ASN 46 2HD2 ASN 46 3.141 3.536 -25.921 369 H GLN 47 HN GLN 47 -1.328 0.778 -28.721 370 HA GLN 47 HA GLN 47 -0.006 -1.259 -30.015 371 HB2 GLN 47 2HB GLN 47 1.783 -1.313 -28.491 372 HB3 GLN 47 3HB GLN 47 0.776 -0.878 -27.124 373 HG2 GLN 47 2HG GLN 47 -0.287 -3.099 -27.128 374 HG3 GLN 47 3HG GLN 47 0.549 -3.540 -28.604 375 HE21 GLN 47 1HE2 GLN 47 1.638 -1.833 -25.679 376 HE22 GLN 47 2HE2 GLN 47 2.916 -2.920 -25.249 377 H VAL 48 HN VAL 48 -1.090 -3.387 -29.644 378 HA VAL 48 HA VAL 48 -3.841 -2.960 -28.996 379 HB VAL 48 HB VAL 48 -2.159 -5.188 -30.074 380 HG11 VAL 48 1HG1 VAL 48 -4.352 -6.532 -30.186 381 HG12 VAL 48 2HG1 VAL 48 -3.491 -6.479 -28.629 382 HG13 VAL 48 3HG1 VAL 48 -4.925 -5.457 -28.889 383 HG21 VAL 48 3HG2 VAL 48 -3.647 -5.019 -31.976 384 HG22 VAL 48 1HG2 VAL 48 -4.708 -3.893 -31.096 385 HG23 VAL 48 2HG2 VAL 48 -3.061 -3.393 -31.550 386 H VAL 49 HN VAL 49 -4.144 -2.553 -26.811 387 HA VAL 49 HA VAL 49 -2.902 -4.401 -24.931 388 HB VAL 49 HB VAL 49 -4.475 -1.848 -24.536 389 HG11 VAL 49 1HG1 VAL 49 -3.136 -3.735 -22.594 390 HG12 VAL 49 2HG1 VAL 49 -3.388 -2.016 -22.204 391 HG13 VAL 49 3HG1 VAL 49 -4.784 -3.064 -22.550 392 HG21 VAL 49 3HG2 VAL 49 -2.010 -1.233 -23.680 393 HG22 VAL 49 1HG2 VAL 49 -1.578 -2.449 -24.906 394 HG23 VAL 49 2HG2 VAL 49 -2.522 -1.014 -25.371 395 HA PRO 50 HA PRO 50 -6.709 -6.563 -24.941 396 HB2 PRO 50 2HB PRO 50 -5.871 -8.712 -23.474 397 HB3 PRO 50 3HB PRO 50 -5.674 -8.602 -25.212 398 HG2 PRO 50 2HG PRO 50 -3.640 -8.276 -23.091 399 HG3 PRO 50 3HG PRO 50 -3.404 -8.592 -24.799 400 HD2 PRO 50 2HD PRO 50 -3.053 -6.083 -23.452 401 HD3 PRO 50 3HD PRO 50 -2.931 -6.374 -25.176 402 H MET 51 HN MET 51 -8.408 -7.265 -23.470 403 HA MET 51 HA MET 51 -8.643 -5.401 -21.436 404 HB2 MET 51 2HB MET 51 -10.577 -6.504 -22.537 405 HB3 MET 51 3HB MET 51 -10.061 -8.073 -21.950 406 HG2 MET 51 2HG MET 51 -10.424 -7.334 -19.597 407 HG3 MET 51 3HG MET 51 -10.884 -5.737 -20.155 408 HE1 MET 51 3HE MET 51 -12.386 -9.334 -21.966 409 HE2 MET 51 1HE MET 51 -11.268 -9.352 -20.580 410 HE3 MET 51 2HE MET 51 -13.000 -9.677 -20.331 411 H GLY 52 HN GLY 52 -7.704 -5.320 -19.444 412 HA2 GLY 52 1HA GLY 52 -7.426 -6.367 -17.316 413 HA3 GLY 52 2HA GLY 52 -7.075 -7.884 -18.121 414 H THR 53 HN THR 53 -5.517 -5.988 -20.193 415 HA THR 53 HA THR 53 -2.974 -6.411 -18.926 416 HB THR 53 HB THR 53 -3.927 -5.292 -21.607 417 HG1 THR 53 HG1 THR 53 -3.976 -7.664 -20.848 418 HG21 THR 53 3HG2 THR 53 -1.103 -5.746 -20.521 419 HG22 THR 53 1HG2 THR 53 -1.474 -5.698 -22.261 420 HG23 THR 53 2HG2 THR 53 -1.749 -4.258 -21.253 421 H THR 54 HN THR 54 -2.033 -5.094 -17.511 422 HA THR 54 HA THR 54 -3.030 -2.653 -16.743 423 HB THR 54 HB THR 54 -0.076 -3.415 -16.677 424 HG1 THR 54 HG1 THR 54 -0.717 -5.028 -15.220 425 HG21 THR 54 3HG2 THR 54 -0.603 -1.339 -15.478 426 HG22 THR 54 1HG2 THR 54 -2.030 -2.090 -14.726 427 HG23 THR 54 2HG2 THR 54 -0.396 -2.629 -14.270 428 H LEU 55 HN LEU 55 -2.797 -0.525 -17.296 429 HA LEU 55 HA LEU 55 -1.790 -0.095 -19.970 430 HB2 LEU 55 2HB LEU 55 -3.993 0.764 -18.964 431 HB3 LEU 55 3HB LEU 55 -3.009 1.956 -18.138 432 HG LEU 55 HG LEU 55 -2.374 3.015 -20.138 433 HD11 LEU 55 1HD1 LEU 55 -3.167 1.944 -22.394 434 HD12 LEU 55 2HD1 LEU 55 -1.656 1.409 -21.619 435 HD13 LEU 55 3HD1 LEU 55 -3.135 0.432 -21.455 436 HD21 LEU 55 3HD2 LEU 55 -5.241 2.271 -19.922 437 HD22 LEU 55 1HD2 LEU 55 -4.455 3.867 -19.882 438 HD23 LEU 55 2HD2 LEU 55 -4.720 3.044 -21.438 439 H MET 56 HN MET 56 0.133 0.839 -20.497 440 HA MET 56 HA MET 56 1.718 1.744 -18.225 441 HB2 MET 56 2HB MET 56 2.401 0.527 -20.943 442 HB3 MET 56 3HB MET 56 3.627 1.365 -20.013 443 HG2 MET 56 2HG MET 56 2.015 -0.695 -18.534 444 HG3 MET 56 3HG MET 56 3.128 -1.301 -19.744 445 HE1 MET 56 3HE MET 56 3.309 -1.567 -16.275 446 HE2 MET 56 1HE MET 56 4.067 -0.106 -15.596 447 HE3 MET 56 2HE MET 56 2.489 0.007 -16.413 448 HA PRO 57 HA PRO 57 2.024 5.701 -19.979 449 HB2 PRO 57 2HB PRO 57 4.528 6.530 -19.263 450 HB3 PRO 57 3HB PRO 57 3.165 6.537 -18.162 451 HG2 PRO 57 2HG PRO 57 5.455 4.671 -18.263 452 HG3 PRO 57 3HG PRO 57 4.333 4.961 -16.949 453 HD2 PRO 57 2HD PRO 57 4.341 2.717 -18.736 454 HD3 PRO 57 3HD PRO 57 3.152 3.066 -17.498 455 H ASP 58 HN ASP 58 4.404 3.400 -20.919 456 HA ASP 58 HA ASP 58 5.116 5.063 -23.164 457 HB2 ASP 58 2HB ASP 58 6.345 2.906 -21.660 458 HB3 ASP 58 3HB ASP 58 6.273 2.438 -23.347 459 HD2 ASP 58 HD2 ASP 58 9.345 4.123 -22.480 460 H MET 59 HN MET 59 2.478 3.345 -22.476 461 HA MET 59 HA MET 59 2.436 1.945 -25.038 462 HB2 MET 59 2HB MET 59 1.228 1.380 -22.312 463 HB3 MET 59 3HB MET 59 0.357 0.814 -23.724 464 HG2 MET 59 2HG MET 59 2.748 -0.138 -24.445 465 HG3 MET 59 3HG MET 59 3.097 -0.008 -22.733 466 HE1 MET 59 3HE MET 59 0.971 -0.864 -20.940 467 HE2 MET 59 1HE MET 59 -0.216 -0.215 -22.098 468 HE3 MET 59 2HE MET 59 -0.341 -1.903 -21.546 469 H VAL 60 HN VAL 60 1.746 4.864 -24.057 470 HA VAL 60 HA VAL 60 -0.837 4.918 -25.436 471 HB VAL 60 HB VAL 60 -0.127 6.451 -22.926 472 HG11 VAL 60 1HG1 VAL 60 -2.286 7.436 -23.023 473 HG12 VAL 60 2HG1 VAL 60 -1.591 7.617 -24.652 474 HG13 VAL 60 3HG1 VAL 60 -2.806 6.354 -24.337 475 HG21 VAL 60 3HG2 VAL 60 -2.302 4.369 -23.214 476 HG22 VAL 60 1HG2 VAL 60 -0.650 3.952 -22.701 477 HG23 VAL 60 2HG2 VAL 60 -1.627 5.078 -21.728 478 H LYS 61 HN LYS 61 -1.078 6.620 -26.893 479 HA LYS 61 HA LYS 61 1.386 8.022 -27.482 480 HB2 LYS 61 2HB LYS 61 -1.249 7.834 -28.972 481 HB3 LYS 61 3HB LYS 61 0.166 8.694 -29.545 482 HG2 LYS 61 2HG LYS 61 1.452 6.451 -29.216 483 HG3 LYS 61 3HG LYS 61 -0.125 5.703 -29.061 484 HD2 LYS 61 2HD LYS 61 -0.643 7.023 -31.323 485 HD3 LYS 61 3HD LYS 61 1.103 7.053 -31.475 486 HE2 LYS 61 2HE LYS 61 1.018 4.488 -31.024 487 HE3 LYS 61 3HE LYS 61 -0.708 4.610 -31.302 488 HZ1 LYS 61 2HZ LYS 61 1.007 5.847 -33.315 489 HZ3 LYS 61 1HZ LYS 61 -0.384 5.025 -33.518 490 H GLY 62 HN GLY 62 1.524 10.342 -27.690 491 HA2 GLY 62 1HA GLY 62 1.230 12.425 -26.901 492 HA3 GLY 62 2HA GLY 62 -0.483 12.157 -27.155 493 H TYR 63 HN TYR 63 1.120 9.924 -24.976 494 HA TYR 63 HA TYR 63 -0.446 10.967 -22.788 495 HB2 TYR 63 2HB TYR 63 -0.305 8.545 -23.119 496 HB3 TYR 63 3HB TYR 63 1.424 8.614 -23.398 497 HD1 TYR 63 HD2 TYR 63 2.996 8.869 -21.496 498 HD2 TYR 63 HD1 TYR 63 -1.216 8.448 -20.877 499 HE1 TYR 63 HE2 TYR 63 3.405 8.304 -19.052 500 HE2 TYR 63 HE1 TYR 63 -0.793 7.883 -18.434 501 HH TYR 63 HH TYR 63 1.677 8.610 -16.821 502 H ALA 64 HN ALA 64 0.745 10.887 -20.523 503 HA ALA 64 HA ALA 64 3.412 11.348 -20.222 504 HB1 ALA 64 1HB ALA 64 2.118 13.559 -21.575 505 HB2 ALA 64 2HB ALA 64 2.714 14.085 -19.983 506 HB3 ALA 64 3HB ALA 64 3.834 13.348 -21.153 507 HA PRO 65 HA PRO 65 1.843 11.475 -16.193 508 HB2 PRO 65 2HB PRO 65 4.069 12.182 -14.774 509 HB3 PRO 65 3HB PRO 65 3.769 10.549 -15.335 510 HG2 PRO 65 2HG PRO 65 5.659 12.557 -16.400 511 HG3 PRO 65 3HG PRO 65 5.640 10.823 -16.655 512 HD2 PRO 65 2HD PRO 65 4.777 12.839 -18.504 513 HD3 PRO 65 3HD PRO 65 4.651 11.104 -18.712 514 H ALA 66 HN ALA 66 1.478 12.790 -14.183 515 HA ALA 66 HA ALA 66 1.731 15.631 -14.807 516 HB1 ALA 66 1HB ALA 66 -0.574 16.072 -14.501 517 HB2 ALA 66 2HB ALA 66 -0.538 14.634 -15.550 518 HB3 ALA 66 3HB ALA 66 -0.881 14.460 -13.812 Start of MODEL 2 1 H1 MET 0 HN MET 0 4.253 0.233 -1.221 2 HA MET 0 HA MET 0 1.957 -0.526 -0.376 3 HB2 MET 0 2HB MET 0 2.773 1.872 -0.613 4 HB3 MET 0 3HB MET 0 2.243 1.863 -2.284 5 HG2 MET 0 2HG MET 0 0.550 2.924 -0.787 6 HG3 MET 0 3HG MET 0 -0.100 1.510 -1.592 7 HE1 MET 0 3HE MET 0 0.817 2.415 2.643 8 HE2 MET 0 1HE MET 0 0.607 3.417 1.187 9 HE3 MET 0 2HE MET 0 -0.818 2.777 2.040 10 H ASN 1 HN ASN 1 -0.363 -0.458 -1.207 11 HA ASN 1 HA ASN 1 -0.414 -1.933 -3.684 12 HB2 ASN 1 2HB ASN 1 -2.714 -1.345 -1.751 13 HB3 ASN 1 3HB ASN 1 -2.702 -2.562 -3.011 14 HD21 ASN 1 1HD2 ASN 1 -3.325 -3.351 -0.553 15 HD22 ASN 1 2HD2 ASN 1 -2.065 -4.280 0.187 16 H GLN 2 HN GLN 2 -0.164 -0.156 -5.218 17 HA GLN 2 HA GLN 2 -2.216 1.892 -5.057 18 HB2 GLN 2 2HB GLN 2 -0.800 3.291 -6.316 19 HB3 GLN 2 3HB GLN 2 0.324 2.404 -5.306 20 HG2 GLN 2 2HG GLN 2 1.307 2.236 -7.447 21 HG3 GLN 2 3HG GLN 2 0.474 0.703 -7.284 22 HE21 GLN 2 1HE2 GLN 2 -0.526 4.032 -8.078 23 HE22 GLN 2 2HE2 GLN 2 -1.343 3.667 -9.561 24 H GLU 3 HN GLU 3 -3.831 2.086 -6.607 25 HA GLU 3 HA GLU 3 -4.265 -0.160 -8.234 26 HB2 GLU 3 2HB GLU 3 -5.662 2.425 -7.655 27 HB3 GLU 3 3HB GLU 3 -6.080 1.643 -9.166 28 HG2 GLU 3 2HG GLU 3 -6.568 -0.481 -7.927 29 HG3 GLU 3 3HG GLU 3 -6.163 0.311 -6.417 30 HE2 GLU 3 HE2 GLU 3 -9.214 -0.397 -7.021 31 H SER 4 HN SER 4 -3.997 -0.458 -10.465 32 HA SER 4 HA SER 4 -2.700 1.777 -11.821 33 HB2 SER 4 2HB SER 4 -2.096 -0.921 -12.878 34 HB3 SER 4 3HB SER 4 -1.018 0.428 -12.578 35 HG SER 4 HG SER 4 -0.410 -0.528 -10.772 36 H VAL 5 HN VAL 5 -3.328 2.152 -14.019 37 HA VAL 5 HA VAL 5 -5.949 1.541 -14.658 38 HB VAL 5 HB VAL 5 -3.610 2.399 -16.370 39 HG11 VAL 5 1HG1 VAL 5 -5.442 1.358 -17.711 40 HG12 VAL 5 2HG1 VAL 5 -6.564 2.571 -17.049 41 HG13 VAL 5 3HG1 VAL 5 -5.193 3.085 -18.061 42 HG21 VAL 5 3HG2 VAL 5 -3.904 4.442 -15.523 43 HG22 VAL 5 1HG2 VAL 5 -5.646 4.398 -15.889 44 HG23 VAL 5 2HG2 VAL 5 -5.042 3.741 -14.348 45 H VAL 6 HN VAL 6 -6.964 -0.109 -15.752 46 HA VAL 6 HA VAL 6 -5.248 -2.101 -17.028 47 HB VAL 6 HB VAL 6 -7.302 -2.588 -14.871 48 HG11 VAL 6 1HG1 VAL 6 -7.551 -4.116 -16.896 49 HG12 VAL 6 2HG1 VAL 6 -5.935 -4.746 -16.497 50 HG13 VAL 6 3HG1 VAL 6 -7.269 -4.915 -15.331 51 HG21 VAL 6 3HG2 VAL 6 -4.332 -2.908 -15.120 52 HG22 VAL 6 1HG2 VAL 6 -5.309 -2.319 -13.754 53 HG23 VAL 6 2HG2 VAL 6 -5.236 -4.061 -14.110 54 H ALA 7 HN ALA 7 -5.999 -2.644 -19.021 55 HA ALA 7 HA ALA 7 -8.105 -1.309 -20.181 56 HB1 ALA 7 1HB ALA 7 -6.642 -2.215 -21.716 57 HB2 ALA 7 2HB ALA 7 -6.454 -3.732 -20.804 58 HB3 ALA 7 3HB ALA 7 -7.919 -3.454 -21.775 59 H ALA 8 HN ALA 8 -10.094 -1.310 -19.156 60 HA ALA 8 HA ALA 8 -11.192 -3.567 -17.913 61 HB1 ALA 8 1HB ALA 8 -12.812 -2.092 -17.316 62 HB2 ALA 8 2HB ALA 8 -11.725 -0.874 -18.025 63 HB3 ALA 8 3HB ALA 8 -13.063 -1.541 -18.990 64 H VAL 9 HN VAL 9 -10.692 -2.810 -21.228 65 HA VAL 9 HA VAL 9 -12.231 -5.121 -21.984 66 HB VAL 9 HB VAL 9 -13.550 -3.967 -23.663 67 HG11 VAL 9 1HG1 VAL 9 -13.972 -2.685 -20.943 68 HG12 VAL 9 2HG1 VAL 9 -15.194 -2.946 -22.211 69 HG13 VAL 9 3HG1 VAL 9 -14.468 -4.339 -21.374 70 HG21 VAL 9 3HG2 VAL 9 -13.699 -1.538 -23.776 71 HG22 VAL 9 1HG2 VAL 9 -12.494 -1.379 -22.475 72 HG23 VAL 9 2HG2 VAL 9 -12.019 -2.061 -24.050 73 H LEU 10 HN LEU 10 -11.939 -5.409 -24.516 74 HA LEU 10 HA LEU 10 -9.172 -5.483 -24.953 75 HB2 LEU 10 2HB LEU 10 -10.475 -7.153 -25.933 76 HB3 LEU 10 3HB LEU 10 -11.604 -6.008 -26.631 77 HG LEU 10 HG LEU 10 -9.396 -5.238 -27.951 78 HD11 LEU 10 1HD1 LEU 10 -8.506 -7.758 -28.562 79 HD12 LEU 10 2HD1 LEU 10 -7.677 -6.596 -27.498 80 HD13 LEU 10 3HD1 LEU 10 -8.724 -7.853 -26.798 81 HD21 LEU 10 3HD2 LEU 10 -10.377 -7.537 -29.350 82 HD22 LEU 10 1HD2 LEU 10 -11.732 -6.742 -28.513 83 HD23 LEU 10 2HD2 LEU 10 -10.713 -5.813 -29.638 84 H ILE 11 HN ILE 11 -7.969 -3.651 -25.103 85 HA ILE 11 HA ILE 11 -9.094 -1.451 -26.670 86 HB ILE 11 HB ILE 11 -6.603 -1.217 -25.044 87 HG12 ILE 11 2HG1 ILE 11 -9.370 -1.634 -23.954 88 HG13 ILE 11 3HG1 ILE 11 -7.842 -2.276 -23.386 89 HG21 ILE 11 1HG2 ILE 11 -7.687 0.582 -26.565 90 HG22 ILE 11 2HG2 ILE 11 -8.864 0.755 -25.242 91 HG23 ILE 11 3HG2 ILE 11 -7.134 1.037 -24.936 92 HD11 ILE 11 3HD1 ILE 11 -8.644 0.668 -23.250 93 HD12 ILE 11 1HD1 ILE 11 -8.718 -0.479 -21.891 94 HD13 ILE 11 2HD1 ILE 11 -7.146 -0.040 -22.601 95 HA PRO 12 HA PRO 12 -6.318 -2.912 -29.747 96 HB2 PRO 12 2HB PRO 12 -7.443 -1.566 -31.843 97 HB3 PRO 12 3HB PRO 12 -7.978 -3.153 -31.325 98 HG2 PRO 12 2HG PRO 12 -9.278 -0.531 -30.908 99 HG3 PRO 12 3HG PRO 12 -9.975 -2.134 -30.785 100 HD2 PRO 12 2HD PRO 12 -9.207 -0.426 -28.613 101 HD3 PRO 12 3HD PRO 12 -9.795 -2.072 -28.494 102 H ILE 13 HN ILE 13 -4.909 -1.870 -31.520 103 HA ILE 13 HA ILE 13 -3.456 0.141 -30.170 104 HB ILE 13 HB ILE 13 -2.335 -1.466 -31.528 105 HG12 ILE 13 2HG1 ILE 13 -2.194 1.299 -32.764 106 HG13 ILE 13 3HG1 ILE 13 -1.301 0.740 -31.364 107 HG21 ILE 13 1HG2 ILE 13 -3.039 -0.610 -34.185 108 HG22 ILE 13 2HG2 ILE 13 -3.114 -2.233 -33.457 109 HG23 ILE 13 3HG2 ILE 13 -4.497 -1.123 -33.302 110 HD11 ILE 13 3HD1 ILE 13 0.175 -0.514 -32.622 111 HD12 ILE 13 1HD1 ILE 13 -1.058 -0.940 -33.834 112 HD13 ILE 13 2HD1 ILE 13 -0.285 0.663 -33.876 113 H ASN 14 HN ASN 14 -2.995 2.337 -30.982 114 HA ASN 14 HA ASN 14 -3.820 4.336 -31.326 115 HB2 ASN 14 2HB ASN 14 -4.669 4.671 -33.750 116 HB3 ASN 14 3HB ASN 14 -3.075 3.960 -33.585 117 HD21 ASN 14 1HD2 ASN 14 -2.658 2.079 -34.496 118 HD22 ASN 14 2HD2 ASN 14 -3.810 0.992 -35.198 119 H THR 15 HN THR 15 -5.632 3.099 -29.691 120 HA THR 15 HA THR 15 -8.244 3.748 -30.891 121 HB THR 15 HB THR 15 -7.454 1.547 -28.912 122 HG1 THR 15 HG1 THR 15 -7.065 1.008 -31.123 123 HG21 THR 15 3HG2 THR 15 -10.088 2.765 -29.643 124 HG22 THR 15 1HG2 THR 15 -10.010 0.991 -29.772 125 HG23 THR 15 2HG2 THR 15 -9.652 1.787 -28.221 126 H ALA 16 HN ALA 16 -9.201 5.479 -30.045 127 HA ALA 16 HA ALA 16 -8.131 6.967 -28.005 128 HB1 ALA 16 1HB ALA 16 -9.655 8.143 -29.263 129 HB2 ALA 16 2HB ALA 16 -10.774 6.765 -29.396 130 HB3 ALA 16 3HB ALA 16 -10.709 7.717 -27.893 131 H LEU 17 HN LEU 17 -8.164 6.899 -25.792 132 HA LEU 17 HA LEU 17 -9.437 4.577 -24.614 133 HB2 LEU 17 2HB LEU 17 -7.519 6.641 -23.527 134 HB3 LEU 17 3HB LEU 17 -8.174 5.313 -22.589 135 HG LEU 17 HG LEU 17 -6.540 4.945 -25.113 136 HD11 LEU 17 1HD1 LEU 17 -4.613 4.544 -23.783 137 HD12 LEU 17 2HD1 LEU 17 -5.299 6.096 -23.247 138 HD13 LEU 17 3HD1 LEU 17 -5.551 4.628 -22.272 139 HD21 LEU 17 3HD2 LEU 17 -6.232 2.635 -23.903 140 HD22 LEU 17 1HD2 LEU 17 -7.761 3.082 -23.110 141 HD23 LEU 17 2HD2 LEU 17 -7.680 2.964 -24.884 142 H THR 18 HN THR 18 -11.126 4.628 -23.132 143 HA THR 18 HA THR 18 -12.279 7.292 -22.633 144 HB THR 18 HB THR 18 -14.522 6.090 -22.889 145 HG1 THR 18 HG1 THR 18 -13.931 3.909 -22.725 146 HG21 THR 18 3HG2 THR 18 -12.540 6.273 -25.189 147 HG22 THR 18 1HG2 THR 18 -14.159 5.584 -25.459 148 HG23 THR 18 2HG2 THR 18 -13.990 7.262 -24.891 149 H VAL 19 HN VAL 19 -14.034 7.074 -20.801 150 HA VAL 19 HA VAL 19 -12.571 6.043 -18.558 151 HB VAL 19 HB VAL 19 -14.018 8.223 -18.876 152 HG11 VAL 19 1HG1 VAL 19 -16.263 7.962 -17.822 153 HG12 VAL 19 2HG1 VAL 19 -16.125 7.157 -19.403 154 HG13 VAL 19 3HG1 VAL 19 -16.060 6.196 -17.907 155 HG21 VAL 19 3HG2 VAL 19 -14.048 6.618 -16.296 156 HG22 VAL 19 1HG2 VAL 19 -12.696 7.617 -16.881 157 HG23 VAL 19 2HG2 VAL 19 -14.244 8.381 -16.448 158 H GLY 20 HN GLY 20 -14.834 4.804 -20.820 159 HA2 GLY 20 1HA GLY 20 -15.868 2.831 -18.890 160 HA3 GLY 20 2HA GLY 20 -16.563 3.228 -20.449 161 H MET 21 HN MET 21 -13.119 3.142 -20.591 162 HA MET 21 HA MET 21 -13.284 0.429 -21.657 163 HB2 MET 21 2HB MET 21 -12.007 2.974 -22.596 164 HB3 MET 21 3HB MET 21 -10.996 1.553 -22.769 165 HG2 MET 21 2HG MET 21 -13.418 0.598 -23.716 166 HG3 MET 21 3HG MET 21 -13.501 2.277 -24.211 167 HE1 MET 21 3HE MET 21 -9.822 2.260 -24.307 168 HE2 MET 21 1HE MET 21 -10.040 2.685 -26.022 169 HE3 MET 21 2HE MET 21 -11.105 3.396 -24.786 170 H MET 22 HN MET 22 -11.553 2.728 -19.568 171 HA MET 22 HA MET 22 -9.557 0.702 -19.008 172 HB2 MET 22 2HB MET 22 -9.857 3.648 -18.207 173 HB3 MET 22 3HB MET 22 -8.533 2.642 -17.655 174 HG2 MET 22 2HG MET 22 -7.712 2.322 -19.923 175 HG3 MET 22 3HG MET 22 -9.161 3.020 -20.617 176 HE1 MET 22 3HE MET 22 -9.927 5.586 -19.389 177 HE2 MET 22 1HE MET 22 -8.840 6.752 -20.181 178 HE3 MET 22 2HE MET 22 -9.519 5.394 -21.111 179 H THR 23 HN THR 23 -8.855 0.845 -16.469 180 HA THR 23 HA THR 23 -10.984 1.243 -14.635 181 HB THR 23 HB THR 23 -11.405 -1.023 -16.050 182 HG1 THR 23 HG1 THR 23 -12.458 -0.001 -14.054 183 HG21 THR 23 3HG2 THR 23 -9.241 -2.103 -15.445 184 HG22 THR 23 1HG2 THR 23 -9.586 -1.833 -13.720 185 HG23 THR 23 2HG2 THR 23 -10.597 -2.952 -14.665 186 H THR 24 HN THR 24 -10.341 0.313 -12.401 187 HA THR 24 HA THR 24 -7.415 0.590 -12.186 188 HB THR 24 HB THR 24 -7.880 1.684 -10.020 189 HG1 THR 24 HG1 THR 24 -9.777 0.584 -9.370 190 HG21 THR 24 3HG2 THR 24 -8.131 3.160 -12.064 191 HG22 THR 24 1HG2 THR 24 -9.859 2.736 -12.109 192 HG23 THR 24 2HG2 THR 24 -9.202 3.647 -10.728 193 H ARG 25 HN ARG 25 -6.264 -1.038 -11.335 194 HA ARG 25 HA ARG 25 -7.541 -2.804 -9.505 195 HB2 ARG 25 2HB ARG 25 -7.479 -3.501 -12.286 196 HB3 ARG 25 3HB ARG 25 -6.269 -4.501 -11.507 197 HG2 ARG 25 2HG ARG 25 -7.918 -5.848 -10.733 198 HG3 ARG 25 3HG ARG 25 -8.514 -4.524 -9.753 199 HD2 ARG 25 2HD ARG 25 -10.292 -4.145 -11.144 200 HD3 ARG 25 3HD ARG 25 -9.301 -4.244 -12.586 201 HE ARG 25 HE ARG 25 -9.406 -6.869 -11.846 202 HH11 ARG 25 2HH2 ARG 25 -11.966 -4.438 -12.149 203 HH12 ARG 25 1HH2 ARG 25 -13.191 -5.596 -12.546 204 HH22 ARG 25 HH1 ARG 25 -12.613 -7.919 -12.669 205 H VAL 26 HN VAL 26 -5.975 -3.944 -8.213 206 HA VAL 26 HA VAL 26 -3.349 -2.813 -8.333 207 HB VAL 26 HB VAL 26 -4.439 -4.995 -6.549 208 HG11 VAL 26 1HG1 VAL 26 -2.396 -3.017 -5.645 209 HG12 VAL 26 2HG1 VAL 26 -2.598 -4.735 -5.224 210 HG13 VAL 26 3HG1 VAL 26 -1.867 -4.280 -6.782 211 HG21 VAL 26 3HG2 VAL 26 -4.898 -3.138 -4.930 212 HG22 VAL 26 1HG2 VAL 26 -4.581 -1.979 -6.244 213 HG23 VAL 26 2HG2 VAL 26 -5.941 -3.121 -6.373 214 H VAL 27 HN VAL 27 -2.635 -3.558 -10.443 215 HA VAL 27 HA VAL 27 -2.126 -6.447 -10.524 216 HB VAL 27 HB VAL 27 -2.087 -6.285 -12.868 217 HG11 VAL 27 1HG1 VAL 27 -4.286 -4.328 -12.198 218 HG12 VAL 27 2HG1 VAL 27 -4.287 -5.660 -13.378 219 HG13 VAL 27 3HG1 VAL 27 -4.343 -6.015 -11.635 220 HG21 VAL 27 3HG2 VAL 27 -2.510 -3.839 -13.854 221 HG22 VAL 27 1HG2 VAL 27 -1.634 -3.373 -12.376 222 HG23 VAL 27 2HG2 VAL 27 -0.874 -4.471 -13.553 223 H SER 28 HN SER 28 0.014 -7.123 -11.404 224 HA SER 28 HA SER 28 2.027 -5.085 -10.870 225 HB2 SER 28 2HB SER 28 1.719 -6.861 -9.018 226 HB3 SER 28 3HB SER 28 2.362 -8.025 -10.159 227 HG SER 28 HG SER 28 4.297 -6.663 -10.331 228 HA PRO 29 HA PRO 29 3.907 -4.824 -11.132 229 HB2 PRO 29 2HB PRO 29 5.343 -3.214 -12.810 230 HB3 PRO 29 3HB PRO 29 6.024 -4.619 -12.014 231 HG2 PRO 29 2HG PRO 29 5.226 -4.298 -14.842 232 HG3 PRO 29 3HG PRO 29 6.277 -5.505 -14.128 233 HD2 PRO 29 2HD PRO 29 3.554 -5.872 -14.951 234 HD3 PRO 29 3HD PRO 29 4.568 -7.043 -14.133 235 H THR 30 HN THR 30 3.423 -2.677 -10.466 236 HA THR 30 HA THR 30 0.911 -1.861 -11.453 237 HB THR 30 HB THR 30 1.538 0.183 -9.949 238 HG1 THR 30 HG1 THR 30 3.539 -0.290 -8.757 239 HG21 THR 30 3HG2 THR 30 1.604 -1.221 -7.836 240 HG22 THR 30 1HG2 THR 30 0.285 -1.687 -8.937 241 HG23 THR 30 2HG2 THR 30 1.766 -2.671 -8.856 242 H GLY 31 HN GLY 31 0.393 -0.845 -13.276 243 HA2 GLY 31 1HA GLY 31 2.520 0.551 -14.729 244 HA3 GLY 31 2HA GLY 31 0.972 0.022 -15.359 245 H ILE 32 HN ILE 32 0.421 2.089 -16.226 246 HA ILE 32 HA ILE 32 0.647 4.514 -15.090 247 HB ILE 32 HB ILE 32 -1.633 3.387 -16.713 248 HG12 ILE 32 2HG1 ILE 32 0.838 4.958 -17.501 249 HG13 ILE 32 3HG1 ILE 32 0.572 3.248 -17.779 250 HG21 ILE 32 1HG2 ILE 32 -2.060 5.557 -15.331 251 HG22 ILE 32 2HG2 ILE 32 -1.010 6.319 -16.550 252 HG23 ILE 32 3HG2 ILE 32 -2.506 5.497 -17.053 253 HD11 ILE 32 3HD1 ILE 32 -0.002 5.084 -19.652 254 HD12 ILE 32 1HD1 ILE 32 -0.982 3.610 -19.468 255 HD13 ILE 32 2HD1 ILE 32 -1.544 5.146 -18.765 256 HA PRO 33 HA PRO 33 -1.773 4.467 -11.509 257 HB2 PRO 33 2HB PRO 33 -1.942 7.149 -11.016 258 HB3 PRO 33 3HB PRO 33 -0.547 6.181 -10.583 259 HG2 PRO 33 2HG PRO 33 -0.849 8.105 -12.806 260 HG3 PRO 33 3HG PRO 33 0.622 7.462 -12.104 261 HD2 PRO 33 2HD PRO 33 -0.579 6.680 -14.589 262 HD3 PRO 33 3HD PRO 33 0.826 5.958 -13.831 263 H ALA 34 HN ALA 34 -3.863 4.636 -10.656 264 HA ALA 34 HA ALA 34 -5.823 4.723 -12.660 265 HB1 ALA 34 1HB ALA 34 -6.044 3.408 -10.605 266 HB2 ALA 34 2HB ALA 34 -6.018 4.894 -9.625 267 HB3 ALA 34 3HB ALA 34 -7.382 4.577 -10.724 268 H GLU 35 HN GLU 35 -4.079 7.216 -11.070 269 HA GLU 35 HA GLU 35 -6.220 9.095 -11.092 270 HB2 GLU 35 2HB GLU 35 -4.665 10.623 -10.148 271 HB3 GLU 35 3HB GLU 35 -4.210 9.066 -9.484 272 HG2 GLU 35 2HG GLU 35 -2.615 8.953 -11.619 273 HG3 GLU 35 3HG GLU 35 -2.818 10.693 -11.622 274 HE2 GLU 35 HE2 GLU 35 -2.708 10.172 -8.236 275 H ASP 36 HN ASP 36 -4.202 7.707 -13.455 276 HA ASP 36 HA ASP 36 -4.142 10.122 -15.043 277 HB2 ASP 36 2HB ASP 36 -2.249 8.237 -14.738 278 HB3 ASP 36 3HB ASP 36 -3.143 7.444 -16.020 279 HD2 ASP 36 HD2 ASP 36 -0.478 9.198 -15.794 280 H ILE 37 HN ILE 37 -6.220 7.563 -14.341 281 HA ILE 37 HA ILE 37 -7.031 6.540 -16.758 282 HB ILE 37 HB ILE 37 -8.163 6.867 -14.060 283 HG12 ILE 37 2HG1 ILE 37 -7.747 4.642 -16.050 284 HG13 ILE 37 3HG1 ILE 37 -7.015 4.860 -14.472 285 HG21 ILE 37 1HG2 ILE 37 -10.034 7.745 -15.338 286 HG22 ILE 37 2HG2 ILE 37 -9.974 6.343 -16.433 287 HG23 ILE 37 3HG2 ILE 37 -10.411 6.118 -14.722 288 HD11 ILE 37 3HD1 ILE 37 -9.294 4.558 -13.419 289 HD12 ILE 37 1HD1 ILE 37 -9.939 4.193 -15.037 290 HD13 ILE 37 2HD1 ILE 37 -8.720 3.124 -14.303 291 HA PRO 38 HA PRO 38 -9.816 10.340 -17.179 292 HB2 PRO 38 2HB PRO 38 -9.418 12.507 -15.562 293 HB3 PRO 38 3HB PRO 38 -10.624 11.278 -15.238 294 HG2 PRO 38 2HG PRO 38 -8.017 11.711 -13.914 295 HG3 PRO 38 3HG PRO 38 -9.396 10.789 -13.348 296 HD2 PRO 38 2HD PRO 38 -6.972 9.739 -14.465 297 HD3 PRO 38 3HD PRO 38 -8.396 8.827 -14.007 298 H ARG 39 HN ARG 39 -6.510 10.299 -16.887 299 HA ARG 39 HA ARG 39 -6.260 12.696 -18.479 300 HB2 ARG 39 2HB ARG 39 -4.162 10.872 -17.201 301 HB3 ARG 39 3HB ARG 39 -3.768 12.299 -18.138 302 HG2 ARG 39 2HG ARG 39 -4.944 13.749 -16.543 303 HG3 ARG 39 3HG ARG 39 -5.562 12.362 -15.668 304 HD2 ARG 39 2HD ARG 39 -3.717 12.927 -14.340 305 HD3 ARG 39 3HD ARG 39 -3.000 11.723 -15.392 306 HE ARG 39 HE ARG 39 -2.487 14.621 -15.436 307 HH11 ARG 39 2HH2 ARG 39 -2.187 11.568 -17.210 308 HH12 ARG 39 1HH2 ARG 39 -0.908 12.142 -18.227 309 HH22 ARG 39 HH1 ARG 39 -0.109 14.385 -17.957 310 H LEU 40 HN LEU 40 -6.293 9.198 -18.686 311 HA LEU 40 HA LEU 40 -4.802 9.084 -21.140 312 HB2 LEU 40 2HB LEU 40 -6.402 7.027 -19.614 313 HB3 LEU 40 3HB LEU 40 -5.503 6.691 -21.080 314 HG LEU 40 HG LEU 40 -4.162 7.845 -18.633 315 HD11 LEU 40 1HD1 LEU 40 -4.521 5.960 -17.516 316 HD12 LEU 40 2HD1 LEU 40 -5.309 5.204 -18.922 317 HD13 LEU 40 3HD1 LEU 40 -3.541 5.116 -18.739 318 HD21 LEU 40 3HD2 LEU 40 -2.974 6.119 -20.808 319 HD22 LEU 40 1HD2 LEU 40 -3.063 7.893 -20.926 320 HD23 LEU 40 2HD2 LEU 40 -2.138 7.134 -19.608 321 H ILE 41 HN ILE 41 -8.085 9.696 -20.113 322 HA ILE 41 HA ILE 41 -9.486 8.734 -22.299 323 HB ILE 41 HB ILE 41 -10.055 11.187 -20.632 324 HG12 ILE 41 2HG1 ILE 41 -10.339 8.257 -20.084 325 HG13 ILE 41 3HG1 ILE 41 -9.837 9.554 -19.017 326 HG21 ILE 41 1HG2 ILE 41 -11.992 9.396 -22.117 327 HG22 ILE 41 2HG2 ILE 41 -12.350 10.906 -21.245 328 HG23 ILE 41 3HG2 ILE 41 -11.382 10.948 -22.739 329 HD11 ILE 41 3HD1 ILE 41 -12.154 10.434 -18.945 330 HD12 ILE 41 1HD1 ILE 41 -12.676 9.157 -20.070 331 HD13 ILE 41 2HD1 ILE 41 -12.110 8.728 -18.438 332 H SER 42 HN SER 42 -9.870 9.453 -24.372 333 HA SER 42 HA SER 42 -9.870 10.828 -26.097 334 HB2 SER 42 2HB SER 42 -9.739 12.739 -24.248 335 HB3 SER 42 3HB SER 42 -8.077 12.876 -24.785 336 HG SER 42 HG SER 42 -8.929 14.157 -26.288 337 H MET 43 HN MET 43 -7.220 9.568 -24.356 338 HA MET 43 HA MET 43 -5.367 10.117 -26.522 339 HB2 MET 43 2HB MET 43 -4.757 8.606 -23.940 340 HB3 MET 43 3HB MET 43 -3.638 9.502 -24.947 341 HG2 MET 43 2HG MET 43 -5.395 11.511 -24.293 342 HG3 MET 43 3HG MET 43 -5.537 10.507 -22.864 343 HE1 MET 43 3HE MET 43 -1.846 9.581 -23.618 344 HE2 MET 43 1HE MET 43 -1.869 9.951 -21.877 345 HE3 MET 43 2HE MET 43 -3.215 9.049 -22.613 346 H GLN 44 HN GLN 44 -4.611 8.517 -27.908 347 HA GLN 44 HA GLN 44 -5.975 5.985 -27.659 348 HB2 GLN 44 2HB GLN 44 -4.228 6.979 -29.950 349 HB3 GLN 44 3HB GLN 44 -5.341 5.626 -29.990 350 HG2 GLN 44 2HG GLN 44 -7.267 7.060 -29.820 351 HG3 GLN 44 3HG GLN 44 -6.302 8.435 -29.324 352 HE21 GLN 44 1HE2 GLN 44 -7.276 6.375 -31.957 353 HE22 GLN 44 2HE2 GLN 44 -6.739 7.370 -33.269 354 H VAL 45 HN VAL 45 -4.806 3.922 -27.862 355 HA VAL 45 HA VAL 45 -2.277 4.060 -26.476 356 HB VAL 45 HB VAL 45 -2.537 1.578 -26.457 357 HG11 VAL 45 1HG1 VAL 45 -4.986 3.046 -25.428 358 HG12 VAL 45 2HG1 VAL 45 -4.260 1.556 -24.779 359 HG13 VAL 45 3HG1 VAL 45 -3.386 3.101 -24.650 360 HG21 VAL 45 3HG2 VAL 45 -4.190 1.905 -28.596 361 HG22 VAL 45 1HG2 VAL 45 -4.169 0.461 -27.555 362 HG23 VAL 45 2HG2 VAL 45 -5.377 1.740 -27.280 363 H ASN 46 HN ASN 46 -0.313 3.041 -27.257 364 HA ASN 46 HA ASN 46 -0.194 3.214 -30.149 365 HB2 ASN 46 2HB ASN 46 2.261 3.438 -29.820 366 HB3 ASN 46 3HB ASN 46 1.410 4.615 -28.840 367 HD21 ASN 46 1HD2 ASN 46 2.476 4.889 -27.037 368 HD22 ASN 46 2HD2 ASN 46 3.095 3.659 -25.986 369 H GLN 47 HN GLN 47 -1.370 0.875 -28.793 370 HA GLN 47 HA GLN 47 -0.044 -1.142 -30.115 371 HB2 GLN 47 2HB GLN 47 1.743 -1.210 -28.587 372 HB3 GLN 47 3HB GLN 47 0.730 -0.808 -27.215 373 HG2 GLN 47 2HG GLN 47 -0.323 -3.035 -27.273 374 HG3 GLN 47 3HG GLN 47 0.529 -3.441 -28.749 375 HE21 GLN 47 1HE2 GLN 47 1.574 -1.787 -25.778 376 HE22 GLN 47 2HE2 GLN 47 2.857 -2.873 -25.358 377 H VAL 48 HN VAL 48 -1.121 -3.280 -29.768 378 HA VAL 48 HA VAL 48 -3.876 -2.869 -29.135 379 HB VAL 48 HB VAL 48 -2.173 -5.077 -30.216 380 HG11 VAL 48 1HG1 VAL 48 -3.421 -6.537 -28.981 381 HG12 VAL 48 2HG1 VAL 48 -4.783 -5.404 -28.807 382 HG13 VAL 48 3HG1 VAL 48 -4.556 -6.294 -30.332 383 HG21 VAL 48 3HG2 VAL 48 -3.698 -4.931 -32.104 384 HG22 VAL 48 1HG2 VAL 48 -4.735 -3.788 -31.217 385 HG23 VAL 48 2HG2 VAL 48 -3.089 -3.309 -31.697 386 H VAL 49 HN VAL 49 -4.200 -2.469 -26.952 387 HA VAL 49 HA VAL 49 -2.973 -4.325 -25.069 388 HB VAL 49 HB VAL 49 -4.521 -1.755 -24.687 389 HG11 VAL 49 1HG1 VAL 49 -4.147 -1.890 -22.385 390 HG12 VAL 49 2HG1 VAL 49 -4.592 -3.557 -22.822 391 HG13 VAL 49 3HG1 VAL 49 -2.883 -3.131 -22.561 392 HG21 VAL 49 3HG2 VAL 49 -1.736 -2.316 -25.297 393 HG22 VAL 49 1HG2 VAL 49 -2.595 -0.759 -25.225 394 HG23 VAL 49 2HG2 VAL 49 -1.899 -1.461 -23.745 395 HA PRO 50 HA PRO 50 -6.810 -6.448 -25.143 396 HB2 PRO 50 2HB PRO 50 -5.978 -8.663 -23.775 397 HB3 PRO 50 3HB PRO 50 -5.806 -8.488 -25.510 398 HG2 PRO 50 2HG PRO 50 -3.735 -8.273 -23.412 399 HG3 PRO 50 3HG PRO 50 -3.531 -8.524 -25.134 400 HD2 PRO 50 2HD PRO 50 -3.124 -6.075 -23.697 401 HD3 PRO 50 3HD PRO 50 -3.033 -6.299 -25.432 402 H MET 51 HN MET 51 -8.475 -7.236 -23.651 403 HA MET 51 HA MET 51 -8.668 -5.432 -21.552 404 HB2 MET 51 2HB MET 51 -10.617 -6.508 -22.676 405 HB3 MET 51 3HB MET 51 -10.108 -8.085 -22.106 406 HG2 MET 51 2HG MET 51 -10.434 -7.347 -19.741 407 HG3 MET 51 3HG MET 51 -10.915 -5.756 -20.296 408 HE1 MET 51 3HE MET 51 -13.102 -9.714 -20.645 409 HE2 MET 51 1HE MET 51 -12.211 -9.309 -22.131 410 HE3 MET 51 2HE MET 51 -11.349 -9.417 -20.578 411 H GLY 52 HN GLY 52 -7.730 -5.433 -19.557 412 HA2 GLY 52 1HA GLY 52 -7.391 -6.540 -17.483 413 HA3 GLY 52 2HA GLY 52 -7.093 -8.041 -18.337 414 H THR 53 HN THR 53 -5.569 -5.995 -20.355 415 HA THR 53 HA THR 53 -2.994 -6.548 -19.177 416 HB THR 53 HB THR 53 -3.971 -5.309 -21.799 417 HG1 THR 53 HG1 THR 53 -4.139 -7.694 -21.172 418 HG21 THR 53 3HG2 THR 53 -1.155 -5.899 -20.767 419 HG22 THR 53 1HG2 THR 53 -1.539 -5.838 -22.504 420 HG23 THR 53 2HG2 THR 53 -1.750 -4.387 -21.495 421 H THR 54 HN THR 54 -2.042 -5.295 -17.712 422 HA THR 54 HA THR 54 -2.977 -2.850 -16.882 423 HB THR 54 HB THR 54 -0.064 -3.784 -16.847 424 HG1 THR 54 HG1 THR 54 -0.890 -5.432 -15.619 425 HG21 THR 54 3HG2 THR 54 -0.438 -1.594 -15.750 426 HG22 THR 54 1HG2 THR 54 -1.838 -2.254 -14.872 427 HG23 THR 54 2HG2 THR 54 -0.199 -2.845 -14.507 428 H LEU 55 HN LEU 55 -2.716 -0.722 -17.401 429 HA LEU 55 HA LEU 55 -1.696 -0.247 -20.058 430 HB2 LEU 55 2HB LEU 55 -3.526 1.041 -18.172 431 HB3 LEU 55 3HB LEU 55 -2.480 2.176 -19.004 432 HG LEU 55 HG LEU 55 -4.463 0.245 -20.214 433 HD11 LEU 55 1HD1 LEU 55 -5.045 2.586 -21.333 434 HD12 LEU 55 2HD1 LEU 55 -5.691 2.103 -19.747 435 HD13 LEU 55 3HD1 LEU 55 -4.290 3.197 -19.841 436 HD21 LEU 55 3HD2 LEU 55 -3.637 1.381 -22.417 437 HD22 LEU 55 1HD2 LEU 55 -2.131 1.626 -21.501 438 HD23 LEU 55 2HD2 LEU 55 -2.764 -0.019 -21.750 439 H MET 56 HN MET 56 0.109 0.993 -20.601 440 HA MET 56 HA MET 56 1.787 1.664 -18.307 441 HB2 MET 56 2HB MET 56 2.473 0.626 -21.107 442 HB3 MET 56 3HB MET 56 3.693 1.305 -20.048 443 HG2 MET 56 2HG MET 56 1.946 -0.794 -18.817 444 HG3 MET 56 3HG MET 56 3.022 -1.355 -20.082 445 HE1 MET 56 3HE MET 56 4.025 -0.355 -15.840 446 HE2 MET 56 1HE MET 56 2.519 0.095 -16.675 447 HE3 MET 56 2HE MET 56 2.972 -1.619 -16.518 448 HA PRO 57 HA PRO 57 2.078 5.685 -19.912 449 HB2 PRO 57 2HB PRO 57 4.578 6.489 -19.154 450 HB3 PRO 57 3HB PRO 57 3.209 6.455 -18.060 451 HG2 PRO 57 2HG PRO 57 5.502 4.596 -18.218 452 HG3 PRO 57 3HG PRO 57 4.373 4.836 -16.900 453 HD2 PRO 57 2HD PRO 57 4.392 2.660 -18.769 454 HD3 PRO 57 3HD PRO 57 3.196 2.962 -17.524 455 H ASP 58 HN ASP 58 4.260 3.330 -21.025 456 HA ASP 58 HA ASP 58 5.047 5.105 -23.177 457 HB2 ASP 58 2HB ASP 58 6.824 3.817 -21.993 458 HB3 ASP 58 3HB ASP 58 6.016 2.315 -22.396 459 HD2 ASP 58 HD2 ASP 58 8.465 2.379 -24.901 460 H MET 59 HN MET 59 2.418 3.356 -22.521 461 HA MET 59 HA MET 59 2.373 1.988 -25.098 462 HB2 MET 59 2HB MET 59 1.174 1.445 -22.380 463 HB3 MET 59 3HB MET 59 0.200 0.985 -23.762 464 HG2 MET 59 2HG MET 59 2.475 -0.125 -24.619 465 HG3 MET 59 3HG MET 59 2.913 -0.066 -22.924 466 HE1 MET 59 3HE MET 59 -0.404 -0.048 -22.163 467 HE2 MET 59 1HE MET 59 -0.601 -1.729 -21.614 468 HE3 MET 59 2HE MET 59 0.793 -0.771 -21.063 469 H VAL 60 HN VAL 60 1.673 4.919 -23.987 470 HA VAL 60 HA VAL 60 -0.825 5.059 -25.516 471 HB VAL 60 HB VAL 60 -0.245 6.591 -22.976 472 HG11 VAL 60 1HG1 VAL 60 -2.660 7.164 -23.113 473 HG12 VAL 60 2HG1 VAL 60 -1.720 7.787 -24.490 474 HG13 VAL 60 3HG1 VAL 60 -2.740 6.343 -24.690 475 HG21 VAL 60 3HG2 VAL 60 -2.412 4.969 -22.443 476 HG22 VAL 60 1HG2 VAL 60 -1.347 3.899 -23.386 477 HG23 VAL 60 2HG2 VAL 60 -0.740 4.679 -21.906 478 H LYS 61 HN LYS 61 -0.978 6.820 -26.917 479 HA LYS 61 HA LYS 61 1.531 8.205 -27.338 480 HB2 LYS 61 2HB LYS 61 -1.024 8.160 -28.971 481 HB3 LYS 61 3HB LYS 61 0.476 8.930 -29.446 482 HG2 LYS 61 2HG LYS 61 1.581 6.592 -29.075 483 HG3 LYS 61 3HG LYS 61 -0.053 5.960 -29.050 484 HD2 LYS 61 2HD LYS 61 0.025 7.669 -31.313 485 HD3 LYS 61 3HD LYS 61 1.561 6.826 -31.339 486 HE2 LYS 61 2HE LYS 61 -0.749 5.066 -30.707 487 HE3 LYS 61 3HE LYS 61 -0.841 5.802 -32.295 488 HZ1 LYS 61 2HZ LYS 61 0.492 3.607 -31.985 489 HZ3 LYS 61 1HZ LYS 61 1.695 4.565 -31.451 490 H GLY 62 HN GLY 62 1.708 10.527 -27.452 491 HA2 GLY 62 1HA GLY 62 1.372 12.601 -26.660 492 HA3 GLY 62 2HA GLY 62 -0.339 12.326 -26.921 493 H TYR 63 HN TYR 63 1.201 10.015 -24.807 494 HA TYR 63 HA TYR 63 -0.340 11.023 -22.592 495 HB2 TYR 63 2HB TYR 63 -0.216 8.609 -22.994 496 HB3 TYR 63 3HB TYR 63 1.515 8.673 -23.255 497 HD1 TYR 63 HD2 TYR 63 3.071 8.882 -21.328 498 HD2 TYR 63 HD1 TYR 63 -1.148 8.439 -20.768 499 HE1 TYR 63 HE2 TYR 63 3.453 8.247 -18.896 500 HE2 TYR 63 HE1 TYR 63 -0.751 7.805 -18.338 501 HH TYR 63 HH TYR 63 2.159 8.344 -16.788 502 H ALA 64 HN ALA 64 0.841 10.877 -20.327 503 HA ALA 64 HA ALA 64 3.509 11.301 -19.999 504 HB1 ALA 64 1HB ALA 64 2.172 13.614 -21.215 505 HB2 ALA 64 2HB ALA 64 2.982 14.019 -19.683 506 HB3 ALA 64 3HB ALA 64 3.908 13.279 -21.011 507 HA PRO 65 HA PRO 65 1.917 11.367 -15.978 508 HB2 PRO 65 2HB PRO 65 4.140 12.023 -14.531 509 HB3 PRO 65 3HB PRO 65 3.827 10.405 -15.127 510 HG2 PRO 65 2HG PRO 65 5.745 12.414 -16.140 511 HG3 PRO 65 3HG PRO 65 5.710 10.686 -16.429 512 HD2 PRO 65 2HD PRO 65 4.880 12.747 -18.243 513 HD3 PRO 65 3HD PRO 65 4.737 11.017 -18.486 514 H ALA 66 HN ALA 66 1.609 12.655 -13.919 515 HA ALA 66 HA ALA 66 1.880 15.501 -14.489 516 HB1 ALA 66 1HB ALA 66 -0.290 15.512 -15.174 517 HB2 ALA 66 2HB ALA 66 -0.643 13.939 -14.417 518 HB3 ALA 66 3HB ALA 66 -0.641 15.421 -13.431 Start of MODEL 3 1 H1 MET 0 HN MET 0 3.949 -1.681 -0.937 2 HA MET 0 HA MET 0 1.568 -0.147 -0.371 3 HB2 MET 0 2HB MET 0 3.923 0.774 -1.109 4 HB3 MET 0 3HB MET 0 3.502 0.206 -2.713 5 HG2 MET 0 2HG MET 0 2.889 2.583 -2.488 6 HG3 MET 0 3HG MET 0 1.439 1.618 -2.682 7 HE1 MET 0 3HE MET 0 -0.291 2.058 -1.782 8 HE2 MET 0 1HE MET 0 -0.677 2.123 -0.045 9 HE3 MET 0 2HE MET 0 -0.366 3.627 -0.945 10 H ASN 1 HN ASN 1 -0.289 -0.131 -1.668 11 HA ASN 1 HA ASN 1 -0.183 -1.867 -3.999 12 HB2 ASN 1 2HB ASN 1 -2.447 -1.770 -1.936 13 HB3 ASN 1 3HB ASN 1 -2.457 -2.736 -3.397 14 HD21 ASN 1 1HD2 ASN 1 -1.237 -4.572 -3.562 15 HD22 ASN 1 2HD2 ASN 1 -0.438 -5.329 -2.225 16 H GLN 2 HN GLN 2 -0.158 0.067 -5.348 17 HA GLN 2 HA GLN 2 -2.407 1.860 -4.969 18 HB2 GLN 2 2HB GLN 2 -1.165 3.347 -6.566 19 HB3 GLN 2 3HB GLN 2 -0.253 2.974 -5.117 20 HG2 GLN 2 2HG GLN 2 1.394 1.962 -6.312 21 HG3 GLN 2 3HG GLN 2 0.245 0.942 -7.154 22 HE21 GLN 2 1HE2 GLN 2 -1.336 2.706 -8.471 23 HE22 GLN 2 2HE2 GLN 2 -0.443 3.591 -9.662 24 H GLU 3 HN GLU 3 -4.102 1.977 -6.427 25 HA GLU 3 HA GLU 3 -4.461 -0.133 -8.176 26 HB2 GLU 3 2HB GLU 3 -5.876 2.401 -7.499 27 HB3 GLU 3 3HB GLU 3 -6.244 1.753 -9.086 28 HG2 GLU 3 2HG GLU 3 -6.771 -0.471 -8.044 29 HG3 GLU 3 3HG GLU 3 -6.432 0.200 -6.461 30 HE2 GLU 3 HE2 GLU 3 -9.921 0.141 -7.362 31 H SER 4 HN SER 4 -4.086 -0.422 -10.376 32 HA SER 4 HA SER 4 -2.828 1.854 -11.699 33 HB2 SER 4 2HB SER 4 -2.201 -0.927 -12.626 34 HB3 SER 4 3HB SER 4 -1.177 0.495 -12.599 35 HG SER 4 HG SER 4 -1.256 -1.520 -10.810 36 H VAL 5 HN VAL 5 -3.417 2.231 -13.910 37 HA VAL 5 HA VAL 5 -6.014 1.613 -14.604 38 HB VAL 5 HB VAL 5 -3.627 2.460 -16.249 39 HG11 VAL 5 1HG1 VAL 5 -5.144 3.086 -18.025 40 HG12 VAL 5 2HG1 VAL 5 -5.366 1.359 -17.659 41 HG13 VAL 5 3HG1 VAL 5 -6.548 2.553 -17.071 42 HG21 VAL 5 3HG2 VAL 5 -5.811 4.367 -15.805 43 HG22 VAL 5 1HG2 VAL 5 -5.034 3.825 -14.299 44 HG23 VAL 5 2HG2 VAL 5 -4.055 4.563 -15.590 45 H VAL 6 HN VAL 6 -7.018 -0.036 -15.715 46 HA VAL 6 HA VAL 6 -5.287 -2.059 -16.920 47 HB VAL 6 HB VAL 6 -7.406 -2.505 -14.816 48 HG11 VAL 6 1HG1 VAL 6 -6.003 -4.691 -16.373 49 HG12 VAL 6 2HG1 VAL 6 -7.372 -4.838 -15.246 50 HG13 VAL 6 3HG1 VAL 6 -7.602 -4.057 -16.829 51 HG21 VAL 6 3HG2 VAL 6 -5.636 -2.568 -13.457 52 HG22 VAL 6 1HG2 VAL 6 -5.108 -4.040 -14.307 53 HG23 VAL 6 2HG2 VAL 6 -4.506 -2.447 -14.827 54 H ALA 7 HN ALA 7 -5.973 -2.565 -18.941 55 HA ALA 7 HA ALA 7 -8.053 -1.243 -20.155 56 HB1 ALA 7 1HB ALA 7 -6.528 -2.148 -21.636 57 HB2 ALA 7 2HB ALA 7 -6.397 -3.678 -20.736 58 HB3 ALA 7 3HB ALA 7 -7.822 -3.365 -21.757 59 H ALA 8 HN ALA 8 -10.087 -1.248 -19.245 60 HA ALA 8 HA ALA 8 -11.215 -3.489 -17.996 61 HB1 ALA 8 1HB ALA 8 -13.001 -1.443 -19.223 62 HB2 ALA 8 2HB ALA 8 -12.934 -2.050 -17.551 63 HB3 ALA 8 3HB ALA 8 -11.760 -0.831 -18.103 64 H VAL 9 HN VAL 9 -10.583 -2.801 -21.302 65 HA VAL 9 HA VAL 9 -12.083 -5.137 -22.069 66 HB VAL 9 HB VAL 9 -13.223 -3.936 -23.923 67 HG11 VAL 9 1HG1 VAL 9 -14.346 -4.576 -21.770 68 HG12 VAL 9 2HG1 VAL 9 -14.051 -2.920 -21.186 69 HG13 VAL 9 3HG1 VAL 9 -15.091 -3.192 -22.605 70 HG21 VAL 9 3HG2 VAL 9 -13.505 -1.522 -23.836 71 HG22 VAL 9 1HG2 VAL 9 -12.485 -1.426 -22.380 72 HG23 VAL 9 2HG2 VAL 9 -11.774 -1.923 -23.934 73 H LEU 10 HN LEU 10 -11.642 -5.561 -24.529 74 HA LEU 10 HA LEU 10 -8.843 -5.530 -24.838 75 HB2 LEU 10 2HB LEU 10 -9.925 -7.366 -25.729 76 HB3 LEU 10 3HB LEU 10 -11.187 -6.407 -26.476 77 HG LEU 10 HG LEU 10 -9.160 -5.490 -27.934 78 HD11 LEU 10 1HD1 LEU 10 -8.064 -8.174 -27.997 79 HD12 LEU 10 2HD1 LEU 10 -7.238 -6.603 -27.867 80 HD13 LEU 10 3HD1 LEU 10 -7.840 -7.416 -26.402 81 HD21 LEU 10 3HD2 LEU 10 -10.652 -6.374 -29.341 82 HD22 LEU 10 1HD2 LEU 10 -9.648 -7.843 -29.281 83 HD23 LEU 10 2HD2 LEU 10 -11.070 -7.692 -28.220 84 H ILE 11 HN ILE 11 -8.010 -3.429 -24.824 85 HA ILE 11 HA ILE 11 -9.137 -1.494 -26.641 86 HB ILE 11 HB ILE 11 -6.596 -1.080 -25.132 87 HG12 ILE 11 2HG1 ILE 11 -9.283 -1.597 -23.919 88 HG13 ILE 11 3HG1 ILE 11 -7.690 -2.049 -23.348 89 HG21 ILE 11 1HG2 ILE 11 -8.861 0.853 -25.193 90 HG22 ILE 11 2HG2 ILE 11 -7.105 1.132 -25.268 91 HG23 ILE 11 3HG2 ILE 11 -7.979 0.562 -26.710 92 HD11 ILE 11 3HD1 ILE 11 -8.343 -0.299 -21.884 93 HD12 ILE 11 1HD1 ILE 11 -7.269 0.509 -23.051 94 HD13 ILE 11 2HD1 ILE 11 -9.035 0.669 -23.209 95 HA PRO 12 HA PRO 12 -6.452 -2.913 -29.793 96 HB2 PRO 12 2HB PRO 12 -7.579 -1.496 -31.840 97 HB3 PRO 12 3HB PRO 12 -8.159 -3.069 -31.330 98 HG2 PRO 12 2HG PRO 12 -9.350 -0.408 -30.843 99 HG3 PRO 12 3HG PRO 12 -10.103 -1.986 -30.725 100 HD2 PRO 12 2HD PRO 12 -9.217 -0.340 -28.549 101 HD3 PRO 12 3HD PRO 12 -9.863 -1.965 -28.439 102 H ILE 13 HN ILE 13 -5.042 -1.905 -31.579 103 HA ILE 13 HA ILE 13 -3.532 0.088 -30.231 104 HB ILE 13 HB ILE 13 -2.540 -1.692 -31.583 105 HG12 ILE 13 2HG1 ILE 13 -1.998 1.183 -32.313 106 HG13 ILE 13 3HG1 ILE 13 -1.124 0.149 -31.200 107 HG21 ILE 13 1HG2 ILE 13 -3.797 -0.257 -33.938 108 HG22 ILE 13 2HG2 ILE 13 -2.603 -1.573 -34.041 109 HG23 ILE 13 3HG2 ILE 13 -4.208 -1.881 -33.337 110 HD11 ILE 13 3HD1 ILE 13 -0.698 -1.354 -33.338 111 HD12 ILE 13 1HD1 ILE 13 -1.089 0.140 -34.223 112 HD13 ILE 13 2HD1 ILE 13 0.277 0.113 -33.082 113 H ASN 14 HN ASN 14 -3.098 2.269 -30.944 114 HA ASN 14 HA ASN 14 -3.808 4.263 -31.449 115 HB2 ASN 14 2HB ASN 14 -4.737 2.894 -34.030 116 HB3 ASN 14 3HB ASN 14 -4.503 4.621 -33.847 117 HD21 ASN 14 1HD2 ASN 14 -3.062 1.583 -34.417 118 HD22 ASN 14 2HD2 ASN 14 -1.408 2.075 -34.563 119 H THR 15 HN THR 15 -5.648 3.125 -29.765 120 HA THR 15 HA THR 15 -8.234 3.896 -30.944 121 HB THR 15 HB THR 15 -7.537 1.562 -29.088 122 HG1 THR 15 HG1 THR 15 -7.230 1.272 -31.410 123 HG21 THR 15 3HG2 THR 15 -10.176 2.838 -29.882 124 HG22 THR 15 1HG2 THR 15 -10.081 1.072 -29.682 125 HG23 THR 15 2HG2 THR 15 -9.701 2.144 -28.313 126 H ALA 16 HN ALA 16 -9.072 5.653 -30.031 127 HA ALA 16 HA ALA 16 -7.927 6.970 -27.913 128 HB1 ALA 16 1HB ALA 16 -9.454 8.024 -29.488 129 HB2 ALA 16 2HB ALA 16 -10.793 6.986 -28.940 130 HB3 ALA 16 3HB ALA 16 -10.104 8.206 -27.841 131 H LEU 17 HN LEU 17 -8.065 6.871 -25.694 132 HA LEU 17 HA LEU 17 -9.426 4.545 -24.636 133 HB2 LEU 17 2HB LEU 17 -7.546 6.556 -23.392 134 HB3 LEU 17 3HB LEU 17 -8.239 5.188 -22.544 135 HG LEU 17 HG LEU 17 -6.524 4.903 -25.022 136 HD11 LEU 17 1HD1 LEU 17 -4.644 4.399 -23.584 137 HD12 LEU 17 2HD1 LEU 17 -5.264 6.027 -23.219 138 HD13 LEU 17 3HD1 LEU 17 -5.640 4.668 -22.133 139 HD21 LEU 17 3HD2 LEU 17 -7.607 2.958 -22.984 140 HD22 LEU 17 1HD2 LEU 17 -7.800 2.948 -24.753 141 HD23 LEU 17 2HD2 LEU 17 -6.218 2.572 -24.029 142 H THR 18 HN THR 18 -11.097 4.593 -23.087 143 HA THR 18 HA THR 18 -12.277 7.250 -22.631 144 HB THR 18 HB THR 18 -14.516 6.065 -22.958 145 HG1 THR 18 HG1 THR 18 -12.692 4.096 -24.136 146 HG21 THR 18 3HG2 THR 18 -13.994 7.206 -24.956 147 HG22 THR 18 1HG2 THR 18 -12.468 6.316 -25.177 148 HG23 THR 18 2HG2 THR 18 -14.021 5.521 -25.530 149 H VAL 19 HN VAL 19 -14.044 7.059 -20.833 150 HA VAL 19 HA VAL 19 -12.650 5.991 -18.570 151 HB VAL 19 HB VAL 19 -14.075 8.178 -18.897 152 HG11 VAL 19 1HG1 VAL 19 -16.161 6.151 -18.025 153 HG12 VAL 19 2HG1 VAL 19 -16.354 7.917 -17.913 154 HG13 VAL 19 3HG1 VAL 19 -16.172 7.141 -19.504 155 HG21 VAL 19 3HG2 VAL 19 -13.369 8.367 -16.791 156 HG22 VAL 19 1HG2 VAL 19 -14.780 7.421 -16.258 157 HG23 VAL 19 2HG2 VAL 19 -13.248 6.598 -16.638 158 H GLY 20 HN GLY 20 -14.866 4.776 -20.891 159 HA2 GLY 20 1HA GLY 20 -15.950 2.792 -19.001 160 HA3 GLY 20 2HA GLY 20 -16.605 3.200 -20.575 161 H MET 21 HN MET 21 -13.158 3.106 -20.628 162 HA MET 21 HA MET 21 -13.300 0.393 -21.697 163 HB2 MET 21 2HB MET 21 -12.014 2.938 -22.628 164 HB3 MET 21 3HB MET 21 -11.005 1.514 -22.789 165 HG2 MET 21 2HG MET 21 -13.417 0.562 -23.761 166 HG3 MET 21 3HG MET 21 -13.497 2.242 -24.254 167 HE1 MET 21 3HE MET 21 -11.327 3.431 -25.693 168 HE2 MET 21 1HE MET 21 -10.436 2.858 -24.263 169 HE3 MET 21 2HE MET 21 -9.829 2.490 -25.896 170 H MET 22 HN MET 22 -11.579 2.722 -19.623 171 HA MET 22 HA MET 22 -9.603 0.693 -19.010 172 HB2 MET 22 2HB MET 22 -9.896 3.665 -18.316 173 HB3 MET 22 3HB MET 22 -8.614 2.673 -17.650 174 HG2 MET 22 2HG MET 22 -7.659 2.257 -19.836 175 HG3 MET 22 3HG MET 22 -9.079 2.877 -20.656 176 HE1 MET 22 3HE MET 22 -9.956 5.401 -19.337 177 HE2 MET 22 1HE MET 22 -8.946 6.675 -20.062 178 HE3 MET 22 2HE MET 22 -9.591 5.364 -21.079 179 H THR 23 HN THR 23 -8.920 0.895 -16.463 180 HA THR 23 HA THR 23 -11.061 1.335 -14.656 181 HB THR 23 HB THR 23 -11.521 -0.937 -16.021 182 HG1 THR 23 HG1 THR 23 -12.894 -0.519 -14.301 183 HG21 THR 23 3HG2 THR 23 -10.641 -2.889 -14.855 184 HG22 THR 23 1HG2 THR 23 -9.240 -1.904 -15.339 185 HG23 THR 23 2HG2 THR 23 -9.816 -1.863 -13.656 186 H THR 24 HN THR 24 -10.442 0.403 -12.402 187 HA THR 24 HA THR 24 -7.516 0.679 -12.167 188 HB THR 24 HB THR 24 -8.020 1.765 -9.983 189 HG1 THR 24 HG1 THR 24 -10.162 1.682 -9.279 190 HG21 THR 24 3HG2 THR 24 -9.751 2.851 -12.268 191 HG22 THR 24 1HG2 THR 24 -9.369 3.743 -10.776 192 HG23 THR 24 2HG2 THR 24 -8.070 3.321 -11.916 193 H ARG 25 HN ARG 25 -6.378 -0.940 -11.280 194 HA ARG 25 HA ARG 25 -7.670 -2.675 -9.434 195 HB2 ARG 25 2HB ARG 25 -7.612 -3.411 -12.209 196 HB3 ARG 25 3HB ARG 25 -6.421 -4.417 -11.408 197 HG2 ARG 25 2HG ARG 25 -8.109 -5.733 -10.665 198 HG3 ARG 25 3HG ARG 25 -8.642 -4.408 -9.649 199 HD2 ARG 25 2HD ARG 25 -10.443 -3.962 -10.986 200 HD3 ARG 25 3HD ARG 25 -9.484 -4.039 -12.451 201 HE ARG 25 HE ARG 25 -9.651 -6.690 -11.725 202 HH11 ARG 25 2HH2 ARG 25 -12.101 -4.164 -12.141 203 HH12 ARG 25 1HH2 ARG 25 -13.347 -5.276 -12.601 204 HH22 ARG 25 HH1 ARG 25 -12.851 -7.618 -12.706 205 H VAL 26 HN VAL 26 -6.109 -3.847 -8.150 206 HA VAL 26 HA VAL 26 -3.474 -2.728 -8.280 207 HB VAL 26 HB VAL 26 -4.642 -4.853 -6.472 208 HG11 VAL 26 1HG1 VAL 26 -2.729 -4.830 -5.278 209 HG12 VAL 26 2HG1 VAL 26 -2.004 -4.187 -6.771 210 HG13 VAL 26 3HG1 VAL 26 -2.507 -3.075 -5.475 211 HG21 VAL 26 3HG2 VAL 26 -6.000 -2.882 -6.271 212 HG22 VAL 26 1HG2 VAL 26 -4.920 -2.947 -4.857 213 HG23 VAL 26 2HG2 VAL 26 -4.564 -1.832 -6.198 214 H VAL 27 HN VAL 27 -2.789 -3.504 -10.395 215 HA VAL 27 HA VAL 27 -2.299 -6.397 -10.444 216 HB VAL 27 HB VAL 27 -2.266 -6.257 -12.792 217 HG11 VAL 27 1HG1 VAL 27 -4.467 -5.638 -13.294 218 HG12 VAL 27 2HG1 VAL 27 -4.515 -5.966 -11.545 219 HG13 VAL 27 3HG1 VAL 27 -4.456 -4.288 -12.135 220 HG21 VAL 27 3HG2 VAL 27 -1.033 -4.442 -13.467 221 HG22 VAL 27 1HG2 VAL 27 -2.672 -3.844 -13.822 222 HG23 VAL 27 2HG2 VAL 27 -1.839 -3.329 -12.335 223 H SER 28 HN SER 28 -0.169 -7.088 -11.364 224 HA SER 28 HA SER 28 1.863 -5.067 -10.836 225 HB2 SER 28 2HB SER 28 1.446 -7.047 -9.079 226 HB3 SER 28 3HB SER 28 2.412 -7.966 -10.215 227 HG SER 28 HG SER 28 4.155 -7.016 -9.436 228 HA PRO 29 HA PRO 29 3.740 -4.814 -11.116 229 HB2 PRO 29 2HB PRO 29 5.169 -3.208 -12.803 230 HB3 PRO 29 3HB PRO 29 5.850 -4.617 -12.015 231 HG2 PRO 29 2HG PRO 29 5.028 -4.286 -14.836 232 HG3 PRO 29 3HG PRO 29 6.079 -5.500 -14.134 233 HD2 PRO 29 2HD PRO 29 3.348 -5.852 -14.934 234 HD3 PRO 29 3HD PRO 29 4.363 -7.030 -14.127 235 H THR 30 HN THR 30 3.270 -2.668 -10.440 236 HA THR 30 HA THR 30 0.761 -1.832 -11.454 237 HB THR 30 HB THR 30 1.285 0.125 -9.848 238 HG1 THR 30 HG1 THR 30 3.307 -0.495 -8.580 239 HG21 THR 30 3HG2 THR 30 0.226 -2.076 -9.056 240 HG22 THR 30 1HG2 THR 30 1.870 -2.638 -8.672 241 HG23 THR 30 2HG2 THR 30 1.190 -1.230 -7.821 242 H GLY 31 HN GLY 31 0.299 -0.749 -13.253 243 HA2 GLY 31 1HA GLY 31 2.476 0.694 -14.588 244 HA3 GLY 31 2HA GLY 31 0.957 0.177 -15.292 245 H ILE 32 HN ILE 32 0.436 2.272 -16.114 246 HA ILE 32 HA ILE 32 0.601 4.662 -14.915 247 HB ILE 32 HB ILE 32 -1.630 3.552 -16.615 248 HG12 ILE 32 2HG1 ILE 32 0.601 5.387 -17.481 249 HG13 ILE 32 3HG1 ILE 32 0.831 3.650 -17.424 250 HG21 ILE 32 1HG2 ILE 32 -2.513 5.671 -16.935 251 HG22 ILE 32 2HG2 ILE 32 -2.152 5.658 -15.192 252 HG23 ILE 32 3HG2 ILE 32 -1.055 6.488 -16.322 253 HD11 ILE 32 3HD1 ILE 32 -0.586 3.256 -19.202 254 HD12 ILE 32 1HD1 ILE 32 -1.677 4.592 -18.763 255 HD13 ILE 32 2HD1 ILE 32 -0.147 4.932 -19.607 256 HA PRO 33 HA PRO 33 -1.889 4.515 -11.386 257 HB2 PRO 33 2HB PRO 33 -2.093 7.185 -10.837 258 HB3 PRO 33 3HB PRO 33 -0.698 6.220 -10.398 259 HG2 PRO 33 2HG PRO 33 -0.975 8.190 -12.585 260 HG3 PRO 33 3HG PRO 33 0.488 7.544 -11.868 261 HD2 PRO 33 2HD PRO 33 -0.657 6.807 -14.393 262 HD3 PRO 33 3HD PRO 33 0.740 6.081 -13.623 263 H ALA 34 HN ALA 34 -3.996 4.714 -10.537 264 HA ALA 34 HA ALA 34 -5.926 4.774 -12.572 265 HB1 ALA 34 1HB ALA 34 -7.489 4.836 -10.521 266 HB2 ALA 34 2HB ALA 34 -6.364 3.463 -10.644 267 HB3 ALA 34 3HB ALA 34 -6.004 4.812 -9.541 268 H GLU 35 HN GLU 35 -4.208 7.287 -10.987 269 HA GLU 35 HA GLU 35 -6.351 9.164 -11.062 270 HB2 GLU 35 2HB GLU 35 -4.802 10.711 -10.125 271 HB3 GLU 35 3HB GLU 35 -4.380 9.165 -9.416 272 HG2 GLU 35 2HG GLU 35 -2.765 9.028 -11.574 273 HG3 GLU 35 3HG GLU 35 -2.898 10.773 -11.489 274 HE2 GLU 35 HE2 GLU 35 -0.434 10.785 -9.115 275 H ASP 36 HN ASP 36 -4.296 7.751 -13.377 276 HA ASP 36 HA ASP 36 -4.200 10.147 -14.990 277 HB2 ASP 36 2HB ASP 36 -2.360 8.182 -14.638 278 HB3 ASP 36 3HB ASP 36 -3.227 7.480 -15.990 279 HD2 ASP 36 HD2 ASP 36 -1.892 9.693 -18.284 280 H ILE 37 HN ILE 37 -6.303 7.597 -14.295 281 HA ILE 37 HA ILE 37 -7.099 6.572 -16.712 282 HB ILE 37 HB ILE 37 -8.264 6.931 -14.031 283 HG12 ILE 37 2HG1 ILE 37 -7.818 4.684 -15.988 284 HG13 ILE 37 3HG1 ILE 37 -7.121 4.915 -14.397 285 HG21 ILE 37 1HG2 ILE 37 -10.041 6.387 -16.425 286 HG22 ILE 37 2HG2 ILE 37 -10.504 6.182 -14.719 287 HG23 ILE 37 3HG2 ILE 37 -10.112 7.801 -15.346 288 HD11 ILE 37 3HD1 ILE 37 -9.490 4.686 -13.438 289 HD12 ILE 37 1HD1 ILE 37 -9.998 4.172 -15.064 290 HD13 ILE 37 2HD1 ILE 37 -8.804 3.210 -14.160 291 HA PRO 38 HA PRO 38 -9.845 10.394 -17.189 292 HB2 PRO 38 2HB PRO 38 -9.444 12.568 -15.583 293 HB3 PRO 38 3HB PRO 38 -10.664 11.352 -15.262 294 HG2 PRO 38 2HG PRO 38 -8.066 11.771 -13.915 295 HG3 PRO 38 3HG PRO 38 -9.459 10.866 -13.357 296 HD2 PRO 38 2HD PRO 38 -7.034 9.786 -14.442 297 HD3 PRO 38 3HD PRO 38 -8.471 8.890 -13.992 298 H ARG 39 HN ARG 39 -6.541 10.333 -16.854 299 HA ARG 39 HA ARG 39 -6.257 12.710 -18.470 300 HB2 ARG 39 2HB ARG 39 -4.223 10.899 -17.082 301 HB3 ARG 39 3HB ARG 39 -3.754 12.240 -18.108 302 HG2 ARG 39 2HG ARG 39 -4.859 13.850 -16.644 303 HG3 ARG 39 3HG ARG 39 -5.613 12.572 -15.711 304 HD2 ARG 39 2HD ARG 39 -3.795 13.058 -14.330 305 HD3 ARG 39 3HD ARG 39 -3.095 11.783 -15.306 306 HE ARG 39 HE ARG 39 -2.425 14.644 -15.415 307 HH11 ARG 39 2HH2 ARG 39 -2.239 11.538 -17.110 308 HH12 ARG 39 1HH2 ARG 39 -0.899 12.016 -18.098 309 HH22 ARG 39 HH1 ARG 39 0.015 14.217 -17.850 310 H LEU 40 HN LEU 40 -6.403 9.236 -18.673 311 HA LEU 40 HA LEU 40 -4.851 9.079 -21.099 312 HB2 LEU 40 2HB LEU 40 -6.470 7.037 -19.572 313 HB3 LEU 40 3HB LEU 40 -5.543 6.691 -21.018 314 HG LEU 40 HG LEU 40 -4.221 7.895 -18.591 315 HD11 LEU 40 1HD1 LEU 40 -4.700 6.082 -17.393 316 HD12 LEU 40 2HD1 LEU 40 -5.399 5.241 -18.798 317 HD13 LEU 40 3HD1 LEU 40 -3.644 5.178 -18.505 318 HD21 LEU 40 3HD2 LEU 40 -3.116 7.780 -20.893 319 HD22 LEU 40 1HD2 LEU 40 -2.208 7.116 -19.512 320 HD23 LEU 40 2HD2 LEU 40 -3.042 6.020 -20.640 321 H ILE 41 HN ILE 41 -8.142 9.697 -20.093 322 HA ILE 41 HA ILE 41 -9.526 8.720 -22.285 323 HB ILE 41 HB ILE 41 -10.117 11.176 -20.629 324 HG12 ILE 41 2HG1 ILE 41 -10.381 8.248 -20.069 325 HG13 ILE 41 3HG1 ILE 41 -9.906 9.556 -19.003 326 HG21 ILE 41 1HG2 ILE 41 -11.429 10.919 -22.744 327 HG22 ILE 41 2HG2 ILE 41 -12.037 9.369 -22.117 328 HG23 ILE 41 3HG2 ILE 41 -12.406 10.883 -21.256 329 HD11 ILE 41 3HD1 ILE 41 -12.174 8.709 -18.443 330 HD12 ILE 41 1HD1 ILE 41 -12.236 10.409 -18.967 331 HD13 ILE 41 2HD1 ILE 41 -12.728 9.115 -20.085 332 H SER 42 HN SER 42 -9.895 9.430 -24.363 333 HA SER 42 HA SER 42 -9.890 10.800 -26.093 334 HB2 SER 42 2HB SER 42 -9.791 12.718 -24.254 335 HB3 SER 42 3HB SER 42 -8.121 12.860 -24.765 336 HG SER 42 HG SER 42 -8.981 14.153 -26.260 337 H MET 43 HN MET 43 -7.249 9.555 -24.330 338 HA MET 43 HA MET 43 -5.381 10.111 -26.480 339 HB2 MET 43 2HB MET 43 -4.794 8.610 -23.885 340 HB3 MET 43 3HB MET 43 -3.661 9.492 -24.890 341 HG2 MET 43 2HG MET 43 -5.364 11.534 -24.284 342 HG3 MET 43 3HG MET 43 -5.618 10.538 -22.865 343 HE1 MET 43 3HE MET 43 -3.348 9.008 -22.453 344 HE2 MET 43 1HE MET 43 -1.975 9.462 -23.489 345 HE3 MET 43 2HE MET 43 -1.952 9.864 -21.756 346 H GLN 44 HN GLN 44 -4.697 8.537 -27.910 347 HA GLN 44 HA GLN 44 -6.034 6.001 -27.670 348 HB2 GLN 44 2HB GLN 44 -4.194 6.891 -29.922 349 HB3 GLN 44 3HB GLN 44 -5.440 5.661 -29.980 350 HG2 GLN 44 2HG GLN 44 -7.208 7.332 -29.744 351 HG3 GLN 44 3HG GLN 44 -6.043 8.597 -29.409 352 HE21 GLN 44 1HE2 GLN 44 -6.648 6.060 -31.839 353 HE22 GLN 44 2HE2 GLN 44 -6.337 7.023 -33.244 354 H VAL 45 HN VAL 45 -4.813 3.930 -28.026 355 HA VAL 45 HA VAL 45 -2.333 4.041 -26.520 356 HB VAL 45 HB VAL 45 -2.611 1.571 -26.493 357 HG11 VAL 45 1HG1 VAL 45 -3.444 2.833 -24.626 358 HG12 VAL 45 2HG1 VAL 45 -4.923 3.274 -25.513 359 HG13 VAL 45 3HG1 VAL 45 -4.650 1.584 -25.023 360 HG21 VAL 45 3HG2 VAL 45 -4.237 1.937 -28.680 361 HG22 VAL 45 1HG2 VAL 45 -4.149 0.456 -27.697 362 HG23 VAL 45 2HG2 VAL 45 -5.418 1.663 -27.376 363 H ASN 46 HN ASN 46 -0.403 2.854 -27.274 364 HA ASN 46 HA ASN 46 -0.232 3.075 -30.168 365 HB2 ASN 46 2HB ASN 46 2.214 3.309 -29.821 366 HB3 ASN 46 3HB ASN 46 1.358 4.485 -28.843 367 HD21 ASN 46 1HD2 ASN 46 2.411 4.756 -27.031 368 HD22 ASN 46 2HD2 ASN 46 3.027 3.524 -25.981 369 H GLN 47 HN GLN 47 -1.411 0.755 -28.733 370 HA GLN 47 HA GLN 47 -0.122 -1.286 -30.049 371 HB2 GLN 47 2HB GLN 47 1.706 -1.338 -28.574 372 HB3 GLN 47 3HB GLN 47 0.738 -0.894 -27.183 373 HG2 GLN 47 2HG GLN 47 -0.338 -3.115 -27.162 374 HG3 GLN 47 3HG GLN 47 0.485 -3.565 -28.642 375 HE21 GLN 47 1HE2 GLN 47 1.577 -1.851 -25.721 376 HE22 GLN 47 2HE2 GLN 47 2.869 -2.927 -25.303 377 H VAL 48 HN VAL 48 -1.187 -3.419 -29.628 378 HA VAL 48 HA VAL 48 -3.923 -2.986 -28.904 379 HB VAL 48 HB VAL 48 -2.275 -5.184 -30.078 380 HG11 VAL 48 1HG1 VAL 48 -5.040 -5.546 -28.880 381 HG12 VAL 48 2HG1 VAL 48 -4.297 -6.669 -30.043 382 HG13 VAL 48 3HG1 VAL 48 -3.548 -6.415 -28.449 383 HG21 VAL 48 3HG2 VAL 48 -4.799 -3.708 -30.888 384 HG22 VAL 48 1HG2 VAL 48 -3.179 -3.583 -31.617 385 HG23 VAL 48 2HG2 VAL 48 -4.120 -5.084 -31.789 386 H VAL 49 HN VAL 49 -4.317 -2.703 -26.743 387 HA VAL 49 HA VAL 49 -2.924 -4.464 -24.882 388 HB VAL 49 HB VAL 49 -4.646 -2.009 -24.486 389 HG11 VAL 49 1HG1 VAL 49 -4.155 -2.099 -22.162 390 HG12 VAL 49 2HG1 VAL 49 -4.714 -3.727 -22.614 391 HG13 VAL 49 3HG1 VAL 49 -2.977 -3.415 -22.385 392 HG21 VAL 49 3HG2 VAL 49 -1.714 -2.473 -24.777 393 HG22 VAL 49 1HG2 VAL 49 -2.712 -1.081 -25.262 394 HG23 VAL 49 2HG2 VAL 49 -2.238 -1.286 -23.558 395 HA PRO 50 HA PRO 50 -6.577 -6.882 -24.902 396 HB2 PRO 50 2HB PRO 50 -5.576 -8.997 -23.491 397 HB3 PRO 50 3HB PRO 50 -5.410 -8.840 -25.228 398 HG2 PRO 50 2HG PRO 50 -3.374 -8.420 -23.127 399 HG3 PRO 50 3HG PRO 50 -3.141 -8.685 -24.843 400 HD2 PRO 50 2HD PRO 50 -2.941 -6.186 -23.450 401 HD3 PRO 50 3HD PRO 50 -2.823 -6.433 -25.181 402 H MET 51 HN MET 51 -8.385 -7.013 -23.665 403 HA MET 51 HA MET 51 -8.594 -5.451 -21.516 404 HB2 MET 51 2HB MET 51 -10.512 -6.548 -22.641 405 HB3 MET 51 3HB MET 51 -9.984 -8.125 -22.090 406 HG2 MET 51 2HG MET 51 -10.205 -7.107 -19.668 407 HG3 MET 51 3HG MET 51 -11.160 -5.858 -20.443 408 HE1 MET 51 3HE MET 51 -11.814 -8.423 -22.851 409 HE2 MET 51 1HE MET 51 -13.549 -8.525 -22.467 410 HE3 MET 51 2HE MET 51 -12.764 -6.935 -22.625 411 H GLY 52 HN GLY 52 -7.712 -5.393 -19.496 412 HA2 GLY 52 1HA GLY 52 -7.399 -6.425 -17.388 413 HA3 GLY 52 2HA GLY 52 -7.103 -7.959 -18.182 414 H THR 53 HN THR 53 -5.547 -5.866 -20.198 415 HA THR 53 HA THR 53 -2.985 -6.458 -18.986 416 HB THR 53 HB THR 53 -3.944 -5.300 -21.647 417 HG1 THR 53 HG1 THR 53 -4.046 -7.659 -21.030 418 HG21 THR 53 3HG2 THR 53 -1.742 -4.994 -22.358 419 HG22 THR 53 1HG2 THR 53 -1.528 -4.560 -20.645 420 HG23 THR 53 2HG2 THR 53 -1.101 -6.193 -21.209 421 H THR 54 HN THR 54 -1.987 -5.177 -17.578 422 HA THR 54 HA THR 54 -2.930 -2.735 -16.751 423 HB THR 54 HB THR 54 0.015 -3.530 -16.756 424 HG1 THR 54 HG1 THR 54 -0.613 -5.201 -15.380 425 HG21 THR 54 3HG2 THR 54 -1.894 -2.232 -14.745 426 HG22 THR 54 1HG2 THR 54 -0.262 -2.804 -14.322 427 HG23 THR 54 2HG2 THR 54 -0.465 -1.483 -15.497 428 H LEU 55 HN LEU 55 -2.722 -0.614 -17.305 429 HA LEU 55 HA LEU 55 -1.734 -0.154 -19.979 430 HB2 LEU 55 2HB LEU 55 -3.920 0.705 -18.908 431 HB3 LEU 55 3HB LEU 55 -2.906 1.900 -18.124 432 HG LEU 55 HG LEU 55 -2.303 2.916 -20.169 433 HD11 LEU 55 1HD1 LEU 55 -3.385 0.432 -21.509 434 HD12 LEU 55 2HD1 LEU 55 -3.046 1.943 -22.388 435 HD13 LEU 55 3HD1 LEU 55 -1.729 1.086 -21.551 436 HD21 LEU 55 3HD2 LEU 55 -5.190 2.238 -19.857 437 HD22 LEU 55 1HD2 LEU 55 -4.359 3.810 -19.769 438 HD23 LEU 55 2HD2 LEU 55 -4.680 3.059 -21.351 439 H MET 56 HN MET 56 0.182 0.790 -20.519 440 HA MET 56 HA MET 56 1.804 1.647 -18.255 441 HB2 MET 56 2HB MET 56 2.439 0.484 -21.008 442 HB3 MET 56 3HB MET 56 3.682 1.304 -20.083 443 HG2 MET 56 2HG MET 56 2.081 -0.806 -18.649 444 HG3 MET 56 3HG MET 56 3.227 -1.358 -19.855 445 HE1 MET 56 3HE MET 56 2.548 0.218 -16.526 446 HE2 MET 56 1HE MET 56 3.135 -1.451 -16.333 447 HE3 MET 56 2HE MET 56 4.076 -0.094 -15.669 448 HA PRO 57 HA PRO 57 2.092 5.639 -19.930 449 HB2 PRO 57 2HB PRO 57 4.609 6.448 -19.238 450 HB3 PRO 57 3HB PRO 57 3.264 6.434 -18.114 451 HG2 PRO 57 2HG PRO 57 5.548 4.566 -18.293 452 HG3 PRO 57 3HG PRO 57 4.448 4.830 -16.955 453 HD2 PRO 57 2HD PRO 57 4.421 2.625 -18.789 454 HD3 PRO 57 3HD PRO 57 3.253 2.950 -17.524 455 H ASP 58 HN ASP 58 4.350 3.306 -21.003 456 HA ASP 58 HA ASP 58 5.068 5.030 -23.209 457 HB2 ASP 58 2HB ASP 58 6.295 2.800 -21.790 458 HB3 ASP 58 3HB ASP 58 6.214 2.423 -23.499 459 HD2 ASP 58 HD2 ASP 58 8.234 2.799 -24.169 460 H MET 59 HN MET 59 2.459 3.241 -22.465 461 HA MET 59 HA MET 59 2.339 1.931 -25.070 462 HB2 MET 59 2HB MET 59 1.189 1.302 -22.331 463 HB3 MET 59 3HB MET 59 0.304 0.754 -23.741 464 HG2 MET 59 2HG MET 59 2.673 -0.177 -24.522 465 HG3 MET 59 3HG MET 59 3.081 -0.044 -22.823 466 HE1 MET 59 3HE MET 59 1.014 -0.914 -20.964 467 HE2 MET 59 1HE MET 59 -0.218 -0.293 -22.088 468 HE3 MET 59 2HE MET 59 -0.297 -1.979 -21.524 469 H VAL 60 HN VAL 60 1.722 4.831 -24.129 470 HA VAL 60 HA VAL 60 -0.902 4.917 -25.408 471 HB VAL 60 HB VAL 60 -0.173 6.372 -22.858 472 HG11 VAL 60 1HG1 VAL 60 -2.461 7.210 -22.887 473 HG12 VAL 60 2HG1 VAL 60 -1.619 7.681 -24.382 474 HG13 VAL 60 3HG1 VAL 60 -2.788 6.338 -24.404 475 HG21 VAL 60 3HG2 VAL 60 -0.651 3.893 -22.642 476 HG22 VAL 60 1HG2 VAL 60 -1.721 4.968 -21.710 477 HG23 VAL 60 2HG2 VAL 60 -2.295 4.240 -23.230 478 H LYS 61 HN LYS 61 -1.102 6.582 -26.882 479 HA LYS 61 HA LYS 61 1.332 8.056 -27.394 480 HB2 LYS 61 2HB LYS 61 -1.277 7.865 -28.929 481 HB3 LYS 61 3HB LYS 61 0.146 8.732 -29.468 482 HG2 LYS 61 2HG LYS 61 1.415 6.464 -29.106 483 HG3 LYS 61 3HG LYS 61 -0.180 5.738 -29.059 484 HD2 LYS 61 2HD LYS 61 -0.002 7.569 -31.322 485 HD3 LYS 61 3HD LYS 61 1.340 6.443 -31.369 486 HE2 LYS 61 2HE LYS 61 -1.199 5.107 -30.675 487 HE3 LYS 61 3HE LYS 61 -1.290 5.928 -32.221 488 HZ1 LYS 61 2HZ LYS 61 1.170 4.481 -31.910 489 HZ3 LYS 61 1HZ LYS 61 0.094 4.413 -33.130 490 H GLY 62 HN GLY 62 1.456 10.370 -27.516 491 HA2 GLY 62 1HA GLY 62 1.079 12.449 -26.756 492 HA3 GLY 62 2HA GLY 62 -0.631 12.123 -26.957 493 H TYR 63 HN TYR 63 1.017 9.874 -24.865 494 HA TYR 63 HA TYR 63 -0.466 10.888 -22.613 495 HB2 TYR 63 2HB TYR 63 -0.312 8.469 -22.998 496 HB3 TYR 63 3HB TYR 63 1.411 8.560 -23.300 497 HD1 TYR 63 HD2 TYR 63 3.007 8.815 -21.415 498 HD2 TYR 63 HD1 TYR 63 -1.189 8.317 -20.748 499 HE1 TYR 63 HE2 TYR 63 3.458 8.216 -18.985 500 HE2 TYR 63 HE1 TYR 63 -0.725 7.720 -18.320 501 HH TYR 63 HH TYR 63 1.514 8.435 -16.688 502 H ALA 64 HN ALA 64 0.789 10.793 -20.387 503 HA ALA 64 HA ALA 64 3.455 11.256 -20.142 504 HB1 ALA 64 1HB ALA 64 2.870 13.983 -19.875 505 HB2 ALA 64 2HB ALA 64 3.829 13.225 -21.170 506 HB3 ALA 64 3HB ALA 64 2.088 13.512 -21.403 507 HA PRO 65 HA PRO 65 1.968 11.392 -16.083 508 HB2 PRO 65 2HB PRO 65 4.228 12.082 -14.709 509 HB3 PRO 65 3HB PRO 65 3.904 10.452 -15.264 510 HG2 PRO 65 2HG PRO 65 5.787 12.445 -16.368 511 HG3 PRO 65 3HG PRO 65 5.750 10.712 -16.622 512 HD2 PRO 65 2HD PRO 65 4.865 12.734 -18.453 513 HD3 PRO 65 3HD PRO 65 4.721 11.000 -18.658 514 H ALA 66 HN ALA 66 2.217 12.823 -13.905 515 HA ALA 66 HA ALA 66 2.024 15.606 -14.779 516 HB1 ALA 66 1HB ALA 66 -0.197 13.918 -14.125 517 HB2 ALA 66 2HB ALA 66 0.002 15.098 -12.807 518 HB3 ALA 66 3HB ALA 66 -0.200 15.662 -14.484 Start of MODEL 4 1 H1 MET 0 HN MET 0 3.539 -1.255 0.109 2 HA MET 0 HA MET 0 1.136 -0.069 0.085 3 HB2 MET 0 2HB MET 0 2.056 1.336 -1.736 4 HB3 MET 0 3HB MET 0 3.348 0.932 -0.623 5 HG2 MET 0 2HG MET 0 4.413 0.392 -2.616 6 HG3 MET 0 3HG MET 0 3.668 -1.160 -2.283 7 HE1 MET 0 3HE MET 0 3.758 1.700 -5.157 8 HE2 MET 0 1HE MET 0 2.039 2.128 -4.990 9 HE3 MET 0 2HE MET 0 3.130 2.268 -3.591 10 H ASN 1 HN ASN 1 -0.685 0.081 -1.304 11 HA ASN 1 HA ASN 1 -0.708 -1.870 -3.463 12 HB2 ASN 1 2HB ASN 1 -3.077 -1.312 -1.607 13 HB3 ASN 1 3HB ASN 1 -2.997 -2.539 -2.856 14 HD21 ASN 1 1HD2 ASN 1 -0.472 -3.556 -2.506 15 HD22 ASN 1 2HD2 ASN 1 -0.346 -4.374 -0.985 16 H GLN 2 HN GLN 2 -0.426 -0.076 -4.975 17 HA GLN 2 HA GLN 2 -2.499 1.952 -4.863 18 HB2 GLN 2 2HB GLN 2 -1.062 3.361 -6.091 19 HB3 GLN 2 3HB GLN 2 0.039 2.486 -5.045 20 HG2 GLN 2 2HG GLN 2 1.084 2.323 -7.159 21 HG3 GLN 2 3HG GLN 2 0.264 0.782 -7.012 22 HE21 GLN 2 1HE2 GLN 2 -0.752 4.096 -7.847 23 HE22 GLN 2 2HE2 GLN 2 -1.522 3.717 -9.352 24 H GLU 3 HN GLU 3 -4.081 2.136 -6.447 25 HA GLU 3 HA GLU 3 -4.472 -0.104 -8.085 26 HB2 GLU 3 2HB GLU 3 -5.870 2.499 -7.575 27 HB3 GLU 3 3HB GLU 3 -6.259 1.682 -9.075 28 HG2 GLU 3 2HG GLU 3 -6.808 -0.400 -7.816 29 HG3 GLU 3 3HG GLU 3 -6.384 0.389 -6.309 30 HE2 GLU 3 HE2 GLU 3 -9.963 0.753 -6.635 31 H SER 4 HN SER 4 -4.254 -0.365 -10.348 32 HA SER 4 HA SER 4 -2.893 1.847 -11.671 33 HB2 SER 4 2HB SER 4 -2.223 -0.861 -12.668 34 HB3 SER 4 3HB SER 4 -1.176 0.515 -12.384 35 HG SER 4 HG SER 4 -0.575 -0.398 -10.553 36 H VAL 5 HN VAL 5 -3.473 2.191 -13.886 37 HA VAL 5 HA VAL 5 -6.062 1.553 -14.590 38 HB VAL 5 HB VAL 5 -3.676 2.362 -16.260 39 HG11 VAL 5 1HG1 VAL 5 -5.711 1.249 -17.460 40 HG12 VAL 5 2HG1 VAL 5 -6.534 2.788 -17.108 41 HG13 VAL 5 3HG1 VAL 5 -5.049 2.777 -18.090 42 HG21 VAL 5 3HG2 VAL 5 -3.960 4.389 -15.378 43 HG22 VAL 5 1HG2 VAL 5 -5.644 4.416 -15.955 44 HG23 VAL 5 2HG2 VAL 5 -5.265 3.758 -14.344 45 H VAL 6 HN VAL 6 -7.052 -0.129 -15.656 46 HA VAL 6 HA VAL 6 -5.311 -2.147 -16.853 47 HB VAL 6 HB VAL 6 -7.384 -2.590 -14.704 48 HG11 VAL 6 1HG1 VAL 6 -5.999 -4.771 -16.287 49 HG12 VAL 6 2HG1 VAL 6 -7.314 -4.936 -15.099 50 HG13 VAL 6 3HG1 VAL 6 -7.629 -4.171 -16.675 51 HG21 VAL 6 3HG2 VAL 6 -4.994 -4.084 -14.310 52 HG22 VAL 6 1HG2 VAL 6 -4.522 -2.418 -14.721 53 HG23 VAL 6 2HG2 VAL 6 -5.618 -2.721 -13.352 54 H ALA 7 HN ALA 7 -5.960 -2.418 -18.919 55 HA ALA 7 HA ALA 7 -8.079 -1.231 -20.093 56 HB1 ALA 7 1HB ALA 7 -6.562 -2.159 -21.573 57 HB2 ALA 7 2HB ALA 7 -6.449 -3.687 -20.668 58 HB3 ALA 7 3HB ALA 7 -7.874 -3.358 -21.682 59 H ALA 8 HN ALA 8 -10.111 -1.220 -19.185 60 HA ALA 8 HA ALA 8 -11.227 -3.462 -17.906 61 HB1 ALA 8 1HB ALA 8 -12.913 -2.006 -17.407 62 HB2 ALA 8 2HB ALA 8 -11.750 -0.793 -17.994 63 HB3 ALA 8 3HB ALA 8 -13.026 -1.400 -19.077 64 H VAL 9 HN VAL 9 -10.612 -2.793 -21.206 65 HA VAL 9 HA VAL 9 -12.149 -5.098 -21.969 66 HB VAL 9 HB VAL 9 -13.396 -3.943 -23.728 67 HG11 VAL 9 1HG1 VAL 9 -14.395 -4.384 -21.474 68 HG12 VAL 9 2HG1 VAL 9 -13.982 -2.715 -21.015 69 HG13 VAL 9 3HG1 VAL 9 -15.133 -3.015 -22.340 70 HG21 VAL 9 3HG2 VAL 9 -11.673 -1.764 -23.084 71 HG22 VAL 9 1HG2 VAL 9 -12.900 -1.868 -24.369 72 HG23 VAL 9 2HG2 VAL 9 -13.346 -1.250 -22.761 73 H LEU 10 HN LEU 10 -11.776 -5.466 -24.462 74 HA LEU 10 HA LEU 10 -8.992 -5.486 -24.832 75 HB2 LEU 10 2HB LEU 10 -10.243 -7.240 -25.750 76 HB3 LEU 10 3HB LEU 10 -11.365 -6.155 -26.547 77 HG LEU 10 HG LEU 10 -9.153 -5.409 -27.847 78 HD11 LEU 10 1HD1 LEU 10 -8.314 -8.136 -28.052 79 HD12 LEU 10 2HD1 LEU 10 -7.372 -6.700 -27.585 80 HD13 LEU 10 3HD1 LEU 10 -8.240 -7.637 -26.345 81 HD21 LEU 10 3HD2 LEU 10 -10.187 -7.962 -28.901 82 HD22 LEU 10 1HD2 LEU 10 -11.430 -6.760 -28.478 83 HD23 LEU 10 2HD2 LEU 10 -10.143 -6.341 -29.634 84 H ILE 11 HN ILE 11 -7.910 -3.560 -24.947 85 HA ILE 11 HA ILE 11 -9.054 -1.483 -26.643 86 HB ILE 11 HB ILE 11 -6.560 -1.142 -25.040 87 HG12 ILE 11 2HG1 ILE 11 -9.308 -1.597 -23.927 88 HG13 ILE 11 3HG1 ILE 11 -7.756 -2.149 -23.330 89 HG21 ILE 11 1HG2 ILE 11 -7.075 1.093 -25.081 90 HG22 ILE 11 2HG2 ILE 11 -7.774 0.565 -26.631 91 HG23 ILE 11 3HG2 ILE 11 -8.826 0.806 -25.216 92 HD11 ILE 11 3HD1 ILE 11 -8.863 0.689 -23.220 93 HD12 ILE 11 1HD1 ILE 11 -8.504 -0.389 -21.850 94 HD13 ILE 11 2HD1 ILE 11 -7.175 0.285 -22.824 95 HA PRO 12 HA PRO 12 -6.276 -2.937 -29.709 96 HB2 PRO 12 2HB PRO 12 -7.376 -1.572 -31.805 97 HB3 PRO 12 3HB PRO 12 -7.937 -3.150 -31.289 98 HG2 PRO 12 2HG PRO 12 -9.195 -0.508 -30.871 99 HG3 PRO 12 3HG PRO 12 -9.918 -2.099 -30.751 100 HD2 PRO 12 2HD PRO 12 -9.125 -0.405 -28.576 101 HD3 PRO 12 3HD PRO 12 -9.741 -2.042 -28.459 102 H ILE 13 HN ILE 13 -4.849 -1.916 -31.480 103 HA ILE 13 HA ILE 13 -3.372 0.079 -30.125 104 HB ILE 13 HB ILE 13 -2.309 -1.595 -31.490 105 HG12 ILE 13 2HG1 ILE 13 -1.985 1.215 -32.579 106 HG13 ILE 13 3HG1 ILE 13 -1.147 0.520 -31.205 107 HG21 ILE 13 1HG2 ILE 13 -3.504 -2.261 -33.276 108 HG22 ILE 13 2HG2 ILE 13 -4.231 -0.656 -33.529 109 HG23 ILE 13 3HG2 ILE 13 -2.585 -0.991 -34.118 110 HD11 ILE 13 3HD1 ILE 13 -0.722 -1.324 -33.314 111 HD12 ILE 13 1HD1 ILE 13 -0.524 0.287 -34.044 112 HD13 ILE 13 2HD1 ILE 13 0.462 -0.179 -32.638 113 H ASN 14 HN ASN 14 -2.894 2.268 -30.913 114 HA ASN 14 HA ASN 14 -3.689 4.273 -31.282 115 HB2 ASN 14 2HB ASN 14 -4.458 4.632 -33.714 116 HB3 ASN 14 3HB ASN 14 -2.901 3.848 -33.529 117 HD21 ASN 14 1HD2 ASN 14 -2.558 1.952 -34.441 118 HD22 ASN 14 2HD2 ASN 14 -3.749 0.923 -35.165 119 H THR 15 HN THR 15 -5.535 3.130 -29.660 120 HA THR 15 HA THR 15 -8.119 3.789 -30.912 121 HB THR 15 HB THR 15 -7.375 1.547 -28.964 122 HG1 THR 15 HG1 THR 15 -7.030 1.160 -31.256 123 HG21 THR 15 3HG2 THR 15 -9.554 1.857 -28.225 124 HG22 THR 15 1HG2 THR 15 -9.998 2.829 -29.648 125 HG23 THR 15 2HG2 THR 15 -9.952 1.054 -29.763 126 H ALA 16 HN ALA 16 -9.043 5.542 -30.078 127 HA ALA 16 HA ALA 16 -7.988 6.979 -27.991 128 HB1 ALA 16 1HB ALA 16 -10.183 7.119 -29.790 129 HB2 ALA 16 2HB ALA 16 -10.848 7.360 -28.156 130 HB3 ALA 16 3HB ALA 16 -9.541 8.413 -28.750 131 H LEU 17 HN LEU 17 -8.031 6.828 -25.791 132 HA LEU 17 HA LEU 17 -9.406 4.548 -24.675 133 HB2 LEU 17 2HB LEU 17 -7.516 6.586 -23.493 134 HB3 LEU 17 3HB LEU 17 -8.209 5.246 -22.601 135 HG LEU 17 HG LEU 17 -6.522 4.871 -25.085 136 HD11 LEU 17 1HD1 LEU 17 -5.567 4.682 -22.218 137 HD12 LEU 17 2HD1 LEU 17 -4.606 4.481 -23.703 138 HD13 LEU 17 3HD1 LEU 17 -5.276 6.077 -23.285 139 HD21 LEU 17 3HD2 LEU 17 -7.803 2.933 -24.712 140 HD22 LEU 17 1HD2 LEU 17 -6.203 2.581 -24.016 141 HD23 LEU 17 2HD2 LEU 17 -7.563 3.007 -22.950 142 H THR 18 HN THR 18 -11.067 4.622 -23.117 143 HA THR 18 HA THR 18 -12.255 7.285 -22.714 144 HB THR 18 HB THR 18 -14.488 6.113 -23.009 145 HG1 THR 18 HG1 THR 18 -14.145 3.921 -22.874 146 HG21 THR 18 3HG2 THR 18 -14.245 5.617 -25.500 147 HG22 THR 18 1HG2 THR 18 -13.637 7.221 -25.026 148 HG23 THR 18 2HG2 THR 18 -12.494 5.889 -25.322 149 H VAL 19 HN VAL 19 -14.095 7.017 -20.926 150 HA VAL 19 HA VAL 19 -12.643 6.073 -18.631 151 HB VAL 19 HB VAL 19 -14.116 8.219 -19.004 152 HG11 VAL 19 1HG1 VAL 19 -16.389 7.946 -18.037 153 HG12 VAL 19 2HG1 VAL 19 -16.187 7.095 -19.588 154 HG13 VAL 19 3HG1 VAL 19 -16.160 6.181 -18.061 155 HG21 VAL 19 3HG2 VAL 19 -14.328 8.457 -16.623 156 HG22 VAL 19 1HG2 VAL 19 -14.303 6.692 -16.389 157 HG23 VAL 19 2HG2 VAL 19 -12.840 7.536 -16.950 158 H GLY 20 HN GLY 20 -14.895 4.788 -20.903 159 HA2 GLY 20 1HA GLY 20 -15.902 2.811 -18.968 160 HA3 GLY 20 2HA GLY 20 -16.579 3.174 -20.543 161 H MET 21 HN MET 21 -13.132 3.146 -20.630 162 HA MET 21 HA MET 21 -13.236 0.420 -21.668 163 HB2 MET 21 2HB MET 21 -11.968 2.973 -22.598 164 HB3 MET 21 3HB MET 21 -10.939 1.561 -22.741 165 HG2 MET 21 2HG MET 21 -13.374 0.610 -23.718 166 HG3 MET 21 3HG MET 21 -13.381 2.273 -24.270 167 HE1 MET 21 3HE MET 21 -11.231 3.364 -25.617 168 HE2 MET 21 1HE MET 21 -10.222 2.758 -24.282 169 HE3 MET 21 2HE MET 21 -9.771 2.408 -25.968 170 H MET 22 HN MET 22 -11.576 2.760 -19.565 171 HA MET 22 HA MET 22 -9.580 0.754 -18.935 172 HB2 MET 22 2HB MET 22 -9.905 3.722 -18.238 173 HB3 MET 22 3HB MET 22 -8.615 2.739 -17.575 174 HG2 MET 22 2HG MET 22 -7.678 2.320 -19.783 175 HG3 MET 22 3HG MET 22 -9.087 2.993 -20.579 176 HE1 MET 22 3HE MET 22 -9.474 5.458 -21.053 177 HE2 MET 22 1HE MET 22 -9.916 5.526 -19.331 178 HE3 MET 22 2HE MET 22 -8.839 6.764 -20.023 179 H THR 23 HN THR 23 -8.936 0.831 -16.419 180 HA THR 23 HA THR 23 -11.084 1.308 -14.611 181 HB THR 23 HB THR 23 -11.693 -0.875 -15.931 182 HG1 THR 23 HG1 THR 23 -12.737 -1.290 -13.998 183 HG21 THR 23 3HG2 THR 23 -9.098 -1.628 -15.064 184 HG22 THR 23 1HG2 THR 23 -10.211 -2.449 -13.944 185 HG23 THR 23 2HG2 THR 23 -10.356 -2.717 -15.698 186 H THR 24 HN THR 24 -10.490 0.396 -12.360 187 HA THR 24 HA THR 24 -7.565 0.637 -12.101 188 HB THR 24 HB THR 24 -8.063 1.726 -9.933 189 HG1 THR 24 HG1 THR 24 -10.044 0.429 -9.591 190 HG21 THR 24 3HG2 THR 24 -8.218 3.220 -11.966 191 HG22 THR 24 1HG2 THR 24 -9.948 2.816 -12.090 192 HG23 THR 24 2HG2 THR 24 -9.342 3.713 -10.676 193 H ARG 25 HN ARG 25 -6.441 -1.001 -11.235 194 HA ARG 25 HA ARG 25 -7.761 -2.754 -9.422 195 HB2 ARG 25 2HB ARG 25 -7.650 -3.454 -12.202 196 HB3 ARG 25 3HB ARG 25 -6.469 -4.466 -11.395 197 HG2 ARG 25 2HG ARG 25 -8.157 -5.797 -10.679 198 HG3 ARG 25 3HG ARG 25 -8.734 -4.477 -9.682 199 HD2 ARG 25 2HD ARG 25 -10.485 -4.019 -11.087 200 HD3 ARG 25 3HD ARG 25 -9.491 -4.156 -12.524 201 HE ARG 25 HE ARG 25 -9.697 -6.777 -11.743 202 HH11 ARG 25 2HH2 ARG 25 -12.139 -4.249 -12.196 203 HH12 ARG 25 1HH2 ARG 25 -13.393 -5.365 -12.624 204 HH22 ARG 25 HH1 ARG 25 -12.907 -7.711 -12.684 205 H VAL 26 HN VAL 26 -6.228 -3.887 -8.092 206 HA VAL 26 HA VAL 26 -3.601 -2.771 -8.149 207 HB VAL 26 HB VAL 26 -4.615 -5.033 -6.432 208 HG11 VAL 26 1HG1 VAL 26 -2.137 -4.178 -6.509 209 HG12 VAL 26 2HG1 VAL 26 -2.777 -2.821 -5.552 210 HG13 VAL 26 3HG1 VAL 26 -2.924 -4.487 -4.943 211 HG21 VAL 26 3HG2 VAL 26 -5.317 -2.118 -6.367 212 HG22 VAL 26 1HG2 VAL 26 -6.324 -3.544 -6.020 213 HG23 VAL 26 2HG2 VAL 26 -5.120 -2.993 -4.830 214 H VAL 27 HN VAL 27 -2.839 -3.471 -10.258 215 HA VAL 27 HA VAL 27 -2.327 -6.356 -10.394 216 HB VAL 27 HB VAL 27 -2.230 -6.138 -12.729 217 HG11 VAL 27 1HG1 VAL 27 -4.413 -4.146 -12.278 218 HG12 VAL 27 2HG1 VAL 27 -4.420 -5.665 -13.205 219 HG13 VAL 27 3HG1 VAL 27 -4.517 -5.706 -11.428 220 HG21 VAL 27 3HG2 VAL 27 -2.575 -3.697 -13.703 221 HG22 VAL 27 1HG2 VAL 27 -1.805 -3.226 -12.169 222 HG23 VAL 27 2HG2 VAL 27 -0.955 -4.311 -13.295 223 H SER 28 HN SER 28 -0.162 -6.992 -11.295 224 HA SER 28 HA SER 28 1.840 -4.980 -10.645 225 HB2 SER 28 2HB SER 28 1.373 -6.979 -8.922 226 HB3 SER 28 3HB SER 28 2.382 -7.882 -10.034 227 HG SER 28 HG SER 28 4.131 -6.807 -9.381 228 HA PRO 29 HA PRO 29 3.730 -4.727 -10.851 229 HB2 PRO 29 2HB PRO 29 5.219 -3.102 -12.467 230 HB3 PRO 29 3HB PRO 29 5.871 -4.521 -11.673 231 HG2 PRO 29 2HG PRO 29 5.150 -4.155 -14.517 232 HG3 PRO 29 3HG PRO 29 6.175 -5.378 -13.793 233 HD2 PRO 29 2HD PRO 29 3.473 -5.717 -14.694 234 HD3 PRO 29 3HD PRO 29 4.459 -6.906 -13.866 235 H THR 30 HN THR 30 3.239 -2.588 -10.166 236 HA THR 30 HA THR 30 0.760 -1.743 -11.217 237 HB THR 30 HB THR 30 1.341 0.264 -9.650 238 HG1 THR 30 HG1 THR 30 3.367 0.040 -8.652 239 HG21 THR 30 3HG2 THR 30 1.327 -1.170 -7.567 240 HG22 THR 30 1HG2 THR 30 0.062 -1.641 -8.727 241 HG23 THR 30 2HG2 THR 30 1.552 -2.605 -8.596 242 H GLY 31 HN GLY 31 0.334 -0.740 -13.070 243 HA2 GLY 31 1HA GLY 31 2.507 0.721 -14.386 244 HA3 GLY 31 2HA GLY 31 1.013 0.161 -15.110 245 H ILE 32 HN ILE 32 0.447 2.218 -15.984 246 HA ILE 32 HA ILE 32 0.552 4.640 -14.844 247 HB ILE 32 HB ILE 32 -1.638 3.444 -16.539 248 HG12 ILE 32 2HG1 ILE 32 0.778 5.131 -17.258 249 HG13 ILE 32 3HG1 ILE 32 0.631 3.403 -17.508 250 HG21 ILE 32 1HG2 ILE 32 -2.215 5.576 -15.178 251 HG22 ILE 32 2HG2 ILE 32 -1.119 6.397 -16.315 252 HG23 ILE 32 3HG2 ILE 32 -2.554 5.538 -16.925 253 HD11 ILE 32 3HD1 ILE 32 0.061 5.011 -19.496 254 HD12 ILE 32 1HD1 ILE 32 -1.030 3.642 -19.175 255 HD13 ILE 32 2HD1 ILE 32 -1.471 5.278 -18.631 256 HA PRO 33 HA PRO 33 -1.976 4.529 -11.340 257 HB2 PRO 33 2HB PRO 33 -2.241 7.207 -10.860 258 HB3 PRO 33 3HB PRO 33 -0.832 6.282 -10.381 259 HG2 PRO 33 2HG PRO 33 -1.123 8.192 -12.619 260 HG3 PRO 33 3HG PRO 33 0.344 7.594 -11.870 261 HD2 PRO 33 2HD PRO 33 -0.755 6.771 -14.388 262 HD3 PRO 33 3HD PRO 33 0.647 6.093 -13.585 263 H ALA 34 HN ALA 34 -4.097 4.702 -10.522 264 HA ALA 34 HA ALA 34 -6.004 4.671 -12.577 265 HB1 ALA 34 1HB ALA 34 -7.602 4.705 -10.586 266 HB2 ALA 34 2HB ALA 34 -6.383 3.408 -10.580 267 HB3 ALA 34 3HB ALA 34 -6.163 4.842 -9.548 268 H GLU 35 HN GLU 35 -4.366 7.261 -11.016 269 HA GLU 35 HA GLU 35 -6.550 9.087 -11.211 270 HB2 GLU 35 2HB GLU 35 -5.069 10.693 -10.252 271 HB3 GLU 35 3HB GLU 35 -4.666 9.174 -9.476 272 HG2 GLU 35 2HG GLU 35 -2.945 9.002 -11.555 273 HG3 GLU 35 3HG GLU 35 -3.096 10.747 -11.508 274 HE2 GLU 35 HE2 GLU 35 -3.352 10.736 -8.469 275 H ASP 36 HN ASP 36 -4.294 7.700 -13.378 276 HA ASP 36 HA ASP 36 -4.183 10.053 -15.039 277 HB2 ASP 36 2HB ASP 36 -2.735 7.474 -14.818 278 HB3 ASP 36 3HB ASP 36 -3.055 7.938 -16.478 279 HD2 ASP 36 HD2 ASP 36 -0.098 9.699 -16.274 280 H ILE 37 HN ILE 37 -6.296 7.495 -14.397 281 HA ILE 37 HA ILE 37 -6.979 6.457 -16.855 282 HB ILE 37 HB ILE 37 -8.237 6.760 -14.207 283 HG12 ILE 37 2HG1 ILE 37 -7.659 4.544 -16.164 284 HG13 ILE 37 3HG1 ILE 37 -7.029 4.778 -14.545 285 HG21 ILE 37 1HG2 ILE 37 -10.437 6.014 -14.932 286 HG22 ILE 37 2HG2 ILE 37 -10.043 7.596 -15.647 287 HG23 ILE 37 3HG2 ILE 37 -9.933 6.120 -16.636 288 HD11 ILE 37 3HD1 ILE 37 -9.327 4.391 -13.611 289 HD12 ILE 37 1HD1 ILE 37 -9.914 4.079 -15.262 290 HD13 ILE 37 2HD1 ILE 37 -8.714 2.992 -14.523 291 HA PRO 38 HA PRO 38 -9.796 10.223 -17.368 292 HB2 PRO 38 2HB PRO 38 -9.475 12.392 -15.737 293 HB3 PRO 38 3HB PRO 38 -10.679 11.150 -15.454 294 HG2 PRO 38 2HG PRO 38 -8.122 11.609 -14.043 295 HG3 PRO 38 3HG PRO 38 -9.509 10.673 -13.524 296 HD2 PRO 38 2HD PRO 38 -7.039 9.649 -14.560 297 HD3 PRO 38 3HD PRO 38 -8.468 8.721 -14.151 298 H ARG 39 HN ARG 39 -6.506 10.195 -16.989 299 HA ARG 39 HA ARG 39 -6.219 12.608 -18.549 300 HB2 ARG 39 2HB ARG 39 -4.165 10.775 -17.216 301 HB3 ARG 39 3HB ARG 39 -3.729 12.188 -18.156 302 HG2 ARG 39 2HG ARG 39 -5.000 13.650 -16.609 303 HG3 ARG 39 3HG ARG 39 -5.547 12.255 -15.701 304 HD2 ARG 39 2HD ARG 39 -3.687 13.116 -14.459 305 HD3 ARG 39 3HD ARG 39 -3.065 11.698 -15.280 306 HE ARG 39 HE ARG 39 -2.394 14.512 -15.875 307 HH11 ARG 39 2HH2 ARG 39 -2.211 11.142 -16.956 308 HH12 ARG 39 1HH2 ARG 39 -0.888 11.431 -18.036 309 HH22 ARG 39 HH1 ARG 39 0.014 13.644 -18.223 310 H LEU 40 HN LEU 40 -6.345 9.140 -18.832 311 HA LEU 40 HA LEU 40 -4.768 9.054 -21.250 312 HB2 LEU 40 2HB LEU 40 -6.360 6.956 -19.771 313 HB3 LEU 40 3HB LEU 40 -5.423 6.654 -21.221 314 HG LEU 40 HG LEU 40 -4.144 7.814 -18.746 315 HD11 LEU 40 1HD1 LEU 40 -3.460 5.144 -18.721 316 HD12 LEU 40 2HD1 LEU 40 -4.636 5.936 -17.645 317 HD13 LEU 40 3HD1 LEU 40 -5.195 5.108 -19.118 318 HD21 LEU 40 3HD2 LEU 40 -2.101 7.135 -19.682 319 HD22 LEU 40 1HD2 LEU 40 -2.893 6.069 -20.867 320 HD23 LEU 40 2HD2 LEU 40 -3.017 7.836 -21.038 321 H ILE 41 HN ILE 41 -8.085 9.559 -20.238 322 HA ILE 41 HA ILE 41 -9.444 8.617 -22.452 323 HB ILE 41 HB ILE 41 -10.064 11.033 -20.750 324 HG12 ILE 41 2HG1 ILE 41 -10.341 8.088 -20.276 325 HG13 ILE 41 3HG1 ILE 41 -9.845 9.357 -19.174 326 HG21 ILE 41 1HG2 ILE 41 -11.928 9.264 -22.356 327 HG22 ILE 41 2HG2 ILE 41 -12.369 10.688 -21.382 328 HG23 ILE 41 3HG2 ILE 41 -11.375 10.884 -22.846 329 HD11 ILE 41 3HD1 ILE 41 -12.678 8.987 -20.256 330 HD12 ILE 41 1HD1 ILE 41 -12.122 8.521 -18.630 331 HD13 ILE 41 2HD1 ILE 41 -12.163 10.237 -19.098 332 H SER 42 HN SER 42 -9.843 9.365 -24.515 333 HA SER 42 HA SER 42 -9.849 10.760 -26.224 334 HB2 SER 42 2HB SER 42 -9.754 12.649 -24.350 335 HB3 SER 42 3HB SER 42 -8.090 12.814 -24.876 336 HG SER 42 HG SER 42 -10.363 13.745 -26.075 337 H MET 43 HN MET 43 -7.191 9.512 -24.487 338 HA MET 43 HA MET 43 -5.338 10.111 -26.641 339 HB2 MET 43 2HB MET 43 -4.721 8.597 -24.060 340 HB3 MET 43 3HB MET 43 -3.603 9.498 -25.065 341 HG2 MET 43 2HG MET 43 -5.415 11.480 -24.405 342 HG3 MET 43 3HG MET 43 -5.476 10.486 -22.964 343 HE1 MET 43 3HE MET 43 -1.815 9.588 -23.605 344 HE2 MET 43 1HE MET 43 -1.866 10.121 -21.907 345 HE3 MET 43 2HE MET 43 -3.200 9.151 -22.577 346 H GLN 44 HN GLN 44 -4.582 8.540 -28.053 347 HA GLN 44 HA GLN 44 -5.909 5.991 -27.837 348 HB2 GLN 44 2HB GLN 44 -4.099 6.943 -30.090 349 HB3 GLN 44 3HB GLN 44 -5.300 5.668 -30.152 350 HG2 GLN 44 2HG GLN 44 -7.120 7.310 -29.823 351 HG3 GLN 44 3HG GLN 44 -5.955 8.604 -29.623 352 HE21 GLN 44 1HE2 GLN 44 -6.550 5.910 -31.884 353 HE22 GLN 44 2HE2 GLN 44 -6.379 6.814 -33.351 354 H VAL 45 HN VAL 45 -4.752 3.940 -27.948 355 HA VAL 45 HA VAL 45 -2.245 4.081 -26.540 356 HB VAL 45 HB VAL 45 -2.509 1.563 -26.626 357 HG11 VAL 45 1HG1 VAL 45 -4.783 3.157 -25.395 358 HG12 VAL 45 2HG1 VAL 45 -4.233 1.540 -24.896 359 HG13 VAL 45 3HG1 VAL 45 -3.163 2.947 -24.688 360 HG21 VAL 45 3HG2 VAL 45 -4.224 0.543 -27.682 361 HG22 VAL 45 1HG2 VAL 45 -5.382 1.829 -27.267 362 HG23 VAL 45 2HG2 VAL 45 -4.279 2.036 -28.649 363 H ASN 46 HN ASN 46 -0.302 2.886 -27.278 364 HA ASN 46 HA ASN 46 -0.102 3.133 -30.168 365 HB2 ASN 46 2HB ASN 46 2.336 3.369 -29.798 366 HB3 ASN 46 3HB ASN 46 1.475 4.525 -28.802 367 HD21 ASN 46 1HD2 ASN 46 2.532 4.763 -26.987 368 HD22 ASN 46 2HD2 ASN 46 3.139 3.511 -25.955 369 H GLN 47 HN GLN 47 -1.290 0.801 -28.738 370 HA GLN 47 HA GLN 47 0.020 -1.230 -30.067 371 HB2 GLN 47 2HB GLN 47 1.813 -1.289 -28.546 372 HB3 GLN 47 3HB GLN 47 0.807 -0.872 -27.174 373 HG2 GLN 47 2HG GLN 47 -0.253 -3.098 -27.210 374 HG3 GLN 47 3HG GLN 47 0.596 -3.519 -28.683 375 HE21 GLN 47 1HE2 GLN 47 1.634 -1.852 -25.715 376 HE22 GLN 47 2HE2 GLN 47 2.921 -2.932 -25.292 377 H VAL 48 HN VAL 48 -1.061 -3.362 -29.699 378 HA VAL 48 HA VAL 48 -3.813 -2.944 -29.077 379 HB VAL 48 HB VAL 48 -2.104 -5.184 -30.083 380 HG11 VAL 48 1HG1 VAL 48 -4.871 -5.449 -28.904 381 HG12 VAL 48 2HG1 VAL 48 -4.301 -6.538 -30.191 382 HG13 VAL 48 3HG1 VAL 48 -3.435 -6.466 -28.638 383 HG21 VAL 48 3HG2 VAL 48 -2.941 -3.507 -31.662 384 HG22 VAL 48 1HG2 VAL 48 -3.678 -5.097 -31.973 385 HG23 VAL 48 2HG2 VAL 48 -4.611 -3.832 -31.138 386 H VAL 49 HN VAL 49 -4.149 -2.488 -26.906 387 HA VAL 49 HA VAL 49 -2.923 -4.281 -24.966 388 HB VAL 49 HB VAL 49 -4.512 -1.724 -24.677 389 HG11 VAL 49 1HG1 VAL 49 -4.115 -1.778 -22.353 390 HG12 VAL 49 2HG1 VAL 49 -4.652 -3.425 -22.760 391 HG13 VAL 49 3HG1 VAL 49 -2.923 -3.092 -22.497 392 HG21 VAL 49 3HG2 VAL 49 -2.483 -1.021 -25.536 393 HG22 VAL 49 1HG2 VAL 49 -2.149 -0.995 -23.787 394 HG23 VAL 49 2HG2 VAL 49 -1.576 -2.355 -24.783 395 HA PRO 50 HA PRO 50 -6.714 -6.479 -25.007 396 HB2 PRO 50 2HB PRO 50 -5.865 -8.619 -23.536 397 HB3 PRO 50 3HB PRO 50 -5.664 -8.510 -25.273 398 HG2 PRO 50 2HG PRO 50 -3.638 -8.168 -23.148 399 HG3 PRO 50 3HG PRO 50 -3.396 -8.484 -24.855 400 HD2 PRO 50 2HD PRO 50 -3.065 -5.972 -23.511 401 HD3 PRO 50 3HD PRO 50 -2.937 -6.263 -25.234 402 H MET 51 HN MET 51 -8.364 -7.301 -23.485 403 HA MET 51 HA MET 51 -8.630 -5.399 -21.464 404 HB2 MET 51 2HB MET 51 -10.564 -6.492 -22.562 405 HB3 MET 51 3HB MET 51 -10.035 -8.070 -22.012 406 HG2 MET 51 2HG MET 51 -10.227 -7.040 -19.591 407 HG3 MET 51 3HG MET 51 -11.190 -5.795 -20.361 408 HE1 MET 51 3HE MET 51 -13.665 -6.334 -21.555 409 HE2 MET 51 1HE MET 51 -12.486 -7.074 -22.664 410 HE3 MET 51 2HE MET 51 -13.929 -7.987 -22.160 411 H GLY 52 HN GLY 52 -7.679 -5.326 -19.478 412 HA2 GLY 52 1HA GLY 52 -7.401 -6.387 -17.354 413 HA3 GLY 52 2HA GLY 52 -7.041 -7.895 -18.171 414 H THR 53 HN THR 53 -5.490 -5.995 -20.235 415 HA THR 53 HA THR 53 -2.944 -6.426 -18.999 416 HB THR 53 HB THR 53 -3.966 -5.269 -21.630 417 HG1 THR 53 HG1 THR 53 -3.813 -7.653 -20.925 418 HG21 THR 53 3HG2 THR 53 -1.749 -4.911 -22.388 419 HG22 THR 53 1HG2 THR 53 -1.675 -4.255 -20.735 420 HG23 THR 53 2HG2 THR 53 -1.046 -5.885 -21.074 421 H THR 54 HN THR 54 -1.951 -5.159 -17.574 422 HA THR 54 HA THR 54 -2.950 -2.769 -16.661 423 HB THR 54 HB THR 54 -0.006 -3.597 -16.741 424 HG1 THR 54 HG1 THR 54 -0.686 -5.234 -15.391 425 HG21 THR 54 3HG2 THR 54 -0.371 -1.454 -15.585 426 HG22 THR 54 1HG2 THR 54 -1.769 -2.127 -14.713 427 HG23 THR 54 2HG2 THR 54 -0.129 -2.720 -14.358 428 H LEU 55 HN LEU 55 -2.710 -0.603 -17.090 429 HA LEU 55 HA LEU 55 -1.884 -0.028 -19.792 430 HB2 LEU 55 2HB LEU 55 -3.884 0.882 -18.189 431 HB3 LEU 55 3HB LEU 55 -2.702 2.161 -17.993 432 HG LEU 55 HG LEU 55 -3.738 3.032 -19.790 433 HD11 LEU 55 1HD1 LEU 55 -2.571 2.711 -21.789 434 HD12 LEU 55 2HD1 LEU 55 -1.416 2.220 -20.527 435 HD13 LEU 55 3HD1 LEU 55 -2.291 0.984 -21.462 436 HD21 LEU 55 3HD2 LEU 55 -4.906 0.369 -19.959 437 HD22 LEU 55 1HD2 LEU 55 -5.608 1.959 -20.343 438 HD23 LEU 55 2HD2 LEU 55 -4.641 1.096 -21.562 439 H MET 56 HN MET 56 0.016 0.889 -20.422 440 HA MET 56 HA MET 56 1.792 1.652 -18.237 441 HB2 MET 56 2HB MET 56 2.237 0.435 -21.000 442 HB3 MET 56 3HB MET 56 3.555 1.252 -20.184 443 HG2 MET 56 2HG MET 56 1.984 -0.852 -18.675 444 HG3 MET 56 3HG MET 56 3.177 -1.367 -19.851 445 HE1 MET 56 3HE MET 56 2.543 -0.959 -16.455 446 HE2 MET 56 1HE MET 56 3.895 -0.126 -15.651 447 HE3 MET 56 2HE MET 56 2.660 0.816 -16.521 448 HA PRO 57 HA PRO 57 2.071 5.637 -19.931 449 HB2 PRO 57 2HB PRO 57 4.590 6.426 -19.223 450 HB3 PRO 57 3HB PRO 57 3.236 6.434 -18.112 451 HG2 PRO 57 2HG PRO 57 5.503 4.542 -18.257 452 HG3 PRO 57 3HG PRO 57 4.394 4.827 -16.930 453 HD2 PRO 57 2HD PRO 57 4.361 2.609 -18.748 454 HD3 PRO 57 3HD PRO 57 3.185 2.955 -17.496 455 H ASP 58 HN ASP 58 4.352 3.290 -20.951 456 HA ASP 58 HA ASP 58 5.078 4.985 -23.175 457 HB2 ASP 58 2HB ASP 58 6.309 2.796 -21.709 458 HB3 ASP 58 3HB ASP 58 6.231 2.369 -23.406 459 HD2 ASP 58 HD2 ASP 58 7.229 4.354 -24.825 460 H MET 59 HN MET 59 2.398 3.407 -22.539 461 HA MET 59 HA MET 59 2.347 1.935 -25.060 462 HB2 MET 59 2HB MET 59 1.153 1.450 -22.328 463 HB3 MET 59 3HB MET 59 0.173 0.972 -23.700 464 HG2 MET 59 2HG MET 59 2.473 -0.148 -24.527 465 HG3 MET 59 3HG MET 59 2.854 -0.104 -22.818 466 HE1 MET 59 3HE MET 59 -0.699 -1.740 -21.615 467 HE2 MET 59 1HE MET 59 0.727 -0.871 -21.000 468 HE3 MET 59 2HE MET 59 -0.417 -0.047 -22.085 469 H VAL 60 HN VAL 60 1.645 4.882 -23.924 470 HA VAL 60 HA VAL 60 -0.858 5.021 -25.449 471 HB VAL 60 HB VAL 60 -0.192 6.564 -22.935 472 HG11 VAL 60 1HG1 VAL 60 -1.608 7.805 -24.513 473 HG12 VAL 60 2HG1 VAL 60 -2.746 6.437 -24.576 474 HG13 VAL 60 3HG1 VAL 60 -2.518 7.337 -23.057 475 HG21 VAL 60 3HG2 VAL 60 -2.481 4.671 -22.982 476 HG22 VAL 60 1HG2 VAL 60 -0.856 3.943 -22.954 477 HG23 VAL 60 2HG2 VAL 60 -1.347 5.075 -21.671 478 H LYS 61 HN LYS 61 -0.984 6.697 -26.935 479 HA LYS 61 HA LYS 61 1.521 8.040 -27.442 480 HB2 LYS 61 2HB LYS 61 -1.091 7.956 -28.980 481 HB3 LYS 61 3HB LYS 61 0.359 8.779 -29.519 482 HG2 LYS 61 2HG LYS 61 1.566 6.486 -29.180 483 HG3 LYS 61 3HG LYS 61 -0.042 5.794 -29.090 484 HD2 LYS 61 2HD LYS 61 0.117 7.599 -31.374 485 HD3 LYS 61 3HD LYS 61 1.439 6.451 -31.441 486 HE2 LYS 61 2HE LYS 61 -0.005 4.580 -31.552 487 HE3 LYS 61 3HE LYS 61 -1.342 5.435 -30.808 488 HZ1 LYS 61 2HZ LYS 61 -0.371 6.418 -33.397 489 HZ3 LYS 61 1HZ LYS 61 -1.885 6.447 -32.797 490 H GLY 62 HN GLY 62 1.768 10.346 -27.588 491 HA2 GLY 62 1HA GLY 62 1.522 12.437 -26.806 492 HA3 GLY 62 2HA GLY 62 -0.198 12.228 -27.072 493 H TYR 63 HN TYR 63 1.272 9.901 -24.913 494 HA TYR 63 HA TYR 63 -0.256 10.979 -22.723 495 HB2 TYR 63 2HB TYR 63 -0.186 8.558 -23.076 496 HB3 TYR 63 3HB TYR 63 1.545 8.577 -23.345 497 HD1 TYR 63 HD2 TYR 63 3.112 8.810 -21.423 498 HD2 TYR 63 HD1 TYR 63 -1.110 8.422 -20.850 499 HE1 TYR 63 HE2 TYR 63 3.492 8.208 -18.982 500 HE2 TYR 63 HE1 TYR 63 -0.716 7.821 -18.411 501 HH TYR 63 HH TYR 63 2.282 8.291 -16.901 502 H ALA 64 HN ALA 64 0.911 10.845 -20.450 503 HA ALA 64 HA ALA 64 3.594 11.231 -20.137 504 HB1 ALA 64 1HB ALA 64 2.854 13.989 -19.868 505 HB2 ALA 64 2HB ALA 64 4.088 13.270 -20.932 506 HB3 ALA 64 3HB ALA 64 2.414 13.453 -21.508 507 HA PRO 65 HA PRO 65 2.032 11.314 -16.104 508 HB2 PRO 65 2HB PRO 65 4.262 11.982 -14.672 509 HB3 PRO 65 3HB PRO 65 3.951 10.361 -15.261 510 HG2 PRO 65 2HG PRO 65 5.856 12.373 -16.292 511 HG3 PRO 65 3HG PRO 65 5.825 10.644 -16.575 512 HD2 PRO 65 2HD PRO 65 4.977 12.696 -18.391 513 HD3 PRO 65 3HD PRO 65 4.839 10.965 -18.627 514 H ALA 66 HN ALA 66 1.631 12.592 -14.094 515 HA ALA 66 HA ALA 66 1.933 15.443 -14.649 516 HB1 ALA 66 1HB ALA 66 -0.527 15.621 -13.800 517 HB2 ALA 66 2HB ALA 66 -0.241 15.147 -15.492 518 HB3 ALA 66 3HB ALA 66 -0.648 13.911 -14.277 Start of MODEL 5 1 H1 MET 0 HN MET 0 1.684 -0.123 1.202 2 HA MET 0 HA MET 0 1.138 1.284 -0.606 3 HB2 MET 0 2HB MET 0 2.983 0.317 -2.309 4 HB3 MET 0 3HB MET 0 3.463 0.926 -0.738 5 HG2 MET 0 2HG MET 0 4.533 -1.238 -1.048 6 HG3 MET 0 3HG MET 0 3.300 -1.429 0.181 7 HE1 MET 0 3HE MET 0 4.319 -3.896 -2.852 8 HE2 MET 0 1HE MET 0 3.644 -2.739 -4.023 9 HE3 MET 0 2HE MET 0 4.833 -2.192 -2.817 10 H ASN 1 HN ASN 1 -1.122 -0.263 -0.730 11 HA ASN 1 HA ASN 1 -1.153 -1.738 -3.161 12 HB2 ASN 1 2HB ASN 1 -3.460 -0.797 -1.375 13 HB3 ASN 1 3HB ASN 1 -3.599 -1.988 -2.653 14 HD21 ASN 1 1HD2 ASN 1 -4.250 -3.622 -1.324 15 HD22 ASN 1 2HD2 ASN 1 -3.220 -4.419 -0.182 16 H GLN 2 HN GLN 2 -0.629 -0.145 -4.813 17 HA GLN 2 HA GLN 2 -2.448 2.111 -4.965 18 HB2 GLN 2 2HB GLN 2 -0.814 3.231 -6.240 19 HB3 GLN 2 3HB GLN 2 0.141 2.330 -5.080 20 HG2 GLN 2 2HG GLN 2 1.229 1.861 -7.123 21 HG3 GLN 2 3HG GLN 2 0.224 0.445 -6.888 22 HE21 GLN 2 1HE2 GLN 2 -0.354 3.772 -8.035 23 HE22 GLN 2 2HE2 GLN 2 -1.112 3.357 -9.536 24 H GLU 3 HN GLU 3 -3.936 2.338 -6.635 25 HA GLU 3 HA GLU 3 -4.402 -0.003 -8.173 26 HB2 GLU 3 2HB GLU 3 -5.798 2.615 -7.702 27 HB3 GLU 3 3HB GLU 3 -6.207 1.746 -9.168 28 HG2 GLU 3 2HG GLU 3 -6.867 -0.234 -7.911 29 HG3 GLU 3 3HG GLU 3 -6.206 0.415 -6.423 30 HE2 GLU 3 HE2 GLU 3 -9.015 0.272 -5.841 31 H SER 4 HN SER 4 -4.151 -0.299 -10.419 32 HA SER 4 HA SER 4 -2.804 1.910 -11.766 33 HB2 SER 4 2HB SER 4 -2.133 -0.758 -12.813 34 HB3 SER 4 3HB SER 4 -1.074 0.577 -12.405 35 HG SER 4 HG SER 4 -0.585 -0.418 -10.583 36 H VAL 5 HN VAL 5 -3.366 2.226 -13.998 37 HA VAL 5 HA VAL 5 -5.969 1.630 -14.688 38 HB VAL 5 HB VAL 5 -3.558 2.395 -16.337 39 HG11 VAL 5 1HG1 VAL 5 -5.034 2.967 -18.156 40 HG12 VAL 5 2HG1 VAL 5 -5.308 1.263 -17.721 41 HG13 VAL 5 3HG1 VAL 5 -6.465 2.511 -17.201 42 HG21 VAL 5 3HG2 VAL 5 -4.944 3.839 -14.444 43 HG22 VAL 5 1HG2 VAL 5 -3.984 4.530 -15.774 44 HG23 VAL 5 2HG2 VAL 5 -5.743 4.326 -15.958 45 H VAL 6 HN VAL 6 -6.989 -0.016 -15.806 46 HA VAL 6 HA VAL 6 -5.288 -2.102 -16.933 47 HB VAL 6 HB VAL 6 -7.449 -2.507 -14.858 48 HG11 VAL 6 1HG1 VAL 6 -7.107 -4.143 -17.001 49 HG12 VAL 6 2HG1 VAL 6 -5.933 -4.848 -15.864 50 HG13 VAL 6 3HG1 VAL 6 -7.644 -4.697 -15.397 51 HG21 VAL 6 3HG2 VAL 6 -5.671 -2.279 -13.492 52 HG22 VAL 6 1HG2 VAL 6 -5.246 -3.918 -14.041 53 HG23 VAL 6 2HG2 VAL 6 -4.499 -2.499 -14.814 54 H ALA 7 HN ALA 7 -6.000 -2.697 -18.924 55 HA ALA 7 HA ALA 7 -8.060 -1.368 -20.176 56 HB1 ALA 7 1HB ALA 7 -6.523 -2.352 -21.610 57 HB2 ALA 7 2HB ALA 7 -6.475 -3.874 -20.687 58 HB3 ALA 7 3HB ALA 7 -7.870 -3.510 -21.731 59 H ALA 8 HN ALA 8 -10.079 -1.311 -19.222 60 HA ALA 8 HA ALA 8 -11.236 -3.505 -17.920 61 HB1 ALA 8 1HB ALA 8 -12.834 -1.980 -17.415 62 HB2 ALA 8 2HB ALA 8 -11.740 -0.806 -18.186 63 HB3 ALA 8 3HB ALA 8 -13.072 -1.528 -19.120 64 H VAL 9 HN VAL 9 -10.631 -2.891 -21.247 65 HA VAL 9 HA VAL 9 -12.130 -5.231 -21.961 66 HB VAL 9 HB VAL 9 -13.441 -4.134 -23.705 67 HG11 VAL 9 1HG1 VAL 9 -14.002 -2.871 -21.003 68 HG12 VAL 9 2HG1 VAL 9 -15.171 -3.224 -22.297 69 HG13 VAL 9 3HG1 VAL 9 -14.382 -4.558 -21.422 70 HG21 VAL 9 3HG2 VAL 9 -11.871 -2.133 -23.883 71 HG22 VAL 9 1HG2 VAL 9 -13.614 -1.784 -23.965 72 HG23 VAL 9 2HG2 VAL 9 -12.714 -1.471 -22.462 73 H LEU 10 HN LEU 10 -11.822 -5.553 -24.497 74 HA LEU 10 HA LEU 10 -9.051 -5.588 -24.911 75 HB2 LEU 10 2HB LEU 10 -10.335 -7.291 -25.872 76 HB3 LEU 10 3HB LEU 10 -11.456 -6.166 -26.614 77 HG LEU 10 HG LEU 10 -9.217 -5.412 -27.899 78 HD11 LEU 10 1HD1 LEU 10 -7.595 -6.981 -28.153 79 HD12 LEU 10 2HD1 LEU 10 -8.112 -7.398 -26.502 80 HD13 LEU 10 3HD1 LEU 10 -8.707 -8.345 -27.887 81 HD21 LEU 10 3HD2 LEU 10 -11.566 -6.758 -28.524 82 HD22 LEU 10 1HD2 LEU 10 -10.379 -6.091 -29.671 83 HD23 LEU 10 2HD2 LEU 10 -10.280 -7.800 -29.181 84 H ILE 11 HN ILE 11 -7.885 -3.730 -25.063 85 HA ILE 11 HA ILE 11 -9.031 -1.569 -26.664 86 HB ILE 11 HB ILE 11 -6.539 -1.291 -25.046 87 HG12 ILE 11 2HG1 ILE 11 -9.303 -1.714 -23.946 88 HG13 ILE 11 3HG1 ILE 11 -7.772 -2.351 -23.380 89 HG21 ILE 11 1HG2 ILE 11 -7.552 0.497 -26.565 90 HG22 ILE 11 2HG2 ILE 11 -8.846 0.630 -25.349 91 HG23 ILE 11 3HG2 ILE 11 -7.159 0.967 -24.894 92 HD11 ILE 11 3HD1 ILE 11 -8.649 -0.543 -21.895 93 HD12 ILE 11 1HD1 ILE 11 -7.075 -0.114 -22.606 94 HD13 ILE 11 2HD1 ILE 11 -8.571 0.594 -23.262 95 HA PRO 12 HA PRO 12 -6.249 -3.016 -29.739 96 HB2 PRO 12 2HB PRO 12 -7.376 -1.672 -31.835 97 HB3 PRO 12 3HB PRO 12 -7.909 -3.258 -31.316 98 HG2 PRO 12 2HG PRO 12 -9.211 -0.637 -30.899 99 HG3 PRO 12 3HG PRO 12 -9.907 -2.241 -30.776 100 HD2 PRO 12 2HD PRO 12 -9.139 -0.531 -28.604 101 HD3 PRO 12 3HD PRO 12 -9.726 -2.178 -28.484 102 H ILE 13 HN ILE 13 -4.825 -1.987 -31.495 103 HA ILE 13 HA ILE 13 -3.378 0.029 -30.153 104 HB ILE 13 HB ILE 13 -2.288 -1.604 -31.530 105 HG12 ILE 13 2HG1 ILE 13 -1.997 1.083 -32.893 106 HG13 ILE 13 3HG1 ILE 13 -1.372 0.750 -31.291 107 HG21 ILE 13 1HG2 ILE 13 -3.503 -2.320 -33.284 108 HG22 ILE 13 2HG2 ILE 13 -4.268 -0.733 -33.546 109 HG23 ILE 13 3HG2 ILE 13 -2.624 -1.041 -34.156 110 HD11 ILE 13 3HD1 ILE 13 -0.698 -1.176 -33.516 111 HD12 ILE 13 1HD1 ILE 13 0.154 0.385 -33.439 112 HD13 ILE 13 2HD1 ILE 13 0.247 -0.748 -32.069 113 H ASN 14 HN ASN 14 -2.934 2.230 -30.934 114 HA ASN 14 HA ASN 14 -3.755 4.227 -31.283 115 HB2 ASN 14 2HB ASN 14 -4.556 4.596 -33.698 116 HB3 ASN 14 3HB ASN 14 -2.997 3.812 -33.546 117 HD21 ASN 14 1HD2 ASN 14 -2.667 1.952 -34.522 118 HD22 ASN 14 2HD2 ASN 14 -3.870 0.917 -35.217 119 H THR 15 HN THR 15 -5.566 3.025 -29.646 120 HA THR 15 HA THR 15 -8.180 3.638 -30.863 121 HB THR 15 HB THR 15 -7.386 1.482 -28.837 122 HG1 THR 15 HG1 THR 15 -6.965 1.003 -31.093 123 HG21 THR 15 3HG2 THR 15 -9.589 1.651 -28.176 124 HG22 THR 15 1HG2 THR 15 -10.009 2.695 -29.555 125 HG23 THR 15 2HG2 THR 15 -9.947 0.928 -29.763 126 H ALA 16 HN ALA 16 -9.145 5.380 -30.053 127 HA ALA 16 HA ALA 16 -8.085 6.904 -28.030 128 HB1 ALA 16 1HB ALA 16 -9.593 8.063 -29.323 129 HB2 ALA 16 2HB ALA 16 -10.714 6.686 -29.445 130 HB3 ALA 16 3HB ALA 16 -10.662 7.663 -27.958 131 H LEU 17 HN LEU 17 -8.113 6.845 -25.821 132 HA LEU 17 HA LEU 17 -9.380 4.547 -24.614 133 HB2 LEU 17 2HB LEU 17 -7.541 6.687 -23.539 134 HB3 LEU 17 3HB LEU 17 -8.185 5.371 -22.578 135 HG LEU 17 HG LEU 17 -6.481 4.976 -25.051 136 HD11 LEU 17 1HD1 LEU 17 -5.651 4.956 -22.136 137 HD12 LEU 17 2HD1 LEU 17 -4.632 4.468 -23.512 138 HD13 LEU 17 3HD1 LEU 17 -5.183 6.154 -23.367 139 HD21 LEU 17 3HD2 LEU 17 -7.635 2.991 -24.785 140 HD22 LEU 17 1HD2 LEU 17 -6.157 2.695 -23.838 141 HD23 LEU 17 2HD2 LEU 17 -7.674 3.123 -23.010 142 H THR 18 HN THR 18 -11.083 4.587 -23.136 143 HA THR 18 HA THR 18 -12.312 7.225 -22.703 144 HB THR 18 HB THR 18 -14.529 5.915 -22.996 145 HG1 THR 18 HG1 THR 18 -13.797 3.768 -22.985 146 HG21 THR 18 3HG2 THR 18 -13.948 7.310 -24.879 147 HG22 THR 18 1HG2 THR 18 -12.562 6.277 -25.304 148 HG23 THR 18 2HG2 THR 18 -14.222 5.691 -25.566 149 H VAL 19 HN VAL 19 -14.099 7.002 -20.922 150 HA VAL 19 HA VAL 19 -12.705 5.973 -18.640 151 HB VAL 19 HB VAL 19 -14.162 8.132 -18.985 152 HG11 VAL 19 1HG1 VAL 19 -16.211 6.875 -19.618 153 HG12 VAL 19 2HG1 VAL 19 -16.252 6.169 -17.985 154 HG13 VAL 19 3HG1 VAL 19 -16.449 7.925 -18.201 155 HG21 VAL 19 3HG2 VAL 19 -13.246 6.645 -16.750 156 HG22 VAL 19 1HG2 VAL 19 -13.609 8.385 -16.841 157 HG23 VAL 19 2HG2 VAL 19 -14.876 7.235 -16.348 158 H GLY 20 HN GLY 20 -14.886 4.712 -20.974 159 HA2 GLY 20 1HA GLY 20 -15.944 2.713 -19.086 160 HA3 GLY 20 2HA GLY 20 -16.594 3.103 -20.666 161 H MET 21 HN MET 21 -13.145 3.073 -20.694 162 HA MET 21 HA MET 21 -13.229 0.355 -21.755 163 HB2 MET 21 2HB MET 21 -11.991 2.921 -22.687 164 HB3 MET 21 3HB MET 21 -10.941 1.524 -22.824 165 HG2 MET 21 2HG MET 21 -13.314 0.500 -23.819 166 HG3 MET 21 3HG MET 21 -13.432 2.173 -24.327 167 HE1 MET 21 3HE MET 21 -10.965 3.305 -24.742 168 HE2 MET 21 1HE MET 21 -9.699 2.133 -24.302 169 HE3 MET 21 2HE MET 21 -9.892 2.640 -25.997 170 H MET 22 HN MET 22 -11.543 2.731 -19.696 171 HA MET 22 HA MET 22 -9.561 0.720 -19.039 172 HB2 MET 22 2HB MET 22 -9.862 3.708 -18.427 173 HB3 MET 22 3HB MET 22 -8.592 2.738 -17.707 174 HG2 MET 22 2HG MET 22 -7.599 2.254 -19.861 175 HG3 MET 22 3HG MET 22 -9.003 2.847 -20.726 176 HE1 MET 22 3HE MET 22 -9.586 5.270 -21.149 177 HE2 MET 22 1HE MET 22 -9.859 5.479 -19.403 178 HE3 MET 22 2HE MET 22 -8.870 6.658 -20.296 179 H THR 23 HN THR 23 -8.898 0.838 -16.531 180 HA THR 23 HA THR 23 -11.027 1.366 -14.715 181 HB THR 23 HB THR 23 -11.504 -0.918 -16.070 182 HG1 THR 23 HG1 THR 23 -12.885 -1.024 -14.330 183 HG21 THR 23 3HG2 THR 23 -10.734 -2.835 -14.628 184 HG22 THR 23 1HG2 THR 23 -9.376 -2.053 -15.473 185 HG23 THR 23 2HG2 THR 23 -9.666 -1.714 -13.750 186 H THR 24 HN THR 24 -10.421 0.471 -12.453 187 HA THR 24 HA THR 24 -7.495 0.720 -12.219 188 HB THR 24 HB THR 24 -8.024 1.760 -10.002 189 HG1 THR 24 HG1 THR 24 -10.090 0.505 -9.852 190 HG21 THR 24 3HG2 THR 24 -9.723 2.949 -12.259 191 HG22 THR 24 1HG2 THR 24 -9.211 3.803 -10.784 192 HG23 THR 24 2HG2 THR 24 -7.999 3.302 -11.988 193 H ARG 25 HN ARG 25 -6.331 -0.783 -11.113 194 HA ARG 25 HA ARG 25 -7.612 -2.561 -9.353 195 HB2 ARG 25 2HB ARG 25 -7.575 -3.318 -12.127 196 HB3 ARG 25 3HB ARG 25 -6.394 -4.329 -11.316 197 HG2 ARG 25 2HG ARG 25 -8.093 -5.617 -10.548 198 HG3 ARG 25 3HG ARG 25 -8.620 -4.270 -9.559 199 HD2 ARG 25 2HD ARG 25 -10.403 -3.817 -10.921 200 HD3 ARG 25 3HD ARG 25 -9.443 -3.963 -12.379 201 HE ARG 25 HE ARG 25 -9.642 -6.577 -11.645 202 HH11 ARG 25 2HH2 ARG 25 -12.115 -4.047 -11.845 203 HH12 ARG 25 1HH2 ARG 25 -13.398 -5.156 -12.200 204 HH22 ARG 25 HH1 ARG 25 -12.916 -7.499 -12.352 205 H VAL 26 HN VAL 26 -6.039 -3.697 -8.063 206 HA VAL 26 HA VAL 26 -3.402 -2.595 -8.246 207 HB VAL 26 HB VAL 26 -4.387 -4.766 -6.398 208 HG11 VAL 26 1HG1 VAL 26 -1.892 -3.817 -6.650 209 HG12 VAL 26 2HG1 VAL 26 -2.543 -2.582 -5.546 210 HG13 VAL 26 3HG1 VAL 26 -2.582 -4.300 -5.082 211 HG21 VAL 26 3HG2 VAL 26 -4.813 -2.671 -4.862 212 HG22 VAL 26 1HG2 VAL 26 -5.021 -1.830 -6.417 213 HG23 VAL 26 2HG2 VAL 26 -6.058 -3.218 -6.010 214 H VAL 27 HN VAL 27 -2.770 -3.406 -10.371 215 HA VAL 27 HA VAL 27 -2.269 -6.297 -10.379 216 HB VAL 27 HB VAL 27 -2.297 -6.205 -12.725 217 HG11 VAL 27 1HG1 VAL 27 -4.516 -5.877 -11.442 218 HG12 VAL 27 2HG1 VAL 27 -4.459 -4.207 -12.054 219 HG13 VAL 27 3HG1 VAL 27 -4.505 -5.572 -13.196 220 HG21 VAL 27 3HG2 VAL 27 -2.066 -3.204 -12.413 221 HG22 VAL 27 1HG2 VAL 27 -0.971 -4.323 -13.259 222 HG23 VAL 27 2HG2 VAL 27 -2.578 -3.970 -13.937 223 H SER 28 HN SER 28 -0.157 -7.006 -11.304 224 HA SER 28 HA SER 28 1.878 -4.967 -10.865 225 HB2 SER 28 2HB SER 28 1.506 -6.912 -9.063 226 HB3 SER 28 3HB SER 28 2.444 -7.855 -10.204 227 HG SER 28 HG SER 28 4.164 -6.313 -10.044 228 HA PRO 29 HA PRO 29 3.747 -4.711 -11.188 229 HB2 PRO 29 2HB PRO 29 5.134 -3.129 -12.932 230 HB3 PRO 29 3HB PRO 29 5.838 -4.522 -12.134 231 HG2 PRO 29 2HG PRO 29 4.956 -4.244 -14.942 232 HG3 PRO 29 3HG PRO 29 6.027 -5.441 -14.241 233 HD2 PRO 29 2HD PRO 29 3.281 -5.817 -14.979 234 HD3 PRO 29 3HD PRO 29 4.318 -6.977 -14.172 235 H THR 30 HN THR 30 3.283 -2.554 -10.541 236 HA THR 30 HA THR 30 0.751 -1.745 -11.525 237 HB THR 30 HB THR 30 1.248 0.210 -9.939 238 HG1 THR 30 HG1 THR 30 3.336 -0.149 -8.792 239 HG21 THR 30 3HG2 THR 30 1.396 -1.157 -7.880 240 HG22 THR 30 1HG2 THR 30 0.290 -1.945 -9.030 241 HG23 THR 30 2HG2 THR 30 1.948 -2.558 -8.828 242 H GLY 31 HN GLY 31 0.231 -0.625 -13.287 243 HA2 GLY 31 1HA GLY 31 2.389 0.770 -14.703 244 HA3 GLY 31 2HA GLY 31 0.843 0.269 -15.358 245 H ILE 32 HN ILE 32 0.342 2.375 -16.179 246 HA ILE 32 HA ILE 32 0.568 4.761 -14.964 247 HB ILE 32 HB ILE 32 -1.688 3.708 -16.668 248 HG12 ILE 32 2HG1 ILE 32 0.546 5.511 -17.570 249 HG13 ILE 32 3HG1 ILE 32 0.809 3.783 -17.448 250 HG21 ILE 32 1HG2 ILE 32 -2.153 5.823 -15.239 251 HG22 ILE 32 2HG2 ILE 32 -1.035 6.628 -16.366 252 HG23 ILE 32 3HG2 ILE 32 -2.514 5.852 -16.982 253 HD11 ILE 32 3HD1 ILE 32 -0.564 3.303 -19.230 254 HD12 ILE 32 1HD1 ILE 32 -1.722 4.590 -18.815 255 HD13 ILE 32 2HD1 ILE 32 -0.214 4.992 -19.669 256 HA PRO 33 HA PRO 33 -1.928 4.628 -11.437 257 HB2 PRO 33 2HB PRO 33 -2.084 7.296 -10.865 258 HB3 PRO 33 3HB PRO 33 -0.707 6.302 -10.433 259 HG2 PRO 33 2HG PRO 33 -0.945 8.296 -12.603 260 HG3 PRO 33 3HG PRO 33 0.505 7.617 -11.890 261 HD2 PRO 33 2HD PRO 33 -0.650 6.923 -14.422 262 HD3 PRO 33 3HD PRO 33 0.732 6.164 -13.658 263 H ALA 34 HN ALA 34 -4.036 4.749 -10.646 264 HA ALA 34 HA ALA 34 -5.948 4.934 -12.681 265 HB1 ALA 34 1HB ALA 34 -7.534 4.885 -10.665 266 HB2 ALA 34 2HB ALA 34 -6.380 3.536 -10.800 267 HB3 ALA 34 3HB ALA 34 -6.073 4.859 -9.649 268 H GLU 35 HN GLU 35 -4.281 7.347 -10.840 269 HA GLU 35 HA GLU 35 -6.391 9.239 -10.886 270 HB2 GLU 35 2HB GLU 35 -4.862 10.712 -9.831 271 HB3 GLU 35 3HB GLU 35 -4.404 9.126 -9.242 272 HG2 GLU 35 2HG GLU 35 -2.776 9.136 -11.355 273 HG3 GLU 35 3HG GLU 35 -2.994 10.873 -11.271 274 HE2 GLU 35 HE2 GLU 35 -1.710 9.543 -7.754 275 H ASP 36 HN ASP 36 -4.577 7.878 -13.330 276 HA ASP 36 HA ASP 36 -4.474 10.382 -14.811 277 HB2 ASP 36 2HB ASP 36 -3.072 7.705 -15.238 278 HB3 ASP 36 3HB ASP 36 -3.011 9.008 -16.408 279 HD2 ASP 36 HD2 ASP 36 -0.050 9.748 -14.780 280 H ILE 37 HN ILE 37 -6.430 7.736 -14.216 281 HA ILE 37 HA ILE 37 -7.066 6.647 -16.656 282 HB ILE 37 HB ILE 37 -8.360 6.959 -14.027 283 HG12 ILE 37 2HG1 ILE 37 -7.786 4.696 -15.946 284 HG13 ILE 37 3HG1 ILE 37 -7.032 5.024 -14.399 285 HG21 ILE 37 1HG2 ILE 37 -10.524 6.105 -14.775 286 HG22 ILE 37 2HG2 ILE 37 -10.186 7.708 -15.471 287 HG23 ILE 37 3HG2 ILE 37 -10.004 6.247 -16.471 288 HD11 ILE 37 3HD1 ILE 37 -9.310 4.682 -13.302 289 HD12 ILE 37 1HD1 ILE 37 -9.905 4.130 -14.886 290 HD13 ILE 37 2HD1 ILE 37 -8.615 3.227 -14.056 291 HA PRO 38 HA PRO 38 -9.993 10.314 -17.266 292 HB2 PRO 38 2HB PRO 38 -9.747 12.526 -15.680 293 HB3 PRO 38 3HB PRO 38 -10.916 11.255 -15.378 294 HG2 PRO 38 2HG PRO 38 -8.383 11.819 -13.962 295 HG3 PRO 38 3HG PRO 38 -9.746 10.853 -13.431 296 HD2 PRO 38 2HD PRO 38 -7.239 9.881 -14.430 297 HD3 PRO 38 3HD PRO 38 -8.643 8.920 -14.010 298 H ARG 39 HN ARG 39 -6.714 10.357 -16.906 299 HA ARG 39 HA ARG 39 -6.475 12.765 -18.483 300 HB2 ARG 39 2HB ARG 39 -4.536 11.036 -16.915 301 HB3 ARG 39 3HB ARG 39 -3.913 12.112 -18.149 302 HG2 ARG 39 2HG ARG 39 -4.824 14.067 -17.044 303 HG3 ARG 39 3HG ARG 39 -5.799 13.089 -15.965 304 HD2 ARG 39 2HD ARG 39 -4.000 13.600 -14.559 305 HD3 ARG 39 3HD ARG 39 -3.458 12.069 -15.217 306 HE ARG 39 HE ARG 39 -2.349 14.726 -15.816 307 HH11 ARG 39 2HH2 ARG 39 -2.558 11.347 -16.862 308 HH12 ARG 39 1HH2 ARG 39 -1.111 11.421 -17.810 309 HH22 ARG 39 HH1 ARG 39 0.119 13.476 -17.917 310 H LEU 40 HN LEU 40 -6.338 9.247 -18.666 311 HA LEU 40 HA LEU 40 -4.834 9.178 -21.101 312 HB2 LEU 40 2HB LEU 40 -6.454 7.061 -19.678 313 HB3 LEU 40 3HB LEU 40 -5.414 6.782 -21.061 314 HG LEU 40 HG LEU 40 -4.356 7.950 -18.484 315 HD11 LEU 40 1HD1 LEU 40 -4.705 6.024 -17.439 316 HD12 LEU 40 2HD1 LEU 40 -5.346 5.271 -18.919 317 HD13 LEU 40 3HD1 LEU 40 -3.595 5.252 -18.597 318 HD21 LEU 40 3HD2 LEU 40 -3.231 7.320 -21.063 319 HD22 LEU 40 1HD2 LEU 40 -2.486 8.131 -19.664 320 HD23 LEU 40 2HD2 LEU 40 -2.443 6.356 -19.791 321 H ILE 41 HN ILE 41 -8.184 9.613 -20.130 322 HA ILE 41 HA ILE 41 -9.501 8.659 -22.352 323 HB ILE 41 HB ILE 41 -10.153 11.088 -20.679 324 HG12 ILE 41 2HG1 ILE 41 -10.434 8.146 -20.199 325 HG13 ILE 41 3HG1 ILE 41 -9.965 9.421 -19.093 326 HG21 ILE 41 1HG2 ILE 41 -12.446 10.745 -21.350 327 HG22 ILE 41 2HG2 ILE 41 -11.428 10.931 -22.798 328 HG23 ILE 41 3HG2 ILE 41 -11.993 9.315 -22.308 329 HD11 ILE 41 3HD1 ILE 41 -12.251 8.573 -18.596 330 HD12 ILE 41 1HD1 ILE 41 -12.285 10.291 -19.061 331 HD13 ILE 41 2HD1 ILE 41 -12.774 9.042 -20.231 332 H SER 42 HN SER 42 -9.882 9.379 -24.429 333 HA SER 42 HA SER 42 -9.880 10.755 -26.154 334 HB2 SER 42 2HB SER 42 -9.813 12.669 -24.313 335 HB3 SER 42 3HB SER 42 -8.137 12.823 -24.801 336 HG SER 42 HG SER 42 -9.452 12.726 -27.098 337 H MET 43 HN MET 43 -7.234 9.532 -24.380 338 HA MET 43 HA MET 43 -5.362 10.109 -26.522 339 HB2 MET 43 2HB MET 43 -4.820 8.642 -23.891 340 HB3 MET 43 3HB MET 43 -3.644 9.435 -24.921 341 HG2 MET 43 2HG MET 43 -5.276 11.565 -24.408 342 HG3 MET 43 3HG MET 43 -5.559 10.639 -22.948 343 HE1 MET 43 3HE MET 43 -1.928 9.464 -23.660 344 HE2 MET 43 1HE MET 43 -1.858 9.851 -21.924 345 HE3 MET 43 2HE MET 43 -3.282 9.019 -22.594 346 H GLN 44 HN GLN 44 -4.698 8.554 -27.974 347 HA GLN 44 HA GLN 44 -6.007 6.010 -27.751 348 HB2 GLN 44 2HB GLN 44 -4.174 7.051 -29.954 349 HB3 GLN 44 3HB GLN 44 -5.226 5.653 -30.055 350 HG2 GLN 44 2HG GLN 44 -7.225 7.064 -29.830 351 HG3 GLN 44 3HG GLN 44 -6.243 8.481 -29.513 352 HE21 GLN 44 1HE2 GLN 44 -7.261 6.131 -31.888 353 HE22 GLN 44 2HE2 GLN 44 -6.801 7.002 -33.313 354 H VAL 45 HN VAL 45 -4.784 3.940 -28.080 355 HA VAL 45 HA VAL 45 -2.327 4.049 -26.537 356 HB VAL 45 HB VAL 45 -2.619 1.539 -26.620 357 HG11 VAL 45 1HG1 VAL 45 -3.377 3.111 -24.763 358 HG12 VAL 45 2HG1 VAL 45 -5.013 2.979 -25.452 359 HG13 VAL 45 3HG1 VAL 45 -4.186 1.527 -24.838 360 HG21 VAL 45 3HG2 VAL 45 -4.408 0.523 -27.607 361 HG22 VAL 45 1HG2 VAL 45 -5.474 1.931 -27.390 362 HG23 VAL 45 2HG2 VAL 45 -4.267 1.922 -28.698 363 H ASN 46 HN ASN 46 -0.363 2.950 -27.261 364 HA ASN 46 HA ASN 46 -0.159 3.134 -30.153 365 HB2 ASN 46 2HB ASN 46 2.286 3.381 -29.762 366 HB3 ASN 46 3HB ASN 46 1.399 4.570 -28.830 367 HD21 ASN 46 1HD2 ASN 46 2.606 4.890 -27.099 368 HD22 ASN 46 2HD2 ASN 46 3.135 3.684 -25.974 369 H GLN 47 HN GLN 47 -1.337 0.806 -28.743 370 HA GLN 47 HA GLN 47 0.007 -1.223 -30.024 371 HB2 GLN 47 2HB GLN 47 1.800 -1.231 -28.496 372 HB3 GLN 47 3HB GLN 47 0.778 -0.831 -27.129 373 HG2 GLN 47 2HG GLN 47 -0.235 -3.076 -27.160 374 HG3 GLN 47 3HG GLN 47 0.624 -3.485 -28.632 375 HE21 GLN 47 1HE2 GLN 47 1.634 -1.785 -25.674 376 HE22 GLN 47 2HE2 GLN 47 2.938 -2.841 -25.245 377 H VAL 48 HN VAL 48 -1.045 -3.367 -29.627 378 HA VAL 48 HA VAL 48 -3.804 -2.969 -28.993 379 HB VAL 48 HB VAL 48 -2.085 -5.189 -30.030 380 HG11 VAL 48 1HG1 VAL 48 -3.404 -6.467 -28.554 381 HG12 VAL 48 2HG1 VAL 48 -4.856 -5.484 -28.859 382 HG13 VAL 48 3HG1 VAL 48 -4.242 -6.579 -30.120 383 HG21 VAL 48 3HG2 VAL 48 -3.644 -5.096 -31.915 384 HG22 VAL 48 1HG2 VAL 48 -4.625 -3.881 -31.060 385 HG23 VAL 48 2HG2 VAL 48 -2.968 -3.485 -31.574 386 H VAL 49 HN VAL 49 -4.131 -2.536 -26.819 387 HA VAL 49 HA VAL 49 -2.870 -4.334 -24.903 388 HB VAL 49 HB VAL 49 -4.461 -1.782 -24.579 389 HG11 VAL 49 1HG1 VAL 49 -3.780 -1.833 -22.230 390 HG12 VAL 49 2HG1 VAL 49 -4.728 -3.283 -22.641 391 HG13 VAL 49 3HG1 VAL 49 -2.958 -3.391 -22.486 392 HG21 VAL 49 3HG2 VAL 49 -1.636 -2.345 -25.089 393 HG22 VAL 49 1HG2 VAL 49 -2.533 -0.809 -25.176 394 HG23 VAL 49 2HG2 VAL 49 -1.887 -1.376 -23.617 395 HA PRO 50 HA PRO 50 -6.673 -6.525 -24.955 396 HB2 PRO 50 2HB PRO 50 -5.786 -8.734 -23.613 397 HB3 PRO 50 3HB PRO 50 -5.645 -8.547 -25.350 398 HG2 PRO 50 2HG PRO 50 -3.544 -8.311 -23.284 399 HG3 PRO 50 3HG PRO 50 -3.364 -8.550 -25.011 400 HD2 PRO 50 2HD PRO 50 -2.971 -6.103 -23.566 401 HD3 PRO 50 3HD PRO 50 -2.905 -6.316 -25.304 402 H MET 51 HN MET 51 -8.385 -7.111 -23.530 403 HA MET 51 HA MET 51 -8.571 -5.398 -21.419 404 HB2 MET 51 2HB MET 51 -10.503 -6.554 -22.463 405 HB3 MET 51 3HB MET 51 -9.911 -8.111 -21.922 406 HG2 MET 51 2HG MET 51 -10.047 -7.019 -19.501 407 HG3 MET 51 3HG MET 51 -11.129 -5.877 -20.273 408 HE1 MET 51 3HE MET 51 -11.865 -8.159 -22.623 409 HE2 MET 51 1HE MET 51 -13.455 -8.729 -22.062 410 HE3 MET 51 2HE MET 51 -13.093 -6.986 -22.092 411 H GLY 52 HN GLY 52 -7.645 -5.321 -19.417 412 HA2 GLY 52 1HA GLY 52 -7.218 -6.364 -17.333 413 HA3 GLY 52 2HA GLY 52 -6.868 -7.869 -18.158 414 H THR 53 HN THR 53 -5.413 -5.985 -20.289 415 HA THR 53 HA THR 53 -2.821 -6.363 -19.138 416 HB THR 53 HB THR 53 -3.846 -5.092 -21.731 417 HG1 THR 53 HG1 THR 53 -4.162 -7.441 -21.286 418 HG21 THR 53 3HG2 THR 53 -1.374 -4.548 -20.832 419 HG22 THR 53 1HG2 THR 53 -1.067 -6.225 -21.341 420 HG23 THR 53 2HG2 THR 53 -1.632 -5.025 -22.527 421 H THR 54 HN THR 54 -1.919 -5.090 -17.656 422 HA THR 54 HA THR 54 -2.903 -2.657 -16.844 423 HB THR 54 HB THR 54 0.051 -3.398 -16.766 424 HG1 THR 54 HG1 THR 54 -0.625 -4.976 -15.182 425 HG21 THR 54 3HG2 THR 54 -0.316 -2.745 -14.331 426 HG22 THR 54 1HG2 THR 54 -0.555 -1.399 -15.471 427 HG23 THR 54 2HG2 THR 54 -1.963 -2.235 -14.773 428 H LEU 55 HN LEU 55 -2.782 -0.561 -17.453 429 HA LEU 55 HA LEU 55 -1.689 -0.080 -20.071 430 HB2 LEU 55 2HB LEU 55 -3.918 0.749 -19.084 431 HB3 LEU 55 3HB LEU 55 -2.953 1.948 -18.246 432 HG LEU 55 HG LEU 55 -2.280 2.993 -20.256 433 HD11 LEU 55 1HD1 LEU 55 -2.924 2.041 -22.512 434 HD12 LEU 55 2HD1 LEU 55 -1.638 1.179 -21.633 435 HD13 LEU 55 3HD1 LEU 55 -3.290 0.518 -21.666 436 HD21 LEU 55 3HD2 LEU 55 -4.350 3.873 -19.943 437 HD22 LEU 55 1HD2 LEU 55 -4.623 3.106 -21.526 438 HD23 LEU 55 2HD2 LEU 55 -5.166 2.294 -20.038 439 H MET 56 HN MET 56 0.231 0.886 -20.555 440 HA MET 56 HA MET 56 1.770 1.775 -18.246 441 HB2 MET 56 2HB MET 56 2.505 0.599 -20.967 442 HB3 MET 56 3HB MET 56 3.709 1.445 -20.015 443 HG2 MET 56 2HG MET 56 2.108 -0.650 -18.575 444 HG3 MET 56 3HG MET 56 3.245 -1.230 -19.776 445 HE1 MET 56 3HE MET 56 2.487 -0.114 -16.502 446 HE2 MET 56 1HE MET 56 3.536 -1.526 -16.229 447 HE3 MET 56 2HE MET 56 4.025 0.076 -15.625 448 HA PRO 57 HA PRO 57 2.063 5.760 -19.939 449 HB2 PRO 57 2HB PRO 57 4.549 6.602 -19.178 450 HB3 PRO 57 3HB PRO 57 3.172 6.580 -18.095 451 HG2 PRO 57 2HG PRO 57 5.482 4.738 -18.193 452 HG3 PRO 57 3HG PRO 57 4.339 4.998 -16.890 453 HD2 PRO 57 2HD PRO 57 4.393 2.781 -18.709 454 HD3 PRO 57 3HD PRO 57 3.184 3.100 -17.482 455 H ASP 58 HN ASP 58 4.327 3.421 -20.955 456 HA ASP 58 HA ASP 58 5.103 5.148 -23.146 457 HB2 ASP 58 2HB ASP 58 6.319 2.938 -21.678 458 HB3 ASP 58 3HB ASP 58 6.304 2.567 -23.391 459 HD2 ASP 58 HD2 ASP 58 8.330 4.709 -21.233 460 H MET 59 HN MET 59 2.509 3.311 -22.446 461 HA MET 59 HA MET 59 2.475 1.982 -25.044 462 HB2 MET 59 2HB MET 59 1.262 1.355 -22.329 463 HB3 MET 59 3HB MET 59 0.436 0.770 -23.760 464 HG2 MET 59 2HG MET 59 2.843 -0.116 -24.459 465 HG3 MET 59 3HG MET 59 3.206 0.054 -22.753 466 HE1 MET 59 3HE MET 59 1.099 -0.821 -20.939 467 HE2 MET 59 1HE MET 59 -0.118 -0.270 -22.114 468 HE3 MET 59 2HE MET 59 -0.160 -1.943 -21.510 469 H VAL 60 HN VAL 60 1.844 4.874 -24.328 470 HA VAL 60 HA VAL 60 -0.797 4.884 -25.563 471 HB VAL 60 HB VAL 60 -0.050 6.414 -23.063 472 HG11 VAL 60 1HG1 VAL 60 -1.414 7.737 -24.676 473 HG12 VAL 60 2HG1 VAL 60 -2.660 6.467 -24.614 474 HG13 VAL 60 3HG1 VAL 60 -2.262 7.395 -23.148 475 HG21 VAL 60 3HG2 VAL 60 -1.873 5.149 -22.004 476 HG22 VAL 60 1HG2 VAL 60 -2.131 4.248 -23.516 477 HG23 VAL 60 2HG2 VAL 60 -0.603 4.065 -22.621 478 H LYS 61 HN LYS 61 -1.131 6.655 -26.960 479 HA LYS 61 HA LYS 61 1.334 8.015 -27.664 480 HB2 LYS 61 2HB LYS 61 -1.352 7.793 -29.052 481 HB3 LYS 61 3HB LYS 61 0.005 8.710 -29.674 482 HG2 LYS 61 2HG LYS 61 1.373 6.488 -29.386 483 HG3 LYS 61 3HG LYS 61 -0.190 5.706 -29.249 484 HD2 LYS 61 2HD LYS 61 -0.702 7.141 -31.473 485 HD3 LYS 61 3HD LYS 61 1.042 7.088 -31.629 486 HE2 LYS 61 2HE LYS 61 0.901 4.547 -31.319 487 HE3 LYS 61 3HE LYS 61 -0.842 4.696 -31.412 488 HZ1 LYS 61 2HZ LYS 61 0.273 6.095 -33.581 489 HZ3 LYS 61 1HZ LYS 61 -0.657 4.760 -33.634 490 H GLY 62 HN GLY 62 1.587 10.284 -27.700 491 HA2 GLY 62 1HA GLY 62 1.300 12.386 -26.964 492 HA3 GLY 62 2HA GLY 62 -0.424 12.140 -27.158 493 H TYR 63 HN TYR 63 1.082 9.803 -25.071 494 HA TYR 63 HA TYR 63 -0.363 10.827 -22.827 495 HB2 TYR 63 2HB TYR 63 -0.104 8.402 -23.269 496 HB3 TYR 63 3HB TYR 63 1.634 8.566 -23.422 497 HD1 TYR 63 HD1 TYR 63 3.034 8.981 -21.382 498 HD2 TYR 63 HD2 TYR 63 -1.146 8.109 -21.127 499 HE1 TYR 63 HE1 TYR 63 3.300 8.395 -18.922 500 HE2 TYR 63 HE2 TYR 63 -0.867 7.526 -18.668 501 HH TYR 63 HH TYR 63 0.773 8.203 -16.834 502 H ALA 64 HN ALA 64 0.862 10.808 -20.594 503 HA ALA 64 HA ALA 64 3.523 11.346 -20.344 504 HB1 ALA 64 1HB ALA 64 2.111 13.528 -21.646 505 HB2 ALA 64 2HB ALA 64 2.779 14.057 -20.083 506 HB3 ALA 64 3HB ALA 64 3.850 13.348 -21.315 507 HA PRO 65 HA PRO 65 2.028 11.422 -16.285 508 HB2 PRO 65 2HB PRO 65 4.259 12.194 -14.909 509 HB3 PRO 65 3HB PRO 65 3.997 10.554 -15.466 510 HG2 PRO 65 2HG PRO 65 5.806 12.617 -16.565 511 HG3 PRO 65 3HG PRO 65 5.833 10.884 -16.821 512 HD2 PRO 65 2HD PRO 65 4.875 12.874 -18.651 513 HD3 PRO 65 3HD PRO 65 4.797 11.136 -18.858 514 H ALA 66 HN ALA 66 2.182 12.847 -14.111 515 HA ALA 66 HA ALA 66 1.895 15.626 -14.982 516 HB1 ALA 66 1HB ALA 66 -0.332 15.567 -14.708 517 HB2 ALA 66 2HB ALA 66 -0.249 13.839 -14.289 518 HB3 ALA 66 3HB ALA 66 -0.102 15.072 -13.014 Start of MODEL 6 1 H1 MET 0 HN MET 0 2.542 -2.532 -0.180 2 HA MET 0 HA MET 0 1.235 0.069 -0.414 3 HB2 MET 0 2HB MET 0 3.581 -1.112 -2.004 4 HB3 MET 0 3HB MET 0 2.826 0.426 -2.373 5 HG2 MET 0 2HG MET 0 3.725 1.488 -0.492 6 HG3 MET 0 3HG MET 0 3.771 0.015 0.456 7 HE1 MET 0 3HE MET 0 6.859 -1.857 -0.743 8 HE2 MET 0 1HE MET 0 6.036 -1.389 0.764 9 HE3 MET 0 2HE MET 0 5.101 -2.085 -0.582 10 H ASN 1 HN ASN 1 -0.699 -0.118 -1.456 11 HA ASN 1 HA ASN 1 -0.767 -1.984 -3.688 12 HB2 ASN 1 2HB ASN 1 -3.048 -1.471 -1.707 13 HB3 ASN 1 3HB ASN 1 -3.115 -2.563 -3.076 14 HD21 ASN 1 1HD2 ASN 1 -1.196 -4.151 -3.149 15 HD22 ASN 1 2HD2 ASN 1 -0.836 -4.988 -1.675 16 H GLN 2 HN GLN 2 -0.491 -0.159 -5.157 17 HA GLN 2 HA GLN 2 -2.529 1.898 -4.947 18 HB2 GLN 2 2HB GLN 2 -1.090 3.323 -6.156 19 HB3 GLN 2 3HB GLN 2 0.014 2.401 -5.154 20 HG2 GLN 2 2HG GLN 2 1.024 2.285 -7.287 21 HG3 GLN 2 3HG GLN 2 0.180 0.753 -7.176 22 HE21 GLN 2 1HE2 GLN 2 -0.790 4.108 -7.893 23 HE22 GLN 2 2HE2 GLN 2 -1.589 3.789 -9.396 24 H GLU 3 HN GLU 3 -4.129 2.158 -6.503 25 HA GLU 3 HA GLU 3 -4.590 -0.027 -8.193 26 HB2 GLU 3 2HB GLU 3 -5.921 2.587 -7.589 27 HB3 GLU 3 3HB GLU 3 -6.340 1.841 -9.118 28 HG2 GLU 3 2HG GLU 3 -6.900 -0.289 -7.915 29 HG3 GLU 3 3HG GLU 3 -6.503 0.475 -6.389 30 HE2 GLU 3 HE2 GLU 3 -10.012 0.680 -7.871 31 H SER 4 HN SER 4 -4.192 -0.332 -10.385 32 HA SER 4 HA SER 4 -2.896 1.921 -11.712 33 HB2 SER 4 2HB SER 4 -2.230 -0.818 -12.672 34 HB3 SER 4 3HB SER 4 -1.193 0.582 -12.482 35 HG SER 4 HG SER 4 -1.395 -1.539 -10.847 36 H VAL 5 HN VAL 5 -3.422 2.235 -13.959 37 HA VAL 5 HA VAL 5 -6.017 1.638 -14.680 38 HB VAL 5 HB VAL 5 -3.584 2.415 -16.291 39 HG11 VAL 5 1HG1 VAL 5 -6.469 2.542 -17.222 40 HG12 VAL 5 2HG1 VAL 5 -5.004 2.943 -18.150 41 HG13 VAL 5 3HG1 VAL 5 -5.330 1.255 -17.687 42 HG21 VAL 5 3HG2 VAL 5 -3.989 4.508 -15.623 43 HG22 VAL 5 1HG2 VAL 5 -5.712 4.379 -16.052 44 HG23 VAL 5 2HG2 VAL 5 -5.150 3.836 -14.453 45 H VAL 6 HN VAL 6 -7.022 -0.003 -15.821 46 HA VAL 6 HA VAL 6 -5.313 -2.079 -16.946 47 HB VAL 6 HB VAL 6 -7.420 -2.481 -14.820 48 HG11 VAL 6 1HG1 VAL 6 -7.858 -4.542 -15.557 49 HG12 VAL 6 2HG1 VAL 6 -6.972 -4.138 -17.047 50 HG13 VAL 6 3HG1 VAL 6 -6.125 -4.923 -15.692 51 HG21 VAL 6 3HG2 VAL 6 -4.457 -2.646 -14.933 52 HG22 VAL 6 1HG2 VAL 6 -5.539 -2.260 -13.572 53 HG23 VAL 6 2HG2 VAL 6 -5.283 -3.954 -14.053 54 H ALA 7 HN ALA 7 -6.011 -2.589 -18.959 55 HA ALA 7 HA ALA 7 -8.100 -1.302 -20.176 56 HB1 ALA 7 1HB ALA 7 -7.900 -3.476 -21.721 57 HB2 ALA 7 2HB ALA 7 -6.608 -2.253 -21.658 58 HB3 ALA 7 3HB ALA 7 -6.459 -3.755 -20.715 59 H ALA 8 HN ALA 8 -10.104 -1.268 -19.182 60 HA ALA 8 HA ALA 8 -11.235 -3.491 -17.907 61 HB1 ALA 8 1HB ALA 8 -11.751 -0.797 -18.091 62 HB2 ALA 8 2HB ALA 8 -13.080 -1.482 -19.057 63 HB3 ALA 8 3HB ALA 8 -12.853 -1.992 -17.367 64 H VAL 9 HN VAL 9 -10.678 -2.810 -21.229 65 HA VAL 9 HA VAL 9 -12.203 -5.135 -21.962 66 HB VAL 9 HB VAL 9 -13.469 -3.974 -23.720 67 HG11 VAL 9 1HG1 VAL 9 -14.055 -2.850 -20.960 68 HG12 VAL 9 2HG1 VAL 9 -15.210 -3.075 -22.295 69 HG13 VAL 9 3HG1 VAL 9 -14.479 -4.491 -21.503 70 HG21 VAL 9 3HG2 VAL 9 -12.143 -2.006 -24.091 71 HG22 VAL 9 1HG2 VAL 9 -13.751 -1.483 -23.533 72 HG23 VAL 9 2HG2 VAL 9 -12.371 -1.467 -22.410 73 H LEU 10 HN LEU 10 -11.876 -5.488 -24.471 74 HA LEU 10 HA LEU 10 -9.109 -5.537 -24.888 75 HB2 LEU 10 2HB LEU 10 -10.394 -7.235 -25.849 76 HB3 LEU 10 3HB LEU 10 -11.521 -6.110 -26.581 77 HG LEU 10 HG LEU 10 -9.309 -5.351 -27.894 78 HD11 LEU 10 1HD1 LEU 10 -7.598 -6.688 -27.282 79 HD12 LEU 10 2HD1 LEU 10 -8.669 -8.006 -26.747 80 HD13 LEU 10 3HD1 LEU 10 -8.318 -7.793 -28.479 81 HD21 LEU 10 3HD2 LEU 10 -11.616 -6.919 -28.442 82 HD22 LEU 10 1HD2 LEU 10 -10.623 -5.964 -29.569 83 HD23 LEU 10 2HD2 LEU 10 -10.234 -7.675 -29.270 84 H ILE 11 HN ILE 11 -7.913 -3.706 -25.072 85 HA ILE 11 HA ILE 11 -9.044 -1.539 -26.681 86 HB ILE 11 HB ILE 11 -6.562 -1.266 -25.046 87 HG12 ILE 11 2HG1 ILE 11 -9.341 -1.644 -23.963 88 HG13 ILE 11 3HG1 ILE 11 -7.826 -2.313 -23.390 89 HG21 ILE 11 1HG2 ILE 11 -7.154 0.997 -24.927 90 HG22 ILE 11 2HG2 ILE 11 -7.566 0.515 -26.591 91 HG23 ILE 11 3HG2 ILE 11 -8.848 0.674 -25.367 92 HD11 ILE 11 3HD1 ILE 11 -7.084 -0.090 -22.617 93 HD12 ILE 11 1HD1 ILE 11 -8.564 0.648 -23.276 94 HD13 ILE 11 2HD1 ILE 11 -8.668 -0.487 -21.909 95 HA PRO 12 HA PRO 12 -6.245 -3.040 -29.719 96 HB2 PRO 12 2HB PRO 12 -7.370 -1.741 -31.844 97 HB3 PRO 12 3HB PRO 12 -7.896 -3.321 -31.299 98 HG2 PRO 12 2HG PRO 12 -9.216 -0.700 -30.936 99 HG3 PRO 12 3HG PRO 12 -9.903 -2.305 -30.786 100 HD2 PRO 12 2HD PRO 12 -9.155 -0.552 -28.643 101 HD3 PRO 12 3HD PRO 12 -9.733 -2.200 -28.496 102 H ILE 13 HN ILE 13 -4.821 -2.033 -31.489 103 HA ILE 13 HA ILE 13 -3.415 0.041 -30.172 104 HB ILE 13 HB ILE 13 -2.317 -1.680 -31.482 105 HG12 ILE 13 2HG1 ILE 13 -1.974 1.185 -32.368 106 HG13 ILE 13 3HG1 ILE 13 -1.036 0.284 -31.194 107 HG21 ILE 13 1HG2 ILE 13 -4.329 -1.161 -33.378 108 HG22 ILE 13 2HG2 ILE 13 -2.797 -0.675 -34.142 109 HG23 ILE 13 3HG2 ILE 13 -2.986 -2.323 -33.496 110 HD11 ILE 13 3HD1 ILE 13 -0.851 0.291 -34.167 111 HD12 ILE 13 1HD1 ILE 13 0.416 0.013 -32.949 112 HD13 ILE 13 2HD1 ILE 13 -0.689 -1.308 -33.401 113 H ASN 14 HN ASN 14 -3.039 2.228 -30.928 114 HA ASN 14 HA ASN 14 -3.807 4.192 -31.459 115 HB2 ASN 14 2HB ASN 14 -5.066 3.183 -34.012 116 HB3 ASN 14 3HB ASN 14 -4.033 4.578 -33.772 117 HD21 ASN 14 1HD2 ASN 14 -1.768 4.231 -33.335 118 HD22 ASN 14 2HD2 ASN 14 -0.944 2.864 -34.007 119 H THR 15 HN THR 15 -5.594 2.942 -29.745 120 HA THR 15 HA THR 15 -8.225 3.609 -30.896 121 HB THR 15 HB THR 15 -7.429 1.445 -28.877 122 HG1 THR 15 HG1 THR 15 -7.016 0.933 -31.119 123 HG21 THR 15 3HG2 THR 15 -9.631 1.672 -28.211 124 HG22 THR 15 1HG2 THR 15 -10.051 2.662 -29.629 125 HG23 THR 15 2HG2 THR 15 -9.988 0.889 -29.769 126 H ALA 16 HN ALA 16 -9.101 5.395 -30.081 127 HA ALA 16 HA ALA 16 -7.979 6.865 -28.049 128 HB1 ALA 16 1HB ALA 16 -10.934 6.826 -28.752 129 HB2 ALA 16 2HB ALA 16 -9.956 8.202 -28.188 130 HB3 ALA 16 3HB ALA 16 -9.698 7.536 -29.818 131 H LEU 17 HN LEU 17 -8.009 6.794 -25.840 132 HA LEU 17 HA LEU 17 -9.327 4.525 -24.644 133 HB2 LEU 17 2HB LEU 17 -7.485 6.650 -23.542 134 HB3 LEU 17 3HB LEU 17 -8.143 5.329 -22.597 135 HG LEU 17 HG LEU 17 -6.419 4.945 -25.058 136 HD11 LEU 17 1HD1 LEU 17 -5.230 6.144 -23.221 137 HD12 LEU 17 2HD1 LEU 17 -5.551 4.749 -22.164 138 HD13 LEU 17 3HD1 LEU 17 -4.544 4.550 -23.618 139 HD21 LEU 17 3HD2 LEU 17 -7.582 2.962 -24.810 140 HD22 LEU 17 1HD2 LEU 17 -6.109 2.657 -23.858 141 HD23 LEU 17 2HD2 LEU 17 -7.629 3.083 -23.035 142 H THR 18 HN THR 18 -11.024 4.587 -23.148 143 HA THR 18 HA THR 18 -12.235 7.234 -22.728 144 HB THR 18 HB THR 18 -14.465 5.946 -23.054 145 HG1 THR 18 HG1 THR 18 -13.766 3.793 -23.088 146 HG21 THR 18 3HG2 THR 18 -14.128 5.761 -25.629 147 HG22 THR 18 1HG2 THR 18 -13.872 7.369 -24.908 148 HG23 THR 18 2HG2 THR 18 -12.474 6.351 -25.332 149 H VAL 19 HN VAL 19 -14.036 7.031 -20.966 150 HA VAL 19 HA VAL 19 -12.686 5.965 -18.678 151 HB VAL 19 HB VAL 19 -14.112 8.139 -19.016 152 HG11 VAL 19 1HG1 VAL 19 -16.183 7.114 -19.716 153 HG12 VAL 19 2HG1 VAL 19 -16.223 6.093 -18.259 154 HG13 VAL 19 3HG1 VAL 19 -16.427 7.855 -18.116 155 HG21 VAL 19 3HG2 VAL 19 -13.509 6.453 -16.703 156 HG22 VAL 19 1HG2 VAL 19 -13.349 8.214 -16.911 157 HG23 VAL 19 2HG2 VAL 19 -14.913 7.513 -16.432 158 H GLY 20 HN GLY 20 -14.889 4.763 -21.039 159 HA2 GLY 20 1HA GLY 20 -15.976 2.753 -19.184 160 HA3 GLY 20 2HA GLY 20 -16.595 3.157 -20.772 161 H MET 21 HN MET 21 -13.148 3.093 -20.744 162 HA MET 21 HA MET 21 -13.238 0.374 -21.806 163 HB2 MET 21 2HB MET 21 -11.967 2.930 -22.732 164 HB3 MET 21 3HB MET 21 -10.943 1.515 -22.873 165 HG2 MET 21 2HG MET 21 -13.332 0.536 -23.872 166 HG3 MET 21 3HG MET 21 -13.423 2.213 -24.373 167 HE1 MET 21 3HE MET 21 -9.759 2.229 -24.351 168 HE2 MET 21 1HE MET 21 -9.886 2.622 -26.082 169 HE3 MET 21 2HE MET 21 -11.013 3.358 -24.918 170 H MET 22 HN MET 22 -11.566 2.748 -19.736 171 HA MET 22 HA MET 22 -9.585 0.743 -19.068 172 HB2 MET 22 2HB MET 22 -9.906 3.719 -18.406 173 HB3 MET 22 3HB MET 22 -8.617 2.742 -17.732 174 HG2 MET 22 2HG MET 22 -7.676 2.302 -19.931 175 HG3 MET 22 3HG MET 22 -9.087 2.956 -20.740 176 HE1 MET 22 3HE MET 22 -9.578 5.315 -21.177 177 HE2 MET 22 1HE MET 22 -9.871 5.618 -19.448 178 HE3 MET 22 2HE MET 22 -8.829 6.719 -20.380 179 H THR 23 HN THR 23 -8.940 0.919 -16.533 180 HA THR 23 HA THR 23 -11.091 1.402 -14.743 181 HB THR 23 HB THR 23 -11.558 -0.875 -16.105 182 HG1 THR 23 HG1 THR 23 -12.649 0.128 -14.173 183 HG21 THR 23 3HG2 THR 23 -9.235 -1.777 -15.270 184 HG22 THR 23 1HG2 THR 23 -10.021 -1.887 -13.677 185 HG23 THR 23 2HG2 THR 23 -10.658 -2.824 -15.049 186 H THR 24 HN THR 24 -10.504 0.516 -12.478 187 HA THR 24 HA THR 24 -7.578 0.760 -12.218 188 HB THR 24 HB THR 24 -8.119 1.820 -10.017 189 HG1 THR 24 HG1 THR 24 -10.342 1.919 -9.458 190 HG21 THR 24 3HG2 THR 24 -9.310 3.855 -10.818 191 HG22 THR 24 1HG2 THR 24 -8.089 3.350 -12.011 192 HG23 THR 24 2HG2 THR 24 -9.809 2.988 -12.291 193 H ARG 25 HN ARG 25 -6.440 -0.824 -11.252 194 HA ARG 25 HA ARG 25 -7.759 -2.575 -9.452 195 HB2 ARG 25 2HB ARG 25 -7.645 -3.313 -12.226 196 HB3 ARG 25 3HB ARG 25 -6.472 -4.318 -11.399 197 HG2 ARG 25 2HG ARG 25 -8.168 -5.629 -10.666 198 HG3 ARG 25 3HG ARG 25 -8.747 -4.289 -9.696 199 HD2 ARG 25 2HD ARG 25 -10.494 -3.866 -11.113 200 HD3 ARG 25 3HD ARG 25 -9.488 -4.002 -12.541 201 HE ARG 25 HE ARG 25 -9.684 -6.621 -11.748 202 HH11 ARG 25 2HH2 ARG 25 -12.136 -4.111 -12.242 203 HH12 ARG 25 1HH2 ARG 25 -13.378 -5.236 -12.678 204 HH22 ARG 25 HH1 ARG 25 -12.878 -7.579 -12.720 205 H VAL 26 HN VAL 26 -6.203 -3.837 -8.202 206 HA VAL 26 HA VAL 26 -3.574 -2.675 -8.259 207 HB VAL 26 HB VAL 26 -4.721 -4.843 -6.492 208 HG11 VAL 26 1HG1 VAL 26 -2.677 -2.961 -5.468 209 HG12 VAL 26 2HG1 VAL 26 -2.851 -4.716 -5.226 210 HG13 VAL 26 3HG1 VAL 26 -2.115 -4.092 -6.722 211 HG21 VAL 26 3HG2 VAL 26 -4.553 -2.214 -5.273 212 HG22 VAL 26 1HG2 VAL 26 -5.601 -2.187 -6.711 213 HG23 VAL 26 2HG2 VAL 26 -5.936 -3.329 -5.387 214 H VAL 27 HN VAL 27 -2.882 -3.433 -10.386 215 HA VAL 27 HA VAL 27 -2.362 -6.319 -10.446 216 HB VAL 27 HB VAL 27 -2.326 -6.173 -12.790 217 HG11 VAL 27 1HG1 VAL 27 -4.520 -4.195 -12.221 218 HG12 VAL 27 2HG1 VAL 27 -4.530 -5.632 -13.271 219 HG13 VAL 27 3HG1 VAL 27 -4.581 -5.822 -11.502 220 HG21 VAL 27 3HG2 VAL 27 -1.993 -3.216 -12.350 221 HG22 VAL 27 1HG2 VAL 27 -1.052 -4.325 -13.376 222 HG23 VAL 27 2HG2 VAL 27 -2.683 -3.818 -13.876 223 H SER 28 HN SER 28 -0.221 -6.994 -11.333 224 HA SER 28 HA SER 28 1.789 -4.951 -10.806 225 HB2 SER 28 2HB SER 28 1.474 -6.741 -8.956 226 HB3 SER 28 3HB SER 28 2.152 -7.886 -10.096 227 HG SER 28 HG SER 28 4.058 -7.212 -9.405 228 HA PRO 29 HA PRO 29 3.667 -4.686 -11.072 229 HB2 PRO 29 2HB PRO 29 5.097 -3.079 -12.758 230 HB3 PRO 29 3HB PRO 29 5.782 -4.479 -11.957 231 HG2 PRO 29 2HG PRO 29 4.979 -4.169 -14.785 232 HG3 PRO 29 3HG PRO 29 6.034 -5.371 -14.069 233 HD2 PRO 29 2HD PRO 29 3.311 -5.747 -14.888 234 HD3 PRO 29 3HD PRO 29 4.329 -6.913 -14.066 235 H THR 30 HN THR 30 3.179 -2.538 -10.413 236 HA THR 30 HA THR 30 0.670 -1.727 -11.444 237 HB THR 30 HB THR 30 1.211 0.267 -9.863 238 HG1 THR 30 HG1 THR 30 3.225 -0.023 -8.753 239 HG21 THR 30 3HG2 THR 30 1.024 -1.062 -7.829 240 HG22 THR 30 1HG2 THR 30 0.074 -1.903 -9.078 241 HG23 THR 30 2HG2 THR 30 1.695 -2.496 -8.642 242 H GLY 31 HN GLY 31 0.203 -0.654 -13.248 243 HA2 GLY 31 1HA GLY 31 2.374 0.772 -14.604 244 HA3 GLY 31 2HA GLY 31 0.843 0.266 -15.291 245 H ILE 32 HN ILE 32 0.325 2.359 -16.116 246 HA ILE 32 HA ILE 32 0.527 4.752 -14.908 247 HB ILE 32 HB ILE 32 -1.708 3.680 -16.628 248 HG12 ILE 32 2HG1 ILE 32 0.527 5.488 -17.516 249 HG13 ILE 32 3HG1 ILE 32 0.792 3.760 -17.390 250 HG21 ILE 32 1HG2 ILE 32 -1.070 6.603 -16.325 251 HG22 ILE 32 2HG2 ILE 32 -2.536 5.822 -16.963 252 HG23 ILE 32 3HG2 ILE 32 -2.203 5.795 -15.215 253 HD11 ILE 32 3HD1 ILE 32 -0.218 4.971 -19.619 254 HD12 ILE 32 1HD1 ILE 32 -0.560 3.278 -19.186 255 HD13 ILE 32 2HD1 ILE 32 -1.730 4.555 -18.776 256 HA PRO 33 HA PRO 33 -1.998 4.616 -11.403 257 HB2 PRO 33 2HB PRO 33 -2.172 7.285 -10.841 258 HB3 PRO 33 3HB PRO 33 -0.794 6.299 -10.393 259 HG2 PRO 33 2HG PRO 33 -1.023 8.285 -12.571 260 HG3 PRO 33 3HG PRO 33 0.424 7.616 -11.844 261 HD2 PRO 33 2HD PRO 33 -0.705 6.908 -14.384 262 HD3 PRO 33 3HD PRO 33 0.674 6.159 -13.605 263 H ALA 34 HN ALA 34 -4.113 4.753 -10.617 264 HA ALA 34 HA ALA 34 -6.010 4.913 -12.674 265 HB1 ALA 34 1HB ALA 34 -6.493 3.524 -10.817 266 HB2 ALA 34 2HB ALA 34 -6.127 4.814 -9.646 267 HB3 ALA 34 3HB ALA 34 -7.603 4.904 -10.638 268 H GLU 35 HN GLU 35 -4.340 7.345 -10.885 269 HA GLU 35 HA GLU 35 -6.464 9.230 -10.934 270 HB2 GLU 35 2HB GLU 35 -4.934 10.722 -9.897 271 HB3 GLU 35 3HB GLU 35 -4.496 9.143 -9.276 272 HG2 GLU 35 2HG GLU 35 -2.855 9.116 -11.391 273 HG3 GLU 35 3HG GLU 35 -3.044 10.855 -11.300 274 HE2 GLU 35 HE2 GLU 35 -3.285 10.592 -8.256 275 H ASP 36 HN ASP 36 -4.518 7.881 -13.328 276 HA ASP 36 HA ASP 36 -4.441 10.364 -14.835 277 HB2 ASP 36 2HB ASP 36 -3.041 7.678 -15.174 278 HB3 ASP 36 3HB ASP 36 -3.019 8.896 -16.433 279 HD2 ASP 36 HD2 ASP 36 -1.761 11.059 -13.800 280 H ILE 37 HN ILE 37 -6.416 7.720 -14.247 281 HA ILE 37 HA ILE 37 -7.056 6.651 -16.696 282 HB ILE 37 HB ILE 37 -8.357 6.954 -14.065 283 HG12 ILE 37 2HG1 ILE 37 -7.722 4.707 -15.978 284 HG13 ILE 37 3HG1 ILE 37 -7.035 5.022 -14.397 285 HG21 ILE 37 1HG2 ILE 37 -9.977 6.254 -16.529 286 HG22 ILE 37 2HG2 ILE 37 -10.509 6.068 -14.841 287 HG23 ILE 37 3HG2 ILE 37 -10.185 7.690 -15.499 288 HD11 ILE 37 3HD1 ILE 37 -9.363 4.655 -13.407 289 HD12 ILE 37 1HD1 ILE 37 -9.874 4.103 -15.020 290 HD13 ILE 37 2HD1 ILE 37 -8.614 3.212 -14.133 291 HA PRO 38 HA PRO 38 -9.972 10.333 -17.270 292 HB2 PRO 38 2HB PRO 38 -9.710 12.533 -15.671 293 HB3 PRO 38 3HB PRO 38 -10.883 11.266 -15.373 294 HG2 PRO 38 2HG PRO 38 -8.343 11.809 -13.962 295 HG3 PRO 38 3HG PRO 38 -9.708 10.846 -13.433 296 HD2 PRO 38 2HD PRO 38 -7.210 9.869 -14.448 297 HD3 PRO 38 3HD PRO 38 -8.616 8.912 -14.028 298 H ARG 39 HN ARG 39 -6.690 10.362 -16.919 299 HA ARG 39 HA ARG 39 -6.448 12.778 -18.483 300 HB2 ARG 39 2HB ARG 39 -4.568 11.076 -16.845 301 HB3 ARG 39 3HB ARG 39 -3.873 12.000 -18.162 302 HG2 ARG 39 2HG ARG 39 -4.628 14.095 -17.237 303 HG3 ARG 39 3HG ARG 39 -5.722 13.300 -16.123 304 HD2 ARG 39 2HD ARG 39 -3.977 13.696 -14.650 305 HD3 ARG 39 3HD ARG 39 -3.437 12.147 -15.265 306 HE ARG 39 HE ARG 39 -2.246 14.769 -15.837 307 HH11 ARG 39 2HH2 ARG 39 -2.508 11.400 -16.901 308 HH12 ARG 39 1HH2 ARG 39 -1.029 11.439 -17.801 309 HH22 ARG 39 HH1 ARG 39 0.256 13.461 -17.860 310 H LEU 40 HN LEU 40 -6.271 9.252 -18.671 311 HA LEU 40 HA LEU 40 -4.792 9.195 -21.115 312 HB2 LEU 40 2HB LEU 40 -6.420 7.074 -19.708 313 HB3 LEU 40 3HB LEU 40 -5.373 6.802 -21.087 314 HG LEU 40 HG LEU 40 -4.324 7.956 -18.501 315 HD11 LEU 40 1HD1 LEU 40 -5.383 5.327 -18.879 316 HD12 LEU 40 2HD1 LEU 40 -3.615 5.215 -18.696 317 HD13 LEU 40 3HD1 LEU 40 -4.589 6.026 -17.447 318 HD21 LEU 40 3HD2 LEU 40 -2.458 8.142 -19.689 319 HD22 LEU 40 1HD2 LEU 40 -2.403 6.365 -19.784 320 HD23 LEU 40 2HD2 LEU 40 -3.190 7.302 -21.077 321 H ILE 41 HN ILE 41 -8.133 9.662 -20.144 322 HA ILE 41 HA ILE 41 -9.468 8.712 -22.356 323 HB ILE 41 HB ILE 41 -10.080 11.164 -20.701 324 HG12 ILE 41 2HG1 ILE 41 -10.403 8.229 -20.198 325 HG13 ILE 41 3HG1 ILE 41 -9.915 9.507 -19.102 326 HG21 ILE 41 1HG2 ILE 41 -11.341 10.930 -22.863 327 HG22 ILE 41 2HG2 ILE 41 -12.004 9.402 -22.235 328 HG23 ILE 41 3HG2 ILE 41 -12.346 10.933 -21.394 329 HD11 ILE 41 3HD1 ILE 41 -12.207 8.705 -18.585 330 HD12 ILE 41 1HD1 ILE 41 -12.227 10.413 -19.087 331 HD13 ILE 41 2HD1 ILE 41 -12.730 9.143 -20.229 332 H SER 42 HN SER 42 -9.838 9.417 -24.439 333 HA SER 42 HA SER 42 -9.821 10.778 -26.176 334 HB2 SER 42 2HB SER 42 -9.715 12.704 -24.339 335 HB3 SER 42 3HB SER 42 -8.048 12.842 -24.862 336 HG SER 42 HG SER 42 -9.830 12.687 -27.007 337 H MET 43 HN MET 43 -7.190 9.537 -24.393 338 HA MET 43 HA MET 43 -5.317 10.067 -26.548 339 HB2 MET 43 2HB MET 43 -4.771 8.643 -23.896 340 HB3 MET 43 3HB MET 43 -3.598 9.417 -24.942 341 HG2 MET 43 2HG MET 43 -5.212 11.561 -24.456 342 HG3 MET 43 3HG MET 43 -5.511 10.657 -22.986 343 HE1 MET 43 3HE MET 43 -1.876 9.447 -23.653 344 HE2 MET 43 1HE MET 43 -1.834 9.850 -21.919 345 HE3 MET 43 2HE MET 43 -3.252 9.021 -22.606 346 H GLN 44 HN GLN 44 -4.707 8.486 -27.990 347 HA GLN 44 HA GLN 44 -6.019 5.952 -27.697 348 HB2 GLN 44 2HB GLN 44 -4.200 6.912 -29.947 349 HB3 GLN 44 3HB GLN 44 -5.303 5.552 -30.004 350 HG2 GLN 44 2HG GLN 44 -7.217 6.919 -30.090 351 HG3 GLN 44 3HG GLN 44 -6.424 8.265 -29.295 352 HE21 GLN 44 1HE2 GLN 44 -6.674 6.410 -32.270 353 HE22 GLN 44 2HE2 GLN 44 -6.100 7.627 -33.361 354 H VAL 45 HN VAL 45 -4.794 3.871 -28.048 355 HA VAL 45 HA VAL 45 -2.337 3.982 -26.507 356 HB VAL 45 HB VAL 45 -2.611 1.505 -26.511 357 HG11 VAL 45 1HG1 VAL 45 -4.984 3.132 -25.539 358 HG12 VAL 45 2HG1 VAL 45 -4.565 1.491 -24.994 359 HG13 VAL 45 3HG1 VAL 45 -3.461 2.847 -24.662 360 HG21 VAL 45 3HG2 VAL 45 -4.296 1.959 -28.678 361 HG22 VAL 45 1HG2 VAL 45 -4.095 0.426 -27.795 362 HG23 VAL 45 2HG2 VAL 45 -5.408 1.543 -27.352 363 H ASN 46 HN ASN 46 -0.362 2.922 -27.234 364 HA ASN 46 HA ASN 46 -0.160 3.104 -30.125 365 HB2 ASN 46 2HB ASN 46 2.278 3.371 -29.738 366 HB3 ASN 46 3HB ASN 46 1.388 4.540 -28.782 367 HD21 ASN 46 1HD2 ASN 46 2.432 4.838 -26.967 368 HD22 ASN 46 2HD2 ASN 46 3.037 3.620 -25.894 369 H GLN 47 HN GLN 47 -1.332 0.766 -28.734 370 HA GLN 47 HA GLN 47 0.028 -1.252 -30.017 371 HB2 GLN 47 2HB GLN 47 1.810 -1.260 -28.476 372 HB3 GLN 47 3HB GLN 47 0.777 -0.871 -27.115 373 HG2 GLN 47 2HG GLN 47 -0.232 -3.122 -27.173 374 HG3 GLN 47 3HG GLN 47 0.654 -3.519 -28.632 375 HE21 GLN 47 1HE2 GLN 47 1.594 -1.834 -25.642 376 HE22 GLN 47 2HE2 GLN 47 2.901 -2.881 -25.199 377 H VAL 48 HN VAL 48 -1.015 -3.405 -29.630 378 HA VAL 48 HA VAL 48 -3.781 -3.024 -29.033 379 HB VAL 48 HB VAL 48 -2.029 -5.231 -30.034 380 HG11 VAL 48 1HG1 VAL 48 -4.330 -6.541 -30.139 381 HG12 VAL 48 2HG1 VAL 48 -3.273 -6.641 -28.711 382 HG13 VAL 48 3HG1 VAL 48 -4.689 -5.563 -28.695 383 HG21 VAL 48 3HG2 VAL 48 -2.904 -3.597 -31.624 384 HG22 VAL 48 1HG2 VAL 48 -3.639 -5.193 -31.908 385 HG23 VAL 48 2HG2 VAL 48 -4.565 -3.922 -31.074 386 H VAL 49 HN VAL 49 -4.148 -2.575 -26.869 387 HA VAL 49 HA VAL 49 -2.914 -4.361 -24.921 388 HB VAL 49 HB VAL 49 -4.487 -1.794 -24.627 389 HG11 VAL 49 1HG1 VAL 49 -3.176 -3.602 -22.582 390 HG12 VAL 49 2HG1 VAL 49 -3.533 -1.888 -22.260 391 HG13 VAL 49 3HG1 VAL 49 -4.857 -3.018 -22.633 392 HG21 VAL 49 3HG2 VAL 49 -1.931 -1.361 -23.667 393 HG22 VAL 49 1HG2 VAL 49 -1.652 -2.385 -25.097 394 HG23 VAL 49 2HG2 VAL 49 -2.549 -0.856 -25.258 395 HA PRO 50 HA PRO 50 -6.734 -6.516 -24.983 396 HB2 PRO 50 2HB PRO 50 -5.893 -8.700 -23.571 397 HB3 PRO 50 3HB PRO 50 -5.715 -8.555 -25.309 398 HG2 PRO 50 2HG PRO 50 -3.655 -8.287 -23.205 399 HG3 PRO 50 3HG PRO 50 -3.441 -8.568 -24.922 400 HD2 PRO 50 2HD PRO 50 -3.058 -6.090 -23.528 401 HD3 PRO 50 3HD PRO 50 -2.958 -6.345 -25.258 402 H MET 51 HN MET 51 -8.438 -7.190 -23.528 403 HA MET 51 HA MET 51 -8.646 -5.382 -21.458 404 HB2 MET 51 2HB MET 51 -10.580 -6.503 -22.557 405 HB3 MET 51 3HB MET 51 -10.052 -8.064 -21.959 406 HG2 MET 51 2HG MET 51 -10.404 -7.305 -19.611 407 HG3 MET 51 3HG MET 51 -10.876 -5.716 -20.180 408 HE1 MET 51 3HE MET 51 -13.200 -9.642 -20.705 409 HE2 MET 51 1HE MET 51 -11.848 -9.305 -21.813 410 HE3 MET 51 2HE MET 51 -11.554 -9.431 -20.062 411 H GLY 52 HN GLY 52 -7.693 -5.314 -19.472 412 HA2 GLY 52 1HA GLY 52 -7.373 -6.375 -17.361 413 HA3 GLY 52 2HA GLY 52 -7.028 -7.884 -18.182 414 H THR 53 HN THR 53 -5.501 -5.988 -20.267 415 HA THR 53 HA THR 53 -2.941 -6.403 -19.038 416 HB THR 53 HB THR 53 -3.915 -5.232 -21.692 417 HG1 THR 53 HG1 THR 53 -4.122 -7.571 -21.202 418 HG21 THR 53 3HG2 THR 53 -1.470 -5.744 -22.365 419 HG22 THR 53 1HG2 THR 53 -1.708 -4.275 -21.388 420 HG23 THR 53 2HG2 THR 53 -1.101 -5.764 -20.623 421 H THR 54 HN THR 54 -2.029 -5.104 -17.587 422 HA THR 54 HA THR 54 -3.015 -2.659 -16.818 423 HB THR 54 HB THR 54 -0.066 -3.436 -16.726 424 HG1 THR 54 HG1 THR 54 -0.731 -5.038 -15.252 425 HG21 THR 54 3HG2 THR 54 -2.039 -2.119 -14.790 426 HG22 THR 54 1HG2 THR 54 -0.417 -2.675 -14.313 427 HG23 THR 54 2HG2 THR 54 -0.594 -1.372 -15.512 428 H LEU 55 HN LEU 55 -2.789 -0.539 -17.379 429 HA LEU 55 HA LEU 55 -1.730 -0.103 -20.032 430 HB2 LEU 55 2HB LEU 55 -3.954 0.751 -19.056 431 HB3 LEU 55 3HB LEU 55 -2.982 1.951 -18.227 432 HG LEU 55 HG LEU 55 -2.305 2.979 -20.240 433 HD11 LEU 55 1HD1 LEU 55 -3.119 0.400 -21.528 434 HD12 LEU 55 2HD1 LEU 55 -3.136 1.902 -22.483 435 HD13 LEU 55 3HD1 LEU 55 -1.627 1.353 -21.715 436 HD21 LEU 55 3HD2 LEU 55 -4.376 3.864 -19.958 437 HD22 LEU 55 1HD2 LEU 55 -4.643 3.071 -21.529 438 HD23 LEU 55 2HD2 LEU 55 -5.191 2.283 -20.030 439 H MET 56 HN MET 56 0.196 0.845 -20.523 440 HA MET 56 HA MET 56 1.743 1.738 -18.220 441 HB2 MET 56 2HB MET 56 2.467 0.550 -20.939 442 HB3 MET 56 3HB MET 56 3.677 1.390 -19.991 443 HG2 MET 56 2HG MET 56 2.059 -0.702 -18.557 444 HG3 MET 56 3HG MET 56 3.213 -1.278 -19.744 445 HE1 MET 56 3HE MET 56 4.011 -0.081 -15.566 446 HE2 MET 56 1HE MET 56 2.455 -0.040 -16.430 447 HE3 MET 56 2HE MET 56 3.338 -1.576 -16.260 448 HA PRO 57 HA PRO 57 2.054 5.715 -19.925 449 HB2 PRO 57 2HB PRO 57 4.544 6.548 -19.166 450 HB3 PRO 57 3HB PRO 57 3.166 6.536 -18.083 451 HG2 PRO 57 2HG PRO 57 5.467 4.682 -18.174 452 HG3 PRO 57 3HG PRO 57 4.325 4.952 -16.873 453 HD2 PRO 57 2HD PRO 57 4.368 2.729 -18.685 454 HD3 PRO 57 3HD PRO 57 3.160 3.058 -17.459 455 H ASP 58 HN ASP 58 4.313 3.365 -20.929 456 HA ASP 58 HA ASP 58 5.104 5.080 -23.122 457 HB2 ASP 58 2HB ASP 58 6.317 2.904 -21.634 458 HB3 ASP 58 3HB ASP 58 6.249 2.450 -23.325 459 HD2 ASP 58 HD2 ASP 58 8.694 3.129 -21.863 460 H MET 59 HN MET 59 2.503 3.234 -22.410 461 HA MET 59 HA MET 59 2.449 1.932 -25.020 462 HB2 MET 59 2HB MET 59 1.228 1.296 -22.308 463 HB3 MET 59 3HB MET 59 0.419 0.709 -23.748 464 HG2 MET 59 2HG MET 59 2.832 -0.169 -24.426 465 HG3 MET 59 3HG MET 59 3.185 0.009 -22.719 466 HE1 MET 59 3HE MET 59 1.053 -0.858 -20.922 467 HE2 MET 59 1HE MET 59 -0.155 -0.331 -22.118 468 HE3 MET 59 2HE MET 59 -0.188 -1.998 -21.497 469 H VAL 60 HN VAL 60 1.839 4.821 -24.300 470 HA VAL 60 HA VAL 60 -0.816 4.847 -25.506 471 HB VAL 60 HB VAL 60 -0.028 6.384 -23.023 472 HG11 VAL 60 1HG1 VAL 60 -2.651 6.441 -24.552 473 HG12 VAL 60 2HG1 VAL 60 -2.249 7.361 -23.083 474 HG13 VAL 60 3HG1 VAL 60 -1.406 7.711 -24.611 475 HG21 VAL 60 3HG2 VAL 60 -0.584 4.038 -22.563 476 HG22 VAL 60 1HG2 VAL 60 -1.838 5.132 -21.930 477 HG23 VAL 60 2HG2 VAL 60 -2.124 4.224 -23.435 478 H LYS 61 HN LYS 61 -1.152 6.614 -26.908 479 HA LYS 61 HA LYS 61 1.313 7.945 -27.655 480 HB2 LYS 61 2HB LYS 61 -1.399 7.702 -28.980 481 HB3 LYS 61 3HB LYS 61 -0.100 8.688 -29.620 482 HG2 LYS 61 2HG LYS 61 1.359 6.503 -29.395 483 HG3 LYS 61 3HG LYS 61 -0.179 5.672 -29.277 484 HD2 LYS 61 2HD LYS 61 -0.087 7.633 -31.498 485 HD3 LYS 61 3HD LYS 61 1.112 6.364 -31.652 486 HE2 LYS 61 2HE LYS 61 -0.472 4.704 -31.956 487 HE3 LYS 61 3HE LYS 61 -1.616 5.439 -30.850 488 HZ1 LYS 61 2HZ LYS 61 -2.609 5.870 -32.873 489 HZ3 LYS 61 1HZ LYS 61 -1.212 6.023 -33.695 490 H GLY 62 HN GLY 62 1.565 10.228 -27.757 491 HA2 GLY 62 1HA GLY 62 1.346 12.323 -26.977 492 HA3 GLY 62 2HA GLY 62 -0.383 12.112 -27.170 493 H TYR 63 HN TYR 63 1.144 9.773 -25.078 494 HA TYR 63 HA TYR 63 -0.312 10.794 -22.835 495 HB2 TYR 63 2HB TYR 63 -0.039 8.367 -23.281 496 HB3 TYR 63 3HB TYR 63 1.700 8.540 -23.416 497 HD1 TYR 63 HD2 TYR 63 3.081 8.937 -21.369 498 HD2 TYR 63 HD1 TYR 63 -1.109 8.099 -21.143 499 HE1 TYR 63 HE2 TYR 63 3.323 8.356 -18.906 500 HE2 TYR 63 HE1 TYR 63 -0.853 7.521 -18.681 501 HH TYR 63 HH TYR 63 0.872 8.265 -16.828 502 H ALA 64 HN ALA 64 0.929 10.766 -20.602 503 HA ALA 64 HA ALA 64 3.583 11.318 -20.357 504 HB1 ALA 64 1HB ALA 64 2.960 14.013 -20.088 505 HB2 ALA 64 2HB ALA 64 3.853 13.281 -21.444 506 HB3 ALA 64 3HB ALA 64 2.097 13.545 -21.573 507 HA PRO 65 HA PRO 65 2.084 11.398 -16.299 508 HB2 PRO 65 2HB PRO 65 4.323 12.148 -14.923 509 HB3 PRO 65 3HB PRO 65 4.044 10.510 -15.481 510 HG2 PRO 65 2HG PRO 65 5.873 12.555 -16.580 511 HG3 PRO 65 3HG PRO 65 5.883 10.822 -16.837 512 HD2 PRO 65 2HD PRO 65 4.945 12.822 -18.666 513 HD3 PRO 65 3HD PRO 65 4.849 11.085 -18.873 514 H ALA 66 HN ALA 66 1.861 12.729 -14.229 515 HA ALA 66 HA ALA 66 1.984 15.565 -14.891 516 HB1 ALA 66 1HB ALA 66 -0.447 15.551 -13.771 517 HB2 ALA 66 2HB ALA 66 -0.222 15.336 -15.524 518 HB3 ALA 66 3HB ALA 66 -0.489 13.919 -14.479 Start of MODEL 7 1 H1 MET 0 HN MET 0 4.036 0.467 -2.079 2 HA MET 0 HA MET 0 1.894 -0.621 -0.605 3 HB2 MET 0 2HB MET 0 2.550 1.765 -0.439 4 HB3 MET 0 3HB MET 0 2.270 2.001 -2.153 5 HG2 MET 0 2HG MET 0 0.376 2.851 -0.727 6 HG3 MET 0 3HG MET 0 -0.136 1.642 -1.887 7 HE1 MET 0 3HE MET 0 -2.242 -0.362 0.275 8 HE2 MET 0 1HE MET 0 -2.433 1.386 0.002 9 HE3 MET 0 2HE MET 0 -1.820 0.343 -1.304 10 H ASN 1 HN ASN 1 -0.203 -1.215 -1.266 11 HA ASN 1 HA ASN 1 -0.385 -2.170 -3.887 12 HB2 ASN 1 2HB ASN 1 -2.638 -1.733 -1.855 13 HB3 ASN 1 3HB ASN 1 -2.698 -2.813 -3.234 14 HD21 ASN 1 1HD2 ASN 1 -2.794 -3.111 -0.211 15 HD22 ASN 1 2HD2 ASN 1 -1.682 -4.387 0.157 16 H GLN 2 HN GLN 2 -0.167 -0.302 -5.311 17 HA GLN 2 HA GLN 2 -2.226 1.721 -5.000 18 HB2 GLN 2 2HB GLN 2 -0.836 3.196 -6.204 19 HB3 GLN 2 3HB GLN 2 0.303 2.265 -5.252 20 HG2 GLN 2 2HG GLN 2 1.267 2.217 -7.408 21 HG3 GLN 2 3HG GLN 2 0.447 0.671 -7.317 22 HE21 GLN 2 1HE2 GLN 2 -0.587 4.029 -7.926 23 HE22 GLN 2 2HE2 GLN 2 -1.414 3.736 -9.420 24 H GLU 3 HN GLU 3 -3.866 1.998 -6.511 25 HA GLU 3 HA GLU 3 -4.348 -0.147 -8.240 26 HB2 GLU 3 2HB GLU 3 -5.676 2.453 -7.564 27 HB3 GLU 3 3HB GLU 3 -6.127 1.722 -9.092 28 HG2 GLU 3 2HG GLU 3 -6.658 -0.421 -7.909 29 HG3 GLU 3 3HG GLU 3 -6.213 0.314 -6.381 30 HE2 GLU 3 HE2 GLU 3 -9.871 0.709 -7.440 31 H SER 4 HN SER 4 -3.982 -0.410 -10.441 32 HA SER 4 HA SER 4 -2.731 1.877 -11.752 33 HB2 SER 4 2HB SER 4 -2.061 -0.840 -12.771 34 HB3 SER 4 3HB SER 4 -1.033 0.566 -12.580 35 HG SER 4 HG SER 4 -1.188 -1.582 -10.973 36 H VAL 5 HN VAL 5 -3.322 2.247 -13.967 37 HA VAL 5 HA VAL 5 -5.919 1.619 -14.652 38 HB VAL 5 HB VAL 5 -3.543 2.465 -16.315 39 HG11 VAL 5 1HG1 VAL 5 -6.474 2.565 -17.101 40 HG12 VAL 5 2HG1 VAL 5 -5.083 3.105 -18.070 41 HG13 VAL 5 3HG1 VAL 5 -5.299 1.376 -17.709 42 HG21 VAL 5 3HG2 VAL 5 -3.931 4.551 -15.599 43 HG22 VAL 5 1HG2 VAL 5 -5.682 4.405 -15.884 44 HG23 VAL 5 2HG2 VAL 5 -4.978 3.828 -14.354 45 H VAL 6 HN VAL 6 -6.920 -0.034 -15.760 46 HA VAL 6 HA VAL 6 -5.193 -2.043 -16.988 47 HB VAL 6 HB VAL 6 -7.257 -2.518 -14.837 48 HG11 VAL 6 1HG1 VAL 6 -6.000 -4.944 -15.758 49 HG12 VAL 6 2HG1 VAL 6 -7.730 -4.537 -15.657 50 HG13 VAL 6 3HG1 VAL 6 -6.802 -4.126 -17.120 51 HG21 VAL 6 3HG2 VAL 6 -4.991 -4.022 -14.296 52 HG22 VAL 6 1HG2 VAL 6 -4.331 -2.506 -14.957 53 HG23 VAL 6 2HG2 VAL 6 -5.422 -2.464 -13.550 54 H ALA 7 HN ALA 7 -5.932 -2.599 -18.980 55 HA ALA 7 HA ALA 7 -8.055 -1.290 -20.148 56 HB1 ALA 7 1HB ALA 7 -7.825 -3.439 -21.738 57 HB2 ALA 7 2HB ALA 7 -6.583 -2.165 -21.686 58 HB3 ALA 7 3HB ALA 7 -6.350 -3.673 -20.769 59 H ALA 8 HN ALA 8 -10.064 -1.327 -19.183 60 HA ALA 8 HA ALA 8 -11.125 -3.587 -17.911 61 HB1 ALA 8 1HB ALA 8 -12.965 -1.558 -19.091 62 HB2 ALA 8 2HB ALA 8 -12.863 -2.180 -17.426 63 HB3 ALA 8 3HB ALA 8 -11.712 -0.943 -17.987 64 H VAL 9 HN VAL 9 -10.591 -2.880 -21.231 65 HA VAL 9 HA VAL 9 -12.081 -5.236 -21.965 66 HB VAL 9 HB VAL 9 -13.274 -4.045 -23.791 67 HG11 VAL 9 1HG1 VAL 9 -14.034 -3.073 -21.017 68 HG12 VAL 9 2HG1 VAL 9 -15.113 -3.283 -22.417 69 HG13 VAL 9 3HG1 VAL 9 -14.366 -4.704 -21.647 70 HG21 VAL 9 3HG2 VAL 9 -11.885 -2.020 -23.881 71 HG22 VAL 9 1HG2 VAL 9 -13.601 -1.617 -23.639 72 HG23 VAL 9 2HG2 VAL 9 -12.468 -1.543 -22.269 73 H LEU 10 HN LEU 10 -11.675 -5.687 -24.411 74 HA LEU 10 HA LEU 10 -8.895 -5.635 -24.791 75 HB2 LEU 10 2HB LEU 10 -10.000 -7.457 -25.684 76 HB3 LEU 10 3HB LEU 10 -11.273 -6.485 -26.394 77 HG LEU 10 HG LEU 10 -9.280 -5.555 -27.884 78 HD11 LEU 10 1HD1 LEU 10 -7.331 -6.569 -27.559 79 HD12 LEU 10 2HD1 LEU 10 -8.065 -7.771 -26.470 80 HD13 LEU 10 3HD1 LEU 10 -8.058 -8.049 -28.229 81 HD21 LEU 10 3HD2 LEU 10 -10.775 -6.432 -29.285 82 HD22 LEU 10 1HD2 LEU 10 -9.794 -7.916 -29.226 83 HD23 LEU 10 2HD2 LEU 10 -11.203 -7.737 -28.153 84 H ILE 11 HN ILE 11 -8.006 -3.572 -24.815 85 HA ILE 11 HA ILE 11 -9.176 -1.597 -26.571 86 HB ILE 11 HB ILE 11 -6.603 -1.216 -25.106 87 HG12 ILE 11 2HG1 ILE 11 -9.297 -1.641 -23.842 88 HG13 ILE 11 3HG1 ILE 11 -7.729 -2.245 -23.345 89 HG21 ILE 11 1HG2 ILE 11 -7.770 0.491 -26.634 90 HG22 ILE 11 2HG2 ILE 11 -8.948 0.665 -25.311 91 HG23 ILE 11 3HG2 ILE 11 -7.230 1.031 -25.026 92 HD11 ILE 11 3HD1 ILE 11 -8.544 -0.401 -21.868 93 HD12 ILE 11 1HD1 ILE 11 -7.016 0.020 -22.678 94 HD13 ILE 11 2HD1 ILE 11 -8.553 0.695 -23.271 95 HA PRO 12 HA PRO 12 -6.560 -3.008 -29.786 96 HB2 PRO 12 2HB PRO 12 -7.722 -1.572 -31.800 97 HB3 PRO 12 3HB PRO 12 -8.298 -3.147 -31.291 98 HG2 PRO 12 2HG PRO 12 -9.469 -0.485 -30.761 99 HG3 PRO 12 3HG PRO 12 -10.225 -2.061 -30.639 100 HD2 PRO 12 2HD PRO 12 -9.290 -0.433 -28.470 101 HD3 PRO 12 3HD PRO 12 -9.940 -2.057 -28.358 102 H ILE 13 HN ILE 13 -5.191 -1.985 -31.600 103 HA ILE 13 HA ILE 13 -3.648 -0.003 -30.265 104 HB ILE 13 HB ILE 13 -2.562 -1.683 -31.558 105 HG12 ILE 13 2HG1 ILE 13 -2.179 0.730 -33.296 106 HG13 ILE 13 3HG1 ILE 13 -1.839 0.866 -31.582 107 HG21 ILE 13 1HG2 ILE 13 -4.650 -1.107 -33.494 108 HG22 ILE 13 2HG2 ILE 13 -3.036 -1.122 -34.244 109 HG23 ILE 13 3HG2 ILE 13 -3.604 -2.537 -33.326 110 HD11 ILE 13 3HD1 ILE 13 0.127 -0.221 -31.845 111 HD12 ILE 13 1HD1 ILE 13 -0.710 -1.620 -32.559 112 HD13 ILE 13 2HD1 ILE 13 -0.177 -0.277 -33.598 113 H ASN 14 HN ASN 14 -3.184 2.169 -31.041 114 HA ASN 14 HA ASN 14 -3.893 4.168 -31.531 115 HB2 ASN 14 2HB ASN 14 -4.540 2.582 -34.034 116 HB3 ASN 14 3HB ASN 14 -5.024 4.265 -33.968 117 HD21 ASN 14 1HD2 ASN 14 -2.208 2.560 -32.623 118 HD22 ASN 14 2HD2 ASN 14 -0.983 3.483 -33.428 119 H THR 15 HN THR 15 -5.698 2.986 -29.793 120 HA THR 15 HA THR 15 -8.313 3.794 -30.886 121 HB THR 15 HB THR 15 -7.586 1.502 -28.987 122 HG1 THR 15 HG1 THR 15 -7.276 1.138 -31.296 123 HG21 THR 15 3HG2 THR 15 -10.215 2.783 -29.775 124 HG22 THR 15 1HG2 THR 15 -10.143 1.011 -29.620 125 HG23 THR 15 2HG2 THR 15 -9.749 2.043 -28.224 126 H ALA 16 HN ALA 16 -9.164 5.534 -29.950 127 HA ALA 16 HA ALA 16 -7.924 6.893 -27.898 128 HB1 ALA 16 1HB ALA 16 -10.808 6.904 -28.868 129 HB2 ALA 16 2HB ALA 16 -10.118 8.120 -27.766 130 HB3 ALA 16 3HB ALA 16 -9.482 7.955 -29.420 131 H LEU 17 HN LEU 17 -8.050 6.880 -25.665 132 HA LEU 17 HA LEU 17 -9.344 4.550 -24.531 133 HB2 LEU 17 2HB LEU 17 -7.465 6.616 -23.382 134 HB3 LEU 17 3HB LEU 17 -8.132 5.274 -22.474 135 HG LEU 17 HG LEU 17 -6.429 4.951 -24.958 136 HD11 LEU 17 1HD1 LEU 17 -5.172 6.060 -23.149 137 HD12 LEU 17 2HD1 LEU 17 -5.576 4.711 -22.059 138 HD13 LEU 17 3HD1 LEU 17 -4.568 4.422 -23.497 139 HD21 LEU 17 3HD2 LEU 17 -7.745 3.011 -24.687 140 HD22 LEU 17 1HD2 LEU 17 -6.153 2.616 -23.997 141 HD23 LEU 17 2HD2 LEU 17 -7.517 3.002 -22.921 142 H THR 18 HN THR 18 -11.036 4.592 -23.033 143 HA THR 18 HA THR 18 -12.212 7.244 -22.543 144 HB THR 18 HB THR 18 -14.450 5.873 -22.810 145 HG1 THR 18 HG1 THR 18 -13.860 4.122 -24.488 146 HG21 THR 18 3HG2 THR 18 -14.161 5.911 -25.425 147 HG22 THR 18 1HG2 THR 18 -14.081 7.463 -24.556 148 HG23 THR 18 2HG2 THR 18 -12.583 6.659 -25.084 149 H VAL 19 HN VAL 19 -13.978 7.042 -20.753 150 HA VAL 19 HA VAL 19 -12.603 5.937 -18.501 151 HB VAL 19 HB VAL 19 -14.034 8.123 -18.806 152 HG11 VAL 19 1HG1 VAL 19 -16.132 6.138 -17.861 153 HG12 VAL 19 2HG1 VAL 19 -16.318 7.906 -17.951 154 HG13 VAL 19 3HG1 VAL 19 -16.110 6.956 -19.442 155 HG21 VAL 19 3HG2 VAL 19 -14.426 8.155 -16.357 156 HG22 VAL 19 1HG2 VAL 19 -14.077 6.411 -16.297 157 HG23 VAL 19 2HG2 VAL 19 -12.805 7.558 -16.785 158 H GLY 20 HN GLY 20 -14.836 4.768 -20.843 159 HA2 GLY 20 1HA GLY 20 -15.911 2.746 -18.991 160 HA3 GLY 20 2HA GLY 20 -16.558 3.175 -20.562 161 H MET 21 HN MET 21 -13.110 3.088 -20.600 162 HA MET 21 HA MET 21 -13.241 0.388 -21.702 163 HB2 MET 21 2HB MET 21 -12.015 2.950 -22.630 164 HB3 MET 21 3HB MET 21 -10.933 1.577 -22.749 165 HG2 MET 21 2HG MET 21 -13.284 0.503 -23.758 166 HG3 MET 21 3HG MET 21 -13.411 2.168 -24.290 167 HE1 MET 21 3HE MET 21 -10.124 2.697 -24.207 168 HE2 MET 21 1HE MET 21 -9.784 2.557 -25.948 169 HE3 MET 21 2HE MET 21 -11.226 3.439 -25.392 170 H MET 22 HN MET 22 -11.493 2.718 -19.638 171 HA MET 22 HA MET 22 -9.540 0.670 -19.018 172 HB2 MET 22 2HB MET 22 -9.792 3.650 -18.345 173 HB3 MET 22 3HB MET 22 -8.518 2.648 -17.680 174 HG2 MET 22 2HG MET 22 -7.581 2.207 -19.868 175 HG3 MET 22 3HG MET 22 -9.000 2.833 -20.685 176 HE1 MET 22 3HE MET 22 -8.823 6.635 -20.135 177 HE2 MET 22 1HE MET 22 -9.550 5.295 -21.054 178 HE3 MET 22 2HE MET 22 -9.812 5.415 -19.297 179 H THR 23 HN THR 23 -8.840 0.894 -16.474 180 HA THR 23 HA THR 23 -10.960 1.374 -14.658 181 HB THR 23 HB THR 23 -11.671 -0.794 -15.890 182 HG1 THR 23 HG1 THR 23 -12.595 -0.510 -13.856 183 HG21 THR 23 3HG2 THR 23 -10.194 -2.536 -15.929 184 HG22 THR 23 1HG2 THR 23 -9.004 -1.568 -15.026 185 HG23 THR 23 2HG2 THR 23 -10.207 -2.545 -14.150 186 H THR 24 HN THR 24 -10.340 0.427 -12.403 187 HA THR 24 HA THR 24 -7.412 0.686 -12.187 188 HB THR 24 HB THR 24 -7.919 1.720 -9.965 189 HG1 THR 24 HG1 THR 24 -10.111 1.758 -9.342 190 HG21 THR 24 3HG2 THR 24 -7.918 3.280 -11.929 191 HG22 THR 24 1HG2 THR 24 -9.636 2.908 -12.210 192 HG23 THR 24 2HG2 THR 24 -9.141 3.759 -10.727 193 H ARG 25 HN ARG 25 -6.277 -0.972 -11.389 194 HA ARG 25 HA ARG 25 -7.560 -2.731 -9.546 195 HB2 ARG 25 2HB ARG 25 -7.482 -3.414 -12.334 196 HB3 ARG 25 3HB ARG 25 -6.290 -4.429 -11.545 197 HG2 ARG 25 2HG ARG 25 -7.967 -5.765 -10.815 198 HG3 ARG 25 3HG ARG 25 -8.537 -4.450 -9.807 199 HD2 ARG 25 2HD ARG 25 -10.316 -4.020 -11.178 200 HD3 ARG 25 3HD ARG 25 -9.330 -4.090 -12.625 201 HE ARG 25 HE ARG 25 -9.464 -6.732 -11.970 202 HH11 ARG 25 2HH2 ARG 25 -12.001 -4.266 -12.164 203 HH12 ARG 25 1HH2 ARG 25 -13.242 -5.399 -12.583 204 HH22 ARG 25 HH1 ARG 25 -12.691 -7.722 -12.788 205 H VAL 26 HN VAL 26 -6.002 -3.880 -8.254 206 HA VAL 26 HA VAL 26 -3.372 -2.755 -8.359 207 HB VAL 26 HB VAL 26 -4.600 -4.881 -6.592 208 HG11 VAL 26 1HG1 VAL 26 -2.622 -5.127 -5.588 209 HG12 VAL 26 2HG1 VAL 26 -1.895 -4.161 -6.894 210 HG13 VAL 26 3HG1 VAL 26 -2.442 -3.366 -5.399 211 HG21 VAL 26 3HG2 VAL 26 -4.976 -3.125 -4.976 212 HG22 VAL 26 1HG2 VAL 26 -4.189 -1.927 -6.031 213 HG23 VAL 26 2HG2 VAL 26 -5.737 -2.659 -6.517 214 H VAL 27 HN VAL 27 -2.681 -3.492 -10.488 215 HA VAL 27 HA VAL 27 -2.155 -6.377 -10.576 216 HB VAL 27 HB VAL 27 -2.134 -6.213 -12.920 217 HG11 VAL 27 1HG1 VAL 27 -4.382 -5.888 -11.617 218 HG12 VAL 27 2HG1 VAL 27 -4.335 -4.252 -12.316 219 HG13 VAL 27 3HG1 VAL 27 -4.343 -5.676 -13.383 220 HG21 VAL 27 3HG2 VAL 27 -2.535 -3.823 -13.957 221 HG22 VAL 27 1HG2 VAL 27 -1.773 -3.270 -12.446 222 HG23 VAL 27 2HG2 VAL 27 -0.893 -4.368 -13.538 223 H SER 28 HN SER 28 -0.018 -7.028 -11.509 224 HA SER 28 HA SER 28 1.988 -4.986 -10.964 225 HB2 SER 28 2HB SER 28 1.605 -6.976 -9.217 226 HB3 SER 28 3HB SER 28 2.566 -7.886 -10.365 227 HG SER 28 HG SER 28 4.344 -6.762 -9.847 228 HA PRO 29 HA PRO 29 3.860 -4.705 -11.244 229 HB2 PRO 29 2HB PRO 29 5.265 -3.066 -12.921 230 HB3 PRO 29 3HB PRO 29 5.966 -4.473 -12.146 231 HG2 PRO 29 2HG PRO 29 5.135 -4.130 -14.962 232 HG3 PRO 29 3HG PRO 29 6.204 -5.335 -14.272 233 HD2 PRO 29 2HD PRO 29 3.476 -5.717 -15.071 234 HD3 PRO 29 3HD PRO 29 4.509 -6.888 -14.275 235 H THR 30 HN THR 30 3.363 -2.571 -10.550 236 HA THR 30 HA THR 30 0.841 -1.762 -11.547 237 HB THR 30 HB THR 30 1.386 0.215 -9.945 238 HG1 THR 30 HG1 THR 30 3.380 -0.392 -8.678 239 HG21 THR 30 3HG2 THR 30 0.259 -1.952 -9.167 240 HG22 THR 30 1HG2 THR 30 1.883 -2.572 -8.782 241 HG23 THR 30 2HG2 THR 30 1.246 -1.149 -7.922 242 H GLY 31 HN GLY 31 0.352 -0.673 -13.336 243 HA2 GLY 31 1HA GLY 31 2.500 0.792 -14.688 244 HA3 GLY 31 2HA GLY 31 0.972 0.276 -15.373 245 H ILE 32 HN ILE 32 0.443 2.380 -16.174 246 HA ILE 32 HA ILE 32 0.618 4.759 -14.954 247 HB ILE 32 HB ILE 32 -1.634 3.667 -16.637 248 HG12 ILE 32 2HG1 ILE 32 0.542 5.522 -17.565 249 HG13 ILE 32 3HG1 ILE 32 0.860 3.804 -17.435 250 HG21 ILE 32 1HG2 ILE 32 -1.037 6.598 -16.330 251 HG22 ILE 32 2HG2 ILE 32 -2.504 5.795 -16.940 252 HG23 ILE 32 3HG2 ILE 32 -2.132 5.766 -15.199 253 HD11 ILE 32 3HD1 ILE 32 -0.529 3.266 -19.192 254 HD12 ILE 32 1HD1 ILE 32 -1.704 4.539 -18.787 255 HD13 ILE 32 2HD1 ILE 32 -0.209 4.954 -19.658 256 HA PRO 33 HA PRO 33 -1.836 4.575 -11.401 257 HB2 PRO 33 2HB PRO 33 -2.031 7.238 -10.821 258 HB3 PRO 33 3HB PRO 33 -0.633 6.267 -10.406 259 HG2 PRO 33 2HG PRO 33 -0.929 8.261 -12.568 260 HG3 PRO 33 3HG PRO 33 0.540 7.606 -11.873 261 HD2 PRO 33 2HD PRO 33 -0.630 6.898 -14.394 262 HD3 PRO 33 3HD PRO 33 0.773 6.161 -13.646 263 H ALA 34 HN ALA 34 -3.936 4.708 -10.559 264 HA ALA 34 HA ALA 34 -5.877 4.842 -12.579 265 HB1 ALA 34 1HB ALA 34 -7.428 4.810 -10.516 266 HB2 ALA 34 2HB ALA 34 -6.300 3.447 -10.710 267 HB3 ALA 34 3HB ALA 34 -5.935 4.746 -9.550 268 H GLU 35 HN GLU 35 -4.198 7.289 -10.816 269 HA GLU 35 HA GLU 35 -6.343 9.153 -10.830 270 HB2 GLU 35 2HB GLU 35 -4.795 10.674 -9.837 271 HB3 GLU 35 3HB GLU 35 -4.383 9.101 -9.183 272 HG2 GLU 35 2HG GLU 35 -2.764 9.051 -11.353 273 HG3 GLU 35 3HG GLU 35 -2.877 10.790 -11.168 274 HE2 GLU 35 HE2 GLU 35 -0.418 10.375 -10.426 275 H ASP 36 HN ASP 36 -4.372 7.840 -13.240 276 HA ASP 36 HA ASP 36 -4.346 10.324 -14.743 277 HB2 ASP 36 2HB ASP 36 -2.950 7.641 -15.131 278 HB3 ASP 36 3HB ASP 36 -2.931 8.886 -16.363 279 HD2 ASP 36 HD2 ASP 36 0.067 8.956 -14.499 280 H ILE 37 HN ILE 37 -6.322 7.696 -14.136 281 HA ILE 37 HA ILE 37 -6.986 6.615 -16.574 282 HB ILE 37 HB ILE 37 -8.266 6.941 -13.936 283 HG12 ILE 37 2HG1 ILE 37 -7.671 4.675 -15.841 284 HG13 ILE 37 3HG1 ILE 37 -6.953 5.001 -14.276 285 HG21 ILE 37 1HG2 ILE 37 -9.900 6.288 -16.403 286 HG22 ILE 37 2HG2 ILE 37 -10.423 6.021 -14.722 287 HG23 ILE 37 3HG2 ILE 37 -10.117 7.674 -15.308 288 HD11 ILE 37 3HD1 ILE 37 -8.530 3.214 -13.940 289 HD12 ILE 37 1HD1 ILE 37 -9.284 4.674 -13.254 290 HD13 ILE 37 2HD1 ILE 37 -9.797 4.073 -14.848 291 HA PRO 38 HA PRO 38 -9.885 10.311 -17.151 292 HB2 PRO 38 2HB PRO 38 -9.596 12.520 -15.568 293 HB3 PRO 38 3HB PRO 38 -10.775 11.262 -15.252 294 HG2 PRO 38 2HG PRO 38 -8.220 11.799 -13.866 295 HG3 PRO 38 3HG PRO 38 -9.587 10.848 -13.319 296 HD2 PRO 38 2HD PRO 38 -7.103 9.849 -14.347 297 HD3 PRO 38 3HD PRO 38 -8.512 8.904 -13.910 298 H ARG 39 HN ARG 39 -6.600 10.321 -16.827 299 HA ARG 39 HA ARG 39 -6.354 12.725 -18.408 300 HB2 ARG 39 2HB ARG 39 -4.410 10.971 -16.870 301 HB3 ARG 39 3HB ARG 39 -3.797 12.056 -18.103 302 HG2 ARG 39 2HG ARG 39 -4.681 14.005 -16.968 303 HG3 ARG 39 3HG ARG 39 -5.653 13.024 -15.888 304 HD2 ARG 39 2HD ARG 39 -3.843 13.490 -14.488 305 HD3 ARG 39 3HD ARG 39 -3.298 11.979 -15.189 306 HE ARG 39 HE ARG 39 -2.211 14.658 -15.733 307 HH11 ARG 39 2HH2 ARG 39 -2.407 11.303 -16.856 308 HH12 ARG 39 1HH2 ARG 39 -0.968 11.410 -17.815 309 HH22 ARG 39 HH1 ARG 39 0.247 13.474 -17.883 310 H LEU 40 HN LEU 40 -6.232 9.202 -18.584 311 HA LEU 40 HA LEU 40 -4.765 9.118 -21.038 312 HB2 LEU 40 2HB LEU 40 -6.393 7.014 -19.606 313 HB3 LEU 40 3HB LEU 40 -5.356 6.729 -20.989 314 HG LEU 40 HG LEU 40 -4.277 7.901 -18.424 315 HD11 LEU 40 1HD1 LEU 40 -5.360 5.267 -18.769 316 HD12 LEU 40 2HD1 LEU 40 -3.596 5.158 -18.557 317 HD13 LEU 40 3HD1 LEU 40 -4.589 5.994 -17.339 318 HD21 LEU 40 3HD2 LEU 40 -2.394 8.009 -19.589 319 HD22 LEU 40 1HD2 LEU 40 -2.414 6.236 -19.742 320 HD23 LEU 40 2HD2 LEU 40 -3.174 7.246 -20.995 321 H ILE 41 HN ILE 41 -8.090 9.622 -20.037 322 HA ILE 41 HA ILE 41 -9.443 8.667 -22.245 323 HB ILE 41 HB ILE 41 -10.060 11.105 -20.572 324 HG12 ILE 41 2HG1 ILE 41 -10.334 8.168 -20.061 325 HG13 ILE 41 3HG1 ILE 41 -9.860 9.456 -18.972 326 HG21 ILE 41 1HG2 ILE 41 -11.952 9.321 -22.124 327 HG22 ILE 41 2HG2 ILE 41 -12.349 10.802 -21.220 328 HG23 ILE 41 3HG2 ILE 41 -11.355 10.898 -22.694 329 HD11 ILE 41 3HD1 ILE 41 -12.677 9.043 -20.077 330 HD12 ILE 41 1HD1 ILE 41 -12.134 8.614 -18.437 331 HD13 ILE 41 2HD1 ILE 41 -12.187 10.321 -18.939 332 H SER 42 HN SER 42 -9.843 9.398 -24.316 333 HA SER 42 HA SER 42 -9.844 10.779 -26.037 334 HB2 SER 42 2HB SER 42 -9.715 12.683 -24.177 335 HB3 SER 42 3HB SER 42 -8.056 12.828 -24.722 336 HG SER 42 HG SER 42 -8.956 14.136 -26.184 337 H MET 43 HN MET 43 -7.192 9.521 -24.296 338 HA MET 43 HA MET 43 -5.331 10.092 -26.446 339 HB2 MET 43 2HB MET 43 -4.799 8.571 -23.844 340 HB3 MET 43 3HB MET 43 -3.615 9.358 -24.868 341 HG2 MET 43 2HG MET 43 -5.195 11.512 -24.313 342 HG3 MET 43 3HG MET 43 -5.502 10.567 -22.869 343 HE1 MET 43 3HE MET 43 -1.873 9.313 -23.508 344 HE2 MET 43 1HE MET 43 -1.894 9.680 -21.767 345 HE3 MET 43 2HE MET 43 -3.297 8.892 -22.527 346 H GLN 44 HN GLN 44 -4.742 8.563 -27.949 347 HA GLN 44 HA GLN 44 -6.075 6.032 -27.751 348 HB2 GLN 44 2HB GLN 44 -4.249 7.071 -29.960 349 HB3 GLN 44 3HB GLN 44 -5.347 5.710 -30.071 350 HG2 GLN 44 2HG GLN 44 -7.273 7.081 -30.070 351 HG3 GLN 44 3HG GLN 44 -6.452 8.414 -29.281 352 HE21 GLN 44 1HE2 GLN 44 -6.903 6.646 -32.265 353 HE22 GLN 44 2HE2 GLN 44 -6.302 7.848 -33.358 354 H VAL 45 HN VAL 45 -4.881 3.952 -28.155 355 HA VAL 45 HA VAL 45 -2.388 4.004 -26.658 356 HB VAL 45 HB VAL 45 -2.723 1.542 -26.623 357 HG11 VAL 45 1HG1 VAL 45 -5.082 3.183 -25.638 358 HG12 VAL 45 2HG1 VAL 45 -4.605 1.573 -25.048 359 HG13 VAL 45 3HG1 VAL 45 -3.530 2.969 -24.793 360 HG21 VAL 45 3HG2 VAL 45 -4.298 0.463 -27.811 361 HG22 VAL 45 1HG2 VAL 45 -5.539 1.689 -27.459 362 HG23 VAL 45 2HG2 VAL 45 -4.380 1.951 -28.784 363 H ASN 46 HN ASN 46 -0.455 2.936 -27.443 364 HA ASN 46 HA ASN 46 -0.354 3.068 -30.342 365 HB2 ASN 46 2HB ASN 46 2.098 3.318 -30.046 366 HB3 ASN 46 3HB ASN 46 1.254 4.509 -29.075 367 HD21 ASN 46 1HD2 ASN 46 2.293 4.816 -27.265 368 HD22 ASN 46 2HD2 ASN 46 2.951 3.610 -26.211 369 H GLN 47 HN GLN 47 -1.495 0.764 -28.864 370 HA GLN 47 HA GLN 47 -0.206 -1.289 -30.164 371 HB2 GLN 47 2HB GLN 47 1.637 -1.301 -28.703 372 HB3 GLN 47 3HB GLN 47 0.673 -0.856 -27.308 373 HG2 GLN 47 2HG GLN 47 -0.382 -3.090 -27.268 374 HG3 GLN 47 3HG GLN 47 0.447 -3.543 -28.744 375 HE21 GLN 47 1HE2 GLN 47 1.503 -1.800 -25.825 376 HE22 GLN 47 2HE2 GLN 47 2.812 -2.851 -25.401 377 H VAL 48 HN VAL 48 -1.258 -3.420 -29.709 378 HA VAL 48 HA VAL 48 -3.988 -2.990 -28.956 379 HB VAL 48 HB VAL 48 -2.346 -5.200 -30.121 380 HG11 VAL 48 1HG1 VAL 48 -5.026 -5.523 -28.762 381 HG12 VAL 48 2HG1 VAL 48 -4.514 -6.589 -30.092 382 HG13 VAL 48 3HG1 VAL 48 -3.558 -6.514 -28.592 383 HG21 VAL 48 3HG2 VAL 48 -4.913 -3.804 -30.947 384 HG22 VAL 48 1HG2 VAL 48 -3.289 -3.542 -31.626 385 HG23 VAL 48 2HG2 VAL 48 -4.111 -5.102 -31.864 386 H VAL 49 HN VAL 49 -4.392 -2.718 -26.801 387 HA VAL 49 HA VAL 49 -2.957 -4.449 -24.938 388 HB VAL 49 HB VAL 49 -4.689 -2.003 -24.527 389 HG11 VAL 49 1HG1 VAL 49 -4.077 -2.061 -22.212 390 HG12 VAL 49 2HG1 VAL 49 -4.719 -3.667 -22.634 391 HG13 VAL 49 3HG1 VAL 49 -2.962 -3.423 -22.477 392 HG21 VAL 49 3HG2 VAL 49 -2.048 -1.557 -23.641 393 HG22 VAL 49 1HG2 VAL 49 -1.907 -2.334 -25.237 394 HG23 VAL 49 2HG2 VAL 49 -2.859 -0.841 -25.055 395 HA PRO 50 HA PRO 50 -6.612 -6.867 -24.910 396 HB2 PRO 50 2HB PRO 50 -5.587 -8.988 -23.524 397 HB3 PRO 50 3HB PRO 50 -5.454 -8.826 -25.264 398 HG2 PRO 50 2HG PRO 50 -3.378 -8.415 -23.200 399 HG3 PRO 50 3HG PRO 50 -3.179 -8.674 -24.922 400 HD2 PRO 50 2HD PRO 50 -2.949 -6.180 -23.525 401 HD3 PRO 50 3HD PRO 50 -2.865 -6.422 -25.258 402 H MET 51 HN MET 51 -8.387 -7.104 -23.612 403 HA MET 51 HA MET 51 -8.572 -5.513 -21.466 404 HB2 MET 51 2HB MET 51 -10.501 -6.633 -22.547 405 HB3 MET 51 3HB MET 51 -9.938 -8.204 -22.012 406 HG2 MET 51 2HG MET 51 -10.117 -7.194 -19.584 407 HG3 MET 51 3HG MET 51 -11.106 -5.957 -20.332 408 HE1 MET 51 3HE MET 51 -13.503 -8.655 -22.308 409 HE2 MET 51 1HE MET 51 -12.749 -7.052 -22.479 410 HE3 MET 51 2HE MET 51 -11.779 -8.523 -22.732 411 H GLY 52 HN GLY 52 -7.634 -5.442 -19.473 412 HA2 GLY 52 1HA GLY 52 -7.263 -6.471 -17.371 413 HA3 GLY 52 2HA GLY 52 -6.964 -8.000 -18.172 414 H THR 53 HN THR 53 -5.487 -5.874 -20.217 415 HA THR 53 HA THR 53 -2.888 -6.438 -19.072 416 HB THR 53 HB THR 53 -3.913 -5.255 -21.699 417 HG1 THR 53 HG1 THR 53 -4.073 -7.593 -21.255 418 HG21 THR 53 3HG2 THR 53 -1.477 -4.535 -20.763 419 HG22 THR 53 1HG2 THR 53 -1.067 -6.178 -21.309 420 HG23 THR 53 2HG2 THR 53 -1.717 -4.992 -22.467 421 H THR 54 HN THR 54 -1.904 -5.157 -17.653 422 HA THR 54 HA THR 54 -2.857 -2.722 -16.815 423 HB THR 54 HB THR 54 0.087 -3.529 -16.844 424 HG1 THR 54 HG1 THR 54 -0.544 -5.147 -15.396 425 HG21 THR 54 3HG2 THR 54 -0.368 -1.446 -15.622 426 HG22 THR 54 1HG2 THR 54 -1.777 -2.182 -14.821 427 HG23 THR 54 2HG2 THR 54 -0.135 -2.746 -14.429 428 H LEU 55 HN LEU 55 -2.686 -0.605 -17.381 429 HA LEU 55 HA LEU 55 -1.707 -0.132 -20.054 430 HB2 LEU 55 2HB LEU 55 -3.896 0.708 -18.974 431 HB3 LEU 55 3HB LEU 55 -2.889 1.909 -18.191 432 HG LEU 55 HG LEU 55 -2.298 2.931 -20.237 433 HD11 LEU 55 1HD1 LEU 55 -3.053 1.960 -22.454 434 HD12 LEU 55 2HD1 LEU 55 -1.726 1.107 -21.628 435 HD13 LEU 55 3HD1 LEU 55 -3.378 0.446 -21.575 436 HD21 LEU 55 3HD2 LEU 55 -4.345 3.831 -19.850 437 HD22 LEU 55 1HD2 LEU 55 -4.698 3.039 -21.405 438 HD23 LEU 55 2HD2 LEU 55 -5.174 2.257 -19.879 439 H MET 56 HN MET 56 0.199 0.827 -20.601 440 HA MET 56 HA MET 56 1.828 1.686 -18.344 441 HB2 MET 56 2HB MET 56 2.436 0.529 -21.101 442 HB3 MET 56 3HB MET 56 3.683 1.392 -20.223 443 HG2 MET 56 2HG MET 56 2.161 -0.768 -18.760 444 HG3 MET 56 3HG MET 56 3.354 -1.262 -19.944 445 HE1 MET 56 3HE MET 56 4.093 -0.060 -15.741 446 HE2 MET 56 1HE MET 56 2.549 0.182 -16.594 447 HE3 MET 56 2HE MET 56 3.253 -1.449 -16.473 448 HA PRO 57 HA PRO 57 2.067 5.698 -19.980 449 HB2 PRO 57 2HB PRO 57 4.587 6.519 -19.315 450 HB3 PRO 57 3HB PRO 57 3.258 6.483 -18.173 451 HG2 PRO 57 2HG PRO 57 5.554 4.635 -18.404 452 HG3 PRO 57 3HG PRO 57 4.471 4.876 -17.047 453 HD2 PRO 57 2HD PRO 57 4.436 2.690 -18.905 454 HD3 PRO 57 3HD PRO 57 3.283 2.993 -17.620 455 H ASP 58 HN ASP 58 4.272 3.369 -21.135 456 HA ASP 58 HA ASP 58 4.955 5.131 -23.330 457 HB2 ASP 58 2HB ASP 58 6.256 2.940 -21.935 458 HB3 ASP 58 3HB ASP 58 6.124 2.524 -23.632 459 HD2 ASP 58 HD2 ASP 58 7.476 6.039 -22.768 460 H MET 59 HN MET 59 2.395 3.281 -22.543 461 HA MET 59 HA MET 59 2.251 1.974 -25.148 462 HB2 MET 59 2HB MET 59 1.158 1.345 -22.389 463 HB3 MET 59 3HB MET 59 0.228 0.806 -23.774 464 HG2 MET 59 2HG MET 59 2.583 -0.125 -24.622 465 HG3 MET 59 3HG MET 59 3.016 -0.021 -22.927 466 HE1 MET 59 3HE MET 59 -0.277 -0.269 -22.137 467 HE2 MET 59 1HE MET 59 -0.333 -1.961 -21.587 468 HE3 MET 59 2HE MET 59 0.987 -0.894 -21.052 469 H VAL 60 HN VAL 60 1.681 4.871 -24.415 470 HA VAL 60 HA VAL 60 -0.947 4.942 -25.642 471 HB VAL 60 HB VAL 60 -0.328 6.396 -23.063 472 HG11 VAL 60 1HG1 VAL 60 -2.901 6.228 -24.669 473 HG12 VAL 60 2HG1 VAL 60 -2.670 7.094 -23.131 474 HG13 VAL 60 3HG1 VAL 60 -1.813 7.635 -24.595 475 HG21 VAL 60 3HG2 VAL 60 -0.648 4.154 -22.420 476 HG22 VAL 60 1HG2 VAL 60 -2.244 4.912 -22.204 477 HG23 VAL 60 2HG2 VAL 60 -1.928 3.895 -23.630 478 H LYS 61 HN LYS 61 -1.082 6.575 -27.140 479 HA LYS 61 HA LYS 61 1.324 8.097 -27.557 480 HB2 LYS 61 2HB LYS 61 -1.273 8.006 -29.122 481 HB3 LYS 61 3HB LYS 61 0.201 8.804 -29.632 482 HG2 LYS 61 2HG LYS 61 1.361 6.492 -29.318 483 HG3 LYS 61 3HG LYS 61 -0.256 5.821 -29.224 484 HD2 LYS 61 2HD LYS 61 -0.387 7.480 -31.485 485 HD3 LYS 61 3HD LYS 61 1.229 6.809 -31.579 486 HE2 LYS 61 2HE LYS 61 -0.976 4.883 -30.906 487 HE3 LYS 61 3HE LYS 61 -0.970 5.519 -32.539 488 HZ1 LYS 61 2HZ LYS 61 1.663 4.774 -31.813 489 HZ3 LYS 61 1HZ LYS 61 0.748 4.177 -33.020 490 H GLY 62 HN GLY 62 1.448 10.417 -27.630 491 HA2 GLY 62 1HA GLY 62 1.051 12.486 -26.852 492 HA3 GLY 62 2HA GLY 62 -0.660 12.139 -27.005 493 H TYR 63 HN TYR 63 1.024 9.852 -25.008 494 HA TYR 63 HA TYR 63 -0.401 10.777 -22.702 495 HB2 TYR 63 2HB TYR 63 -0.074 8.369 -23.224 496 HB3 TYR 63 3HB TYR 63 1.656 8.594 -23.387 497 HD1 TYR 63 HD1 TYR 63 3.060 9.009 -21.349 498 HD2 TYR 63 HD2 TYR 63 -1.086 7.986 -21.082 499 HE1 TYR 63 HE1 TYR 63 3.367 8.374 -18.906 500 HE2 TYR 63 HE2 TYR 63 -0.765 7.354 -18.640 501 HH TYR 63 HH TYR 63 1.439 8.320 -16.805 502 H ALA 64 HN ALA 64 0.883 10.760 -20.507 503 HA ALA 64 HA ALA 64 3.535 11.365 -20.318 504 HB1 ALA 64 1HB ALA 64 2.020 13.536 -21.532 505 HB2 ALA 64 2HB ALA 64 2.747 14.048 -19.989 506 HB3 ALA 64 3HB ALA 64 3.775 13.384 -21.281 507 HA PRO 65 HA PRO 65 2.140 11.326 -16.223 508 HB2 PRO 65 2HB PRO 65 4.395 12.103 -14.890 509 HB3 PRO 65 3HB PRO 65 4.141 10.470 -15.474 510 HG2 PRO 65 2HG PRO 65 5.892 12.582 -16.577 511 HG3 PRO 65 3HG PRO 65 5.937 10.855 -16.870 512 HD2 PRO 65 2HD PRO 65 4.903 12.867 -18.632 513 HD3 PRO 65 3HD PRO 65 4.844 11.133 -18.873 514 H ALA 66 HN ALA 66 2.337 12.711 -14.025 515 HA ALA 66 HA ALA 66 1.998 15.503 -14.825 516 HB1 ALA 66 1HB ALA 66 -0.036 13.667 -13.575 517 HB2 ALA 66 2HB ALA 66 -0.018 15.387 -13.114 518 HB3 ALA 66 3HB ALA 66 -0.253 14.925 -14.817 Start of MODEL 8 1 H1 MET 0 HN MET 0 3.310 -2.132 -1.060 2 HA MET 0 HA MET 0 1.255 -0.340 -0.024 3 HB2 MET 0 2HB MET 0 1.905 1.288 -1.797 4 HB3 MET 0 3HB MET 0 3.283 0.936 -0.774 5 HG2 MET 0 2HG MET 0 4.295 0.656 -2.847 6 HG3 MET 0 3HG MET 0 3.728 -0.984 -2.602 7 HE1 MET 0 3HE MET 0 3.345 2.317 -4.625 8 HE2 MET 0 1HE MET 0 4.376 0.996 -5.225 9 HE3 MET 0 2HE MET 0 2.918 1.469 -6.131 10 H ASN 1 HN ASN 1 -0.624 -0.050 -1.392 11 HA ASN 1 HA ASN 1 -0.719 -1.944 -3.602 12 HB2 ASN 1 2HB ASN 1 -2.945 -1.400 -1.565 13 HB3 ASN 1 3HB ASN 1 -3.092 -2.460 -2.952 14 HD21 ASN 1 1HD2 ASN 1 -3.683 -3.674 -0.789 15 HD22 ASN 1 2HD2 ASN 1 -2.435 -4.698 -0.162 16 H GLN 2 HN GLN 2 -0.457 -0.148 -5.106 17 HA GLN 2 HA GLN 2 -2.498 1.911 -4.912 18 HB2 GLN 2 2HB GLN 2 -1.065 3.333 -6.129 19 HB3 GLN 2 3HB GLN 2 0.042 2.427 -5.117 20 HG2 GLN 2 2HG GLN 2 1.058 2.297 -7.246 21 HG3 GLN 2 3HG GLN 2 0.222 0.762 -7.124 22 HE21 GLN 2 1HE2 GLN 2 -0.764 4.106 -7.872 23 HE22 GLN 2 2HE2 GLN 2 -1.558 3.769 -9.375 24 H GLU 3 HN GLU 3 -4.095 2.146 -6.475 25 HA GLU 3 HA GLU 3 -4.537 -0.059 -8.146 26 HB2 GLU 3 2HB GLU 3 -5.889 2.549 -7.564 27 HB3 GLU 3 3HB GLU 3 -6.297 1.791 -9.091 28 HG2 GLU 3 2HG GLU 3 -6.852 -0.334 -7.883 29 HG3 GLU 3 3HG GLU 3 -6.456 0.433 -6.358 30 HE2 GLU 3 HE2 GLU 3 -10.083 0.773 -7.506 31 H SER 4 HN SER 4 -4.152 -0.372 -10.342 32 HA SER 4 HA SER 4 -2.853 1.873 -11.679 33 HB2 SER 4 2HB SER 4 -2.201 -0.890 -12.601 34 HB3 SER 4 3HB SER 4 -1.166 0.518 -12.475 35 HG SER 4 HG SER 4 -1.337 -1.553 -10.768 36 H VAL 5 HN VAL 5 -3.415 2.213 -13.902 37 HA VAL 5 HA VAL 5 -6.002 1.581 -14.620 38 HB VAL 5 HB VAL 5 -3.596 2.401 -16.252 39 HG11 VAL 5 1HG1 VAL 5 -6.512 2.483 -17.097 40 HG12 VAL 5 2HG1 VAL 5 -5.103 3.012 -18.047 41 HG13 VAL 5 3HG1 VAL 5 -5.322 1.288 -17.664 42 HG21 VAL 5 3HG2 VAL 5 -4.033 4.520 -15.647 43 HG22 VAL 5 1HG2 VAL 5 -5.791 4.311 -15.836 44 HG23 VAL 5 2HG2 VAL 5 -4.990 3.801 -14.330 45 H VAL 6 HN VAL 6 -6.988 -0.081 -15.734 46 HA VAL 6 HA VAL 6 -5.246 -2.112 -16.899 47 HB VAL 6 HB VAL 6 -7.344 -2.554 -14.774 48 HG11 VAL 6 1HG1 VAL 6 -5.927 -4.739 -16.320 49 HG12 VAL 6 2HG1 VAL 6 -7.276 -4.895 -15.169 50 HG13 VAL 6 3HG1 VAL 6 -7.544 -4.136 -16.756 51 HG21 VAL 6 3HG2 VAL 6 -5.063 -4.056 -14.213 52 HG22 VAL 6 1HG2 VAL 6 -4.428 -2.512 -14.832 53 HG23 VAL 6 2HG2 VAL 6 -5.544 -2.524 -13.445 54 H ALA 7 HN ALA 7 -5.938 -2.639 -18.912 55 HA ALA 7 HA ALA 7 -8.028 -1.359 -20.136 56 HB1 ALA 7 1HB ALA 7 -6.539 -2.300 -21.621 57 HB2 ALA 7 2HB ALA 7 -6.364 -3.794 -20.670 58 HB3 ALA 7 3HB ALA 7 -7.812 -3.543 -21.674 59 H ALA 8 HN ALA 8 -10.038 -1.334 -19.157 60 HA ALA 8 HA ALA 8 -11.164 -3.560 -17.882 61 HB1 ALA 8 1HB ALA 8 -12.807 -2.077 -17.365 62 HB2 ALA 8 2HB ALA 8 -11.691 -0.875 -18.056 63 HB3 ALA 8 3HB ALA 8 -13.001 -1.550 -19.055 64 H VAL 9 HN VAL 9 -10.592 -2.886 -21.203 65 HA VAL 9 HA VAL 9 -12.092 -5.223 -21.940 66 HB VAL 9 HB VAL 9 -13.378 -4.084 -23.691 67 HG11 VAL 9 1HG1 VAL 9 -15.119 -3.182 -22.265 68 HG12 VAL 9 2HG1 VAL 9 -14.378 -4.592 -21.471 69 HG13 VAL 9 3HG1 VAL 9 -13.959 -2.947 -20.936 70 HG21 VAL 9 3HG2 VAL 9 -11.925 -1.708 -22.646 71 HG22 VAL 9 1HG2 VAL 9 -12.487 -2.081 -24.293 72 HG23 VAL 9 2HG2 VAL 9 -13.636 -1.471 -23.078 73 H LEU 10 HN LEU 10 -11.788 -5.507 -24.487 74 HA LEU 10 HA LEU 10 -9.010 -5.549 -24.893 75 HB2 LEU 10 2HB LEU 10 -10.303 -7.248 -25.860 76 HB3 LEU 10 3HB LEU 10 -11.411 -6.115 -26.608 77 HG LEU 10 HG LEU 10 -9.175 -5.367 -27.885 78 HD11 LEU 10 1HD1 LEU 10 -7.444 -6.708 -27.513 79 HD12 LEU 10 2HD1 LEU 10 -8.443 -7.842 -26.574 80 HD13 LEU 10 3HD1 LEU 10 -8.345 -7.999 -28.344 81 HD21 LEU 10 3HD2 LEU 10 -11.496 -6.839 -28.488 82 HD22 LEU 10 1HD2 LEU 10 -10.396 -6.014 -29.619 83 HD23 LEU 10 2HD2 LEU 10 -10.140 -7.731 -29.221 84 H ILE 11 HN ILE 11 -7.854 -3.682 -25.022 85 HA ILE 11 HA ILE 11 -8.997 -1.524 -26.632 86 HB ILE 11 HB ILE 11 -6.526 -1.215 -24.992 87 HG12 ILE 11 2HG1 ILE 11 -9.280 -1.716 -23.903 88 HG13 ILE 11 3HG1 ILE 11 -7.732 -2.310 -23.333 89 HG21 ILE 11 1HG2 ILE 11 -7.614 0.554 -26.509 90 HG22 ILE 11 2HG2 ILE 11 -8.864 0.669 -25.246 91 HG23 ILE 11 3HG2 ILE 11 -7.166 1.026 -24.852 92 HD11 ILE 11 3HD1 ILE 11 -8.625 0.608 -23.203 93 HD12 ILE 11 1HD1 ILE 11 -8.664 -0.538 -21.842 94 HD13 ILE 11 2HD1 ILE 11 -7.106 -0.052 -22.552 95 HA PRO 12 HA PRO 12 -6.160 -2.950 -29.667 96 HB2 PRO 12 2HB PRO 12 -7.273 -1.624 -31.781 97 HB3 PRO 12 3HB PRO 12 -7.796 -3.215 -31.265 98 HG2 PRO 12 2HG PRO 12 -9.133 -0.608 -30.872 99 HG3 PRO 12 3HG PRO 12 -9.812 -2.219 -30.754 100 HD2 PRO 12 2HD PRO 12 -9.093 -0.496 -28.577 101 HD3 PRO 12 3HD PRO 12 -9.663 -2.149 -28.461 102 H ILE 13 HN ILE 13 -4.732 -1.903 -31.416 103 HA ILE 13 HA ILE 13 -3.318 0.126 -30.057 104 HB ILE 13 HB ILE 13 -2.202 -1.495 -31.430 105 HG12 ILE 13 2HG1 ILE 13 -1.920 1.198 -32.783 106 HG13 ILE 13 3HG1 ILE 13 -1.313 0.869 -31.173 107 HG21 ILE 13 1HG2 ILE 13 -2.516 -0.927 -34.056 108 HG22 ILE 13 2HG2 ILE 13 -3.400 -2.212 -33.198 109 HG23 ILE 13 3HG2 ILE 13 -4.168 -0.628 -33.463 110 HD11 ILE 13 3HD1 ILE 13 0.480 -0.274 -31.975 111 HD12 ILE 13 1HD1 ILE 13 -0.535 -1.236 -33.075 112 HD13 ILE 13 2HD1 ILE 13 0.039 0.373 -33.573 113 H ASN 14 HN ASN 14 -2.887 2.331 -30.837 114 HA ASN 14 HA ASN 14 -3.732 4.321 -31.182 115 HB2 ASN 14 2HB ASN 14 -4.498 4.696 -33.603 116 HB3 ASN 14 3HB ASN 14 -2.940 3.910 -33.438 117 HD21 ASN 14 1HD2 ASN 14 -2.601 2.094 -34.477 118 HD22 ASN 14 2HD2 ASN 14 -3.795 1.050 -35.171 119 H THR 15 HN THR 15 -5.550 3.066 -29.579 120 HA THR 15 HA THR 15 -8.157 3.647 -30.828 121 HB THR 15 HB THR 15 -7.369 1.530 -28.757 122 HG1 THR 15 HG1 THR 15 -6.862 0.975 -30.958 123 HG21 THR 15 3HG2 THR 15 -9.986 2.687 -29.553 124 HG22 THR 15 1HG2 THR 15 -9.891 0.925 -29.789 125 HG23 THR 15 2HG2 THR 15 -9.595 1.626 -28.179 126 H ALA 16 HN ALA 16 -9.124 5.407 -30.061 127 HA ALA 16 HA ALA 16 -8.128 6.959 -28.039 128 HB1 ALA 16 1HB ALA 16 -10.912 7.384 -28.069 129 HB2 ALA 16 2HB ALA 16 -9.687 8.232 -29.043 130 HB3 ALA 16 3HB ALA 16 -10.513 6.800 -29.703 131 H LEU 17 HN LEU 17 -8.064 6.820 -25.847 132 HA LEU 17 HA LEU 17 -9.357 4.554 -24.624 133 HB2 LEU 17 2HB LEU 17 -7.484 6.681 -23.587 134 HB3 LEU 17 3HB LEU 17 -8.146 5.399 -22.593 135 HG LEU 17 HG LEU 17 -6.498 4.888 -25.081 136 HD11 LEU 17 1HD1 LEU 17 -5.353 6.194 -23.160 137 HD12 LEU 17 2HD1 LEU 17 -5.417 4.646 -22.284 138 HD13 LEU 17 3HD1 LEU 17 -4.545 4.757 -23.832 139 HD21 LEU 17 3HD2 LEU 17 -6.154 2.664 -23.816 140 HD22 LEU 17 1HD2 LEU 17 -7.591 3.147 -22.882 141 HD23 LEU 17 2HD2 LEU 17 -7.703 2.946 -24.647 142 H THR 18 HN THR 18 -11.056 4.599 -23.146 143 HA THR 18 HA THR 18 -12.262 7.243 -22.687 144 HB THR 18 HB THR 18 -14.490 5.953 -22.982 145 HG1 THR 18 HG1 THR 18 -13.748 3.802 -22.977 146 HG21 THR 18 3HG2 THR 18 -14.227 5.776 -25.545 147 HG22 THR 18 1HG2 THR 18 -13.869 7.374 -24.849 148 HG23 THR 18 2HG2 THR 18 -12.538 6.287 -25.310 149 H VAL 19 HN VAL 19 -14.025 7.042 -20.893 150 HA VAL 19 HA VAL 19 -12.636 5.970 -18.631 151 HB VAL 19 HB VAL 19 -14.077 8.149 -18.959 152 HG11 VAL 19 1HG1 VAL 19 -16.145 6.105 -18.082 153 HG12 VAL 19 2HG1 VAL 19 -16.353 7.870 -17.975 154 HG13 VAL 19 3HG1 VAL 19 -16.166 7.090 -19.565 155 HG21 VAL 19 3HG2 VAL 19 -14.774 7.523 -16.334 156 HG22 VAL 19 1HG2 VAL 19 -13.349 6.507 -16.659 157 HG23 VAL 19 2HG2 VAL 19 -13.254 8.270 -16.881 158 H GLY 20 HN GLY 20 -14.825 4.744 -20.967 159 HA2 GLY 20 1HA GLY 20 -15.910 2.750 -19.088 160 HA3 GLY 20 2HA GLY 20 -16.557 3.157 -20.665 161 H MET 21 HN MET 21 -13.109 3.086 -20.697 162 HA MET 21 HA MET 21 -13.226 0.374 -21.772 163 HB2 MET 21 2HB MET 21 -11.954 2.930 -22.691 164 HB3 MET 21 3HB MET 21 -10.931 1.515 -22.847 165 HG2 MET 21 2HG MET 21 -13.321 0.537 -23.838 166 HG3 MET 21 3HG MET 21 -13.427 2.218 -24.322 167 HE1 MET 21 3HE MET 21 -9.881 2.649 -26.032 168 HE2 MET 21 1HE MET 21 -10.997 3.370 -24.848 169 HE3 MET 21 2HE MET 21 -9.751 2.218 -24.310 170 H MET 22 HN MET 22 -11.552 2.704 -19.667 171 HA MET 22 HA MET 22 -9.568 0.683 -19.044 172 HB2 MET 22 2HB MET 22 -9.860 3.660 -18.377 173 HB3 MET 22 3HB MET 22 -8.587 2.672 -17.687 174 HG2 MET 22 2HG MET 22 -7.604 2.240 -19.853 175 HG3 MET 22 3HG MET 22 -9.017 2.836 -20.700 176 HE1 MET 22 3HE MET 22 -9.551 5.299 -21.163 177 HE2 MET 22 1HE MET 22 -9.921 5.389 -19.424 178 HE3 MET 22 2HE MET 22 -8.913 6.643 -20.185 179 H THR 23 HN THR 23 -8.902 0.844 -16.509 180 HA THR 23 HA THR 23 -11.055 1.313 -14.712 181 HB THR 23 HB THR 23 -11.491 -0.971 -16.071 182 HG1 THR 23 HG1 THR 23 -12.907 -0.701 -14.383 183 HG21 THR 23 3HG2 THR 23 -9.905 -1.939 -13.652 184 HG22 THR 23 1HG2 THR 23 -10.573 -2.908 -14.987 185 HG23 THR 23 2HG2 THR 23 -9.165 -1.857 -15.269 186 H THR 24 HN THR 24 -10.449 0.410 -12.448 187 HA THR 24 HA THR 24 -7.525 0.688 -12.195 188 HB THR 24 HB THR 24 -8.066 1.772 -10.003 189 HG1 THR 24 HG1 THR 24 -10.128 0.530 -9.821 190 HG21 THR 24 3HG2 THR 24 -8.014 3.312 -11.959 191 HG22 THR 24 1HG2 THR 24 -9.704 2.899 -12.335 192 HG23 THR 24 2HG2 THR 24 -9.316 3.784 -10.841 193 H ARG 25 HN ARG 25 -6.396 -0.931 -11.304 194 HA ARG 25 HA ARG 25 -7.712 -2.654 -9.455 195 HB2 ARG 25 2HB ARG 25 -7.580 -3.406 -12.224 196 HB3 ARG 25 3HB ARG 25 -6.405 -4.400 -11.386 197 HG2 ARG 25 2HG ARG 25 -8.106 -5.721 -10.680 198 HG3 ARG 25 3HG ARG 25 -8.670 -4.393 -9.685 199 HD2 ARG 25 2HD ARG 25 -10.438 -3.959 -11.068 200 HD3 ARG 25 3HD ARG 25 -9.444 -4.043 -12.509 201 HE ARG 25 HE ARG 25 -9.598 -6.680 -11.855 202 HH11 ARG 25 2HH2 ARG 25 -12.126 -4.203 -12.028 203 HH12 ARG 25 1HH2 ARG 25 -13.375 -5.330 -12.438 204 HH22 ARG 25 HH1 ARG 25 -12.836 -7.655 -12.650 205 H VAL 26 HN VAL 26 -6.175 -3.769 -8.109 206 HA VAL 26 HA VAL 26 -3.541 -2.647 -8.206 207 HB VAL 26 HB VAL 26 -4.712 -4.755 -6.381 208 HG11 VAL 26 1HG1 VAL 26 -2.115 -3.394 -6.538 209 HG12 VAL 26 2HG1 VAL 26 -2.888 -3.262 -4.940 210 HG13 VAL 26 3HG1 VAL 26 -2.589 -4.865 -5.655 211 HG21 VAL 26 3HG2 VAL 26 -5.913 -2.441 -6.597 212 HG22 VAL 26 1HG2 VAL 26 -5.559 -3.106 -4.984 213 HG23 VAL 26 2HG2 VAL 26 -4.517 -1.837 -5.671 214 H VAL 27 HN VAL 27 -2.810 -3.463 -10.290 215 HA VAL 27 HA VAL 27 -2.300 -6.353 -10.265 216 HB VAL 27 HB VAL 27 -2.233 -6.272 -12.613 217 HG11 VAL 27 1HG1 VAL 27 -4.445 -4.304 -12.005 218 HG12 VAL 27 2HG1 VAL 27 -4.429 -5.642 -13.178 219 HG13 VAL 27 3HG1 VAL 27 -4.503 -5.989 -11.434 220 HG21 VAL 27 3HG2 VAL 27 -1.606 -3.426 -12.195 221 HG22 VAL 27 1HG2 VAL 27 -1.131 -4.527 -13.510 222 HG23 VAL 27 2HG2 VAL 27 -2.724 -3.734 -13.545 223 H SER 28 HN SER 28 -0.149 -7.031 -11.186 224 HA SER 28 HA SER 28 1.856 -4.987 -10.653 225 HB2 SER 28 2HB SER 28 1.439 -6.926 -8.857 226 HB3 SER 28 3HB SER 28 2.414 -7.871 -9.965 227 HG SER 28 HG SER 28 4.148 -6.410 -9.719 228 HA PRO 29 HA PRO 29 3.732 -4.718 -10.914 229 HB2 PRO 29 2HB PRO 29 5.166 -3.131 -12.616 230 HB3 PRO 29 3HB PRO 29 5.852 -4.517 -11.792 231 HG2 PRO 29 2HG PRO 29 5.062 -4.251 -14.628 232 HG3 PRO 29 3HG PRO 29 6.118 -5.439 -13.889 233 HD2 PRO 29 2HD PRO 29 3.400 -5.837 -14.716 234 HD3 PRO 29 3HD PRO 29 4.418 -6.987 -13.872 235 H THR 30 HN THR 30 3.231 -2.564 -10.288 236 HA THR 30 HA THR 30 0.727 -1.776 -11.351 237 HB THR 30 HB THR 30 1.245 0.237 -9.787 238 HG1 THR 30 HG1 THR 30 3.263 0.030 -8.717 239 HG21 THR 30 3HG2 THR 30 0.106 -1.924 -8.987 240 HG22 THR 30 1HG2 THR 30 1.724 -2.512 -8.533 241 HG23 THR 30 2HG2 THR 30 1.045 -1.071 -7.739 242 H GLY 31 HN GLY 31 0.277 -0.732 -13.176 243 HA2 GLY 31 1HA GLY 31 2.455 0.693 -14.522 244 HA3 GLY 31 2HA GLY 31 0.936 0.167 -15.222 245 H ILE 32 HN ILE 32 0.404 2.242 -16.079 246 HA ILE 32 HA ILE 32 0.578 4.654 -14.912 247 HB ILE 32 HB ILE 32 -1.639 3.527 -16.619 248 HG12 ILE 32 2HG1 ILE 32 0.604 5.342 -17.493 249 HG13 ILE 32 3HG1 ILE 32 0.833 3.607 -17.401 250 HG21 ILE 32 1HG2 ILE 32 -2.166 5.657 -15.232 251 HG22 ILE 32 2HG2 ILE 32 -1.054 6.465 -16.362 252 HG23 ILE 32 3HG2 ILE 32 -2.509 5.645 -16.978 253 HD11 ILE 32 3HD1 ILE 32 -0.161 4.895 -19.602 254 HD12 ILE 32 1HD1 ILE 32 -0.511 3.193 -19.215 255 HD13 ILE 32 2HD1 ILE 32 -1.674 4.463 -18.769 256 HA PRO 33 HA PRO 33 -1.951 4.560 -11.407 257 HB2 PRO 33 2HB PRO 33 -2.154 7.237 -10.896 258 HB3 PRO 33 3HB PRO 33 -0.766 6.275 -10.429 259 HG2 PRO 33 2HG PRO 33 -1.015 8.216 -12.645 260 HG3 PRO 33 3HG PRO 33 0.439 7.576 -11.904 261 HD2 PRO 33 2HD PRO 33 -0.680 6.808 -14.431 262 HD3 PRO 33 3HD PRO 33 0.706 6.089 -13.636 263 H ALA 34 HN ALA 34 -4.067 4.753 -10.594 264 HA ALA 34 HA ALA 34 -5.972 4.806 -12.651 265 HB1 ALA 34 1HB ALA 34 -7.564 4.858 -10.635 266 HB2 ALA 34 2HB ALA 34 -6.411 3.504 -10.708 267 HB3 ALA 34 3HB ALA 34 -6.103 4.878 -9.620 268 H GLU 35 HN GLU 35 -4.271 7.327 -11.062 269 HA GLU 35 HA GLU 35 -6.412 9.203 -11.166 270 HB2 GLU 35 2HB GLU 35 -4.842 10.774 -10.265 271 HB3 GLU 35 3HB GLU 35 -4.492 9.242 -9.490 272 HG2 GLU 35 2HG GLU 35 -2.826 8.986 -11.607 273 HG3 GLU 35 3HG GLU 35 -2.893 10.736 -11.557 274 HE2 GLU 35 HE2 GLU 35 -0.246 10.013 -10.367 275 H ASP 36 HN ASP 36 -4.317 7.785 -13.451 276 HA ASP 36 HA ASP 36 -4.214 10.168 -15.078 277 HB2 ASP 36 2HB ASP 36 -2.365 8.238 -14.706 278 HB3 ASP 36 3HB ASP 36 -3.237 7.475 -16.021 279 HD2 ASP 36 HD2 ASP 36 -0.746 9.460 -15.405 280 H ILE 37 HN ILE 37 -6.320 7.614 -14.391 281 HA ILE 37 HA ILE 37 -7.104 6.583 -16.807 282 HB ILE 37 HB ILE 37 -8.289 6.961 -14.137 283 HG12 ILE 37 2HG1 ILE 37 -7.851 4.700 -16.082 284 HG13 ILE 37 3HG1 ILE 37 -7.146 4.939 -14.496 285 HG21 ILE 37 1HG2 ILE 37 -10.051 6.413 -16.541 286 HG22 ILE 37 2HG2 ILE 37 -10.528 6.221 -14.837 287 HG23 ILE 37 3HG2 ILE 37 -10.123 7.834 -15.471 288 HD11 ILE 37 3HD1 ILE 37 -9.481 4.705 -13.502 289 HD12 ILE 37 1HD1 ILE 37 -10.047 4.243 -15.126 290 HD13 ILE 37 2HD1 ILE 37 -8.851 3.233 -14.279 291 HA PRO 38 HA PRO 38 -9.837 10.408 -17.332 292 HB2 PRO 38 2HB PRO 38 -9.451 12.589 -15.732 293 HB3 PRO 38 3HB PRO 38 -10.677 11.376 -15.420 294 HG2 PRO 38 2HG PRO 38 -8.094 11.798 -14.045 295 HG3 PRO 38 3HG PRO 38 -9.495 10.897 -13.498 296 HD2 PRO 38 2HD PRO 38 -7.058 9.810 -14.551 297 HD3 PRO 38 3HD PRO 38 -8.501 8.917 -14.113 298 H ARG 39 HN ARG 39 -6.532 10.366 -16.935 299 HA ARG 39 HA ARG 39 -6.234 12.723 -18.576 300 HB2 ARG 39 2HB ARG 39 -4.220 10.943 -17.121 301 HB3 ARG 39 3HB ARG 39 -3.732 12.263 -18.166 302 HG2 ARG 39 2HG ARG 39 -4.871 13.902 -16.758 303 HG3 ARG 39 3HG ARG 39 -5.633 12.641 -15.810 304 HD2 ARG 39 2HD ARG 39 -3.837 13.182 -14.415 305 HD3 ARG 39 3HD ARG 39 -3.129 11.870 -15.336 306 HE ARG 39 HE ARG 39 -2.442 14.722 -15.535 307 HH11 ARG 39 2HH2 ARG 39 -2.244 11.556 -17.112 308 HH12 ARG 39 1HH2 ARG 39 -0.885 11.992 -18.093 309 HH22 ARG 39 HH1 ARG 39 0.036 14.197 -17.910 310 H LEU 40 HN LEU 40 -6.476 9.285 -18.794 311 HA LEU 40 HA LEU 40 -4.845 9.101 -21.182 312 HB2 LEU 40 2HB LEU 40 -6.445 7.063 -19.631 313 HB3 LEU 40 3HB LEU 40 -5.527 6.704 -21.081 314 HG LEU 40 HG LEU 40 -4.204 7.938 -18.667 315 HD11 LEU 40 1HD1 LEU 40 -5.355 5.279 -18.857 316 HD12 LEU 40 2HD1 LEU 40 -3.594 5.219 -18.604 317 HD13 LEU 40 3HD1 LEU 40 -4.627 6.116 -17.465 318 HD21 LEU 40 3HD2 LEU 40 -3.023 6.094 -20.748 319 HD22 LEU 40 1HD2 LEU 40 -3.093 7.861 -20.954 320 HD23 LEU 40 2HD2 LEU 40 -2.182 7.160 -19.595 321 H ILE 41 HN ILE 41 -8.151 9.689 -20.202 322 HA ILE 41 HA ILE 41 -9.507 8.676 -22.396 323 HB ILE 41 HB ILE 41 -10.142 11.136 -20.763 324 HG12 ILE 41 2HG1 ILE 41 -10.376 8.209 -20.184 325 HG13 ILE 41 3HG1 ILE 41 -9.916 9.527 -19.126 326 HG21 ILE 41 1HG2 ILE 41 -12.458 10.700 -21.366 327 HG22 ILE 41 2HG2 ILE 41 -11.466 10.944 -22.823 328 HG23 ILE 41 3HG2 ILE 41 -11.961 9.302 -22.348 329 HD11 ILE 41 3HD1 ILE 41 -12.253 10.362 -19.104 330 HD12 ILE 41 1HD1 ILE 41 -12.731 9.053 -20.212 331 HD13 ILE 41 2HD1 ILE 41 -12.177 8.667 -18.565 332 H SER 42 HN SER 42 -9.887 9.376 -24.479 333 HA SER 42 HA SER 42 -9.886 10.735 -26.216 334 HB2 SER 42 2HB SER 42 -9.814 12.666 -24.392 335 HB3 SER 42 3HB SER 42 -8.140 12.816 -24.889 336 HG SER 42 HG SER 42 -9.463 12.697 -27.179 337 H MET 43 HN MET 43 -7.239 9.526 -24.437 338 HA MET 43 HA MET 43 -5.364 10.093 -26.577 339 HB2 MET 43 2HB MET 43 -4.813 8.598 -23.967 340 HB3 MET 43 3HB MET 43 -3.652 9.436 -24.977 341 HG2 MET 43 2HG MET 43 -5.354 11.512 -24.409 342 HG3 MET 43 3HG MET 43 -5.565 10.550 -22.960 343 HE1 MET 43 3HE MET 43 -3.323 9.036 -22.562 344 HE2 MET 43 1HE MET 43 -1.907 9.462 -23.553 345 HE3 MET 43 2HE MET 43 -1.957 9.915 -21.833 346 H GLN 44 HN GLN 44 -4.618 8.520 -27.988 347 HA GLN 44 HA GLN 44 -5.943 5.968 -27.757 348 HB2 GLN 44 2HB GLN 44 -4.193 7.000 -30.028 349 HB3 GLN 44 3HB GLN 44 -5.283 5.630 -30.085 350 HG2 GLN 44 2HG GLN 44 -7.222 6.994 -30.038 351 HG3 GLN 44 3HG GLN 44 -6.372 8.355 -29.334 352 HE21 GLN 44 1HE2 GLN 44 -6.875 6.444 -32.231 353 HE22 GLN 44 2HE2 GLN 44 -6.341 7.615 -33.391 354 H VAL 45 HN VAL 45 -4.812 3.933 -27.755 355 HA VAL 45 HA VAL 45 -2.288 4.081 -26.409 356 HB VAL 45 HB VAL 45 -2.527 1.565 -26.507 357 HG11 VAL 45 1HG1 VAL 45 -3.238 2.984 -24.587 358 HG12 VAL 45 2HG1 VAL 45 -4.867 3.076 -25.299 359 HG13 VAL 45 3HG1 VAL 45 -4.214 1.507 -24.770 360 HG21 VAL 45 3HG2 VAL 45 -4.278 0.520 -27.514 361 HG22 VAL 45 1HG2 VAL 45 -5.397 1.873 -27.228 362 HG23 VAL 45 2HG2 VAL 45 -4.223 1.957 -28.563 363 H ASN 46 HN ASN 46 -0.324 2.948 -27.152 364 HA ASN 46 HA ASN 46 -0.121 3.212 -30.039 365 HB2 ASN 46 2HB ASN 46 2.328 3.429 -29.642 366 HB3 ASN 46 3HB ASN 46 1.447 4.605 -28.688 367 HD21 ASN 46 1HD2 ASN 46 2.771 4.874 -27.012 368 HD22 ASN 46 2HD2 ASN 46 3.249 3.645 -25.888 369 H GLN 47 HN GLN 47 -1.306 0.854 -28.673 370 HA GLN 47 HA GLN 47 0.019 -1.150 -30.014 371 HB2 GLN 47 2HB GLN 47 1.821 -1.221 -28.506 372 HB3 GLN 47 3HB GLN 47 0.822 -0.820 -27.123 373 HG2 GLN 47 2HG GLN 47 -0.227 -3.049 -27.167 374 HG3 GLN 47 3HG GLN 47 0.606 -3.454 -28.654 375 HE21 GLN 47 1HE2 GLN 47 1.686 -1.803 -25.694 376 HE22 GLN 47 2HE2 GLN 47 2.977 -2.886 -25.293 377 H VAL 48 HN VAL 48 -1.047 -3.293 -29.672 378 HA VAL 48 HA VAL 48 -3.797 -2.900 -29.014 379 HB VAL 48 HB VAL 48 -2.091 -5.107 -30.097 380 HG11 VAL 48 1HG1 VAL 48 -4.827 -5.410 -28.865 381 HG12 VAL 48 2HG1 VAL 48 -4.312 -6.445 -30.219 382 HG13 VAL 48 3HG1 VAL 48 -3.391 -6.449 -28.696 383 HG21 VAL 48 3HG2 VAL 48 -3.012 -3.320 -31.569 384 HG22 VAL 48 1HG2 VAL 48 -3.584 -4.951 -31.997 385 HG23 VAL 48 2HG2 VAL 48 -4.654 -3.836 -31.113 386 H VAL 49 HN VAL 49 -4.104 -2.500 -26.828 387 HA VAL 49 HA VAL 49 -2.849 -4.341 -24.951 388 HB VAL 49 HB VAL 49 -4.445 -1.803 -24.554 389 HG11 VAL 49 1HG1 VAL 49 -3.048 -3.643 -22.597 390 HG12 VAL 49 2HG1 VAL 49 -3.427 -1.946 -22.218 391 HG13 VAL 49 3HG1 VAL 49 -4.740 -3.090 -22.586 392 HG21 VAL 49 3HG2 VAL 49 -1.598 -2.346 -25.076 393 HG22 VAL 49 1HG2 VAL 49 -2.533 -0.841 -25.249 394 HG23 VAL 49 2HG2 VAL 49 -1.895 -1.315 -23.656 395 HA PRO 50 HA PRO 50 -6.648 -6.529 -25.003 396 HB2 PRO 50 2HB PRO 50 -5.776 -8.722 -23.626 397 HB3 PRO 50 3HB PRO 50 -5.610 -8.553 -25.362 398 HG2 PRO 50 2HG PRO 50 -3.540 -8.292 -23.268 399 HG3 PRO 50 3HG PRO 50 -3.334 -8.548 -24.989 400 HD2 PRO 50 2HD PRO 50 -2.967 -6.085 -23.565 401 HD3 PRO 50 3HD PRO 50 -2.875 -6.316 -25.299 402 H MET 51 HN MET 51 -8.333 -7.247 -23.543 403 HA MET 51 HA MET 51 -8.546 -5.466 -21.448 404 HB2 MET 51 2HB MET 51 -10.486 -6.570 -22.532 405 HB3 MET 51 3HB MET 51 -9.930 -8.147 -22.007 406 HG2 MET 51 2HG MET 51 -10.091 -7.134 -19.573 407 HG3 MET 51 3HG MET 51 -11.090 -5.903 -20.319 408 HE1 MET 51 3HE MET 51 -13.577 -6.504 -21.500 409 HE2 MET 51 1HE MET 51 -12.379 -7.208 -22.612 410 HE3 MET 51 2HE MET 51 -13.792 -8.163 -22.105 411 H GLY 52 HN GLY 52 -7.648 -5.427 -19.434 412 HA2 GLY 52 1HA GLY 52 -7.277 -6.502 -17.353 413 HA3 GLY 52 2HA GLY 52 -6.939 -8.004 -18.190 414 H THR 53 HN THR 53 -5.444 -6.005 -20.244 415 HA THR 53 HA THR 53 -2.867 -6.464 -19.045 416 HB THR 53 HB THR 53 -3.834 -5.234 -21.678 417 HG1 THR 53 HG1 THR 53 -4.140 -7.562 -21.283 418 HG21 THR 53 3HG2 THR 53 -1.046 -5.847 -20.600 419 HG22 THR 53 1HG2 THR 53 -1.395 -5.875 -22.345 420 HG23 THR 53 2HG2 THR 53 -1.603 -4.369 -21.420 421 H THR 54 HN THR 54 -1.938 -5.175 -17.596 422 HA THR 54 HA THR 54 -2.928 -2.744 -16.788 423 HB THR 54 HB THR 54 0.034 -3.447 -16.731 424 HG1 THR 54 HG1 THR 54 -2.271 -4.579 -15.303 425 HG21 THR 54 3HG2 THR 54 -1.998 -2.308 -14.745 426 HG22 THR 54 1HG2 THR 54 -0.368 -2.845 -14.271 427 HG23 THR 54 2HG2 THR 54 -0.563 -1.485 -15.402 428 H LEU 55 HN LEU 55 -2.707 -0.613 -17.320 429 HA LEU 55 HA LEU 55 -1.702 -0.141 -19.985 430 HB2 LEU 55 2HB LEU 55 -3.898 0.710 -18.949 431 HB3 LEU 55 3HB LEU 55 -2.903 1.888 -18.118 432 HG LEU 55 HG LEU 55 -2.279 2.966 -20.112 433 HD11 LEU 55 1HD1 LEU 55 -2.966 2.002 -22.381 434 HD12 LEU 55 2HD1 LEU 55 -1.594 1.239 -21.541 435 HD13 LEU 55 3HD1 LEU 55 -3.195 0.461 -21.520 436 HD21 LEU 55 3HD2 LEU 55 -4.632 3.035 -21.387 437 HD22 LEU 55 1HD2 LEU 55 -5.150 2.230 -19.887 438 HD23 LEU 55 2HD2 LEU 55 -4.357 3.821 -19.815 439 H MET 56 HN MET 56 0.220 0.798 -20.507 440 HA MET 56 HA MET 56 1.819 1.662 -18.228 441 HB2 MET 56 2HB MET 56 2.548 0.587 -21.005 442 HB3 MET 56 3HB MET 56 3.747 1.257 -19.918 443 HG2 MET 56 2HG MET 56 1.920 -0.871 -18.813 444 HG3 MET 56 3HG MET 56 3.153 -1.381 -19.950 445 HE1 MET 56 3HE MET 56 2.456 0.398 -16.498 446 HE2 MET 56 1HE MET 56 2.395 -1.381 -16.544 447 HE3 MET 56 2HE MET 56 3.664 -0.557 -15.606 448 HA PRO 57 HA PRO 57 2.106 5.646 -19.921 449 HB2 PRO 57 2HB PRO 57 4.591 6.482 -19.147 450 HB3 PRO 57 3HB PRO 57 3.207 6.465 -18.071 451 HG2 PRO 57 2HG PRO 57 5.512 4.615 -18.156 452 HG3 PRO 57 3HG PRO 57 4.363 4.879 -16.859 453 HD2 PRO 57 2HD PRO 57 4.419 2.661 -18.676 454 HD3 PRO 57 3HD PRO 57 3.205 2.985 -17.455 455 H ASP 58 HN ASP 58 4.392 3.311 -20.910 456 HA ASP 58 HA ASP 58 5.188 5.030 -23.095 457 HB2 ASP 58 2HB ASP 58 6.447 2.570 -23.466 458 HB3 ASP 58 3HB ASP 58 7.153 3.966 -22.677 459 HD2 ASP 58 HD2 ASP 58 7.461 1.116 -22.222 460 H MET 59 HN MET 59 2.541 3.291 -22.456 461 HA MET 59 HA MET 59 2.510 1.976 -25.063 462 HB2 MET 59 2HB MET 59 1.276 1.298 -22.366 463 HB3 MET 59 3HB MET 59 0.486 0.723 -23.821 464 HG2 MET 59 2HG MET 59 2.897 -0.143 -24.491 465 HG3 MET 59 3HG MET 59 3.257 0.041 -22.785 466 HE1 MET 59 3HE MET 59 -0.071 -0.328 -22.155 467 HE2 MET 59 1HE MET 59 -0.081 -1.996 -21.532 468 HE3 MET 59 2HE MET 59 1.155 -0.844 -20.972 469 H VAL 60 HN VAL 60 1.794 4.845 -23.997 470 HA VAL 60 HA VAL 60 -0.831 4.894 -25.300 471 HB VAL 60 HB VAL 60 -0.028 6.416 -22.813 472 HG11 VAL 60 1HG1 VAL 60 -1.537 7.624 -24.441 473 HG12 VAL 60 2HG1 VAL 60 -2.739 6.340 -24.169 474 HG13 VAL 60 3HG1 VAL 60 -2.218 7.373 -22.816 475 HG21 VAL 60 3HG2 VAL 60 -2.290 4.441 -22.937 476 HG22 VAL 60 1HG2 VAL 60 -0.622 3.862 -22.711 477 HG23 VAL 60 2HG2 VAL 60 -1.338 4.995 -21.539 478 H LYS 61 HN LYS 61 -1.134 6.596 -26.745 479 HA LYS 61 HA LYS 61 1.299 8.005 -27.431 480 HB2 LYS 61 2HB LYS 61 -1.396 7.758 -28.795 481 HB3 LYS 61 3HB LYS 61 -0.070 8.718 -29.419 482 HG2 LYS 61 2HG LYS 61 1.359 6.533 -29.189 483 HG3 LYS 61 3HG LYS 61 -0.176 5.704 -29.028 484 HD2 LYS 61 2HD LYS 61 -0.130 7.613 -31.293 485 HD3 LYS 61 3HD LYS 61 1.080 6.354 -31.438 486 HE2 LYS 61 2HE LYS 61 -0.545 4.607 -31.405 487 HE3 LYS 61 3HE LYS 61 -1.774 5.634 -30.694 488 HZ1 LYS 61 2HZ LYS 61 -0.923 5.487 -33.484 489 HZ3 LYS 61 1HZ LYS 61 -1.368 6.958 -32.947 490 H GLY 62 HN GLY 62 1.426 10.327 -27.636 491 HA2 GLY 62 1HA GLY 62 1.180 12.400 -26.802 492 HA3 GLY 62 2HA GLY 62 -0.540 12.150 -27.023 493 H TYR 63 HN TYR 63 1.112 9.894 -24.896 494 HA TYR 63 HA TYR 63 -0.415 10.907 -22.668 495 HB2 TYR 63 2HB TYR 63 -0.241 8.485 -23.046 496 HB3 TYR 63 3HB TYR 63 1.488 8.586 -23.310 497 HD1 TYR 63 HD2 TYR 63 3.044 8.809 -21.405 498 HD2 TYR 63 HD1 TYR 63 -1.171 8.394 -20.802 499 HE1 TYR 63 HE2 TYR 63 3.443 8.229 -18.962 500 HE2 TYR 63 HE1 TYR 63 -0.758 7.814 -18.361 501 HH TYR 63 HH TYR 63 0.703 7.531 -16.804 502 H ALA 64 HN ALA 64 0.819 10.831 -20.429 503 HA ALA 64 HA ALA 64 3.480 11.310 -20.162 504 HB1 ALA 64 1HB ALA 64 2.745 14.053 -19.944 505 HB2 ALA 64 2HB ALA 64 3.904 13.316 -21.076 506 HB3 ALA 64 3HB ALA 64 2.195 13.493 -21.541 507 HA PRO 65 HA PRO 65 1.940 11.446 -16.121 508 HB2 PRO 65 2HB PRO 65 4.195 12.100 -14.723 509 HB3 PRO 65 3HB PRO 65 3.852 10.475 -15.283 510 HG2 PRO 65 2HG PRO 65 5.778 12.441 -16.365 511 HG3 PRO 65 3HG PRO 65 5.716 10.708 -16.621 512 HD2 PRO 65 2HD PRO 65 4.882 12.746 -18.459 513 HD3 PRO 65 3HD PRO 65 4.714 11.014 -18.668 514 H ALA 66 HN ALA 66 1.931 12.817 -13.994 515 HA ALA 66 HA ALA 66 2.028 15.633 -14.753 516 HB1 ALA 66 1HB ALA 66 -0.237 15.333 -15.180 517 HB2 ALA 66 2HB ALA 66 -0.403 14.038 -13.969 518 HB3 ALA 66 3HB ALA 66 -0.273 15.735 -13.446 Start of MODEL 9 1 H1 MET 0 HN MET 0 2.799 -1.713 0.427 2 HA MET 0 HA MET 0 1.622 0.364 -0.919 3 HB2 MET 0 2HB MET 0 4.126 -0.572 -0.753 4 HB3 MET 0 3HB MET 0 3.707 -1.434 -2.220 5 HG2 MET 0 2HG MET 0 4.737 0.693 -2.845 6 HG3 MET 0 3HG MET 0 3.043 0.751 -3.289 7 HE1 MET 0 3HE MET 0 5.596 2.474 -2.511 8 HE2 MET 0 1HE MET 0 4.651 3.980 -2.431 9 HE3 MET 0 2HE MET 0 5.500 3.384 -0.984 10 H ASN 1 HN ASN 1 -0.499 -0.198 -1.657 11 HA ASN 1 HA ASN 1 -0.409 -1.899 -4.016 12 HB2 ASN 1 2HB ASN 1 -2.677 -1.790 -1.958 13 HB3 ASN 1 3HB ASN 1 -2.694 -2.744 -3.428 14 HD21 ASN 1 1HD2 ASN 1 -2.986 -3.707 -0.779 15 HD22 ASN 1 2HD2 ASN 1 -1.683 -4.793 -0.427 16 H GLN 2 HN GLN 2 -0.360 0.039 -5.353 17 HA GLN 2 HA GLN 2 -2.578 1.867 -4.956 18 HB2 GLN 2 2HB GLN 2 -1.316 3.347 -6.541 19 HB3 GLN 2 3HB GLN 2 -0.403 2.943 -5.101 20 HG2 GLN 2 2HG GLN 2 1.223 1.932 -6.322 21 HG3 GLN 2 3HG GLN 2 0.056 0.918 -7.148 22 HE21 GLN 2 1HE2 GLN 2 -1.530 2.705 -8.439 23 HE22 GLN 2 2HE2 GLN 2 -0.645 3.575 -9.647 24 H GLU 3 HN GLU 3 -4.276 2.018 -6.406 25 HA GLU 3 HA GLU 3 -4.675 -0.072 -8.168 26 HB2 GLU 3 2HB GLU 3 -6.036 2.509 -7.516 27 HB3 GLU 3 3HB GLU 3 -6.442 1.809 -9.070 28 HG2 GLU 3 2HG GLU 3 -7.029 -0.346 -7.968 29 HG3 GLU 3 3HG GLU 3 -6.573 0.312 -6.409 30 HE2 GLU 3 HE2 GLU 3 -9.315 1.559 -5.631 31 H SER 4 HN SER 4 -4.195 -0.394 -10.326 32 HA SER 4 HA SER 4 -2.974 1.891 -11.669 33 HB2 SER 4 2HB SER 4 -2.303 -0.930 -12.481 34 HB3 SER 4 3HB SER 4 -1.323 0.518 -12.597 35 HG SER 4 HG SER 4 -1.336 -1.354 -10.629 36 H VAL 5 HN VAL 5 -3.525 2.215 -13.903 37 HA VAL 5 HA VAL 5 -6.106 1.561 -14.622 38 HB VAL 5 HB VAL 5 -3.712 2.366 -16.282 39 HG11 VAL 5 1HG1 VAL 5 -6.553 2.811 -17.160 40 HG12 VAL 5 2HG1 VAL 5 -5.061 2.735 -18.128 41 HG13 VAL 5 3HG1 VAL 5 -5.769 1.242 -17.466 42 HG21 VAL 5 3HG2 VAL 5 -4.005 4.396 -15.412 43 HG22 VAL 5 1HG2 VAL 5 -5.684 4.418 -16.001 44 HG23 VAL 5 2HG2 VAL 5 -5.317 3.771 -14.385 45 H VAL 6 HN VAL 6 -7.080 -0.121 -15.710 46 HA VAL 6 HA VAL 6 -5.320 -2.149 -16.859 47 HB VAL 6 HB VAL 6 -7.427 -2.572 -14.742 48 HG11 VAL 6 1HG1 VAL 6 -7.652 -4.159 -16.715 49 HG12 VAL 6 2HG1 VAL 6 -6.037 -4.775 -16.287 50 HG13 VAL 6 3HG1 VAL 6 -7.380 -4.917 -15.127 51 HG21 VAL 6 3HG2 VAL 6 -4.540 -2.477 -14.758 52 HG22 VAL 6 1HG2 VAL 6 -5.659 -2.645 -13.384 53 HG23 VAL 6 2HG2 VAL 6 -5.099 -4.091 -14.257 54 H ALA 7 HN ALA 7 -5.951 -2.542 -18.913 55 HA ALA 7 HA ALA 7 -8.018 -1.324 -20.166 56 HB1 ALA 7 1HB ALA 7 -7.832 -3.472 -21.706 57 HB2 ALA 7 2HB ALA 7 -6.467 -2.338 -21.568 58 HB3 ALA 7 3HB ALA 7 -6.460 -3.856 -20.639 59 H ALA 8 HN ALA 8 -10.073 -1.244 -19.328 60 HA ALA 8 HA ALA 8 -11.257 -3.439 -18.009 61 HB1 ALA 8 1HB ALA 8 -13.087 -1.442 -19.151 62 HB2 ALA 8 2HB ALA 8 -12.784 -1.871 -17.450 63 HB3 ALA 8 3HB ALA 8 -11.719 -0.711 -18.278 64 H VAL 9 HN VAL 9 -10.558 -2.857 -21.295 65 HA VAL 9 HA VAL 9 -12.149 -5.112 -22.061 66 HB VAL 9 HB VAL 9 -13.327 -3.911 -23.870 67 HG11 VAL 9 1HG1 VAL 9 -15.127 -3.094 -22.516 68 HG12 VAL 9 2HG1 VAL 9 -14.376 -4.451 -21.643 69 HG13 VAL 9 3HG1 VAL 9 -14.035 -2.776 -21.147 70 HG21 VAL 9 3HG2 VAL 9 -12.604 -1.863 -24.413 71 HG22 VAL 9 1HG2 VAL 9 -13.466 -1.278 -22.970 72 HG23 VAL 9 2HG2 VAL 9 -11.734 -1.678 -22.871 73 H LEU 10 HN LEU 10 -11.758 -5.527 -24.533 74 HA LEU 10 HA LEU 10 -8.970 -5.565 -24.889 75 HB2 LEU 10 2HB LEU 10 -10.124 -7.345 -25.804 76 HB3 LEU 10 3HB LEU 10 -11.362 -6.328 -26.515 77 HG LEU 10 HG LEU 10 -9.315 -5.449 -27.974 78 HD11 LEU 10 1HD1 LEU 10 -8.428 -8.290 -27.800 79 HD12 LEU 10 2HD1 LEU 10 -7.522 -6.824 -28.247 80 HD13 LEU 10 3HD1 LEU 10 -7.877 -7.164 -26.536 81 HD21 LEU 10 3HD2 LEU 10 -10.862 -6.234 -29.381 82 HD22 LEU 10 1HD2 LEU 10 -9.912 -7.739 -29.378 83 HD23 LEU 10 2HD2 LEU 10 -11.312 -7.569 -28.293 84 H ILE 11 HN ILE 11 -8.043 -3.511 -24.867 85 HA ILE 11 HA ILE 11 -9.140 -1.490 -26.610 86 HB ILE 11 HB ILE 11 -6.552 -1.195 -25.157 87 HG12 ILE 11 2HG1 ILE 11 -9.236 -1.606 -23.871 88 HG13 ILE 11 3HG1 ILE 11 -7.667 -2.226 -23.396 89 HG21 ILE 11 1HG2 ILE 11 -8.883 0.714 -25.367 90 HG22 ILE 11 2HG2 ILE 11 -7.184 1.068 -24.972 91 HG23 ILE 11 3HG2 ILE 11 -7.630 0.578 -26.624 92 HD11 ILE 11 3HD1 ILE 11 -8.479 0.715 -23.271 93 HD12 ILE 11 1HD1 ILE 11 -8.448 -0.401 -21.884 94 HD13 ILE 11 2HD1 ILE 11 -6.934 0.031 -22.713 95 HA PRO 12 HA PRO 12 -6.575 -2.935 -29.849 96 HB2 PRO 12 2HB PRO 12 -7.687 -1.428 -31.839 97 HB3 PRO 12 3HB PRO 12 -8.318 -2.989 -31.354 98 HG2 PRO 12 2HG PRO 12 -9.394 -0.297 -30.781 99 HG3 PRO 12 3HG PRO 12 -10.205 -1.847 -30.683 100 HD2 PRO 12 2HD PRO 12 -9.213 -0.288 -28.489 101 HD3 PRO 12 3HD PRO 12 -9.919 -1.889 -28.402 102 H ILE 13 HN ILE 13 -5.134 -1.967 -31.610 103 HA ILE 13 HA ILE 13 -3.533 -0.056 -30.258 104 HB ILE 13 HB ILE 13 -2.598 -1.816 -31.639 105 HG12 ILE 13 2HG1 ILE 13 -1.879 0.696 -33.104 106 HG13 ILE 13 3HG1 ILE 13 -1.619 0.633 -31.372 107 HG21 ILE 13 1HG2 ILE 13 -3.662 -2.373 -33.514 108 HG22 ILE 13 2HG2 ILE 13 -4.501 -0.805 -33.601 109 HG23 ILE 13 3HG2 ILE 13 -2.860 -0.974 -34.268 110 HD11 ILE 13 3HD1 ILE 13 -0.359 -1.050 -33.543 111 HD12 ILE 13 1HD1 ILE 13 0.414 -0.209 -32.177 112 HD13 ILE 13 2HD1 ILE 13 -0.496 -1.712 -31.897 113 H ASN 14 HN ASN 14 -2.985 2.112 -30.995 114 HA ASN 14 HA ASN 14 -3.666 4.148 -31.393 115 HB2 ASN 14 2HB ASN 14 -4.599 2.908 -34.036 116 HB3 ASN 14 3HB ASN 14 -4.271 4.611 -33.786 117 HD21 ASN 14 1HD2 ASN 14 -3.022 3.062 -35.722 118 HD22 ASN 14 2HD2 ASN 14 -1.330 2.927 -35.376 119 H THR 15 HN THR 15 -5.559 3.104 -29.759 120 HA THR 15 HA THR 15 -8.111 3.898 -30.998 121 HB THR 15 HB THR 15 -7.496 1.610 -29.056 122 HG1 THR 15 HG1 THR 15 -7.119 1.225 -31.348 123 HG21 THR 15 3HG2 THR 15 -10.135 1.466 -30.144 124 HG22 THR 15 1HG2 THR 15 -9.693 1.701 -28.436 125 HG23 THR 15 2HG2 THR 15 -9.961 3.111 -29.488 126 H ALA 16 HN ALA 16 -9.129 5.557 -30.058 127 HA ALA 16 HA ALA 16 -7.938 6.983 -27.999 128 HB1 ALA 16 1HB ALA 16 -10.746 6.932 -29.154 129 HB2 ALA 16 2HB ALA 16 -10.231 8.111 -27.924 130 HB3 ALA 16 3HB ALA 16 -9.430 8.075 -29.513 131 H LEU 17 HN LEU 17 -8.001 6.857 -25.791 132 HA LEU 17 HA LEU 17 -9.351 4.566 -24.677 133 HB2 LEU 17 2HB LEU 17 -7.502 6.642 -23.499 134 HB3 LEU 17 3HB LEU 17 -8.189 5.309 -22.592 135 HG LEU 17 HG LEU 17 -6.473 4.918 -25.055 136 HD11 LEU 17 1HD1 LEU 17 -4.577 4.531 -23.625 137 HD12 LEU 17 2HD1 LEU 17 -5.239 6.148 -23.283 138 HD13 LEU 17 3HD1 LEU 17 -5.564 4.799 -22.168 139 HD21 LEU 17 3HD2 LEU 17 -6.153 2.641 -23.997 140 HD22 LEU 17 1HD2 LEU 17 -7.489 3.061 -22.898 141 HD23 LEU 17 2HD2 LEU 17 -7.772 2.982 -24.654 142 H THR 18 HN THR 18 -11.054 4.602 -23.180 143 HA THR 18 HA THR 18 -12.272 7.244 -22.743 144 HB THR 18 HB THR 18 -14.485 5.824 -23.005 145 HG1 THR 18 HG1 THR 18 -13.839 4.084 -24.680 146 HG21 THR 18 3HG2 THR 18 -14.434 6.042 -25.502 147 HG22 THR 18 1HG2 THR 18 -13.830 7.519 -24.714 148 HG23 THR 18 2HG2 THR 18 -12.684 6.358 -25.427 149 H VAL 19 HN VAL 19 -14.042 7.058 -20.963 150 HA VAL 19 HA VAL 19 -12.679 5.996 -18.684 151 HB VAL 19 HB VAL 19 -14.135 8.165 -19.044 152 HG11 VAL 19 1HG1 VAL 19 -16.410 7.963 -18.228 153 HG12 VAL 19 2HG1 VAL 19 -16.190 6.895 -19.634 154 HG13 VAL 19 3HG1 VAL 19 -16.207 6.210 -17.991 155 HG21 VAL 19 3HG2 VAL 19 -13.443 8.392 -16.938 156 HG22 VAL 19 1HG2 VAL 19 -14.826 7.410 -16.397 157 HG23 VAL 19 2HG2 VAL 19 -13.272 6.628 -16.773 158 H GLY 20 HN GLY 20 -14.852 4.758 -21.034 159 HA2 GLY 20 1HA GLY 20 -15.948 2.768 -19.158 160 HA3 GLY 20 2HA GLY 20 -16.573 3.162 -20.748 161 H MET 21 HN MET 21 -13.125 3.101 -20.726 162 HA MET 21 HA MET 21 -13.218 0.382 -21.787 163 HB2 MET 21 2HB MET 21 -11.963 2.936 -22.713 164 HB3 MET 21 3HB MET 21 -10.899 1.547 -22.813 165 HG2 MET 21 2HG MET 21 -13.257 0.506 -23.846 166 HG3 MET 21 3HG MET 21 -13.347 2.170 -24.388 167 HE1 MET 21 3HE MET 21 -9.703 2.495 -26.008 168 HE2 MET 21 1HE MET 21 -11.203 3.387 -25.654 169 HE3 MET 21 2HE MET 21 -10.189 2.785 -24.321 170 H MET 22 HN MET 22 -11.537 2.746 -19.709 171 HA MET 22 HA MET 22 -9.584 0.718 -19.022 172 HB2 MET 22 2HB MET 22 -9.866 3.710 -18.427 173 HB3 MET 22 3HB MET 22 -8.623 2.733 -17.672 174 HG2 MET 22 2HG MET 22 -7.579 2.231 -19.794 175 HG3 MET 22 3HG MET 22 -8.962 2.815 -20.700 176 HE1 MET 22 3HE MET 22 -9.807 5.560 -19.440 177 HE2 MET 22 1HE MET 22 -8.802 6.604 -20.474 178 HE3 MET 22 2HE MET 22 -9.565 5.147 -21.155 179 H THR 23 HN THR 23 -8.970 0.724 -16.537 180 HA THR 23 HA THR 23 -11.132 1.296 -14.745 181 HB THR 23 HB THR 23 -11.555 -0.997 -16.104 182 HG1 THR 23 HG1 THR 23 -12.893 -0.254 -14.374 183 HG21 THR 23 3HG2 THR 23 -10.056 -1.965 -13.633 184 HG22 THR 23 1HG2 THR 23 -10.667 -2.928 -15.000 185 HG23 THR 23 2HG2 THR 23 -9.248 -1.877 -15.216 186 H THR 24 HN THR 24 -10.561 0.410 -12.470 187 HA THR 24 HA THR 24 -7.642 0.694 -12.179 188 HB THR 24 HB THR 24 -8.206 1.760 -9.998 189 HG1 THR 24 HG1 THR 24 -10.419 1.778 -9.408 190 HG21 THR 24 3HG2 THR 24 -9.875 2.836 -12.332 191 HG22 THR 24 1HG2 THR 24 -9.580 3.722 -10.816 192 HG23 THR 24 2HG2 THR 24 -8.222 3.338 -11.902 193 H ARG 25 HN ARG 25 -6.494 -0.890 -11.233 194 HA ARG 25 HA ARG 25 -7.797 -2.656 -9.433 195 HB2 ARG 25 2HB ARG 25 -7.675 -3.386 -12.209 196 HB3 ARG 25 3HB ARG 25 -6.494 -4.382 -11.383 197 HG2 ARG 25 2HG ARG 25 -8.180 -5.710 -10.656 198 HG3 ARG 25 3HG ARG 25 -8.768 -4.379 -9.681 199 HD2 ARG 25 2HD ARG 25 -10.513 -3.948 -11.104 200 HD3 ARG 25 3HD ARG 25 -9.510 -4.104 -12.532 201 HE ARG 25 HE ARG 25 -9.737 -6.717 -11.630 202 HH11 ARG 25 2HH2 ARG 25 -12.087 -4.192 -12.442 203 HH12 ARG 25 1HH2 ARG 25 -13.312 -5.316 -12.929 204 HH22 ARG 25 HH1 ARG 25 -12.858 -7.667 -12.821 205 H VAL 26 HN VAL 26 -6.238 -3.849 -8.149 206 HA VAL 26 HA VAL 26 -3.613 -2.686 -8.230 207 HB VAL 26 HB VAL 26 -4.862 -4.774 -6.432 208 HG11 VAL 26 1HG1 VAL 26 -2.233 -4.501 -6.682 209 HG12 VAL 26 2HG1 VAL 26 -2.514 -3.104 -5.615 210 HG13 VAL 26 3HG1 VAL 26 -2.997 -4.735 -5.091 211 HG21 VAL 26 3HG2 VAL 26 -5.701 -2.234 -6.611 212 HG22 VAL 26 1HG2 VAL 26 -5.631 -3.116 -5.067 213 HG23 VAL 26 2HG2 VAL 26 -4.325 -1.989 -5.509 214 H VAL 27 HN VAL 27 -2.872 -3.457 -10.321 215 HA VAL 27 HA VAL 27 -2.370 -6.347 -10.367 216 HB VAL 27 HB VAL 27 -2.290 -6.205 -12.710 217 HG11 VAL 27 1HG1 VAL 27 -4.566 -5.803 -11.438 218 HG12 VAL 27 2HG1 VAL 27 -4.482 -4.211 -12.230 219 HG13 VAL 27 3HG1 VAL 27 -4.483 -5.695 -13.212 220 HG21 VAL 27 3HG2 VAL 27 -2.666 -3.785 -13.745 221 HG22 VAL 27 1HG2 VAL 27 -1.857 -3.281 -12.242 222 HG23 VAL 27 2HG2 VAL 27 -1.039 -4.396 -13.362 223 H SER 28 HN SER 28 -0.218 -7.035 -11.220 224 HA SER 28 HA SER 28 1.794 -5.006 -10.649 225 HB2 SER 28 2HB SER 28 1.391 -6.885 -8.852 226 HB3 SER 28 3HB SER 28 2.220 -7.933 -9.985 227 HG SER 28 HG SER 28 3.795 -7.097 -8.600 228 HA PRO 29 HA PRO 29 3.677 -4.747 -10.882 229 HB2 PRO 29 2HB PRO 29 5.142 -3.136 -12.533 230 HB3 PRO 29 3HB PRO 29 5.808 -4.544 -11.730 231 HG2 PRO 29 2HG PRO 29 5.054 -4.212 -14.569 232 HG3 PRO 29 3HG PRO 29 6.091 -5.424 -13.844 233 HD2 PRO 29 2HD PRO 29 3.381 -5.782 -14.710 234 HD3 PRO 29 3HD PRO 29 4.380 -6.958 -13.880 235 H THR 30 HN THR 30 3.183 -2.605 -10.214 236 HA THR 30 HA THR 30 0.695 -1.777 -11.270 237 HB THR 30 HB THR 30 1.187 0.193 -9.675 238 HG1 THR 30 HG1 THR 30 3.211 -0.440 -8.378 239 HG21 THR 30 3HG2 THR 30 0.234 -2.150 -8.940 240 HG22 THR 30 1HG2 THR 30 1.884 -2.458 -8.348 241 HG23 THR 30 2HG2 THR 30 0.938 -1.103 -7.684 242 H GLY 31 HN GLY 31 0.265 -0.745 -13.106 243 HA2 GLY 31 1HA GLY 31 2.446 0.712 -14.415 244 HA3 GLY 31 2HA GLY 31 0.949 0.164 -15.143 245 H ILE 32 HN ILE 32 0.399 2.232 -16.004 246 HA ILE 32 HA ILE 32 0.512 4.645 -14.842 247 HB ILE 32 HB ILE 32 -1.673 3.472 -16.559 248 HG12 ILE 32 2HG1 ILE 32 0.720 5.194 -17.269 249 HG13 ILE 32 3HG1 ILE 32 0.632 3.458 -17.488 250 HG21 ILE 32 1HG2 ILE 32 -2.254 5.590 -15.176 251 HG22 ILE 32 2HG2 ILE 32 -1.154 6.422 -16.301 252 HG23 ILE 32 3HG2 ILE 32 -2.587 5.570 -16.925 253 HD11 ILE 32 3HD1 ILE 32 0.039 4.965 -19.523 254 HD12 ILE 32 1HD1 ILE 32 -1.066 3.620 -19.148 255 HD13 ILE 32 2HD1 ILE 32 -1.491 5.281 -18.670 256 HA PRO 33 HA PRO 33 -2.031 4.517 -11.349 257 HB2 PRO 33 2HB PRO 33 -2.284 7.191 -10.848 258 HB3 PRO 33 3HB PRO 33 -0.881 6.256 -10.371 259 HG2 PRO 33 2HG PRO 33 -1.154 8.185 -12.594 260 HG3 PRO 33 3HG PRO 33 0.307 7.574 -11.844 261 HD2 PRO 33 2HD PRO 33 -0.786 6.778 -14.374 262 HD3 PRO 33 3HD PRO 33 0.609 6.086 -13.571 263 H ALA 34 HN ALA 34 -4.154 4.687 -10.541 264 HA ALA 34 HA ALA 34 -6.051 4.689 -12.605 265 HB1 ALA 34 1HB ALA 34 -7.629 4.824 -10.525 266 HB2 ALA 34 2HB ALA 34 -6.574 3.402 -10.714 267 HB3 ALA 34 3HB ALA 34 -6.123 4.701 -9.584 268 H GLU 35 HN GLU 35 -4.404 7.252 -11.020 269 HA GLU 35 HA GLU 35 -6.580 9.090 -11.188 270 HB2 GLU 35 2HB GLU 35 -5.115 10.661 -10.182 271 HB3 GLU 35 3HB GLU 35 -4.653 9.127 -9.472 272 HG2 GLU 35 2HG GLU 35 -2.964 9.047 -11.556 273 HG3 GLU 35 3HG GLU 35 -3.189 10.784 -11.529 274 HE2 GLU 35 HE2 GLU 35 -3.272 9.784 -8.184 275 H ASP 36 HN ASP 36 -4.309 7.729 -13.368 276 HA ASP 36 HA ASP 36 -4.216 10.096 -15.009 277 HB2 ASP 36 2HB ASP 36 -2.779 7.490 -14.849 278 HB3 ASP 36 3HB ASP 36 -3.051 8.057 -16.485 279 HD2 ASP 36 HD2 ASP 36 0.044 9.399 -15.926 280 H ILE 37 HN ILE 37 -6.302 7.503 -14.395 281 HA ILE 37 HA ILE 37 -6.977 6.480 -16.856 282 HB ILE 37 HB ILE 37 -8.242 6.764 -14.211 283 HG12 ILE 37 2HG1 ILE 37 -7.670 4.562 -16.187 284 HG13 ILE 37 3HG1 ILE 37 -7.030 4.786 -14.572 285 HG21 ILE 37 1HG2 ILE 37 -10.441 6.016 -14.949 286 HG22 ILE 37 2HG2 ILE 37 -10.050 7.611 -15.634 287 HG23 ILE 37 3HG2 ILE 37 -9.935 6.154 -16.650 288 HD11 ILE 37 3HD1 ILE 37 -8.707 3.004 -14.527 289 HD12 ILE 37 1HD1 ILE 37 -9.337 4.408 -13.633 290 HD13 ILE 37 2HD1 ILE 37 -9.911 4.074 -15.284 291 HA PRO 38 HA PRO 38 -9.810 10.233 -17.370 292 HB2 PRO 38 2HB PRO 38 -9.512 12.398 -15.729 293 HB3 PRO 38 3HB PRO 38 -10.710 11.148 -15.458 294 HG2 PRO 38 2HG PRO 38 -8.165 11.615 -14.030 295 HG3 PRO 38 3HG PRO 38 -9.550 10.669 -13.523 296 HD2 PRO 38 2HD PRO 38 -7.067 9.664 -14.549 297 HD3 PRO 38 3HD PRO 38 -8.493 8.726 -14.151 298 H ARG 39 HN ARG 39 -6.521 10.231 -16.962 299 HA ARG 39 HA ARG 39 -6.243 12.647 -18.521 300 HB2 ARG 39 2HB ARG 39 -4.223 10.845 -17.103 301 HB3 ARG 39 3HB ARG 39 -3.733 12.186 -18.119 302 HG2 ARG 39 2HG ARG 39 -4.942 13.784 -16.687 303 HG3 ARG 39 3HG ARG 39 -5.617 12.478 -15.733 304 HD2 ARG 39 2HD ARG 39 -3.772 13.249 -14.435 305 HD3 ARG 39 3HD ARG 39 -3.169 11.795 -15.205 306 HE ARG 39 HE ARG 39 -2.352 14.565 -15.795 307 HH11 ARG 39 2HH2 ARG 39 -2.309 11.195 -16.889 308 HH12 ARG 39 1HH2 ARG 39 -0.945 11.421 -17.932 309 HH22 ARG 39 HH1 ARG 39 0.072 13.586 -18.082 310 H LEU 40 HN LEU 40 -6.406 9.201 -18.833 311 HA LEU 40 HA LEU 40 -4.781 9.125 -21.230 312 HB2 LEU 40 2HB LEU 40 -6.357 6.996 -19.776 313 HB3 LEU 40 3HB LEU 40 -5.376 6.719 -21.201 314 HG LEU 40 HG LEU 40 -4.147 7.935 -18.738 315 HD11 LEU 40 1HD1 LEU 40 -4.418 6.111 -17.510 316 HD12 LEU 40 2HD1 LEU 40 -5.395 5.375 -18.804 317 HD13 LEU 40 3HD1 LEU 40 -3.632 5.132 -18.772 318 HD21 LEU 40 3HD2 LEU 40 -2.984 7.819 -21.006 319 HD22 LEU 40 1HD2 LEU 40 -2.103 7.164 -19.605 320 HD23 LEU 40 2HD2 LEU 40 -2.902 6.059 -20.749 321 H ILE 41 HN ILE 41 -8.106 9.592 -20.229 322 HA ILE 41 HA ILE 41 -9.440 8.627 -22.453 323 HB ILE 41 HB ILE 41 -10.117 11.024 -20.744 324 HG12 ILE 41 2HG1 ILE 41 -10.320 8.073 -20.271 325 HG13 ILE 41 3HG1 ILE 41 -9.866 9.356 -19.167 326 HG21 ILE 41 1HG2 ILE 41 -11.377 10.683 -22.935 327 HG22 ILE 41 2HG2 ILE 41 -12.041 9.207 -22.195 328 HG23 ILE 41 3HG2 ILE 41 -12.348 10.792 -21.447 329 HD11 ILE 41 3HD1 ILE 41 -12.121 8.455 -18.635 330 HD12 ILE 41 1HD1 ILE 41 -12.207 10.170 -19.103 331 HD13 ILE 41 2HD1 ILE 41 -12.680 8.907 -20.263 332 H SER 42 HN SER 42 -9.846 9.383 -24.512 333 HA SER 42 HA SER 42 -9.870 10.787 -26.212 334 HB2 SER 42 2HB SER 42 -9.820 12.665 -24.323 335 HB3 SER 42 3HB SER 42 -8.160 12.869 -24.846 336 HG SER 42 HG SER 42 -10.585 13.362 -26.271 337 H MET 43 HN MET 43 -7.197 9.579 -24.471 338 HA MET 43 HA MET 43 -5.337 10.243 -26.596 339 HB2 MET 43 2HB MET 43 -4.775 8.709 -24.008 340 HB3 MET 43 3HB MET 43 -3.609 9.545 -25.015 341 HG2 MET 43 2HG MET 43 -5.336 11.614 -24.424 342 HG3 MET 43 3HG MET 43 -5.485 10.650 -22.969 343 HE1 MET 43 3HE MET 43 -3.243 9.187 -22.582 344 HE2 MET 43 1HE MET 43 -1.838 9.596 -23.596 345 HE3 MET 43 2HE MET 43 -1.878 10.095 -21.888 346 H GLN 44 HN GLN 44 -4.588 8.730 -28.063 347 HA GLN 44 HA GLN 44 -5.895 6.178 -27.961 348 HB2 GLN 44 2HB GLN 44 -4.035 7.395 -30.052 349 HB3 GLN 44 3HB GLN 44 -4.906 5.886 -30.242 350 HG2 GLN 44 2HG GLN 44 -7.066 7.036 -30.092 351 HG3 GLN 44 3HG GLN 44 -6.286 8.548 -29.671 352 HE21 GLN 44 1HE2 GLN 44 -6.624 6.094 -32.181 353 HE22 GLN 44 2HE2 GLN 44 -6.289 7.106 -33.546 354 H VAL 45 HN VAL 45 -4.753 4.114 -28.075 355 HA VAL 45 HA VAL 45 -2.257 4.231 -26.600 356 HB VAL 45 HB VAL 45 -2.627 1.757 -26.463 357 HG11 VAL 45 1HG1 VAL 45 -4.434 1.916 -24.820 358 HG12 VAL 45 2HG1 VAL 45 -3.329 3.304 -24.677 359 HG13 VAL 45 3HG1 VAL 45 -4.909 3.502 -25.474 360 HG21 VAL 45 3HG2 VAL 45 -4.247 2.015 -28.603 361 HG22 VAL 45 1HG2 VAL 45 -4.375 0.678 -27.436 362 HG23 VAL 45 2HG2 VAL 45 -5.461 2.082 -27.304 363 H ASN 46 HN ASN 46 -0.293 3.282 -27.328 364 HA ASN 46 HA ASN 46 -0.122 3.289 -30.199 365 HB2 ASN 46 2HB ASN 46 2.343 3.254 -29.795 366 HB3 ASN 46 3HB ASN 46 1.578 4.538 -28.880 367 HD21 ASN 46 1HD2 ASN 46 2.809 4.735 -27.145 368 HD22 ASN 46 2HD2 ASN 46 3.189 3.488 -26.004 369 H GLN 47 HN GLN 47 -1.444 1.062 -28.581 370 HA GLN 47 HA GLN 47 -0.408 -1.080 -29.996 371 HB2 GLN 47 2HB GLN 47 1.469 -1.278 -28.591 372 HB3 GLN 47 3HB GLN 47 0.589 -0.772 -27.162 373 HG2 GLN 47 2HG GLN 47 -0.619 -2.897 -27.063 374 HG3 GLN 47 3HG GLN 47 0.011 -3.389 -28.622 375 HE21 GLN 47 1HE2 GLN 47 1.590 -1.804 -25.861 376 HE22 GLN 47 2HE2 GLN 47 2.790 -3.016 -25.563 377 H VAL 48 HN VAL 48 -1.749 -2.995 -29.742 378 HA VAL 48 HA VAL 48 -4.337 -2.342 -28.704 379 HB VAL 48 HB VAL 48 -4.248 -3.478 -30.767 380 HG11 VAL 48 1HG1 VAL 48 -3.223 -5.891 -30.773 381 HG12 VAL 48 2HG1 VAL 48 -2.164 -4.474 -30.964 382 HG13 VAL 48 3HG1 VAL 48 -2.284 -5.289 -29.387 383 HG21 VAL 48 3HG2 VAL 48 -5.628 -4.520 -28.564 384 HG22 VAL 48 1HG2 VAL 48 -5.987 -4.795 -30.285 385 HG23 VAL 48 2HG2 VAL 48 -4.956 -5.942 -29.397 386 H VAL 49 HN VAL 49 -4.319 -2.198 -26.464 387 HA VAL 49 HA VAL 49 -2.998 -4.264 -24.947 388 HB VAL 49 HB VAL 49 -4.685 -1.897 -24.108 389 HG11 VAL 49 1HG1 VAL 49 -4.659 -3.540 -22.344 390 HG12 VAL 49 2HG1 VAL 49 -2.901 -3.762 -22.510 391 HG13 VAL 49 3HG1 VAL 49 -3.549 -2.221 -21.899 392 HG21 VAL 49 3HG2 VAL 49 -1.875 -2.163 -24.954 393 HG22 VAL 49 1HG2 VAL 49 -2.915 -0.722 -24.855 394 HG23 VAL 49 2HG2 VAL 49 -2.094 -1.329 -23.396 395 HA PRO 50 HA PRO 50 -6.640 -6.669 -24.902 396 HB2 PRO 50 2HB PRO 50 -5.623 -8.817 -23.552 397 HB3 PRO 50 3HB PRO 50 -5.467 -8.613 -25.285 398 HG2 PRO 50 2HG PRO 50 -3.422 -8.240 -23.184 399 HG3 PRO 50 3HG PRO 50 -3.197 -8.459 -24.908 400 HD2 PRO 50 2HD PRO 50 -3.000 -5.996 -23.451 401 HD3 PRO 50 3HD PRO 50 -2.890 -6.198 -25.188 402 H MET 51 HN MET 51 -8.430 -6.953 -23.633 403 HA MET 51 HA MET 51 -8.627 -5.413 -21.438 404 HB2 MET 51 2HB MET 51 -10.519 -6.532 -22.666 405 HB3 MET 51 3HB MET 51 -10.039 -8.081 -22.002 406 HG2 MET 51 2HG MET 51 -10.466 -7.226 -19.687 407 HG3 MET 51 3HG MET 51 -10.935 -5.671 -20.345 408 HE1 MET 51 3HE MET 51 -11.230 -9.315 -20.848 409 HE2 MET 51 1HE MET 51 -12.967 -9.696 -20.756 410 HE3 MET 51 2HE MET 51 -12.251 -9.174 -22.300 411 H GLY 52 HN GLY 52 -7.730 -5.437 -19.425 412 HA2 GLY 52 1HA GLY 52 -7.445 -6.585 -17.358 413 HA3 GLY 52 2HA GLY 52 -7.095 -8.061 -18.235 414 H THR 53 HN THR 53 -5.556 -5.927 -20.158 415 HA THR 53 HA THR 53 -3.006 -6.452 -18.899 416 HB THR 53 HB THR 53 -3.892 -5.205 -21.551 417 HG1 THR 53 HG1 THR 53 -4.099 -7.603 -20.895 418 HG21 THR 53 3HG2 THR 53 -1.650 -4.334 -21.063 419 HG22 THR 53 1HG2 THR 53 -1.117 -5.928 -20.479 420 HG23 THR 53 2HG2 THR 53 -1.475 -5.687 -22.206 421 H THR 54 HN THR 54 -1.957 -5.140 -17.552 422 HA THR 54 HA THR 54 -3.012 -2.749 -16.657 423 HB THR 54 HB THR 54 -0.050 -3.495 -16.684 424 HG1 THR 54 HG1 THR 54 -0.659 -5.103 -15.202 425 HG21 THR 54 3HG2 THR 54 -0.480 -1.440 -15.447 426 HG22 THR 54 1HG2 THR 54 -1.944 -2.130 -14.707 427 HG23 THR 54 2HG2 THR 54 -0.339 -2.743 -14.242 428 H LEU 55 HN LEU 55 -2.772 -0.588 -17.116 429 HA LEU 55 HA LEU 55 -1.930 -0.050 -19.819 430 HB2 LEU 55 2HB LEU 55 -3.944 0.877 -18.268 431 HB3 LEU 55 3HB LEU 55 -2.761 2.146 -18.023 432 HG LEU 55 HG LEU 55 -3.713 3.055 -19.840 433 HD11 LEU 55 1HD1 LEU 55 -2.295 0.967 -21.490 434 HD12 LEU 55 2HD1 LEU 55 -2.535 2.697 -21.832 435 HD13 LEU 55 3HD1 LEU 55 -1.408 2.192 -20.550 436 HD21 LEU 55 3HD2 LEU 55 -5.611 2.035 -20.407 437 HD22 LEU 55 1HD2 LEU 55 -4.657 1.177 -21.641 438 HD23 LEU 55 2HD2 LEU 55 -4.949 0.420 -20.056 439 H MET 56 HN MET 56 0.008 0.764 -20.443 440 HA MET 56 HA MET 56 1.775 1.567 -18.269 441 HB2 MET 56 2HB MET 56 2.235 0.396 -21.056 442 HB3 MET 56 3HB MET 56 3.550 1.136 -20.166 443 HG2 MET 56 2HG MET 56 1.858 -0.976 -18.801 444 HG3 MET 56 3HG MET 56 3.084 -1.478 -19.948 445 HE1 MET 56 3HE MET 56 2.533 -1.395 -16.453 446 HE2 MET 56 1HE MET 56 3.662 -0.255 -15.682 447 HE3 MET 56 2HE MET 56 2.292 0.359 -16.638 448 HA PRO 57 HA PRO 57 2.074 5.550 -19.963 449 HB2 PRO 57 2HB PRO 57 4.600 6.323 -19.261 450 HB3 PRO 57 3HB PRO 57 3.248 6.339 -18.146 451 HG2 PRO 57 2HG PRO 57 5.503 4.434 -18.297 452 HG3 PRO 57 3HG PRO 57 4.398 4.725 -16.968 453 HD2 PRO 57 2HD PRO 57 4.348 2.507 -18.786 454 HD3 PRO 57 3HD PRO 57 3.177 2.860 -17.531 455 H ASP 58 HN ASP 58 4.439 3.240 -20.941 456 HA ASP 58 HA ASP 58 5.136 4.915 -23.181 457 HB2 ASP 58 2HB ASP 58 6.351 2.712 -21.716 458 HB3 ASP 58 3HB ASP 58 6.281 2.297 -23.417 459 HD2 ASP 58 HD2 ASP 58 7.457 5.845 -22.771 460 H MET 59 HN MET 59 2.427 3.428 -22.603 461 HA MET 59 HA MET 59 2.381 1.950 -25.121 462 HB2 MET 59 2HB MET 59 1.177 1.423 -22.397 463 HB3 MET 59 3HB MET 59 0.225 0.940 -23.787 464 HG2 MET 59 2HG MET 59 2.564 -0.130 -24.584 465 HG3 MET 59 3HG MET 59 2.905 -0.103 -22.866 466 HE1 MET 59 3HE MET 59 -0.341 -0.106 -22.159 467 HE2 MET 59 1HE MET 59 -0.637 -1.814 -21.755 468 HE3 MET 59 2HE MET 59 0.786 -0.976 -21.090 469 H VAL 60 HN VAL 60 1.687 4.877 -23.950 470 HA VAL 60 HA VAL 60 -0.830 5.034 -25.452 471 HB VAL 60 HB VAL 60 -0.132 6.466 -22.880 472 HG11 VAL 60 1HG1 VAL 60 -2.348 7.452 -22.997 473 HG12 VAL 60 2HG1 VAL 60 -1.443 7.847 -24.478 474 HG13 VAL 60 3HG1 VAL 60 -2.692 6.580 -24.510 475 HG21 VAL 60 3HG2 VAL 60 -1.499 3.942 -23.441 476 HG22 VAL 60 1HG2 VAL 60 -0.906 4.606 -21.900 477 HG23 VAL 60 2HG2 VAL 60 -2.509 5.076 -22.513 478 H LYS 61 HN LYS 61 -0.923 6.670 -26.963 479 HA LYS 61 HA LYS 61 1.562 8.057 -27.429 480 HB2 LYS 61 2HB LYS 61 -1.032 7.927 -28.993 481 HB3 LYS 61 3HB LYS 61 0.396 8.797 -29.513 482 HG2 LYS 61 2HG LYS 61 1.654 6.516 -29.147 483 HG3 LYS 61 3HG LYS 61 0.055 5.801 -29.144 484 HD2 LYS 61 2HD LYS 61 0.339 7.676 -31.377 485 HD3 LYS 61 3HD LYS 61 1.618 6.479 -31.412 486 HE2 LYS 61 2HE LYS 61 0.141 4.693 -31.726 487 HE3 LYS 61 3HE LYS 61 -1.171 5.481 -30.873 488 HZ1 LYS 61 2HZ LYS 61 -1.179 5.335 -33.481 489 HZ3 LYS 61 1HZ LYS 61 -0.268 6.682 -33.395 490 H GLY 62 HN GLY 62 1.808 10.352 -27.520 491 HA2 GLY 62 1HA GLY 62 1.514 12.447 -26.766 492 HA3 GLY 62 2HA GLY 62 -0.203 12.210 -27.024 493 H TYR 63 HN TYR 63 1.254 9.875 -24.887 494 HA TYR 63 HA TYR 63 -0.251 10.951 -22.683 495 HB2 TYR 63 2HB TYR 63 -0.193 8.533 -23.041 496 HB3 TYR 63 3HB TYR 63 1.535 8.546 -23.332 497 HD1 TYR 63 HD2 TYR 63 3.128 8.735 -21.435 498 HD2 TYR 63 HD1 TYR 63 -1.090 8.416 -20.797 499 HE1 TYR 63 HE2 TYR 63 3.536 8.118 -19.003 500 HE2 TYR 63 HE1 TYR 63 -0.668 7.800 -18.366 501 HH TYR 63 HH TYR 63 1.859 8.431 -16.762 502 H ALA 64 HN ALA 64 0.927 10.796 -20.415 503 HA ALA 64 HA ALA 64 3.608 11.168 -20.102 504 HB1 ALA 64 1HB ALA 64 4.093 13.174 -20.988 505 HB2 ALA 64 2HB ALA 64 2.385 13.439 -21.416 506 HB3 ALA 64 3HB ALA 64 2.986 13.920 -19.811 507 HA PRO 65 HA PRO 65 2.043 11.268 -16.071 508 HB2 PRO 65 2HB PRO 65 4.281 11.904 -14.638 509 HB3 PRO 65 3HB PRO 65 3.948 10.288 -15.227 510 HG2 PRO 65 2HG PRO 65 5.881 12.273 -16.257 511 HG3 PRO 65 3HG PRO 65 5.826 10.545 -16.541 512 HD2 PRO 65 2HD PRO 65 5.007 12.609 -18.356 513 HD3 PRO 65 3HD PRO 65 4.845 10.881 -18.593 514 H ALA 66 HN ALA 66 1.731 12.560 -14.026 515 HA ALA 66 HA ALA 66 2.017 15.405 -14.623 516 HB1 ALA 66 1HB ALA 66 -0.183 15.181 -15.352 517 HB2 ALA 66 2HB ALA 66 -0.538 13.862 -14.211 518 HB3 ALA 66 3HB ALA 66 -0.423 15.539 -13.626 Start of MODEL 10 1 H1 MET 0 HN MET 0 3.831 -1.185 -2.139 2 HA MET 0 HA MET 0 1.816 -0.835 -0.080 3 HB2 MET 0 2HB MET 0 3.082 1.366 -0.762 4 HB3 MET 0 3HB MET 0 2.264 1.217 -2.304 5 HG2 MET 0 2HG MET 0 0.156 1.672 -1.398 6 HG3 MET 0 3HG MET 0 0.561 1.003 0.170 7 HE1 MET 0 3HE MET 0 -0.657 4.481 -0.500 8 HE2 MET 0 1HE MET 0 -0.986 3.001 0.433 9 HE3 MET 0 2HE MET 0 -0.288 4.426 1.240 10 H ASN 1 HN ASN 1 -0.408 -0.220 -1.297 11 HA ASN 1 HA ASN 1 -0.510 -2.003 -3.603 12 HB2 ASN 1 2HB ASN 1 -2.714 -1.367 -1.570 13 HB3 ASN 1 3HB ASN 1 -2.882 -2.464 -2.926 14 HD21 ASN 1 1HD2 ASN 1 -0.593 -3.857 -2.981 15 HD22 ASN 1 2HD2 ASN 1 -0.367 -4.795 -1.542 16 H GLN 2 HN GLN 2 -0.224 -0.248 -5.149 17 HA GLN 2 HA GLN 2 -2.218 1.858 -4.983 18 HB2 GLN 2 2HB GLN 2 -0.766 3.222 -6.242 19 HB3 GLN 2 3HB GLN 2 0.331 2.315 -5.220 20 HG2 GLN 2 2HG GLN 2 1.326 2.119 -7.354 21 HG3 GLN 2 3HG GLN 2 0.460 0.604 -7.190 22 HE21 GLN 2 1HE2 GLN 2 -0.465 3.949 -8.006 23 HE22 GLN 2 2HE2 GLN 2 -1.278 3.595 -9.493 24 H GLU 3 HN GLU 3 -3.823 2.092 -6.538 25 HA GLU 3 HA GLU 3 -4.301 -0.140 -8.174 26 HB2 GLU 3 2HB GLU 3 -5.649 2.458 -7.565 27 HB3 GLU 3 3HB GLU 3 -6.067 1.726 -9.101 28 HG2 GLU 3 2HG GLU 3 -6.631 -0.412 -7.936 29 HG3 GLU 3 3HG GLU 3 -6.200 0.308 -6.397 30 HE2 GLU 3 HE2 GLU 3 -8.846 -0.377 -8.078 31 H SER 4 HN SER 4 -4.050 -0.428 -10.411 32 HA SER 4 HA SER 4 -2.730 1.793 -11.765 33 HB2 SER 4 2HB SER 4 -2.121 -0.964 -12.720 34 HB3 SER 4 3HB SER 4 -1.066 0.429 -12.584 35 HG SER 4 HG SER 4 -1.320 -1.669 -10.875 36 H VAL 5 HN VAL 5 -3.322 2.121 -13.988 37 HA VAL 5 HA VAL 5 -5.936 1.536 -14.644 38 HB VAL 5 HB VAL 5 -3.555 2.277 -16.351 39 HG11 VAL 5 1HG1 VAL 5 -6.488 2.486 -17.101 40 HG12 VAL 5 2HG1 VAL 5 -5.081 2.906 -18.106 41 HG13 VAL 5 3HG1 VAL 5 -5.392 1.207 -17.675 42 HG21 VAL 5 3HG2 VAL 5 -3.914 4.423 -15.771 43 HG22 VAL 5 1HG2 VAL 5 -5.684 4.250 -15.845 44 HG23 VAL 5 2HG2 VAL 5 -4.800 3.736 -14.388 45 H VAL 6 HN VAL 6 -6.980 -0.122 -15.705 46 HA VAL 6 HA VAL 6 -5.307 -2.198 -16.893 47 HB VAL 6 HB VAL 6 -7.375 -2.584 -14.726 48 HG11 VAL 6 1HG1 VAL 6 -5.986 -4.814 -16.230 49 HG12 VAL 6 2HG1 VAL 6 -7.355 -4.921 -15.097 50 HG13 VAL 6 3HG1 VAL 6 -7.585 -4.190 -16.704 51 HG21 VAL 6 3HG2 VAL 6 -5.186 -4.083 -14.056 52 HG22 VAL 6 1HG2 VAL 6 -4.428 -2.694 -14.872 53 HG23 VAL 6 2HG2 VAL 6 -5.503 -2.429 -13.478 54 H ALA 7 HN ALA 7 -5.995 -2.482 -18.945 55 HA ALA 7 HA ALA 7 -8.148 -1.256 -20.062 56 HB1 ALA 7 1HB ALA 7 -6.685 -2.108 -21.621 57 HB2 ALA 7 2HB ALA 7 -6.440 -3.625 -20.723 58 HB3 ALA 7 3HB ALA 7 -7.922 -3.387 -21.680 59 H ALA 8 HN ALA 8 -10.156 -1.308 -19.100 60 HA ALA 8 HA ALA 8 -11.208 -3.600 -17.864 61 HB1 ALA 8 1HB ALA 8 -13.044 -1.522 -18.970 62 HB2 ALA 8 2HB ALA 8 -12.943 -2.204 -17.329 63 HB3 ALA 8 3HB ALA 8 -11.784 -0.956 -17.847 64 H VAL 9 HN VAL 9 -10.675 -2.833 -21.161 65 HA VAL 9 HA VAL 9 -12.201 -5.146 -21.945 66 HB VAL 9 HB VAL 9 -13.481 -3.989 -23.653 67 HG11 VAL 9 1HG1 VAL 9 -15.148 -2.944 -22.226 68 HG12 VAL 9 2HG1 VAL 9 -14.470 -4.372 -21.409 69 HG13 VAL 9 3HG1 VAL 9 -13.951 -2.740 -20.925 70 HG21 VAL 9 3HG2 VAL 9 -13.626 -1.562 -23.766 71 HG22 VAL 9 1HG2 VAL 9 -12.457 -1.403 -22.433 72 HG23 VAL 9 2HG2 VAL 9 -11.938 -2.080 -23.996 73 H LEU 10 HN LEU 10 -11.831 -5.500 -24.432 74 HA LEU 10 HA LEU 10 -9.049 -5.501 -24.818 75 HB2 LEU 10 2HB LEU 10 -10.307 -7.255 -25.734 76 HB3 LEU 10 3HB LEU 10 -11.425 -6.167 -26.533 77 HG LEU 10 HG LEU 10 -9.173 -5.430 -27.802 78 HD11 LEU 10 1HD1 LEU 10 -7.461 -6.854 -27.742 79 HD12 LEU 10 2HD1 LEU 10 -8.237 -7.569 -26.309 80 HD13 LEU 10 3HD1 LEU 10 -8.524 -8.271 -27.919 81 HD21 LEU 10 3HD2 LEU 10 -11.486 -6.890 -28.405 82 HD22 LEU 10 1HD2 LEU 10 -10.341 -6.147 -29.548 83 HD23 LEU 10 2HD2 LEU 10 -10.138 -7.848 -29.063 84 H ILE 11 HN ILE 11 -7.946 -3.600 -24.977 85 HA ILE 11 HA ILE 11 -9.116 -1.522 -26.665 86 HB ILE 11 HB ILE 11 -6.659 -1.135 -25.016 87 HG12 ILE 11 2HG1 ILE 11 -9.412 -1.655 -23.956 88 HG13 ILE 11 3HG1 ILE 11 -7.854 -2.135 -23.312 89 HG21 ILE 11 1HG2 ILE 11 -8.107 0.511 -26.633 90 HG22 ILE 11 2HG2 ILE 11 -8.839 0.850 -25.047 91 HG23 ILE 11 3HG2 ILE 11 -7.086 1.053 -25.280 92 HD11 ILE 11 3HD1 ILE 11 -9.248 0.538 -23.116 93 HD12 ILE 11 1HD1 ILE 11 -8.450 -0.412 -21.841 94 HD13 ILE 11 2HD1 ILE 11 -7.471 0.477 -23.032 95 HA PRO 12 HA PRO 12 -6.251 -2.970 -29.660 96 HB2 PRO 12 2HB PRO 12 -7.365 -1.691 -31.802 97 HB3 PRO 12 3HB PRO 12 -7.879 -3.275 -31.259 98 HG2 PRO 12 2HG PRO 12 -9.235 -0.670 -30.920 99 HG3 PRO 12 3HG PRO 12 -9.904 -2.283 -30.775 100 HD2 PRO 12 2HD PRO 12 -9.205 -0.516 -28.627 101 HD3 PRO 12 3HD PRO 12 -9.765 -2.170 -28.483 102 H ILE 13 HN ILE 13 -4.837 -1.936 -31.437 103 HA ILE 13 HA ILE 13 -3.427 0.114 -30.108 104 HB ILE 13 HB ILE 13 -2.281 -1.485 -31.454 105 HG12 ILE 13 2HG1 ILE 13 -2.092 1.124 -32.968 106 HG13 ILE 13 3HG1 ILE 13 -1.506 0.954 -31.325 107 HG21 ILE 13 1HG2 ILE 13 -4.443 -1.227 -33.215 108 HG22 ILE 13 2HG2 ILE 13 -3.029 -0.625 -34.113 109 HG23 ILE 13 3HG2 ILE 13 -3.005 -2.258 -33.405 110 HD11 ILE 13 3HD1 ILE 13 -0.517 -1.312 -32.758 111 HD12 ILE 13 1HD1 ILE 13 -0.241 0.113 -33.788 112 HD13 ILE 13 2HD1 ILE 13 0.413 0.071 -32.134 113 H ASN 14 HN ASN 14 -2.996 2.310 -30.940 114 HA ASN 14 HA ASN 14 -3.847 4.295 -31.302 115 HB2 ASN 14 2HB ASN 14 -4.256 2.758 -33.873 116 HB3 ASN 14 3HB ASN 14 -4.935 4.371 -33.786 117 HD21 ASN 14 1HD2 ASN 14 -2.412 2.765 -34.891 118 HD22 ASN 14 2HD2 ASN 14 -1.127 3.917 -34.739 119 H THR 15 HN THR 15 -5.635 3.052 -29.646 120 HA THR 15 HA THR 15 -8.262 3.648 -30.842 121 HB THR 15 HB THR 15 -7.446 1.500 -28.815 122 HG1 THR 15 HG1 THR 15 -7.001 0.943 -31.019 123 HG21 THR 15 3HG2 THR 15 -9.995 0.923 -29.784 124 HG22 THR 15 1HG2 THR 15 -9.657 1.618 -28.180 125 HG23 THR 15 2HG2 THR 15 -10.074 2.685 -29.543 126 H ALA 16 HN ALA 16 -9.194 5.411 -30.040 127 HA ALA 16 HA ALA 16 -8.145 6.918 -28.006 128 HB1 ALA 16 1HB ALA 16 -11.113 6.872 -28.508 129 HB2 ALA 16 2HB ALA 16 -10.018 8.261 -28.309 130 HB3 ALA 16 3HB ALA 16 -10.015 7.336 -29.830 131 H LEU 17 HN LEU 17 -8.103 6.781 -25.810 132 HA LEU 17 HA LEU 17 -9.424 4.510 -24.614 133 HB2 LEU 17 2HB LEU 17 -7.520 6.589 -23.529 134 HB3 LEU 17 3HB LEU 17 -8.179 5.267 -22.586 135 HG LEU 17 HG LEU 17 -6.539 4.865 -25.099 136 HD11 LEU 17 1HD1 LEU 17 -4.627 4.402 -23.679 137 HD12 LEU 17 2HD1 LEU 17 -5.222 6.056 -23.392 138 HD13 LEU 17 3HD1 LEU 17 -5.587 4.763 -22.224 139 HD21 LEU 17 3HD2 LEU 17 -6.203 2.584 -23.897 140 HD22 LEU 17 1HD2 LEU 17 -7.680 3.032 -23.010 141 HD23 LEU 17 2HD2 LEU 17 -7.714 2.897 -24.785 142 H THR 18 HN THR 18 -11.113 4.571 -23.126 143 HA THR 18 HA THR 18 -12.280 7.235 -22.662 144 HB THR 18 HB THR 18 -14.519 6.038 -22.934 145 HG1 THR 18 HG1 THR 18 -12.713 4.053 -24.113 146 HG21 THR 18 3HG2 THR 18 -14.305 5.645 -25.450 147 HG22 THR 18 1HG2 THR 18 -13.736 7.245 -24.918 148 HG23 THR 18 2HG2 THR 18 -12.561 5.960 -25.287 149 H VAL 19 HN VAL 19 -14.033 7.044 -20.838 150 HA VAL 19 HA VAL 19 -12.592 6.020 -18.580 151 HB VAL 19 HB VAL 19 -14.030 8.199 -18.918 152 HG11 VAL 19 1HG1 VAL 19 -16.287 7.948 -17.885 153 HG12 VAL 19 2HG1 VAL 19 -16.135 7.140 -19.464 154 HG13 VAL 19 3HG1 VAL 19 -16.089 6.181 -17.965 155 HG21 VAL 19 3HG2 VAL 19 -13.689 8.543 -16.711 156 HG22 VAL 19 1HG2 VAL 19 -14.555 7.062 -16.239 157 HG23 VAL 19 2HG2 VAL 19 -12.863 6.968 -16.783 158 H GLY 20 HN GLY 20 -14.834 4.764 -20.850 159 HA2 GLY 20 1HA GLY 20 -15.886 2.806 -18.914 160 HA3 GLY 20 2HA GLY 20 -16.568 3.191 -20.481 161 H MET 21 HN MET 21 -13.122 3.105 -20.595 162 HA MET 21 HA MET 21 -13.278 0.382 -21.635 163 HB2 MET 21 2HB MET 21 -12.004 2.918 -22.597 164 HB3 MET 21 3HB MET 21 -10.986 1.500 -22.748 165 HG2 MET 21 2HG MET 21 -13.406 0.529 -23.695 166 HG3 MET 21 3HG MET 21 -13.480 2.201 -24.217 167 HE1 MET 21 3HE MET 21 -9.940 2.485 -26.029 168 HE2 MET 21 1HE MET 21 -11.386 3.390 -25.522 169 HE3 MET 21 2HE MET 21 -10.276 2.730 -24.298 170 H MET 22 HN MET 22 -11.558 2.708 -19.567 171 HA MET 22 HA MET 22 -9.582 0.673 -18.959 172 HB2 MET 22 2HB MET 22 -9.831 3.654 -18.286 173 HB3 MET 22 3HB MET 22 -8.542 2.651 -17.650 174 HG2 MET 22 2HG MET 22 -7.650 2.220 -19.860 175 HG3 MET 22 3HG MET 22 -9.083 2.854 -20.644 176 HE1 MET 22 3HE MET 22 -9.919 5.353 -19.351 177 HE2 MET 22 1HE MET 22 -8.901 6.651 -20.021 178 HE3 MET 22 2HE MET 22 -9.542 5.381 -21.091 179 H THR 23 HN THR 23 -8.872 0.911 -16.420 180 HA THR 23 HA THR 23 -10.975 1.411 -14.593 181 HB THR 23 HB THR 23 -11.691 -0.766 -15.839 182 HG1 THR 23 HG1 THR 23 -12.274 0.074 -13.599 183 HG21 THR 23 3HG2 THR 23 -10.210 -2.422 -13.957 184 HG22 THR 23 1HG2 THR 23 -10.331 -2.597 -15.724 185 HG23 THR 23 2HG2 THR 23 -9.064 -1.566 -15.017 186 H THR 24 HN THR 24 -10.353 0.489 -12.339 187 HA THR 24 HA THR 24 -7.418 0.682 -12.146 188 HB THR 24 HB THR 24 -7.865 1.787 -9.960 189 HG1 THR 24 HG1 THR 24 -9.921 0.542 -9.684 190 HG21 THR 24 3HG2 THR 24 -9.631 2.919 -12.196 191 HG22 THR 24 1HG2 THR 24 -9.136 3.805 -10.733 192 HG23 THR 24 2HG2 THR 24 -7.915 3.316 -11.932 193 H ARG 25 HN ARG 25 -6.313 -0.974 -11.295 194 HA ARG 25 HA ARG 25 -7.623 -2.670 -9.420 195 HB2 ARG 25 2HB ARG 25 -7.611 -3.410 -12.193 196 HB3 ARG 25 3HB ARG 25 -6.433 -4.441 -11.405 197 HG2 ARG 25 2HG ARG 25 -8.135 -5.718 -10.626 198 HG3 ARG 25 3HG ARG 25 -8.644 -4.372 -9.626 199 HD2 ARG 25 2HD ARG 25 -10.444 -3.920 -10.961 200 HD3 ARG 25 3HD ARG 25 -9.489 -4.018 -12.427 201 HE ARG 25 HE ARG 25 -9.671 -6.655 -11.745 202 HH11 ARG 25 2HH2 ARG 25 -12.147 -4.129 -11.944 203 HH12 ARG 25 1HH2 ARG 25 -13.419 -5.234 -12.342 204 HH22 ARG 25 HH1 ARG 25 -12.928 -7.572 -12.530 205 H VAL 26 HN VAL 26 -6.081 -3.798 -8.106 206 HA VAL 26 HA VAL 26 -3.424 -2.765 -8.279 207 HB VAL 26 HB VAL 26 -4.677 -4.828 -6.455 208 HG11 VAL 26 1HG1 VAL 26 -1.995 -3.455 -6.464 209 HG12 VAL 26 2HG1 VAL 26 -2.743 -3.970 -4.933 210 HG13 VAL 26 3HG1 VAL 26 -2.387 -5.171 -6.199 211 HG21 VAL 26 3HG2 VAL 26 -5.343 -2.167 -6.652 212 HG22 VAL 26 1HG2 VAL 26 -5.531 -3.171 -5.194 213 HG23 VAL 26 2HG2 VAL 26 -4.088 -2.147 -5.389 214 H VAL 27 HN VAL 27 -2.776 -3.560 -10.400 215 HA VAL 27 HA VAL 27 -2.327 -6.459 -10.437 216 HB VAL 27 HB VAL 27 -2.341 -6.345 -12.784 217 HG11 VAL 27 1HG1 VAL 27 -4.559 -5.925 -11.444 218 HG12 VAL 27 2HG1 VAL 27 -4.483 -4.316 -12.201 219 HG13 VAL 27 3HG1 VAL 27 -4.544 -5.776 -13.218 220 HG21 VAL 27 3HG2 VAL 27 -1.046 -4.530 -13.423 221 HG22 VAL 27 1HG2 VAL 27 -2.678 -3.997 -13.892 222 HG23 VAL 27 2HG2 VAL 27 -1.940 -3.389 -12.390 223 H SER 28 HN SER 28 -0.222 -7.162 -11.449 224 HA SER 28 HA SER 28 1.840 -5.166 -10.956 225 HB2 SER 28 2HB SER 28 1.442 -7.125 -9.171 226 HB3 SER 28 3HB SER 28 2.373 -8.065 -10.320 227 HG SER 28 HG SER 28 3.326 -6.415 -8.459 228 HA PRO 29 HA PRO 29 3.713 -4.934 -11.277 229 HB2 PRO 29 2HB PRO 29 5.122 -3.357 -13.008 230 HB3 PRO 29 3HB PRO 29 5.806 -4.766 -12.222 231 HG2 PRO 29 2HG PRO 29 4.928 -4.452 -15.027 232 HG3 PRO 29 3HG PRO 29 5.982 -5.670 -14.337 233 HD2 PRO 29 2HD PRO 29 3.231 -6.002 -15.077 234 HD3 PRO 29 3HD PRO 29 4.252 -7.182 -14.280 235 H THR 30 HN THR 30 3.281 -2.776 -10.612 236 HA THR 30 HA THR 30 0.761 -1.923 -11.594 237 HB THR 30 HB THR 30 1.353 0.047 -10.004 238 HG1 THR 30 HG1 THR 30 3.340 -0.718 -8.712 239 HG21 THR 30 3HG2 THR 30 1.871 -2.685 -8.746 240 HG22 THR 30 1HG2 THR 30 1.097 -1.266 -8.002 241 HG23 THR 30 2HG2 THR 30 0.240 -2.190 -9.259 242 H GLY 31 HN GLY 31 0.288 -0.832 -13.385 243 HA2 GLY 31 1HA GLY 31 2.465 0.578 -14.753 244 HA3 GLY 31 2HA GLY 31 0.925 0.088 -15.432 245 H ILE 32 HN ILE 32 0.445 2.202 -16.246 246 HA ILE 32 HA ILE 32 0.667 4.582 -15.040 247 HB ILE 32 HB ILE 32 -1.595 3.516 -16.726 248 HG12 ILE 32 2HG1 ILE 32 0.752 5.260 -17.512 249 HG13 ILE 32 3HG1 ILE 32 0.766 3.512 -17.639 250 HG21 ILE 32 1HG2 ILE 32 -0.990 6.444 -16.422 251 HG22 ILE 32 2HG2 ILE 32 -2.464 5.642 -17.016 252 HG23 ILE 32 3HG2 ILE 32 -2.077 5.620 -15.279 253 HD11 ILE 32 3HD1 ILE 32 -0.774 3.475 -19.379 254 HD12 ILE 32 1HD1 ILE 32 -1.590 4.957 -18.828 255 HD13 ILE 32 2HD1 ILE 32 -0.030 5.064 -19.680 256 HA PRO 33 HA PRO 33 -1.789 4.473 -11.486 257 HB2 PRO 33 2HB PRO 33 -1.942 7.145 -10.931 258 HB3 PRO 33 3HB PRO 33 -0.559 6.156 -10.508 259 HG2 PRO 33 2HG PRO 33 -0.826 8.134 -12.688 260 HG3 PRO 33 3HG PRO 33 0.633 7.462 -11.988 261 HD2 PRO 33 2HD PRO 33 -0.550 6.749 -14.502 262 HD3 PRO 33 3HD PRO 33 0.842 5.998 -13.748 263 H ALA 34 HN ALA 34 -3.885 4.682 -10.626 264 HA ALA 34 HA ALA 34 -5.832 4.792 -12.639 265 HB1 ALA 34 1HB ALA 34 -5.945 4.884 -9.603 266 HB2 ALA 34 2HB ALA 34 -7.393 4.787 -10.634 267 HB3 ALA 34 3HB ALA 34 -6.190 3.475 -10.662 268 H GLU 35 HN GLU 35 -4.064 7.267 -11.045 269 HA GLU 35 HA GLU 35 -6.176 9.177 -11.082 270 HB2 GLU 35 2HB GLU 35 -4.590 10.693 -10.159 271 HB3 GLU 35 3HB GLU 35 -4.177 9.136 -9.470 272 HG2 GLU 35 2HG GLU 35 -2.578 8.960 -11.605 273 HG3 GLU 35 3HG GLU 35 -2.730 10.706 -11.612 274 HE2 GLU 35 HE2 GLU 35 -2.256 8.854 -8.388 275 H ASP 36 HN ASP 36 -4.224 7.735 -13.452 276 HA ASP 36 HA ASP 36 -4.131 10.147 -15.051 277 HB2 ASP 36 2HB ASP 36 -2.241 8.259 -14.731 278 HB3 ASP 36 3HB ASP 36 -3.136 7.461 -16.009 279 HD2 ASP 36 HD2 ASP 36 -0.363 9.834 -16.694 280 H ILE 37 HN ILE 37 -6.211 7.593 -14.330 281 HA ILE 37 HA ILE 37 -7.024 6.555 -16.739 282 HB ILE 37 HB ILE 37 -8.161 6.906 -14.044 283 HG12 ILE 37 2HG1 ILE 37 -7.759 4.651 -16.008 284 HG13 ILE 37 3HG1 ILE 37 -6.981 4.905 -14.459 285 HG21 ILE 37 1HG2 ILE 37 -9.956 6.357 -16.423 286 HG22 ILE 37 2HG2 ILE 37 -10.402 6.126 -14.715 287 HG23 ILE 37 3HG2 ILE 37 -10.035 7.757 -15.327 288 HD11 ILE 37 3HD1 ILE 37 -9.848 4.057 -14.999 289 HD12 ILE 37 1HD1 ILE 37 -8.609 3.222 -14.033 290 HD13 ILE 37 2HD1 ILE 37 -9.358 4.716 -13.420 291 HA PRO 38 HA PRO 38 -9.804 10.356 -17.182 292 HB2 PRO 38 2HB PRO 38 -9.395 12.536 -15.585 293 HB3 PRO 38 3HB PRO 38 -10.603 11.312 -15.246 294 HG2 PRO 38 2HG PRO 38 -7.989 11.750 -13.936 295 HG3 PRO 38 3HG PRO 38 -9.368 10.837 -13.357 296 HD2 PRO 38 2HD PRO 38 -6.951 9.771 -14.474 297 HD3 PRO 38 3HD PRO 38 -8.376 8.866 -14.003 298 H ARG 39 HN ARG 39 -6.498 10.307 -16.905 299 HA ARG 39 HA ARG 39 -6.247 12.691 -18.516 300 HB2 ARG 39 2HB ARG 39 -4.181 10.875 -17.181 301 HB3 ARG 39 3HB ARG 39 -3.739 12.230 -18.201 302 HG2 ARG 39 2HG ARG 39 -4.837 13.816 -16.698 303 HG3 ARG 39 3HG ARG 39 -5.546 12.518 -15.759 304 HD2 ARG 39 2HD ARG 39 -3.699 13.024 -14.422 305 HD3 ARG 39 3HD ARG 39 -3.011 11.761 -15.424 306 HE ARG 39 HE ARG 39 -2.378 14.631 -15.539 307 HH11 ARG 39 2HH2 ARG 39 -2.195 11.531 -17.244 308 HH12 ARG 39 1HH2 ARG 39 -0.885 12.028 -18.263 309 HH22 ARG 39 HH1 ARG 39 0.008 14.240 -18.032 310 H LEU 40 HN LEU 40 -6.284 9.189 -18.694 311 HA LEU 40 HA LEU 40 -4.806 9.050 -21.152 312 HB2 LEU 40 2HB LEU 40 -6.422 7.010 -19.619 313 HB3 LEU 40 3HB LEU 40 -5.510 6.664 -21.075 314 HG LEU 40 HG LEU 40 -4.178 7.838 -18.635 315 HD11 LEU 40 1HD1 LEU 40 -4.626 5.986 -17.486 316 HD12 LEU 40 2HD1 LEU 40 -5.327 5.179 -18.910 317 HD13 LEU 40 3HD1 LEU 40 -3.570 5.125 -18.631 318 HD21 LEU 40 3HD2 LEU 40 -2.158 7.074 -19.581 319 HD22 LEU 40 1HD2 LEU 40 -3.003 6.049 -20.766 320 HD23 LEU 40 2HD2 LEU 40 -3.064 7.822 -20.919 321 H ILE 41 HN ILE 41 -8.091 9.669 -20.118 322 HA ILE 41 HA ILE 41 -9.495 8.708 -22.302 323 HB ILE 41 HB ILE 41 -10.063 11.169 -20.647 324 HG12 ILE 41 2HG1 ILE 41 -10.324 8.245 -20.067 325 HG13 ILE 41 3HG1 ILE 41 -9.834 9.558 -19.015 326 HG21 ILE 41 1HG2 ILE 41 -12.385 10.799 -21.220 327 HG22 ILE 41 2HG2 ILE 41 -11.417 10.970 -22.704 328 HG23 ILE 41 3HG2 ILE 41 -11.954 9.358 -22.173 329 HD11 ILE 41 3HD1 ILE 41 -12.670 9.116 -20.059 330 HD12 ILE 41 1HD1 ILE 41 -12.096 8.719 -18.422 331 HD13 ILE 41 2HD1 ILE 41 -12.161 10.416 -18.955 332 H SER 42 HN SER 42 -9.881 9.425 -24.375 333 HA SER 42 HA SER 42 -9.882 10.798 -26.103 334 HB2 SER 42 2HB SER 42 -9.745 12.712 -24.258 335 HB3 SER 42 3HB SER 42 -8.082 12.843 -24.795 336 HG SER 42 HG SER 42 -9.888 12.714 -26.922 337 H MET 43 HN MET 43 -7.233 9.531 -24.366 338 HA MET 43 HA MET 43 -5.382 10.075 -26.535 339 HB2 MET 43 2HB MET 43 -4.783 8.571 -23.944 340 HB3 MET 43 3HB MET 43 -3.651 9.439 -24.962 341 HG2 MET 43 2HG MET 43 -5.341 11.494 -24.339 342 HG3 MET 43 3HG MET 43 -5.567 10.504 -22.911 343 HE1 MET 43 3HE MET 43 -1.937 9.419 -23.603 344 HE2 MET 43 1HE MET 43 -1.885 9.826 -21.871 345 HE3 MET 43 2HE MET 43 -3.294 8.970 -22.543 346 H GLN 44 HN GLN 44 -4.686 8.487 -27.952 347 HA GLN 44 HA GLN 44 -6.020 5.942 -27.663 348 HB2 GLN 44 2HB GLN 44 -4.348 6.919 -30.014 349 HB3 GLN 44 3HB GLN 44 -5.499 5.598 -30.010 350 HG2 GLN 44 2HG GLN 44 -7.375 7.060 -29.846 351 HG3 GLN 44 3HG GLN 44 -6.403 8.398 -29.267 352 HE21 GLN 44 1HE2 GLN 44 -6.774 6.213 -32.044 353 HE22 GLN 44 2HE2 GLN 44 -6.422 7.367 -33.287 354 H VAL 45 HN VAL 45 -4.867 3.896 -27.803 355 HA VAL 45 HA VAL 45 -2.318 4.033 -26.498 356 HB VAL 45 HB VAL 45 -2.539 1.514 -26.666 357 HG11 VAL 45 1HG1 VAL 45 -4.862 2.952 -25.343 358 HG12 VAL 45 2HG1 VAL 45 -4.143 1.394 -24.869 359 HG13 VAL 45 3HG1 VAL 45 -3.206 2.898 -24.690 360 HG21 VAL 45 3HG2 VAL 45 -4.281 0.496 -27.693 361 HG22 VAL 45 1HG2 VAL 45 -5.432 1.781 -27.254 362 HG23 VAL 45 2HG2 VAL 45 -4.339 2.000 -28.642 363 H ASN 46 HN ASN 46 -0.333 3.077 -27.313 364 HA ASN 46 HA ASN 46 -0.213 3.365 -30.197 365 HB2 ASN 46 2HB ASN 46 2.223 3.657 -29.866 366 HB3 ASN 46 3HB ASN 46 1.354 4.744 -28.801 367 HD21 ASN 46 1HD2 ASN 46 2.437 4.930 -26.996 368 HD22 ASN 46 2HD2 ASN 46 3.104 3.652 -26.036 369 H GLN 47 HN GLN 47 -1.305 0.949 -28.816 370 HA GLN 47 HA GLN 47 0.005 -0.997 -30.260 371 HB2 GLN 47 2HB GLN 47 1.863 -1.039 -28.809 372 HB3 GLN 47 3HB GLN 47 0.891 -0.735 -27.382 373 HG2 GLN 47 2HG GLN 47 -0.126 -3.009 -27.582 374 HG3 GLN 47 3HG GLN 47 0.827 -3.314 -29.021 375 HE21 GLN 47 1HE2 GLN 47 1.547 -1.777 -25.889 376 HE22 GLN 47 2HE2 GLN 47 2.889 -2.781 -25.454 377 H VAL 48 HN VAL 48 -0.945 -3.218 -29.814 378 HA VAL 48 HA VAL 48 -3.701 -2.886 -29.097 379 HB VAL 48 HB VAL 48 -1.972 -4.996 -30.306 380 HG11 VAL 48 1HG1 VAL 48 -4.405 -5.513 -28.673 381 HG12 VAL 48 2HG1 VAL 48 -4.311 -6.337 -30.248 382 HG13 VAL 48 3HG1 VAL 48 -3.021 -6.570 -29.044 383 HG21 VAL 48 3HG2 VAL 48 -3.663 -4.938 -32.062 384 HG22 VAL 48 1HG2 VAL 48 -4.673 -3.846 -31.084 385 HG23 VAL 48 2HG2 VAL 48 -3.098 -3.290 -31.697 386 H VAL 49 HN VAL 49 -4.268 -2.782 -26.982 387 HA VAL 49 HA VAL 49 -2.841 -4.585 -25.153 388 HB VAL 49 HB VAL 49 -2.409 -2.627 -24.162 389 HG11 VAL 49 1HG1 VAL 49 -3.839 -0.554 -24.462 390 HG12 VAL 49 2HG1 VAL 49 -3.077 -1.190 -25.940 391 HG13 VAL 49 3HG1 VAL 49 -4.804 -1.490 -25.629 392 HG21 VAL 49 3HG2 VAL 49 -5.263 -2.379 -23.279 393 HG22 VAL 49 1HG2 VAL 49 -4.365 -3.860 -22.871 394 HG23 VAL 49 2HG2 VAL 49 -3.759 -2.275 -22.332 395 HA PRO 50 HA PRO 50 -6.725 -6.586 -25.029 396 HB2 PRO 50 2HB PRO 50 -5.950 -8.739 -23.535 397 HB3 PRO 50 3HB PRO 50 -5.769 -8.666 -25.277 398 HG2 PRO 50 2HG PRO 50 -3.700 -8.381 -23.185 399 HG3 PRO 50 3HG PRO 50 -3.496 -8.734 -24.889 400 HD2 PRO 50 2HD PRO 50 -3.036 -6.218 -23.590 401 HD3 PRO 50 3HD PRO 50 -2.945 -6.542 -25.310 402 H MET 51 HN MET 51 -8.357 -7.378 -23.438 403 HA MET 51 HA MET 51 -8.547 -5.409 -21.468 404 HB2 MET 51 2HB MET 51 -10.526 -6.490 -22.493 405 HB3 MET 51 3HB MET 51 -10.015 -8.065 -21.918 406 HG2 MET 51 2HG MET 51 -10.299 -7.315 -19.557 407 HG3 MET 51 3HG MET 51 -10.759 -5.716 -20.106 408 HE1 MET 51 3HE MET 51 -12.128 -9.237 -21.919 409 HE2 MET 51 1HE MET 51 -11.281 -9.374 -20.360 410 HE3 MET 51 2HE MET 51 -13.041 -9.630 -20.442 411 H GLY 52 HN GLY 52 -7.654 -5.312 -19.452 412 HA2 GLY 52 1HA GLY 52 -7.332 -6.333 -17.327 413 HA3 GLY 52 2HA GLY 52 -6.988 -7.858 -18.119 414 H THR 53 HN THR 53 -5.426 -6.093 -20.249 415 HA THR 53 HA THR 53 -2.881 -6.481 -19.014 416 HB THR 53 HB THR 53 -3.911 -5.387 -21.670 417 HG1 THR 53 HG1 THR 53 -3.800 -7.749 -20.932 418 HG21 THR 53 3HG2 THR 53 -1.346 -4.816 -20.498 419 HG22 THR 53 1HG2 THR 53 -1.099 -6.102 -21.704 420 HG23 THR 53 2HG2 THR 53 -1.847 -4.561 -22.187 421 H THR 54 HN THR 54 -1.952 -5.196 -17.562 422 HA THR 54 HA THR 54 -2.910 -2.746 -16.778 423 HB THR 54 HB THR 54 0.041 -3.493 -16.699 424 HG1 THR 54 HG1 THR 54 -0.577 -5.238 -15.426 425 HG21 THR 54 3HG2 THR 54 -0.548 -1.502 -15.399 426 HG22 THR 54 1HG2 THR 54 -1.978 -2.316 -14.721 427 HG23 THR 54 2HG2 THR 54 -0.346 -2.850 -14.255 428 H LEU 55 HN LEU 55 -2.796 -0.665 -17.423 429 HA LEU 55 HA LEU 55 -1.724 -0.214 -20.049 430 HB2 LEU 55 2HB LEU 55 -3.907 0.680 -18.906 431 HB3 LEU 55 3HB LEU 55 -2.843 1.923 -18.276 432 HG LEU 55 HG LEU 55 -2.312 2.726 -20.452 433 HD11 LEU 55 1HD1 LEU 55 -3.655 1.434 -22.405 434 HD12 LEU 55 2HD1 LEU 55 -1.964 1.092 -21.966 435 HD13 LEU 55 3HD1 LEU 55 -3.273 0.067 -21.330 436 HD21 LEU 55 3HD2 LEU 55 -4.327 3.687 -19.799 437 HD22 LEU 55 1HD2 LEU 55 -4.675 3.078 -21.436 438 HD23 LEU 55 2HD2 LEU 55 -5.238 2.172 -20.011 439 H MET 56 HN MET 56 0.170 0.793 -20.594 440 HA MET 56 HA MET 56 1.801 1.606 -18.319 441 HB2 MET 56 2HB MET 56 2.402 0.434 -21.068 442 HB3 MET 56 3HB MET 56 3.654 1.319 -20.220 443 HG2 MET 56 2HG MET 56 2.165 -0.826 -18.702 444 HG3 MET 56 3HG MET 56 3.346 -1.333 -19.893 445 HE1 MET 56 3HE MET 56 3.582 -1.652 -16.415 446 HE2 MET 56 1HE MET 56 4.080 -0.089 -15.726 447 HE3 MET 56 2HE MET 56 2.527 -0.228 -16.585 448 HA PRO 57 HA PRO 57 2.086 5.624 -19.932 449 HB2 PRO 57 2HB PRO 57 4.616 6.415 -19.266 450 HB3 PRO 57 3HB PRO 57 3.288 6.386 -18.122 451 HG2 PRO 57 2HG PRO 57 5.565 4.516 -18.368 452 HG3 PRO 57 3HG PRO 57 4.486 4.759 -17.009 453 HD2 PRO 57 2HD PRO 57 4.426 2.586 -18.880 454 HD3 PRO 57 3HD PRO 57 3.278 2.892 -17.591 455 H ASP 58 HN ASP 58 4.392 3.337 -21.049 456 HA ASP 58 HA ASP 58 5.038 5.087 -23.253 457 HB2 ASP 58 2HB ASP 58 6.909 3.894 -22.239 458 HB3 ASP 58 3HB ASP 58 6.069 2.361 -22.356 459 HD2 ASP 58 HD2 ASP 58 6.557 3.434 -26.020 460 H MET 59 HN MET 59 2.436 3.328 -22.528 461 HA MET 59 HA MET 59 2.323 1.979 -25.114 462 HB2 MET 59 2HB MET 59 1.212 1.384 -22.364 463 HB3 MET 59 3HB MET 59 0.231 0.899 -23.733 464 HG2 MET 59 2HG MET 59 2.571 -0.103 -24.614 465 HG3 MET 59 3HG MET 59 2.960 -0.094 -22.905 466 HE1 MET 59 3HE MET 59 0.868 -0.949 -21.115 467 HE2 MET 59 1HE MET 59 -0.347 -0.206 -22.183 468 HE3 MET 59 2HE MET 59 -0.499 -1.917 -21.717 469 H VAL 60 HN VAL 60 1.711 4.900 -24.161 470 HA VAL 60 HA VAL 60 -0.878 5.007 -25.509 471 HB VAL 60 HB VAL 60 -0.235 6.547 -22.990 472 HG11 VAL 60 1HG1 VAL 60 -2.838 6.208 -24.518 473 HG12 VAL 60 2HG1 VAL 60 -2.598 7.163 -23.035 474 HG13 VAL 60 3HG1 VAL 60 -1.799 7.653 -24.548 475 HG21 VAL 60 3HG2 VAL 60 -0.590 4.561 -21.965 476 HG22 VAL 60 1HG2 VAL 60 -2.301 4.930 -22.285 477 HG23 VAL 60 2HG2 VAL 60 -1.403 3.852 -23.381 478 H LYS 61 HN LYS 61 -1.132 6.820 -26.851 479 HA LYS 61 HA LYS 61 1.357 8.211 -27.381 480 HB2 LYS 61 2HB LYS 61 -1.273 8.132 -28.891 481 HB3 LYS 61 3HB LYS 61 0.167 8.977 -29.421 482 HG2 LYS 61 2HG LYS 61 1.398 6.699 -29.188 483 HG3 LYS 61 3HG LYS 61 -0.192 5.976 -29.047 484 HD2 LYS 61 2HD LYS 61 -0.684 7.409 -31.259 485 HD3 LYS 61 3HD LYS 61 1.060 7.358 -31.424 486 HE2 LYS 61 2HE LYS 61 0.901 4.806 -31.110 487 HE3 LYS 61 3HE LYS 61 -0.838 4.975 -31.247 488 HZ1 LYS 61 2HZ LYS 61 1.002 6.014 -33.328 489 HZ3 LYS 61 1HZ LYS 61 -0.607 5.800 -33.458 490 H GLY 62 HN GLY 62 1.505 10.541 -27.494 491 HA2 GLY 62 1HA GLY 62 1.213 12.594 -26.629 492 HA3 GLY 62 2HA GLY 62 -0.504 12.332 -26.862 493 H TYR 63 HN TYR 63 1.138 10.013 -24.807 494 HA TYR 63 HA TYR 63 -0.385 10.964 -22.549 495 HB2 TYR 63 2HB TYR 63 -0.240 8.556 -22.995 496 HB3 TYR 63 3HB TYR 63 1.487 8.646 -23.277 497 HD1 TYR 63 HD2 TYR 63 3.064 8.853 -21.366 498 HD2 TYR 63 HD1 TYR 63 -1.140 8.338 -20.762 499 HE1 TYR 63 HE2 TYR 63 3.485 8.188 -18.948 500 HE2 TYR 63 HE1 TYR 63 -0.705 7.675 -18.346 501 HH TYR 63 HH TYR 63 0.777 7.282 -16.830 502 H ALA 64 HN ALA 64 0.843 10.803 -20.312 503 HA ALA 64 HA ALA 64 3.509 11.244 -20.023 504 HB1 ALA 64 1HB ALA 64 3.655 13.168 -21.323 505 HB2 ALA 64 2HB ALA 64 2.016 13.711 -20.892 506 HB3 ALA 64 3HB ALA 64 3.342 13.865 -19.716 507 HA PRO 65 HA PRO 65 1.976 11.289 -15.979 508 HB2 PRO 65 2HB PRO 65 4.221 11.941 -14.562 509 HB3 PRO 65 3HB PRO 65 3.901 10.325 -15.160 510 HG2 PRO 65 2HG PRO 65 5.800 12.341 -16.193 511 HG3 PRO 65 3HG PRO 65 5.763 10.614 -16.490 512 HD2 PRO 65 2HD PRO 65 4.903 12.682 -18.282 513 HD3 PRO 65 3HD PRO 65 4.759 10.953 -18.530 514 H ALA 66 HN ALA 66 1.835 12.589 -13.856 515 HA ALA 66 HA ALA 66 2.000 15.431 -14.482 516 HB1 ALA 66 1HB ALA 66 -0.232 15.105 -15.127 517 HB2 ALA 66 2HB ALA 66 -0.511 13.857 -13.889 518 HB3 ALA 66 3HB ALA 66 -0.384 15.567 -13.414 Start of MODEL 11 1 H1 MET 0 HN MET 0 2.871 -2.196 -0.433 2 HA MET 0 HA MET 0 1.318 0.256 -0.272 3 HB2 MET 0 2HB MET 0 3.914 0.442 -0.906 4 HB3 MET 0 3HB MET 0 3.388 -0.163 -2.465 5 HG2 MET 0 2HG MET 0 2.074 1.751 -2.922 6 HG3 MET 0 3HG MET 0 1.896 2.164 -1.228 7 HE1 MET 0 3HE MET 0 5.443 2.953 -0.186 8 HE2 MET 0 1HE MET 0 4.090 4.102 -0.048 9 HE3 MET 0 2HE MET 0 3.816 2.366 0.233 10 H ASN 1 HN ASN 1 -0.489 0.243 -1.578 11 HA ASN 1 HA ASN 1 -0.494 -1.708 -3.732 12 HB2 ASN 1 2HB ASN 1 -2.778 -1.220 -1.746 13 HB3 ASN 1 3HB ASN 1 -2.880 -2.270 -3.146 14 HD21 ASN 1 1HD2 ASN 1 -3.292 -3.019 -0.451 15 HD22 ASN 1 2HD2 ASN 1 -2.106 -4.199 -0.003 16 H GLN 2 HN GLN 2 -0.313 -0.005 -5.312 17 HA GLN 2 HA GLN 2 -2.344 2.067 -5.143 18 HB2 GLN 2 2HB GLN 2 -0.941 3.300 -6.773 19 HB3 GLN 2 3HB GLN 2 -0.029 2.870 -5.340 20 HG2 GLN 2 2HG GLN 2 1.468 1.726 -6.597 21 HG3 GLN 2 3HG GLN 2 0.198 0.680 -7.202 22 HE21 GLN 2 1HE2 GLN 2 -1.404 2.543 -8.510 23 HE22 GLN 2 2HE2 GLN 2 -0.580 3.155 -9.906 24 H GLU 3 HN GLU 3 -4.012 2.181 -6.624 25 HA GLU 3 HA GLU 3 -4.442 -0.050 -8.252 26 HB2 GLU 3 2HB GLU 3 -5.842 2.512 -7.633 27 HB3 GLU 3 3HB GLU 3 -6.249 1.795 -9.179 28 HG2 GLU 3 2HG GLU 3 -6.769 -0.371 -8.043 29 HG3 GLU 3 3HG GLU 3 -6.350 0.335 -6.496 30 HE2 GLU 3 HE2 GLU 3 -8.748 2.811 -6.789 31 H SER 4 HN SER 4 -4.010 -0.428 -10.413 32 HA SER 4 HA SER 4 -2.793 1.816 -11.826 33 HB2 SER 4 2HB SER 4 -2.238 -1.010 -12.677 34 HB3 SER 4 3HB SER 4 -1.197 0.398 -12.753 35 HG SER 4 HG SER 4 -1.418 -1.512 -10.767 36 H VAL 5 HN VAL 5 -3.373 2.115 -14.066 37 HA VAL 5 HA VAL 5 -6.004 1.567 -14.698 38 HB VAL 5 HB VAL 5 -3.612 2.279 -16.398 39 HG11 VAL 5 1HG1 VAL 5 -5.093 2.843 -18.201 40 HG12 VAL 5 2HG1 VAL 5 -5.434 1.162 -17.723 41 HG13 VAL 5 3HG1 VAL 5 -6.528 2.471 -17.214 42 HG21 VAL 5 3HG2 VAL 5 -3.985 4.421 -15.834 43 HG22 VAL 5 1HG2 VAL 5 -5.750 4.255 -15.996 44 HG23 VAL 5 2HG2 VAL 5 -4.944 3.758 -14.489 45 H VAL 6 HN VAL 6 -7.077 -0.078 -15.756 46 HA VAL 6 HA VAL 6 -5.429 -2.207 -16.892 47 HB VAL 6 HB VAL 6 -7.579 -2.517 -14.792 48 HG11 VAL 6 1HG1 VAL 6 -7.585 -4.856 -15.126 49 HG12 VAL 6 2HG1 VAL 6 -7.724 -4.153 -16.755 50 HG13 VAL 6 3HG1 VAL 6 -6.162 -4.793 -16.193 51 HG21 VAL 6 3HG2 VAL 6 -4.698 -2.434 -14.712 52 HG22 VAL 6 1HG2 VAL 6 -5.860 -2.590 -13.373 53 HG23 VAL 6 2HG2 VAL 6 -5.268 -4.044 -14.211 54 H ALA 7 HN ALA 7 -6.091 -2.589 -18.938 55 HA ALA 7 HA ALA 7 -8.195 -1.291 -20.123 56 HB1 ALA 7 1HB ALA 7 -6.512 -3.698 -20.747 57 HB2 ALA 7 2HB ALA 7 -7.939 -3.380 -21.762 58 HB3 ALA 7 3HB ALA 7 -6.657 -2.153 -21.618 59 H ALA 8 HN ALA 8 -10.210 -1.339 -19.153 60 HA ALA 8 HA ALA 8 -11.303 -3.632 -17.973 61 HB1 ALA 8 1HB ALA 8 -12.989 -2.205 -17.419 62 HB2 ALA 8 2HB ALA 8 -11.873 -0.958 -18.025 63 HB3 ALA 8 3HB ALA 8 -13.155 -1.594 -19.083 64 H VAL 9 HN VAL 9 -10.728 -2.818 -21.261 65 HA VAL 9 HA VAL 9 -12.236 -5.133 -22.087 66 HB VAL 9 HB VAL 9 -13.370 -3.853 -23.904 67 HG11 VAL 9 1HG1 VAL 9 -14.152 -3.099 -21.067 68 HG12 VAL 9 2HG1 VAL 9 -15.214 -3.051 -22.494 69 HG13 VAL 9 3HG1 VAL 9 -14.583 -4.608 -21.907 70 HG21 VAL 9 3HG2 VAL 9 -13.701 -1.316 -22.970 71 HG22 VAL 9 1HG2 VAL 9 -11.997 -1.610 -22.547 72 HG23 VAL 9 2HG2 VAL 9 -12.537 -1.778 -24.235 73 H LEU 10 HN LEU 10 -11.808 -5.498 -24.552 74 HA LEU 10 HA LEU 10 -9.021 -5.488 -24.887 75 HB2 LEU 10 2HB LEU 10 -10.246 -7.251 -25.823 76 HB3 LEU 10 3HB LEU 10 -11.365 -6.175 -26.636 77 HG LEU 10 HG LEU 10 -9.104 -5.417 -27.879 78 HD11 LEU 10 1HD1 LEU 10 -7.380 -6.824 -27.795 79 HD12 LEU 10 2HD1 LEU 10 -8.171 -7.553 -26.376 80 HD13 LEU 10 3HD1 LEU 10 -8.428 -8.250 -27.993 81 HD21 LEU 10 3HD2 LEU 10 -10.033 -7.842 -29.152 82 HD22 LEU 10 1HD2 LEU 10 -11.398 -6.899 -28.508 83 HD23 LEU 10 2HD2 LEU 10 -10.249 -6.143 -29.637 84 H ILE 11 HN ILE 11 -7.947 -3.560 -24.996 85 HA ILE 11 HA ILE 11 -9.088 -1.495 -26.714 86 HB ILE 11 HB ILE 11 -6.644 -1.114 -25.042 87 HG12 ILE 11 2HG1 ILE 11 -9.412 -1.620 -24.011 88 HG13 ILE 11 3HG1 ILE 11 -7.864 -2.115 -23.354 89 HG21 ILE 11 1HG2 ILE 11 -7.054 1.072 -25.324 90 HG22 ILE 11 2HG2 ILE 11 -8.085 0.535 -26.672 91 HG23 ILE 11 3HG2 ILE 11 -8.807 0.883 -25.083 92 HD11 ILE 11 3HD1 ILE 11 -9.242 0.565 -23.157 93 HD12 ILE 11 1HD1 ILE 11 -8.450 -0.392 -21.883 94 HD13 ILE 11 2HD1 ILE 11 -7.465 0.498 -23.069 95 HA PRO 12 HA PRO 12 -6.204 -2.923 -29.696 96 HB2 PRO 12 2HB PRO 12 -7.278 -1.599 -31.832 97 HB3 PRO 12 3HB PRO 12 -7.818 -3.184 -31.316 98 HG2 PRO 12 2HG PRO 12 -9.143 -0.566 -30.955 99 HG3 PRO 12 3HG PRO 12 -9.835 -2.172 -30.839 100 HD2 PRO 12 2HD PRO 12 -9.135 -0.444 -28.659 101 HD3 PRO 12 3HD PRO 12 -9.718 -2.092 -28.544 102 H ILE 13 HN ILE 13 -4.757 -1.884 -31.443 103 HA ILE 13 HA ILE 13 -3.352 0.148 -30.067 104 HB ILE 13 HB ILE 13 -2.219 -1.501 -31.399 105 HG12 ILE 13 2HG1 ILE 13 -1.854 1.143 -32.817 106 HG13 ILE 13 3HG1 ILE 13 -1.363 0.907 -31.151 107 HG21 ILE 13 1HG2 ILE 13 -2.920 -2.193 -33.385 108 HG22 ILE 13 2HG2 ILE 13 -4.281 -1.051 -33.265 109 HG23 ILE 13 3HG2 ILE 13 -2.768 -0.553 -34.061 110 HD11 ILE 13 3HD1 ILE 13 0.587 0.082 -31.967 111 HD12 ILE 13 1HD1 ILE 13 -0.336 -1.357 -32.462 112 HD13 ILE 13 2HD1 ILE 13 -0.075 -0.027 -33.616 113 H ASN 14 HN ASN 14 -2.914 2.346 -30.833 114 HA ASN 14 HA ASN 14 -3.721 4.333 -31.248 115 HB2 ASN 14 2HB ASN 14 -4.635 3.080 -33.890 116 HB3 ASN 14 3HB ASN 14 -4.258 4.771 -33.627 117 HD21 ASN 14 1HD2 ASN 14 -3.011 3.536 -35.619 118 HD22 ASN 14 2HD2 ASN 14 -1.341 3.235 -35.274 119 H THR 15 HN THR 15 -5.558 3.096 -29.635 120 HA THR 15 HA THR 15 -8.148 3.750 -30.879 121 HB THR 15 HB THR 15 -7.397 1.520 -28.917 122 HG1 THR 15 HG1 THR 15 -6.963 1.169 -31.214 123 HG21 THR 15 3HG2 THR 15 -9.938 0.978 -29.819 124 HG22 THR 15 1HG2 THR 15 -9.606 1.767 -28.258 125 HG23 THR 15 2HG2 THR 15 -10.018 2.751 -29.684 126 H ALA 16 HN ALA 16 -9.059 5.512 -30.050 127 HA ALA 16 HA ALA 16 -8.039 6.946 -27.956 128 HB1 ALA 16 1HB ALA 16 -10.346 6.974 -29.689 129 HB2 ALA 16 2HB ALA 16 -10.851 7.384 -28.031 130 HB3 ALA 16 3HB ALA 16 -9.573 8.330 -28.833 131 H LEU 17 HN LEU 17 -8.079 6.798 -25.755 132 HA LEU 17 HA LEU 17 -9.425 4.494 -24.641 133 HB2 LEU 17 2HB LEU 17 -7.522 6.525 -23.468 134 HB3 LEU 17 3HB LEU 17 -8.206 5.180 -22.576 135 HG LEU 17 HG LEU 17 -6.532 4.835 -25.075 136 HD11 LEU 17 1HD1 LEU 17 -4.652 4.289 -23.604 137 HD12 LEU 17 2HD1 LEU 17 -5.197 5.968 -23.373 138 HD13 LEU 17 3HD1 LEU 17 -5.633 4.719 -22.182 139 HD21 LEU 17 3HD2 LEU 17 -6.220 2.523 -23.968 140 HD22 LEU 17 1HD2 LEU 17 -7.664 2.950 -23.019 141 HD23 LEU 17 2HD2 LEU 17 -7.757 2.876 -24.795 142 H THR 18 HN THR 18 -11.125 4.541 -23.156 143 HA THR 18 HA THR 18 -12.266 7.204 -22.640 144 HB THR 18 HB THR 18 -14.519 5.855 -22.917 145 HG1 THR 18 HG1 THR 18 -13.939 4.126 -24.625 146 HG21 THR 18 3HG2 THR 18 -14.207 5.915 -25.541 147 HG22 THR 18 1HG2 THR 18 -14.167 7.454 -24.647 148 HG23 THR 18 2HG2 THR 18 -12.647 6.686 -25.166 149 H VAL 19 HN VAL 19 -13.999 7.047 -20.839 150 HA VAL 19 HA VAL 19 -12.652 5.891 -18.602 151 HB VAL 19 HB VAL 19 -14.062 8.100 -18.901 152 HG11 VAL 19 1HG1 VAL 19 -16.172 6.201 -17.827 153 HG12 VAL 19 2HG1 VAL 19 -16.333 7.950 -18.114 154 HG13 VAL 19 3HG1 VAL 19 -16.147 6.836 -19.490 155 HG21 VAL 19 3HG2 VAL 19 -13.089 6.595 -16.721 156 HG22 VAL 19 1HG2 VAL 19 -13.492 8.329 -16.757 157 HG23 VAL 19 2HG2 VAL 19 -14.719 7.140 -16.256 158 H GLY 20 HN GLY 20 -14.878 4.756 -20.955 159 HA2 GLY 20 1HA GLY 20 -16.015 2.759 -19.115 160 HA3 GLY 20 2HA GLY 20 -16.623 3.188 -20.701 161 H MET 21 HN MET 21 -13.178 3.050 -20.671 162 HA MET 21 HA MET 21 -13.324 0.336 -21.740 163 HB2 MET 21 2HB MET 21 -12.000 2.868 -22.669 164 HB3 MET 21 3HB MET 21 -11.025 1.422 -22.836 165 HG2 MET 21 2HG MET 21 -13.444 0.516 -23.812 166 HG3 MET 21 3HG MET 21 -13.518 2.203 -24.282 167 HE1 MET 21 3HE MET 21 -10.074 2.432 -24.285 168 HE2 MET 21 1HE MET 21 -9.948 2.513 -26.059 169 HE3 MET 21 2HE MET 21 -11.239 3.403 -25.217 170 H MET 22 HN MET 22 -11.584 2.688 -19.698 171 HA MET 22 HA MET 22 -9.643 0.642 -19.033 172 HB2 MET 22 2HB MET 22 -9.890 3.638 -18.443 173 HB3 MET 22 3HB MET 22 -8.647 2.652 -17.697 174 HG2 MET 22 2HG MET 22 -7.640 2.124 -19.835 175 HG3 MET 22 3HG MET 22 -9.021 2.737 -20.722 176 HE1 MET 22 3HE MET 22 -9.797 5.433 -19.316 177 HE2 MET 22 1HE MET 22 -8.823 6.550 -20.302 178 HE3 MET 22 2HE MET 22 -9.625 5.157 -21.066 179 H THR 23 HN THR 23 -8.959 0.952 -16.475 180 HA THR 23 HA THR 23 -11.098 1.449 -14.692 181 HB THR 23 HB THR 23 -11.559 -0.869 -16.010 182 HG1 THR 23 HG1 THR 23 -12.898 -0.089 -14.307 183 HG21 THR 23 3HG2 THR 23 -9.431 -1.974 -15.329 184 HG22 THR 23 1HG2 THR 23 -9.787 -1.613 -13.622 185 HG23 THR 23 2HG2 THR 23 -10.816 -2.751 -14.525 186 H THR 24 HN THR 24 -10.483 0.395 -12.424 187 HA THR 24 HA THR 24 -7.564 0.724 -12.181 188 HB THR 24 HB THR 24 -8.047 1.833 -10.028 189 HG1 THR 24 HG1 THR 24 -10.834 1.452 -10.837 190 HG21 THR 24 3HG2 THR 24 -9.370 3.788 -10.757 191 HG22 THR 24 1HG2 THR 24 -8.285 3.297 -12.080 192 HG23 THR 24 2HG2 THR 24 -10.011 2.867 -12.139 193 H ARG 25 HN ARG 25 -6.399 -0.777 -11.073 194 HA ARG 25 HA ARG 25 -7.653 -2.538 -9.289 195 HB2 ARG 25 2HB ARG 25 -7.704 -3.315 -12.060 196 HB3 ARG 25 3HB ARG 25 -6.524 -4.342 -11.269 197 HG2 ARG 25 2HG ARG 25 -8.279 -5.600 -10.558 198 HG3 ARG 25 3HG ARG 25 -8.624 -4.308 -9.426 199 HD2 ARG 25 2HD ARG 25 -10.471 -3.610 -10.593 200 HD3 ARG 25 3HD ARG 25 -9.664 -3.751 -12.142 201 HE ARG 25 HE ARG 25 -10.012 -6.375 -11.534 202 HH11 ARG 25 2HH2 ARG 25 -12.278 -3.660 -11.317 203 HH12 ARG 25 1HH2 ARG 25 -13.677 -4.645 -11.586 204 HH22 ARG 25 HH1 ARG 25 -13.406 -7.002 -11.920 205 H VAL 26 HN VAL 26 -6.062 -3.606 -7.997 206 HA VAL 26 HA VAL 26 -3.406 -2.588 -8.323 207 HB VAL 26 HB VAL 26 -4.477 -4.598 -6.336 208 HG11 VAL 26 1HG1 VAL 26 -1.896 -3.308 -6.745 209 HG12 VAL 26 2HG1 VAL 26 -2.558 -2.968 -5.128 210 HG13 VAL 26 3HG1 VAL 26 -2.343 -4.651 -5.666 211 HG21 VAL 26 3HG2 VAL 26 -4.919 -2.706 -4.844 212 HG22 VAL 26 1HG2 VAL 26 -4.424 -1.568 -6.121 213 HG23 VAL 26 2HG2 VAL 26 -5.877 -2.574 -6.338 214 H VAL 27 HN VAL 27 -2.814 -3.505 -10.399 215 HA VAL 27 HA VAL 27 -2.430 -6.412 -10.306 216 HB VAL 27 HB VAL 27 -2.462 -6.394 -12.662 217 HG11 VAL 27 1HG1 VAL 27 -4.665 -6.078 -11.437 218 HG12 VAL 27 2HG1 VAL 27 -4.583 -4.365 -11.913 219 HG13 VAL 27 3HG1 VAL 27 -4.660 -5.632 -13.160 220 HG21 VAL 27 3HG2 VAL 27 -1.184 -4.625 -13.420 221 HG22 VAL 27 1HG2 VAL 27 -2.822 -4.063 -13.832 222 HG23 VAL 27 2HG2 VAL 27 -2.007 -3.439 -12.378 223 H SER 28 HN SER 28 -0.362 -7.189 -11.395 224 HA SER 28 HA SER 28 1.758 -5.242 -10.952 225 HB2 SER 28 2HB SER 28 1.350 -7.196 -9.163 226 HB3 SER 28 3HB SER 28 2.239 -8.153 -10.332 227 HG SER 28 HG SER 28 4.063 -6.924 -10.041 228 HA PRO 29 HA PRO 29 3.614 -5.030 -11.329 229 HB2 PRO 29 2HB PRO 29 4.996 -3.478 -13.102 230 HB3 PRO 29 3HB PRO 29 5.683 -4.893 -12.329 231 HG2 PRO 29 2HG PRO 29 4.736 -4.577 -15.112 232 HG3 PRO 29 3HG PRO 29 5.792 -5.805 -14.444 233 HD2 PRO 29 2HD PRO 29 3.019 -6.105 -15.111 234 HD3 PRO 29 3HD PRO 29 4.045 -7.296 -14.337 235 H THR 30 HN THR 30 3.230 -2.861 -10.665 236 HA THR 30 HA THR 30 0.699 -1.977 -11.611 237 HB THR 30 HB THR 30 1.292 -0.052 -9.989 238 HG1 THR 30 HG1 THR 30 3.314 -0.825 -8.738 239 HG21 THR 30 3HG2 THR 30 0.133 -2.065 -9.092 240 HG22 THR 30 1HG2 THR 30 1.687 -2.927 -9.000 241 HG23 THR 30 2HG2 THR 30 1.385 -1.521 -7.951 242 H GLY 31 HN GLY 31 0.244 -0.877 -13.401 243 HA2 GLY 31 1HA GLY 31 2.433 0.540 -14.742 244 HA3 GLY 31 2HA GLY 31 0.896 0.061 -15.435 245 H ILE 32 HN ILE 32 0.432 2.187 -16.231 246 HA ILE 32 HA ILE 32 0.650 4.553 -14.993 247 HB ILE 32 HB ILE 32 -1.599 3.518 -16.716 248 HG12 ILE 32 2HG1 ILE 32 0.777 5.247 -17.452 249 HG13 ILE 32 3HG1 ILE 32 0.763 3.502 -17.613 250 HG21 ILE 32 1HG2 ILE 32 -2.457 5.647 -16.984 251 HG22 ILE 32 2HG2 ILE 32 -2.073 5.613 -15.246 252 HG23 ILE 32 3HG2 ILE 32 -0.980 6.438 -16.384 253 HD11 ILE 32 3HD1 ILE 32 -1.560 5.003 -18.794 254 HD12 ILE 32 1HD1 ILE 32 0.009 5.110 -19.628 255 HD13 ILE 32 2HD1 ILE 32 -0.755 3.524 -19.370 256 HA PRO 33 HA PRO 33 -1.846 4.409 -11.469 257 HB2 PRO 33 2HB PRO 33 -1.998 7.074 -10.883 258 HB3 PRO 33 3HB PRO 33 -0.622 6.075 -10.456 259 HG2 PRO 33 2HG PRO 33 -0.859 8.081 -12.615 260 HG3 PRO 33 3HG PRO 33 0.590 7.396 -11.907 261 HD2 PRO 33 2HD PRO 33 -0.567 6.717 -14.442 262 HD3 PRO 33 3HD PRO 33 0.815 5.953 -13.682 263 H ALA 34 HN ALA 34 -3.950 4.627 -10.623 264 HA ALA 34 HA ALA 34 -5.877 4.753 -12.653 265 HB1 ALA 34 1HB ALA 34 -6.113 3.459 -10.564 266 HB2 ALA 34 2HB ALA 34 -6.156 4.973 -9.628 267 HB3 ALA 34 3HB ALA 34 -7.468 4.596 -10.770 268 H GLU 35 HN GLU 35 -4.115 7.216 -11.031 269 HA GLU 35 HA GLU 35 -6.214 9.137 -11.082 270 HB2 GLU 35 2HB GLU 35 -4.652 10.622 -10.108 271 HB3 GLU 35 3HB GLU 35 -4.179 9.055 -9.482 272 HG2 GLU 35 2HG GLU 35 -2.591 8.966 -11.596 273 HG3 GLU 35 3HG GLU 35 -2.842 10.700 -11.651 274 HE2 GLU 35 HE2 GLU 35 -2.429 9.482 -8.197 275 H ASP 36 HN ASP 36 -4.290 7.680 -13.453 276 HA ASP 36 HA ASP 36 -4.180 10.097 -15.049 277 HB2 ASP 36 2HB ASP 36 -2.293 8.193 -14.712 278 HB3 ASP 36 3HB ASP 36 -3.167 7.430 -16.026 279 HD2 ASP 36 HD2 ASP 36 -1.965 9.666 -18.399 280 H ILE 37 HN ILE 37 -6.246 7.528 -14.337 281 HA ILE 37 HA ILE 37 -7.039 6.486 -16.752 282 HB ILE 37 HB ILE 37 -8.194 6.827 -14.062 283 HG12 ILE 37 2HG1 ILE 37 -7.765 4.572 -16.022 284 HG13 ILE 37 3HG1 ILE 37 -6.987 4.838 -14.475 285 HG21 ILE 37 1HG2 ILE 37 -10.426 6.107 -14.687 286 HG22 ILE 37 2HG2 ILE 37 -10.042 7.667 -15.455 287 HG23 ILE 37 3HG2 ILE 37 -9.990 6.167 -16.412 288 HD11 ILE 37 3HD1 ILE 37 -8.624 3.111 -14.117 289 HD12 ILE 37 1HD1 ILE 37 -9.301 4.587 -13.388 290 HD13 ILE 37 2HD1 ILE 37 -9.881 4.032 -14.977 291 HA PRO 38 HA PRO 38 -9.847 10.266 -17.203 292 HB2 PRO 38 2HB PRO 38 -9.462 12.447 -15.601 293 HB3 PRO 38 3HB PRO 38 -10.662 11.213 -15.269 294 HG2 PRO 38 2HG PRO 38 -8.058 11.670 -13.946 295 HG3 PRO 38 3HG PRO 38 -9.432 10.745 -13.375 296 HD2 PRO 38 2HD PRO 38 -7.002 9.700 -14.483 297 HD3 PRO 38 3HD PRO 38 -8.422 8.783 -14.019 298 H ARG 39 HN ARG 39 -6.543 10.237 -16.917 299 HA ARG 39 HA ARG 39 -6.301 12.629 -18.517 300 HB2 ARG 39 2HB ARG 39 -4.226 10.816 -17.191 301 HB3 ARG 39 3HB ARG 39 -3.792 12.184 -18.197 302 HG2 ARG 39 2HG ARG 39 -4.913 13.746 -16.681 303 HG3 ARG 39 3HG ARG 39 -5.600 12.430 -15.750 304 HD2 ARG 39 2HD ARG 39 -3.754 12.954 -14.417 305 HD3 ARG 39 3HD ARG 39 -3.054 11.706 -15.429 306 HE ARG 39 HE ARG 39 -2.460 14.585 -15.531 307 HH11 ARG 39 2HH2 ARG 39 -2.239 11.495 -17.250 308 HH12 ARG 39 1HH2 ARG 39 -0.938 12.013 -18.269 309 HH22 ARG 39 HH1 ARG 39 -0.075 14.236 -18.032 310 H LEU 40 HN LEU 40 -6.291 9.121 -18.700 311 HA LEU 40 HA LEU 40 -4.817 9.002 -21.159 312 HB2 LEU 40 2HB LEU 40 -6.431 6.943 -19.649 313 HB3 LEU 40 3HB LEU 40 -5.495 6.613 -21.093 314 HG LEU 40 HG LEU 40 -4.196 7.799 -18.644 315 HD11 LEU 40 1HD1 LEU 40 -5.344 5.134 -18.903 316 HD12 LEU 40 2HD1 LEU 40 -3.593 5.091 -18.584 317 HD13 LEU 40 3HD1 LEU 40 -4.679 5.965 -17.477 318 HD21 LEU 40 3HD2 LEU 40 -3.010 5.979 -20.744 319 HD22 LEU 40 1HD2 LEU 40 -3.054 7.751 -20.911 320 HD23 LEU 40 2HD2 LEU 40 -2.169 7.006 -19.558 321 H ILE 41 HN ILE 41 -8.111 9.592 -20.132 322 HA ILE 41 HA ILE 41 -9.497 8.635 -22.330 323 HB ILE 41 HB ILE 41 -10.095 11.076 -20.655 324 HG12 ILE 41 2HG1 ILE 41 -10.320 8.145 -20.100 325 HG13 ILE 41 3HG1 ILE 41 -9.868 9.459 -19.032 326 HG21 ILE 41 1HG2 ILE 41 -11.428 10.853 -22.740 327 HG22 ILE 41 2HG2 ILE 41 -11.985 9.260 -22.174 328 HG23 ILE 41 3HG2 ILE 41 -12.399 10.726 -21.254 329 HD11 ILE 41 3HD1 ILE 41 -12.211 10.271 -18.990 330 HD12 ILE 41 1HD1 ILE 41 -12.682 8.976 -20.117 331 HD13 ILE 41 2HD1 ILE 41 -12.122 8.569 -18.477 332 H SER 42 HN SER 42 -9.881 9.366 -24.398 333 HA SER 42 HA SER 42 -9.887 10.754 -26.114 334 HB2 SER 42 2HB SER 42 -9.840 12.664 -24.307 335 HB3 SER 42 3HB SER 42 -8.137 12.788 -24.701 336 HG SER 42 HG SER 42 -9.410 12.713 -27.058 337 H MET 43 HN MET 43 -7.235 9.498 -24.376 338 HA MET 43 HA MET 43 -5.381 10.075 -26.535 339 HB2 MET 43 2HB MET 43 -4.759 8.564 -23.957 340 HB3 MET 43 3HB MET 43 -3.648 9.475 -24.960 341 HG2 MET 43 2HG MET 43 -5.389 11.478 -24.313 342 HG3 MET 43 3HG MET 43 -5.594 10.463 -22.900 343 HE1 MET 43 3HE MET 43 -2.003 9.857 -21.747 344 HE2 MET 43 1HE MET 43 -3.320 8.977 -22.558 345 HE3 MET 43 2HE MET 43 -1.888 9.487 -23.484 346 H GLN 44 HN GLN 44 -4.689 8.507 -27.969 347 HA GLN 44 HA GLN 44 -5.987 5.946 -27.690 348 HB2 GLN 44 2HB GLN 44 -4.290 6.893 -30.030 349 HB3 GLN 44 3HB GLN 44 -5.497 5.623 -30.029 350 HG2 GLN 44 2HG GLN 44 -7.310 7.193 -29.798 351 HG3 GLN 44 3HG GLN 44 -6.230 8.496 -29.343 352 HE21 GLN 44 1HE2 GLN 44 -6.874 6.189 -31.968 353 HE22 GLN 44 2HE2 GLN 44 -6.511 7.248 -33.290 354 H VAL 45 HN VAL 45 -4.838 3.917 -27.739 355 HA VAL 45 HA VAL 45 -2.303 4.064 -26.434 356 HB VAL 45 HB VAL 45 -2.494 1.543 -26.641 357 HG11 VAL 45 1HG1 VAL 45 -4.161 1.387 -24.883 358 HG12 VAL 45 2HG1 VAL 45 -3.181 2.854 -24.644 359 HG13 VAL 45 3HG1 VAL 45 -4.822 2.981 -25.323 360 HG21 VAL 45 3HG2 VAL 45 -4.266 2.033 -28.635 361 HG22 VAL 45 1HG2 VAL 45 -4.219 0.522 -27.696 362 HG23 VAL 45 2HG2 VAL 45 -5.381 1.800 -27.267 363 H ASN 46 HN ASN 46 -0.316 3.011 -27.224 364 HA ASN 46 HA ASN 46 -0.128 3.390 -30.098 365 HB2 ASN 46 2HB ASN 46 2.362 3.523 -29.646 366 HB3 ASN 46 3HB ASN 46 1.447 4.761 -28.809 367 HD21 ASN 46 1HD2 ASN 46 1.973 5.075 -26.796 368 HD22 ASN 46 2HD2 ASN 46 2.622 3.920 -25.680 369 H GLN 47 HN GLN 47 -1.255 0.955 -28.765 370 HA GLN 47 HA GLN 47 0.049 -0.975 -30.228 371 HB2 GLN 47 2HB GLN 47 1.909 -1.052 -28.784 372 HB3 GLN 47 3HB GLN 47 0.946 -0.750 -27.351 373 HG2 GLN 47 2HG GLN 47 -0.094 -3.014 -27.568 374 HG3 GLN 47 3HG GLN 47 0.858 -3.316 -29.008 375 HE21 GLN 47 1HE2 GLN 47 1.587 -1.806 -25.865 376 HE22 GLN 47 2HE2 GLN 47 2.920 -2.825 -25.435 377 H VAL 48 HN VAL 48 -0.908 -3.198 -29.811 378 HA VAL 48 HA VAL 48 -3.662 -2.869 -29.096 379 HB VAL 48 HB VAL 48 -1.932 -4.966 -30.319 380 HG11 VAL 48 1HG1 VAL 48 -4.169 -6.389 -30.279 381 HG12 VAL 48 2HG1 VAL 48 -2.977 -6.500 -28.962 382 HG13 VAL 48 3HG1 VAL 48 -4.435 -5.499 -28.761 383 HG21 VAL 48 3HG2 VAL 48 -4.631 -3.790 -31.068 384 HG22 VAL 48 1HG2 VAL 48 -3.052 -3.284 -31.716 385 HG23 VAL 48 2HG2 VAL 48 -3.668 -4.920 -32.052 386 H VAL 49 HN VAL 49 -4.248 -2.787 -26.986 387 HA VAL 49 HA VAL 49 -2.826 -4.595 -25.159 388 HB VAL 49 HB VAL 49 -2.407 -2.645 -24.149 389 HG11 VAL 49 1HG1 VAL 49 -3.833 -0.570 -24.453 390 HG12 VAL 49 2HG1 VAL 49 -3.059 -1.199 -25.928 391 HG13 VAL 49 3HG1 VAL 49 -4.789 -1.500 -25.633 392 HG21 VAL 49 3HG2 VAL 49 -5.274 -2.415 -23.298 393 HG22 VAL 49 1HG2 VAL 49 -4.363 -3.885 -22.877 394 HG23 VAL 49 2HG2 VAL 49 -3.783 -2.292 -22.335 395 HA PRO 50 HA PRO 50 -6.699 -6.613 -25.060 396 HB2 PRO 50 2HB PRO 50 -5.931 -8.754 -23.545 397 HB3 PRO 50 3HB PRO 50 -5.728 -8.689 -25.285 398 HG2 PRO 50 2HG PRO 50 -3.687 -8.382 -23.169 399 HG3 PRO 50 3HG PRO 50 -3.460 -8.742 -24.869 400 HD2 PRO 50 2HD PRO 50 -3.031 -6.217 -23.578 401 HD3 PRO 50 3HD PRO 50 -2.916 -6.549 -25.294 402 H MET 51 HN MET 51 -8.364 -7.370 -23.505 403 HA MET 51 HA MET 51 -8.574 -5.405 -21.538 404 HB2 MET 51 2HB MET 51 -10.545 -6.469 -22.581 405 HB3 MET 51 3HB MET 51 -10.044 -8.052 -22.022 406 HG2 MET 51 2HG MET 51 -10.360 -7.345 -19.657 407 HG3 MET 51 3HG MET 51 -10.789 -5.729 -20.179 408 HE1 MET 51 3HE MET 51 -11.262 -9.320 -20.621 409 HE2 MET 51 1HE MET 51 -12.984 -9.598 -20.269 410 HE3 MET 51 2HE MET 51 -12.453 -9.312 -21.944 411 H GLY 52 HN GLY 52 -7.709 -5.306 -19.510 412 HA2 GLY 52 1HA GLY 52 -7.426 -6.325 -17.377 413 HA3 GLY 52 2HA GLY 52 -7.073 -7.852 -18.161 414 H THR 53 HN THR 53 -5.475 -6.086 -20.267 415 HA THR 53 HA THR 53 -2.951 -6.471 -18.980 416 HB THR 53 HB THR 53 -3.921 -5.409 -21.672 417 HG1 THR 53 HG1 THR 53 -3.942 -7.732 -21.152 418 HG21 THR 53 3HG2 THR 53 -1.829 -4.646 -22.181 419 HG22 THR 53 1HG2 THR 53 -1.387 -4.827 -20.466 420 HG23 THR 53 2HG2 THR 53 -1.111 -6.168 -21.603 421 H THR 54 HN THR 54 -2.045 -5.163 -17.534 422 HA THR 54 HA THR 54 -3.017 -2.702 -16.805 423 HB THR 54 HB THR 54 -0.065 -3.423 -16.662 424 HG1 THR 54 HG1 THR 54 -0.687 -5.137 -15.315 425 HG21 THR 54 3HG2 THR 54 -2.139 -2.303 -14.706 426 HG22 THR 54 1HG2 THR 54 -0.486 -2.769 -14.240 427 HG23 THR 54 2HG2 THR 54 -0.745 -1.431 -15.385 428 H LEU 55 HN LEU 55 -2.828 -0.608 -17.431 429 HA LEU 55 HA LEU 55 -1.742 -0.202 -20.065 430 HB2 LEU 55 2HB LEU 55 -3.936 0.714 -18.998 431 HB3 LEU 55 3HB LEU 55 -2.890 1.940 -18.309 432 HG LEU 55 HG LEU 55 -2.284 2.786 -20.443 433 HD11 LEU 55 1HD1 LEU 55 -1.845 1.149 -21.943 434 HD12 LEU 55 2HD1 LEU 55 -3.218 0.143 -21.422 435 HD13 LEU 55 3HD1 LEU 55 -3.493 1.540 -22.490 436 HD21 LEU 55 3HD2 LEU 55 -5.212 2.219 -20.097 437 HD22 LEU 55 1HD2 LEU 55 -4.317 3.746 -19.911 438 HD23 LEU 55 2HD2 LEU 55 -4.629 3.090 -21.535 439 H MET 56 HN MET 56 0.179 0.754 -20.591 440 HA MET 56 HA MET 56 1.789 1.574 -18.307 441 HB2 MET 56 2HB MET 56 2.396 0.407 -21.055 442 HB3 MET 56 3HB MET 56 3.649 1.290 -20.206 443 HG2 MET 56 2HG MET 56 2.154 -0.854 -18.691 444 HG3 MET 56 3HG MET 56 3.341 -1.359 -19.877 445 HE1 MET 56 3HE MET 56 3.565 -1.698 -16.412 446 HE2 MET 56 1HE MET 56 4.063 -0.143 -15.704 447 HE3 MET 56 2HE MET 56 2.511 -0.272 -16.566 448 HA PRO 57 HA PRO 57 2.111 5.599 -19.897 449 HB2 PRO 57 2HB PRO 57 4.645 6.368 -19.222 450 HB3 PRO 57 3HB PRO 57 3.315 6.342 -18.081 451 HG2 PRO 57 2HG PRO 57 5.579 4.457 -18.333 452 HG3 PRO 57 3HG PRO 57 4.500 4.701 -16.974 453 HD2 PRO 57 2HD PRO 57 4.427 2.538 -18.858 454 HD3 PRO 57 3HD PRO 57 3.279 2.845 -17.569 455 H ASP 58 HN ASP 58 4.384 3.293 -21.031 456 HA ASP 58 HA ASP 58 5.065 5.053 -23.216 457 HB2 ASP 58 2HB ASP 58 6.269 2.736 -21.884 458 HB3 ASP 58 3HB ASP 58 6.224 2.490 -23.618 459 HD2 ASP 58 HD2 ASP 58 8.415 4.777 -21.505 460 H MET 59 HN MET 59 2.467 3.235 -22.472 461 HA MET 59 HA MET 59 2.316 1.965 -25.093 462 HB2 MET 59 2HB MET 59 1.194 1.335 -22.350 463 HB3 MET 59 3HB MET 59 0.241 0.850 -23.738 464 HG2 MET 59 2HG MET 59 2.590 -0.129 -24.597 465 HG3 MET 59 3HG MET 59 2.978 -0.109 -22.888 466 HE1 MET 59 3HE MET 59 0.880 -0.986 -21.097 467 HE2 MET 59 1HE MET 59 -0.329 -0.254 -22.178 468 HE3 MET 59 2HE MET 59 -0.475 -1.965 -21.710 469 H VAL 60 HN VAL 60 1.732 4.872 -24.100 470 HA VAL 60 HA VAL 60 -0.876 5.011 -25.409 471 HB VAL 60 HB VAL 60 -0.169 6.497 -22.873 472 HG11 VAL 60 1HG1 VAL 60 -2.525 7.177 -22.886 473 HG12 VAL 60 2HG1 VAL 60 -1.701 7.705 -24.372 474 HG13 VAL 60 3HG1 VAL 60 -2.782 6.292 -24.409 475 HG21 VAL 60 3HG2 VAL 60 -2.335 4.892 -22.283 476 HG22 VAL 60 1HG2 VAL 60 -1.324 3.830 -23.293 477 HG23 VAL 60 2HG2 VAL 60 -0.646 4.569 -21.823 478 H LYS 61 HN LYS 61 -1.085 6.758 -26.807 479 HA LYS 61 HA LYS 61 1.387 8.155 -27.343 480 HB2 LYS 61 2HB LYS 61 -1.271 8.079 -28.800 481 HB3 LYS 61 3HB LYS 61 0.138 8.964 -29.349 482 HG2 LYS 61 2HG LYS 61 1.426 6.716 -29.189 483 HG3 LYS 61 3HG LYS 61 -0.139 5.949 -29.004 484 HD2 LYS 61 2HD LYS 61 -0.742 7.392 -31.183 485 HD3 LYS 61 3HD LYS 61 0.996 7.388 -31.405 486 HE2 LYS 61 2HE LYS 61 0.883 4.815 -31.074 487 HE3 LYS 61 3HE LYS 61 -0.855 4.973 -31.236 488 HZ1 LYS 61 2HZ LYS 61 0.476 6.380 -33.325 489 HZ3 LYS 61 1HZ LYS 61 -0.622 5.184 -33.450 490 H GLY 62 HN GLY 62 1.536 10.496 -27.493 491 HA2 GLY 62 1HA GLY 62 1.315 12.534 -26.568 492 HA3 GLY 62 2HA GLY 62 -0.404 12.321 -26.831 493 H TYR 63 HN TYR 63 1.199 9.971 -24.759 494 HA TYR 63 HA TYR 63 -0.368 10.911 -22.525 495 HB2 TYR 63 2HB TYR 63 -0.224 8.506 -22.966 496 HB3 TYR 63 3HB TYR 63 1.505 8.591 -23.242 497 HD1 TYR 63 HD2 TYR 63 3.073 8.822 -21.315 498 HD2 TYR 63 HD1 TYR 63 -1.128 8.247 -20.747 499 HE1 TYR 63 HE2 TYR 63 3.485 8.147 -18.899 500 HE2 TYR 63 HE1 TYR 63 -0.702 7.573 -18.333 501 HH TYR 63 HH TYR 63 1.624 8.284 -16.650 502 H ALA 64 HN ALA 64 0.822 10.736 -20.267 503 HA ALA 64 HA ALA 64 3.481 11.172 -19.929 504 HB1 ALA 64 1HB ALA 64 2.005 13.654 -20.796 505 HB2 ALA 64 2HB ALA 64 3.334 13.786 -19.619 506 HB3 ALA 64 3HB ALA 64 3.639 13.099 -21.232 507 HA PRO 65 HA PRO 65 1.873 11.202 -15.913 508 HB2 PRO 65 2HB PRO 65 4.095 11.836 -14.453 509 HB3 PRO 65 3HB PRO 65 3.777 10.224 -15.065 510 HG2 PRO 65 2HG PRO 65 5.706 12.235 -16.052 511 HG3 PRO 65 3HG PRO 65 5.665 10.510 -16.358 512 HD2 PRO 65 2HD PRO 65 4.849 12.592 -18.155 513 HD3 PRO 65 3HD PRO 65 4.701 10.865 -18.415 514 H ALA 66 HN ALA 66 1.493 12.461 -13.876 515 HA ALA 66 HA ALA 66 1.855 15.310 -14.348 516 HB1 ALA 66 1HB ALA 66 -0.718 15.346 -13.513 517 HB2 ALA 66 2HB ALA 66 -0.257 15.341 -15.233 518 HB3 ALA 66 3HB ALA 66 -0.731 13.822 -14.434 Start of MODEL 12 1 H1 MET 0 HN MET 0 0.277 1.270 -0.126 2 HA MET 0 HA MET 0 2.797 0.911 -1.550 3 HB2 MET 0 2HB MET 0 2.602 -0.234 0.779 4 HB3 MET 0 3HB MET 0 1.348 -1.241 0.082 5 HG2 MET 0 2HG MET 0 4.093 -1.013 -1.220 6 HG3 MET 0 3HG MET 0 3.792 -2.159 0.071 7 HE1 MET 0 3HE MET 0 4.717 -3.744 -1.698 8 HE2 MET 0 1HE MET 0 3.456 -4.665 -0.844 9 HE3 MET 0 2HE MET 0 3.581 -4.762 -2.616 10 H ASN 1 HN ASN 1 -0.620 -0.161 -1.070 11 HA ASN 1 HA ASN 1 -0.540 -1.504 -3.608 12 HB2 ASN 1 2HB ASN 1 -2.847 -1.079 -1.635 13 HB3 ASN 1 3HB ASN 1 -2.907 -2.131 -3.035 14 HD21 ASN 1 1HD2 ASN 1 -3.139 -2.625 -0.117 15 HD22 ASN 1 2HD2 ASN 1 -1.992 -3.866 0.264 16 H GLN 2 HN GLN 2 -0.415 0.190 -5.192 17 HA GLN 2 HA GLN 2 -2.487 2.223 -5.001 18 HB2 GLN 2 2HB GLN 2 -1.101 3.520 -6.594 19 HB3 GLN 2 3HB GLN 2 -0.190 3.091 -5.159 20 HG2 GLN 2 2HG GLN 2 1.346 1.997 -6.414 21 HG3 GLN 2 3HG GLN 2 0.107 0.943 -7.065 22 HE21 GLN 2 1HE2 GLN 2 -1.512 2.798 -8.356 23 HE22 GLN 2 2HE2 GLN 2 -0.679 3.464 -9.721 24 H GLU 3 HN GLU 3 -4.151 2.293 -6.484 25 HA GLU 3 HA GLU 3 -4.524 0.083 -8.133 26 HB2 GLU 3 2HB GLU 3 -5.947 2.629 -7.532 27 HB3 GLU 3 3HB GLU 3 -6.306 1.946 -9.105 28 HG2 GLU 3 2HG GLU 3 -6.748 -0.288 -7.945 29 HG3 GLU 3 3HG GLU 3 -6.575 0.538 -6.409 30 HE2 GLU 3 HE2 GLU 3 -8.376 2.884 -6.855 31 H SER 4 HN SER 4 -4.076 -0.297 -10.295 32 HA SER 4 HA SER 4 -2.852 1.948 -11.700 33 HB2 SER 4 2HB SER 4 -2.207 -0.899 -12.445 34 HB3 SER 4 3HB SER 4 -1.218 0.539 -12.608 35 HG SER 4 HG SER 4 -1.206 -1.280 -10.602 36 H VAL 5 HN VAL 5 -3.438 2.248 -13.920 37 HA VAL 5 HA VAL 5 -6.021 1.572 -14.610 38 HB VAL 5 HB VAL 5 -3.645 2.372 -16.298 39 HG11 VAL 5 1HG1 VAL 5 -6.502 2.774 -17.153 40 HG12 VAL 5 2HG1 VAL 5 -5.017 2.726 -18.135 41 HG13 VAL 5 3HG1 VAL 5 -5.689 1.221 -17.463 42 HG21 VAL 5 3HG2 VAL 5 -5.226 3.789 -14.399 43 HG22 VAL 5 1HG2 VAL 5 -3.949 4.417 -15.468 44 HG23 VAL 5 2HG2 VAL 5 -5.643 4.408 -16.014 45 H VAL 6 HN VAL 6 -6.992 -0.107 -15.720 46 HA VAL 6 HA VAL 6 -5.229 -2.146 -16.840 47 HB VAL 6 HB VAL 6 -7.327 -2.556 -14.711 48 HG11 VAL 6 1HG1 VAL 6 -7.577 -4.163 -16.653 49 HG12 VAL 6 2HG1 VAL 6 -5.946 -4.761 -16.266 50 HG13 VAL 6 3HG1 VAL 6 -7.256 -4.913 -15.071 51 HG21 VAL 6 3HG2 VAL 6 -5.412 -2.328 -13.505 52 HG22 VAL 6 1HG2 VAL 6 -5.209 -4.040 -13.950 53 HG23 VAL 6 2HG2 VAL 6 -4.364 -2.774 -14.873 54 H ALA 7 HN ALA 7 -5.857 -2.515 -18.898 55 HA ALA 7 HA ALA 7 -7.931 -1.330 -20.152 56 HB1 ALA 7 1HB ALA 7 -6.401 -3.888 -20.610 57 HB2 ALA 7 2HB ALA 7 -7.749 -3.463 -21.692 58 HB3 ALA 7 3HB ALA 7 -6.358 -2.364 -21.528 59 H ALA 8 HN ALA 8 -9.983 -1.242 -19.308 60 HA ALA 8 HA ALA 8 -11.166 -3.418 -17.961 61 HB1 ALA 8 1HB ALA 8 -12.997 -1.443 -19.142 62 HB2 ALA 8 2HB ALA 8 -12.701 -1.846 -17.433 63 HB3 ALA 8 3HB ALA 8 -11.634 -0.697 -18.275 64 H VAL 9 HN VAL 9 -10.480 -2.871 -21.263 65 HA VAL 9 HA VAL 9 -12.049 -5.155 -21.992 66 HB VAL 9 HB VAL 9 -13.252 -3.992 -23.807 67 HG11 VAL 9 1HG1 VAL 9 -15.054 -3.186 -22.457 68 HG12 VAL 9 2HG1 VAL 9 -14.273 -4.508 -21.556 69 HG13 VAL 9 3HG1 VAL 9 -13.959 -2.816 -21.103 70 HG21 VAL 9 3HG2 VAL 9 -11.706 -2.004 -23.882 71 HG22 VAL 9 1HG2 VAL 9 -13.440 -1.605 -23.900 72 HG23 VAL 9 2HG2 VAL 9 -12.498 -1.411 -22.402 73 H LEU 10 HN LEU 10 -11.674 -5.578 -24.473 74 HA LEU 10 HA LEU 10 -8.885 -5.597 -24.840 75 HB2 LEU 10 2HB LEU 10 -10.019 -7.398 -25.734 76 HB3 LEU 10 3HB LEU 10 -11.280 -6.405 -26.438 77 HG LEU 10 HG LEU 10 -9.264 -5.507 -27.928 78 HD11 LEU 10 1HD1 LEU 10 -8.076 -7.970 -28.347 79 HD12 LEU 10 2HD1 LEU 10 -7.345 -6.568 -27.529 80 HD13 LEU 10 3HD1 LEU 10 -8.146 -7.838 -26.573 81 HD21 LEU 10 3HD2 LEU 10 -9.836 -7.798 -29.322 82 HD22 LEU 10 1HD2 LEU 10 -11.218 -7.679 -28.206 83 HD23 LEU 10 2HD2 LEU 10 -10.834 -6.325 -29.295 84 H ILE 11 HN ILE 11 -8.012 -3.510 -24.812 85 HA ILE 11 HA ILE 11 -9.129 -1.522 -26.570 86 HB ILE 11 HB ILE 11 -6.525 -1.198 -25.154 87 HG12 ILE 11 2HG1 ILE 11 -9.184 -1.634 -23.831 88 HG13 ILE 11 3HG1 ILE 11 -7.600 -2.221 -23.367 89 HG21 ILE 11 1HG2 ILE 11 -7.450 0.604 -26.556 90 HG22 ILE 11 2HG2 ILE 11 -8.908 0.635 -25.535 91 HG23 ILE 11 3HG2 ILE 11 -7.327 1.071 -24.843 92 HD11 ILE 11 3HD1 ILE 11 -6.902 0.068 -22.729 93 HD12 ILE 11 1HD1 ILE 11 -8.481 0.701 -23.252 94 HD13 ILE 11 2HD1 ILE 11 -8.382 -0.402 -21.859 95 HA PRO 12 HA PRO 12 -6.597 -2.963 -29.836 96 HB2 PRO 12 2HB PRO 12 -7.746 -1.473 -31.818 97 HB3 PRO 12 3HB PRO 12 -8.358 -3.037 -31.317 98 HG2 PRO 12 2HG PRO 12 -9.447 -0.349 -30.742 99 HG3 PRO 12 3HG PRO 12 -10.245 -1.904 -30.626 100 HD2 PRO 12 2HD PRO 12 -9.235 -0.328 -28.454 101 HD3 PRO 12 3HD PRO 12 -9.928 -1.934 -28.350 102 H ILE 13 HN ILE 13 -5.190 -1.990 -31.624 103 HA ILE 13 HA ILE 13 -3.581 -0.066 -30.302 104 HB ILE 13 HB ILE 13 -2.663 -1.827 -31.700 105 HG12 ILE 13 2HG1 ILE 13 -2.078 0.884 -32.920 106 HG13 ILE 13 3HG1 ILE 13 -1.486 0.375 -31.351 107 HG21 ILE 13 1HG2 ILE 13 -4.542 -0.731 -33.678 108 HG22 ILE 13 2HG2 ILE 13 -2.914 -1.065 -34.315 109 HG23 ILE 13 3HG2 ILE 13 -3.845 -2.361 -33.526 110 HD11 ILE 13 3HD1 ILE 13 0.116 -0.968 -32.260 111 HD12 ILE 13 1HD1 ILE 13 -1.011 -1.642 -33.461 112 HD13 ILE 13 2HD1 ILE 13 -0.206 -0.086 -33.773 113 H ASN 14 HN ASN 14 -3.042 2.099 -31.081 114 HA ASN 14 HA ASN 14 -3.758 4.133 -31.451 115 HB2 ASN 14 2HB ASN 14 -4.220 2.638 -34.038 116 HB3 ASN 14 3HB ASN 14 -4.801 4.289 -33.951 117 HD21 ASN 14 1HD2 ASN 14 -2.345 2.507 -34.982 118 HD22 ASN 14 2HD2 ASN 14 -1.001 3.588 -34.819 119 H THR 15 HN THR 15 -5.629 3.104 -29.803 120 HA THR 15 HA THR 15 -8.199 3.843 -31.041 121 HB THR 15 HB THR 15 -7.539 1.600 -29.062 122 HG1 THR 15 HG1 THR 15 -7.177 1.186 -31.354 123 HG21 THR 15 3HG2 THR 15 -10.188 1.412 -30.131 124 HG22 THR 15 1HG2 THR 15 -9.734 1.663 -28.428 125 HG23 THR 15 2HG2 THR 15 -10.025 3.063 -29.488 126 H ALA 16 HN ALA 16 -9.294 5.456 -30.093 127 HA ALA 16 HA ALA 16 -8.096 6.970 -28.094 128 HB1 ALA 16 1HB ALA 16 -11.049 6.884 -28.814 129 HB2 ALA 16 2HB ALA 16 -10.129 8.261 -28.162 130 HB3 ALA 16 3HB ALA 16 -9.814 7.683 -29.816 131 H LEU 17 HN LEU 17 -8.134 6.907 -25.879 132 HA LEU 17 HA LEU 17 -9.398 4.596 -24.696 133 HB2 LEU 17 2HB LEU 17 -7.565 6.729 -23.599 134 HB3 LEU 17 3HB LEU 17 -8.206 5.402 -22.651 135 HG LEU 17 HG LEU 17 -6.517 5.018 -25.135 136 HD11 LEU 17 1HD1 LEU 17 -5.539 4.779 -22.287 137 HD12 LEU 17 2HD1 LEU 17 -4.593 4.755 -23.794 138 HD13 LEU 17 3HD1 LEU 17 -5.362 6.265 -23.250 139 HD21 LEU 17 3HD2 LEU 17 -7.692 3.037 -24.809 140 HD22 LEU 17 1HD2 LEU 17 -6.155 2.747 -23.959 141 HD23 LEU 17 2HD2 LEU 17 -7.618 3.164 -23.035 142 H THR 18 HN THR 18 -11.098 4.616 -23.211 143 HA THR 18 HA THR 18 -12.353 7.245 -22.787 144 HB THR 18 HB THR 18 -14.539 5.779 -22.969 145 HG1 THR 18 HG1 THR 18 -13.892 3.993 -24.595 146 HG21 THR 18 3HG2 THR 18 -13.522 7.430 -24.781 147 HG22 THR 18 1HG2 THR 18 -13.008 5.930 -25.590 148 HG23 THR 18 2HG2 THR 18 -14.737 6.233 -25.292 149 H VAL 19 HN VAL 19 -14.143 6.984 -20.987 150 HA VAL 19 HA VAL 19 -12.686 6.034 -18.702 151 HB VAL 19 HB VAL 19 -14.186 8.166 -19.072 152 HG11 VAL 19 1HG1 VAL 19 -16.446 7.858 -18.071 153 HG12 VAL 19 2HG1 VAL 19 -16.250 7.029 -19.633 154 HG13 VAL 19 3HG1 VAL 19 -16.193 6.097 -18.118 155 HG21 VAL 19 3HG2 VAL 19 -13.584 8.480 -16.949 156 HG22 VAL 19 1HG2 VAL 19 -14.819 7.324 -16.397 157 HG23 VAL 19 2HG2 VAL 19 -13.189 6.749 -16.824 158 H GLY 20 HN GLY 20 -14.900 4.716 -20.979 159 HA2 GLY 20 1HA GLY 20 -15.905 2.736 -19.044 160 HA3 GLY 20 2HA GLY 20 -16.574 3.087 -20.626 161 H MET 21 HN MET 21 -13.128 3.099 -20.692 162 HA MET 21 HA MET 21 -13.192 0.365 -21.712 163 HB2 MET 21 2HB MET 21 -12.005 2.928 -22.686 164 HB3 MET 21 3HB MET 21 -10.899 1.571 -22.768 165 HG2 MET 21 2HG MET 21 -13.213 0.429 -23.775 166 HG3 MET 21 3HG MET 21 -13.387 2.082 -24.329 167 HE1 MET 21 3HE MET 21 -10.192 2.773 -24.259 168 HE2 MET 21 1HE MET 21 -9.757 2.549 -25.971 169 HE3 MET 21 2HE MET 21 -11.262 3.396 -25.538 170 H MET 22 HN MET 22 -11.554 2.754 -19.643 171 HA MET 22 HA MET 22 -9.535 0.781 -18.988 172 HB2 MET 22 2HB MET 22 -9.900 3.751 -18.319 173 HB3 MET 22 3HB MET 22 -8.593 2.792 -17.653 174 HG2 MET 22 2HG MET 22 -7.679 2.349 -19.876 175 HG3 MET 22 3HG MET 22 -9.086 3.043 -20.656 176 HE1 MET 22 3HE MET 22 -9.501 5.507 -21.047 177 HE2 MET 22 1HE MET 22 -9.858 5.594 -19.305 178 HE3 MET 22 2HE MET 22 -8.796 6.808 -20.058 179 H THR 23 HN THR 23 -8.910 0.750 -16.518 180 HA THR 23 HA THR 23 -11.065 1.258 -14.697 181 HB THR 23 HB THR 23 -11.365 -1.067 -16.111 182 HG1 THR 23 HG1 THR 23 -11.681 -0.813 -13.211 183 HG21 THR 23 3HG2 THR 23 -10.678 -2.922 -14.582 184 HG22 THR 23 1HG2 THR 23 -9.252 -2.083 -15.237 185 HG23 THR 23 2HG2 THR 23 -9.791 -1.755 -13.573 186 H THR 24 HN THR 24 -10.464 0.482 -12.435 187 HA THR 24 HA THR 24 -7.543 0.756 -12.171 188 HB THR 24 HB THR 24 -8.013 1.963 -10.122 189 HG1 THR 24 HG1 THR 24 -10.798 1.230 -10.667 190 HG21 THR 24 3HG2 THR 24 -8.538 3.396 -12.076 191 HG22 THR 24 1HG2 THR 24 -10.162 2.676 -12.187 192 HG23 THR 24 2HG2 THR 24 -9.732 3.688 -10.788 193 H ARG 25 HN ARG 25 -6.364 -0.734 -11.075 194 HA ARG 25 HA ARG 25 -7.633 -2.514 -9.298 195 HB2 ARG 25 2HB ARG 25 -7.527 -3.292 -12.072 196 HB3 ARG 25 3HB ARG 25 -6.363 -4.284 -11.217 197 HG2 ARG 25 2HG ARG 25 -8.081 -5.578 -10.499 198 HG3 ARG 25 3HG ARG 25 -8.623 -4.233 -9.515 199 HD2 ARG 25 2HD ARG 25 -10.386 -3.779 -10.903 200 HD3 ARG 25 3HD ARG 25 -9.401 -3.914 -12.346 201 HE ARG 25 HE ARG 25 -9.604 -6.531 -11.647 202 HH11 ARG 25 2HH2 ARG 25 -12.089 -4.011 -11.817 203 HH12 ARG 25 1HH2 ARG 25 -13.366 -5.121 -12.188 204 HH22 ARG 25 HH1 ARG 25 -12.872 -7.459 -12.370 205 H VAL 26 HN VAL 26 -6.053 -3.632 -7.994 206 HA VAL 26 HA VAL 26 -3.423 -2.489 -8.182 207 HB VAL 26 HB VAL 26 -4.567 -4.519 -6.254 208 HG11 VAL 26 1HG1 VAL 26 -2.566 -2.796 -5.125 209 HG12 VAL 26 2HG1 VAL 26 -2.552 -4.567 -5.303 210 HG13 VAL 26 3HG1 VAL 26 -1.923 -3.536 -6.611 211 HG21 VAL 26 3HG2 VAL 26 -4.258 -1.704 -5.396 212 HG22 VAL 26 1HG2 VAL 26 -5.536 -1.995 -6.600 213 HG23 VAL 26 2HG2 VAL 26 -5.552 -2.877 -5.054 214 H VAL 27 HN VAL 27 -2.757 -3.380 -10.259 215 HA VAL 27 HA VAL 27 -2.260 -6.270 -10.152 216 HB VAL 27 HB VAL 27 -2.249 -6.263 -12.501 217 HG11 VAL 27 1HG1 VAL 27 -4.422 -4.245 -11.926 218 HG12 VAL 27 2HG1 VAL 27 -4.449 -5.640 -13.032 219 HG13 VAL 27 3HG1 VAL 27 -4.488 -5.899 -11.271 220 HG21 VAL 27 3HG2 VAL 27 -2.191 -3.229 -12.382 221 HG22 VAL 27 1HG2 VAL 27 -0.879 -4.304 -12.920 222 HG23 VAL 27 2HG2 VAL 27 -2.382 -4.191 -13.867 223 H SER 28 HN SER 28 -0.136 -7.024 -10.986 224 HA SER 28 HA SER 28 1.897 -4.972 -10.586 225 HB2 SER 28 2HB SER 28 1.500 -6.855 -8.738 226 HB3 SER 28 3HB SER 28 2.423 -7.852 -9.845 227 HG SER 28 HG SER 28 3.683 -6.661 -8.160 228 HA PRO 29 HA PRO 29 3.767 -4.720 -10.889 229 HB2 PRO 29 2HB PRO 29 5.178 -3.178 -12.650 230 HB3 PRO 29 3HB PRO 29 5.871 -4.550 -11.808 231 HG2 PRO 29 2HG PRO 29 5.032 -4.341 -14.635 232 HG3 PRO 29 3HG PRO 29 6.094 -5.519 -13.889 233 HD2 PRO 29 2HD PRO 29 3.359 -5.917 -14.659 234 HD3 PRO 29 3HD PRO 29 4.385 -7.056 -13.809 235 H THR 30 HN THR 30 3.280 -2.557 -10.293 236 HA THR 30 HA THR 30 0.775 -1.769 -11.384 237 HB THR 30 HB THR 30 1.186 0.180 -9.764 238 HG1 THR 30 HG1 THR 30 3.219 -0.409 -8.440 239 HG21 THR 30 3HG2 THR 30 1.455 -1.307 -7.689 240 HG22 THR 30 1HG2 THR 30 0.125 -1.781 -8.773 241 HG23 THR 30 2HG2 THR 30 1.659 -2.684 -8.798 242 H GLY 31 HN GLY 31 0.373 -0.704 -13.208 243 HA2 GLY 31 1HA GLY 31 2.587 0.733 -14.481 244 HA3 GLY 31 2HA GLY 31 1.087 0.217 -15.226 245 H ILE 32 HN ILE 32 0.499 2.266 -16.062 246 HA ILE 32 HA ILE 32 0.669 4.682 -14.887 247 HB ILE 32 HB ILE 32 -1.521 3.546 -16.621 248 HG12 ILE 32 2HG1 ILE 32 0.750 5.373 -17.418 249 HG13 ILE 32 3HG1 ILE 32 0.921 3.629 -17.413 250 HG21 ILE 32 1HG2 ILE 32 -0.985 6.489 -16.350 251 HG22 ILE 32 2HG2 ILE 32 -2.429 5.646 -16.960 252 HG23 ILE 32 3HG2 ILE 32 -2.079 5.663 -15.215 253 HD11 ILE 32 3HD1 ILE 32 0.051 4.978 -19.580 254 HD12 ILE 32 1HD1 ILE 32 -0.517 3.333 -19.206 255 HD13 ILE 32 2HD1 ILE 32 -1.517 4.740 -18.771 256 HA PRO 33 HA PRO 33 -1.886 4.565 -11.404 257 HB2 PRO 33 2HB PRO 33 -2.116 7.239 -10.890 258 HB3 PRO 33 3HB PRO 33 -0.723 6.288 -10.414 259 HG2 PRO 33 2HG PRO 33 -0.972 8.231 -12.629 260 HG3 PRO 33 3HG PRO 33 0.482 7.602 -11.878 261 HD2 PRO 33 2HD PRO 33 -0.612 6.828 -14.414 262 HD3 PRO 33 3HD PRO 33 0.774 6.119 -13.611 263 H ALA 34 HN ALA 34 -4.010 4.751 -10.600 264 HA ALA 34 HA ALA 34 -5.901 4.786 -12.672 265 HB1 ALA 34 1HB ALA 34 -6.171 4.978 -9.645 266 HB2 ALA 34 2HB ALA 34 -7.523 4.691 -10.766 267 HB3 ALA 34 3HB ALA 34 -6.211 3.496 -10.630 268 H GLU 35 HN GLU 35 -4.226 7.320 -11.081 269 HA GLU 35 HA GLU 35 -6.381 9.181 -11.195 270 HB2 GLU 35 2HB GLU 35 -3.493 10.016 -10.934 271 HB3 GLU 35 3HB GLU 35 -4.912 10.695 -10.162 272 HG2 GLU 35 2HG GLU 35 -5.006 8.172 -9.117 273 HG3 GLU 35 3HG GLU 35 -3.278 8.308 -9.374 274 HE2 GLU 35 HE2 GLU 35 -3.282 11.340 -7.363 275 H ASP 36 HN ASP 36 -4.264 7.776 -13.468 276 HA ASP 36 HA ASP 36 -4.194 10.160 -15.102 277 HB2 ASP 36 2HB ASP 36 -2.764 7.524 -15.040 278 HB3 ASP 36 3HB ASP 36 -3.008 8.222 -16.629 279 HD2 ASP 36 HD2 ASP 36 -0.699 10.034 -13.922 280 H ILE 37 HN ILE 37 -6.250 7.574 -14.417 281 HA ILE 37 HA ILE 37 -6.968 6.512 -16.851 282 HB ILE 37 HB ILE 37 -8.181 6.824 -14.184 283 HG12 ILE 37 2HG1 ILE 37 -7.655 4.587 -16.139 284 HG13 ILE 37 3HG1 ILE 37 -6.938 4.857 -14.563 285 HG21 ILE 37 1HG2 ILE 37 -9.897 6.234 -16.611 286 HG22 ILE 37 2HG2 ILE 37 -10.379 5.975 -14.918 287 HG23 ILE 37 3HG2 ILE 37 -10.047 7.622 -15.506 288 HD11 ILE 37 3HD1 ILE 37 -8.526 3.132 -14.183 289 HD12 ILE 37 1HD1 ILE 37 -9.354 4.602 -13.616 290 HD13 ILE 37 2HD1 ILE 37 -9.751 3.915 -15.209 291 HA PRO 38 HA PRO 38 -9.835 10.241 -17.348 292 HB2 PRO 38 2HB PRO 38 -9.513 12.428 -15.740 293 HB3 PRO 38 3HB PRO 38 -10.697 11.174 -15.427 294 HG2 PRO 38 2HG PRO 38 -8.123 11.674 -14.063 295 HG3 PRO 38 3HG PRO 38 -9.491 10.726 -13.513 296 HD2 PRO 38 2HD PRO 38 -7.026 9.722 -14.582 297 HD3 PRO 38 3HD PRO 38 -8.437 8.782 -14.141 298 H ARG 39 HN ARG 39 -6.538 10.260 -17.017 299 HA ARG 39 HA ARG 39 -6.307 12.661 -18.606 300 HB2 ARG 39 2HB ARG 39 -4.160 10.866 -17.365 301 HB3 ARG 39 3HB ARG 39 -3.835 12.363 -18.216 302 HG2 ARG 39 2HG ARG 39 -5.205 13.618 -16.543 303 HG3 ARG 39 3HG ARG 39 -5.549 12.123 -15.697 304 HD2 ARG 39 2HD ARG 39 -3.710 13.222 -14.541 305 HD3 ARG 39 3HD ARG 39 -3.064 11.800 -15.334 306 HE ARG 39 HE ARG 39 -2.545 14.612 -16.069 307 HH11 ARG 39 2HH2 ARG 39 -2.264 11.212 -17.027 308 HH12 ARG 39 1HH2 ARG 39 -1.006 11.512 -18.179 309 HH22 ARG 39 HH1 ARG 39 -0.211 13.751 -18.493 310 H LEU 40 HN LEU 40 -6.375 9.184 -18.847 311 HA LEU 40 HA LEU 40 -4.828 9.086 -21.278 312 HB2 LEU 40 2HB LEU 40 -6.405 7.004 -19.763 313 HB3 LEU 40 3HB LEU 40 -5.496 6.684 -21.226 314 HG LEU 40 HG LEU 40 -4.180 7.854 -18.774 315 HD11 LEU 40 1HD1 LEU 40 -3.453 5.229 -18.703 316 HD12 LEU 40 2HD1 LEU 40 -4.723 5.963 -17.695 317 HD13 LEU 40 3HD1 LEU 40 -5.160 5.107 -19.194 318 HD21 LEU 40 3HD2 LEU 40 -2.954 6.135 -20.931 319 HD22 LEU 40 1HD2 LEU 40 -3.080 7.905 -21.073 320 HD23 LEU 40 2HD2 LEU 40 -2.144 7.182 -19.742 321 H ILE 41 HN ILE 41 -8.148 9.575 -20.252 322 HA ILE 41 HA ILE 41 -9.493 8.626 -22.479 323 HB ILE 41 HB ILE 41 -10.170 11.011 -20.755 324 HG12 ILE 41 2HG1 ILE 41 -10.339 8.060 -20.277 325 HG13 ILE 41 3HG1 ILE 41 -9.896 9.350 -19.177 326 HG21 ILE 41 1HG2 ILE 41 -12.004 9.181 -22.323 327 HG22 ILE 41 2HG2 ILE 41 -12.457 10.623 -21.382 328 HG23 ILE 41 3HG2 ILE 41 -11.479 10.795 -22.860 329 HD11 ILE 41 3HD1 ILE 41 -12.253 10.139 -19.117 330 HD12 ILE 41 1HD1 ILE 41 -12.709 8.849 -20.257 331 HD13 ILE 41 2HD1 ILE 41 -12.134 8.432 -18.625 332 H SER 42 HN SER 42 -9.896 9.396 -24.532 333 HA SER 42 HA SER 42 -9.929 10.816 -26.219 334 HB2 SER 42 2HB SER 42 -9.881 12.676 -24.311 335 HB3 SER 42 3HB SER 42 -8.224 12.893 -24.839 336 HG SER 42 HG SER 42 -9.126 14.183 -26.305 337 H MET 43 HN MET 43 -7.250 9.602 -24.492 338 HA MET 43 HA MET 43 -5.398 10.287 -26.619 339 HB2 MET 43 2HB MET 43 -4.787 8.730 -24.060 340 HB3 MET 43 3HB MET 43 -3.661 9.643 -25.046 341 HG2 MET 43 2HG MET 43 -5.418 11.642 -24.401 342 HG3 MET 43 3HG MET 43 -5.613 10.621 -22.990 343 HE1 MET 43 3HE MET 43 -3.277 9.138 -22.723 344 HE2 MET 43 1HE MET 43 -1.912 9.697 -23.720 345 HE3 MET 43 2HE MET 43 -1.926 10.018 -21.969 346 H GLN 44 HN GLN 44 -4.682 8.789 -28.110 347 HA GLN 44 HA GLN 44 -5.969 6.234 -28.015 348 HB2 GLN 44 2HB GLN 44 -4.368 7.780 -30.052 349 HB3 GLN 44 3HB GLN 44 -4.531 6.048 -30.260 350 HG2 GLN 44 2HG GLN 44 -6.875 6.156 -30.529 351 HG3 GLN 44 3HG GLN 44 -7.010 7.675 -29.666 352 HE21 GLN 44 1HE2 GLN 44 -7.094 6.242 -32.622 353 HE22 GLN 44 2HE2 GLN 44 -6.775 7.590 -33.662 354 H VAL 45 HN VAL 45 -4.788 4.167 -28.232 355 HA VAL 45 HA VAL 45 -2.310 4.275 -26.706 356 HB VAL 45 HB VAL 45 -2.698 1.804 -26.551 357 HG11 VAL 45 1HG1 VAL 45 -5.000 3.523 -25.566 358 HG12 VAL 45 2HG1 VAL 45 -4.440 1.981 -24.874 359 HG13 VAL 45 3HG1 VAL 45 -3.398 3.422 -24.796 360 HG21 VAL 45 3HG2 VAL 45 -5.491 2.320 -27.565 361 HG22 VAL 45 1HG2 VAL 45 -4.186 1.846 -28.678 362 HG23 VAL 45 2HG2 VAL 45 -4.642 0.773 -27.333 363 H ASN 46 HN ASN 46 -0.350 3.350 -27.444 364 HA ASN 46 HA ASN 46 -0.210 3.296 -30.318 365 HB2 ASN 46 2HB ASN 46 2.256 3.320 -29.947 366 HB3 ASN 46 3HB ASN 46 1.482 4.604 -29.039 367 HD21 ASN 46 1HD2 ASN 46 2.651 4.862 -27.283 368 HD22 ASN 46 2HD2 ASN 46 3.101 3.635 -26.145 369 H GLN 47 HN GLN 47 -1.527 1.087 -28.753 370 HA GLN 47 HA GLN 47 -0.453 -1.066 -30.086 371 HB2 GLN 47 2HB GLN 47 1.440 -1.197 -28.687 372 HB3 GLN 47 3HB GLN 47 0.554 -0.701 -27.260 373 HG2 GLN 47 2HG GLN 47 -0.593 -2.850 -27.126 374 HG3 GLN 47 3HG GLN 47 0.012 -3.337 -28.696 375 HE21 GLN 47 1HE2 GLN 47 1.634 -1.702 -25.991 376 HE22 GLN 47 2HE2 GLN 47 2.859 -2.895 -25.710 377 H VAL 48 HN VAL 48 -1.771 -2.987 -29.795 378 HA VAL 48 HA VAL 48 -4.353 -2.350 -28.725 379 HB VAL 48 HB VAL 48 -4.291 -3.493 -30.784 380 HG11 VAL 48 1HG1 VAL 48 -2.280 -5.280 -29.436 381 HG12 VAL 48 2HG1 VAL 48 -3.233 -5.888 -30.811 382 HG13 VAL 48 3HG1 VAL 48 -2.193 -4.458 -31.012 383 HG21 VAL 48 3HG2 VAL 48 -5.607 -4.555 -28.546 384 HG22 VAL 48 1HG2 VAL 48 -6.006 -4.825 -30.260 385 HG23 VAL 48 2HG2 VAL 48 -4.940 -5.965 -29.405 386 H VAL 49 HN VAL 49 -4.301 -2.196 -26.487 387 HA VAL 49 HA VAL 49 -2.936 -4.243 -24.982 388 HB VAL 49 HB VAL 49 -4.634 -1.888 -24.130 389 HG11 VAL 49 1HG1 VAL 49 -2.826 -3.742 -22.549 390 HG12 VAL 49 2HG1 VAL 49 -3.456 -2.195 -21.935 391 HG13 VAL 49 3HG1 VAL 49 -4.580 -3.510 -22.355 392 HG21 VAL 49 3HG2 VAL 49 -1.825 -2.140 -24.994 393 HG22 VAL 49 1HG2 VAL 49 -2.881 -0.710 -24.917 394 HG23 VAL 49 2HG2 VAL 49 -2.050 -1.283 -23.451 395 HA PRO 50 HA PRO 50 -6.549 -6.688 -24.870 396 HB2 PRO 50 2HB PRO 50 -5.490 -8.815 -23.519 397 HB3 PRO 50 3HB PRO 50 -5.359 -8.621 -25.256 398 HG2 PRO 50 2HG PRO 50 -3.291 -8.210 -23.184 399 HG3 PRO 50 3HG PRO 50 -3.086 -8.438 -24.909 400 HD2 PRO 50 2HD PRO 50 -2.898 -5.964 -23.471 401 HD3 PRO 50 3HD PRO 50 -2.809 -6.175 -25.208 402 H MET 51 HN MET 51 -8.321 -6.967 -23.580 403 HA MET 51 HA MET 51 -8.504 -5.419 -21.390 404 HB2 MET 51 2HB MET 51 -10.397 -6.569 -22.597 405 HB3 MET 51 3HB MET 51 -9.902 -8.104 -21.910 406 HG2 MET 51 2HG MET 51 -10.309 -7.199 -19.605 407 HG3 MET 51 3HG MET 51 -10.812 -5.670 -20.297 408 HE1 MET 51 3HE MET 51 -12.777 -9.738 -20.605 409 HE2 MET 51 1HE MET 51 -12.084 -9.231 -22.164 410 HE3 MET 51 2HE MET 51 -11.049 -9.329 -20.720 411 H GLY 52 HN GLY 52 -7.594 -5.428 -19.382 412 HA2 GLY 52 1HA GLY 52 -7.270 -6.560 -17.316 413 HA3 GLY 52 2HA GLY 52 -6.923 -8.040 -18.187 414 H THR 53 HN THR 53 -5.419 -5.910 -20.142 415 HA THR 53 HA THR 53 -2.851 -6.411 -18.910 416 HB THR 53 HB THR 53 -3.778 -5.195 -21.563 417 HG1 THR 53 HG1 THR 53 -3.951 -7.590 -20.875 418 HG21 THR 53 3HG2 THR 53 -0.984 -5.873 -20.509 419 HG22 THR 53 1HG2 THR 53 -1.360 -5.672 -22.237 420 HG23 THR 53 2HG2 THR 53 -1.541 -4.297 -21.121 421 H THR 54 HN THR 54 -1.813 -5.086 -17.569 422 HA THR 54 HA THR 54 -2.862 -2.700 -16.677 423 HB THR 54 HB THR 54 0.122 -3.292 -16.751 424 HG1 THR 54 HG1 THR 54 -0.595 -4.766 -14.886 425 HG21 THR 54 3HG2 THR 54 -0.582 -1.363 -15.375 426 HG22 THR 54 1HG2 THR 54 -1.855 -2.344 -14.610 427 HG23 THR 54 2HG2 THR 54 -0.142 -2.712 -14.300 428 H LEU 55 HN LEU 55 -2.663 -0.539 -17.153 429 HA LEU 55 HA LEU 55 -1.878 -0.005 -19.875 430 HB2 LEU 55 2HB LEU 55 -3.894 0.887 -18.322 431 HB3 LEU 55 3HB LEU 55 -2.734 2.175 -18.063 432 HG LEU 55 HG LEU 55 -3.672 3.093 -19.877 433 HD11 LEU 55 1HD1 LEU 55 -2.526 2.722 -21.889 434 HD12 LEU 55 2HD1 LEU 55 -1.385 2.221 -20.619 435 HD13 LEU 55 3HD1 LEU 55 -2.285 0.993 -21.542 436 HD21 LEU 55 3HD2 LEU 55 -4.897 0.437 -20.132 437 HD22 LEU 55 1HD2 LEU 55 -5.595 2.058 -20.364 438 HD23 LEU 55 2HD2 LEU 55 -4.678 1.287 -21.681 439 H MET 56 HN MET 56 0.055 0.789 -20.523 440 HA MET 56 HA MET 56 1.832 1.654 -18.384 441 HB2 MET 56 2HB MET 56 2.271 0.489 -21.178 442 HB3 MET 56 3HB MET 56 3.586 1.245 -20.301 443 HG2 MET 56 2HG MET 56 1.950 -0.868 -18.886 444 HG3 MET 56 3HG MET 56 3.114 -1.386 -20.089 445 HE1 MET 56 3HE MET 56 2.691 -1.311 -16.629 446 HE2 MET 56 1HE MET 56 3.928 -0.294 -15.852 447 HE3 MET 56 2HE MET 56 2.553 0.462 -16.692 448 HA PRO 57 HA PRO 57 2.027 5.638 -20.091 449 HB2 PRO 57 2HB PRO 57 4.540 6.466 -19.406 450 HB3 PRO 57 3HB PRO 57 3.195 6.458 -18.283 451 HG2 PRO 57 2HG PRO 57 5.488 4.599 -18.441 452 HG3 PRO 57 3HG PRO 57 4.386 4.872 -17.106 453 HD2 PRO 57 2HD PRO 57 4.371 2.647 -18.917 454 HD3 PRO 57 3HD PRO 57 3.200 2.980 -17.657 455 H ASP 58 HN ASP 58 4.453 3.385 -21.067 456 HA ASP 58 HA ASP 58 5.101 5.064 -23.315 457 HB2 ASP 58 2HB ASP 58 6.918 3.849 -22.163 458 HB3 ASP 58 3HB ASP 58 6.100 2.321 -22.420 459 HD2 ASP 58 HD2 ASP 58 7.321 3.846 -25.887 460 H MET 59 HN MET 59 2.418 3.532 -22.724 461 HA MET 59 HA MET 59 2.384 2.054 -25.243 462 HB2 MET 59 2HB MET 59 1.203 1.508 -22.513 463 HB3 MET 59 3HB MET 59 0.249 1.013 -23.897 464 HG2 MET 59 2HG MET 59 2.600 -0.022 -24.709 465 HG3 MET 59 3HG MET 59 2.947 0.006 -22.992 466 HE1 MET 59 3HE MET 59 -0.278 -0.043 -22.254 467 HE2 MET 59 1HE MET 59 -0.563 -1.757 -21.869 468 HE3 MET 59 2HE MET 59 0.860 -0.920 -21.204 469 H VAL 60 HN VAL 60 1.716 4.987 -24.206 470 HA VAL 60 HA VAL 60 -0.822 5.101 -25.662 471 HB VAL 60 HB VAL 60 -0.180 6.563 -23.093 472 HG11 VAL 60 1HG1 VAL 60 -2.528 7.346 -23.232 473 HG12 VAL 60 2HG1 VAL 60 -1.528 7.936 -24.581 474 HG13 VAL 60 3HG1 VAL 60 -2.665 6.591 -24.838 475 HG21 VAL 60 3HG2 VAL 60 -0.803 4.601 -22.165 476 HG22 VAL 60 1HG2 VAL 60 -2.447 5.128 -22.596 477 HG23 VAL 60 2HG2 VAL 60 -1.562 4.013 -23.664 478 H LYS 61 HN LYS 61 -0.961 6.787 -27.130 479 HA LYS 61 HA LYS 61 1.519 8.208 -27.570 480 HB2 LYS 61 2HB LYS 61 -1.043 8.082 -29.189 481 HB3 LYS 61 3HB LYS 61 0.427 8.896 -29.683 482 HG2 LYS 61 2HG LYS 61 1.605 6.591 -29.274 483 HG3 LYS 61 3HG LYS 61 -0.012 5.917 -29.265 484 HD2 LYS 61 2HD LYS 61 -0.226 7.373 -31.533 485 HD3 LYS 61 3HD LYS 61 1.514 7.168 -31.540 486 HE2 LYS 61 2HE LYS 61 1.133 4.655 -31.233 487 HE3 LYS 61 3HE LYS 61 -0.579 4.947 -31.464 488 HZ1 LYS 61 2HZ LYS 61 -0.161 4.846 -33.656 489 HZ3 LYS 61 1HZ LYS 61 1.452 4.804 -33.442 490 H GLY 62 HN GLY 62 1.733 10.496 -27.603 491 HA2 GLY 62 1HA GLY 62 1.359 12.591 -26.883 492 HA3 GLY 62 2HA GLY 62 -0.351 12.301 -27.137 493 H TYR 63 HN TYR 63 1.129 9.985 -25.015 494 HA TYR 63 HA TYR 63 -0.380 11.033 -22.803 495 HB2 TYR 63 2HB TYR 63 -0.282 8.617 -23.171 496 HB3 TYR 63 3HB TYR 63 1.446 8.661 -23.462 497 HD1 TYR 63 HD1 TYR 63 3.037 8.858 -21.569 498 HD2 TYR 63 HD2 TYR 63 -1.176 8.489 -20.924 499 HE1 TYR 63 HE1 TYR 63 3.456 8.239 -19.138 500 HE2 TYR 63 HE2 TYR 63 -0.743 7.871 -18.496 501 HH TYR 63 HH TYR 63 1.277 8.434 -16.830 502 H ALA 64 HN ALA 64 0.803 10.889 -20.537 503 HA ALA 64 HA ALA 64 3.477 11.302 -20.222 504 HB1 ALA 64 1HB ALA 64 3.656 13.220 -21.519 505 HB2 ALA 64 2HB ALA 64 2.008 13.768 -21.129 506 HB3 ALA 64 3HB ALA 64 3.308 13.930 -19.924 507 HA PRO 65 HA PRO 65 1.903 11.373 -16.193 508 HB2 PRO 65 2HB PRO 65 4.135 12.023 -14.757 509 HB3 PRO 65 3HB PRO 65 3.815 10.406 -15.350 510 HG2 PRO 65 2HG PRO 65 5.733 12.410 -16.372 511 HG3 PRO 65 3HG PRO 65 5.692 10.682 -16.661 512 HD2 PRO 65 2HD PRO 65 4.859 12.744 -18.472 513 HD3 PRO 65 3HD PRO 65 4.711 11.015 -18.714 514 H ALA 66 HN ALA 66 1.449 12.640 -14.210 515 HA ALA 66 HA ALA 66 1.816 15.491 -14.714 516 HB1 ALA 66 1HB ALA 66 -0.345 15.079 -15.682 517 HB2 ALA 66 2HB ALA 66 -0.836 14.062 -14.306 518 HB3 ALA 66 3HB ALA 66 -0.624 15.815 -14.086 Start of MODEL 13 1 H1 MET 0 HN MET 0 1.780 -1.291 0.500 2 HA MET 0 HA MET 0 1.811 1.060 -1.158 3 HB2 MET 0 2HB MET 0 3.704 -0.024 -2.241 4 HB3 MET 0 3HB MET 0 3.879 -0.339 -0.526 5 HG2 MET 0 2HG MET 0 2.387 -2.517 -1.194 6 HG3 MET 0 3HG MET 0 3.158 -2.237 -2.743 7 HE1 MET 0 3HE MET 0 5.891 -4.611 -2.099 8 HE2 MET 0 1HE MET 0 4.158 -4.950 -1.879 9 HE3 MET 0 2HE MET 0 4.694 -3.865 -3.185 10 H ASN 1 HN ASN 1 -0.742 -0.229 -1.057 11 HA ASN 1 HA ASN 1 -0.861 -1.771 -3.491 12 HB2 ASN 1 2HB ASN 1 -3.067 -0.983 -1.513 13 HB3 ASN 1 3HB ASN 1 -3.264 -2.107 -2.843 14 HD21 ASN 1 1HD2 ASN 1 -1.732 -3.963 -2.901 15 HD22 ASN 1 2HD2 ASN 1 -1.328 -4.746 -1.410 16 H GLN 2 HN GLN 2 -0.471 -0.073 -5.080 17 HA GLN 2 HA GLN 2 -2.369 2.124 -5.010 18 HB2 GLN 2 2HB GLN 2 -0.834 3.385 -6.255 19 HB3 GLN 2 3HB GLN 2 0.222 2.412 -5.251 20 HG2 GLN 2 2HG GLN 2 1.170 2.153 -7.397 21 HG3 GLN 2 3HG GLN 2 0.208 0.698 -7.227 22 HE21 GLN 2 1HE2 GLN 2 -0.502 4.101 -8.019 23 HE22 GLN 2 2HE2 GLN 2 -1.358 3.809 -9.496 24 H GLU 3 HN GLU 3 -3.948 2.382 -6.588 25 HA GLU 3 HA GLU 3 -4.485 0.118 -8.178 26 HB2 GLU 3 2HB GLU 3 -5.782 2.761 -7.623 27 HB3 GLU 3 3HB GLU 3 -6.232 1.977 -9.124 28 HG2 GLU 3 2HG GLU 3 -6.802 -0.111 -7.862 29 HG3 GLU 3 3HG GLU 3 -6.356 0.677 -6.361 30 HE2 GLU 3 HE2 GLU 3 -8.933 0.008 -8.195 31 H SER 4 HN SER 4 -4.044 -0.273 -10.336 32 HA SER 4 HA SER 4 -2.770 1.940 -11.748 33 HB2 SER 4 2HB SER 4 -2.118 -0.756 -12.746 34 HB3 SER 4 3HB SER 4 -1.052 0.588 -12.388 35 HG SER 4 HG SER 4 -1.526 -1.644 -10.900 36 H VAL 5 HN VAL 5 -3.382 2.273 -13.949 37 HA VAL 5 HA VAL 5 -5.976 1.628 -14.627 38 HB VAL 5 HB VAL 5 -3.604 2.431 -16.318 39 HG11 VAL 5 1HG1 VAL 5 -6.543 2.566 -17.067 40 HG12 VAL 5 2HG1 VAL 5 -5.154 3.059 -18.064 41 HG13 VAL 5 3HG1 VAL 5 -5.400 1.341 -17.667 42 HG21 VAL 5 3HG2 VAL 5 -5.745 4.380 -15.842 43 HG22 VAL 5 1HG2 VAL 5 -4.932 3.847 -14.351 44 HG23 VAL 5 2HG2 VAL 5 -3.981 4.550 -15.681 45 H VAL 6 HN VAL 6 -6.973 -0.053 -15.694 46 HA VAL 6 HA VAL 6 -5.242 -2.079 -16.888 47 HB VAL 6 HB VAL 6 -7.289 -2.515 -14.713 48 HG11 VAL 6 1HG1 VAL 6 -7.220 -4.863 -15.097 49 HG12 VAL 6 2HG1 VAL 6 -7.553 -4.107 -16.673 50 HG13 VAL 6 3HG1 VAL 6 -5.917 -4.703 -16.299 51 HG21 VAL 6 3HG2 VAL 6 -5.354 -2.284 -13.541 52 HG22 VAL 6 1HG2 VAL 6 -5.142 -3.988 -14.009 53 HG23 VAL 6 2HG2 VAL 6 -4.328 -2.703 -14.934 54 H ALA 7 HN ALA 7 -5.923 -2.414 -18.934 55 HA ALA 7 HA ALA 7 -8.067 -1.222 -20.088 56 HB1 ALA 7 1HB ALA 7 -7.850 -3.384 -21.657 57 HB2 ALA 7 2HB ALA 7 -6.593 -2.124 -21.612 58 HB3 ALA 7 3HB ALA 7 -6.380 -3.627 -20.682 59 H ALA 8 HN ALA 8 -10.059 -1.235 -19.071 60 HA ALA 8 HA ALA 8 -11.135 -3.494 -17.810 61 HB1 ALA 8 1HB ALA 8 -12.791 -2.042 -17.244 62 HB2 ALA 8 2HB ALA 8 -11.695 -0.815 -17.925 63 HB3 ALA 8 3HB ALA 8 -13.011 -1.483 -18.920 64 H VAL 9 HN VAL 9 -10.631 -2.762 -21.129 65 HA VAL 9 HA VAL 9 -12.151 -5.094 -21.869 66 HB VAL 9 HB VAL 9 -13.391 -3.897 -23.640 67 HG11 VAL 9 1HG1 VAL 9 -15.168 -3.081 -22.220 68 HG12 VAL 9 2HG1 VAL 9 -14.418 -4.496 -21.443 69 HG13 VAL 9 3HG1 VAL 9 -14.039 -2.856 -20.863 70 HG21 VAL 9 3HG2 VAL 9 -12.421 -1.402 -22.205 71 HG22 VAL 9 1HG2 VAL 9 -12.012 -1.905 -23.863 72 HG23 VAL 9 2HG2 VAL 9 -13.683 -1.442 -23.460 73 H LEU 10 HN LEU 10 -11.815 -5.460 -24.364 74 HA LEU 10 HA LEU 10 -9.048 -5.493 -24.785 75 HB2 LEU 10 2HB LEU 10 -10.350 -7.205 -25.720 76 HB3 LEU 10 3HB LEU 10 -11.450 -6.081 -26.492 77 HG LEU 10 HG LEU 10 -9.187 -5.373 -27.763 78 HD11 LEU 10 1HD1 LEU 10 -8.594 -8.206 -27.981 79 HD12 LEU 10 2HD1 LEU 10 -7.506 -6.826 -27.699 80 HD13 LEU 10 3HD1 LEU 10 -8.330 -7.605 -26.327 81 HD21 LEU 10 3HD2 LEU 10 -10.341 -6.059 -29.537 82 HD22 LEU 10 1HD2 LEU 10 -10.269 -7.762 -29.024 83 HD23 LEU 10 2HD2 LEU 10 -11.548 -6.696 -28.394 84 H ILE 11 HN ILE 11 -7.879 -3.641 -24.965 85 HA ILE 11 HA ILE 11 -9.026 -1.499 -26.592 86 HB ILE 11 HB ILE 11 -6.538 -1.199 -24.972 87 HG12 ILE 11 2HG1 ILE 11 -9.308 -1.591 -23.871 88 HG13 ILE 11 3HG1 ILE 11 -7.785 -2.246 -23.303 89 HG21 ILE 11 1HG2 ILE 11 -8.841 0.722 -25.293 90 HG22 ILE 11 2HG2 ILE 11 -7.147 1.060 -24.861 91 HG23 ILE 11 3HG2 ILE 11 -7.561 0.566 -26.520 92 HD11 ILE 11 3HD1 ILE 11 -8.635 -0.417 -21.829 93 HD12 ILE 11 1HD1 ILE 11 -7.055 -0.015 -22.544 94 HD13 ILE 11 2HD1 ILE 11 -8.541 0.711 -23.203 95 HA PRO 12 HA PRO 12 -6.236 -2.987 -29.640 96 HB2 PRO 12 2HB PRO 12 -7.367 -1.683 -31.759 97 HB3 PRO 12 3HB PRO 12 -7.894 -3.264 -31.215 98 HG2 PRO 12 2HG PRO 12 -9.208 -0.642 -30.843 99 HG3 PRO 12 3HG PRO 12 -9.897 -2.246 -30.693 100 HD2 PRO 12 2HD PRO 12 -9.139 -0.498 -28.550 101 HD3 PRO 12 3HD PRO 12 -9.719 -2.145 -28.404 102 H ILE 13 HN ILE 13 -4.824 -1.974 -31.422 103 HA ILE 13 HA ILE 13 -3.386 0.070 -30.108 104 HB ILE 13 HB ILE 13 -2.278 -1.577 -31.448 105 HG12 ILE 13 2HG1 ILE 13 -1.973 1.011 -32.969 106 HG13 ILE 13 3HG1 ILE 13 -1.472 0.875 -31.296 107 HG21 ILE 13 1HG2 ILE 13 -2.518 -1.410 -33.998 108 HG22 ILE 13 2HG2 ILE 13 -3.808 -2.232 -33.089 109 HG23 ILE 13 3HG2 ILE 13 -4.050 -0.566 -33.667 110 HD11 ILE 13 3HD1 ILE 13 0.014 0.106 -33.567 111 HD12 ILE 13 1HD1 ILE 13 0.408 -0.255 -31.869 112 HD13 ILE 13 2HD1 ILE 13 -0.523 -1.425 -32.835 113 H ASN 14 HN ASN 14 -2.937 2.254 -30.955 114 HA ASN 14 HA ASN 14 -3.775 4.242 -31.334 115 HB2 ASN 14 2HB ASN 14 -4.699 2.958 -33.958 116 HB3 ASN 14 3HB ASN 14 -4.363 4.660 -33.713 117 HD21 ASN 14 1HD2 ASN 14 -3.137 3.201 -35.686 118 HD22 ASN 14 2HD2 ASN 14 -1.445 3.029 -35.360 119 H THR 15 HN THR 15 -5.586 3.039 -29.686 120 HA THR 15 HA THR 15 -8.197 3.637 -30.916 121 HB THR 15 HB THR 15 -7.399 1.489 -28.883 122 HG1 THR 15 HG1 THR 15 -7.000 0.915 -31.088 123 HG21 THR 15 3HG2 THR 15 -9.599 1.699 -28.204 124 HG22 THR 15 1HG2 THR 15 -10.034 2.686 -29.620 125 HG23 THR 15 2HG2 THR 15 -9.957 0.913 -29.761 126 H ALA 16 HN ALA 16 -9.171 5.381 -30.119 127 HA ALA 16 HA ALA 16 -8.125 6.926 -28.110 128 HB1 ALA 16 1HB ALA 16 -10.685 6.700 -29.597 129 HB2 ALA 16 2HB ALA 16 -10.782 7.561 -28.042 130 HB3 ALA 16 3HB ALA 16 -9.655 8.121 -29.301 131 H LEU 17 HN LEU 17 -8.132 6.877 -25.902 132 HA LEU 17 HA LEU 17 -9.385 4.581 -24.671 133 HB2 LEU 17 2HB LEU 17 -7.522 6.718 -23.633 134 HB3 LEU 17 3HB LEU 17 -8.165 5.416 -22.651 135 HG LEU 17 HG LEU 17 -6.503 4.973 -25.144 136 HD11 LEU 17 1HD1 LEU 17 -4.594 4.590 -23.727 137 HD12 LEU 17 2HD1 LEU 17 -5.244 6.215 -23.402 138 HD13 LEU 17 3HD1 LEU 17 -5.565 4.885 -22.265 139 HD21 LEU 17 3HD2 LEU 17 -6.160 2.718 -23.886 140 HD22 LEU 17 1HD2 LEU 17 -7.660 3.169 -23.040 141 HD23 LEU 17 2HD2 LEU 17 -7.655 2.997 -24.812 142 H THR 18 HN THR 18 -11.068 4.634 -23.170 143 HA THR 18 HA THR 18 -12.287 7.278 -22.741 144 HB THR 18 HB THR 18 -14.508 5.968 -22.988 145 HG1 THR 18 HG1 THR 18 -13.874 3.814 -23.026 146 HG21 THR 18 3HG2 THR 18 -13.669 7.398 -24.874 147 HG22 THR 18 1HG2 THR 18 -12.661 6.042 -25.433 148 HG23 THR 18 2HG2 THR 18 -14.435 5.909 -25.478 149 H VAL 19 HN VAL 19 -14.080 7.034 -20.943 150 HA VAL 19 HA VAL 19 -12.641 6.045 -18.666 151 HB VAL 19 HB VAL 19 -14.118 8.194 -19.018 152 HG11 VAL 19 1HG1 VAL 19 -16.174 6.951 -19.598 153 HG12 VAL 19 2HG1 VAL 19 -16.169 6.208 -17.980 154 HG13 VAL 19 3HG1 VAL 19 -16.388 7.966 -18.152 155 HG21 VAL 19 3HG2 VAL 19 -12.884 7.806 -16.999 156 HG22 VAL 19 1HG2 VAL 19 -14.553 8.221 -16.538 157 HG23 VAL 19 2HG2 VAL 19 -14.010 6.526 -16.487 158 H GLY 20 HN GLY 20 -14.858 4.762 -20.958 159 HA2 GLY 20 1HA GLY 20 -15.878 2.773 -19.040 160 HA3 GLY 20 2HA GLY 20 -16.553 3.149 -20.613 161 H MET 21 HN MET 21 -13.106 3.129 -20.693 162 HA MET 21 HA MET 21 -13.200 0.409 -21.747 163 HB2 MET 21 2HB MET 21 -11.966 2.973 -22.683 164 HB3 MET 21 3HB MET 21 -10.912 1.580 -22.821 165 HG2 MET 21 2HG MET 21 -13.309 0.566 -23.802 166 HG3 MET 21 3HG MET 21 -13.386 2.233 -24.337 167 HE1 MET 21 3HE MET 21 -9.742 2.323 -24.369 168 HE2 MET 21 1HE MET 21 -9.923 2.641 -26.111 169 HE3 MET 21 2HE MET 21 -11.049 3.383 -24.950 170 H MET 22 HN MET 22 -11.552 2.750 -19.639 171 HA MET 22 HA MET 22 -9.551 0.742 -19.016 172 HB2 MET 22 2HB MET 22 -9.843 3.720 -18.344 173 HB3 MET 22 3HB MET 22 -8.549 2.732 -17.697 174 HG2 MET 22 2HG MET 22 -7.637 2.306 -19.904 175 HG3 MET 22 3HG MET 22 -9.065 2.943 -20.696 176 HE1 MET 22 3HE MET 22 -9.909 5.474 -19.426 177 HE2 MET 22 1HE MET 22 -8.878 6.732 -20.147 178 HE3 MET 22 2HE MET 22 -9.522 5.420 -21.162 179 H THR 23 HN THR 23 -8.883 0.872 -16.500 180 HA THR 23 HA THR 23 -11.030 1.371 -14.693 181 HB THR 23 HB THR 23 -11.696 -0.808 -15.907 182 HG1 THR 23 HG1 THR 23 -12.431 -0.247 -13.746 183 HG21 THR 23 3HG2 THR 23 -10.130 -2.471 -16.016 184 HG22 THR 23 1HG2 THR 23 -9.000 -1.525 -15.016 185 HG23 THR 23 2HG2 THR 23 -10.210 -2.576 -14.241 186 H THR 24 HN THR 24 -10.418 0.525 -12.424 187 HA THR 24 HA THR 24 -7.492 0.784 -12.182 188 HB THR 24 HB THR 24 -8.001 1.929 -10.030 189 HG1 THR 24 HG1 THR 24 -9.996 1.301 -9.291 190 HG21 THR 24 3HG2 THR 24 -8.056 3.387 -12.076 191 HG22 THR 24 1HG2 THR 24 -9.777 2.989 -12.292 192 HG23 THR 24 2HG2 THR 24 -9.250 3.914 -10.866 193 H ARG 25 HN ARG 25 -6.382 -0.863 -11.332 194 HA ARG 25 HA ARG 25 -7.722 -2.552 -9.450 195 HB2 ARG 25 2HB ARG 25 -7.510 -3.325 -12.210 196 HB3 ARG 25 3HB ARG 25 -6.355 -4.305 -11.330 197 HG2 ARG 25 2HG ARG 25 -8.068 -5.629 -10.659 198 HG3 ARG 25 3HG ARG 25 -8.668 -4.295 -9.694 199 HD2 ARG 25 2HD ARG 25 -10.389 -3.868 -11.142 200 HD3 ARG 25 3HD ARG 25 -9.356 -3.997 -12.552 201 HE ARG 25 HE ARG 25 -9.553 -6.617 -11.803 202 HH11 ARG 25 2HH2 ARG 25 -12.031 -4.119 -12.220 203 HH12 ARG 25 1HH2 ARG 25 -13.271 -5.246 -12.659 204 HH22 ARG 25 HH1 ARG 25 -12.753 -7.585 -12.747 205 H VAL 26 HN VAL 26 -6.201 -3.718 -8.098 206 HA VAL 26 HA VAL 26 -3.579 -2.548 -8.113 207 HB VAL 26 HB VAL 26 -4.739 -4.691 -6.325 208 HG11 VAL 26 1HG1 VAL 26 -2.147 -3.696 -6.500 209 HG12 VAL 26 2HG1 VAL 26 -2.865 -2.779 -5.154 210 HG13 VAL 26 3HG1 VAL 26 -2.858 -4.558 -5.115 211 HG21 VAL 26 3HG2 VAL 26 -6.283 -2.947 -6.092 212 HG22 VAL 26 1HG2 VAL 26 -5.122 -2.652 -4.776 213 HG23 VAL 26 2HG2 VAL 26 -5.038 -1.688 -6.270 214 H VAL 27 HN VAL 27 -2.853 -3.365 -10.220 215 HA VAL 27 HA VAL 27 -2.272 -6.241 -10.163 216 HB VAL 27 HB VAL 27 -2.219 -6.190 -12.506 217 HG11 VAL 27 1HG1 VAL 27 -4.493 -5.848 -11.294 218 HG12 VAL 27 2HG1 VAL 27 -4.439 -4.213 -11.997 219 HG13 VAL 27 3HG1 VAL 27 -4.419 -5.640 -13.061 220 HG21 VAL 27 3HG2 VAL 27 -1.145 -4.461 -13.454 221 HG22 VAL 27 1HG2 VAL 27 -2.729 -3.647 -13.454 222 HG23 VAL 27 2HG2 VAL 27 -1.575 -3.350 -12.131 223 H SER 28 HN SER 28 -0.106 -6.908 -10.974 224 HA SER 28 HA SER 28 1.854 -4.800 -10.526 225 HB2 SER 28 2HB SER 28 1.582 -6.430 -8.563 226 HB3 SER 28 3HB SER 28 2.196 -7.687 -9.618 227 HG SER 28 HG SER 28 4.198 -6.929 -9.411 228 HA PRO 29 HA PRO 29 3.728 -4.507 -10.780 229 HB2 PRO 29 2HB PRO 29 5.150 -2.967 -12.534 230 HB3 PRO 29 3HB PRO 29 5.853 -4.304 -11.645 231 HG2 PRO 29 2HG PRO 29 5.087 -4.174 -14.497 232 HG3 PRO 29 3HG PRO 29 6.157 -5.309 -13.698 233 HD2 PRO 29 2HD PRO 29 3.456 -5.792 -14.533 234 HD3 PRO 29 3HD PRO 29 4.486 -6.887 -13.632 235 H THR 30 HN THR 30 3.200 -2.324 -10.264 236 HA THR 30 HA THR 30 0.698 -1.628 -11.440 237 HB THR 30 HB THR 30 0.810 0.198 -9.777 238 HG1 THR 30 HG1 THR 30 3.496 -0.770 -9.216 239 HG21 THR 30 3HG2 THR 30 1.232 -1.044 -7.725 240 HG22 THR 30 1HG2 THR 30 0.527 -2.199 -8.882 241 HG23 THR 30 2HG2 THR 30 2.281 -2.201 -8.578 242 H GLY 31 HN GLY 31 0.333 -0.602 -13.294 243 HA2 GLY 31 1HA GLY 31 2.554 0.846 -14.534 244 HA3 GLY 31 2HA GLY 31 1.072 0.312 -15.300 245 H ILE 32 HN ILE 32 0.416 2.312 -16.162 246 HA ILE 32 HA ILE 32 0.577 4.763 -15.055 247 HB ILE 32 HB ILE 32 -1.628 3.560 -16.726 248 HG12 ILE 32 2HG1 ILE 32 0.699 5.316 -17.549 249 HG13 ILE 32 3HG1 ILE 32 0.734 3.566 -17.619 250 HG21 ILE 32 1HG2 ILE 32 -2.236 5.680 -15.404 251 HG22 ILE 32 2HG2 ILE 32 -1.087 6.514 -16.478 252 HG23 ILE 32 3HG2 ILE 32 -2.502 5.680 -17.164 253 HD11 ILE 32 3HD1 ILE 32 -1.640 4.904 -18.875 254 HD12 ILE 32 1HD1 ILE 32 -0.076 5.077 -19.706 255 HD13 ILE 32 2HD1 ILE 32 -0.745 3.457 -19.395 256 HA PRO 33 HA PRO 33 -1.920 4.682 -11.526 257 HB2 PRO 33 2HB PRO 33 -2.100 7.363 -11.026 258 HB3 PRO 33 3HB PRO 33 -0.717 6.392 -10.561 259 HG2 PRO 33 2HG PRO 33 -0.959 8.325 -12.784 260 HG3 PRO 33 3HG PRO 33 0.492 7.677 -12.046 261 HD2 PRO 33 2HD PRO 33 -0.643 6.907 -14.565 262 HD3 PRO 33 3HD PRO 33 0.740 6.180 -13.773 263 H ALA 34 HN ALA 34 -4.033 4.815 -10.745 264 HA ALA 34 HA ALA 34 -5.933 4.946 -12.806 265 HB1 ALA 34 1HB ALA 34 -6.055 4.863 -9.777 266 HB2 ALA 34 2HB ALA 34 -7.526 4.921 -10.778 267 HB3 ALA 34 3HB ALA 34 -6.393 3.557 -10.939 268 H GLU 35 HN GLU 35 -4.246 7.400 -11.101 269 HA GLU 35 HA GLU 35 -6.389 9.272 -11.108 270 HB2 GLU 35 2HB GLU 35 -4.799 10.817 -10.182 271 HB3 GLU 35 3HB GLU 35 -4.459 9.259 -9.456 272 HG2 GLU 35 2HG GLU 35 -2.853 9.144 -11.700 273 HG3 GLU 35 3HG GLU 35 -2.817 10.863 -11.360 274 HE2 GLU 35 HE2 GLU 35 -1.685 8.705 -8.179 275 H ASP 36 HN ASP 36 -4.378 7.942 -13.498 276 HA ASP 36 HA ASP 36 -4.357 10.402 -15.032 277 HB2 ASP 36 2HB ASP 36 -2.890 7.768 -15.166 278 HB3 ASP 36 3HB ASP 36 -3.091 8.664 -16.658 279 HD2 ASP 36 HD2 ASP 36 -2.575 9.942 -13.533 280 H ILE 37 HN ILE 37 -6.397 7.847 -14.383 281 HA ILE 37 HA ILE 37 -7.096 6.737 -16.798 282 HB ILE 37 HB ILE 37 -8.336 7.128 -14.157 283 HG12 ILE 37 2HG1 ILE 37 -7.834 4.851 -16.068 284 HG13 ILE 37 3HG1 ILE 37 -7.151 5.123 -14.477 285 HG21 ILE 37 1HG2 ILE 37 -10.554 6.397 -14.844 286 HG22 ILE 37 2HG2 ILE 37 -10.145 7.958 -15.595 287 HG23 ILE 37 3HG2 ILE 37 -10.067 6.460 -16.554 288 HD11 ILE 37 3HD1 ILE 37 -8.821 3.398 -14.233 289 HD12 ILE 37 1HD1 ILE 37 -9.510 4.876 -13.519 290 HD13 ILE 37 2HD1 ILE 37 -10.023 4.348 -15.140 291 HA PRO 38 HA PRO 38 -9.900 10.491 -17.445 292 HB2 PRO 38 2HB PRO 38 -9.579 12.714 -15.889 293 HB3 PRO 38 3HB PRO 38 -10.785 11.485 -15.567 294 HG2 PRO 38 2HG PRO 38 -8.231 11.986 -14.166 295 HG3 PRO 38 3HG PRO 38 -9.622 11.071 -13.619 296 HD2 PRO 38 2HD PRO 38 -7.151 10.008 -14.613 297 HD3 PRO 38 3HD PRO 38 -8.583 9.098 -14.176 298 H ARG 39 HN ARG 39 -6.608 10.481 -17.045 299 HA ARG 39 HA ARG 39 -6.319 12.831 -18.699 300 HB2 ARG 39 2HB ARG 39 -4.178 11.058 -17.417 301 HB3 ARG 39 3HB ARG 39 -3.883 12.589 -18.218 302 HG2 ARG 39 2HG ARG 39 -5.344 13.740 -16.529 303 HG3 ARG 39 3HG ARG 39 -5.602 12.207 -15.720 304 HD2 ARG 39 2HD ARG 39 -3.810 13.500 -14.592 305 HD3 ARG 39 3HD ARG 39 -3.170 12.009 -15.253 306 HE ARG 39 HE ARG 39 -2.620 14.744 -16.228 307 HH11 ARG 39 2HH2 ARG 39 -2.325 11.268 -16.847 308 HH12 ARG 39 1HH2 ARG 39 -1.040 11.455 -17.993 309 HH22 ARG 39 HH1 ARG 39 -0.233 13.653 -18.503 310 H LEU 40 HN LEU 40 -6.479 9.369 -18.863 311 HA LEU 40 HA LEU 40 -4.865 9.184 -21.256 312 HB2 LEU 40 2HB LEU 40 -6.477 7.131 -19.735 313 HB3 LEU 40 3HB LEU 40 -5.482 6.790 -21.136 314 HG LEU 40 HG LEU 40 -4.247 8.102 -18.732 315 HD11 LEU 40 1HD1 LEU 40 -3.859 5.263 -18.611 316 HD12 LEU 40 2HD1 LEU 40 -4.529 6.366 -17.385 317 HD13 LEU 40 3HD1 LEU 40 -5.602 5.622 -18.594 318 HD21 LEU 40 3HD2 LEU 40 -2.225 7.191 -19.526 319 HD22 LEU 40 1HD2 LEU 40 -3.062 6.059 -20.615 320 HD23 LEU 40 2HD2 LEU 40 -3.068 7.803 -20.969 321 H ILE 41 HN ILE 41 -8.189 9.724 -20.287 322 HA ILE 41 HA ILE 41 -9.525 8.694 -22.479 323 HB ILE 41 HB ILE 41 -10.179 11.162 -20.866 324 HG12 ILE 41 2HG1 ILE 41 -10.422 8.235 -20.282 325 HG13 ILE 41 3HG1 ILE 41 -9.956 9.552 -19.225 326 HG21 ILE 41 1HG2 ILE 41 -11.482 10.943 -22.948 327 HG22 ILE 41 2HG2 ILE 41 -11.998 9.318 -22.438 328 HG23 ILE 41 3HG2 ILE 41 -12.484 10.744 -21.490 329 HD11 ILE 41 3HD1 ILE 41 -12.294 10.404 -19.224 330 HD12 ILE 41 1HD1 ILE 41 -12.771 9.077 -20.310 331 HD13 ILE 41 2HD1 ILE 41 -12.219 8.719 -18.657 332 H SER 42 HN SER 42 -9.913 9.374 -24.568 333 HA SER 42 HA SER 42 -9.917 10.718 -26.318 334 HB2 SER 42 2HB SER 42 -9.831 12.663 -24.499 335 HB3 SER 42 3HB SER 42 -8.168 12.817 -25.030 336 HG SER 42 HG SER 42 -10.566 13.092 -26.618 337 H MET 43 HN MET 43 -7.266 9.530 -24.530 338 HA MET 43 HA MET 43 -5.387 10.088 -26.667 339 HB2 MET 43 2HB MET 43 -4.870 8.596 -24.045 340 HB3 MET 43 3HB MET 43 -3.684 9.391 -25.062 341 HG2 MET 43 2HG MET 43 -5.326 11.519 -24.534 342 HG3 MET 43 3HG MET 43 -5.586 10.583 -23.076 343 HE1 MET 43 3HE MET 43 -1.910 9.400 -23.549 344 HE2 MET 43 1HE MET 43 -2.082 9.849 -21.835 345 HE3 MET 43 2HE MET 43 -3.404 8.997 -22.669 346 H GLN 44 HN GLN 44 -4.587 8.504 -28.048 347 HA GLN 44 HA GLN 44 -5.941 5.960 -27.848 348 HB2 GLN 44 2HB GLN 44 -4.181 7.034 -30.095 349 HB3 GLN 44 3HB GLN 44 -5.216 5.621 -30.173 350 HG2 GLN 44 2HG GLN 44 -7.228 6.992 -29.915 351 HG3 GLN 44 3HG GLN 44 -6.272 8.423 -29.580 352 HE21 GLN 44 1HE2 GLN 44 -6.778 5.890 -32.016 353 HE22 GLN 44 2HE2 GLN 44 -6.524 6.873 -33.419 354 H VAL 45 HN VAL 45 -4.783 3.912 -27.956 355 HA VAL 45 HA VAL 45 -2.262 4.064 -26.569 356 HB VAL 45 HB VAL 45 -2.530 1.547 -26.622 357 HG11 VAL 45 1HG1 VAL 45 -4.886 3.016 -25.405 358 HG12 VAL 45 2HG1 VAL 45 -4.087 1.539 -24.815 359 HG13 VAL 45 3HG1 VAL 45 -3.234 3.100 -24.748 360 HG21 VAL 45 3HG2 VAL 45 -5.407 1.899 -27.312 361 HG22 VAL 45 1HG2 VAL 45 -4.243 1.909 -28.658 362 HG23 VAL 45 2HG2 VAL 45 -4.326 0.508 -27.563 363 H ASN 46 HN ASN 46 -0.317 2.907 -27.316 364 HA ASN 46 HA ASN 46 -0.155 3.105 -30.211 365 HB2 ASN 46 2HB ASN 46 2.296 3.330 -29.862 366 HB3 ASN 46 3HB ASN 46 1.437 4.519 -28.902 367 HD21 ASN 46 1HD2 ASN 46 2.334 4.795 -27.019 368 HD22 ASN 46 2HD2 ASN 46 2.995 3.581 -25.975 369 H GLN 47 HN GLN 47 -1.339 0.785 -28.802 370 HA GLN 47 HA GLN 47 -0.025 -1.253 -30.102 371 HB2 GLN 47 2HB GLN 47 1.775 -1.300 -28.590 372 HB3 GLN 47 3HB GLN 47 0.775 -0.873 -27.216 373 HG2 GLN 47 2HG GLN 47 -0.280 -3.098 -27.223 374 HG3 GLN 47 3HG GLN 47 0.552 -3.531 -28.703 375 HE21 GLN 47 1HE2 GLN 47 1.641 -1.830 -25.774 376 HE22 GLN 47 2HE2 GLN 47 2.926 -2.912 -25.353 377 H VAL 48 HN VAL 48 -1.102 -3.384 -29.716 378 HA VAL 48 HA VAL 48 -3.850 -2.958 -29.055 379 HB VAL 48 HB VAL 48 -2.168 -5.180 -30.140 380 HG11 VAL 48 1HG1 VAL 48 -3.406 -6.632 -28.889 381 HG12 VAL 48 2HG1 VAL 48 -4.754 -5.487 -28.688 382 HG13 VAL 48 3HG1 VAL 48 -4.566 -6.381 -30.216 383 HG21 VAL 48 3HG2 VAL 48 -4.747 -3.921 -31.129 384 HG22 VAL 48 1HG2 VAL 48 -3.114 -3.399 -31.607 385 HG23 VAL 48 2HG2 VAL 48 -3.682 -5.034 -32.020 386 H VAL 49 HN VAL 49 -4.146 -2.541 -26.871 387 HA VAL 49 HA VAL 49 -2.892 -4.379 -24.988 388 HB VAL 49 HB VAL 49 -4.446 -1.811 -24.615 389 HG11 VAL 49 1HG1 VAL 49 -3.286 -2.032 -22.270 390 HG12 VAL 49 2HG1 VAL 49 -4.810 -2.890 -22.600 391 HG13 VAL 49 3HG1 VAL 49 -3.263 -3.767 -22.664 392 HG21 VAL 49 3HG2 VAL 49 -1.816 -1.511 -23.689 393 HG22 VAL 49 1HG2 VAL 49 -1.666 -2.371 -25.240 394 HG23 VAL 49 2HG2 VAL 49 -2.525 -0.814 -25.166 395 HA PRO 50 HA PRO 50 -6.699 -6.539 -24.958 396 HB2 PRO 50 2HB PRO 50 -5.858 -8.670 -23.467 397 HB3 PRO 50 3HB PRO 50 -5.664 -8.580 -25.207 398 HG2 PRO 50 2HG PRO 50 -3.627 -8.229 -23.093 399 HG3 PRO 50 3HG PRO 50 -3.394 -8.565 -24.797 400 HD2 PRO 50 2HD PRO 50 -3.041 -6.041 -23.481 401 HD3 PRO 50 3HD PRO 50 -2.921 -6.352 -25.202 402 H MET 51 HN MET 51 -8.356 -7.318 -23.430 403 HA MET 51 HA MET 51 -8.591 -5.399 -21.421 404 HB2 MET 51 2HB MET 51 -10.539 -6.479 -22.515 405 HB3 MET 51 3HB MET 51 -10.036 -8.055 -21.938 406 HG2 MET 51 2HG MET 51 -10.374 -7.313 -19.577 407 HG3 MET 51 3HG MET 51 -10.843 -5.720 -20.136 408 HE1 MET 51 3HE MET 51 -12.673 -9.468 -21.691 409 HE2 MET 51 1HE MET 51 -11.166 -9.299 -20.759 410 HE3 MET 51 2HE MET 51 -12.701 -9.616 -19.917 411 H GLY 52 HN GLY 52 -7.621 -5.325 -19.444 412 HA2 GLY 52 1HA GLY 52 -7.353 -6.371 -17.311 413 HA3 GLY 52 2HA GLY 52 -7.029 -7.894 -18.114 414 H THR 53 HN THR 53 -5.459 -6.006 -20.194 415 HA THR 53 HA THR 53 -2.913 -6.471 -18.945 416 HB THR 53 HB THR 53 -3.911 -5.407 -21.624 417 HG1 THR 53 HG1 THR 53 -3.805 -7.761 -20.840 418 HG21 THR 53 3HG2 THR 53 -1.453 -5.647 -22.311 419 HG22 THR 53 1HG2 THR 53 -1.795 -4.227 -21.294 420 HG23 THR 53 2HG2 THR 53 -1.046 -5.675 -20.579 421 H THR 54 HN THR 54 -1.927 -5.166 -17.549 422 HA THR 54 HA THR 54 -2.889 -2.718 -16.758 423 HB THR 54 HB THR 54 0.068 -3.440 -16.733 424 HG1 THR 54 HG1 THR 54 -2.178 -4.515 -15.175 425 HG21 THR 54 3HG2 THR 54 -0.296 -2.807 -14.275 426 HG22 THR 54 1HG2 THR 54 -0.497 -1.459 -15.419 427 HG23 THR 54 2HG2 THR 54 -1.928 -2.264 -14.733 428 H LEU 55 HN LEU 55 -2.606 -0.582 -17.285 429 HA LEU 55 HA LEU 55 -1.644 -0.156 -19.981 430 HB2 LEU 55 2HB LEU 55 -3.807 0.752 -18.719 431 HB3 LEU 55 3HB LEU 55 -2.705 2.039 -18.272 432 HG LEU 55 HG LEU 55 -2.327 2.645 -20.553 433 HD11 LEU 55 1HD1 LEU 55 -2.151 0.890 -21.955 434 HD12 LEU 55 2HD1 LEU 55 -3.405 -0.053 -21.114 435 HD13 LEU 55 3HD1 LEU 55 -3.872 1.227 -22.260 436 HD21 LEU 55 3HD2 LEU 55 -4.272 3.682 -19.757 437 HD22 LEU 55 1HD2 LEU 55 -4.728 3.029 -21.350 438 HD23 LEU 55 2HD2 LEU 55 -5.227 2.184 -19.865 439 H MET 56 HN MET 56 0.241 0.862 -20.540 440 HA MET 56 HA MET 56 1.881 1.689 -18.276 441 HB2 MET 56 2HB MET 56 2.563 0.656 -21.081 442 HB3 MET 56 3HB MET 56 3.780 1.326 -20.012 443 HG2 MET 56 2HG MET 56 1.983 -0.862 -18.949 444 HG3 MET 56 3HG MET 56 3.274 -1.304 -20.048 445 HE1 MET 56 3HE MET 56 2.594 0.667 -16.545 446 HE2 MET 56 1HE MET 56 2.207 -1.060 -16.739 447 HE3 MET 56 2HE MET 56 3.555 -0.563 -15.689 448 HA PRO 57 HA PRO 57 2.111 5.701 -19.913 449 HB2 PRO 57 2HB PRO 57 4.606 6.540 -19.176 450 HB3 PRO 57 3HB PRO 57 3.244 6.498 -18.073 451 HG2 PRO 57 2HG PRO 57 5.558 4.665 -18.232 452 HG3 PRO 57 3HG PRO 57 4.434 4.901 -16.909 453 HD2 PRO 57 2HD PRO 57 4.467 2.711 -18.761 454 HD3 PRO 57 3HD PRO 57 3.275 3.009 -17.511 455 H ASP 58 HN ASP 58 4.245 3.338 -21.054 456 HA ASP 58 HA ASP 58 5.031 5.114 -23.210 457 HB2 ASP 58 2HB ASP 58 6.734 3.697 -21.905 458 HB3 ASP 58 3HB ASP 58 6.002 2.280 -22.630 459 HD2 ASP 58 HD2 ASP 58 7.292 4.286 -25.697 460 H MET 59 HN MET 59 2.438 3.292 -22.492 461 HA MET 59 HA MET 59 2.358 1.958 -25.084 462 HB2 MET 59 2HB MET 59 1.204 1.380 -22.349 463 HB3 MET 59 3HB MET 59 0.242 0.888 -23.729 464 HG2 MET 59 2HG MET 59 2.557 -0.145 -24.587 465 HG3 MET 59 3HG MET 59 2.982 -0.081 -22.888 466 HE1 MET 59 3HE MET 59 -0.411 -1.896 -21.542 467 HE2 MET 59 1HE MET 59 0.957 -0.880 -21.028 468 HE3 MET 59 2HE MET 59 -0.311 -0.200 -22.075 469 H VAL 60 HN VAL 60 1.661 4.874 -24.002 470 HA VAL 60 HA VAL 60 -0.880 4.979 -25.453 471 HB VAL 60 HB VAL 60 -0.269 6.475 -22.898 472 HG11 VAL 60 1HG1 VAL 60 -1.759 7.644 -24.509 473 HG12 VAL 60 2HG1 VAL 60 -2.860 6.246 -24.465 474 HG13 VAL 60 3HG1 VAL 60 -2.580 7.206 -22.992 475 HG21 VAL 60 3HG2 VAL 60 -0.676 4.424 -21.989 476 HG22 VAL 60 1HG2 VAL 60 -2.364 4.937 -22.224 477 HG23 VAL 60 2HG2 VAL 60 -1.591 3.852 -23.404 478 H LYS 61 HN LYS 61 -1.003 6.635 -26.939 479 HA LYS 61 HA LYS 61 1.445 8.104 -27.351 480 HB2 LYS 61 2HB LYS 61 -1.124 7.986 -28.960 481 HB3 LYS 61 3HB LYS 61 0.343 8.808 -29.452 482 HG2 LYS 61 2HG LYS 61 1.535 6.512 -29.092 483 HG3 LYS 61 3HG LYS 61 -0.075 5.821 -29.047 484 HD2 LYS 61 2HD LYS 61 -0.054 7.547 -31.313 485 HD3 LYS 61 3HD LYS 61 1.482 6.706 -31.356 486 HE2 LYS 61 2HE LYS 61 -0.849 4.966 -30.704 487 HE3 LYS 61 3HE LYS 61 -0.903 5.673 -32.307 488 HZ1 LYS 61 2HZ LYS 61 1.601 4.859 -32.314 489 HZ3 LYS 61 1HZ LYS 61 0.397 3.837 -32.710 490 H GLY 62 HN GLY 62 1.567 10.433 -27.501 491 HA2 GLY 62 1HA GLY 62 1.207 12.502 -26.701 492 HA3 GLY 62 2HA GLY 62 -0.500 12.199 -26.961 493 H TYR 63 HN TYR 63 1.099 9.932 -24.833 494 HA TYR 63 HA TYR 63 -0.482 10.884 -22.629 495 HB2 TYR 63 2HB TYR 63 -0.221 8.477 -23.008 496 HB3 TYR 63 3HB TYR 63 1.505 8.637 -23.265 497 HD1 TYR 63 HD2 TYR 63 3.047 8.894 -21.353 498 HD2 TYR 63 HD1 TYR 63 -1.154 8.334 -20.767 499 HE1 TYR 63 HE2 TYR 63 3.458 8.304 -18.914 500 HE2 TYR 63 HE1 TYR 63 -0.728 7.745 -18.330 501 HH TYR 63 HH TYR 63 1.400 8.475 -16.649 502 H ALA 64 HN ALA 64 0.698 10.821 -20.359 503 HA ALA 64 HA ALA 64 3.337 11.403 -20.031 504 HB1 ALA 64 1HB ALA 64 2.592 14.093 -19.737 505 HB2 ALA 64 2HB ALA 64 3.643 13.412 -21.002 506 HB3 ALA 64 3HB ALA 64 1.899 13.604 -21.302 507 HA PRO 65 HA PRO 65 1.727 11.380 -16.016 508 HB2 PRO 65 2HB PRO 65 3.920 12.124 -14.564 509 HB3 PRO 65 3HB PRO 65 3.674 10.496 -15.163 510 HG2 PRO 65 2HG PRO 65 5.509 12.583 -16.169 511 HG3 PRO 65 3HG PRO 65 5.546 10.856 -16.462 512 HD2 PRO 65 2HD PRO 65 4.634 12.884 -18.274 513 HD3 PRO 65 3HD PRO 65 4.564 11.150 -18.519 514 H ALA 66 HN ALA 66 1.045 12.598 -14.131 515 HA ALA 66 HA ALA 66 1.435 15.463 -14.477 516 HB1 ALA 66 1HB ALA 66 -0.582 15.033 -15.759 517 HB2 ALA 66 2HB ALA 66 -1.266 14.060 -14.434 518 HB3 ALA 66 3HB ALA 66 -1.040 15.813 -14.226 Start of MODEL 14 1 H1 MET 0 HN MET 0 4.009 -0.540 -0.864 2 HA MET 0 HA MET 0 1.443 -0.512 0.105 3 HB2 MET 0 2HB MET 0 3.047 1.096 -1.899 4 HB3 MET 0 3HB MET 0 1.324 1.402 -1.825 5 HG2 MET 0 2HG MET 0 2.686 2.898 -0.303 6 HG3 MET 0 3HG MET 0 1.441 1.994 0.535 7 HE1 MET 0 3HE MET 0 2.789 2.598 2.753 8 HE2 MET 0 1HE MET 0 1.948 1.029 2.735 9 HE3 MET 0 2HE MET 0 3.584 1.155 3.426 10 H ASN 1 HN ASN 1 -0.457 0.243 -1.620 11 HA ASN 1 HA ASN 1 -0.443 -1.706 -3.768 12 HB2 ASN 1 2HB ASN 1 -2.740 -1.289 -1.782 13 HB3 ASN 1 3HB ASN 1 -2.819 -2.321 -3.197 14 HD21 ASN 1 1HD2 ASN 1 -3.072 -2.901 -0.322 15 HD22 ASN 1 2HD2 ASN 1 -1.918 -4.139 0.047 16 H GLN 2 HN GLN 2 -0.300 0.013 -5.330 17 HA GLN 2 HA GLN 2 -2.373 2.043 -5.133 18 HB2 GLN 2 2HB GLN 2 -0.983 3.335 -6.736 19 HB3 GLN 2 3HB GLN 2 -0.085 2.916 -5.290 20 HG2 GLN 2 2HG GLN 2 1.455 1.786 -6.511 21 HG3 GLN 2 3HG GLN 2 0.214 0.765 -7.209 22 HE21 GLN 2 1HE2 GLN 2 -1.342 2.593 -8.547 23 HE22 GLN 2 2HE2 GLN 2 -0.465 3.293 -9.866 24 H GLU 3 HN GLU 3 -4.043 2.118 -6.608 25 HA GLU 3 HA GLU 3 -4.405 -0.081 -8.283 26 HB2 GLU 3 2HB GLU 3 -5.858 2.434 -7.629 27 HB3 GLU 3 3HB GLU 3 -6.222 1.768 -9.208 28 HG2 GLU 3 2HG GLU 3 -6.742 -0.441 -8.168 29 HG3 GLU 3 3HG GLU 3 -6.350 0.203 -6.586 30 HE2 GLU 3 HE2 GLU 3 -9.359 0.062 -6.291 31 H SER 4 HN SER 4 -4.002 -0.408 -10.467 32 HA SER 4 HA SER 4 -2.796 1.870 -11.834 33 HB2 SER 4 2HB SER 4 -2.164 -0.959 -12.654 34 HB3 SER 4 3HB SER 4 -1.177 0.482 -12.801 35 HG SER 4 HG SER 4 -1.433 -1.314 -10.650 36 H VAL 5 HN VAL 5 -3.372 2.185 -14.068 37 HA VAL 5 HA VAL 5 -5.976 1.569 -14.736 38 HB VAL 5 HB VAL 5 -3.589 2.348 -16.415 39 HG11 VAL 5 1HG1 VAL 5 -5.102 2.933 -18.203 40 HG12 VAL 5 2HG1 VAL 5 -5.359 1.224 -17.777 41 HG13 VAL 5 3HG1 VAL 5 -6.513 2.463 -17.224 42 HG21 VAL 5 3HG2 VAL 5 -3.935 4.427 -15.682 43 HG22 VAL 5 1HG2 VAL 5 -5.660 4.346 -16.113 44 HG23 VAL 5 2HG2 VAL 5 -5.113 3.769 -14.520 45 H VAL 6 HN VAL 6 -6.995 -0.090 -15.828 46 HA VAL 6 HA VAL 6 -5.294 -2.151 -16.998 47 HB VAL 6 HB VAL 6 -7.335 -2.545 -14.810 48 HG11 VAL 6 1HG1 VAL 6 -7.881 -4.557 -15.600 49 HG12 VAL 6 2HG1 VAL 6 -6.934 -4.218 -17.068 50 HG13 VAL 6 3HG1 VAL 6 -6.166 -5.024 -15.679 51 HG21 VAL 6 3HG2 VAL 6 -4.375 -2.864 -15.073 52 HG22 VAL 6 1HG2 VAL 6 -5.351 -2.297 -13.697 53 HG23 VAL 6 2HG2 VAL 6 -5.253 -4.036 -14.061 54 H ALA 7 HN ALA 7 -5.981 -2.468 -19.046 55 HA ALA 7 HA ALA 7 -8.126 -1.261 -20.187 56 HB1 ALA 7 1HB ALA 7 -7.915 -3.431 -21.759 57 HB2 ALA 7 2HB ALA 7 -6.675 -2.154 -21.731 58 HB3 ALA 7 3HB ALA 7 -6.432 -3.651 -20.799 59 H ALA 8 HN ALA 8 -10.118 -1.276 -19.173 60 HA ALA 8 HA ALA 8 -11.194 -3.535 -17.913 61 HB1 ALA 8 1HB ALA 8 -11.751 -0.869 -17.992 62 HB2 ALA 8 2HB ALA 8 -13.045 -1.497 -19.041 63 HB3 ALA 8 3HB ALA 8 -12.882 -2.097 -17.373 64 H VAL 9 HN VAL 9 -10.687 -2.808 -21.232 65 HA VAL 9 HA VAL 9 -12.196 -5.143 -21.973 66 HB VAL 9 HB VAL 9 -13.436 -3.933 -23.753 67 HG11 VAL 9 1HG1 VAL 9 -14.139 -2.982 -20.957 68 HG12 VAL 9 2HG1 VAL 9 -15.246 -3.206 -22.332 69 HG13 VAL 9 3HG1 VAL 9 -14.466 -4.618 -21.578 70 HG21 VAL 9 3HG2 VAL 9 -13.803 -1.467 -23.411 71 HG22 VAL 9 1HG2 VAL 9 -12.445 -1.485 -22.259 72 HG23 VAL 9 2HG2 VAL 9 -12.170 -1.906 -23.967 73 H LEU 10 HN LEU 10 -11.883 -5.470 -24.489 74 HA LEU 10 HA LEU 10 -9.116 -5.500 -24.920 75 HB2 LEU 10 2HB LEU 10 -10.382 -7.202 -25.888 76 HB3 LEU 10 3HB LEU 10 -11.537 -6.088 -26.592 77 HG LEU 10 HG LEU 10 -9.344 -5.285 -27.923 78 HD11 LEU 10 1HD1 LEU 10 -8.332 -7.685 -28.573 79 HD12 LEU 10 2HD1 LEU 10 -7.628 -6.632 -27.322 80 HD13 LEU 10 3HD1 LEU 10 -8.694 -7.978 -26.855 81 HD21 LEU 10 3HD2 LEU 10 -10.273 -7.582 -29.333 82 HD22 LEU 10 1HD2 LEU 10 -11.650 -6.866 -28.463 83 HD23 LEU 10 2HD2 LEU 10 -10.690 -5.870 -29.583 84 H ILE 11 HN ILE 11 -7.945 -3.649 -25.082 85 HA ILE 11 HA ILE 11 -9.099 -1.481 -26.671 86 HB ILE 11 HB ILE 11 -6.603 -1.213 -25.055 87 HG12 ILE 11 2HG1 ILE 11 -9.370 -1.623 -23.960 88 HG13 ILE 11 3HG1 ILE 11 -7.841 -2.259 -23.387 89 HG21 ILE 11 1HG2 ILE 11 -8.879 0.741 -25.300 90 HG22 ILE 11 2HG2 ILE 11 -7.158 1.043 -24.957 91 HG23 ILE 11 3HG2 ILE 11 -7.669 0.567 -26.594 92 HD11 ILE 11 3HD1 ILE 11 -7.144 -0.015 -22.625 93 HD12 ILE 11 1HD1 ILE 11 -8.643 0.686 -23.280 94 HD13 ILE 11 2HD1 ILE 11 -8.715 -0.447 -21.909 95 HA PRO 12 HA PRO 12 -6.327 -2.928 -29.756 96 HB2 PRO 12 2HB PRO 12 -7.467 -1.591 -31.850 97 HB3 PRO 12 3HB PRO 12 -7.993 -3.179 -31.326 98 HG2 PRO 12 2HG PRO 12 -9.301 -0.561 -30.908 99 HG3 PRO 12 3HG PRO 12 -9.992 -2.166 -30.779 100 HD2 PRO 12 2HD PRO 12 -9.220 -0.451 -28.613 101 HD3 PRO 12 3HD PRO 12 -9.802 -2.099 -28.489 102 H ILE 13 HN ILE 13 -4.931 -1.884 -31.538 103 HA ILE 13 HA ILE 13 -3.474 0.131 -30.200 104 HB ILE 13 HB ILE 13 -2.381 -1.488 -31.583 105 HG12 ILE 13 2HG1 ILE 13 -2.103 1.130 -33.060 106 HG13 ILE 13 3HG1 ILE 13 -1.569 0.956 -31.400 107 HG21 ILE 13 1HG2 ILE 13 -2.823 -0.840 -34.225 108 HG22 ILE 13 2HG2 ILE 13 -3.495 -2.246 -33.363 109 HG23 ILE 13 3HG2 ILE 13 -4.454 -0.754 -33.515 110 HD11 ILE 13 3HD1 ILE 13 -0.640 -1.318 -32.964 111 HD12 ILE 13 1HD1 ILE 13 -0.154 0.207 -33.742 112 HD13 ILE 13 2HD1 ILE 13 0.312 -0.119 -32.056 113 H ASN 14 HN ASN 14 -3.043 2.334 -30.983 114 HA ASN 14 HA ASN 14 -3.873 4.329 -31.322 115 HB2 ASN 14 2HB ASN 14 -4.308 2.833 -33.914 116 HB3 ASN 14 3HB ASN 14 -4.965 4.454 -33.800 117 HD21 ASN 14 1HD2 ASN 14 -2.556 2.962 -35.101 118 HD22 ASN 14 2HD2 ASN 14 -1.224 4.047 -34.880 119 H THR 15 HN THR 15 -5.666 3.083 -29.677 120 HA THR 15 HA THR 15 -8.293 3.708 -30.860 121 HB THR 15 HB THR 15 -7.497 1.555 -28.829 122 HG1 THR 15 HG1 THR 15 -7.016 1.012 -31.036 123 HG21 THR 15 3HG2 THR 15 -10.085 2.788 -29.468 124 HG22 THR 15 1HG2 THR 15 -10.062 1.072 -29.938 125 HG23 THR 15 2HG2 THR 15 -9.713 1.538 -28.257 126 H ALA 16 HN ALA 16 -9.204 5.479 -30.051 127 HA ALA 16 HA ALA 16 -8.143 6.974 -28.019 128 HB1 ALA 16 1HB ALA 16 -11.033 7.245 -28.143 129 HB2 ALA 16 2HB ALA 16 -9.770 8.360 -28.715 130 HB3 ALA 16 3HB ALA 16 -10.352 7.055 -29.776 131 H LEU 17 HN LEU 17 -8.095 6.842 -25.822 132 HA LEU 17 HA LEU 17 -9.374 4.560 -24.617 133 HB2 LEU 17 2HB LEU 17 -7.515 6.693 -23.565 134 HB3 LEU 17 3HB LEU 17 -8.172 5.403 -22.577 135 HG LEU 17 HG LEU 17 -6.499 4.933 -25.058 136 HD11 LEU 17 1HD1 LEU 17 -5.302 6.186 -23.222 137 HD12 LEU 17 2HD1 LEU 17 -5.542 4.751 -22.195 138 HD13 LEU 17 3HD1 LEU 17 -4.585 4.625 -23.691 139 HD21 LEU 17 3HD2 LEU 17 -7.785 3.005 -24.650 140 HD22 LEU 17 1HD2 LEU 17 -6.192 2.669 -23.932 141 HD23 LEU 17 2HD2 LEU 17 -7.561 3.121 -22.888 142 H THR 18 HN THR 18 -11.097 4.573 -23.178 143 HA THR 18 HA THR 18 -12.310 7.207 -22.674 144 HB THR 18 HB THR 18 -14.526 5.803 -22.967 145 HG1 THR 18 HG1 THR 18 -13.889 4.084 -24.667 146 HG21 THR 18 3HG2 THR 18 -13.767 7.531 -24.649 147 HG22 THR 18 1HG2 THR 18 -12.755 6.287 -25.421 148 HG23 THR 18 2HG2 THR 18 -14.527 6.120 -25.422 149 H VAL 19 HN VAL 19 -14.018 7.042 -20.872 150 HA VAL 19 HA VAL 19 -12.669 5.898 -18.633 151 HB VAL 19 HB VAL 19 -14.024 8.098 -18.866 152 HG11 VAL 19 1HG1 VAL 19 -16.319 8.075 -18.576 153 HG12 VAL 19 2HG1 VAL 19 -16.084 6.645 -19.610 154 HG13 VAL 19 3HG1 VAL 19 -16.323 6.447 -17.857 155 HG21 VAL 19 3HG2 VAL 19 -13.638 6.254 -16.606 156 HG22 VAL 19 1HG2 VAL 19 -13.285 7.993 -16.744 157 HG23 VAL 19 2HG2 VAL 19 -14.934 7.448 -16.352 158 H GLY 20 HN GLY 20 -14.874 4.732 -20.992 159 HA2 GLY 20 1HA GLY 20 -15.980 2.716 -19.152 160 HA3 GLY 20 2HA GLY 20 -16.603 3.144 -20.733 161 H MET 21 HN MET 21 -13.155 3.050 -20.719 162 HA MET 21 HA MET 21 -13.271 0.341 -21.802 163 HB2 MET 21 2HB MET 21 -12.009 2.897 -22.735 164 HB3 MET 21 3HB MET 21 -10.982 1.485 -22.887 165 HG2 MET 21 2HG MET 21 -13.331 0.467 -23.883 166 HG3 MET 21 3HG MET 21 -13.519 2.151 -24.331 167 HE1 MET 21 3HE MET 21 -9.969 2.735 -26.039 168 HE2 MET 21 1HE MET 21 -11.095 3.397 -24.830 169 HE3 MET 21 2HE MET 21 -9.831 2.247 -24.333 170 H MET 22 HN MET 22 -11.562 2.701 -19.746 171 HA MET 22 HA MET 22 -9.587 0.679 -19.104 172 HB2 MET 22 2HB MET 22 -9.871 3.662 -18.457 173 HB3 MET 22 3HB MET 22 -8.590 2.677 -17.779 174 HG2 MET 22 2HG MET 22 -7.673 2.198 -19.986 175 HG3 MET 22 3HG MET 22 -9.072 2.885 -20.786 176 HE1 MET 22 3HE MET 22 -9.623 5.338 -20.993 177 HE2 MET 22 1HE MET 22 -9.743 5.509 -19.226 178 HE3 MET 22 2HE MET 22 -8.773 6.666 -20.167 179 H THR 23 HN THR 23 -8.904 0.873 -16.574 180 HA THR 23 HA THR 23 -11.040 1.364 -14.766 181 HB THR 23 HB THR 23 -11.700 -0.828 -15.997 182 HG1 THR 23 HG1 THR 23 -12.391 -0.091 -13.808 183 HG21 THR 23 3HG2 THR 23 -10.233 -2.518 -14.187 184 HG22 THR 23 1HG2 THR 23 -10.217 -2.564 -15.966 185 HG23 THR 23 2HG2 THR 23 -9.042 -1.553 -15.092 186 H THR 24 HN THR 24 -10.421 0.445 -12.501 187 HA THR 24 HA THR 24 -7.497 0.734 -12.271 188 HB THR 24 HB THR 24 -8.022 1.800 -10.069 189 HG1 THR 24 HG1 THR 24 -10.023 0.716 -9.635 190 HG21 THR 24 3HG2 THR 24 -9.716 2.929 -12.360 191 HG22 THR 24 1HG2 THR 24 -9.288 3.809 -10.873 192 HG23 THR 24 2HG2 THR 24 -8.017 3.345 -12.029 193 H ARG 25 HN ARG 25 -6.351 -0.891 -11.413 194 HA ARG 25 HA ARG 25 -7.622 -2.626 -9.549 195 HB2 ARG 25 2HB ARG 25 -7.552 -3.364 -12.332 196 HB3 ARG 25 3HB ARG 25 -6.386 -4.380 -11.508 197 HG2 ARG 25 2HG ARG 25 -8.140 -5.678 -10.872 198 HG3 ARG 25 3HG ARG 25 -8.565 -4.400 -9.752 199 HD2 ARG 25 2HD ARG 25 -10.361 -3.716 -11.011 200 HD3 ARG 25 3HD ARG 25 -9.489 -3.874 -12.523 201 HE ARG 25 HE ARG 25 -9.838 -6.491 -11.881 202 HH11 ARG 25 2HH2 ARG 25 -12.134 -3.794 -11.817 203 HH12 ARG 25 1HH2 ARG 25 -13.511 -4.797 -12.131 204 HH22 ARG 25 HH1 ARG 25 -13.206 -7.157 -12.407 205 H VAL 26 HN VAL 26 -6.058 -3.665 -8.206 206 HA VAL 26 HA VAL 26 -3.412 -2.596 -8.426 207 HB VAL 26 HB VAL 26 -4.528 -4.643 -6.502 208 HG11 VAL 26 1HG1 VAL 26 -2.220 -4.665 -6.199 209 HG12 VAL 26 2HG1 VAL 26 -2.050 -2.930 -6.562 210 HG13 VAL 26 3HG1 VAL 26 -2.752 -3.451 -5.011 211 HG21 VAL 26 3HG2 VAL 26 -4.474 -1.621 -6.203 212 HG22 VAL 26 1HG2 VAL 26 -5.922 -2.591 -6.566 213 HG23 VAL 26 2HG2 VAL 26 -5.076 -2.801 -5.014 214 H VAL 27 HN VAL 27 -2.732 -3.478 -10.492 215 HA VAL 27 HA VAL 27 -2.289 -6.377 -10.414 216 HB VAL 27 HB VAL 27 -2.250 -6.340 -12.766 217 HG11 VAL 27 1HG1 VAL 27 -4.496 -5.984 -11.547 218 HG12 VAL 27 2HG1 VAL 27 -4.417 -4.320 -12.176 219 HG13 VAL 27 3HG1 VAL 27 -4.443 -5.698 -13.303 220 HG21 VAL 27 3HG2 VAL 27 -0.988 -4.565 -13.505 221 HG22 VAL 27 1HG2 VAL 27 -2.619 -3.978 -13.908 222 HG23 VAL 27 2HG2 VAL 27 -1.802 -3.395 -12.438 223 H SER 28 HN SER 28 -0.170 -7.118 -11.384 224 HA SER 28 HA SER 28 1.893 -5.123 -10.877 225 HB2 SER 28 2HB SER 28 1.614 -6.834 -8.996 226 HB3 SER 28 3HB SER 28 2.114 -8.070 -10.134 227 HG SER 28 HG SER 28 3.862 -7.156 -8.772 228 HA PRO 29 HA PRO 29 3.760 -4.880 -11.179 229 HB2 PRO 29 2HB PRO 29 5.184 -3.299 -12.895 230 HB3 PRO 29 3HB PRO 29 5.864 -4.704 -12.099 231 HG2 PRO 29 2HG PRO 29 5.019 -4.396 -14.915 232 HG3 PRO 29 3HG PRO 29 6.070 -5.609 -14.211 233 HD2 PRO 29 2HD PRO 29 3.330 -5.953 -14.984 234 HD3 PRO 29 3HD PRO 29 4.346 -7.129 -14.174 235 H THR 30 HN THR 30 3.303 -2.729 -10.517 236 HA THR 30 HA THR 30 0.795 -1.886 -11.532 237 HB THR 30 HB THR 30 1.277 0.043 -9.915 238 HG1 THR 30 HG1 THR 30 3.448 0.225 -9.535 239 HG21 THR 30 3HG2 THR 30 1.637 -1.465 -7.861 240 HG22 THR 30 1HG2 THR 30 0.249 -1.910 -8.883 241 HG23 THR 30 2HG2 THR 30 1.767 -2.832 -8.993 242 H GLY 31 HN GLY 31 0.340 -0.801 -13.332 243 HA2 GLY 31 1HA GLY 31 2.526 0.625 -14.668 244 HA3 GLY 31 2HA GLY 31 1.004 0.118 -15.372 245 H ILE 32 HN ILE 32 0.477 2.207 -16.194 246 HA ILE 32 HA ILE 32 0.664 4.601 -14.998 247 HB ILE 32 HB ILE 32 -1.570 3.499 -16.699 248 HG12 ILE 32 2HG1 ILE 32 0.718 5.297 -17.519 249 HG13 ILE 32 3HG1 ILE 32 0.848 3.549 -17.547 250 HG21 ILE 32 1HG2 ILE 32 -2.078 5.612 -15.270 251 HG22 ILE 32 2HG2 ILE 32 -0.992 6.434 -16.416 252 HG23 ILE 32 3HG2 ILE 32 -2.456 5.614 -17.010 253 HD11 ILE 32 3HD1 ILE 32 -1.601 4.708 -18.830 254 HD12 ILE 32 1HD1 ILE 32 -0.052 4.980 -19.664 255 HD13 ILE 32 2HD1 ILE 32 -0.603 3.321 -19.330 256 HA PRO 33 HA PRO 33 -1.828 4.474 -11.469 257 HB2 PRO 33 2HB PRO 33 -2.021 7.145 -10.927 258 HB3 PRO 33 3HB PRO 33 -0.630 6.176 -10.486 259 HG2 PRO 33 2HG PRO 33 -0.899 8.142 -12.677 260 HG3 PRO 33 3HG PRO 33 0.561 7.492 -11.959 261 HD2 PRO 33 2HD PRO 33 -0.586 6.753 -14.482 262 HD3 PRO 33 3HD PRO 33 0.808 6.023 -13.710 263 H ALA 34 HN ALA 34 -3.935 4.632 -10.646 264 HA ALA 34 HA ALA 34 -5.857 4.742 -12.688 265 HB1 ALA 34 1HB ALA 34 -6.312 3.372 -10.813 266 HB2 ALA 34 2HB ALA 34 -5.936 4.674 -9.660 267 HB3 ALA 34 3HB ALA 34 -7.425 4.749 -10.632 268 H GLU 35 HN GLU 35 -4.151 7.212 -11.029 269 HA GLU 35 HA GLU 35 -6.296 9.084 -11.035 270 HB2 GLU 35 2HB GLU 35 -4.717 10.627 -10.108 271 HB3 GLU 35 3HB GLU 35 -4.334 9.069 -9.403 272 HG2 GLU 35 2HG GLU 35 -2.730 8.930 -11.593 273 HG3 GLU 35 3HG GLU 35 -2.792 10.673 -11.422 274 HE2 GLU 35 HE2 GLU 35 -2.321 8.992 -8.041 275 H ASP 36 HN ASP 36 -4.292 7.735 -13.422 276 HA ASP 36 HA ASP 36 -4.257 10.179 -14.975 277 HB2 ASP 36 2HB ASP 36 -2.859 7.505 -15.128 278 HB3 ASP 36 3HB ASP 36 -3.041 8.424 -16.609 279 HD2 ASP 36 HD2 ASP 36 0.041 9.438 -15.796 280 H ILE 37 HN ILE 37 -6.228 7.497 -14.334 281 HA ILE 37 HA ILE 37 -7.003 6.524 -16.780 282 HB ILE 37 HB ILE 37 -8.162 6.729 -14.075 283 HG12 ILE 37 2HG1 ILE 37 -7.663 4.544 -16.102 284 HG13 ILE 37 3HG1 ILE 37 -6.847 4.816 -14.576 285 HG21 ILE 37 1HG2 ILE 37 -10.081 7.503 -15.311 286 HG22 ILE 37 2HG2 ILE 37 -9.901 6.187 -16.496 287 HG23 ILE 37 3HG2 ILE 37 -10.346 5.814 -14.814 288 HD11 ILE 37 3HD1 ILE 37 -9.255 4.524 -13.524 289 HD12 ILE 37 1HD1 ILE 37 -9.625 3.728 -15.072 290 HD13 ILE 37 2HD1 ILE 37 -8.336 3.085 -14.026 291 HA PRO 38 HA PRO 38 -9.946 10.217 -17.068 292 HB2 PRO 38 2HB PRO 38 -9.607 12.356 -15.401 293 HB3 PRO 38 3HB PRO 38 -10.762 11.075 -15.093 294 HG2 PRO 38 2HG PRO 38 -8.154 11.572 -13.792 295 HG3 PRO 38 3HG PRO 38 -9.490 10.585 -13.232 296 HD2 PRO 38 2HD PRO 38 -7.044 9.656 -14.407 297 HD3 PRO 38 3HD PRO 38 -8.427 8.679 -13.954 298 H ARG 39 HN ARG 39 -6.638 10.288 -16.826 299 HA ARG 39 HA ARG 39 -6.502 12.732 -18.361 300 HB2 ARG 39 2HB ARG 39 -4.454 11.007 -16.920 301 HB3 ARG 39 3HB ARG 39 -3.924 12.175 -18.114 302 HG2 ARG 39 2HG ARG 39 -4.863 14.025 -16.872 303 HG3 ARG 39 3HG ARG 39 -5.776 12.957 -15.826 304 HD2 ARG 39 2HD ARG 39 -3.949 13.484 -14.449 305 HD3 ARG 39 3HD ARG 39 -3.406 11.980 -15.165 306 HE ARG 39 HE ARG 39 -2.349 14.670 -15.718 307 HH11 ARG 39 2HH2 ARG 39 -2.528 11.313 -16.838 308 HH12 ARG 39 1HH2 ARG 39 -1.103 11.433 -17.815 309 HH22 ARG 39 HH1 ARG 39 0.091 13.509 -17.900 310 H LEU 40 HN LEU 40 -6.337 9.229 -18.626 311 HA LEU 40 HA LEU 40 -4.880 9.218 -21.090 312 HB2 LEU 40 2HB LEU 40 -6.462 7.070 -19.670 313 HB3 LEU 40 3HB LEU 40 -5.468 6.818 -21.092 314 HG LEU 40 HG LEU 40 -4.239 8.008 -18.622 315 HD11 LEU 40 1HD1 LEU 40 -4.581 6.209 -17.375 316 HD12 LEU 40 2HD1 LEU 40 -5.529 5.459 -18.681 317 HD13 LEU 40 3HD1 LEU 40 -3.769 5.206 -18.601 318 HD21 LEU 40 3HD2 LEU 40 -2.210 7.186 -19.474 319 HD22 LEU 40 1HD2 LEU 40 -3.028 6.081 -20.605 320 HD23 LEU 40 2HD2 LEU 40 -3.074 7.837 -20.888 321 H ILE 41 HN ILE 41 -8.166 9.775 -20.073 322 HA ILE 41 HA ILE 41 -9.576 8.809 -22.239 323 HB ILE 41 HB ILE 41 -10.110 11.301 -20.619 324 HG12 ILE 41 2HG1 ILE 41 -9.758 8.779 -19.609 325 HG13 ILE 41 3HG1 ILE 41 -10.711 10.049 -18.866 326 HG21 ILE 41 1HG2 ILE 41 -11.471 11.143 -22.656 327 HG22 ILE 41 2HG2 ILE 41 -12.008 9.518 -22.169 328 HG23 ILE 41 3HG2 ILE 41 -12.449 10.934 -21.184 329 HD11 ILE 41 3HD1 ILE 41 -12.743 9.228 -20.072 330 HD12 ILE 41 1HD1 ILE 41 -11.768 7.920 -20.783 331 HD13 ILE 41 2HD1 ILE 41 -12.034 7.976 -19.024 332 H SER 42 HN SER 42 -9.921 9.462 -24.333 333 HA SER 42 HA SER 42 -9.915 10.794 -26.093 334 HB2 SER 42 2HB SER 42 -9.893 12.767 -24.377 335 HB3 SER 42 3HB SER 42 -8.175 12.859 -24.707 336 HG SER 42 HG SER 42 -9.380 12.716 -27.106 337 H MET 43 HN MET 43 -7.273 9.593 -24.297 338 HA MET 43 HA MET 43 -5.393 10.108 -26.443 339 HB2 MET 43 2HB MET 43 -4.888 8.639 -23.806 340 HB3 MET 43 3HB MET 43 -3.694 9.406 -24.834 341 HG2 MET 43 2HG MET 43 -5.295 11.565 -24.332 342 HG3 MET 43 3HG MET 43 -5.588 10.649 -22.867 343 HE1 MET 43 3HE MET 43 -3.359 9.002 -22.496 344 HE2 MET 43 1HE MET 43 -1.963 9.411 -23.522 345 HE3 MET 43 2HE MET 43 -1.943 9.817 -21.790 346 H GLN 44 HN GLN 44 -4.715 8.527 -27.869 347 HA GLN 44 HA GLN 44 -6.058 5.991 -27.610 348 HB2 GLN 44 2HB GLN 44 -4.289 6.948 -29.897 349 HB3 GLN 44 3HB GLN 44 -5.454 5.639 -29.937 350 HG2 GLN 44 2HG GLN 44 -7.319 7.120 -29.844 351 HG3 GLN 44 3HG GLN 44 -6.356 8.447 -29.224 352 HE21 GLN 44 1HE2 GLN 44 -7.065 6.452 -32.023 353 HE22 GLN 44 2HE2 GLN 44 -6.506 7.544 -33.246 354 H VAL 45 HN VAL 45 -4.847 3.925 -27.955 355 HA VAL 45 HA VAL 45 -2.339 4.045 -26.508 356 HB VAL 45 HB VAL 45 -2.599 1.565 -26.517 357 HG11 VAL 45 1HG1 VAL 45 -4.427 1.524 -24.896 358 HG12 VAL 45 2HG1 VAL 45 -3.417 2.971 -24.660 359 HG13 VAL 45 3HG1 VAL 45 -4.996 3.110 -25.470 360 HG21 VAL 45 3HG2 VAL 45 -4.221 1.890 -28.664 361 HG22 VAL 45 1HG2 VAL 45 -4.247 0.456 -27.610 362 HG23 VAL 45 2HG2 VAL 45 -5.435 1.759 -27.369 363 H ASN 46 HN ASN 46 -0.394 2.941 -27.296 364 HA ASN 46 HA ASN 46 -0.264 3.177 -30.188 365 HB2 ASN 46 2HB ASN 46 2.187 3.403 -29.860 366 HB3 ASN 46 3HB ASN 46 1.339 4.566 -28.860 367 HD21 ASN 46 1HD2 ASN 46 2.463 4.818 -27.083 368 HD22 ASN 46 2HD2 ASN 46 3.068 3.572 -26.043 369 H GLN 47 HN GLN 47 -1.435 0.830 -28.817 370 HA GLN 47 HA GLN 47 -0.132 -1.182 -30.166 371 HB2 GLN 47 2HB GLN 47 1.682 -1.263 -28.674 372 HB3 GLN 47 3HB GLN 47 0.698 -0.853 -27.283 373 HG2 GLN 47 2HG GLN 47 -0.366 -3.074 -27.312 374 HG3 GLN 47 3HG GLN 47 0.451 -3.489 -28.806 375 HE21 GLN 47 1HE2 GLN 47 1.576 -1.831 -25.867 376 HE22 GLN 47 2HE2 GLN 47 2.861 -2.924 -25.473 377 H VAL 48 HN VAL 48 -1.206 -3.319 -29.814 378 HA VAL 48 HA VAL 48 -3.948 -2.908 -29.121 379 HB VAL 48 HB VAL 48 -2.274 -5.113 -30.256 380 HG11 VAL 48 1HG1 VAL 48 -3.568 -6.433 -28.802 381 HG12 VAL 48 2HG1 VAL 48 -5.015 -5.420 -29.022 382 HG13 VAL 48 3HG1 VAL 48 -4.457 -6.474 -30.343 383 HG21 VAL 48 3HG2 VAL 48 -4.859 -3.843 -31.215 384 HG22 VAL 48 1HG2 VAL 48 -3.231 -3.293 -31.679 385 HG23 VAL 48 2HG2 VAL 48 -3.781 -4.924 -32.131 386 H VAL 49 HN VAL 49 -4.224 -2.530 -26.928 387 HA VAL 49 HA VAL 49 -2.955 -4.401 -25.088 388 HB VAL 49 HB VAL 49 -4.519 -1.850 -24.644 389 HG11 VAL 49 1HG1 VAL 49 -3.614 -1.991 -22.321 390 HG12 VAL 49 2HG1 VAL 49 -4.766 -3.288 -22.717 391 HG13 VAL 49 3HG1 VAL 49 -3.019 -3.627 -22.692 392 HG21 VAL 49 3HG2 VAL 49 -2.610 -0.873 -25.307 393 HG22 VAL 49 1HG2 VAL 49 -1.924 -1.448 -23.769 394 HG23 VAL 49 2HG2 VAL 49 -1.705 -2.405 -25.254 395 HA PRO 50 HA PRO 50 -6.763 -6.563 -25.074 396 HB2 PRO 50 2HB PRO 50 -5.905 -8.731 -23.649 397 HB3 PRO 50 3HB PRO 50 -5.732 -8.597 -25.388 398 HG2 PRO 50 2HG PRO 50 -3.668 -8.301 -23.292 399 HG3 PRO 50 3HG PRO 50 -3.457 -8.593 -25.007 400 HD2 PRO 50 2HD PRO 50 -3.086 -6.104 -23.631 401 HD3 PRO 50 3HD PRO 50 -2.988 -6.370 -25.361 402 H MET 51 HN MET 51 -8.454 -7.251 -23.603 403 HA MET 51 HA MET 51 -8.651 -5.426 -21.536 404 HB2 MET 51 2HB MET 51 -10.600 -6.512 -22.633 405 HB3 MET 51 3HB MET 51 -10.086 -8.087 -22.062 406 HG2 MET 51 2HG MET 51 -10.413 -7.351 -19.697 407 HG3 MET 51 3HG MET 51 -10.893 -5.759 -20.250 408 HE1 MET 51 3HE MET 51 -11.997 -9.324 -21.995 409 HE2 MET 51 1HE MET 51 -11.455 -9.457 -20.305 410 HE3 MET 51 2HE MET 51 -13.171 -9.697 -20.710 411 H GLY 52 HN GLY 52 -7.721 -5.380 -19.538 412 HA2 GLY 52 1HA GLY 52 -7.411 -6.457 -17.435 413 HA3 GLY 52 2HA GLY 52 -7.075 -7.963 -18.265 414 H THR 53 HN THR 53 -5.528 -6.053 -20.329 415 HA THR 53 HA THR 53 -2.976 -6.490 -19.079 416 HB THR 53 HB THR 53 -3.925 -5.347 -21.755 417 HG1 THR 53 HG1 THR 53 -4.044 -7.723 -20.997 418 HG21 THR 53 3HG2 THR 53 -1.534 -4.597 -20.837 419 HG22 THR 53 1HG2 THR 53 -1.100 -6.289 -21.178 420 HG23 THR 53 2HG2 THR 53 -1.681 -5.237 -22.491 421 H THR 54 HN THR 54 -2.039 -5.175 -17.660 422 HA THR 54 HA THR 54 -3.023 -2.725 -16.902 423 HB THR 54 HB THR 54 -0.064 -3.434 -16.821 424 HG1 THR 54 HG1 THR 54 -0.660 -5.114 -15.405 425 HG21 THR 54 3HG2 THR 54 -0.441 -2.769 -14.389 426 HG22 THR 54 1HG2 THR 54 -0.699 -1.436 -15.540 427 HG23 THR 54 2HG2 THR 54 -2.095 -2.287 -14.837 428 H LEU 55 HN LEU 55 -2.690 -0.579 -17.406 429 HA LEU 55 HA LEU 55 -1.713 -0.167 -20.102 430 HB2 LEU 55 2HB LEU 55 -3.903 0.722 -19.049 431 HB3 LEU 55 3HB LEU 55 -2.880 1.925 -18.291 432 HG LEU 55 HG LEU 55 -2.256 2.880 -20.364 433 HD11 LEU 55 1HD1 LEU 55 -1.711 1.181 -21.819 434 HD12 LEU 55 2HD1 LEU 55 -3.237 0.305 -21.547 435 HD13 LEU 55 3HD1 LEU 55 -3.225 1.786 -22.534 436 HD21 LEU 55 3HD2 LEU 55 -4.600 3.118 -21.526 437 HD22 LEU 55 1HD2 LEU 55 -5.169 2.240 -20.085 438 HD23 LEU 55 2HD2 LEU 55 -4.313 3.790 -19.903 439 H MET 56 HN MET 56 0.216 0.756 -20.631 440 HA MET 56 HA MET 56 1.829 1.603 -18.358 441 HB2 MET 56 2HB MET 56 2.452 0.440 -21.111 442 HB3 MET 56 3HB MET 56 3.701 1.280 -20.214 443 HG2 MET 56 2HG MET 56 2.133 -0.843 -18.754 444 HG3 MET 56 3HG MET 56 3.299 -1.377 -19.949 445 HE1 MET 56 3HE MET 56 3.198 -1.505 -16.459 446 HE2 MET 56 1HE MET 56 4.108 -0.145 -15.759 447 HE3 MET 56 2HE MET 56 2.573 0.155 -16.608 448 HA PRO 57 HA PRO 57 2.141 5.610 -19.994 449 HB2 PRO 57 2HB PRO 57 4.664 6.397 -19.298 450 HB3 PRO 57 3HB PRO 57 3.321 6.380 -18.173 451 HG2 PRO 57 2HG PRO 57 5.594 4.501 -18.375 452 HG3 PRO 57 3HG PRO 57 4.498 4.757 -17.032 453 HD2 PRO 57 2HD PRO 57 4.455 2.571 -18.888 454 HD3 PRO 57 3HD PRO 57 3.291 2.890 -17.618 455 H ASP 58 HN ASP 58 4.400 3.282 -21.087 456 HA ASP 58 HA ASP 58 5.108 5.023 -23.284 457 HB2 ASP 58 2HB ASP 58 6.841 3.642 -22.033 458 HB3 ASP 58 3HB ASP 58 6.064 2.194 -22.641 459 HD2 ASP 58 HD2 ASP 58 7.202 3.840 -25.930 460 H MET 59 HN MET 59 2.494 3.253 -22.561 461 HA MET 59 HA MET 59 2.380 1.941 -25.167 462 HB2 MET 59 2HB MET 59 1.232 1.304 -22.429 463 HB3 MET 59 3HB MET 59 0.339 0.768 -23.838 464 HG2 MET 59 2HG MET 59 2.713 -0.160 -24.630 465 HG3 MET 59 3HG MET 59 3.105 -0.059 -22.925 466 HE1 MET 59 3HE MET 59 -0.293 -1.995 -21.688 467 HE2 MET 59 1HE MET 59 1.025 -0.955 -21.097 468 HE3 MET 59 2HE MET 59 -0.194 -0.298 -22.216 469 H VAL 60 HN VAL 60 1.736 4.836 -24.137 470 HA VAL 60 HA VAL 60 -0.879 4.930 -25.444 471 HB VAL 60 HB VAL 60 -0.144 6.384 -22.895 472 HG11 VAL 60 1HG1 VAL 60 -2.850 6.286 -24.250 473 HG12 VAL 60 2HG1 VAL 60 -2.310 7.347 -22.927 474 HG13 VAL 60 3HG1 VAL 60 -1.660 7.571 -24.568 475 HG21 VAL 60 3HG2 VAL 60 -1.688 4.971 -21.741 476 HG22 VAL 60 1HG2 VAL 60 -2.237 4.221 -23.260 477 HG23 VAL 60 2HG2 VAL 60 -0.592 3.909 -22.657 478 H LYS 61 HN LYS 61 -1.115 6.644 -26.871 479 HA LYS 61 HA LYS 61 1.329 8.096 -27.413 480 HB2 LYS 61 2HB LYS 61 -1.306 7.950 -28.908 481 HB3 LYS 61 3HB LYS 61 0.119 8.806 -29.459 482 HG2 LYS 61 2HG LYS 61 1.376 6.536 -29.173 483 HG3 LYS 61 3HG LYS 61 -0.213 5.808 -29.050 484 HD2 LYS 61 2HD LYS 61 -0.651 7.257 -31.284 485 HD3 LYS 61 3HD LYS 61 1.092 7.135 -31.421 486 HE2 LYS 61 2HE LYS 61 0.837 4.598 -31.090 487 HE3 LYS 61 3HE LYS 61 -0.895 4.826 -31.232 488 HZ1 LYS 61 2HZ LYS 61 0.962 4.653 -33.317 489 HZ3 LYS 61 1HZ LYS 61 0.348 6.160 -33.375 490 H GLY 62 HN GLY 62 1.451 10.419 -27.541 491 HA2 GLY 62 1HA GLY 62 1.124 12.482 -26.714 492 HA3 GLY 62 2HA GLY 62 -0.590 12.189 -26.936 493 H TYR 63 HN TYR 63 1.068 9.912 -24.857 494 HA TYR 63 HA TYR 63 -0.455 10.876 -22.608 495 HB2 TYR 63 2HB TYR 63 -0.276 8.467 -23.007 496 HB3 TYR 63 3HB TYR 63 1.445 8.576 -23.318 497 HD1 TYR 63 HD2 TYR 63 3.052 8.790 -21.449 498 HD2 TYR 63 HD1 TYR 63 -1.141 8.314 -20.745 499 HE1 TYR 63 HE2 TYR 63 3.522 8.168 -19.029 500 HE2 TYR 63 HE1 TYR 63 -0.657 7.694 -18.327 501 HH TYR 63 HH TYR 63 1.891 8.400 -16.762 502 H ALA 64 HN ALA 64 0.786 10.757 -20.371 503 HA ALA 64 HA ALA 64 3.448 11.259 -20.109 504 HB1 ALA 64 1HB ALA 64 3.035 13.923 -19.769 505 HB2 ALA 64 2HB ALA 64 3.659 13.211 -21.277 506 HB3 ALA 64 3HB ALA 64 1.930 13.610 -21.130 507 HA PRO 65 HA PRO 65 1.950 11.259 -16.051 508 HB2 PRO 65 2HB PRO 65 4.196 11.949 -14.656 509 HB3 PRO 65 3HB PRO 65 3.900 10.329 -15.254 510 HG2 PRO 65 2HG PRO 65 5.752 12.382 -16.301 511 HG3 PRO 65 3HG PRO 65 5.744 10.655 -16.601 512 HD2 PRO 65 2HD PRO 65 4.828 12.711 -18.380 513 HD3 PRO 65 3HD PRO 65 4.713 10.981 -18.631 514 H ALA 66 HN ALA 66 2.190 12.640 -13.833 515 HA ALA 66 HA ALA 66 1.912 15.436 -14.650 516 HB1 ALA 66 1HB ALA 66 -0.197 13.619 -13.711 517 HB2 ALA 66 2HB ALA 66 -0.045 15.079 -12.704 518 HB3 ALA 66 3HB ALA 66 -0.328 15.231 -14.455 Start of MODEL 15 1 H1 MET 0 HN MET 0 3.798 -1.023 -0.043 2 HA MET 0 HA MET 0 1.318 0.112 0.006 3 HB2 MET 0 2HB MET 0 3.500 1.208 -0.667 4 HB3 MET 0 3HB MET 0 3.472 0.313 -2.173 5 HG2 MET 0 2HG MET 0 2.602 2.621 -2.491 6 HG3 MET 0 3HG MET 0 1.364 1.431 -2.843 7 HE1 MET 0 3HE MET 0 1.598 4.718 -1.619 8 HE2 MET 0 1HE MET 0 0.208 4.073 -2.525 9 HE3 MET 0 2HE MET 0 -0.032 4.771 -0.905 10 H ASN 1 HN ASN 1 -0.337 0.407 -1.679 11 HA ASN 1 HA ASN 1 -0.270 -1.576 -3.775 12 HB2 ASN 1 2HB ASN 1 -2.606 -1.286 -1.810 13 HB3 ASN 1 3HB ASN 1 -2.611 -2.314 -3.230 14 HD21 ASN 1 1HD2 ASN 1 -0.464 -3.683 -3.357 15 HD22 ASN 1 2HD2 ASN 1 -0.095 -4.597 -1.933 16 H GLN 2 HN GLN 2 -0.189 0.175 -5.308 17 HA GLN 2 HA GLN 2 -2.325 2.131 -5.086 18 HB2 GLN 2 2HB GLN 2 -0.995 3.443 -6.738 19 HB3 GLN 2 3HB GLN 2 -0.080 3.078 -5.288 20 HG2 GLN 2 2HG GLN 2 1.481 1.935 -6.475 21 HG3 GLN 2 3HG GLN 2 0.258 0.914 -7.205 22 HE21 GLN 2 1HE2 GLN 2 -1.289 2.736 -8.552 23 HE22 GLN 2 2HE2 GLN 2 -0.396 3.461 -9.847 24 H GLU 3 HN GLU 3 -4.023 2.170 -6.531 25 HA GLU 3 HA GLU 3 -4.390 -0.037 -8.182 26 HB2 GLU 3 2HB GLU 3 -5.845 2.476 -7.535 27 HB3 GLU 3 3HB GLU 3 -6.219 1.806 -9.111 28 HG2 GLU 3 2HG GLU 3 -6.711 -0.409 -8.052 29 HG3 GLU 3 3HG GLU 3 -6.336 0.260 -6.477 30 HE2 GLU 3 HE2 GLU 3 -8.743 -0.418 -8.411 31 H SER 4 HN SER 4 -3.963 -0.407 -10.348 32 HA SER 4 HA SER 4 -2.773 1.853 -11.758 33 HB2 SER 4 2HB SER 4 -2.198 -0.966 -12.620 34 HB3 SER 4 3HB SER 4 -1.169 0.450 -12.695 35 HG SER 4 HG SER 4 -1.237 -1.485 -10.789 36 H VAL 5 HN VAL 5 -3.348 2.141 -14.005 37 HA VAL 5 HA VAL 5 -5.983 1.568 -14.627 38 HB VAL 5 HB VAL 5 -3.610 2.328 -16.334 39 HG11 VAL 5 1HG1 VAL 5 -5.133 2.922 -18.106 40 HG12 VAL 5 2HG1 VAL 5 -5.411 1.219 -17.672 41 HG13 VAL 5 3HG1 VAL 5 -6.540 2.476 -17.112 42 HG21 VAL 5 3HG2 VAL 5 -4.928 3.773 -14.394 43 HG22 VAL 5 1HG2 VAL 5 -4.000 4.463 -15.747 44 HG23 VAL 5 2HG2 VAL 5 -5.765 4.277 -15.882 45 H VAL 6 HN VAL 6 -7.032 -0.087 -15.691 46 HA VAL 6 HA VAL 6 -5.354 -2.174 -16.860 47 HB VAL 6 HB VAL 6 -7.466 -2.533 -14.731 48 HG11 VAL 6 1HG1 VAL 6 -6.078 -4.778 -16.215 49 HG12 VAL 6 2HG1 VAL 6 -7.457 -4.874 -15.094 50 HG13 VAL 6 3HG1 VAL 6 -7.668 -4.142 -16.703 51 HG21 VAL 6 3HG2 VAL 6 -4.612 -2.383 -14.676 52 HG22 VAL 6 1HG2 VAL 6 -5.738 -2.696 -13.334 53 HG23 VAL 6 2HG2 VAL 6 -5.089 -4.053 -14.286 54 H ALA 7 HN ALA 7 -6.048 -2.632 -18.884 55 HA ALA 7 HA ALA 7 -8.146 -1.332 -20.078 56 HB1 ALA 7 1HB ALA 7 -7.929 -3.474 -21.664 57 HB2 ALA 7 2HB ALA 7 -6.647 -2.242 -21.578 58 HB3 ALA 7 3HB ALA 7 -6.485 -3.760 -20.664 59 H ALA 8 HN ALA 8 -10.187 -1.336 -19.204 60 HA ALA 8 HA ALA 8 -11.290 -3.603 -17.938 61 HB1 ALA 8 1HB ALA 8 -12.929 -2.137 -17.363 62 HB2 ALA 8 2HB ALA 8 -11.815 -0.913 -18.018 63 HB3 ALA 8 3HB ALA 8 -13.130 -1.553 -19.033 64 H VAL 9 HN VAL 9 -10.645 -2.922 -21.210 65 HA VAL 9 HA VAL 9 -12.215 -5.181 -22.018 66 HB VAL 9 HB VAL 9 -13.402 -3.942 -23.801 67 HG11 VAL 9 1HG1 VAL 9 -14.463 -4.572 -21.614 68 HG12 VAL 9 2HG1 VAL 9 -14.119 -2.925 -21.033 69 HG13 VAL 9 3HG1 VAL 9 -15.211 -3.171 -22.417 70 HG21 VAL 9 3HG2 VAL 9 -12.588 -1.893 -24.264 71 HG22 VAL 9 1HG2 VAL 9 -13.631 -1.354 -22.926 72 HG23 VAL 9 2HG2 VAL 9 -11.907 -1.685 -22.633 73 H LEU 10 HN LEU 10 -11.851 -5.490 -24.530 74 HA LEU 10 HA LEU 10 -9.062 -5.531 -24.893 75 HB2 LEU 10 2HB LEU 10 -10.346 -7.261 -25.830 76 HB3 LEU 10 3HB LEU 10 -11.432 -6.148 -26.637 77 HG LEU 10 HG LEU 10 -9.159 -5.441 -27.876 78 HD11 LEU 10 1HD1 LEU 10 -7.461 -6.880 -27.797 79 HD12 LEU 10 2HD1 LEU 10 -8.258 -7.585 -26.371 80 HD13 LEU 10 3HD1 LEU 10 -8.533 -8.288 -27.983 81 HD21 LEU 10 3HD2 LEU 10 -10.269 -6.181 -29.657 82 HD22 LEU 10 1HD2 LEU 10 -10.165 -7.873 -29.114 83 HD23 LEU 10 2HD2 LEU 10 -11.481 -6.829 -28.526 84 H ILE 11 HN ILE 11 -7.937 -3.641 -25.026 85 HA ILE 11 HA ILE 11 -9.073 -1.536 -26.706 86 HB ILE 11 HB ILE 11 -6.626 -1.175 -25.041 87 HG12 ILE 11 2HG1 ILE 11 -9.373 -1.727 -23.988 88 HG13 ILE 11 3HG1 ILE 11 -7.811 -2.192 -23.344 89 HG21 ILE 11 1HG2 ILE 11 -8.069 0.491 -26.636 90 HG22 ILE 11 2HG2 ILE 11 -8.813 0.804 -25.050 91 HG23 ILE 11 3HG2 ILE 11 -7.060 1.017 -25.268 92 HD11 ILE 11 3HD1 ILE 11 -7.464 0.426 -23.047 93 HD12 ILE 11 1HD1 ILE 11 -9.242 0.458 -23.125 94 HD13 ILE 11 2HD1 ILE 11 -8.424 -0.490 -21.860 95 HA PRO 12 HA PRO 12 -6.192 -2.993 -29.682 96 HB2 PRO 12 2HB PRO 12 -7.282 -1.703 -31.830 97 HB3 PRO 12 3HB PRO 12 -7.807 -3.287 -31.296 98 HG2 PRO 12 2HG PRO 12 -9.155 -0.678 -30.960 99 HG3 PRO 12 3HG PRO 12 -9.832 -2.289 -30.825 100 HD2 PRO 12 2HD PRO 12 -9.144 -0.531 -28.666 101 HD3 PRO 12 3HD PRO 12 -9.711 -2.183 -28.532 102 H ILE 13 HN ILE 13 -4.759 -1.958 -31.444 103 HA ILE 13 HA ILE 13 -3.359 0.089 -30.095 104 HB ILE 13 HB ILE 13 -2.209 -1.530 -31.427 105 HG12 ILE 13 2HG1 ILE 13 -1.958 1.099 -32.900 106 HG13 ILE 13 3HG1 ILE 13 -1.397 0.890 -31.253 107 HG21 ILE 13 1HG2 ILE 13 -4.330 -1.211 -33.236 108 HG22 ILE 13 2HG2 ILE 13 -2.878 -0.640 -34.094 109 HG23 ILE 13 3HG2 ILE 13 -2.913 -2.277 -33.395 110 HD11 ILE 13 3HD1 ILE 13 0.549 0.220 -32.258 111 HD12 ILE 13 1HD1 ILE 13 -0.296 -1.336 -32.435 112 HD13 ILE 13 2HD1 ILE 13 -0.267 -0.180 -33.788 113 H ASN 14 HN ASN 14 -2.936 2.288 -30.884 114 HA ASN 14 HA ASN 14 -3.764 4.270 -31.282 115 HB2 ASN 14 2HB ASN 14 -4.153 2.727 -33.852 116 HB3 ASN 14 3HB ASN 14 -4.832 4.341 -33.776 117 HD21 ASN 14 1HD2 ASN 14 -2.284 2.708 -34.819 118 HD22 ASN 14 2HD2 ASN 14 -1.006 3.867 -34.671 119 H THR 15 HN THR 15 -5.571 3.018 -29.643 120 HA THR 15 HA THR 15 -8.184 3.642 -30.856 121 HB THR 15 HB THR 15 -7.400 1.459 -28.853 122 HG1 THR 15 HG1 THR 15 -6.939 0.950 -31.072 123 HG21 THR 15 3HG2 THR 15 -9.939 0.897 -29.827 124 HG22 THR 15 1HG2 THR 15 -9.616 1.613 -28.230 125 HG23 THR 15 2HG2 THR 15 -10.019 2.661 -29.611 126 H ALA 16 HN ALA 16 -9.078 5.423 -30.051 127 HA ALA 16 HA ALA 16 -8.049 6.887 -27.985 128 HB1 ALA 16 1HB ALA 16 -9.850 7.412 -29.800 129 HB2 ALA 16 2HB ALA 16 -11.011 6.820 -28.588 130 HB3 ALA 16 3HB ALA 16 -9.972 8.217 -28.217 131 H LEU 17 HN LEU 17 -8.066 6.769 -25.782 132 HA LEU 17 HA LEU 17 -9.376 4.472 -24.621 133 HB2 LEU 17 2HB LEU 17 -7.511 6.560 -23.488 134 HB3 LEU 17 3HB LEU 17 -8.163 5.215 -22.574 135 HG LEU 17 HG LEU 17 -6.483 4.874 -25.070 136 HD11 LEU 17 1HD1 LEU 17 -5.185 6.049 -23.359 137 HD12 LEU 17 2HD1 LEU 17 -5.584 4.779 -22.176 138 HD13 LEU 17 3HD1 LEU 17 -4.593 4.388 -23.603 139 HD21 LEU 17 3HD2 LEU 17 -7.612 2.990 -23.016 140 HD22 LEU 17 1HD2 LEU 17 -7.647 2.889 -24.793 141 HD23 LEU 17 2HD2 LEU 17 -6.131 2.579 -23.914 142 H THR 18 HN THR 18 -11.085 4.510 -23.154 143 HA THR 18 HA THR 18 -12.269 7.161 -22.671 144 HB THR 18 HB THR 18 -14.498 5.770 -22.928 145 HG1 THR 18 HG1 THR 18 -13.885 4.026 -24.612 146 HG21 THR 18 3HG2 THR 18 -12.648 6.490 -25.249 147 HG22 THR 18 1HG2 THR 18 -14.288 5.852 -25.515 148 HG23 THR 18 2HG2 THR 18 -14.062 7.397 -24.661 149 H VAL 19 HN VAL 19 -14.012 6.987 -20.872 150 HA VAL 19 HA VAL 19 -12.641 5.889 -18.616 151 HB VAL 19 HB VAL 19 -14.080 8.073 -18.943 152 HG11 VAL 19 1HG1 VAL 19 -16.143 6.025 -18.068 153 HG12 VAL 19 2HG1 VAL 19 -16.351 7.787 -17.938 154 HG13 VAL 19 3HG1 VAL 19 -16.174 7.027 -19.538 155 HG21 VAL 19 3HG2 VAL 19 -13.266 6.473 -16.674 156 HG22 VAL 19 1HG2 VAL 19 -13.322 8.243 -16.851 157 HG23 VAL 19 2HG2 VAL 19 -14.766 7.357 -16.305 158 H GLY 20 HN GLY 20 -14.859 4.695 -20.952 159 HA2 GLY 20 1HA GLY 20 -15.954 2.699 -19.084 160 HA3 GLY 20 2HA GLY 20 -16.583 3.106 -20.669 161 H MET 21 HN MET 21 -13.135 3.017 -20.667 162 HA MET 21 HA MET 21 -13.254 0.297 -21.722 163 HB2 MET 21 2HB MET 21 -11.987 2.843 -22.673 164 HB3 MET 21 3HB MET 21 -10.958 1.431 -22.809 165 HG2 MET 21 2HG MET 21 -13.335 0.424 -23.793 166 HG3 MET 21 3HG MET 21 -13.462 2.100 -24.291 167 HE1 MET 21 3HE MET 21 -9.944 2.555 -26.066 168 HE2 MET 21 1HE MET 21 -11.172 3.340 -25.045 169 HE3 MET 21 2HE MET 21 -9.907 2.333 -24.301 170 H MET 22 HN MET 22 -11.561 2.661 -19.663 171 HA MET 22 HA MET 22 -9.585 0.643 -19.009 172 HB2 MET 22 2HB MET 22 -9.868 3.629 -18.379 173 HB3 MET 22 3HB MET 22 -8.591 2.647 -17.690 174 HG2 MET 22 2HG MET 22 -7.647 2.170 -19.876 175 HG3 MET 22 3HG MET 22 -9.054 2.810 -20.700 176 HE1 MET 22 3HE MET 22 -8.840 6.610 -20.160 177 HE2 MET 22 1HE MET 22 -9.596 5.268 -21.051 178 HE3 MET 22 2HE MET 22 -9.835 5.416 -19.293 179 H THR 23 HN THR 23 -8.908 0.908 -16.462 180 HA THR 23 HA THR 23 -11.039 1.400 -14.666 181 HB THR 23 HB THR 23 -11.495 -0.911 -16.011 182 HG1 THR 23 HG1 THR 23 -12.969 -0.577 -14.388 183 HG21 THR 23 3HG2 THR 23 -10.785 -2.794 -14.499 184 HG22 THR 23 1HG2 THR 23 -9.392 -2.036 -15.308 185 HG23 THR 23 2HG2 THR 23 -9.747 -1.656 -13.606 186 H THR 24 HN THR 24 -10.434 0.473 -12.398 187 HA THR 24 HA THR 24 -7.507 0.729 -12.167 188 HB THR 24 HB THR 24 -8.025 1.789 -9.960 189 HG1 THR 24 HG1 THR 24 -10.034 0.753 -9.506 190 HG21 THR 24 3HG2 THR 24 -8.017 3.314 -11.962 191 HG22 THR 24 1HG2 THR 24 -9.745 2.962 -12.209 192 HG23 THR 24 2HG2 THR 24 -9.213 3.826 -10.747 193 H ARG 25 HN ARG 25 -6.349 -0.757 -11.020 194 HA ARG 25 HA ARG 25 -7.620 -2.514 -9.247 195 HB2 ARG 25 2HB ARG 25 -7.654 -3.300 -12.013 196 HB3 ARG 25 3HB ARG 25 -6.471 -4.319 -11.218 197 HG2 ARG 25 2HG ARG 25 -8.172 -5.576 -10.404 198 HG3 ARG 25 3HG ARG 25 -8.651 -4.215 -9.410 199 HD2 ARG 25 2HD ARG 25 -10.467 -3.752 -10.722 200 HD3 ARG 25 3HD ARG 25 -9.544 -3.897 -12.204 201 HE ARG 25 HE ARG 25 -9.745 -6.512 -11.497 202 HH11 ARG 25 2HH2 ARG 25 -12.210 -3.967 -11.562 203 HH12 ARG 25 1HH2 ARG 25 -13.512 -5.064 -11.878 204 HH22 ARG 25 HH1 ARG 25 -13.050 -7.407 -12.081 205 H VAL 26 HN VAL 26 -6.034 -3.698 -8.001 206 HA VAL 26 HA VAL 26 -3.382 -2.630 -8.254 207 HB VAL 26 HB VAL 26 -4.339 -4.753 -6.341 208 HG11 VAL 26 1HG1 VAL 26 -2.676 -3.735 -4.840 209 HG12 VAL 26 2HG1 VAL 26 -1.932 -4.288 -6.359 210 HG13 VAL 26 3HG1 VAL 26 -2.254 -2.556 -6.105 211 HG21 VAL 26 3HG2 VAL 26 -5.919 -3.329 -5.628 212 HG22 VAL 26 1HG2 VAL 26 -4.579 -2.351 -4.984 213 HG23 VAL 26 2HG2 VAL 26 -5.260 -1.982 -6.587 214 H VAL 27 HN VAL 27 -2.788 -3.487 -10.362 215 HA VAL 27 HA VAL 27 -2.368 -6.391 -10.338 216 HB VAL 27 HB VAL 27 -2.411 -6.323 -12.689 217 HG11 VAL 27 1HG1 VAL 27 -4.611 -5.983 -11.408 218 HG12 VAL 27 2HG1 VAL 27 -4.535 -4.295 -11.968 219 HG13 VAL 27 3HG1 VAL 27 -4.613 -5.622 -13.152 220 HG21 VAL 27 3HG2 VAL 27 -2.780 -3.963 -13.807 221 HG22 VAL 27 1HG2 VAL 27 -1.949 -3.378 -12.346 222 HG23 VAL 27 2HG2 VAL 27 -1.141 -4.542 -13.423 223 H SER 28 HN SER 28 -0.290 -7.133 -11.400 224 HA SER 28 HA SER 28 1.806 -5.160 -10.953 225 HB2 SER 28 2HB SER 28 1.435 -7.075 -9.142 226 HB3 SER 28 3HB SER 28 2.274 -8.075 -10.311 227 HG SER 28 HG SER 28 4.076 -6.612 -10.240 228 HA PRO 29 HA PRO 29 3.667 -4.939 -11.318 229 HB2 PRO 29 2HB PRO 29 5.049 -3.377 -13.085 230 HB3 PRO 29 3HB PRO 29 5.740 -4.788 -12.308 231 HG2 PRO 29 2HG PRO 29 4.805 -4.478 -15.095 232 HG3 PRO 29 3HG PRO 29 5.866 -5.700 -14.423 233 HD2 PRO 29 2HD PRO 29 3.097 -6.017 -15.103 234 HD3 PRO 29 3HD PRO 29 4.127 -7.201 -14.324 235 H THR 30 HN THR 30 3.268 -2.771 -10.656 236 HA THR 30 HA THR 30 0.733 -1.905 -11.602 237 HB THR 30 HB THR 30 1.374 0.060 -10.011 238 HG1 THR 30 HG1 THR 30 3.686 -0.246 -10.220 239 HG21 THR 30 3HG2 THR 30 1.573 -2.835 -9.028 240 HG22 THR 30 1HG2 THR 30 1.416 -1.424 -7.954 241 HG23 THR 30 2HG2 THR 30 0.100 -1.837 -9.079 242 H GLY 31 HN GLY 31 0.257 -0.808 -13.388 243 HA2 GLY 31 1HA GLY 31 2.430 0.598 -14.764 244 HA3 GLY 31 2HA GLY 31 0.882 0.123 -15.433 245 H ILE 32 HN ILE 32 0.411 2.244 -16.231 246 HA ILE 32 HA ILE 32 0.657 4.614 -14.995 247 HB ILE 32 HB ILE 32 -1.603 3.592 -16.711 248 HG12 ILE 32 2HG1 ILE 32 0.739 5.340 -17.490 249 HG13 ILE 32 3HG1 ILE 32 0.798 3.591 -17.576 250 HG21 ILE 32 1HG2 ILE 32 -0.958 6.508 -16.365 251 HG22 ILE 32 2HG2 ILE 32 -2.436 5.737 -16.990 252 HG23 ILE 32 3HG2 ILE 32 -2.073 5.685 -15.248 253 HD11 ILE 32 3HD1 ILE 32 -0.010 5.065 -19.663 254 HD12 ILE 32 1HD1 ILE 32 -0.732 3.474 -19.324 255 HD13 ILE 32 2HD1 ILE 32 -1.576 4.959 -18.824 256 HA PRO 33 HA PRO 33 -1.830 4.478 -11.463 257 HB2 PRO 33 2HB PRO 33 -1.958 7.143 -10.869 258 HB3 PRO 33 3HB PRO 33 -0.589 6.132 -10.449 259 HG2 PRO 33 2HG PRO 33 -0.814 8.145 -12.602 260 HG3 PRO 33 3HG PRO 33 0.631 7.446 -11.899 261 HD2 PRO 33 2HD PRO 33 -0.538 6.784 -14.434 262 HD3 PRO 33 3HD PRO 33 0.839 6.006 -13.679 263 H ALA 34 HN ALA 34 -3.934 4.619 -10.661 264 HA ALA 34 HA ALA 34 -5.853 4.827 -12.685 265 HB1 ALA 34 1HB ALA 34 -7.438 4.767 -10.693 266 HB2 ALA 34 2HB ALA 34 -6.254 3.441 -10.770 267 HB3 ALA 34 3HB ALA 34 -5.997 4.800 -9.650 268 H GLU 35 HN GLU 35 -4.125 7.230 -10.913 269 HA GLU 35 HA GLU 35 -6.222 9.148 -10.942 270 HB2 GLU 35 2HB GLU 35 -4.656 10.619 -9.918 271 HB3 GLU 35 3HB GLU 35 -4.255 9.033 -9.290 272 HG2 GLU 35 2HG GLU 35 -2.623 8.967 -11.421 273 HG3 GLU 35 3HG GLU 35 -2.759 10.711 -11.307 274 HE2 GLU 35 HE2 GLU 35 -0.460 8.616 -9.034 275 H ASP 36 HN ASP 36 -4.472 7.742 -13.390 276 HA ASP 36 HA ASP 36 -4.307 10.238 -14.880 277 HB2 ASP 36 2HB ASP 36 -2.939 7.537 -15.201 278 HB3 ASP 36 3HB ASP 36 -2.952 8.707 -16.506 279 HD2 ASP 36 HD2 ASP 36 0.033 8.745 -15.118 280 H ILE 37 HN ILE 37 -6.354 7.683 -14.252 281 HA ILE 37 HA ILE 37 -7.040 6.592 -16.683 282 HB ILE 37 HB ILE 37 -8.303 6.962 -14.045 283 HG12 ILE 37 2HG1 ILE 37 -7.795 4.672 -15.949 284 HG13 ILE 37 3HG1 ILE 37 -7.041 4.985 -14.398 285 HG21 ILE 37 1HG2 ILE 37 -9.970 6.334 -16.497 286 HG22 ILE 37 2HG2 ILE 37 -10.491 6.116 -14.809 287 HG23 ILE 37 3HG2 ILE 37 -10.134 7.746 -15.426 288 HD11 ILE 37 3HD1 ILE 37 -9.922 4.141 -14.915 289 HD12 ILE 37 1HD1 ILE 37 -8.666 3.247 -14.026 290 HD13 ILE 37 2HD1 ILE 37 -9.361 4.731 -13.333 291 HA PRO 38 HA PRO 38 -9.854 10.347 -17.287 292 HB2 PRO 38 2HB PRO 38 -9.529 12.556 -15.710 293 HB3 PRO 38 3HB PRO 38 -10.734 11.323 -15.396 294 HG2 PRO 38 2HG PRO 38 -8.175 11.813 -13.999 295 HG3 PRO 38 3HG PRO 38 -9.564 10.892 -13.456 296 HD2 PRO 38 2HD PRO 38 -7.095 9.839 -14.468 297 HD3 PRO 38 3HD PRO 38 -8.525 8.924 -14.034 298 H ARG 39 HN ARG 39 -6.563 10.326 -16.908 299 HA ARG 39 HA ARG 39 -6.277 12.698 -18.532 300 HB2 ARG 39 2HB ARG 39 -4.299 10.929 -17.027 301 HB3 ARG 39 3HB ARG 39 -3.752 12.155 -18.153 302 HG2 ARG 39 2HG ARG 39 -4.812 13.931 -16.861 303 HG3 ARG 39 3HG ARG 39 -5.647 12.774 -15.844 304 HD2 ARG 39 2HD ARG 39 -3.812 13.399 -14.494 305 HD3 ARG 39 3HD ARG 39 -3.249 11.905 -15.216 306 HE ARG 39 HE ARG 39 -2.264 14.617 -15.799 307 HH11 ARG 39 2HH2 ARG 39 -2.378 11.249 -16.891 308 HH12 ARG 39 1HH2 ARG 39 -0.971 11.395 -17.890 309 HH22 ARG 39 HH1 ARG 39 0.171 13.498 -18.008 310 H LEU 40 HN LEU 40 -6.415 9.227 -18.726 311 HA LEU 40 HA LEU 40 -4.826 9.071 -21.133 312 HB2 LEU 40 2HB LEU 40 -6.444 7.009 -19.630 313 HB3 LEU 40 3HB LEU 40 -5.461 6.679 -21.044 314 HG LEU 40 HG LEU 40 -4.216 7.940 -18.613 315 HD11 LEU 40 1HD1 LEU 40 -3.718 5.169 -18.480 316 HD12 LEU 40 2HD1 LEU 40 -4.628 6.179 -17.331 317 HD13 LEU 40 3HD1 LEU 40 -5.479 5.355 -18.660 318 HD21 LEU 40 3HD2 LEU 40 -3.021 5.976 -20.571 319 HD22 LEU 40 1HD2 LEU 40 -3.041 7.732 -20.860 320 HD23 LEU 40 2HD2 LEU 40 -2.188 7.073 -19.443 321 H ILE 41 HN ILE 41 -8.151 9.598 -20.145 322 HA ILE 41 HA ILE 41 -9.498 8.608 -22.343 323 HB ILE 41 HB ILE 41 -10.128 11.063 -20.700 324 HG12 ILE 41 2HG1 ILE 41 -10.397 8.130 -20.156 325 HG13 ILE 41 3HG1 ILE 41 -9.917 9.429 -19.082 326 HG21 ILE 41 1HG2 ILE 41 -12.050 9.249 -22.171 327 HG22 ILE 41 2HG2 ILE 41 -12.389 10.804 -21.374 328 HG23 ILE 41 3HG2 ILE 41 -11.404 10.760 -22.855 329 HD11 ILE 41 3HD1 ILE 41 -12.739 9.021 -20.176 330 HD12 ILE 41 1HD1 ILE 41 -12.194 8.588 -18.538 331 HD13 ILE 41 2HD1 ILE 41 -12.238 10.295 -19.039 332 H SER 42 HN SER 42 -9.881 9.307 -24.426 333 HA SER 42 HA SER 42 -9.883 10.666 -26.164 334 HB2 SER 42 2HB SER 42 -9.789 12.595 -24.329 335 HB3 SER 42 3HB SER 42 -8.126 12.748 -24.859 336 HG SER 42 HG SER 42 -9.983 12.583 -26.964 337 H MET 43 HN MET 43 -7.232 9.456 -24.389 338 HA MET 43 HA MET 43 -5.365 10.013 -26.538 339 HB2 MET 43 2HB MET 43 -4.807 8.540 -23.916 340 HB3 MET 43 3HB MET 43 -3.646 9.361 -24.941 341 HG2 MET 43 2HG MET 43 -5.285 11.468 -24.404 342 HG3 MET 43 3HG MET 43 -5.590 10.520 -22.962 343 HE1 MET 43 3HE MET 43 -1.950 9.323 -23.484 344 HE2 MET 43 1HE MET 43 -1.996 9.751 -21.757 345 HE3 MET 43 2HE MET 43 -3.382 8.921 -22.506 346 H GLN 44 HN GLN 44 -4.732 8.455 -27.998 347 HA GLN 44 HA GLN 44 -6.005 5.889 -27.703 348 HB2 GLN 44 2HB GLN 44 -4.303 6.840 -30.038 349 HB3 GLN 44 3HB GLN 44 -5.499 5.559 -30.040 350 HG2 GLN 44 2HG GLN 44 -7.326 7.106 -29.837 351 HG3 GLN 44 3HG GLN 44 -6.273 8.418 -29.347 352 HE21 GLN 44 1HE2 GLN 44 -7.322 6.378 -31.989 353 HE22 GLN 44 2HE2 GLN 44 -6.784 7.375 -33.299 354 H VAL 45 HN VAL 45 -4.846 3.856 -27.786 355 HA VAL 45 HA VAL 45 -2.311 4.009 -26.468 356 HB VAL 45 HB VAL 45 -2.514 1.482 -26.663 357 HG11 VAL 45 1HG1 VAL 45 -4.752 3.020 -25.301 358 HG12 VAL 45 2HG1 VAL 45 -4.239 1.360 -24.912 359 HG13 VAL 45 3HG1 VAL 45 -3.126 2.723 -24.640 360 HG21 VAL 45 3HG2 VAL 45 -4.290 1.948 -28.639 361 HG22 VAL 45 1HG2 VAL 45 -4.289 0.466 -27.653 362 HG23 VAL 45 2HG2 VAL 45 -5.410 1.793 -27.264 363 H ASN 46 HN ASN 46 -0.316 3.018 -27.257 364 HA ASN 46 HA ASN 46 -0.151 3.338 -30.136 365 HB2 ASN 46 2HB ASN 46 2.330 3.513 -29.714 366 HB3 ASN 46 3HB ASN 46 1.418 4.729 -28.843 367 HD21 ASN 46 1HD2 ASN 46 1.916 5.007 -26.816 368 HD22 ASN 46 2HD2 ASN 46 2.621 3.852 -25.735 369 H GLN 47 HN GLN 47 -1.267 0.915 -28.795 370 HA GLN 47 HA GLN 47 0.055 -1.024 -30.231 371 HB2 GLN 47 2HB GLN 47 1.905 -1.074 -28.770 372 HB3 GLN 47 3HB GLN 47 0.927 -0.776 -27.347 373 HG2 GLN 47 2HG GLN 47 -0.091 -3.048 -27.564 374 HG3 GLN 47 3HG GLN 47 0.871 -3.347 -28.998 375 HE21 GLN 47 1HE2 GLN 47 1.569 -1.827 -25.852 376 HE22 GLN 47 2HE2 GLN 47 2.909 -2.833 -25.414 377 H VAL 48 HN VAL 48 -0.897 -3.247 -29.801 378 HA VAL 48 HA VAL 48 -3.658 -2.923 -29.111 379 HB VAL 48 HB VAL 48 -1.909 -5.045 -30.274 380 HG11 VAL 48 1HG1 VAL 48 -3.026 -6.504 -28.862 381 HG12 VAL 48 2HG1 VAL 48 -4.509 -5.520 -28.839 382 HG13 VAL 48 3HG1 VAL 48 -4.101 -6.481 -30.280 383 HG21 VAL 48 3HG2 VAL 48 -4.579 -3.869 -31.119 384 HG22 VAL 48 1HG2 VAL 48 -2.982 -3.350 -31.711 385 HG23 VAL 48 2HG2 VAL 48 -3.572 -4.992 -32.064 386 H VAL 49 HN VAL 49 -4.235 -2.790 -26.998 387 HA VAL 49 HA VAL 49 -2.837 -4.590 -25.144 388 HB VAL 49 HB VAL 49 -2.410 -2.635 -24.150 389 HG11 VAL 49 1HG1 VAL 49 -3.796 -0.546 -24.500 390 HG12 VAL 49 2HG1 VAL 49 -3.030 -1.212 -25.962 391 HG13 VAL 49 3HG1 VAL 49 -4.765 -1.477 -25.667 392 HG21 VAL 49 3HG2 VAL 49 -3.799 -2.244 -22.355 393 HG22 VAL 49 1HG2 VAL 49 -5.282 -2.353 -23.333 394 HG23 VAL 49 2HG2 VAL 49 -4.400 -3.833 -22.886 395 HA PRO 50 HA PRO 50 -6.740 -6.566 -25.074 396 HB2 PRO 50 2HB PRO 50 -5.977 -8.758 -23.632 397 HB3 PRO 50 3HB PRO 50 -5.805 -8.649 -25.372 398 HG2 PRO 50 2HG PRO 50 -3.722 -8.429 -23.286 399 HG3 PRO 50 3HG PRO 50 -3.531 -8.746 -24.999 400 HD2 PRO 50 2HD PRO 50 -3.040 -6.264 -23.649 401 HD3 PRO 50 3HD PRO 50 -2.961 -6.551 -25.376 402 H MET 51 HN MET 51 -8.370 -7.377 -23.491 403 HA MET 51 HA MET 51 -8.545 -5.449 -21.486 404 HB2 MET 51 2HB MET 51 -10.528 -6.525 -22.510 405 HB3 MET 51 3HB MET 51 -10.006 -8.104 -21.958 406 HG2 MET 51 2HG MET 51 -10.064 -6.822 -19.555 407 HG3 MET 51 3HG MET 51 -11.266 -5.866 -20.398 408 HE1 MET 51 3HE MET 51 -13.536 -8.842 -21.800 409 HE2 MET 51 1HE MET 51 -13.529 -7.073 -21.602 410 HE3 MET 51 2HE MET 51 -12.223 -7.872 -22.509 411 H GLY 52 HN GLY 52 -7.719 -5.387 -19.435 412 HA2 GLY 52 1HA GLY 52 -7.350 -6.433 -17.344 413 HA3 GLY 52 2HA GLY 52 -7.002 -7.945 -18.159 414 H THR 53 HN THR 53 -5.477 -6.050 -20.249 415 HA THR 53 HA THR 53 -2.917 -6.462 -19.020 416 HB THR 53 HB THR 53 -3.923 -5.341 -21.679 417 HG1 THR 53 HG1 THR 53 -3.908 -7.716 -20.928 418 HG21 THR 53 3HG2 THR 53 -1.834 -4.482 -22.037 419 HG22 THR 53 1HG2 THR 53 -1.273 -5.070 -20.454 420 HG23 THR 53 2HG2 THR 53 -1.202 -6.138 -21.876 421 H THR 54 HN THR 54 -2.026 -5.164 -17.555 422 HA THR 54 HA THR 54 -3.010 -2.714 -16.801 423 HB THR 54 HB THR 54 -0.057 -3.450 -16.676 424 HG1 THR 54 HG1 THR 54 -0.691 -5.181 -15.390 425 HG21 THR 54 3HG2 THR 54 -0.457 -2.768 -14.255 426 HG22 THR 54 1HG2 THR 54 -0.687 -1.437 -15.414 427 HG23 THR 54 2HG2 THR 54 -2.100 -2.270 -14.723 428 H LEU 55 HN LEU 55 -2.835 -0.614 -17.411 429 HA LEU 55 HA LEU 55 -1.771 -0.177 -20.045 430 HB2 LEU 55 2HB LEU 55 -3.948 0.733 -18.942 431 HB3 LEU 55 3HB LEU 55 -2.890 1.945 -18.246 432 HG LEU 55 HG LEU 55 -2.298 2.815 -20.378 433 HD11 LEU 55 1HD1 LEU 55 -1.901 0.939 -21.725 434 HD12 LEU 55 2HD1 LEU 55 -3.549 0.308 -21.494 435 HD13 LEU 55 3HD1 LEU 55 -3.284 1.758 -22.491 436 HD21 LEU 55 3HD2 LEU 55 -4.315 3.784 -19.790 437 HD22 LEU 55 1HD2 LEU 55 -4.651 3.171 -21.427 438 HD23 LEU 55 2HD2 LEU 55 -5.230 2.272 -20.004 439 H MET 56 HN MET 56 0.157 0.749 -20.581 440 HA MET 56 HA MET 56 1.792 1.556 -18.309 441 HB2 MET 56 2HB MET 56 2.359 0.374 -21.057 442 HB3 MET 56 3HB MET 56 3.627 1.267 -20.241 443 HG2 MET 56 2HG MET 56 2.153 -0.881 -18.701 444 HG3 MET 56 3HG MET 56 3.358 -1.369 -19.876 445 HE1 MET 56 3HE MET 56 4.049 -0.160 -15.700 446 HE2 MET 56 1HE MET 56 2.495 -0.267 -16.560 447 HE3 MET 56 2HE MET 56 3.540 -1.702 -16.430 448 HA PRO 57 HA PRO 57 2.130 5.581 -19.896 449 HB2 PRO 57 2HB PRO 57 4.675 6.330 -19.242 450 HB3 PRO 57 3HB PRO 57 3.355 6.312 -18.089 451 HG2 PRO 57 2HG PRO 57 5.603 4.411 -18.364 452 HG3 PRO 57 3HG PRO 57 4.537 4.660 -16.995 453 HD2 PRO 57 2HD PRO 57 4.432 2.502 -18.881 454 HD3 PRO 57 3HD PRO 57 3.298 2.815 -17.583 455 H ASP 58 HN ASP 58 4.372 3.258 -21.054 456 HA ASP 58 HA ASP 58 5.041 5.018 -23.246 457 HB2 ASP 58 2HB ASP 58 6.904 3.792 -22.276 458 HB3 ASP 58 3HB ASP 58 6.030 2.275 -22.361 459 HD2 ASP 58 HD2 ASP 58 7.140 1.102 -23.876 460 H MET 59 HN MET 59 2.440 3.227 -22.484 461 HA MET 59 HA MET 59 2.266 1.948 -25.101 462 HB2 MET 59 2HB MET 59 1.165 1.315 -22.348 463 HB3 MET 59 3HB MET 59 0.211 0.820 -23.733 464 HG2 MET 59 2HG MET 59 2.561 -0.146 -24.597 465 HG3 MET 59 3HG MET 59 2.960 -0.115 -22.891 466 HE1 MET 59 3HE MET 59 -0.470 -1.992 -21.681 467 HE2 MET 59 1HE MET 59 0.873 -0.986 -21.087 468 HE3 MET 59 2HE MET 59 -0.352 -0.285 -22.171 469 H VAL 60 HN VAL 60 1.730 4.855 -24.214 470 HA VAL 60 HA VAL 60 -0.887 5.002 -25.479 471 HB VAL 60 HB VAL 60 -0.236 6.461 -22.913 472 HG11 VAL 60 1HG1 VAL 60 -2.550 7.157 -22.942 473 HG12 VAL 60 2HG1 VAL 60 -1.803 7.588 -24.499 474 HG13 VAL 60 3HG1 VAL 60 -2.874 6.170 -24.387 475 HG21 VAL 60 3HG2 VAL 60 -2.074 4.074 -23.301 476 HG22 VAL 60 1HG2 VAL 60 -0.475 4.028 -22.521 477 HG23 VAL 60 2HG2 VAL 60 -1.796 4.968 -21.787 478 H LYS 61 HN LYS 61 -1.076 6.762 -26.858 479 HA LYS 61 HA LYS 61 1.392 8.207 -27.297 480 HB2 LYS 61 2HB LYS 61 -1.209 8.131 -28.856 481 HB3 LYS 61 3HB LYS 61 0.237 8.991 -29.348 482 HG2 LYS 61 2HG LYS 61 1.471 6.708 -29.112 483 HG3 LYS 61 3HG LYS 61 -0.123 5.984 -29.030 484 HD2 LYS 61 2HD LYS 61 -0.554 7.448 -31.230 485 HD3 LYS 61 3HD LYS 61 1.194 7.416 -31.344 486 HE2 LYS 61 2HE LYS 61 1.065 4.864 -31.100 487 HE3 LYS 61 3HE LYS 61 -0.675 5.004 -31.248 488 HZ1 LYS 61 2HZ LYS 61 1.266 5.954 -33.288 489 HZ3 LYS 61 1HZ LYS 61 -0.353 6.048 -33.427 490 H GLY 62 HN GLY 62 1.517 10.542 -27.383 491 HA2 GLY 62 1HA GLY 62 1.187 12.583 -26.506 492 HA3 GLY 62 2HA GLY 62 -0.525 12.299 -26.749 493 H TYR 63 HN TYR 63 1.111 9.966 -24.716 494 HA TYR 63 HA TYR 63 -0.430 10.869 -22.456 495 HB2 TYR 63 2HB TYR 63 -0.236 8.472 -22.913 496 HB3 TYR 63 3HB TYR 63 1.487 8.598 -23.207 497 HD1 TYR 63 HD1 TYR 63 3.076 8.798 -21.311 498 HD2 TYR 63 HD2 TYR 63 -1.116 8.234 -20.670 499 HE1 TYR 63 HE1 TYR 63 3.528 8.118 -18.904 500 HE2 TYR 63 HE2 TYR 63 -0.650 7.556 -18.264 501 HH TYR 63 HH TYR 63 1.199 8.046 -16.584 502 H ALA 64 HN ALA 64 0.790 10.703 -20.212 503 HA ALA 64 HA ALA 64 3.448 11.213 -19.917 504 HB1 ALA 64 1HB ALA 64 3.011 13.864 -19.507 505 HB2 ALA 64 2HB ALA 64 3.655 13.198 -21.028 506 HB3 ALA 64 3HB ALA 64 1.922 13.579 -20.886 507 HA PRO 65 HA PRO 65 1.926 11.099 -15.869 508 HB2 PRO 65 2HB PRO 65 4.151 11.791 -14.440 509 HB3 PRO 65 3HB PRO 65 3.885 10.181 -15.080 510 HG2 PRO 65 2HG PRO 65 5.711 12.288 -16.063 511 HG3 PRO 65 3HG PRO 65 5.733 10.569 -16.405 512 HD2 PRO 65 2HD PRO 65 4.797 12.653 -18.140 513 HD3 PRO 65 3HD PRO 65 4.712 10.927 -18.434 514 H ALA 66 HN ALA 66 1.980 12.391 -13.645 515 HA ALA 66 HA ALA 66 1.845 15.228 -14.313 516 HB1 ALA 66 1HB ALA 66 -0.395 13.987 -12.728 517 HB2 ALA 66 2HB ALA 66 -0.382 15.483 -13.692 518 HB3 ALA 66 3HB ALA 66 -0.434 13.901 -14.505 Start of MODEL 16 1 H1 MET 0 HN MET 0 2.735 -2.434 -0.286 2 HA MET 0 HA MET 0 1.145 0.015 -0.229 3 HB2 MET 0 2HB MET 0 2.580 0.545 -2.367 4 HB3 MET 0 3HB MET 0 3.364 0.708 -0.808 5 HG2 MET 0 2HG MET 0 4.332 -1.582 -1.041 6 HG3 MET 0 3HG MET 0 3.523 -1.778 -2.583 7 HE1 MET 0 3HE MET 0 3.822 -0.245 -4.575 8 HE2 MET 0 1HE MET 0 3.866 1.341 -3.769 9 HE3 MET 0 2HE MET 0 5.194 0.856 -4.850 10 H ASN 1 HN ASN 1 -0.724 -0.072 -1.403 11 HA ASN 1 HA ASN 1 -0.766 -1.968 -3.610 12 HB2 ASN 1 2HB ASN 1 -3.039 -1.449 -1.620 13 HB3 ASN 1 3HB ASN 1 -3.144 -2.510 -3.011 14 HD21 ASN 1 1HD2 ASN 1 -3.083 -4.536 -2.448 15 HD22 ASN 1 2HD2 ASN 1 -2.080 -5.268 -1.241 16 H GLN 2 HN GLN 2 -0.490 -0.168 -5.105 17 HA GLN 2 HA GLN 2 -2.533 1.888 -4.936 18 HB2 GLN 2 2HB GLN 2 -1.089 3.302 -6.145 19 HB3 GLN 2 3HB GLN 2 0.013 2.390 -5.133 20 HG2 GLN 2 2HG GLN 2 1.032 2.256 -7.259 21 HG3 GLN 2 3HG GLN 2 0.186 0.726 -7.141 22 HE21 GLN 2 1HE2 GLN 2 -0.777 4.078 -7.886 23 HE22 GLN 2 2HE2 GLN 2 -1.570 3.749 -9.390 24 H GLU 3 HN GLU 3 -4.121 2.125 -6.509 25 HA GLU 3 HA GLU 3 -4.547 -0.085 -8.184 26 HB2 GLU 3 2HB GLU 3 -5.930 2.490 -7.561 27 HB3 GLU 3 3HB GLU 3 -6.314 1.781 -9.117 28 HG2 GLU 3 2HG GLU 3 -6.802 -0.413 -7.938 29 HG3 GLU 3 3HG GLU 3 -6.540 0.394 -6.405 30 HE2 GLU 3 HE2 GLU 3 -9.434 2.398 -6.765 31 H SER 4 HN SER 4 -4.151 -0.384 -10.379 32 HA SER 4 HA SER 4 -2.879 1.883 -11.704 33 HB2 SER 4 2HB SER 4 -2.186 -0.851 -12.663 34 HB3 SER 4 3HB SER 4 -1.164 0.560 -12.478 35 HG SER 4 HG SER 4 -1.473 -1.563 -10.783 36 H VAL 5 HN VAL 5 -3.411 2.198 -13.948 37 HA VAL 5 HA VAL 5 -5.998 1.573 -14.670 38 HB VAL 5 HB VAL 5 -3.585 2.353 -16.312 39 HG11 VAL 5 1HG1 VAL 5 -6.491 2.549 -17.157 40 HG12 VAL 5 2HG1 VAL 5 -5.044 2.920 -18.125 41 HG13 VAL 5 3HG1 VAL 5 -5.399 1.238 -17.664 42 HG21 VAL 5 3HG2 VAL 5 -5.775 4.278 -15.852 43 HG22 VAL 5 1HG2 VAL 5 -4.889 3.794 -14.387 44 HG23 VAL 5 2HG2 VAL 5 -4.011 4.499 -15.766 45 H VAL 6 HN VAL 6 -6.990 -0.110 -15.736 46 HA VAL 6 HA VAL 6 -5.250 -2.162 -16.876 47 HB VAL 6 HB VAL 6 -7.393 -2.569 -14.786 48 HG11 VAL 6 1HG1 VAL 6 -7.481 -4.182 -16.783 49 HG12 VAL 6 2HG1 VAL 6 -5.914 -4.795 -16.201 50 HG13 VAL 6 3HG1 VAL 6 -7.353 -4.896 -15.157 51 HG21 VAL 6 3HG2 VAL 6 -5.671 -2.618 -13.370 52 HG22 VAL 6 1HG2 VAL 6 -5.035 -4.038 -14.235 53 HG23 VAL 6 2HG2 VAL 6 -4.518 -2.402 -14.709 54 H ALA 7 HN ALA 7 -5.907 -2.659 -18.904 55 HA ALA 7 HA ALA 7 -7.961 -1.393 -20.174 56 HB1 ALA 7 1HB ALA 7 -7.775 -3.558 -21.700 57 HB2 ALA 7 2HB ALA 7 -6.423 -2.406 -21.582 58 HB3 ALA 7 3HB ALA 7 -6.391 -3.915 -20.639 59 H ALA 8 HN ALA 8 -9.998 -1.307 -19.271 60 HA ALA 8 HA ALA 8 -11.189 -3.473 -17.947 61 HB1 ALA 8 1HB ALA 8 -12.849 -1.963 -17.536 62 HB2 ALA 8 2HB ALA 8 -11.658 -0.799 -18.162 63 HB3 ALA 8 3HB ALA 8 -12.930 -1.433 -19.233 64 H VAL 9 HN VAL 9 -10.524 -2.920 -21.268 65 HA VAL 9 HA VAL 9 -12.054 -5.246 -21.971 66 HB VAL 9 HB VAL 9 -13.262 -4.114 -23.802 67 HG11 VAL 9 1HG1 VAL 9 -14.321 -4.623 -21.593 68 HG12 VAL 9 2HG1 VAL 9 -13.961 -2.956 -21.085 69 HG13 VAL 9 3HG1 VAL 9 -15.064 -3.251 -22.451 70 HG21 VAL 9 3HG2 VAL 9 -12.676 -2.048 -24.405 71 HG22 VAL 9 1HG2 VAL 9 -13.396 -1.449 -22.891 72 HG23 VAL 9 2HG2 VAL 9 -11.664 -1.859 -22.952 73 H LEU 10 HN LEU 10 -11.690 -5.642 -24.480 74 HA LEU 10 HA LEU 10 -8.896 -5.676 -24.830 75 HB2 LEU 10 2HB LEU 10 -10.040 -7.469 -25.732 76 HB3 LEU 10 3HB LEU 10 -11.284 -6.464 -26.450 77 HG LEU 10 HG LEU 10 -9.237 -5.582 -27.911 78 HD11 LEU 10 1HD1 LEU 10 -7.417 -6.902 -28.112 79 HD12 LEU 10 2HD1 LEU 10 -7.844 -7.367 -26.448 80 HD13 LEU 10 3HD1 LEU 10 -8.328 -8.401 -27.813 81 HD21 LEU 10 3HD2 LEU 10 -10.762 -6.375 -29.331 82 HD22 LEU 10 1HD2 LEU 10 -9.838 -7.896 -29.292 83 HD23 LEU 10 2HD2 LEU 10 -11.246 -7.682 -28.224 84 H ILE 11 HN ILE 11 -8.004 -3.601 -24.800 85 HA ILE 11 HA ILE 11 -9.111 -1.605 -26.563 86 HB ILE 11 HB ILE 11 -6.531 -1.277 -25.103 87 HG12 ILE 11 2HG1 ILE 11 -9.202 -1.753 -23.831 88 HG13 ILE 11 3HG1 ILE 11 -7.609 -2.275 -23.319 89 HG21 ILE 11 1HG2 ILE 11 -8.910 0.547 -25.551 90 HG22 ILE 11 2HG2 ILE 11 -7.362 0.992 -24.793 91 HG23 ILE 11 3HG2 ILE 11 -7.411 0.530 -26.511 92 HD11 ILE 11 3HD1 ILE 11 -8.598 0.615 -23.270 93 HD12 ILE 11 1HD1 ILE 11 -8.497 -0.465 -21.858 94 HD13 ILE 11 2HD1 ILE 11 -7.012 0.047 -22.696 95 HA PRO 12 HA PRO 12 -6.522 -3.040 -29.787 96 HB2 PRO 12 2HB PRO 12 -7.642 -1.555 -31.788 97 HB3 PRO 12 3HB PRO 12 -8.258 -3.120 -31.297 98 HG2 PRO 12 2HG PRO 12 -9.364 -0.435 -30.741 99 HG3 PRO 12 3HG PRO 12 -10.160 -1.993 -30.637 100 HD2 PRO 12 2HD PRO 12 -9.189 -0.413 -28.449 101 HD3 PRO 12 3HD PRO 12 -9.880 -2.021 -28.356 102 H ILE 13 HN ILE 13 -5.091 -2.061 -31.556 103 HA ILE 13 HA ILE 13 -3.522 -0.116 -30.205 104 HB ILE 13 HB ILE 13 -2.592 -1.921 -31.574 105 HG12 ILE 13 2HG1 ILE 13 -1.853 0.761 -32.762 106 HG13 ILE 13 3HG1 ILE 13 -1.426 0.303 -31.125 107 HG21 ILE 13 1HG2 ILE 13 -2.976 -2.244 -33.786 108 HG22 ILE 13 2HG2 ILE 13 -4.521 -1.463 -33.371 109 HG23 ILE 13 3HG2 ILE 13 -3.215 -0.511 -34.118 110 HD11 ILE 13 3HD1 ILE 13 -0.419 -1.857 -32.180 111 HD12 ILE 13 1HD1 ILE 13 -0.542 -0.989 -33.728 112 HD13 ILE 13 2HD1 ILE 13 0.466 -0.331 -32.417 113 H ASN 14 HN ASN 14 -2.974 2.040 -31.003 114 HA ASN 14 HA ASN 14 -3.652 4.061 -31.466 115 HB2 ASN 14 2HB ASN 14 -4.817 2.952 -34.059 116 HB3 ASN 14 3HB ASN 14 -4.047 4.507 -33.811 117 HD21 ASN 14 1HD2 ASN 14 -1.904 3.544 -32.168 118 HD22 ASN 14 2HD2 ASN 14 -0.788 2.683 -33.175 119 H THR 15 HN THR 15 -5.526 2.959 -29.785 120 HA THR 15 HA THR 15 -8.098 3.761 -30.979 121 HB THR 15 HB THR 15 -7.463 1.536 -28.970 122 HG1 THR 15 HG1 THR 15 -7.053 0.967 -31.179 123 HG21 THR 15 3HG2 THR 15 -9.927 2.997 -29.456 124 HG22 THR 15 1HG2 THR 15 -10.087 1.356 -30.126 125 HG23 THR 15 2HG2 THR 15 -9.676 1.580 -28.409 126 H ALA 16 HN ALA 16 -9.147 5.402 -30.030 127 HA ALA 16 HA ALA 16 -7.908 6.903 -28.048 128 HB1 ALA 16 1HB ALA 16 -9.590 7.705 -29.715 129 HB2 ALA 16 2HB ALA 16 -10.853 6.826 -28.820 130 HB3 ALA 16 3HB ALA 16 -9.990 8.177 -28.046 131 H LEU 17 HN LEU 17 -8.020 6.943 -25.818 132 HA LEU 17 HA LEU 17 -9.242 4.613 -24.610 133 HB2 LEU 17 2HB LEU 17 -7.432 6.778 -23.533 134 HB3 LEU 17 3HB LEU 17 -8.060 5.452 -22.574 135 HG LEU 17 HG LEU 17 -6.346 5.082 -25.044 136 HD11 LEU 17 1HD1 LEU 17 -5.121 6.299 -23.285 137 HD12 LEU 17 2HD1 LEU 17 -5.489 4.989 -22.138 138 HD13 LEU 17 3HD1 LEU 17 -4.472 4.665 -23.562 139 HD21 LEU 17 3HD2 LEU 17 -7.333 3.045 -24.843 140 HD22 LEU 17 1HD2 LEU 17 -6.008 2.820 -23.676 141 HD23 LEU 17 2HD2 LEU 17 -7.640 3.234 -23.100 142 H THR 18 HN THR 18 -10.998 4.623 -23.222 143 HA THR 18 HA THR 18 -12.238 7.254 -22.763 144 HB THR 18 HB THR 18 -14.439 5.933 -23.087 145 HG1 THR 18 HG1 THR 18 -13.718 3.788 -23.066 146 HG21 THR 18 3HG2 THR 18 -14.042 7.223 -25.015 147 HG22 THR 18 1HG2 THR 18 -12.436 6.503 -25.282 148 HG23 THR 18 2HG2 THR 18 -13.903 5.584 -25.695 149 H VAL 19 HN VAL 19 -14.026 7.028 -20.995 150 HA VAL 19 HA VAL 19 -12.650 5.991 -18.707 151 HB VAL 19 HB VAL 19 -14.116 8.148 -19.066 152 HG11 VAL 19 1HG1 VAL 19 -16.145 6.753 -19.662 153 HG12 VAL 19 2HG1 VAL 19 -16.208 6.257 -17.954 154 HG13 VAL 19 3HG1 VAL 19 -16.396 7.972 -18.391 155 HG21 VAL 19 3HG2 VAL 19 -14.444 8.286 -16.651 156 HG22 VAL 19 1HG2 VAL 19 -14.239 6.524 -16.502 157 HG23 VAL 19 2HG2 VAL 19 -12.871 7.539 -17.020 158 H GLY 20 HN GLY 20 -14.817 4.739 -21.060 159 HA2 GLY 20 1HA GLY 20 -15.892 2.736 -19.187 160 HA3 GLY 20 2HA GLY 20 -16.523 3.127 -20.775 161 H MET 21 HN MET 21 -13.077 3.100 -20.770 162 HA MET 21 HA MET 21 -13.147 0.382 -21.833 163 HB2 MET 21 2HB MET 21 -11.892 2.948 -22.740 164 HB3 MET 21 3HB MET 21 -10.844 1.549 -22.869 165 HG2 MET 21 2HG MET 21 -13.196 0.528 -23.901 166 HG3 MET 21 3HG MET 21 -13.325 2.205 -24.393 167 HE1 MET 21 3HE MET 21 -11.120 3.497 -25.348 168 HE2 MET 21 1HE MET 21 -9.940 2.643 -24.324 169 HE3 MET 21 2HE MET 21 -9.740 2.655 -26.093 170 H MET 22 HN MET 22 -11.490 2.749 -19.742 171 HA MET 22 HA MET 22 -9.521 0.733 -19.063 172 HB2 MET 22 2HB MET 22 -9.820 3.721 -18.455 173 HB3 MET 22 3HB MET 22 -8.564 2.747 -17.715 174 HG2 MET 22 2HG MET 22 -7.532 2.267 -19.847 175 HG3 MET 22 3HG MET 22 -8.926 2.842 -20.740 176 HE1 MET 22 3HE MET 22 -9.830 5.473 -19.472 177 HE2 MET 22 1HE MET 22 -8.828 6.657 -20.344 178 HE3 MET 22 2HE MET 22 -9.508 5.258 -21.210 179 H THR 23 HN THR 23 -8.892 0.835 -16.549 180 HA THR 23 HA THR 23 -11.049 1.369 -14.763 181 HB THR 23 HB THR 23 -11.651 -0.840 -16.051 182 HG1 THR 23 HG1 THR 23 -12.813 -0.720 -14.166 183 HG21 THR 23 3HG2 THR 23 -9.089 -1.610 -15.232 184 HG22 THR 23 1HG2 THR 23 -10.130 -2.300 -13.964 185 HG23 THR 23 2HG2 THR 23 -10.401 -2.732 -15.669 186 H THR 24 HN THR 24 -10.473 0.450 -12.492 187 HA THR 24 HA THR 24 -7.549 0.696 -12.216 188 HB THR 24 HB THR 24 -8.067 1.811 -10.056 189 HG1 THR 24 HG1 THR 24 -10.109 0.508 -9.842 190 HG21 THR 24 3HG2 THR 24 -9.811 2.890 -12.335 191 HG22 THR 24 1HG2 THR 24 -9.369 3.795 -10.868 192 HG23 THR 24 2HG2 THR 24 -8.112 3.327 -12.038 193 H ARG 25 HN ARG 25 -6.441 -0.925 -11.297 194 HA ARG 25 HA ARG 25 -7.777 -2.634 -9.460 195 HB2 ARG 25 2HB ARG 25 -7.672 -3.392 -12.231 196 HB3 ARG 25 3HB ARG 25 -6.521 -4.412 -11.391 197 HG2 ARG 25 2HG ARG 25 -8.268 -5.693 -10.719 198 HG3 ARG 25 3HG ARG 25 -8.755 -4.373 -9.674 199 HD2 ARG 25 2HD ARG 25 -10.560 -3.883 -10.979 200 HD3 ARG 25 3HD ARG 25 -9.592 -3.866 -12.441 201 HE ARG 25 HE ARG 25 -9.755 -6.542 -11.982 202 HH11 ARG 25 2HH2 ARG 25 -12.267 -4.045 -11.917 203 HH12 ARG 25 1HH2 ARG 25 -13.533 -5.131 -12.384 204 HH22 ARG 25 HH1 ARG 25 -13.015 -7.437 -12.780 205 H VAL 26 HN VAL 26 -6.259 -3.687 -8.077 206 HA VAL 26 HA VAL 26 -3.611 -2.637 -8.200 207 HB VAL 26 HB VAL 26 -4.803 -4.747 -6.392 208 HG11 VAL 26 1HG1 VAL 26 -2.155 -3.827 -6.648 209 HG12 VAL 26 2HG1 VAL 26 -2.805 -3.023 -5.199 210 HG13 VAL 26 3HG1 VAL 26 -2.844 -4.799 -5.324 211 HG21 VAL 26 3HG2 VAL 26 -4.549 -1.839 -5.657 212 HG22 VAL 26 1HG2 VAL 26 -5.964 -2.412 -6.573 213 HG23 VAL 26 2HG2 VAL 26 -5.606 -3.095 -4.969 214 H VAL 27 HN VAL 27 -2.932 -3.448 -10.316 215 HA VAL 27 HA VAL 27 -2.425 -6.337 -10.307 216 HB VAL 27 HB VAL 27 -2.387 -6.244 -12.656 217 HG11 VAL 27 1HG1 VAL 27 -4.641 -5.897 -11.396 218 HG12 VAL 27 2HG1 VAL 27 -4.582 -4.259 -12.090 219 HG13 VAL 27 3HG1 VAL 27 -4.589 -5.680 -13.162 220 HG21 VAL 27 3HG2 VAL 27 -1.090 -4.384 -13.226 221 HG22 VAL 27 1HG2 VAL 27 -2.709 -3.956 -13.829 222 HG23 VAL 27 2HG2 VAL 27 -2.116 -3.260 -12.302 223 H SER 28 HN SER 28 -0.289 -7.035 -11.210 224 HA SER 28 HA SER 28 1.732 -4.995 -10.716 225 HB2 SER 28 2HB SER 28 1.319 -6.937 -8.917 226 HB3 SER 28 3HB SER 28 2.291 -7.877 -10.031 227 HG SER 28 HG SER 28 4.028 -6.433 -9.778 228 HA PRO 29 HA PRO 29 3.607 -4.737 -10.995 229 HB2 PRO 29 2HB PRO 29 5.033 -3.160 -12.713 230 HB3 PRO 29 3HB PRO 29 5.720 -4.549 -11.893 231 HG2 PRO 29 2HG PRO 29 4.905 -4.284 -14.722 232 HG3 PRO 29 3HG PRO 29 5.961 -5.476 -13.991 233 HD2 PRO 29 2HD PRO 29 3.233 -5.860 -14.791 234 HD3 PRO 29 3HD PRO 29 4.253 -7.014 -13.955 235 H THR 30 HN THR 30 3.130 -2.574 -10.372 236 HA THR 30 HA THR 30 0.624 -1.772 -11.445 237 HB THR 30 HB THR 30 1.116 0.204 -9.832 238 HG1 THR 30 HG1 THR 30 3.067 -0.528 -8.463 239 HG21 THR 30 3HG2 THR 30 0.875 -1.135 -7.819 240 HG22 THR 30 1HG2 THR 30 -0.010 -2.000 -9.099 241 HG23 THR 30 2HG2 THR 30 1.608 -2.554 -8.606 242 H GLY 31 HN GLY 31 0.202 -0.677 -13.247 243 HA2 GLY 31 1HA GLY 31 2.412 0.758 -14.532 244 HA3 GLY 31 2HA GLY 31 0.903 0.254 -15.267 245 H ILE 32 HN ILE 32 0.365 2.334 -16.088 246 HA ILE 32 HA ILE 32 0.539 4.729 -14.886 247 HB ILE 32 HB ILE 32 -1.673 3.632 -16.618 248 HG12 ILE 32 2HG1 ILE 32 0.587 5.449 -17.450 249 HG13 ILE 32 3HG1 ILE 32 0.796 3.710 -17.395 250 HG21 ILE 32 1HG2 ILE 32 -1.082 6.565 -16.317 251 HG22 ILE 32 2HG2 ILE 32 -2.536 5.757 -16.951 252 HG23 ILE 32 3HG2 ILE 32 -2.201 5.743 -15.203 253 HD11 ILE 32 3HD1 ILE 32 -0.123 4.992 -19.592 254 HD12 ILE 32 1HD1 ILE 32 -0.620 3.333 -19.183 255 HD13 ILE 32 2HD1 ILE 32 -1.676 4.706 -18.771 256 HA PRO 33 HA PRO 33 -2.003 4.588 -11.393 257 HB2 PRO 33 2HB PRO 33 -2.203 7.258 -10.844 258 HB3 PRO 33 3HB PRO 33 -0.819 6.286 -10.385 259 HG2 PRO 33 2HG PRO 33 -1.055 8.261 -12.573 260 HG3 PRO 33 3HG PRO 33 0.394 7.607 -11.835 261 HD2 PRO 33 2HD PRO 33 -0.715 6.879 -14.378 262 HD3 PRO 33 3HD PRO 33 0.666 6.145 -13.589 263 H ALA 34 HN ALA 34 -4.123 4.722 -10.613 264 HA ALA 34 HA ALA 34 -6.009 4.868 -12.689 265 HB1 ALA 34 1HB ALA 34 -7.611 4.827 -10.655 266 HB2 ALA 34 2HB ALA 34 -6.499 3.452 -10.860 267 HB3 ALA 34 3HB ALA 34 -6.135 4.720 -9.665 268 H GLU 35 HN GLU 35 -4.367 7.298 -10.883 269 HA GLU 35 HA GLU 35 -6.514 9.161 -10.912 270 HB2 GLU 35 2HB GLU 35 -4.990 10.668 -9.870 271 HB3 GLU 35 3HB GLU 35 -4.567 9.088 -9.240 272 HG2 GLU 35 2HG GLU 35 -2.909 9.061 -11.354 273 HG3 GLU 35 3HG GLU 35 -3.076 10.801 -11.229 274 HE2 GLU 35 HE2 GLU 35 -1.731 8.445 -8.371 275 H ASP 36 HN ASP 36 -4.505 7.868 -13.301 276 HA ASP 36 HA ASP 36 -4.462 10.364 -14.785 277 HB2 ASP 36 2HB ASP 36 -3.044 7.692 -15.170 278 HB3 ASP 36 3HB ASP 36 -3.008 8.950 -16.389 279 HD2 ASP 36 HD2 ASP 36 -0.033 9.059 -14.540 280 H ILE 37 HN ILE 37 -6.426 7.712 -14.233 281 HA ILE 37 HA ILE 37 -7.042 6.649 -16.690 282 HB ILE 37 HB ILE 37 -8.360 6.935 -14.069 283 HG12 ILE 37 2HG1 ILE 37 -7.722 4.706 -16.001 284 HG13 ILE 37 3HG1 ILE 37 -7.053 4.998 -14.408 285 HG21 ILE 37 1HG2 ILE 37 -10.177 7.696 -15.509 286 HG22 ILE 37 2HG2 ILE 37 -9.978 6.261 -16.542 287 HG23 ILE 37 3HG2 ILE 37 -10.515 6.076 -14.855 288 HD11 ILE 37 3HD1 ILE 37 -8.671 3.170 -14.266 289 HD12 ILE 37 1HD1 ILE 37 -9.330 4.583 -13.408 290 HD13 ILE 37 2HD1 ILE 37 -9.924 4.173 -15.035 291 HA PRO 38 HA PRO 38 -9.962 10.324 -17.287 292 HB2 PRO 38 2HB PRO 38 -9.730 12.519 -15.675 293 HB3 PRO 38 3HB PRO 38 -10.901 11.245 -15.397 294 HG2 PRO 38 2HG PRO 38 -8.381 11.793 -13.952 295 HG3 PRO 38 3HG PRO 38 -9.749 10.822 -13.444 296 HD2 PRO 38 2HD PRO 38 -7.234 9.859 -14.431 297 HD3 PRO 38 3HD PRO 38 -8.642 8.895 -14.033 298 H ARG 39 HN ARG 39 -6.685 10.369 -16.889 299 HA ARG 39 HA ARG 39 -6.433 12.790 -18.443 300 HB2 ARG 39 2HB ARG 39 -4.533 11.068 -16.832 301 HB3 ARG 39 3HB ARG 39 -3.867 12.091 -18.089 302 HG2 ARG 39 2HG ARG 39 -4.768 14.099 -17.060 303 HG3 ARG 39 3HG ARG 39 -5.757 13.168 -15.953 304 HD2 ARG 39 2HD ARG 39 -3.962 13.684 -14.552 305 HD3 ARG 39 3HD ARG 39 -3.415 12.144 -15.184 306 HE ARG 39 HE ARG 39 -2.316 14.796 -15.829 307 HH11 ARG 39 2HH2 ARG 39 -2.495 11.392 -16.794 308 HH12 ARG 39 1HH2 ARG 39 -1.041 11.453 -17.733 309 HH22 ARG 39 HH1 ARG 39 0.175 13.512 -17.881 310 H LEU 40 HN LEU 40 -6.334 9.282 -18.671 311 HA LEU 40 HA LEU 40 -4.792 9.239 -21.092 312 HB2 LEU 40 2HB LEU 40 -6.398 7.099 -19.686 313 HB3 LEU 40 3HB LEU 40 -5.357 6.837 -21.072 314 HG LEU 40 HG LEU 40 -4.307 7.994 -18.486 315 HD11 LEU 40 1HD1 LEU 40 -4.460 6.047 -17.438 316 HD12 LEU 40 2HD1 LEU 40 -5.376 5.390 -18.816 317 HD13 LEU 40 3HD1 LEU 40 -3.603 5.231 -18.768 318 HD21 LEU 40 3HD2 LEU 40 -2.380 6.427 -19.805 319 HD22 LEU 40 1HD2 LEU 40 -3.177 7.393 -21.070 320 HD23 LEU 40 2HD2 LEU 40 -2.440 8.200 -19.665 321 H ILE 41 HN ILE 41 -8.135 9.688 -20.136 322 HA ILE 41 HA ILE 41 -9.442 8.725 -22.370 323 HB ILE 41 HB ILE 41 -10.124 11.139 -20.688 324 HG12 ILE 41 2HG1 ILE 41 -10.358 8.194 -20.203 325 HG13 ILE 41 3HG1 ILE 41 -9.915 9.480 -19.098 326 HG21 ILE 41 1HG2 ILE 41 -11.919 9.342 -22.340 327 HG22 ILE 41 2HG2 ILE 41 -12.421 10.732 -21.349 328 HG23 ILE 41 3HG2 ILE 41 -11.405 10.986 -22.788 329 HD11 ILE 41 3HD1 ILE 41 -12.253 10.310 -19.081 330 HD12 ILE 41 1HD1 ILE 41 -12.713 9.039 -20.240 331 HD13 ILE 41 2HD1 ILE 41 -12.184 8.598 -18.599 332 H SER 42 HN SER 42 -9.825 9.466 -24.440 333 HA SER 42 HA SER 42 -9.824 10.860 -26.150 334 HB2 SER 42 2HB SER 42 -9.763 12.753 -24.281 335 HB3 SER 42 3HB SER 42 -8.093 12.925 -24.783 336 HG SER 42 HG SER 42 -9.853 12.786 -26.948 337 H MET 43 HN MET 43 -7.178 9.631 -24.383 338 HA MET 43 HA MET 43 -5.292 10.255 -26.495 339 HB2 MET 43 2HB MET 43 -4.781 8.705 -23.906 340 HB3 MET 43 3HB MET 43 -3.592 9.523 -24.900 341 HG2 MET 43 2HG MET 43 -5.246 11.635 -24.331 342 HG3 MET 43 3HG MET 43 -5.500 10.667 -22.893 343 HE1 MET 43 3HE MET 43 -3.209 9.062 -22.617 344 HE2 MET 43 1HE MET 43 -1.856 9.551 -23.664 345 HE3 MET 43 2HE MET 43 -1.797 9.889 -21.917 346 H GLN 44 HN GLN 44 -4.595 8.741 -27.979 347 HA GLN 44 HA GLN 44 -5.939 6.213 -27.890 348 HB2 GLN 44 2HB GLN 44 -4.152 7.578 -29.939 349 HB3 GLN 44 3HB GLN 44 -4.714 5.932 -30.151 350 HG2 GLN 44 2HG GLN 44 -7.002 6.591 -30.281 351 HG3 GLN 44 3HG GLN 44 -6.697 8.142 -29.523 352 HE21 GLN 44 1HE2 GLN 44 -6.889 6.374 -32.420 353 HE22 GLN 44 2HE2 GLN 44 -6.433 7.610 -33.544 354 H VAL 45 HN VAL 45 -4.755 4.128 -28.199 355 HA VAL 45 HA VAL 45 -2.300 4.181 -26.627 356 HB VAL 45 HB VAL 45 -2.711 1.722 -26.502 357 HG11 VAL 45 1HG1 VAL 45 -4.718 1.929 -24.992 358 HG12 VAL 45 2HG1 VAL 45 -3.408 3.087 -24.661 359 HG13 VAL 45 3HG1 VAL 45 -4.868 3.619 -25.529 360 HG21 VAL 45 3HG2 VAL 45 -4.062 1.617 -28.629 361 HG22 VAL 45 1HG2 VAL 45 -4.777 0.763 -27.240 362 HG23 VAL 45 2HG2 VAL 45 -5.411 2.353 -27.730 363 H ASN 46 HN ASN 46 -0.334 3.307 -27.375 364 HA ASN 46 HA ASN 46 -0.169 3.292 -30.242 365 HB2 ASN 46 2HB ASN 46 2.300 3.258 -29.836 366 HB3 ASN 46 3HB ASN 46 1.529 4.549 -28.935 367 HD21 ASN 46 1HD2 ASN 46 2.825 4.750 -27.234 368 HD22 ASN 46 2HD2 ASN 46 3.179 3.519 -26.069 369 H GLN 47 HN GLN 47 -1.381 1.060 -28.416 370 HA GLN 47 HA GLN 47 -0.360 -1.088 -29.899 371 HB2 GLN 47 2HB GLN 47 1.506 -1.243 -28.467 372 HB3 GLN 47 3HB GLN 47 0.597 -0.750 -27.052 373 HG2 GLN 47 2HG GLN 47 -0.561 -2.891 -26.946 374 HG3 GLN 47 3HG GLN 47 0.056 -3.372 -28.514 375 HE21 GLN 47 1HE2 GLN 47 1.672 -1.766 -25.789 376 HE22 GLN 47 2HE2 GLN 47 2.880 -2.973 -25.501 377 H VAL 48 HN VAL 48 -1.671 -3.029 -29.609 378 HA VAL 48 HA VAL 48 -4.280 -2.382 -28.606 379 HB VAL 48 HB VAL 48 -4.180 -3.528 -30.660 380 HG11 VAL 48 1HG1 VAL 48 -3.115 -5.921 -30.666 381 HG12 VAL 48 2HG1 VAL 48 -2.078 -4.487 -30.853 382 HG13 VAL 48 3HG1 VAL 48 -2.187 -5.307 -29.277 383 HG21 VAL 48 3HG2 VAL 48 -4.815 -5.947 -29.076 384 HG22 VAL 48 1HG2 VAL 48 -5.664 -4.464 -28.577 385 HG23 VAL 48 2HG2 VAL 48 -5.803 -5.049 -30.253 386 H VAL 49 HN VAL 49 -4.276 -2.227 -26.367 387 HA VAL 49 HA VAL 49 -2.943 -4.269 -24.830 388 HB VAL 49 HB VAL 49 -4.673 -1.927 -24.008 389 HG11 VAL 49 1HG1 VAL 49 -3.409 -2.238 -21.813 390 HG12 VAL 49 2HG1 VAL 49 -4.654 -3.452 -22.194 391 HG13 VAL 49 3HG1 VAL 49 -2.932 -3.837 -22.431 392 HG21 VAL 49 3HG2 VAL 49 -1.845 -2.148 -24.830 393 HG22 VAL 49 1HG2 VAL 49 -2.925 -0.733 -24.786 394 HG23 VAL 49 2HG2 VAL 49 -2.113 -1.280 -23.299 395 HA PRO 50 HA PRO 50 -6.555 -6.721 -24.807 396 HB2 PRO 50 2HB PRO 50 -5.516 -8.857 -23.454 397 HB3 PRO 50 3HB PRO 50 -5.356 -8.650 -25.187 398 HG2 PRO 50 2HG PRO 50 -3.323 -8.252 -23.078 399 HG3 PRO 50 3HG PRO 50 -3.090 -8.467 -24.802 400 HD2 PRO 50 2HD PRO 50 -2.929 -6.003 -23.342 401 HD3 PRO 50 3HD PRO 50 -2.810 -6.202 -25.079 402 H MET 51 HN MET 51 -8.344 -7.041 -23.541 403 HA MET 51 HA MET 51 -8.575 -5.499 -21.350 404 HB2 MET 51 2HB MET 51 -10.441 -6.659 -22.583 405 HB3 MET 51 3HB MET 51 -9.936 -8.195 -21.908 406 HG2 MET 51 2HG MET 51 -10.392 -7.341 -19.602 407 HG3 MET 51 3HG MET 51 -10.875 -5.792 -20.264 408 HE1 MET 51 3HE MET 51 -12.892 -9.835 -20.719 409 HE2 MET 51 1HE MET 51 -12.087 -9.305 -22.216 410 HE3 MET 51 2HE MET 51 -11.152 -9.457 -20.709 411 H GLY 52 HN GLY 52 -7.721 -5.509 -19.317 412 HA2 GLY 52 1HA GLY 52 -7.391 -6.622 -17.254 413 HA3 GLY 52 2HA GLY 52 -7.053 -8.113 -18.111 414 H THR 53 HN THR 53 -5.528 -5.954 -20.050 415 HA THR 53 HA THR 53 -2.971 -6.465 -18.771 416 HB THR 53 HB THR 53 -3.830 -5.354 -21.492 417 HG1 THR 53 HG1 THR 53 -4.153 -7.679 -20.902 418 HG21 THR 53 3HG2 THR 53 -1.084 -6.007 -20.317 419 HG22 THR 53 1HG2 THR 53 -1.395 -5.978 -22.070 420 HG23 THR 53 2HG2 THR 53 -1.590 -4.494 -21.106 421 H THR 54 HN THR 54 -2.009 -5.091 -17.425 422 HA THR 54 HA THR 54 -3.058 -2.643 -16.719 423 HB THR 54 HB THR 54 -0.086 -3.277 -16.595 424 HG1 THR 54 HG1 THR 54 -0.658 -4.929 -15.105 425 HG21 THR 54 3HG2 THR 54 -0.504 -2.601 -14.178 426 HG22 THR 54 1HG2 THR 54 -0.814 -1.289 -15.340 427 HG23 THR 54 2HG2 THR 54 -2.175 -2.193 -14.635 428 H LEU 55 HN LEU 55 -2.773 -0.510 -17.285 429 HA LEU 55 HA LEU 55 -1.771 -0.149 -19.978 430 HB2 LEU 55 2HB LEU 55 -3.990 0.718 -19.031 431 HB3 LEU 55 3HB LEU 55 -3.031 1.930 -18.204 432 HG LEU 55 HG LEU 55 -2.346 2.946 -20.220 433 HD11 LEU 55 1HD1 LEU 55 -1.655 1.213 -21.616 434 HD12 LEU 55 2HD1 LEU 55 -3.233 0.393 -21.548 435 HD13 LEU 55 3HD1 LEU 55 -3.055 1.906 -22.469 436 HD21 LEU 55 3HD2 LEU 55 -4.674 3.018 -21.526 437 HD22 LEU 55 1HD2 LEU 55 -5.229 2.235 -20.027 438 HD23 LEU 55 2HD2 LEU 55 -4.424 3.821 -19.957 439 H MET 56 HN MET 56 0.153 0.777 -20.508 440 HA MET 56 HA MET 56 1.723 1.723 -18.245 441 HB2 MET 56 2HB MET 56 2.399 0.501 -20.959 442 HB3 MET 56 3HB MET 56 3.622 1.382 -20.066 443 HG2 MET 56 2HG MET 56 2.077 -0.708 -18.548 444 HG3 MET 56 3HG MET 56 3.220 -1.283 -19.746 445 HE1 MET 56 3HE MET 56 4.102 -0.046 -15.603 446 HE2 MET 56 1HE MET 56 2.521 0.029 -16.419 447 HE3 MET 56 2HE MET 56 3.384 -1.523 -16.292 448 HA PRO 57 HA PRO 57 1.979 5.689 -19.987 449 HB2 PRO 57 2HB PRO 57 4.479 6.542 -19.286 450 HB3 PRO 57 3HB PRO 57 3.124 6.530 -18.175 451 HG2 PRO 57 2HG PRO 57 5.433 4.689 -18.299 452 HG3 PRO 57 3HG PRO 57 4.317 4.962 -16.976 453 HD2 PRO 57 2HD PRO 57 4.336 2.725 -18.772 454 HD3 PRO 57 3HD PRO 57 3.151 3.057 -17.524 455 H ASP 58 HN ASP 58 4.458 3.466 -20.913 456 HA ASP 58 HA ASP 58 5.109 5.129 -23.168 457 HB2 ASP 58 2HB ASP 58 6.825 3.785 -21.834 458 HB3 ASP 58 3HB ASP 58 6.096 2.324 -22.471 459 HD2 ASP 58 HD2 ASP 58 8.446 2.332 -23.049 460 H MET 59 HN MET 59 2.489 3.387 -22.489 461 HA MET 59 HA MET 59 2.459 1.996 -25.056 462 HB2 MET 59 2HB MET 59 1.268 1.402 -22.330 463 HB3 MET 59 3HB MET 59 0.392 0.840 -23.740 464 HG2 MET 59 2HG MET 59 2.811 -0.070 -24.473 465 HG3 MET 59 3HG MET 59 3.125 0.013 -22.751 466 HE1 MET 59 3HE MET 59 1.006 -0.929 -21.010 467 HE2 MET 59 1HE MET 59 -0.172 -0.229 -22.146 468 HE3 MET 59 2HE MET 59 -0.306 -1.938 -21.666 469 H VAL 60 HN VAL 60 1.810 4.908 -24.240 470 HA VAL 60 HA VAL 60 -0.802 4.935 -25.547 471 HB VAL 60 HB VAL 60 -0.093 6.462 -23.033 472 HG11 VAL 60 1HG1 VAL 60 -2.405 7.306 -23.133 473 HG12 VAL 60 2HG1 VAL 60 -1.461 7.807 -24.556 474 HG13 VAL 60 3HG1 VAL 60 -2.639 6.479 -24.691 475 HG21 VAL 60 3HG2 VAL 60 -2.186 4.302 -23.455 476 HG22 VAL 60 1HG2 VAL 60 -0.609 4.057 -22.665 477 HG23 VAL 60 2HG2 VAL 60 -1.811 5.149 -21.935 478 H LYS 61 HN LYS 61 -1.042 6.609 -27.030 479 HA LYS 61 HA LYS 61 1.410 8.014 -27.639 480 HB2 LYS 61 2HB LYS 61 -1.243 7.775 -29.086 481 HB3 LYS 61 3HB LYS 61 0.112 8.716 -29.675 482 HG2 LYS 61 2HG LYS 61 1.503 6.503 -29.354 483 HG3 LYS 61 3HG LYS 61 -0.058 5.709 -29.286 484 HD2 LYS 61 2HD LYS 61 0.084 7.604 -31.532 485 HD3 LYS 61 3HD LYS 61 1.370 6.417 -31.616 486 HE2 LYS 61 2HE LYS 61 -0.091 4.636 -31.924 487 HE3 LYS 61 3HE LYS 61 -1.350 5.352 -30.938 488 HZ1 LYS 61 2HZ LYS 61 -1.489 5.307 -33.581 489 HZ3 LYS 61 1HZ LYS 61 -0.727 6.738 -33.431 490 H GLY 62 HN GLY 62 1.631 10.300 -27.728 491 HA2 GLY 62 1HA GLY 62 1.321 12.403 -27.005 492 HA3 GLY 62 2HA GLY 62 -0.400 12.133 -27.189 493 H TYR 63 HN TYR 63 1.144 9.833 -25.091 494 HA TYR 63 HA TYR 63 -0.297 10.873 -22.846 495 HB2 TYR 63 2HB TYR 63 -0.052 8.444 -23.277 496 HB3 TYR 63 3HB TYR 63 1.687 8.598 -23.435 497 HD1 TYR 63 HD1 TYR 63 3.097 8.995 -21.406 498 HD2 TYR 63 HD2 TYR 63 -1.096 8.192 -21.125 499 HE1 TYR 63 HE1 TYR 63 3.364 8.423 -18.943 500 HE2 TYR 63 HE2 TYR 63 -0.815 7.623 -18.664 501 HH TYR 63 HH TYR 63 1.307 8.518 -16.840 502 H ALA 64 HN ALA 64 0.952 10.846 -20.619 503 HA ALA 64 HA ALA 64 3.608 11.365 -20.373 504 HB1 ALA 64 1HB ALA 64 3.965 13.335 -21.401 505 HB2 ALA 64 2HB ALA 64 2.226 13.553 -21.710 506 HB3 ALA 64 3HB ALA 64 2.930 14.090 -20.166 507 HA PRO 65 HA PRO 65 2.099 11.545 -16.323 508 HB2 PRO 65 2HB PRO 65 4.343 12.293 -14.953 509 HB3 PRO 65 3HB PRO 65 4.046 10.648 -15.481 510 HG2 PRO 65 2HG PRO 65 5.904 12.650 -16.611 511 HG3 PRO 65 3HG PRO 65 5.893 10.913 -16.836 512 HD2 PRO 65 2HD PRO 65 4.986 12.890 -18.705 513 HD3 PRO 65 3HD PRO 65 4.869 11.150 -18.881 514 H ALA 66 HN ALA 66 2.204 12.988 -14.188 515 HA ALA 66 HA ALA 66 2.041 15.767 -15.087 516 HB1 ALA 66 1HB ALA 66 -0.220 15.484 -15.115 517 HB2 ALA 66 2HB ALA 66 -0.153 14.020 -14.105 518 HB3 ALA 66 3HB ALA 66 -0.057 15.628 -13.349 Start of MODEL 17 1 H1 MET 0 HN MET 0 3.561 -1.992 -1.576 2 HA MET 0 HA MET 0 1.501 -0.675 -0.023 3 HB2 MET 0 2HB MET 0 3.413 0.927 -0.908 4 HB3 MET 0 3HB MET 0 2.715 0.652 -2.492 5 HG2 MET 0 2HG MET 0 1.750 2.694 -1.509 6 HG3 MET 0 3HG MET 0 0.501 1.476 -1.667 7 HE1 MET 0 3HE MET 0 -1.060 1.350 -0.248 8 HE2 MET 0 1HE MET 0 -1.061 1.458 1.529 9 HE3 MET 0 2HE MET 0 -0.988 2.941 0.547 10 H ASN 1 HN ASN 1 -0.485 -0.193 -1.368 11 HA ASN 1 HA ASN 1 -0.585 -2.023 -3.636 12 HB2 ASN 1 2HB ASN 1 -2.837 -1.382 -1.659 13 HB3 ASN 1 3HB ASN 1 -2.959 -2.491 -3.010 14 HD21 ASN 1 1HD2 ASN 1 -2.971 -4.492 -2.355 15 HD22 ASN 1 2HD2 ASN 1 -1.988 -5.204 -1.120 16 H GLN 2 HN GLN 2 -0.251 -0.252 -5.154 17 HA GLN 2 HA GLN 2 -2.203 1.890 -4.990 18 HB2 GLN 2 2HB GLN 2 -0.716 3.223 -6.235 19 HB3 GLN 2 3HB GLN 2 0.362 2.273 -5.232 20 HG2 GLN 2 2HG GLN 2 1.335 2.072 -7.375 21 HG3 GLN 2 3HG GLN 2 0.425 0.582 -7.224 22 HE21 GLN 2 1HE2 GLN 2 -0.405 3.964 -7.990 23 HE22 GLN 2 2HE2 GLN 2 -1.238 3.654 -9.476 24 H GLU 3 HN GLU 3 -3.804 2.171 -6.541 25 HA GLU 3 HA GLU 3 -4.340 -0.041 -8.186 26 HB2 GLU 3 2HB GLU 3 -5.618 2.601 -7.588 27 HB3 GLU 3 3HB GLU 3 -6.073 1.845 -9.102 28 HG2 GLU 3 2HG GLU 3 -6.644 -0.264 -7.863 29 HG3 GLU 3 3HG GLU 3 -6.219 0.518 -6.353 30 HE2 GLU 3 HE2 GLU 3 -7.803 2.996 -6.506 31 H SER 4 HN SER 4 -4.085 -0.331 -10.419 32 HA SER 4 HA SER 4 -2.731 1.870 -11.772 33 HB2 SER 4 2HB SER 4 -2.146 -0.882 -12.741 34 HB3 SER 4 3HB SER 4 -1.073 0.492 -12.565 35 HG SER 4 HG SER 4 -1.275 -1.626 -10.941 36 H VAL 5 HN VAL 5 -3.332 2.220 -13.983 37 HA VAL 5 HA VAL 5 -5.947 1.644 -14.645 38 HB VAL 5 HB VAL 5 -3.566 2.390 -16.349 39 HG11 VAL 5 1HG1 VAL 5 -5.116 3.067 -18.082 40 HG12 VAL 5 2HG1 VAL 5 -5.388 1.351 -17.695 41 HG13 VAL 5 3HG1 VAL 5 -6.507 2.592 -17.079 42 HG21 VAL 5 3HG2 VAL 5 -5.677 4.375 -15.824 43 HG22 VAL 5 1HG2 VAL 5 -4.805 3.838 -14.369 44 HG23 VAL 5 2HG2 VAL 5 -3.906 4.530 -15.741 45 H VAL 6 HN VAL 6 -6.993 0.011 -15.751 46 HA VAL 6 HA VAL 6 -5.306 -2.088 -16.891 47 HB VAL 6 HB VAL 6 -7.521 -2.450 -14.868 48 HG11 VAL 6 1HG1 VAL 6 -7.518 -4.062 -16.882 49 HG12 VAL 6 2HG1 VAL 6 -6.007 -4.703 -16.193 50 HG13 VAL 6 3HG1 VAL 6 -7.514 -4.767 -15.248 51 HG21 VAL 6 3HG2 VAL 6 -5.925 -3.184 -13.371 52 HG22 VAL 6 1HG2 VAL 6 -4.780 -3.652 -14.650 53 HG23 VAL 6 2HG2 VAL 6 -5.010 -1.934 -14.248 54 H ALA 7 HN ALA 7 -6.052 -2.828 -18.844 55 HA ALA 7 HA ALA 7 -8.084 -1.390 -20.126 56 HB1 ALA 7 1HB ALA 7 -7.787 -3.502 -21.737 57 HB2 ALA 7 2HB ALA 7 -6.526 -2.253 -21.595 58 HB3 ALA 7 3HB ALA 7 -6.367 -3.783 -20.700 59 H ALA 8 HN ALA 8 -10.128 -1.441 -19.236 60 HA ALA 8 HA ALA 8 -11.230 -3.724 -18.035 61 HB1 ALA 8 1HB ALA 8 -13.001 -1.645 -19.253 62 HB2 ALA 8 2HB ALA 8 -13.011 -2.338 -17.613 63 HB3 ALA 8 3HB ALA 8 -11.815 -1.093 -18.046 64 H VAL 9 HN VAL 9 -10.569 -2.971 -21.318 65 HA VAL 9 HA VAL 9 -12.023 -5.312 -22.147 66 HB VAL 9 HB VAL 9 -13.173 -4.093 -23.985 67 HG11 VAL 9 1HG1 VAL 9 -14.022 -3.212 -21.206 68 HG12 VAL 9 2HG1 VAL 9 -15.059 -3.368 -22.644 69 HG13 VAL 9 3HG1 VAL 9 -14.334 -4.818 -21.908 70 HG21 VAL 9 3HG2 VAL 9 -11.599 -2.001 -23.510 71 HG22 VAL 9 1HG2 VAL 9 -13.234 -1.810 -24.188 72 HG23 VAL 9 2HG2 VAL 9 -12.953 -1.533 -22.453 73 H LEU 10 HN LEU 10 -11.522 -5.744 -24.564 74 HA LEU 10 HA LEU 10 -8.732 -5.607 -24.864 75 HB2 LEU 10 2HB LEU 10 -9.747 -7.472 -25.771 76 HB3 LEU 10 3HB LEU 10 -11.036 -6.551 -26.521 77 HG LEU 10 HG LEU 10 -9.025 -5.561 -27.959 78 HD11 LEU 10 1HD1 LEU 10 -7.677 -7.491 -26.438 79 HD12 LEU 10 2HD1 LEU 10 -7.849 -8.201 -28.062 80 HD13 LEU 10 3HD1 LEU 10 -7.072 -6.612 -27.863 81 HD21 LEU 10 3HD2 LEU 10 -10.972 -7.652 -28.293 82 HD22 LEU 10 1HD2 LEU 10 -10.332 -6.496 -29.486 83 HD23 LEU 10 2HD2 LEU 10 -9.497 -8.044 -29.209 84 H ILE 11 HN ILE 11 -7.960 -3.484 -24.840 85 HA ILE 11 HA ILE 11 -9.139 -1.571 -26.646 86 HB ILE 11 HB ILE 11 -6.608 -1.101 -25.134 87 HG12 ILE 11 2HG1 ILE 11 -9.301 -1.642 -23.925 88 HG13 ILE 11 3HG1 ILE 11 -7.712 -2.137 -23.376 89 HG21 ILE 11 1HG2 ILE 11 -8.237 0.482 -26.678 90 HG22 ILE 11 2HG2 ILE 11 -8.797 0.849 -25.029 91 HG23 ILE 11 3HG2 ILE 11 -7.082 1.060 -25.454 92 HD11 ILE 11 3HD1 ILE 11 -9.081 0.535 -23.071 93 HD12 ILE 11 1HD1 ILE 11 -8.181 -0.418 -21.866 94 HD13 ILE 11 2HD1 ILE 11 -7.303 0.483 -23.125 95 HA PRO 12 HA PRO 12 -6.420 -2.896 -29.810 96 HB2 PRO 12 2HB PRO 12 -7.585 -1.493 -31.846 97 HB3 PRO 12 3HB PRO 12 -8.124 -3.085 -31.348 98 HG2 PRO 12 2HG PRO 12 -9.383 -0.459 -30.840 99 HG3 PRO 12 3HG PRO 12 -10.094 -2.056 -30.733 100 HD2 PRO 12 2HD PRO 12 -9.249 -0.404 -28.546 101 HD3 PRO 12 3HD PRO 12 -9.853 -2.046 -28.446 102 H ILE 13 HN ILE 13 -5.048 -1.830 -31.600 103 HA ILE 13 HA ILE 13 -3.539 0.139 -30.246 104 HB ILE 13 HB ILE 13 -2.409 -1.395 -31.625 105 HG12 ILE 13 2HG1 ILE 13 -2.368 1.133 -33.276 106 HG13 ILE 13 3HG1 ILE 13 -1.730 1.094 -31.644 107 HG21 ILE 13 1HG2 ILE 13 -4.591 -0.835 -33.530 108 HG22 ILE 13 2HG2 ILE 13 -2.979 -1.029 -34.260 109 HG23 ILE 13 3HG2 ILE 13 -3.658 -2.324 -33.244 110 HD11 ILE 13 3HD1 ILE 13 -0.352 -0.972 -32.396 111 HD12 ILE 13 1HD1 ILE 13 -0.796 -0.505 -34.055 112 HD13 ILE 13 2HD1 ILE 13 0.144 0.613 -33.038 113 H ASN 14 HN ASN 14 -3.087 2.348 -31.006 114 HA ASN 14 HA ASN 14 -3.899 4.359 -31.297 115 HB2 ASN 14 2HB ASN 14 -4.373 2.910 -33.905 116 HB3 ASN 14 3HB ASN 14 -5.028 4.529 -33.761 117 HD21 ASN 14 1HD2 ASN 14 -2.419 2.755 -34.676 118 HD22 ASN 14 2HD2 ASN 14 -1.159 3.942 -34.605 119 H THR 15 HN THR 15 -5.690 3.075 -29.660 120 HA THR 15 HA THR 15 -8.323 3.756 -30.797 121 HB THR 15 HB THR 15 -7.527 1.577 -28.795 122 HG1 THR 15 HG1 THR 15 -7.061 1.059 -31.014 123 HG21 THR 15 3HG2 THR 15 -9.740 1.512 -28.229 124 HG22 THR 15 1HG2 THR 15 -10.097 2.849 -29.349 125 HG23 THR 15 2HG2 THR 15 -10.114 1.169 -29.935 126 H ALA 16 HN ALA 16 -9.142 5.571 -29.985 127 HA ALA 16 HA ALA 16 -8.052 6.990 -27.913 128 HB1 ALA 16 1HB ALA 16 -10.206 8.216 -27.924 129 HB2 ALA 16 2HB ALA 16 -9.626 7.891 -29.575 130 HB3 ALA 16 3HB ALA 16 -10.939 6.908 -28.883 131 H LEU 17 HN LEU 17 -7.983 6.751 -25.732 132 HA LEU 17 HA LEU 17 -9.371 4.521 -24.580 133 HB2 LEU 17 2HB LEU 17 -7.504 6.599 -23.434 134 HB3 LEU 17 3HB LEU 17 -8.183 5.272 -22.512 135 HG LEU 17 HG LEU 17 -6.489 4.875 -24.990 136 HD11 LEU 17 1HD1 LEU 17 -4.618 4.375 -23.479 137 HD12 LEU 17 2HD1 LEU 17 -5.163 6.063 -23.331 138 HD13 LEU 17 3HD1 LEU 17 -5.612 4.870 -22.089 139 HD21 LEU 17 3HD2 LEU 17 -7.673 3.050 -22.922 140 HD22 LEU 17 1HD2 LEU 17 -7.639 2.896 -24.695 141 HD23 LEU 17 2HD2 LEU 17 -6.160 2.604 -23.748 142 H THR 18 HN THR 18 -11.064 4.565 -23.077 143 HA THR 18 HA THR 18 -12.279 7.213 -22.654 144 HB THR 18 HB THR 18 -14.488 5.779 -22.846 145 HG1 THR 18 HG1 THR 18 -13.867 3.994 -24.481 146 HG21 THR 18 3HG2 THR 18 -14.172 7.326 -24.643 147 HG22 THR 18 1HG2 THR 18 -12.666 6.535 -25.168 148 HG23 THR 18 2HG2 THR 18 -14.235 5.747 -25.462 149 H VAL 19 HN VAL 19 -14.033 7.033 -20.844 150 HA VAL 19 HA VAL 19 -12.614 6.031 -18.565 151 HB VAL 19 HB VAL 19 -14.076 8.191 -18.937 152 HG11 VAL 19 1HG1 VAL 19 -16.161 7.091 -19.492 153 HG12 VAL 19 2HG1 VAL 19 -16.117 6.160 -17.976 154 HG13 VAL 19 3HG1 VAL 19 -16.338 7.925 -17.930 155 HG21 VAL 19 3HG2 VAL 19 -13.293 8.414 -16.859 156 HG22 VAL 19 1HG2 VAL 19 -14.739 7.555 -16.279 157 HG23 VAL 19 2HG2 VAL 19 -13.247 6.650 -16.628 158 H GLY 20 HN GLY 20 -14.814 4.734 -20.853 159 HA2 GLY 20 1HA GLY 20 -15.867 2.777 -18.916 160 HA3 GLY 20 2HA GLY 20 -16.536 3.146 -20.493 161 H MET 21 HN MET 21 -13.089 3.097 -20.571 162 HA MET 21 HA MET 21 -13.203 0.363 -21.589 163 HB2 MET 21 2HB MET 21 -12.001 2.907 -22.592 164 HB3 MET 21 3HB MET 21 -10.909 1.539 -22.679 165 HG2 MET 21 2HG MET 21 -13.238 0.407 -23.653 166 HG3 MET 21 3HG MET 21 -13.416 2.059 -24.209 167 HE1 MET 21 3HE MET 21 -10.192 2.707 -24.163 168 HE2 MET 21 1HE MET 21 -9.789 2.500 -25.884 169 HE3 MET 21 2HE MET 21 -11.272 3.365 -25.415 170 H MET 22 HN MET 22 -11.501 2.747 -19.561 171 HA MET 22 HA MET 22 -9.509 0.743 -18.913 172 HB2 MET 22 2HB MET 22 -9.803 3.730 -18.289 173 HB3 MET 22 3HB MET 22 -8.510 2.756 -17.617 174 HG2 MET 22 2HG MET 22 -7.583 2.295 -19.806 175 HG3 MET 22 3HG MET 22 -9.014 2.894 -20.621 176 HE1 MET 22 3HE MET 22 -8.887 6.706 -20.077 177 HE2 MET 22 1HE MET 22 -9.553 5.382 -21.063 178 HE3 MET 22 2HE MET 22 -9.876 5.438 -19.314 179 H THR 23 HN THR 23 -8.834 0.797 -16.434 180 HA THR 23 HA THR 23 -10.954 1.355 -14.596 181 HB THR 23 HB THR 23 -11.525 -0.885 -15.884 182 HG1 THR 23 HG1 THR 23 -12.577 -0.217 -13.922 183 HG21 THR 23 3HG2 THR 23 -10.558 -2.864 -14.656 184 HG22 THR 23 1HG2 THR 23 -9.329 -2.014 -15.623 185 HG23 THR 23 2HG2 THR 23 -9.400 -1.772 -13.861 186 H THR 24 HN THR 24 -10.328 0.514 -12.332 187 HA THR 24 HA THR 24 -7.396 0.729 -12.121 188 HB THR 24 HB THR 24 -7.878 1.892 -9.959 189 HG1 THR 24 HG1 THR 24 -9.972 0.685 -9.735 190 HG21 THR 24 3HG2 THR 24 -7.840 3.346 -12.001 191 HG22 THR 24 1HG2 THR 24 -9.565 2.999 -12.266 192 HG23 THR 24 2HG2 THR 24 -9.053 3.916 -10.829 193 H ARG 25 HN ARG 25 -6.300 -0.903 -11.215 194 HA ARG 25 HA ARG 25 -7.581 -2.505 -9.256 195 HB2 ARG 25 2HB ARG 25 -7.716 -3.359 -11.986 196 HB3 ARG 25 3HB ARG 25 -6.512 -4.378 -11.223 197 HG2 ARG 25 2HG ARG 25 -8.181 -5.597 -10.295 198 HG3 ARG 25 3HG ARG 25 -8.633 -4.200 -9.338 199 HD2 ARG 25 2HD ARG 25 -10.469 -3.753 -10.635 200 HD3 ARG 25 3HD ARG 25 -9.595 -4.017 -12.131 201 HE ARG 25 HE ARG 25 -9.825 -6.574 -11.233 202 HH11 ARG 25 2HH2 ARG 25 -12.237 -3.986 -11.435 203 HH12 ARG 25 1HH2 ARG 25 -13.568 -5.074 -11.647 204 HH22 ARG 25 HH1 ARG 25 -13.159 -7.435 -11.689 205 H VAL 26 HN VAL 26 -6.012 -3.740 -8.022 206 HA VAL 26 HA VAL 26 -3.354 -2.720 -8.262 207 HB VAL 26 HB VAL 26 -4.414 -4.888 -6.446 208 HG11 VAL 26 1HG1 VAL 26 -2.346 -4.913 -5.616 209 HG12 VAL 26 2HG1 VAL 26 -1.844 -3.658 -6.774 210 HG13 VAL 26 3HG1 VAL 26 -2.507 -3.193 -5.189 211 HG21 VAL 26 3HG2 VAL 26 -5.908 -3.175 -5.974 212 HG22 VAL 26 1HG2 VAL 26 -4.592 -2.842 -4.823 213 HG23 VAL 26 2HG2 VAL 26 -4.720 -1.897 -6.326 214 H VAL 27 HN VAL 27 -2.811 -3.486 -10.431 215 HA VAL 27 HA VAL 27 -2.378 -6.385 -10.532 216 HB VAL 27 HB VAL 27 -2.469 -6.225 -12.875 217 HG11 VAL 27 1HG1 VAL 27 -4.575 -4.222 -12.045 218 HG12 VAL 27 2HG1 VAL 27 -4.678 -5.510 -13.269 219 HG13 VAL 27 3HG1 VAL 27 -4.644 -5.927 -11.539 220 HG21 VAL 27 3HG2 VAL 27 -2.768 -3.929 -13.993 221 HG22 VAL 27 1HG2 VAL 27 -2.149 -3.247 -12.470 222 HG23 VAL 27 2HG2 VAL 27 -1.139 -4.362 -13.422 223 H SER 28 HN SER 28 -0.313 -7.109 -11.565 224 HA SER 28 HA SER 28 1.782 -5.131 -11.136 225 HB2 SER 28 2HB SER 28 1.426 -7.094 -9.356 226 HB3 SER 28 3HB SER 28 2.291 -8.046 -10.546 227 HG SER 28 HG SER 28 4.133 -6.966 -10.154 228 HA PRO 29 HA PRO 29 3.646 -4.912 -11.512 229 HB2 PRO 29 2HB PRO 29 5.016 -3.328 -13.268 230 HB3 PRO 29 3HB PRO 29 5.710 -4.753 -12.521 231 HG2 PRO 29 2HG PRO 29 4.749 -4.397 -15.293 232 HG3 PRO 29 3HG PRO 29 5.812 -5.633 -14.650 233 HD2 PRO 29 2HD PRO 29 3.036 -5.930 -15.307 234 HD3 PRO 29 3HD PRO 29 4.069 -7.130 -14.557 235 H THR 30 HN THR 30 3.261 -2.755 -10.813 236 HA THR 30 HA THR 30 0.718 -1.868 -11.702 237 HB THR 30 HB THR 30 1.370 0.073 -10.109 238 HG1 THR 30 HG1 THR 30 3.407 -0.698 -8.903 239 HG21 THR 30 3HG2 THR 30 0.347 -2.269 -9.395 240 HG22 THR 30 1HG2 THR 30 1.997 -2.605 -8.818 241 HG23 THR 30 2HG2 THR 30 1.082 -1.234 -8.147 242 H GLY 31 HN GLY 31 0.202 -0.764 -13.473 243 HA2 GLY 31 1HA GLY 31 2.344 0.635 -14.900 244 HA3 GLY 31 2HA GLY 31 0.772 0.179 -15.525 245 H ILE 32 HN ILE 32 0.362 2.336 -16.306 246 HA ILE 32 HA ILE 32 0.649 4.682 -15.050 247 HB ILE 32 HB ILE 32 -1.665 3.716 -16.727 248 HG12 ILE 32 2HG1 ILE 32 0.578 5.495 -17.646 249 HG13 ILE 32 3HG1 ILE 32 0.826 3.763 -17.548 250 HG21 ILE 32 1HG2 ILE 32 -2.446 5.885 -16.986 251 HG22 ILE 32 2HG2 ILE 32 -2.062 5.807 -15.249 252 HG23 ILE 32 3HG2 ILE 32 -0.942 6.614 -16.373 253 HD11 ILE 32 3HD1 ILE 32 -0.626 3.307 -19.285 254 HD12 ILE 32 1HD1 ILE 32 -1.712 4.654 -18.868 255 HD13 ILE 32 2HD1 ILE 32 -0.198 4.972 -19.747 256 HA PRO 33 HA PRO 33 -1.774 4.548 -11.474 257 HB2 PRO 33 2HB PRO 33 -1.848 7.207 -10.850 258 HB3 PRO 33 3HB PRO 33 -0.488 6.170 -10.466 259 HG2 PRO 33 2HG PRO 33 -0.720 8.210 -12.593 260 HG3 PRO 33 3HG PRO 33 0.726 7.481 -11.925 261 HD2 PRO 33 2HD PRO 33 -0.499 6.864 -14.444 262 HD3 PRO 33 3HD PRO 33 0.878 6.056 -13.723 263 H ALA 34 HN ALA 34 -3.858 4.748 -10.612 264 HA ALA 34 HA ALA 34 -5.819 4.967 -12.590 265 HB1 ALA 34 1HB ALA 34 -7.359 4.977 -10.566 266 HB2 ALA 34 2HB ALA 34 -6.197 3.630 -10.631 267 HB3 ALA 34 3HB ALA 34 -5.897 5.014 -9.551 268 H GLU 35 HN GLU 35 -3.994 7.368 -10.915 269 HA GLU 35 HA GLU 35 -6.054 9.331 -10.949 270 HB2 GLU 35 2HB GLU 35 -4.430 10.798 -9.991 271 HB3 GLU 35 3HB GLU 35 -4.102 9.221 -9.299 272 HG2 GLU 35 2HG GLU 35 -2.476 9.020 -11.444 273 HG3 GLU 35 3HG GLU 35 -2.514 10.769 -11.341 274 HE2 GLU 35 HE2 GLU 35 -2.278 8.803 -8.165 275 H ASP 36 HN ASP 36 -4.402 7.833 -13.394 276 HA ASP 36 HA ASP 36 -4.179 10.297 -14.930 277 HB2 ASP 36 2HB ASP 36 -2.727 7.670 -14.954 278 HB3 ASP 36 3HB ASP 36 -2.994 8.416 -16.517 279 HD2 ASP 36 HD2 ASP 36 0.128 9.704 -15.750 280 H ILE 37 HN ILE 37 -6.266 7.787 -14.233 281 HA ILE 37 HA ILE 37 -7.001 6.676 -16.643 282 HB ILE 37 HB ILE 37 -8.224 7.098 -13.992 283 HG12 ILE 37 2HG1 ILE 37 -7.755 4.778 -15.868 284 HG13 ILE 37 3HG1 ILE 37 -6.994 5.101 -14.323 285 HG21 ILE 37 1HG2 ILE 37 -9.937 6.412 -16.397 286 HG22 ILE 37 2HG2 ILE 37 -10.434 6.304 -14.692 287 HG23 ILE 37 3HG2 ILE 37 -10.049 7.887 -15.407 288 HD11 ILE 37 3HD1 ILE 37 -8.673 3.353 -14.020 289 HD12 ILE 37 1HD1 ILE 37 -9.239 4.828 -13.199 290 HD13 ILE 37 2HD1 ILE 37 -9.922 4.371 -14.778 291 HA PRO 38 HA PRO 38 -9.769 10.465 -17.249 292 HB2 PRO 38 2HB PRO 38 -9.392 12.685 -15.700 293 HB3 PRO 38 3HB PRO 38 -10.610 11.472 -15.357 294 HG2 PRO 38 2HG PRO 38 -8.027 11.941 -13.998 295 HG3 PRO 38 3HG PRO 38 -9.420 11.045 -13.428 296 HD2 PRO 38 2HD PRO 38 -6.980 9.947 -14.461 297 HD3 PRO 38 3HD PRO 38 -8.417 9.057 -13.999 298 H ARG 39 HN ARG 39 -6.472 10.410 -16.903 299 HA ARG 39 HA ARG 39 -6.177 12.755 -18.563 300 HB2 ARG 39 2HB ARG 39 -4.051 10.952 -17.300 301 HB3 ARG 39 3HB ARG 39 -3.731 12.461 -18.131 302 HG2 ARG 39 2HG ARG 39 -5.138 13.675 -16.440 303 HG3 ARG 39 3HG ARG 39 -5.420 12.163 -15.601 304 HD2 ARG 39 2HD ARG 39 -3.585 13.406 -14.509 305 HD3 ARG 39 3HD ARG 39 -2.971 11.914 -15.193 306 HE ARG 39 HE ARG 39 -2.411 14.651 -16.154 307 HH11 ARG 39 2HH2 ARG 39 -2.175 11.178 -16.819 308 HH12 ARG 39 1HH2 ARG 39 -0.913 11.363 -17.991 309 HH22 ARG 39 HH1 ARG 39 -0.089 13.556 -18.493 310 H LEU 40 HN LEU 40 -6.381 9.293 -18.719 311 HA LEU 40 HA LEU 40 -4.808 9.080 -21.134 312 HB2 LEU 40 2HB LEU 40 -6.428 7.076 -19.561 313 HB3 LEU 40 3HB LEU 40 -5.518 6.695 -21.009 314 HG LEU 40 HG LEU 40 -4.170 7.932 -18.613 315 HD11 LEU 40 1HD1 LEU 40 -3.594 5.219 -18.495 316 HD12 LEU 40 2HD1 LEU 40 -4.647 6.135 -17.390 317 HD13 LEU 40 3HD1 LEU 40 -5.349 5.275 -18.782 318 HD21 LEU 40 3HD2 LEU 40 -2.165 7.113 -19.538 319 HD22 LEU 40 1HD2 LEU 40 -3.025 6.041 -20.670 320 HD23 LEU 40 2HD2 LEU 40 -3.071 7.805 -20.905 321 H ILE 41 HN ILE 41 -8.117 9.668 -20.125 322 HA ILE 41 HA ILE 41 -9.486 8.677 -22.315 323 HB ILE 41 HB ILE 41 -10.088 11.128 -20.655 324 HG12 ILE 41 2HG1 ILE 41 -10.404 8.192 -20.143 325 HG13 ILE 41 3HG1 ILE 41 -9.882 9.466 -19.059 326 HG21 ILE 41 1HG2 ILE 41 -12.343 10.926 -21.337 327 HG22 ILE 41 2HG2 ILE 41 -11.367 10.837 -22.823 328 HG23 ILE 41 3HG2 ILE 41 -12.049 9.352 -22.116 329 HD11 ILE 41 3HD1 ILE 41 -12.725 9.135 -20.125 330 HD12 ILE 41 1HD1 ILE 41 -12.171 8.673 -18.498 331 HD13 ILE 41 2HD1 ILE 41 -12.182 10.386 -18.981 332 H SER 42 HN SER 42 -9.879 9.383 -24.394 333 HA SER 42 HA SER 42 -9.880 10.741 -26.131 334 HB2 SER 42 2HB SER 42 -9.777 12.668 -24.297 335 HB3 SER 42 3HB SER 42 -8.114 12.817 -24.828 336 HG SER 42 HG SER 42 -9.914 12.651 -26.960 337 H MET 43 HN MET 43 -7.228 9.519 -24.368 338 HA MET 43 HA MET 43 -5.368 10.072 -26.526 339 HB2 MET 43 2HB MET 43 -4.781 8.594 -23.916 340 HB3 MET 43 3HB MET 43 -3.642 9.450 -24.937 341 HG2 MET 43 2HG MET 43 -5.309 11.521 -24.364 342 HG3 MET 43 3HG MET 43 -5.599 10.549 -22.935 343 HE1 MET 43 3HE MET 43 -3.322 8.973 -22.517 344 HE2 MET 43 1HE MET 43 -1.974 9.419 -23.591 345 HE3 MET 43 2HE MET 43 -1.897 9.811 -21.857 346 H GLN 44 HN GLN 44 -4.761 8.513 -27.992 347 HA GLN 44 HA GLN 44 -6.046 5.960 -27.703 348 HB2 GLN 44 2HB GLN 44 -4.276 6.851 -30.008 349 HB3 GLN 44 3HB GLN 44 -5.527 5.624 -30.026 350 HG2 GLN 44 2HG GLN 44 -7.285 7.285 -29.776 351 HG3 GLN 44 3HG GLN 44 -6.127 8.552 -29.421 352 HE21 GLN 44 1HE2 GLN 44 -7.021 6.171 -31.897 353 HE22 GLN 44 2HE2 GLN 44 -6.620 7.127 -33.285 354 H VAL 45 HN VAL 45 -4.860 3.899 -27.942 355 HA VAL 45 HA VAL 45 -2.333 4.043 -26.549 356 HB VAL 45 HB VAL 45 -2.602 1.521 -26.638 357 HG11 VAL 45 1HG1 VAL 45 -3.988 1.505 -24.746 358 HG12 VAL 45 2HG1 VAL 45 -3.308 3.150 -24.763 359 HG13 VAL 45 3HG1 VAL 45 -4.970 2.868 -25.336 360 HG21 VAL 45 3HG2 VAL 45 -4.522 0.512 -27.438 361 HG22 VAL 45 1HG2 VAL 45 -5.484 2.006 -27.332 362 HG23 VAL 45 2HG2 VAL 45 -4.288 1.808 -28.636 363 H ASN 46 HN ASN 46 -0.391 2.918 -27.335 364 HA ASN 46 HA ASN 46 -0.272 3.136 -30.229 365 HB2 ASN 46 2HB ASN 46 2.174 3.384 -29.920 366 HB3 ASN 46 3HB ASN 46 1.333 4.537 -28.904 367 HD21 ASN 46 1HD2 ASN 46 2.437 4.782 -27.118 368 HD22 ASN 46 2HD2 ASN 46 3.074 3.534 -26.099 369 H GLN 47 HN GLN 47 -1.414 0.800 -28.772 370 HA GLN 47 HA GLN 47 -0.135 -1.226 -30.133 371 HB2 GLN 47 2HB GLN 47 1.709 -1.222 -28.647 372 HB3 GLN 47 3HB GLN 47 0.710 -0.901 -27.244 373 HG2 GLN 47 2HG GLN 47 -0.259 -3.162 -27.348 374 HG3 GLN 47 3HG GLN 47 0.570 -3.491 -28.856 375 HE21 GLN 47 1HE2 GLN 47 1.640 -1.883 -25.870 376 HE22 GLN 47 2HE2 GLN 47 2.968 -2.937 -25.512 377 H VAL 48 HN VAL 48 -1.178 -3.376 -29.696 378 HA VAL 48 HA VAL 48 -3.900 -2.935 -28.843 379 HB VAL 48 HB VAL 48 -2.374 -5.043 -30.315 380 HG11 VAL 48 1HG1 VAL 48 -4.892 -6.121 -30.225 381 HG12 VAL 48 2HG1 VAL 48 -3.509 -6.672 -29.250 382 HG13 VAL 48 3HG1 VAL 48 -4.690 -5.535 -28.557 383 HG21 VAL 48 3HG2 VAL 48 -3.531 -3.028 -31.380 384 HG22 VAL 48 1HG2 VAL 48 -3.925 -4.628 -32.052 385 HG23 VAL 48 2HG2 VAL 48 -5.067 -3.819 -30.952 386 H VAL 49 HN VAL 49 -4.150 -2.854 -26.645 387 HA VAL 49 HA VAL 49 -2.707 -4.846 -25.067 388 HB VAL 49 HB VAL 49 -2.717 -3.371 -23.374 389 HG11 VAL 49 1HG1 VAL 49 -3.438 -1.356 -25.522 390 HG12 VAL 49 2HG1 VAL 49 -2.403 -1.112 -24.095 391 HG13 VAL 49 3HG1 VAL 49 -1.857 -2.167 -25.421 392 HG21 VAL 49 3HG2 VAL 49 -5.049 -3.430 -22.863 393 HG22 VAL 49 1HG2 VAL 49 -4.581 -1.715 -22.955 394 HG23 VAL 49 2HG2 VAL 49 -5.458 -2.472 -24.307 395 HA PRO 50 HA PRO 50 -6.469 -7.050 -24.902 396 HB2 PRO 50 2HB PRO 50 -5.552 -9.206 -23.496 397 HB3 PRO 50 3HB PRO 50 -5.404 -9.064 -25.236 398 HG2 PRO 50 2HG PRO 50 -3.319 -8.735 -23.166 399 HG3 PRO 50 3HG PRO 50 -3.125 -9.018 -24.885 400 HD2 PRO 50 2HD PRO 50 -2.782 -6.526 -23.507 401 HD3 PRO 50 3HD PRO 50 -2.703 -6.786 -25.238 402 H MET 51 HN MET 51 -8.263 -7.066 -23.643 403 HA MET 51 HA MET 51 -8.413 -5.489 -21.529 404 HB2 MET 51 2HB MET 51 -10.364 -6.613 -22.561 405 HB3 MET 51 3HB MET 51 -9.821 -8.176 -21.985 406 HG2 MET 51 2HG MET 51 -10.129 -7.432 -19.623 407 HG3 MET 51 3HG MET 51 -10.628 -5.845 -20.176 408 HE1 MET 51 3HE MET 51 -12.835 -9.807 -20.792 409 HE2 MET 51 1HE MET 51 -11.823 -9.258 -22.149 410 HE3 MET 51 2HE MET 51 -11.090 -9.545 -20.552 411 H GLY 52 HN GLY 52 -7.565 -5.374 -19.494 412 HA2 GLY 52 1HA GLY 52 -7.216 -6.377 -17.372 413 HA3 GLY 52 2HA GLY 52 -6.847 -7.901 -18.155 414 H THR 53 HN THR 53 -5.341 -5.965 -20.254 415 HA THR 53 HA THR 53 -2.777 -6.369 -19.032 416 HB THR 53 HB THR 53 -3.790 -5.215 -21.674 417 HG1 THR 53 HG1 THR 53 -3.892 -7.514 -21.458 418 HG21 THR 53 3HG2 THR 53 -1.055 -5.200 -20.456 419 HG22 THR 53 1HG2 THR 53 -1.155 -5.894 -22.092 420 HG23 THR 53 2HG2 THR 53 -1.698 -4.225 -21.800 421 H THR 54 HN THR 54 -1.912 -5.084 -17.538 422 HA THR 54 HA THR 54 -2.917 -2.650 -16.765 423 HB THR 54 HB THR 54 0.037 -3.384 -16.626 424 HG1 THR 54 HG1 THR 54 -0.611 -5.088 -15.293 425 HG21 THR 54 3HG2 THR 54 -2.009 -2.208 -14.674 426 HG22 THR 54 1HG2 THR 54 -0.362 -2.698 -14.211 427 HG23 THR 54 2HG2 THR 54 -0.603 -1.367 -15.368 428 H LEU 55 HN LEU 55 -2.938 -0.618 -17.511 429 HA LEU 55 HA LEU 55 -1.815 -0.123 -20.076 430 HB2 LEU 55 2HB LEU 55 -3.980 0.773 -18.988 431 HB3 LEU 55 3HB LEU 55 -2.939 1.953 -18.217 432 HG LEU 55 HG LEU 55 -2.329 2.943 -20.277 433 HD11 LEU 55 1HD1 LEU 55 -3.332 0.395 -21.498 434 HD12 LEU 55 2HD1 LEU 55 -3.329 1.894 -22.458 435 HD13 LEU 55 3HD1 LEU 55 -1.808 1.274 -21.773 436 HD21 LEU 55 3HD2 LEU 55 -4.701 3.183 -21.418 437 HD22 LEU 55 1HD2 LEU 55 -5.236 2.332 -19.948 438 HD23 LEU 55 2HD2 LEU 55 -4.363 3.878 -19.814 439 H MET 56 HN MET 56 0.110 0.797 -20.630 440 HA MET 56 HA MET 56 1.765 1.613 -18.376 441 HB2 MET 56 2HB MET 56 2.296 0.359 -21.093 442 HB3 MET 56 3HB MET 56 3.574 1.302 -20.350 443 HG2 MET 56 2HG MET 56 2.171 -0.812 -18.695 444 HG3 MET 56 3HG MET 56 3.369 -1.315 -19.871 445 HE1 MET 56 3HE MET 56 3.832 -1.611 -16.425 446 HE2 MET 56 1HE MET 56 4.047 0.025 -15.758 447 HE3 MET 56 2HE MET 56 2.544 -0.397 -16.613 448 HA PRO 57 HA PRO 57 2.096 5.618 -20.014 449 HB2 PRO 57 2HB PRO 57 4.634 6.380 -19.348 450 HB3 PRO 57 3HB PRO 57 3.304 6.375 -18.207 451 HG2 PRO 57 2HG PRO 57 5.556 4.474 -18.435 452 HG3 PRO 57 3HG PRO 57 4.478 4.741 -17.080 453 HD2 PRO 57 2HD PRO 57 4.393 2.556 -18.936 454 HD3 PRO 57 3HD PRO 57 3.247 2.886 -17.652 455 H ASP 58 HN ASP 58 4.370 3.291 -21.112 456 HA ASP 58 HA ASP 58 5.039 5.018 -23.329 457 HB2 ASP 58 2HB ASP 58 6.314 2.825 -21.915 458 HB3 ASP 58 3HB ASP 58 6.187 2.399 -23.610 459 HD2 ASP 58 HD2 ASP 58 6.756 5.635 -22.411 460 H MET 59 HN MET 59 2.422 3.288 -22.592 461 HA MET 59 HA MET 59 2.306 1.903 -25.159 462 HB2 MET 59 2HB MET 59 1.178 1.369 -22.405 463 HB3 MET 59 3HB MET 59 0.183 0.887 -23.765 464 HG2 MET 59 2HG MET 59 2.510 -0.169 -24.634 465 HG3 MET 59 3HG MET 59 2.884 -0.160 -22.922 466 HE1 MET 59 3HE MET 59 -0.608 -1.907 -21.738 467 HE2 MET 59 1HE MET 59 0.776 -0.958 -21.143 468 HE3 MET 59 2HE MET 59 -0.428 -0.201 -22.213 469 H VAL 60 HN VAL 60 1.644 4.837 -24.061 470 HA VAL 60 HA VAL 60 -0.901 4.967 -25.507 471 HB VAL 60 HB VAL 60 -0.252 6.472 -22.967 472 HG11 VAL 60 1HG1 VAL 60 -1.736 7.670 -24.537 473 HG12 VAL 60 2HG1 VAL 60 -2.838 6.272 -24.548 474 HG13 VAL 60 3HG1 VAL 60 -2.583 7.193 -23.046 475 HG21 VAL 60 3HG2 VAL 60 -0.692 4.459 -22.012 476 HG22 VAL 60 1HG2 VAL 60 -2.379 4.948 -22.298 477 HG23 VAL 60 2HG2 VAL 60 -1.566 3.848 -23.437 478 H LYS 61 HN LYS 61 -1.071 6.690 -26.937 479 HA LYS 61 HA LYS 61 1.412 8.095 -27.412 480 HB2 LYS 61 2HB LYS 61 -1.187 8.028 -28.973 481 HB3 LYS 61 3HB LYS 61 0.286 8.824 -29.489 482 HG2 LYS 61 2HG LYS 61 1.446 6.514 -29.174 483 HG3 LYS 61 3HG LYS 61 -0.169 5.843 -29.069 484 HD2 LYS 61 2HD LYS 61 -0.518 7.293 -31.321 485 HD3 LYS 61 3HD LYS 61 1.219 7.094 -31.431 486 HE2 LYS 61 2HE LYS 61 0.897 4.591 -31.143 487 HE3 LYS 61 3HE LYS 61 -0.836 4.846 -31.185 488 HZ1 LYS 61 2HZ LYS 61 1.096 5.151 -33.372 489 HZ3 LYS 61 1HZ LYS 61 -0.239 6.082 -33.409 490 H GLY 62 HN GLY 62 1.579 10.419 -27.542 491 HA2 GLY 62 1HA GLY 62 1.275 12.486 -26.717 492 HA3 GLY 62 2HA GLY 62 -0.439 12.227 -26.976 493 H TYR 63 HN TYR 63 1.131 9.916 -24.866 494 HA TYR 63 HA TYR 63 -0.421 10.905 -22.648 495 HB2 TYR 63 2HB TYR 63 -0.283 8.496 -23.023 496 HB3 TYR 63 3HB TYR 63 1.439 8.570 -23.338 497 HD1 TYR 63 HD1 TYR 63 3.052 8.806 -21.458 498 HD2 TYR 63 HD2 TYR 63 -1.142 8.311 -20.773 499 HE1 TYR 63 HE1 TYR 63 3.514 8.177 -19.039 500 HE2 TYR 63 HE2 TYR 63 -0.666 7.684 -18.355 501 HH TYR 63 HH TYR 63 2.328 8.228 -16.910 502 H ALA 64 HN ALA 64 0.768 10.766 -20.385 503 HA ALA 64 HA ALA 64 3.436 11.231 -20.077 504 HB1 ALA 64 1HB ALA 64 2.969 13.911 -19.715 505 HB2 ALA 64 2HB ALA 64 3.726 13.205 -21.163 506 HB3 ALA 64 3HB ALA 64 1.985 13.576 -21.160 507 HA PRO 65 HA PRO 65 1.890 11.221 -16.038 508 HB2 PRO 65 2HB PRO 65 4.105 11.937 -14.606 509 HB3 PRO 65 3HB PRO 65 3.839 10.314 -15.213 510 HG2 PRO 65 2HG PRO 65 5.680 12.393 -16.227 511 HG3 PRO 65 3HG PRO 65 5.699 10.668 -16.531 512 HD2 PRO 65 2HD PRO 65 4.784 12.716 -18.319 513 HD3 PRO 65 3HD PRO 65 4.695 10.984 -18.575 514 H ALA 66 HN ALA 66 1.377 12.450 -14.055 515 HA ALA 66 HA ALA 66 1.749 15.304 -14.408 516 HB1 ALA 66 1HB ALA 66 -1.037 14.125 -14.108 517 HB2 ALA 66 2HB ALA 66 -0.595 15.826 -14.389 518 HB3 ALA 66 3HB ALA 66 -0.348 14.619 -15.673 Start of MODEL 18 1 H1 MET 0 HN MET 0 0.707 -1.145 0.487 2 HA MET 0 HA MET 0 2.171 0.562 -1.374 3 HB2 MET 0 2HB MET 0 3.772 -1.236 -1.707 4 HB3 MET 0 3HB MET 0 3.580 -1.085 0.028 5 HG2 MET 0 2HG MET 0 1.734 -2.919 -0.192 6 HG3 MET 0 3HG MET 0 2.366 -3.194 -1.803 7 HE1 MET 0 3HE MET 0 4.425 -5.925 -1.130 8 HE2 MET 0 1HE MET 0 3.396 -4.911 -2.170 9 HE3 MET 0 2HE MET 0 5.139 -4.574 -2.042 10 H ASN 1 HN ASN 1 -0.714 -0.215 -1.319 11 HA ASN 1 HA ASN 1 -0.732 -1.886 -3.707 12 HB2 ASN 1 2HB ASN 1 -3.067 -1.334 -1.806 13 HB3 ASN 1 3HB ASN 1 -3.035 -2.516 -3.099 14 HD21 ASN 1 1HD2 ASN 1 -3.363 -2.641 -0.108 15 HD22 ASN 1 2HD2 ASN 1 -2.252 -3.853 0.436 16 H GLN 2 HN GLN 2 -0.422 -0.052 -5.166 17 HA GLN 2 HA GLN 2 -2.438 2.024 -4.969 18 HB2 GLN 2 2HB GLN 2 -0.984 3.421 -6.187 19 HB3 GLN 2 3HB GLN 2 0.114 2.480 -5.197 20 HG2 GLN 2 2HG GLN 2 1.100 2.346 -7.340 21 HG3 GLN 2 3HG GLN 2 0.230 0.830 -7.220 22 HE21 GLN 2 1HE2 GLN 2 -0.690 4.201 -7.927 23 HE22 GLN 2 2HE2 GLN 2 -1.510 3.896 -9.422 24 H GLU 3 HN GLU 3 -4.046 2.296 -6.515 25 HA GLU 3 HA GLU 3 -4.550 0.110 -8.191 26 HB2 GLU 3 2HB GLU 3 -5.841 2.735 -7.572 27 HB3 GLU 3 3HB GLU 3 -6.266 2.022 -9.114 28 HG2 GLU 3 2HG GLU 3 -6.872 -0.116 -7.953 29 HG3 GLU 3 3HG GLU 3 -6.458 0.608 -6.412 30 HE2 GLU 3 HE2 GLU 3 -8.979 2.670 -6.109 31 H SER 4 HN SER 4 -4.105 -0.236 -10.357 32 HA SER 4 HA SER 4 -2.816 2.000 -11.718 33 HB2 SER 4 2HB SER 4 -2.161 -0.745 -12.658 34 HB3 SER 4 3HB SER 4 -1.115 0.647 -12.459 35 HG SER 4 HG SER 4 -1.367 -1.474 -10.818 36 H VAL 5 HN VAL 5 -3.347 2.297 -13.964 37 HA VAL 5 HA VAL 5 -5.944 1.701 -14.678 38 HB VAL 5 HB VAL 5 -3.523 2.417 -16.340 39 HG11 VAL 5 1HG1 VAL 5 -5.009 3.029 -18.133 40 HG12 VAL 5 2HG1 VAL 5 -5.340 1.339 -17.687 41 HG13 VAL 5 3HG1 VAL 5 -6.439 2.633 -17.152 42 HG21 VAL 5 3HG2 VAL 5 -3.787 4.485 -15.551 43 HG22 VAL 5 1HG2 VAL 5 -5.484 4.502 -16.088 44 HG23 VAL 5 2HG2 VAL 5 -5.069 3.892 -14.468 45 H VAL 6 HN VAL 6 -6.959 0.032 -15.752 46 HA VAL 6 HA VAL 6 -5.261 -2.052 -16.883 47 HB VAL 6 HB VAL 6 -7.338 -2.422 -14.724 48 HG11 VAL 6 1HG1 VAL 6 -5.960 -4.653 -16.241 49 HG12 VAL 6 2HG1 VAL 6 -7.291 -4.775 -15.065 50 HG13 VAL 6 3HG1 VAL 6 -7.580 -4.047 -16.664 51 HG21 VAL 6 3HG2 VAL 6 -4.380 -2.614 -14.888 52 HG22 VAL 6 1HG2 VAL 6 -5.433 -2.205 -13.512 53 HG23 VAL 6 2HG2 VAL 6 -5.200 -3.907 -13.980 54 H ALA 7 HN ALA 7 -5.963 -2.529 -18.899 55 HA ALA 7 HA ALA 7 -8.079 -1.276 -20.094 56 HB1 ALA 7 1HB ALA 7 -6.633 -2.208 -21.616 57 HB2 ALA 7 2HB ALA 7 -6.386 -3.679 -20.645 58 HB3 ALA 7 3HB ALA 7 -7.869 -3.490 -21.612 59 H ALA 8 HN ALA 8 -10.087 -1.259 -19.122 60 HA ALA 8 HA ALA 8 -11.186 -3.476 -17.807 61 HB1 ALA 8 1HB ALA 8 -11.770 -0.758 -18.187 62 HB2 ALA 8 2HB ALA 8 -13.148 -1.618 -18.916 63 HB3 ALA 8 3HB ALA 8 -12.707 -1.922 -17.219 64 H VAL 9 HN VAL 9 -10.637 -2.845 -21.141 65 HA VAL 9 HA VAL 9 -12.122 -5.206 -21.834 66 HB VAL 9 HB VAL 9 -13.481 -4.159 -23.535 67 HG11 VAL 9 1HG1 VAL 9 -13.903 -2.740 -20.885 68 HG12 VAL 9 2HG1 VAL 9 -15.131 -3.085 -22.127 69 HG13 VAL 9 3HG1 VAL 9 -14.377 -4.422 -21.224 70 HG21 VAL 9 3HG2 VAL 9 -12.320 -1.539 -22.533 71 HG22 VAL 9 1HG2 VAL 9 -12.099 -2.267 -24.143 72 HG23 VAL 9 2HG2 VAL 9 -13.704 -1.680 -23.644 73 H LEU 10 HN LEU 10 -11.807 -5.569 -24.352 74 HA LEU 10 HA LEU 10 -9.040 -5.588 -24.776 75 HB2 LEU 10 2HB LEU 10 -10.323 -7.306 -25.716 76 HB3 LEU 10 3HB LEU 10 -11.444 -6.191 -26.473 77 HG LEU 10 HG LEU 10 -9.211 -5.447 -27.767 78 HD11 LEU 10 1HD1 LEU 10 -8.459 -8.160 -28.138 79 HD12 LEU 10 2HD1 LEU 10 -7.481 -6.808 -27.519 80 HD13 LEU 10 3HD1 LEU 10 -8.412 -7.821 -26.391 81 HD21 LEU 10 3HD2 LEU 10 -10.224 -7.840 -29.047 82 HD22 LEU 10 1HD2 LEU 10 -11.546 -6.866 -28.360 83 HD23 LEU 10 2HD2 LEU 10 -10.404 -6.131 -29.511 84 H ILE 11 HN ILE 11 -7.876 -3.733 -24.960 85 HA ILE 11 HA ILE 11 -9.035 -1.595 -26.585 86 HB ILE 11 HB ILE 11 -6.558 -1.289 -24.946 87 HG12 ILE 11 2HG1 ILE 11 -9.337 -1.692 -23.881 88 HG13 ILE 11 3HG1 ILE 11 -7.812 -2.308 -23.275 89 HG21 ILE 11 1HG2 ILE 11 -7.375 0.988 -24.698 90 HG22 ILE 11 2HG2 ILE 11 -7.316 0.529 -26.417 91 HG23 ILE 11 3HG2 ILE 11 -8.875 0.566 -25.559 92 HD11 ILE 11 3HD1 ILE 11 -8.670 0.623 -23.217 93 HD12 ILE 11 1HD1 ILE 11 -8.683 -0.490 -21.828 94 HD13 ILE 11 2HD1 ILE 11 -7.138 -0.021 -22.577 95 HA PRO 12 HA PRO 12 -6.220 -3.075 -29.618 96 HB2 PRO 12 2HB PRO 12 -7.364 -1.802 -31.749 97 HB3 PRO 12 3HB PRO 12 -7.869 -3.386 -31.195 98 HG2 PRO 12 2HG PRO 12 -9.222 -0.781 -30.845 99 HG3 PRO 12 3HG PRO 12 -9.888 -2.394 -30.686 100 HD2 PRO 12 2HD PRO 12 -9.161 -0.620 -28.552 101 HD3 PRO 12 3HD PRO 12 -9.718 -2.274 -28.396 102 H ILE 13 HN ILE 13 -4.828 -2.046 -31.414 103 HA ILE 13 HA ILE 13 -3.415 0.022 -30.108 104 HB ILE 13 HB ILE 13 -2.290 -1.617 -31.448 105 HG12 ILE 13 2HG1 ILE 13 -1.973 0.916 -33.035 106 HG13 ILE 13 3HG1 ILE 13 -1.580 0.906 -31.327 107 HG21 ILE 13 1HG2 ILE 13 -3.059 -0.664 -34.095 108 HG22 ILE 13 2HG2 ILE 13 -2.940 -2.323 -33.459 109 HG23 ILE 13 3HG2 ILE 13 -4.424 -1.375 -33.200 110 HD11 ILE 13 3HD1 ILE 13 -0.100 -0.254 -33.576 111 HD12 ILE 13 1HD1 ILE 13 0.446 0.070 -31.913 112 HD13 ILE 13 2HD1 ILE 13 -0.391 -1.454 -32.294 113 H ASN 14 HN ASN 14 -2.990 2.206 -30.980 114 HA ASN 14 HA ASN 14 -3.845 4.183 -31.372 115 HB2 ASN 14 2HB ASN 14 -4.963 3.044 -33.969 116 HB3 ASN 14 3HB ASN 14 -4.253 4.625 -33.706 117 HD21 ASN 14 1HD2 ASN 14 -3.683 2.202 -35.471 118 HD22 ASN 14 2HD2 ASN 14 -1.979 1.931 -35.327 119 H THR 15 HN THR 15 -5.622 2.918 -29.694 120 HA THR 15 HA THR 15 -8.260 3.484 -30.882 121 HB THR 15 HB THR 15 -7.397 1.417 -28.792 122 HG1 THR 15 HG1 THR 15 -7.000 0.816 -31.004 123 HG21 THR 15 3HG2 THR 15 -9.591 1.523 -28.111 124 HG22 THR 15 1HG2 THR 15 -10.043 2.574 -29.475 125 HG23 THR 15 2HG2 THR 15 -9.971 0.809 -29.696 126 H ALA 16 HN ALA 16 -9.237 5.244 -30.125 127 HA ALA 16 HA ALA 16 -8.188 6.871 -28.193 128 HB1 ALA 16 1HB ALA 16 -10.881 6.492 -29.465 129 HB2 ALA 16 2HB ALA 16 -10.757 7.581 -28.063 130 HB3 ALA 16 3HB ALA 16 -9.782 7.891 -29.520 131 H LEU 17 HN LEU 17 -8.036 6.804 -26.002 132 HA LEU 17 HA LEU 17 -9.157 4.539 -24.650 133 HB2 LEU 17 2HB LEU 17 -7.412 6.850 -23.824 134 HB3 LEU 17 3HB LEU 17 -8.037 5.694 -22.665 135 HG LEU 17 HG LEU 17 -6.328 4.957 -25.056 136 HD11 LEU 17 1HD1 LEU 17 -5.316 6.427 -23.140 137 HD12 LEU 17 2HD1 LEU 17 -5.325 4.896 -22.231 138 HD13 LEU 17 3HD1 LEU 17 -4.426 5.017 -23.762 139 HD21 LEU 17 3HD2 LEU 17 -7.375 3.365 -22.709 140 HD22 LEU 17 1HD2 LEU 17 -7.635 3.079 -24.447 141 HD23 LEU 17 2HD2 LEU 17 -6.024 2.823 -23.734 142 H THR 18 HN THR 18 -10.755 4.544 -23.017 143 HA THR 18 HA THR 18 -12.125 7.060 -22.507 144 HB THR 18 HB THR 18 -14.321 5.688 -23.068 145 HG1 THR 18 HG1 THR 18 -13.593 4.220 -24.950 146 HG21 THR 18 3HG2 THR 18 -14.388 6.614 -25.239 147 HG22 THR 18 1HG2 THR 18 -13.131 7.622 -24.482 148 HG23 THR 18 2HG2 THR 18 -12.669 6.269 -25.542 149 H VAL 19 HN VAL 19 -13.487 7.015 -20.629 150 HA VAL 19 HA VAL 19 -12.394 5.533 -18.553 151 HB VAL 19 HB VAL 19 -13.890 7.715 -18.719 152 HG11 VAL 19 1HG1 VAL 19 -15.891 5.539 -18.023 153 HG12 VAL 19 2HG1 VAL 19 -16.158 7.284 -17.795 154 HG13 VAL 19 3HG1 VAL 19 -15.937 6.624 -19.433 155 HG21 VAL 19 3HG2 VAL 19 -13.348 5.803 -16.500 156 HG22 VAL 19 1HG2 VAL 19 -12.880 7.510 -16.688 157 HG23 VAL 19 2HG2 VAL 19 -14.535 7.092 -16.184 158 H GLY 20 HN GLY 20 -14.982 4.820 -20.872 159 HA2 GLY 20 1HA GLY 20 -15.990 2.576 -19.345 160 HA3 GLY 20 2HA GLY 20 -16.493 3.107 -20.938 161 H MET 21 HN MET 21 -13.055 2.952 -20.671 162 HA MET 21 HA MET 21 -13.116 0.289 -21.869 163 HB2 MET 21 2HB MET 21 -11.828 2.875 -22.695 164 HB3 MET 21 3HB MET 21 -10.814 1.457 -22.871 165 HG2 MET 21 2HG MET 21 -13.224 0.553 -23.924 166 HG3 MET 21 3HG MET 21 -13.244 2.241 -24.396 167 HE1 MET 21 3HE MET 21 -9.828 2.661 -26.184 168 HE2 MET 21 1HE MET 21 -10.948 3.373 -24.998 169 HE3 MET 21 2HE MET 21 -9.622 2.320 -24.449 170 H MET 22 HN MET 22 -11.398 2.661 -19.800 171 HA MET 22 HA MET 22 -9.502 0.592 -19.077 172 HB2 MET 22 2HB MET 22 -9.686 3.580 -18.394 173 HB3 MET 22 3HB MET 22 -8.384 2.537 -17.857 174 HG2 MET 22 2HG MET 22 -7.335 3.178 -19.788 175 HG3 MET 22 3HG MET 22 -8.381 2.011 -20.572 176 HE1 MET 22 3HE MET 22 -8.158 6.371 -20.532 177 HE2 MET 22 1HE MET 22 -9.549 6.105 -19.454 178 HE3 MET 22 2HE MET 22 -7.994 5.310 -19.112 179 H THR 23 HN THR 23 -8.842 0.929 -16.519 180 HA THR 23 HA THR 23 -10.988 1.501 -14.768 181 HB THR 23 HB THR 23 -11.730 -0.690 -15.925 182 HG1 THR 23 HG1 THR 23 -12.550 -0.107 -13.841 183 HG21 THR 23 3HG2 THR 23 -9.085 -1.489 -14.968 184 HG22 THR 23 1HG2 THR 23 -10.345 -2.447 -14.155 185 HG23 THR 23 2HG2 THR 23 -10.247 -2.430 -15.932 186 H THR 24 HN THR 24 -10.433 0.690 -12.467 187 HA THR 24 HA THR 24 -7.506 0.890 -12.201 188 HB THR 24 HB THR 24 -8.039 2.011 -10.033 189 HG1 THR 24 HG1 THR 24 -10.347 2.294 -9.609 190 HG21 THR 24 3HG2 THR 24 -9.692 3.109 -12.369 191 HG22 THR 24 1HG2 THR 24 -9.290 4.014 -10.890 192 HG23 THR 24 2HG2 THR 24 -7.998 3.523 -12.012 193 H ARG 25 HN ARG 25 -6.410 -0.763 -11.345 194 HA ARG 25 HA ARG 25 -7.744 -2.440 -9.460 195 HB2 ARG 25 2HB ARG 25 -7.636 -3.217 -12.222 196 HB3 ARG 25 3HB ARG 25 -6.469 -4.219 -11.384 197 HG2 ARG 25 2HG ARG 25 -8.164 -5.505 -10.608 198 HG3 ARG 25 3HG ARG 25 -8.757 -4.137 -9.687 199 HD2 ARG 25 2HD ARG 25 -10.493 -3.775 -11.131 200 HD3 ARG 25 3HD ARG 25 -9.467 -3.926 -12.543 201 HE ARG 25 HE ARG 25 -9.636 -6.530 -11.735 202 HH11 ARG 25 2HH2 ARG 25 -12.139 -4.065 -12.194 203 HH12 ARG 25 1HH2 ARG 25 -13.371 -5.213 -12.600 204 HH22 ARG 25 HH1 ARG 25 -12.831 -7.548 -12.639 205 H VAL 26 HN VAL 26 -6.217 -3.607 -8.130 206 HA VAL 26 HA VAL 26 -3.569 -2.511 -8.228 207 HB VAL 26 HB VAL 26 -4.862 -4.547 -6.403 208 HG11 VAL 26 1HG1 VAL 26 -2.598 -2.958 -5.391 209 HG12 VAL 26 2HG1 VAL 26 -2.956 -4.692 -5.214 210 HG13 VAL 26 3HG1 VAL 26 -2.169 -4.093 -6.694 211 HG21 VAL 26 3HG2 VAL 26 -5.205 -1.704 -6.637 212 HG22 VAL 26 1HG2 VAL 26 -5.953 -2.835 -5.483 213 HG23 VAL 26 2HG2 VAL 26 -4.393 -2.069 -5.095 214 H VAL 27 HN VAL 27 -2.851 -3.333 -10.313 215 HA VAL 27 HA VAL 27 -2.375 -6.229 -10.289 216 HB VAL 27 HB VAL 27 -2.330 -6.156 -12.636 217 HG11 VAL 27 1HG1 VAL 27 -4.586 -5.751 -11.378 218 HG12 VAL 27 2HG1 VAL 27 -4.503 -4.137 -12.124 219 HG13 VAL 27 3HG1 VAL 27 -4.524 -5.592 -13.150 220 HG21 VAL 27 3HG2 VAL 27 -1.980 -3.185 -12.292 221 HG22 VAL 27 1HG2 VAL 27 -1.025 -4.335 -13.259 222 HG23 VAL 27 2HG2 VAL 27 -2.646 -3.843 -13.806 223 H SER 28 HN SER 28 -0.236 -6.918 -11.258 224 HA SER 28 HA SER 28 1.791 -4.896 -10.733 225 HB2 SER 28 2HB SER 28 1.583 -6.503 -8.804 226 HB3 SER 28 3HB SER 28 1.954 -7.824 -9.893 227 HG SER 28 HG SER 28 4.034 -6.869 -10.305 228 HA PRO 29 HA PRO 29 3.669 -4.647 -11.010 229 HB2 PRO 29 2HB PRO 29 5.104 -3.079 -12.727 230 HB3 PRO 29 3HB PRO 29 5.783 -4.470 -11.905 231 HG2 PRO 29 2HG PRO 29 4.973 -4.204 -14.735 232 HG3 PRO 29 3HG PRO 29 6.023 -5.400 -14.002 233 HD2 PRO 29 2HD PRO 29 3.294 -5.772 -14.806 234 HD3 PRO 29 3HD PRO 29 4.307 -6.931 -13.967 235 H THR 30 HN THR 30 3.191 -2.490 -10.382 236 HA THR 30 HA THR 30 0.691 -1.676 -11.445 237 HB THR 30 HB THR 30 1.214 0.316 -9.860 238 HG1 THR 30 HG1 THR 30 3.467 0.271 -9.737 239 HG21 THR 30 3HG2 THR 30 1.689 -2.440 -8.620 240 HG22 THR 30 1HG2 THR 30 0.995 -1.005 -7.827 241 HG23 THR 30 2HG2 THR 30 0.072 -1.859 -9.086 242 H GLY 31 HN GLY 31 0.262 -0.618 -13.267 243 HA2 GLY 31 1HA GLY 31 2.460 0.805 -14.584 244 HA3 GLY 31 2HA GLY 31 0.947 0.290 -15.302 245 H ILE 32 HN ILE 32 0.428 2.371 -16.150 246 HA ILE 32 HA ILE 32 0.601 4.777 -14.985 247 HB ILE 32 HB ILE 32 -1.630 3.651 -16.674 248 HG12 ILE 32 2HG1 ILE 32 0.615 5.464 -17.556 249 HG13 ILE 32 3HG1 ILE 32 0.828 3.726 -17.482 250 HG21 ILE 32 1HG2 ILE 32 -2.506 5.767 -17.026 251 HG22 ILE 32 2HG2 ILE 32 -2.150 5.778 -15.282 252 HG23 ILE 32 3HG2 ILE 32 -1.048 6.589 -16.421 253 HD11 ILE 32 3HD1 ILE 32 -0.565 3.334 -19.273 254 HD12 ILE 32 1HD1 ILE 32 -1.674 4.653 -18.829 255 HD13 ILE 32 2HD1 ILE 32 -0.150 5.018 -19.672 256 HA PRO 33 HA PRO 33 -1.897 4.693 -11.459 257 HB2 PRO 33 2HB PRO 33 -2.090 7.371 -10.950 258 HB3 PRO 33 3HB PRO 33 -0.700 6.406 -10.494 259 HG2 PRO 33 2HG PRO 33 -0.963 8.346 -12.709 260 HG3 PRO 33 3HG PRO 33 0.495 7.703 -11.980 261 HD2 PRO 33 2HD PRO 33 -0.647 6.935 -14.496 262 HD3 PRO 33 3HD PRO 33 0.744 6.213 -13.713 263 H ALA 34 HN ALA 34 -4.006 4.889 -10.630 264 HA ALA 34 HA ALA 34 -5.928 4.945 -12.670 265 HB1 ALA 34 1HB ALA 34 -6.382 3.645 -10.742 266 HB2 ALA 34 2HB ALA 34 -6.011 4.993 -9.640 267 HB3 ALA 34 3HB ALA 34 -7.496 5.028 -10.620 268 H GLU 35 HN GLU 35 -4.209 7.463 -11.094 269 HA GLU 35 HA GLU 35 -6.346 9.344 -11.178 270 HB2 GLU 35 2HB GLU 35 -4.764 10.912 -10.295 271 HB3 GLU 35 3HB GLU 35 -4.405 9.379 -9.526 272 HG2 GLU 35 2HG GLU 35 -2.767 9.127 -11.668 273 HG3 GLU 35 3HG GLU 35 -2.830 10.877 -11.607 274 HE2 GLU 35 HE2 GLU 35 -2.027 10.284 -8.004 275 H ASP 36 HN ASP 36 -4.297 7.914 -13.491 276 HA ASP 36 HA ASP 36 -4.255 10.301 -15.129 277 HB2 ASP 36 2HB ASP 36 -2.312 8.478 -14.738 278 HB3 ASP 36 3HB ASP 36 -3.151 7.639 -16.028 279 HD2 ASP 36 HD2 ASP 36 -0.445 10.107 -16.596 280 H ILE 37 HN ILE 37 -6.211 7.617 -14.427 281 HA ILE 37 HA ILE 37 -6.949 6.564 -16.849 282 HB ILE 37 HB ILE 37 -8.134 6.836 -14.164 283 HG12 ILE 37 2HG1 ILE 37 -7.653 4.592 -16.134 284 HG13 ILE 37 3HG1 ILE 37 -6.798 4.917 -14.640 285 HG21 ILE 37 1HG2 ILE 37 -10.044 7.578 -15.442 286 HG22 ILE 37 2HG2 ILE 37 -9.860 6.220 -16.577 287 HG23 ILE 37 3HG2 ILE 37 -10.314 5.910 -14.885 288 HD11 ILE 37 3HD1 ILE 37 -8.267 3.211 -13.982 289 HD12 ILE 37 1HD1 ILE 37 -9.185 4.665 -13.522 290 HD13 ILE 37 2HD1 ILE 37 -9.581 3.803 -15.028 291 HA PRO 38 HA PRO 38 -9.925 10.215 -17.291 292 HB2 PRO 38 2HB PRO 38 -9.644 12.402 -15.676 293 HB3 PRO 38 3HB PRO 38 -10.788 11.114 -15.355 294 HG2 PRO 38 2HG PRO 38 -8.212 11.680 -14.020 295 HG3 PRO 38 3HG PRO 38 -9.545 10.692 -13.459 296 HD2 PRO 38 2HD PRO 38 -7.067 9.763 -14.563 297 HD3 PRO 38 3HD PRO 38 -8.445 8.781 -14.109 298 H ARG 39 HN ARG 39 -6.622 10.341 -16.984 299 HA ARG 39 HA ARG 39 -6.487 12.743 -18.582 300 HB2 ARG 39 2HB ARG 39 -4.376 11.048 -17.170 301 HB3 ARG 39 3HB ARG 39 -3.940 12.350 -18.258 302 HG2 ARG 39 2HG ARG 39 -5.065 14.004 -16.869 303 HG3 ARG 39 3HG ARG 39 -5.814 12.760 -15.888 304 HD2 ARG 39 2HD ARG 39 -4.018 13.313 -14.509 305 HD3 ARG 39 3HD ARG 39 -3.283 12.021 -15.435 306 HE ARG 39 HE ARG 39 -2.667 14.888 -15.632 307 HH11 ARG 39 2HH2 ARG 39 -2.409 11.734 -17.226 308 HH12 ARG 39 1HH2 ARG 39 -1.069 12.206 -18.217 309 HH22 ARG 39 HH1 ARG 39 -0.198 14.431 -18.032 310 H LEU 40 HN LEU 40 -6.398 9.259 -18.797 311 HA LEU 40 HA LEU 40 -4.870 9.209 -21.238 312 HB2 LEU 40 2HB LEU 40 -6.391 7.059 -19.756 313 HB3 LEU 40 3HB LEU 40 -5.398 6.793 -21.175 314 HG LEU 40 HG LEU 40 -4.193 8.077 -18.739 315 HD11 LEU 40 1HD1 LEU 40 -4.497 6.296 -17.457 316 HD12 LEU 40 2HD1 LEU 40 -5.391 5.475 -18.759 317 HD13 LEU 40 3HD1 LEU 40 -3.623 5.303 -18.648 318 HD21 LEU 40 3HD2 LEU 40 -2.927 6.149 -20.685 319 HD22 LEU 40 1HD2 LEU 40 -3.034 7.896 -21.008 320 HD23 LEU 40 2HD2 LEU 40 -2.143 7.307 -19.584 321 H ILE 41 HN ILE 41 -8.207 9.567 -20.203 322 HA ILE 41 HA ILE 41 -9.545 8.558 -22.388 323 HB ILE 41 HB ILE 41 -10.240 11.001 -20.754 324 HG12 ILE 41 2HG1 ILE 41 -10.371 8.069 -20.158 325 HG13 ILE 41 3HG1 ILE 41 -9.925 9.405 -19.115 326 HG21 ILE 41 1HG2 ILE 41 -12.454 10.744 -21.438 327 HG22 ILE 41 2HG2 ILE 41 -11.518 10.487 -22.930 328 HG23 ILE 41 3HG2 ILE 41 -12.181 9.093 -22.044 329 HD11 ILE 41 3HD1 ILE 41 -12.736 8.729 -20.093 330 HD12 ILE 41 1HD1 ILE 41 -12.118 8.588 -18.430 331 HD13 ILE 41 2HD1 ILE 41 -12.327 10.194 -19.167 332 H SER 42 HN SER 42 -9.975 9.242 -24.466 333 HA SER 42 HA SER 42 -10.043 10.599 -26.204 334 HB2 SER 42 2HB SER 42 -9.993 12.532 -24.375 335 HB3 SER 42 3HB SER 42 -8.338 12.736 -24.916 336 HG SER 42 HG SER 42 -10.133 12.506 -27.042 337 H MET 43 HN MET 43 -7.334 9.473 -24.463 338 HA MET 43 HA MET 43 -5.513 10.087 -26.638 339 HB2 MET 43 2HB MET 43 -4.887 8.653 -24.008 340 HB3 MET 43 3HB MET 43 -3.752 9.475 -25.060 341 HG2 MET 43 2HG MET 43 -5.436 11.558 -24.534 342 HG3 MET 43 3HG MET 43 -5.675 10.631 -23.066 343 HE1 MET 43 3HE MET 43 -1.992 9.535 -23.643 344 HE2 MET 43 1HE MET 43 -2.067 9.973 -21.919 345 HE3 MET 43 2HE MET 43 -3.418 9.091 -22.673 346 H GLN 44 HN GLN 44 -4.802 8.538 -28.079 347 HA GLN 44 HA GLN 44 -6.042 5.960 -27.826 348 HB2 GLN 44 2HB GLN 44 -4.264 7.026 -30.062 349 HB3 GLN 44 3HB GLN 44 -5.295 5.611 -30.138 350 HG2 GLN 44 2HG GLN 44 -7.297 6.906 -30.103 351 HG3 GLN 44 3HG GLN 44 -6.486 8.318 -29.455 352 HE21 GLN 44 1HE2 GLN 44 -6.889 6.260 -32.274 353 HE22 GLN 44 2HE2 GLN 44 -6.408 7.407 -33.479 354 H VAL 45 HN VAL 45 -4.824 3.922 -27.992 355 HA VAL 45 HA VAL 45 -2.335 4.117 -26.539 356 HB VAL 45 HB VAL 45 -2.566 1.587 -26.620 357 HG11 VAL 45 1HG1 VAL 45 -4.739 3.276 -25.339 358 HG12 VAL 45 2HG1 VAL 45 -4.389 1.583 -24.916 359 HG13 VAL 45 3HG1 VAL 45 -3.161 2.842 -24.639 360 HG21 VAL 45 3HG2 VAL 45 -4.374 0.545 -27.543 361 HG22 VAL 45 1HG2 VAL 45 -5.451 1.940 -27.291 362 HG23 VAL 45 2HG2 VAL 45 -4.290 1.944 -28.640 363 H ASN 46 HN ASN 46 -0.399 2.852 -27.263 364 HA ASN 46 HA ASN 46 -0.184 3.109 -30.154 365 HB2 ASN 46 2HB ASN 46 2.256 3.353 -29.776 366 HB3 ASN 46 3HB ASN 46 1.383 4.524 -28.808 367 HD21 ASN 46 1HD2 ASN 46 2.556 4.804 -27.055 368 HD22 ASN 46 2HD2 ASN 46 3.114 3.572 -25.973 369 H GLN 47 HN GLN 47 -1.357 0.783 -28.690 370 HA GLN 47 HA GLN 47 -0.040 -1.253 -30.006 371 HB2 GLN 47 2HB GLN 47 1.761 -1.276 -28.489 372 HB3 GLN 47 3HB GLN 47 0.752 -0.868 -27.116 373 HG2 GLN 47 2HG GLN 47 -0.274 -3.105 -27.133 374 HG3 GLN 47 3HG GLN 47 0.560 -3.521 -28.617 375 HE21 GLN 47 1HE2 GLN 47 1.644 -1.818 -25.689 376 HE22 GLN 47 2HE2 GLN 47 2.938 -2.891 -25.273 377 H VAL 48 HN VAL 48 -1.107 -3.387 -29.614 378 HA VAL 48 HA VAL 48 -3.856 -2.971 -28.947 379 HB VAL 48 HB VAL 48 -2.166 -5.167 -30.063 380 HG11 VAL 48 1HG1 VAL 48 -4.741 -5.531 -28.588 381 HG12 VAL 48 2HG1 VAL 48 -4.505 -6.445 -30.096 382 HG13 VAL 48 3HG1 VAL 48 -3.349 -6.628 -28.755 383 HG21 VAL 48 3HG2 VAL 48 -4.789 -3.945 -30.984 384 HG22 VAL 48 1HG2 VAL 48 -3.175 -3.407 -31.506 385 HG23 VAL 48 2HG2 VAL 48 -3.738 -5.048 -31.904 386 H VAL 49 HN VAL 49 -4.144 -2.560 -26.762 387 HA VAL 49 HA VAL 49 -2.874 -4.390 -24.885 388 HB VAL 49 HB VAL 49 -4.466 -1.848 -24.494 389 HG11 VAL 49 1HG1 VAL 49 -2.974 -3.588 -22.504 390 HG12 VAL 49 2HG1 VAL 49 -3.567 -1.945 -22.161 391 HG13 VAL 49 3HG1 VAL 49 -4.720 -3.246 -22.543 392 HG21 VAL 49 3HG2 VAL 49 -1.623 -2.401 -25.026 393 HG22 VAL 49 1HG2 VAL 49 -2.555 -0.894 -25.199 394 HG23 VAL 49 2HG2 VAL 49 -1.910 -1.363 -23.608 395 HA PRO 50 HA PRO 50 -6.665 -6.587 -24.875 396 HB2 PRO 50 2HB PRO 50 -5.787 -8.745 -23.446 397 HB3 PRO 50 3HB PRO 50 -5.618 -8.614 -25.185 398 HG2 PRO 50 2HG PRO 50 -3.554 -8.297 -23.093 399 HG3 PRO 50 3HG PRO 50 -3.343 -8.591 -24.808 400 HD2 PRO 50 2HD PRO 50 -2.989 -6.096 -23.439 401 HD3 PRO 50 3HD PRO 50 -2.892 -6.366 -25.168 402 H MET 51 HN MET 51 -8.364 -7.240 -23.419 403 HA MET 51 HA MET 51 -8.587 -5.425 -21.364 404 HB2 MET 51 2HB MET 51 -10.519 -6.563 -22.419 405 HB3 MET 51 3HB MET 51 -9.953 -8.126 -21.862 406 HG2 MET 51 2HG MET 51 -10.118 -7.058 -19.449 407 HG3 MET 51 3HG MET 51 -11.135 -5.859 -20.223 408 HE1 MET 51 3HE MET 51 -12.724 -7.044 -22.344 409 HE2 MET 51 1HE MET 51 -11.787 -8.544 -22.543 410 HE3 MET 51 2HE MET 51 -13.511 -8.622 -22.109 411 H GLY 52 HN GLY 52 -7.653 -5.321 -19.370 412 HA2 GLY 52 1HA GLY 52 -7.301 -6.350 -17.252 413 HA3 GLY 52 2HA GLY 52 -6.935 -7.864 -18.055 414 H THR 53 HN THR 53 -5.436 -5.993 -20.172 415 HA THR 53 HA THR 53 -2.870 -6.346 -18.940 416 HB THR 53 HB THR 53 -3.853 -5.213 -21.609 417 HG1 THR 53 HG1 THR 53 -4.094 -7.526 -21.206 418 HG21 THR 53 3HG2 THR 53 -1.030 -6.175 -21.064 419 HG22 THR 53 1HG2 THR 53 -1.616 -5.108 -22.362 420 HG23 THR 53 2HG2 THR 53 -1.448 -4.483 -20.703 421 H THR 54 HN THR 54 -1.980 -5.013 -17.507 422 HA THR 54 HA THR 54 -2.999 -2.567 -16.782 423 HB THR 54 HB THR 54 -0.035 -3.249 -16.658 424 HG1 THR 54 HG1 THR 54 -0.646 -4.888 -15.176 425 HG21 THR 54 3HG2 THR 54 -0.428 -2.549 -14.248 426 HG22 THR 54 1HG2 THR 54 -0.722 -1.236 -15.414 427 HG23 THR 54 2HG2 THR 54 -2.095 -2.113 -14.696 428 H LEU 55 HN LEU 55 -2.746 -0.439 -17.344 429 HA LEU 55 HA LEU 55 -1.725 -0.036 -20.016 430 HB2 LEU 55 2HB LEU 55 -3.928 0.844 -19.012 431 HB3 LEU 55 3HB LEU 55 -2.933 2.046 -18.214 432 HG LEU 55 HG LEU 55 -2.283 3.045 -20.251 433 HD11 LEU 55 1HD1 LEU 55 -3.149 1.955 -22.468 434 HD12 LEU 55 2HD1 LEU 55 -1.644 1.383 -21.709 435 HD13 LEU 55 3HD1 LEU 55 -3.152 0.461 -21.500 436 HD21 LEU 55 3HD2 LEU 55 -4.354 3.932 -19.912 437 HD22 LEU 55 1HD2 LEU 55 -4.625 3.173 -21.499 438 HD23 LEU 55 2HD2 LEU 55 -5.176 2.357 -20.016 439 H MET 56 HN MET 56 0.194 0.910 -20.548 440 HA MET 56 HA MET 56 1.782 1.809 -18.275 441 HB2 MET 56 2HB MET 56 2.465 0.592 -20.993 442 HB3 MET 56 3HB MET 56 3.691 1.426 -20.060 443 HG2 MET 56 2HG MET 56 2.072 -0.630 -18.585 444 HG3 MET 56 3HG MET 56 3.182 -1.240 -19.796 445 HE1 MET 56 3HE MET 56 4.107 0.106 -15.660 446 HE2 MET 56 1HE MET 56 2.546 0.253 -16.502 447 HE3 MET 56 2HE MET 56 3.278 -1.351 -16.258 448 HA PRO 57 HA PRO 57 2.096 5.765 -20.031 449 HB2 PRO 57 2HB PRO 57 4.602 6.589 -19.315 450 HB3 PRO 57 3HB PRO 57 3.238 6.599 -18.214 451 HG2 PRO 57 2HG PRO 57 5.525 4.729 -18.314 452 HG3 PRO 57 3HG PRO 57 4.403 5.021 -17.000 453 HD2 PRO 57 2HD PRO 57 4.407 2.777 -18.787 454 HD3 PRO 57 3HD PRO 57 3.218 3.129 -17.549 455 H ASP 58 HN ASP 58 4.385 3.415 -21.010 456 HA ASP 58 HA ASP 58 5.124 5.091 -23.248 457 HB2 ASP 58 2HB ASP 58 6.350 2.912 -21.750 458 HB3 ASP 58 3HB ASP 58 6.302 2.490 -23.450 459 HD2 ASP 58 HD2 ASP 58 8.623 3.015 -22.001 460 H MET 59 HN MET 59 2.487 3.386 -22.545 461 HA MET 59 HA MET 59 2.436 1.971 -25.098 462 HB2 MET 59 2HB MET 59 1.241 1.409 -22.365 463 HB3 MET 59 3HB MET 59 0.377 0.826 -23.774 464 HG2 MET 59 2HG MET 59 2.764 -0.116 -24.495 465 HG3 MET 59 3HG MET 59 3.134 0.046 -22.789 466 HE1 MET 59 3HE MET 59 -0.172 -0.187 -22.114 467 HE2 MET 59 1HE MET 59 -0.271 -1.865 -21.530 468 HE3 MET 59 2HE MET 59 1.034 -0.799 -20.957 469 H VAL 60 HN VAL 60 1.711 4.883 -24.045 470 HA VAL 60 HA VAL 60 -0.875 4.925 -25.426 471 HB VAL 60 HB VAL 60 -0.135 6.443 -22.916 472 HG11 VAL 60 1HG1 VAL 60 -2.347 7.393 -22.980 473 HG12 VAL 60 2HG1 VAL 60 -1.560 7.708 -24.545 474 HG13 VAL 60 3HG1 VAL 60 -2.779 6.419 -24.406 475 HG21 VAL 60 3HG2 VAL 60 -1.516 5.040 -21.693 476 HG22 VAL 60 1HG2 VAL 60 -2.414 4.493 -23.129 477 HG23 VAL 60 2HG2 VAL 60 -0.762 3.901 -22.833 478 H LYS 61 HN LYS 61 -1.138 6.616 -26.889 479 HA LYS 61 HA LYS 61 1.310 8.029 -27.510 480 HB2 LYS 61 2HB LYS 61 -1.342 7.803 -28.963 481 HB3 LYS 61 3HB LYS 61 0.040 8.702 -29.555 482 HG2 LYS 61 2HG LYS 61 1.381 6.474 -29.226 483 HG3 LYS 61 3HG LYS 61 -0.188 5.703 -29.108 484 HD2 LYS 61 2HD LYS 61 -0.061 7.544 -31.401 485 HD3 LYS 61 3HD LYS 61 1.199 6.329 -31.482 486 HE2 LYS 61 2HE LYS 61 -0.341 4.533 -31.550 487 HE3 LYS 61 3HE LYS 61 -1.621 5.464 -30.799 488 HZ1 LYS 61 2HZ LYS 61 -0.623 6.336 -33.424 489 HZ3 LYS 61 1HZ LYS 61 -2.114 6.512 -32.793 490 H GLY 62 HN GLY 62 1.434 10.350 -27.727 491 HA2 GLY 62 1HA GLY 62 1.141 12.434 -26.938 492 HA3 GLY 62 2HA GLY 62 -0.573 12.158 -27.171 493 H TYR 63 HN TYR 63 1.061 9.934 -25.007 494 HA TYR 63 HA TYR 63 -0.502 10.933 -22.809 495 HB2 TYR 63 2HB TYR 63 -0.240 8.519 -23.127 496 HB3 TYR 63 3HB TYR 63 1.482 8.675 -23.416 497 HD1 TYR 63 HD2 TYR 63 3.059 8.908 -21.553 498 HD2 TYR 63 HD1 TYR 63 -1.142 8.505 -20.852 499 HE1 TYR 63 HE2 TYR 63 3.510 8.380 -19.107 500 HE2 TYR 63 HE1 TYR 63 -0.677 7.979 -18.408 501 HH TYR 63 HH TYR 63 2.575 8.235 -17.097 502 H ALA 64 HN ALA 64 0.712 10.922 -20.551 503 HA ALA 64 HA ALA 64 3.344 11.510 -20.254 504 HB1 ALA 64 1HB ALA 64 3.484 13.393 -21.574 505 HB2 ALA 64 2HB ALA 64 1.771 13.819 -21.338 506 HB3 ALA 64 3HB ALA 64 2.958 14.156 -20.054 507 HA PRO 65 HA PRO 65 1.731 11.636 -16.241 508 HB2 PRO 65 2HB PRO 65 3.950 12.351 -14.815 509 HB3 PRO 65 3HB PRO 65 3.650 10.714 -15.365 510 HG2 PRO 65 2HG PRO 65 5.549 12.711 -16.436 511 HG3 PRO 65 3HG PRO 65 5.529 10.975 -16.677 512 HD2 PRO 65 2HD PRO 65 4.680 12.978 -18.547 513 HD3 PRO 65 3HD PRO 65 4.552 11.241 -18.741 514 H ALA 66 HN ALA 66 1.925 13.088 -14.067 515 HA ALA 66 HA ALA 66 1.732 15.861 -14.970 516 HB1 ALA 66 1HB ALA 66 -0.544 15.321 -15.048 517 HB2 ALA 66 2HB ALA 66 -0.423 14.176 -13.690 518 HB3 ALA 66 3HB ALA 66 -0.358 15.928 -13.385 Start of MODEL 19 1 H1 MET 0 HN MET 0 1.785 0.651 0.799 2 HA MET 0 HA MET 0 2.417 0.558 -1.396 3 HB2 MET 0 2HB MET 0 3.890 -1.369 -1.475 4 HB3 MET 0 3HB MET 0 3.704 -0.992 0.227 5 HG2 MET 0 2HG MET 0 1.618 -2.703 -0.013 6 HG3 MET 0 3HG MET 0 2.588 -3.311 -1.340 7 HE1 MET 0 3HE MET 0 5.410 -4.553 -0.587 8 HE2 MET 0 1HE MET 0 5.178 -2.820 -0.921 9 HE3 MET 0 2HE MET 0 6.043 -3.336 0.546 10 H ASN 1 HN ASN 1 -0.435 0.240 -1.480 11 HA ASN 1 HA ASN 1 -0.584 -1.716 -3.631 12 HB2 ASN 1 2HB ASN 1 -2.772 -1.094 -1.576 13 HB3 ASN 1 3HB ASN 1 -2.946 -2.198 -2.926 14 HD21 ASN 1 1HD2 ASN 1 -1.181 -3.900 -3.076 15 HD22 ASN 1 2HD2 ASN 1 -0.740 -4.715 -1.613 16 H GLN 2 HN GLN 2 -0.340 0.025 -5.197 17 HA GLN 2 HA GLN 2 -2.355 2.111 -5.025 18 HB2 GLN 2 2HB GLN 2 -0.934 3.479 -6.315 19 HB3 GLN 2 3HB GLN 2 0.187 2.591 -5.301 20 HG2 GLN 2 2HG GLN 2 1.152 2.387 -7.448 21 HG3 GLN 2 3HG GLN 2 0.305 0.865 -7.259 22 HE21 GLN 2 1HE2 GLN 2 -0.669 4.193 -8.088 23 HE22 GLN 2 2HE2 GLN 2 -1.501 3.818 -9.560 24 H GLU 3 HN GLU 3 -3.985 2.310 -6.558 25 HA GLU 3 HA GLU 3 -4.463 0.059 -8.163 26 HB2 GLU 3 2HB GLU 3 -5.829 2.633 -7.534 27 HB3 GLU 3 3HB GLU 3 -6.241 1.937 -9.088 28 HG2 GLU 3 2HG GLU 3 -6.860 -0.202 -8.015 29 HG3 GLU 3 3HG GLU 3 -6.331 0.393 -6.454 30 HE2 GLU 3 HE2 GLU 3 -9.030 2.797 -6.433 31 H SER 4 HN SER 4 -4.042 -0.322 -10.327 32 HA SER 4 HA SER 4 -2.818 1.914 -11.747 33 HB2 SER 4 2HB SER 4 -2.198 -0.836 -12.693 34 HB3 SER 4 3HB SER 4 -1.142 0.552 -12.525 35 HG SER 4 HG SER 4 -1.517 -1.559 -10.803 36 H VAL 5 HN VAL 5 -3.432 2.227 -13.962 37 HA VAL 5 HA VAL 5 -6.043 1.610 -14.603 38 HB VAL 5 HB VAL 5 -3.682 2.361 -16.334 39 HG11 VAL 5 1HG1 VAL 5 -5.499 1.297 -17.658 40 HG12 VAL 5 2HG1 VAL 5 -6.633 2.518 -17.032 41 HG13 VAL 5 3HG1 VAL 5 -5.263 3.017 -18.053 42 HG21 VAL 5 3HG2 VAL 5 -3.998 4.482 -15.683 43 HG22 VAL 5 1HG2 VAL 5 -5.765 4.362 -15.865 44 HG23 VAL 5 2HG2 VAL 5 -4.985 3.814 -14.361 45 H VAL 6 HN VAL 6 -7.073 -0.063 -15.655 46 HA VAL 6 HA VAL 6 -5.378 -2.130 -16.831 47 HB VAL 6 HB VAL 6 -7.451 -2.518 -14.670 48 HG11 VAL 6 1HG1 VAL 6 -7.424 -4.855 -15.032 49 HG12 VAL 6 2HG1 VAL 6 -7.645 -4.134 -16.644 50 HG13 VAL 6 3HG1 VAL 6 -6.048 -4.750 -16.156 51 HG21 VAL 6 3HG2 VAL 6 -5.552 -2.296 -13.452 52 HG22 VAL 6 1HG2 VAL 6 -5.299 -3.991 -13.934 53 HG23 VAL 6 2HG2 VAL 6 -4.492 -2.681 -14.829 54 H ALA 7 HN ALA 7 -6.053 -2.426 -18.885 55 HA ALA 7 HA ALA 7 -8.202 -1.223 -20.026 56 HB1 ALA 7 1HB ALA 7 -6.721 -2.093 -21.561 57 HB2 ALA 7 2HB ALA 7 -6.498 -3.607 -20.652 58 HB3 ALA 7 3HB ALA 7 -7.968 -3.361 -21.626 59 H ALA 8 HN ALA 8 -10.258 -1.272 -19.217 60 HA ALA 8 HA ALA 8 -11.307 -3.553 -17.915 61 HB1 ALA 8 1HB ALA 8 -13.176 -1.533 -19.030 62 HB2 ALA 8 2HB ALA 8 -12.993 -2.126 -17.362 63 HB3 ALA 8 3HB ALA 8 -11.886 -0.881 -17.991 64 H VAL 9 HN VAL 9 -10.654 -2.907 -21.183 65 HA VAL 9 HA VAL 9 -12.189 -5.192 -21.977 66 HB VAL 9 HB VAL 9 -13.398 -4.000 -23.769 67 HG11 VAL 9 1HG1 VAL 9 -15.218 -3.258 -22.410 68 HG12 VAL 9 2HG1 VAL 9 -14.418 -4.583 -21.531 69 HG13 VAL 9 3HG1 VAL 9 -14.137 -2.894 -21.044 70 HG21 VAL 9 3HG2 VAL 9 -13.653 -1.396 -22.955 71 HG22 VAL 9 1HG2 VAL 9 -11.925 -1.700 -22.653 72 HG23 VAL 9 2HG2 VAL 9 -12.603 -1.954 -24.279 73 H LEU 10 HN LEU 10 -11.809 -5.520 -24.483 74 HA LEU 10 HA LEU 10 -9.026 -5.545 -24.837 75 HB2 LEU 10 2HB LEU 10 -10.301 -7.266 -25.799 76 HB3 LEU 10 3HB LEU 10 -11.385 -6.146 -26.601 77 HG LEU 10 HG LEU 10 -9.087 -5.432 -27.809 78 HD11 LEU 10 1HD1 LEU 10 -8.231 -7.618 -26.346 79 HD12 LEU 10 2HD1 LEU 10 -8.521 -8.292 -27.968 80 HD13 LEU 10 3HD1 LEU 10 -7.419 -6.910 -27.762 81 HD21 LEU 10 3HD2 LEU 10 -10.150 -7.824 -29.092 82 HD22 LEU 10 1HD2 LEU 10 -11.432 -6.735 -28.511 83 HD23 LEU 10 2HD2 LEU 10 -10.181 -6.125 -29.621 84 H ILE 11 HN ILE 11 -7.857 -3.695 -25.009 85 HA ILE 11 HA ILE 11 -8.988 -1.564 -26.668 86 HB ILE 11 HB ILE 11 -6.564 -1.208 -24.970 87 HG12 ILE 11 2HG1 ILE 11 -9.342 -1.707 -23.949 88 HG13 ILE 11 3HG1 ILE 11 -7.806 -2.268 -23.319 89 HG21 ILE 11 1HG2 ILE 11 -7.740 0.500 -26.577 90 HG22 ILE 11 2HG2 ILE 11 -8.864 0.697 -25.211 91 HG23 ILE 11 3HG2 ILE 11 -7.128 1.020 -24.989 92 HD11 ILE 11 3HD1 ILE 11 -8.650 -0.525 -21.841 93 HD12 ILE 11 1HD1 ILE 11 -7.237 0.123 -22.708 94 HD13 ILE 11 2HD1 ILE 11 -8.880 0.587 -23.213 95 HA PRO 12 HA PRO 12 -6.059 -3.041 -29.595 96 HB2 PRO 12 2HB PRO 12 -7.152 -1.808 -31.775 97 HB3 PRO 12 3HB PRO 12 -7.652 -3.393 -31.220 98 HG2 PRO 12 2HG PRO 12 -9.053 -0.805 -30.941 99 HG3 PRO 12 3HG PRO 12 -9.701 -2.426 -30.786 100 HD2 PRO 12 2HD PRO 12 -9.068 -0.619 -28.650 101 HD3 PRO 12 3HD PRO 12 -9.606 -2.280 -28.494 102 H ILE 13 HN ILE 13 -4.626 -2.011 -31.358 103 HA ILE 13 HA ILE 13 -3.275 0.080 -30.031 104 HB ILE 13 HB ILE 13 -2.106 -1.549 -31.349 105 HG12 ILE 13 2HG1 ILE 13 -1.947 1.262 -32.468 106 HG13 ILE 13 3HG1 ILE 13 -1.030 0.597 -31.130 107 HG21 ILE 13 1HG2 ILE 13 -2.832 -0.583 -34.007 108 HG22 ILE 13 2HG2 ILE 13 -2.691 -2.245 -33.384 109 HG23 ILE 13 3HG2 ILE 13 -4.199 -1.330 -33.145 110 HD11 ILE 13 3HD1 ILE 13 -0.693 -1.138 -33.425 111 HD12 ILE 13 1HD1 ILE 13 -0.357 0.543 -33.905 112 HD13 ILE 13 2HD1 ILE 13 0.539 -0.193 -32.555 113 H ASN 14 HN ASN 14 -2.877 2.275 -30.860 114 HA ASN 14 HA ASN 14 -3.742 4.239 -31.280 115 HB2 ASN 14 2HB ASN 14 -4.736 3.023 -33.902 116 HB3 ASN 14 3HB ASN 14 -4.187 4.666 -33.636 117 HD21 ASN 14 1HD2 ASN 14 -3.316 2.436 -35.436 118 HD22 ASN 14 2HD2 ASN 14 -1.606 2.279 -35.210 119 H THR 15 HN THR 15 -5.535 2.991 -29.632 120 HA THR 15 HA THR 15 -8.153 3.535 -30.873 121 HB THR 15 HB THR 15 -7.332 1.421 -28.813 122 HG1 THR 15 HG1 THR 15 -6.862 0.875 -31.025 123 HG21 THR 15 3HG2 THR 15 -9.963 2.578 -29.544 124 HG22 THR 15 1HG2 THR 15 -9.874 0.821 -29.815 125 HG23 THR 15 2HG2 THR 15 -9.546 1.490 -28.198 126 H ALA 16 HN ALA 16 -9.082 5.322 -30.122 127 HA ALA 16 HA ALA 16 -8.097 6.863 -28.094 128 HB1 ALA 16 1HB ALA 16 -9.997 8.166 -28.425 129 HB2 ALA 16 2HB ALA 16 -9.954 7.228 -29.938 130 HB3 ALA 16 3HB ALA 16 -11.060 6.753 -28.627 131 H LEU 17 HN LEU 17 -8.054 6.743 -25.899 132 HA LEU 17 HA LEU 17 -9.359 4.478 -24.679 133 HB2 LEU 17 2HB LEU 17 -7.457 6.580 -23.644 134 HB3 LEU 17 3HB LEU 17 -8.135 5.307 -22.648 135 HG LEU 17 HG LEU 17 -6.485 4.786 -25.133 136 HD11 LEU 17 1HD1 LEU 17 -5.427 4.468 -22.339 137 HD12 LEU 17 2HD1 LEU 17 -4.546 4.622 -23.878 138 HD13 LEU 17 3HD1 LEU 17 -5.346 6.043 -23.164 139 HD21 LEU 17 3HD2 LEU 17 -7.541 3.017 -22.925 140 HD22 LEU 17 1HD2 LEU 17 -7.811 2.890 -24.680 141 HD23 LEU 17 2HD2 LEU 17 -6.207 2.531 -23.998 142 H THR 18 HN THR 18 -11.060 4.541 -23.206 143 HA THR 18 HA THR 18 -12.241 7.200 -22.760 144 HB THR 18 HB THR 18 -14.477 5.953 -23.033 145 HG1 THR 18 HG1 THR 18 -14.065 3.778 -23.150 146 HG21 THR 18 3HG2 THR 18 -14.209 5.632 -25.583 147 HG22 THR 18 1HG2 THR 18 -13.816 7.256 -24.970 148 HG23 THR 18 2HG2 THR 18 -12.510 6.114 -25.367 149 H VAL 19 HN VAL 19 -14.025 6.991 -20.960 150 HA VAL 19 HA VAL 19 -12.606 5.984 -18.684 151 HB VAL 19 HB VAL 19 -14.056 8.143 -19.026 152 HG11 VAL 19 1HG1 VAL 19 -16.132 6.100 -18.168 153 HG12 VAL 19 2HG1 VAL 19 -16.345 7.865 -18.074 154 HG13 VAL 19 3HG1 VAL 19 -16.134 7.077 -19.656 155 HG21 VAL 19 3HG2 VAL 19 -14.604 8.062 -16.523 156 HG22 VAL 19 1HG2 VAL 19 -13.901 6.427 -16.540 157 HG23 VAL 19 2HG2 VAL 19 -12.903 7.830 -16.991 158 H GLY 20 HN GLY 20 -14.881 4.744 -20.965 159 HA2 GLY 20 1HA GLY 20 -15.902 2.754 -19.054 160 HA3 GLY 20 2HA GLY 20 -16.561 3.127 -20.635 161 H MET 21 HN MET 21 -13.113 3.081 -20.687 162 HA MET 21 HA MET 21 -13.217 0.351 -21.717 163 HB2 MET 21 2HB MET 21 -11.974 2.900 -22.682 164 HB3 MET 21 3HB MET 21 -10.925 1.501 -22.802 165 HG2 MET 21 2HG MET 21 -13.327 0.486 -23.772 166 HG3 MET 21 3HG MET 21 -13.392 2.146 -24.331 167 HE1 MET 21 3HE MET 21 -11.187 3.321 -25.191 168 HE2 MET 21 1HE MET 21 -9.880 2.411 -24.395 169 HE3 MET 21 2HE MET 21 -9.950 2.498 -26.172 170 H MET 22 HN MET 22 -11.626 2.684 -19.579 171 HA MET 22 HA MET 22 -9.607 0.690 -18.950 172 HB2 MET 22 2HB MET 22 -9.901 3.672 -18.297 173 HB3 MET 22 3HB MET 22 -8.609 2.687 -17.641 174 HG2 MET 22 2HG MET 22 -7.698 2.244 -19.849 175 HG3 MET 22 3HG MET 22 -9.119 2.895 -20.642 176 HE1 MET 22 3HE MET 22 -9.954 5.417 -19.420 177 HE2 MET 22 1HE MET 22 -8.898 6.680 -20.096 178 HE3 MET 22 2HE MET 22 -9.520 5.384 -21.146 179 H THR 23 HN THR 23 -8.946 0.937 -16.405 180 HA THR 23 HA THR 23 -11.076 1.438 -14.612 181 HB THR 23 HB THR 23 -11.589 -0.842 -15.958 182 HG1 THR 23 HG1 THR 23 -12.909 -0.145 -14.226 183 HG21 THR 23 3HG2 THR 23 -9.264 -1.749 -15.065 184 HG22 THR 23 1HG2 THR 23 -10.123 -1.894 -13.513 185 HG23 THR 23 2HG2 THR 23 -10.699 -2.793 -14.936 186 H THR 24 HN THR 24 -10.488 0.531 -12.346 187 HA THR 24 HA THR 24 -7.562 0.765 -12.105 188 HB THR 24 HB THR 24 -7.996 1.922 -10.014 189 HG1 THR 24 HG1 THR 24 -10.800 1.282 -10.575 190 HG21 THR 24 3HG2 THR 24 -10.294 2.816 -11.819 191 HG22 THR 24 1HG2 THR 24 -9.382 3.803 -10.652 192 HG23 THR 24 2HG2 THR 24 -8.601 3.251 -12.152 193 H ARG 25 HN ARG 25 -6.398 -0.763 -11.039 194 HA ARG 25 HA ARG 25 -7.693 -2.571 -9.308 195 HB2 ARG 25 2HB ARG 25 -7.596 -3.279 -12.095 196 HB3 ARG 25 3HB ARG 25 -6.427 -4.296 -11.276 197 HG2 ARG 25 2HG ARG 25 -8.135 -5.606 -10.566 198 HG3 ARG 25 3HG ARG 25 -8.689 -4.279 -9.565 199 HD2 ARG 25 2HD ARG 25 -10.433 -3.785 -10.971 200 HD3 ARG 25 3HD ARG 25 -9.449 -3.958 -12.410 201 HE ARG 25 HE ARG 25 -9.748 -6.569 -11.484 202 HH11 ARG 25 2HH2 ARG 25 -11.989 -3.979 -12.393 203 HH12 ARG 25 1HH2 ARG 25 -13.235 -5.068 -12.904 204 HH22 ARG 25 HH1 ARG 25 -12.862 -7.431 -12.757 205 H VAL 26 HN VAL 26 -6.126 -3.772 -8.045 206 HA VAL 26 HA VAL 26 -3.495 -2.627 -8.155 207 HB VAL 26 HB VAL 26 -4.719 -4.724 -6.350 208 HG11 VAL 26 1HG1 VAL 26 -2.806 -3.733 -4.822 209 HG12 VAL 26 2HG1 VAL 26 -2.463 -5.032 -5.990 210 HG13 VAL 26 3HG1 VAL 26 -2.054 -3.346 -6.389 211 HG21 VAL 26 3HG2 VAL 26 -5.966 -2.948 -5.701 212 HG22 VAL 26 1HG2 VAL 26 -4.488 -2.498 -4.816 213 HG23 VAL 26 2HG2 VAL 26 -4.838 -1.761 -6.398 214 H VAL 27 HN VAL 27 -2.823 -3.405 -10.279 215 HA VAL 27 HA VAL 27 -2.314 -6.293 -10.323 216 HB VAL 27 HB VAL 27 -2.297 -6.164 -12.668 217 HG11 VAL 27 1HG1 VAL 27 -4.540 -5.771 -11.350 218 HG12 VAL 27 2HG1 VAL 27 -4.476 -4.168 -12.121 219 HG13 VAL 27 3HG1 VAL 27 -4.502 -5.638 -13.124 220 HG21 VAL 27 3HG2 VAL 27 -1.887 -3.224 -12.235 221 HG22 VAL 27 1HG2 VAL 27 -1.045 -4.347 -13.330 222 HG23 VAL 27 2HG2 VAL 27 -2.683 -3.774 -13.730 223 H SER 28 HN SER 28 -0.184 -6.985 -11.218 224 HA SER 28 HA SER 28 1.840 -4.946 -10.732 225 HB2 SER 28 2HB SER 28 1.431 -6.890 -8.931 226 HB3 SER 28 3HB SER 28 2.404 -7.828 -10.048 227 HG SER 28 HG SER 28 3.996 -6.940 -8.872 228 HA PRO 29 HA PRO 29 3.720 -4.698 -11.013 229 HB2 PRO 29 2HB PRO 29 5.149 -3.126 -12.732 230 HB3 PRO 29 3HB PRO 29 5.831 -4.518 -11.915 231 HG2 PRO 29 2HG PRO 29 5.011 -4.246 -14.742 232 HG3 PRO 29 3HG PRO 29 6.063 -5.444 -14.014 233 HD2 PRO 29 2HD PRO 29 3.332 -5.815 -14.809 234 HD3 PRO 29 3HD PRO 29 4.348 -6.975 -13.977 235 H THR 30 HN THR 30 3.254 -2.533 -10.387 236 HA THR 30 HA THR 30 0.741 -1.724 -11.407 237 HB THR 30 HB THR 30 1.317 0.298 -9.871 238 HG1 THR 30 HG1 THR 30 3.295 -0.441 -8.542 239 HG21 THR 30 3HG2 THR 30 0.162 -1.839 -9.032 240 HG22 THR 30 1HG2 THR 30 1.778 -2.449 -8.605 241 HG23 THR 30 2HG2 THR 30 1.138 -0.991 -7.809 242 H GLY 31 HN GLY 31 0.276 -0.713 -13.247 243 HA2 GLY 31 1HA GLY 31 2.438 0.696 -14.635 244 HA3 GLY 31 2HA GLY 31 0.911 0.164 -15.310 245 H ILE 32 HN ILE 32 0.398 2.242 -16.187 246 HA ILE 32 HA ILE 32 0.580 4.661 -15.048 247 HB ILE 32 HB ILE 32 -1.653 3.517 -16.721 248 HG12 ILE 32 2HG1 ILE 32 0.688 5.258 -17.533 249 HG13 ILE 32 3HG1 ILE 32 0.707 3.508 -17.623 250 HG21 ILE 32 1HG2 ILE 32 -2.182 5.650 -15.345 251 HG22 ILE 32 2HG2 ILE 32 -1.083 6.459 -16.487 252 HG23 ILE 32 3HG2 ILE 32 -2.537 5.628 -17.089 253 HD11 ILE 32 3HD1 ILE 32 -0.123 5.090 -19.673 254 HD12 ILE 32 1HD1 ILE 32 -0.738 3.439 -19.416 255 HD13 ILE 32 2HD1 ILE 32 -1.678 4.838 -18.844 256 HA PRO 33 HA PRO 33 -1.906 4.612 -11.512 257 HB2 PRO 33 2HB PRO 33 -2.092 7.295 -11.026 258 HB3 PRO 33 3HB PRO 33 -0.702 6.332 -10.566 259 HG2 PRO 33 2HG PRO 33 -0.970 8.252 -12.798 260 HG3 PRO 33 3HG PRO 33 0.490 7.613 -12.068 261 HD2 PRO 33 2HD PRO 33 -0.662 6.825 -14.573 262 HD3 PRO 33 3HD PRO 33 0.731 6.107 -13.788 263 H ALA 34 HN ALA 34 -4.012 4.795 -10.689 264 HA ALA 34 HA ALA 34 -5.937 4.859 -12.727 265 HB1 ALA 34 1HB ALA 34 -6.072 3.609 -10.554 266 HB2 ALA 34 2HB ALA 34 -6.316 5.164 -9.722 267 HB3 ALA 34 3HB ALA 34 -7.518 4.587 -10.902 268 H GLU 35 HN GLU 35 -4.224 7.370 -11.129 269 HA GLU 35 HA GLU 35 -6.366 9.247 -11.210 270 HB2 GLU 35 2HB GLU 35 -4.804 10.804 -10.289 271 HB3 GLU 35 3HB GLU 35 -4.423 9.261 -9.549 272 HG2 GLU 35 2HG GLU 35 -2.782 9.070 -11.693 273 HG3 GLU 35 3HG GLU 35 -2.874 10.818 -11.609 274 HE2 GLU 35 HE2 GLU 35 -0.930 11.322 -9.209 275 H ASP 36 HN ASP 36 -4.285 7.844 -13.516 276 HA ASP 36 HA ASP 36 -4.208 10.241 -15.130 277 HB2 ASP 36 2HB ASP 36 -2.897 7.513 -15.253 278 HB3 ASP 36 3HB ASP 36 -2.988 8.477 -16.713 279 HD2 ASP 36 HD2 ASP 36 -1.102 10.729 -14.150 280 H ILE 37 HN ILE 37 -6.315 7.720 -14.434 281 HA ILE 37 HA ILE 37 -7.065 6.643 -16.850 282 HB ILE 37 HB ILE 37 -8.262 7.030 -14.188 283 HG12 ILE 37 2HG1 ILE 37 -7.786 4.768 -16.118 284 HG13 ILE 37 3HG1 ILE 37 -7.124 5.009 -14.513 285 HG21 ILE 37 1HG2 ILE 37 -10.090 7.891 -15.557 286 HG22 ILE 37 2HG2 ILE 37 -10.022 6.439 -16.585 287 HG23 ILE 37 3HG2 ILE 37 -10.497 6.298 -14.875 288 HD11 ILE 37 3HD1 ILE 37 -9.483 4.762 -13.582 289 HD12 ILE 37 1HD1 ILE 37 -10.003 4.298 -15.220 290 HD13 ILE 37 2HD1 ILE 37 -8.825 3.294 -14.342 291 HA PRO 38 HA PRO 38 -9.819 10.447 -17.418 292 HB2 PRO 38 2HB PRO 38 -9.446 12.646 -15.840 293 HB3 PRO 38 3HB PRO 38 -10.666 11.431 -15.516 294 HG2 PRO 38 2HG PRO 38 -8.087 11.879 -14.143 295 HG3 PRO 38 3HG PRO 38 -9.484 10.978 -13.589 296 HD2 PRO 38 2HD PRO 38 -7.041 9.890 -14.628 297 HD3 PRO 38 3HD PRO 38 -8.481 8.996 -14.182 298 H ARG 39 HN ARG 39 -6.520 10.402 -17.042 299 HA ARG 39 HA ARG 39 -6.223 12.757 -18.687 300 HB2 ARG 39 2HB ARG 39 -4.078 10.960 -17.447 301 HB3 ARG 39 3HB ARG 39 -3.793 12.508 -18.218 302 HG2 ARG 39 2HG ARG 39 -5.268 13.606 -16.490 303 HG3 ARG 39 3HG ARG 39 -5.461 12.055 -15.699 304 HD2 ARG 39 2HD ARG 39 -3.681 13.374 -14.591 305 HD3 ARG 39 3HD ARG 39 -3.010 11.920 -15.303 306 HE ARG 39 HE ARG 39 -2.572 14.692 -16.224 307 HH11 ARG 39 2HH2 ARG 39 -2.193 11.244 -16.943 308 HH12 ARG 39 1HH2 ARG 39 -0.948 11.499 -18.120 309 HH22 ARG 39 HH1 ARG 39 -0.221 13.733 -18.594 310 H LEU 40 HN LEU 40 -6.454 9.310 -18.886 311 HA LEU 40 HA LEU 40 -4.846 9.119 -21.287 312 HB2 LEU 40 2HB LEU 40 -6.438 7.094 -19.711 313 HB3 LEU 40 3HB LEU 40 -5.549 6.723 -21.175 314 HG LEU 40 HG LEU 40 -4.182 7.949 -18.780 315 HD11 LEU 40 1HD1 LEU 40 -5.420 5.378 -18.856 316 HD12 LEU 40 2HD1 LEU 40 -3.654 5.156 -18.877 317 HD13 LEU 40 3HD1 LEU 40 -4.416 6.103 -17.577 318 HD21 LEU 40 3HD2 LEU 40 -2.174 7.157 -19.744 319 HD22 LEU 40 1HD2 LEU 40 -3.044 6.133 -20.911 320 HD23 LEU 40 2HD2 LEU 40 -3.096 7.906 -21.070 321 H ILE 41 HN ILE 41 -8.155 9.689 -20.285 322 HA ILE 41 HA ILE 41 -9.524 8.684 -22.467 323 HB ILE 41 HB ILE 41 -10.132 11.154 -20.838 324 HG12 ILE 41 2HG1 ILE 41 -10.405 8.227 -20.266 325 HG13 ILE 41 3HG1 ILE 41 -9.917 9.535 -19.206 326 HG21 ILE 41 1HG2 ILE 41 -12.453 10.750 -21.437 327 HG22 ILE 41 2HG2 ILE 41 -11.462 10.978 -22.898 328 HG23 ILE 41 3HG2 ILE 41 -11.978 9.343 -22.419 329 HD11 ILE 41 3HD1 ILE 41 -12.185 8.721 -18.626 330 HD12 ILE 41 1HD1 ILE 41 -12.246 10.410 -19.184 331 HD13 ILE 41 2HD1 ILE 41 -12.745 9.094 -20.273 332 H SER 42 HN SER 42 -9.902 9.364 -24.554 333 HA SER 42 HA SER 42 -9.908 10.710 -26.303 334 HB2 SER 42 2HB SER 42 -9.811 12.653 -24.484 335 HB3 SER 42 3HB SER 42 -8.148 12.801 -25.015 336 HG SER 42 HG SER 42 -9.944 12.612 -27.148 337 H MET 43 HN MET 43 -7.256 9.509 -24.525 338 HA MET 43 HA MET 43 -5.400 10.037 -26.694 339 HB2 MET 43 2HB MET 43 -4.823 8.640 -24.035 340 HB3 MET 43 3HB MET 43 -3.666 9.423 -25.093 341 HG2 MET 43 2HG MET 43 -5.336 11.539 -24.601 342 HG3 MET 43 3HG MET 43 -5.556 10.642 -23.112 343 HE1 MET 43 3HE MET 43 -1.909 9.477 -23.615 344 HE2 MET 43 1HE MET 43 -1.989 10.019 -21.922 345 HE3 MET 43 2HE MET 43 -3.352 9.123 -22.634 346 H GLN 44 HN GLN 44 -4.711 8.435 -28.089 347 HA GLN 44 HA GLN 44 -5.996 5.878 -27.744 348 HB2 GLN 44 2HB GLN 44 -4.277 6.770 -30.090 349 HB3 GLN 44 3HB GLN 44 -5.471 5.487 -30.067 350 HG2 GLN 44 2HG GLN 44 -7.302 7.034 -29.923 351 HG3 GLN 44 3HG GLN 44 -6.258 8.360 -29.454 352 HE21 GLN 44 1HE2 GLN 44 -6.808 6.021 -32.070 353 HE22 GLN 44 2HE2 GLN 44 -6.421 7.070 -33.394 354 H VAL 45 HN VAL 45 -4.836 3.846 -27.759 355 HA VAL 45 HA VAL 45 -2.321 4.029 -26.415 356 HB VAL 45 HB VAL 45 -2.501 1.509 -26.552 357 HG11 VAL 45 1HG1 VAL 45 -4.754 3.115 -25.303 358 HG12 VAL 45 2HG1 VAL 45 -4.388 1.417 -24.916 359 HG13 VAL 45 3HG1 VAL 45 -3.193 2.688 -24.562 360 HG21 VAL 45 3HG2 VAL 45 -4.251 1.957 -28.596 361 HG22 VAL 45 1HG2 VAL 45 -4.166 0.450 -27.652 362 HG23 VAL 45 2HG2 VAL 45 -5.372 1.693 -27.239 363 H ASN 46 HN ASN 46 -0.298 3.094 -27.155 364 HA ASN 46 HA ASN 46 -0.090 3.352 -30.036 365 HB2 ASN 46 2HB ASN 46 2.366 3.602 -29.594 366 HB3 ASN 46 3HB ASN 46 1.430 4.779 -28.694 367 HD21 ASN 46 1HD2 ASN 46 2.106 5.074 -26.726 368 HD22 ASN 46 2HD2 ASN 46 2.781 3.895 -25.651 369 H GLN 47 HN GLN 47 -1.200 0.936 -28.682 370 HA GLN 47 HA GLN 47 0.175 -1.007 -30.060 371 HB2 GLN 47 2HB GLN 47 1.994 -1.004 -28.555 372 HB3 GLN 47 3HB GLN 47 0.977 -0.711 -27.159 373 HG2 GLN 47 2HG GLN 47 0.006 -3.002 -27.374 374 HG3 GLN 47 3HG GLN 47 1.000 -3.297 -28.787 375 HE21 GLN 47 1HE2 GLN 47 1.611 -1.740 -25.641 376 HE22 GLN 47 2HE2 GLN 47 2.959 -2.720 -25.169 377 H VAL 48 HN VAL 48 -0.760 -3.235 -29.617 378 HA VAL 48 HA VAL 48 -3.538 -2.935 -28.992 379 HB VAL 48 HB VAL 48 -1.737 -5.049 -30.085 380 HG11 VAL 48 1HG1 VAL 48 -4.344 -5.544 -28.675 381 HG12 VAL 48 2HG1 VAL 48 -3.919 -6.513 -30.107 382 HG13 VAL 48 3HG1 VAL 48 -2.852 -6.513 -28.682 383 HG21 VAL 48 3HG2 VAL 48 -4.403 -3.911 -30.992 384 HG22 VAL 48 1HG2 VAL 48 -2.799 -3.410 -31.579 385 HG23 VAL 48 2HG2 VAL 48 -3.388 -5.059 -31.897 386 H VAL 49 HN VAL 49 -4.144 -2.755 -26.888 387 HA VAL 49 HA VAL 49 -2.773 -4.514 -24.977 388 HB VAL 49 HB VAL 49 -2.390 -2.548 -23.994 389 HG11 VAL 49 1HG1 VAL 49 -3.749 -0.465 -24.435 390 HG12 VAL 49 2HG1 VAL 49 -2.953 -1.169 -25.863 391 HG13 VAL 49 3HG1 VAL 49 -4.697 -1.416 -25.603 392 HG21 VAL 49 3HG2 VAL 49 -5.296 -2.273 -23.290 393 HG22 VAL 49 1HG2 VAL 49 -4.404 -3.720 -22.762 394 HG23 VAL 49 2HG2 VAL 49 -3.852 -2.103 -22.263 395 HA PRO 50 HA PRO 50 -6.664 -6.523 -24.970 396 HB2 PRO 50 2HB PRO 50 -5.901 -8.712 -23.523 397 HB3 PRO 50 3HB PRO 50 -5.712 -8.599 -25.261 398 HG2 PRO 50 2HG PRO 50 -3.652 -8.368 -23.154 399 HG3 PRO 50 3HG PRO 50 -3.442 -8.682 -24.865 400 HD2 PRO 50 2HD PRO 50 -2.980 -6.198 -23.507 401 HD3 PRO 50 3HD PRO 50 -2.883 -6.483 -25.233 402 H MET 51 HN MET 51 -8.317 -7.320 -23.418 403 HA MET 51 HA MET 51 -8.531 -5.403 -21.417 404 HB2 MET 51 2HB MET 51 -10.488 -6.516 -22.448 405 HB3 MET 51 3HB MET 51 -9.944 -8.084 -21.888 406 HG2 MET 51 2HG MET 51 -10.073 -6.983 -19.478 407 HG3 MET 51 3HG MET 51 -11.097 -5.796 -20.262 408 HE1 MET 51 3HE MET 51 -13.752 -8.188 -21.959 409 HE2 MET 51 1HE MET 51 -13.598 -6.502 -21.409 410 HE3 MET 51 2HE MET 51 -12.370 -7.201 -22.491 411 H GLY 52 HN GLY 52 -7.715 -5.314 -19.364 412 HA2 GLY 52 1HA GLY 52 -7.338 -6.326 -17.262 413 HA3 GLY 52 2HA GLY 52 -6.986 -7.849 -18.054 414 H THR 53 HN THR 53 -5.447 -6.035 -20.179 415 HA THR 53 HA THR 53 -2.894 -6.419 -18.948 416 HB THR 53 HB THR 53 -3.870 -5.245 -21.600 417 HG1 THR 53 HG1 THR 53 -4.100 -7.572 -21.172 418 HG21 THR 53 3HG2 THR 53 -1.710 -4.340 -21.603 419 HG22 THR 53 1HG2 THR 53 -1.110 -5.515 -20.408 420 HG23 THR 53 2HG2 THR 53 -1.323 -6.003 -22.107 421 H THR 54 HN THR 54 -2.016 -5.126 -17.469 422 HA THR 54 HA THR 54 -2.988 -2.667 -16.730 423 HB THR 54 HB THR 54 -0.053 -3.494 -16.583 424 HG1 THR 54 HG1 THR 54 -0.788 -5.182 -15.330 425 HG21 THR 54 3HG2 THR 54 -0.379 -2.663 -14.209 426 HG22 THR 54 1HG2 THR 54 -0.594 -1.382 -15.426 427 HG23 THR 54 2HG2 THR 54 -2.016 -2.133 -14.664 428 H LEU 55 HN LEU 55 -2.785 -0.569 -17.338 429 HA LEU 55 HA LEU 55 -1.696 -0.146 -19.965 430 HB2 LEU 55 2HB LEU 55 -3.571 1.157 -18.156 431 HB3 LEU 55 3HB LEU 55 -2.489 2.301 -18.925 432 HG LEU 55 HG LEU 55 -4.426 0.395 -20.243 433 HD11 LEU 55 1HD1 LEU 55 -5.676 2.244 -19.861 434 HD12 LEU 55 2HD1 LEU 55 -4.265 3.327 -19.793 435 HD13 LEU 55 3HD1 LEU 55 -4.893 2.783 -21.367 436 HD21 LEU 55 3HD2 LEU 55 -2.745 0.119 -21.759 437 HD22 LEU 55 1HD2 LEU 55 -3.454 1.630 -22.379 438 HD23 LEU 55 2HD2 LEU 55 -1.984 1.682 -21.377 439 H MET 56 HN MET 56 0.116 1.082 -20.517 440 HA MET 56 HA MET 56 1.769 1.807 -18.221 441 HB2 MET 56 2HB MET 56 2.487 0.678 -20.977 442 HB3 MET 56 3HB MET 56 3.697 1.390 -19.928 443 HG2 MET 56 2HG MET 56 1.948 -0.641 -18.611 444 HG3 MET 56 3HG MET 56 2.975 -1.273 -19.882 445 HE1 MET 56 3HE MET 56 3.172 -1.494 -16.264 446 HE2 MET 56 1HE MET 56 4.069 -0.055 -15.723 447 HE3 MET 56 2HE MET 56 2.505 0.131 -16.552 448 HA PRO 57 HA PRO 57 2.100 5.776 -19.943 449 HB2 PRO 57 2HB PRO 57 4.594 6.592 -19.178 450 HB3 PRO 57 3HB PRO 57 3.212 6.597 -18.101 451 HG2 PRO 57 2HG PRO 57 5.498 4.724 -18.175 452 HG3 PRO 57 3HG PRO 57 4.353 5.009 -16.879 453 HD2 PRO 57 2HD PRO 57 4.385 2.777 -18.680 454 HD3 PRO 57 3HD PRO 57 3.176 3.122 -17.460 455 H ASP 58 HN ASP 58 4.315 3.391 -20.941 456 HA ASP 58 HA ASP 58 5.145 5.093 -23.132 457 HB2 ASP 58 2HB ASP 58 6.332 2.921 -21.630 458 HB3 ASP 58 3HB ASP 58 6.241 2.433 -23.311 459 HD2 ASP 58 HD2 ASP 58 8.136 5.688 -22.128 460 H MET 59 HN MET 59 2.501 3.324 -22.439 461 HA MET 59 HA MET 59 2.429 2.034 -25.057 462 HB2 MET 59 2HB MET 59 1.202 1.354 -22.353 463 HB3 MET 59 3HB MET 59 0.438 0.757 -23.812 464 HG2 MET 59 2HG MET 59 2.864 -0.080 -24.453 465 HG3 MET 59 3HG MET 59 3.212 0.128 -22.748 466 HE1 MET 59 3HE MET 59 -0.272 -0.369 -22.336 467 HE2 MET 59 1HE MET 59 -0.124 -1.941 -21.513 468 HE3 MET 59 2HE MET 59 0.947 -0.594 -21.058 469 H VAL 60 HN VAL 60 1.785 4.908 -24.138 470 HA VAL 60 HA VAL 60 -0.884 4.951 -25.334 471 HB VAL 60 HB VAL 60 -0.024 6.514 -22.890 472 HG11 VAL 60 1HG1 VAL 60 -2.221 7.464 -22.861 473 HG12 VAL 60 2HG1 VAL 60 -1.566 7.697 -24.500 474 HG13 VAL 60 3HG1 VAL 60 -2.761 6.414 -24.193 475 HG21 VAL 60 3HG2 VAL 60 -0.552 4.007 -22.626 476 HG22 VAL 60 1HG2 VAL 60 -1.426 5.153 -21.582 477 HG23 VAL 60 2HG2 VAL 60 -2.233 4.454 -23.006 478 H LYS 61 HN LYS 61 -1.229 6.672 -26.763 479 HA LYS 61 HA LYS 61 1.204 8.026 -27.553 480 HB2 LYS 61 2HB LYS 61 -1.542 7.774 -28.803 481 HB3 LYS 61 3HB LYS 61 -0.273 8.779 -29.473 482 HG2 LYS 61 2HG LYS 61 1.229 6.649 -29.365 483 HG3 LYS 61 3HG LYS 61 -0.257 5.759 -29.101 484 HD2 LYS 61 2HD LYS 61 -0.388 7.683 -31.367 485 HD3 LYS 61 3HD LYS 61 0.788 6.402 -31.588 486 HE2 LYS 61 2HE LYS 61 -0.896 4.677 -31.297 487 HE3 LYS 61 3HE LYS 61 -2.079 5.833 -30.718 488 HZ1 LYS 61 2HZ LYS 61 -2.715 5.941 -32.866 489 HZ3 LYS 61 1HZ LYS 61 -1.372 5.211 -33.429 490 H GLY 62 HN GLY 62 1.365 10.345 -27.785 491 HA2 GLY 62 1HA GLY 62 1.219 12.415 -26.910 492 HA3 GLY 62 2HA GLY 62 -0.509 12.228 -27.137 493 H TYR 63 HN TYR 63 1.120 9.945 -24.999 494 HA TYR 63 HA TYR 63 -0.424 10.951 -22.783 495 HB2 TYR 63 2HB TYR 63 -0.209 8.529 -23.160 496 HB3 TYR 63 3HB TYR 63 1.523 8.657 -23.396 497 HD1 TYR 63 HD1 TYR 63 3.043 8.917 -21.464 498 HD2 TYR 63 HD2 TYR 63 -1.173 8.422 -20.933 499 HE1 TYR 63 HE1 TYR 63 3.411 8.350 -19.014 500 HE2 TYR 63 HE2 TYR 63 -0.791 7.857 -18.484 501 HH TYR 63 HH TYR 63 1.891 8.576 -16.867 502 H ALA 64 HN ALA 64 0.796 10.903 -20.536 503 HA ALA 64 HA ALA 64 3.450 11.422 -20.258 504 HB1 ALA 64 1HB ALA 64 2.049 13.641 -21.550 505 HB2 ALA 64 2HB ALA 64 2.810 14.137 -20.019 506 HB3 ALA 64 3HB ALA 64 3.793 13.390 -21.301 507 HA PRO 65 HA PRO 65 1.889 11.539 -16.224 508 HB2 PRO 65 2HB PRO 65 4.129 12.228 -14.817 509 HB3 PRO 65 3HB PRO 65 3.812 10.598 -15.377 510 HG2 PRO 65 2HG PRO 65 5.713 12.590 -16.452 511 HG3 PRO 65 3HG PRO 65 5.678 10.857 -16.707 512 HD2 PRO 65 2HD PRO 65 4.822 12.880 -18.551 513 HD3 PRO 65 3HD PRO 65 4.681 11.145 -18.758 514 H ALA 66 HN ALA 66 1.277 12.823 -14.361 515 HA ALA 66 HA ALA 66 1.762 15.665 -14.791 516 HB1 ALA 66 1HB ALA 66 -0.698 16.094 -14.466 517 HB2 ALA 66 2HB ALA 66 -0.304 15.277 -15.998 518 HB3 ALA 66 3HB ALA 66 -0.976 14.344 -14.638 Start of MODEL 20 1 H1 MET 0 HN MET 0 4.173 -0.712 -1.964 2 HA MET 0 HA MET 0 1.931 -1.167 -0.262 3 HB2 MET 0 2HB MET 0 3.133 1.085 -0.801 4 HB3 MET 0 3HB MET 0 2.317 1.040 -2.351 5 HG2 MET 0 2HG MET 0 0.202 1.408 -1.416 6 HG3 MET 0 3HG MET 0 0.618 0.645 0.106 7 HE1 MET 0 3HE MET 0 2.345 4.475 -1.478 8 HE2 MET 0 1HE MET 0 1.388 3.240 -2.330 9 HE3 MET 0 2HE MET 0 0.567 4.571 -1.480 10 H ASN 1 HN ASN 1 -0.363 -0.570 -1.260 11 HA ASN 1 HA ASN 1 -0.586 -2.196 -3.666 12 HB2 ASN 1 2HB ASN 1 -2.813 -1.538 -1.676 13 HB3 ASN 1 3HB ASN 1 -2.843 -2.772 -2.920 14 HD21 ASN 1 1HD2 ASN 1 -3.288 -3.075 -0.105 15 HD22 ASN 1 2HD2 ASN 1 -2.107 -4.178 0.519 16 H GLN 2 HN GLN 2 -0.412 -0.501 -5.248 17 HA GLN 2 HA GLN 2 -2.346 1.657 -4.935 18 HB2 GLN 2 2HB GLN 2 -0.898 3.085 -6.114 19 HB3 GLN 2 3HB GLN 2 0.212 2.120 -5.162 20 HG2 GLN 2 2HG GLN 2 1.178 2.046 -7.316 21 HG3 GLN 2 3HG GLN 2 0.309 0.526 -7.232 22 HE21 GLN 2 1HE2 GLN 2 -0.621 3.916 -7.830 23 HE22 GLN 2 2HE2 GLN 2 -1.453 3.654 -9.327 24 H GLU 3 HN GLU 3 -3.961 1.935 -6.470 25 HA GLU 3 HA GLU 3 -4.417 -0.226 -8.204 26 HB2 GLU 3 2HB GLU 3 -5.796 2.315 -7.457 27 HB3 GLU 3 3HB GLU 3 -6.200 1.680 -9.039 28 HG2 GLU 3 2HG GLU 3 -6.623 -0.586 -7.921 29 HG3 GLU 3 3HG GLU 3 -6.426 0.211 -6.373 30 HE2 GLU 3 HE2 GLU 3 -8.850 -0.422 -8.702 31 H SER 4 HN SER 4 -4.064 -0.451 -10.415 32 HA SER 4 HA SER 4 -2.830 1.864 -11.691 33 HB2 SER 4 2HB SER 4 -2.123 -0.818 -12.761 34 HB3 SER 4 3HB SER 4 -1.107 0.588 -12.513 35 HG SER 4 HG SER 4 -1.379 -1.616 -10.929 36 H VAL 5 HN VAL 5 -3.381 2.219 -13.933 37 HA VAL 5 HA VAL 5 -5.981 1.617 -14.628 38 HB VAL 5 HB VAL 5 -3.591 2.403 -16.302 39 HG11 VAL 5 1HG1 VAL 5 -5.657 1.317 -17.491 40 HG12 VAL 5 2HG1 VAL 5 -6.438 2.880 -17.150 41 HG13 VAL 5 3HG1 VAL 5 -4.955 2.822 -18.132 42 HG21 VAL 5 3HG2 VAL 5 -3.860 4.445 -15.451 43 HG22 VAL 5 1HG2 VAL 5 -5.565 4.463 -15.962 44 HG23 VAL 5 2HG2 VAL 5 -5.121 3.810 -14.366 45 H VAL 6 HN VAL 6 -6.997 -0.041 -15.708 46 HA VAL 6 HA VAL 6 -5.285 -2.086 -16.903 47 HB VAL 6 HB VAL 6 -7.402 -2.509 -14.791 48 HG11 VAL 6 1HG1 VAL 6 -5.970 -4.726 -16.266 49 HG12 VAL 6 2HG1 VAL 6 -7.393 -4.829 -15.203 50 HG13 VAL 6 3HG1 VAL 6 -7.538 -4.086 -16.813 51 HG21 VAL 6 3HG2 VAL 6 -5.007 -4.001 -14.355 52 HG22 VAL 6 1HG2 VAL 6 -4.549 -2.320 -14.720 53 HG23 VAL 6 2HG2 VAL 6 -5.678 -2.666 -13.388 54 H ALA 7 HN ALA 7 -5.978 -2.573 -18.924 55 HA ALA 7 HA ALA 7 -8.066 -1.265 -20.128 56 HB1 ALA 7 1HB ALA 7 -6.561 -2.183 -21.619 57 HB2 ALA 7 2HB ALA 7 -6.415 -3.703 -20.705 58 HB3 ALA 7 3HB ALA 7 -7.851 -3.406 -21.713 59 H ALA 8 HN ALA 8 -10.096 -1.257 -19.212 60 HA ALA 8 HA ALA 8 -11.219 -3.496 -17.946 61 HB1 ALA 8 1HB ALA 8 -13.006 -1.434 -19.144 62 HB2 ALA 8 2HB ALA 8 -12.924 -2.048 -17.475 63 HB3 ALA 8 3HB ALA 8 -11.748 -0.835 -18.036 64 H VAL 9 HN VAL 9 -10.602 -2.819 -21.251 65 HA VAL 9 HA VAL 9 -12.111 -5.142 -22.015 66 HB VAL 9 HB VAL 9 -13.321 -3.954 -23.819 67 HG11 VAL 9 1HG1 VAL 9 -14.041 -2.940 -21.049 68 HG12 VAL 9 2HG1 VAL 9 -15.137 -3.158 -22.435 69 HG13 VAL 9 3HG1 VAL 9 -14.396 -4.576 -21.655 70 HG21 VAL 9 3HG2 VAL 9 -12.730 -1.862 -24.329 71 HG22 VAL 9 1HG2 VAL 9 -13.512 -1.336 -22.819 72 HG23 VAL 9 2HG2 VAL 9 -11.771 -1.708 -22.837 73 H LEU 10 HN LEU 10 -11.697 -5.575 -24.462 74 HA LEU 10 HA LEU 10 -8.919 -5.517 -24.838 75 HB2 LEU 10 2HB LEU 10 -10.090 -7.325 -25.729 76 HB3 LEU 10 3HB LEU 10 -11.280 -6.305 -26.512 77 HG LEU 10 HG LEU 10 -9.112 -5.477 -27.859 78 HD11 LEU 10 1HD1 LEU 10 -7.303 -6.681 -27.363 79 HD12 LEU 10 2HD1 LEU 10 -8.251 -7.908 -26.490 80 HD13 LEU 10 3HD1 LEU 10 -8.077 -8.010 -28.258 81 HD21 LEU 10 3HD2 LEU 10 -9.926 -7.939 -29.093 82 HD22 LEU 10 1HD2 LEU 10 -11.337 -7.150 -28.347 83 HD23 LEU 10 2HD2 LEU 10 -10.341 -6.263 -29.527 84 H ILE 11 HN ILE 11 -7.918 -3.542 -24.958 85 HA ILE 11 HA ILE 11 -9.111 -1.528 -26.684 86 HB ILE 11 HB ILE 11 -6.587 -1.128 -25.141 87 HG12 ILE 11 2HG1 ILE 11 -9.316 -1.566 -23.963 88 HG13 ILE 11 3HG1 ILE 11 -7.760 -2.152 -23.410 89 HG21 ILE 11 1HG2 ILE 11 -8.703 0.890 -25.040 90 HG22 ILE 11 2HG2 ILE 11 -6.988 1.039 -25.492 91 HG23 ILE 11 3HG2 ILE 11 -8.182 0.497 -26.696 92 HD11 ILE 11 3HD1 ILE 11 -7.393 0.599 -23.309 93 HD12 ILE 11 1HD1 ILE 11 -9.105 0.422 -22.855 94 HD13 ILE 11 2HD1 ILE 11 -7.846 -0.425 -21.925 95 HA PRO 12 HA PRO 12 -6.384 -2.958 -29.803 96 HB2 PRO 12 2HB PRO 12 -7.534 -1.600 -31.878 97 HB3 PRO 12 3HB PRO 12 -8.077 -3.180 -31.348 98 HG2 PRO 12 2HG PRO 12 -9.338 -0.543 -30.908 99 HG3 PRO 12 3HG PRO 12 -10.052 -2.138 -30.770 100 HD2 PRO 12 2HD PRO 12 -9.221 -0.437 -28.615 101 HD3 PRO 12 3HD PRO 12 -9.826 -2.076 -28.483 102 H ILE 13 HN ILE 13 -4.998 -1.935 -31.604 103 HA ILE 13 HA ILE 13 -3.528 0.097 -30.278 104 HB ILE 13 HB ILE 13 -2.421 -1.584 -31.579 105 HG12 ILE 13 2HG1 ILE 13 -1.963 0.828 -33.278 106 HG13 ILE 13 3HG1 ILE 13 -1.748 1.008 -31.549 107 HG21 ILE 13 1HG2 ILE 13 -2.882 -0.886 -34.263 108 HG22 ILE 13 2HG2 ILE 13 -3.355 -2.384 -33.426 109 HG23 ILE 13 3HG2 ILE 13 -4.489 -1.014 -33.509 110 HD11 ILE 13 3HD1 ILE 13 0.310 0.094 -31.792 111 HD12 ILE 13 1HD1 ILE 13 -0.490 -1.451 -32.169 112 HD13 ILE 13 2HD1 ILE 13 -0.031 -0.342 -33.483 113 H ASN 14 HN ASN 14 -3.127 2.283 -31.026 114 HA ASN 14 HA ASN 14 -3.885 4.263 -31.521 115 HB2 ASN 14 2HB ASN 14 -4.462 2.676 -34.043 116 HB3 ASN 14 3HB ASN 14 -4.966 4.353 -33.973 117 HD21 ASN 14 1HD2 ASN 14 -2.150 2.654 -32.616 118 HD22 ASN 14 2HD2 ASN 14 -0.924 3.603 -33.389 119 H THR 15 HN THR 15 -5.680 3.051 -29.811 120 HA THR 15 HA THR 15 -8.303 3.760 -30.952 121 HB THR 15 HB THR 15 -7.533 1.521 -29.008 122 HG1 THR 15 HG1 THR 15 -7.164 1.157 -31.316 123 HG21 THR 15 3HG2 THR 15 -10.172 2.743 -29.807 124 HG22 THR 15 1HG2 THR 15 -10.079 0.966 -29.752 125 HG23 THR 15 2HG2 THR 15 -9.725 1.922 -28.293 126 H ALA 16 HN ALA 16 -9.210 5.494 -30.060 127 HA ALA 16 HA ALA 16 -8.049 6.912 -28.003 128 HB1 ALA 16 1HB ALA 16 -10.376 7.039 -29.691 129 HB2 ALA 16 2HB ALA 16 -10.859 7.421 -28.021 130 HB3 ALA 16 3HB ALA 16 -9.566 8.356 -28.809 131 H LEU 17 HN LEU 17 -8.089 6.802 -25.792 132 HA LEU 17 HA LEU 17 -9.436 4.509 -24.657 133 HB2 LEU 17 2HB LEU 17 -7.526 6.535 -23.487 134 HB3 LEU 17 3HB LEU 17 -8.187 5.167 -22.614 135 HG LEU 17 HG LEU 17 -6.515 4.907 -25.127 136 HD11 LEU 17 1HD1 LEU 17 -5.631 4.660 -22.238 137 HD12 LEU 17 2HD1 LEU 17 -4.641 4.314 -23.676 138 HD13 LEU 17 3HD1 LEU 17 -5.202 5.974 -23.360 139 HD21 LEU 17 3HD2 LEU 17 -7.684 2.923 -24.969 140 HD22 LEU 17 1HD2 LEU 17 -6.207 2.553 -24.047 141 HD23 LEU 17 2HD2 LEU 17 -7.715 2.953 -23.189 142 H THR 18 HN THR 18 -11.108 4.577 -23.133 143 HA THR 18 HA THR 18 -12.259 7.249 -22.677 144 HB THR 18 HB THR 18 -14.500 6.096 -22.936 145 HG1 THR 18 HG1 THR 18 -13.817 3.924 -22.529 146 HG21 THR 18 3HG2 THR 18 -12.510 5.928 -25.248 147 HG22 THR 18 1HG2 THR 18 -14.223 5.488 -25.442 148 HG23 THR 18 2HG2 THR 18 -13.777 7.151 -24.989 149 H VAL 19 HN VAL 19 -14.078 6.972 -20.859 150 HA VAL 19 HA VAL 19 -12.582 6.024 -18.590 151 HB VAL 19 HB VAL 19 -14.044 8.183 -18.934 152 HG11 VAL 19 1HG1 VAL 19 -16.087 6.170 -17.935 153 HG12 VAL 19 2HG1 VAL 19 -16.300 7.937 -17.936 154 HG13 VAL 19 3HG1 VAL 19 -16.133 7.060 -19.476 155 HG21 VAL 19 3HG2 VAL 19 -14.091 8.477 -16.594 156 HG22 VAL 19 1HG2 VAL 19 -14.299 6.736 -16.291 157 HG23 VAL 19 2HG2 VAL 19 -12.740 7.355 -16.885 158 H GLY 20 HN GLY 20 -14.856 4.743 -20.828 159 HA2 GLY 20 1HA GLY 20 -15.850 2.775 -18.872 160 HA3 GLY 20 2HA GLY 20 -16.561 3.150 -20.430 161 H MET 21 HN MET 21 -13.116 3.096 -20.593 162 HA MET 21 HA MET 21 -13.268 0.383 -21.658 163 HB2 MET 21 2HB MET 21 -11.982 2.931 -22.567 164 HB3 MET 21 3HB MET 21 -10.963 1.515 -22.732 165 HG2 MET 21 2HG MET 21 -13.425 0.602 -23.698 166 HG3 MET 21 3HG MET 21 -13.395 2.265 -24.249 167 HE1 MET 21 3HE MET 21 -9.846 2.358 -26.024 168 HE2 MET 21 1HE MET 21 -11.253 3.324 -25.520 169 HE3 MET 21 2HE MET 21 -10.160 2.639 -24.295 170 H MET 22 HN MET 22 -11.506 2.685 -19.580 171 HA MET 22 HA MET 22 -9.568 0.616 -18.975 172 HB2 MET 22 2HB MET 22 -9.782 3.597 -18.289 173 HB3 MET 22 3HB MET 22 -8.512 2.576 -17.643 174 HG2 MET 22 2HG MET 22 -7.616 2.127 -19.854 175 HG3 MET 22 3HG MET 22 -9.026 2.807 -20.641 176 HE1 MET 22 3HE MET 22 -8.745 6.592 -19.992 177 HE2 MET 22 1HE MET 22 -9.428 5.338 -21.056 178 HE3 MET 22 2HE MET 22 -9.798 5.326 -19.315 179 H THR 23 HN THR 23 -8.863 0.773 -16.447 180 HA THR 23 HA THR 23 -11.005 1.272 -14.634 181 HB THR 23 HB THR 23 -11.435 -1.029 -15.967 182 HG1 THR 23 HG1 THR 23 -12.645 -0.156 -14.129 183 HG21 THR 23 3HG2 THR 23 -9.555 -1.772 -13.664 184 HG22 THR 23 1HG2 THR 23 -10.604 -2.922 -14.526 185 HG23 THR 23 2HG2 THR 23 -9.276 -2.111 -15.389 186 H THR 24 HN THR 24 -10.373 0.344 -12.368 187 HA THR 24 HA THR 24 -7.459 0.713 -12.130 188 HB THR 24 HB THR 24 -7.994 1.751 -9.942 189 HG1 THR 24 HG1 THR 24 -10.139 1.587 -9.220 190 HG21 THR 24 3HG2 THR 24 -9.429 3.671 -10.672 191 HG22 THR 24 1HG2 THR 24 -8.183 3.304 -11.889 192 HG23 THR 24 2HG2 THR 24 -9.862 2.773 -12.146 193 H ARG 25 HN ARG 25 -6.249 -0.860 -11.251 194 HA ARG 25 HA ARG 25 -7.425 -2.664 -9.415 195 HB2 ARG 25 2HB ARG 25 -7.410 -3.377 -12.222 196 HB3 ARG 25 3HB ARG 25 -6.258 -4.410 -11.400 197 HG2 ARG 25 2HG ARG 25 -8.089 -5.677 -10.877 198 HG3 ARG 25 3HG ARG 25 -8.345 -4.492 -9.611 199 HD2 ARG 25 2HD ARG 25 -10.308 -3.874 -10.568 200 HD3 ARG 25 3HD ARG 25 -9.460 -3.393 -12.025 201 HE ARG 25 HE ARG 25 -9.596 -6.150 -12.261 202 HH11 ARG 25 2HH2 ARG 25 -12.019 -3.624 -11.712 203 HH12 ARG 25 1HH2 ARG 25 -13.292 -4.503 -12.490 204 HH22 ARG 25 HH1 ARG 25 -12.833 -6.668 -13.409 205 H VAL 26 HN VAL 26 -5.802 -3.001 -7.926 206 HA VAL 26 HA VAL 26 -3.163 -2.182 -8.463 207 HB VAL 26 HB VAL 26 -3.985 -1.973 -6.273 208 HG11 VAL 26 1HG1 VAL 26 -4.557 -4.189 -4.979 209 HG12 VAL 26 2HG1 VAL 26 -5.778 -3.410 -6.014 210 HG13 VAL 26 3HG1 VAL 26 -4.875 -4.823 -6.611 211 HG21 VAL 26 3HG2 VAL 26 -1.707 -2.466 -6.095 212 HG22 VAL 26 1HG2 VAL 26 -2.462 -3.599 -4.949 213 HG23 VAL 26 2HG2 VAL 26 -1.938 -4.171 -6.551 214 H VAL 27 HN VAL 27 -2.537 -3.349 -10.384 215 HA VAL 27 HA VAL 27 -2.150 -6.221 -9.931 216 HB VAL 27 HB VAL 27 -2.126 -6.477 -12.284 217 HG11 VAL 27 1HG1 VAL 27 -4.347 -5.835 -10.975 218 HG12 VAL 27 2HG1 VAL 27 -4.310 -4.440 -12.080 219 HG13 VAL 27 3HG1 VAL 27 -4.344 -6.095 -12.736 220 HG21 VAL 27 3HG2 VAL 27 -1.986 -3.453 -12.416 221 HG22 VAL 27 1HG2 VAL 27 -0.804 -4.637 -13.023 222 HG23 VAL 27 2HG2 VAL 27 -2.390 -4.476 -13.815 223 H SER 28 HN SER 28 -0.070 -7.081 -11.053 224 HA SER 28 HA SER 28 2.044 -5.113 -10.668 225 HB2 SER 28 2HB SER 28 1.654 -6.990 -8.816 226 HB3 SER 28 3HB SER 28 2.492 -8.016 -9.962 227 HG SER 28 HG SER 28 3.459 -5.726 -8.538 228 HA PRO 29 HA PRO 29 3.868 -4.861 -11.075 229 HB2 PRO 29 2HB PRO 29 5.201 -3.335 -12.909 230 HB3 PRO 29 3HB PRO 29 5.928 -4.705 -12.093 231 HG2 PRO 29 2HG PRO 29 4.957 -4.507 -14.878 232 HG3 PRO 29 3HG PRO 29 6.048 -5.686 -14.177 233 HD2 PRO 29 2HD PRO 29 3.279 -6.077 -14.815 234 HD3 PRO 29 3HD PRO 29 4.340 -7.215 -14.008 235 H THR 30 HN THR 30 3.430 -2.685 -10.478 236 HA THR 30 HA THR 30 0.874 -1.895 -11.448 237 HB THR 30 HB THR 30 1.445 0.103 -9.886 238 HG1 THR 30 HG1 THR 30 3.443 -0.617 -8.588 239 HG21 THR 30 3HG2 THR 30 0.290 -1.981 -9.019 240 HG22 THR 30 1HG2 THR 30 1.894 -2.697 -8.726 241 HG23 THR 30 2HG2 THR 30 1.386 -1.251 -7.821 242 H GLY 31 HN GLY 31 0.339 -0.726 -13.176 243 HA2 GLY 31 1HA GLY 31 2.512 0.675 -14.581 244 HA3 GLY 31 2HA GLY 31 0.995 0.133 -15.269 245 H ILE 32 HN ILE 32 0.450 2.219 -16.107 246 HA ILE 32 HA ILE 32 0.592 4.618 -14.924 247 HB ILE 32 HB ILE 32 -1.630 3.471 -16.610 248 HG12 ILE 32 2HG1 ILE 32 0.783 5.162 -17.332 249 HG13 ILE 32 3HG1 ILE 32 0.629 3.438 -17.608 250 HG21 ILE 32 1HG2 ILE 32 -2.170 5.582 -15.197 251 HG22 ILE 32 2HG2 ILE 32 -1.093 6.416 -16.343 252 HG23 ILE 32 3HG2 ILE 32 -2.544 5.574 -16.937 253 HD11 ILE 32 3HD1 ILE 32 -1.107 3.719 -19.217 254 HD12 ILE 32 1HD1 ILE 32 -1.445 5.383 -18.683 255 HD13 ILE 32 2HD1 ILE 32 0.049 5.022 -19.581 256 HA PRO 33 HA PRO 33 -1.886 4.470 -11.387 257 HB2 PRO 33 2HB PRO 33 -2.123 7.141 -10.859 258 HB3 PRO 33 3HB PRO 33 -0.714 6.198 -10.417 259 HG2 PRO 33 2HG PRO 33 -1.024 8.146 -12.619 260 HG3 PRO 33 3HG PRO 33 0.450 7.526 -11.901 261 HD2 PRO 33 2HD PRO 33 -0.693 6.753 -14.416 262 HD3 PRO 33 3HD PRO 33 0.716 6.051 -13.645 263 H ALA 34 HN ALA 34 -3.993 4.693 -10.513 264 HA ALA 34 HA ALA 34 -5.935 4.673 -12.535 265 HB1 ALA 34 1HB ALA 34 -7.486 4.794 -10.478 266 HB2 ALA 34 2HB ALA 34 -6.351 3.425 -10.561 267 HB3 ALA 34 3HB ALA 34 -5.995 4.815 -9.507 268 H GLU 35 HN GLU 35 -4.230 7.250 -11.034 269 HA GLU 35 HA GLU 35 -6.396 9.104 -11.203 270 HB2 GLU 35 2HB GLU 35 -4.914 10.674 -10.228 271 HB3 GLU 35 3HB GLU 35 -4.446 9.147 -9.508 272 HG2 GLU 35 2HG GLU 35 -2.769 9.021 -11.578 273 HG3 GLU 35 3HG GLU 35 -3.016 10.755 -11.636 274 HE2 GLU 35 HE2 GLU 35 -1.755 9.760 -7.998 275 H ASP 36 HN ASP 36 -4.188 7.673 -13.389 276 HA ASP 36 HA ASP 36 -4.059 10.015 -15.064 277 HB2 ASP 36 2HB ASP 36 -2.589 7.491 -14.777 278 HB3 ASP 36 3HB ASP 36 -3.021 7.769 -16.452 279 HD2 ASP 36 HD2 ASP 36 -0.230 9.732 -16.758 280 H ILE 37 HN ILE 37 -6.187 7.464 -14.390 281 HA ILE 37 HA ILE 37 -6.922 6.446 -16.839 282 HB ILE 37 HB ILE 37 -8.139 6.753 -14.171 283 HG12 ILE 37 2HG1 ILE 37 -7.611 4.530 -16.137 284 HG13 ILE 37 3HG1 ILE 37 -6.933 4.769 -14.539 285 HG21 ILE 37 1HG2 ILE 37 -9.869 6.117 -16.576 286 HG22 ILE 37 2HG2 ILE 37 -10.351 6.019 -14.866 287 HG23 ILE 37 3HG2 ILE 37 -9.959 7.596 -15.591 288 HD11 ILE 37 3HD1 ILE 37 -9.795 3.978 -15.226 289 HD12 ILE 37 1HD1 ILE 37 -8.584 3.019 -14.341 290 HD13 ILE 37 2HD1 ILE 37 -9.291 4.470 -13.591 291 HA PRO 38 HA PRO 38 -9.714 10.238 -17.289 292 HB2 PRO 38 2HB PRO 38 -9.346 12.398 -15.657 293 HB3 PRO 38 3HB PRO 38 -10.556 11.166 -15.357 294 HG2 PRO 38 2HG PRO 38 -7.971 11.597 -13.989 295 HG3 PRO 38 3HG PRO 38 -9.358 10.671 -13.450 296 HD2 PRO 38 2HD PRO 38 -6.914 9.629 -14.532 297 HD3 PRO 38 3HD PRO 38 -8.345 8.713 -14.101 298 H ARG 39 HN ARG 39 -6.419 10.180 -16.967 299 HA ARG 39 HA ARG 39 -6.138 12.597 -18.524 300 HB2 ARG 39 2HB ARG 39 -4.018 10.738 -17.329 301 HB3 ARG 39 3HB ARG 39 -3.677 12.256 -18.136 302 HG2 ARG 39 2HG ARG 39 -5.050 13.467 -16.419 303 HG3 ARG 39 3HG ARG 39 -5.366 11.947 -15.607 304 HD2 ARG 39 2HD ARG 39 -3.518 13.035 -14.453 305 HD3 ARG 39 3HD ARG 39 -2.873 11.639 -15.294 306 HE ARG 39 HE ARG 39 -2.397 14.475 -15.972 307 HH11 ARG 39 2HH2 ARG 39 -2.079 11.098 -16.996 308 HH12 ARG 39 1HH2 ARG 39 -0.838 11.437 -18.156 309 HH22 ARG 39 HH1 ARG 39 -0.078 13.693 -18.436 310 H LEU 40 HN LEU 40 -6.297 9.130 -18.816 311 HA LEU 40 HA LEU 40 -4.762 9.040 -21.260 312 HB2 LEU 40 2HB LEU 40 -6.350 6.949 -19.766 313 HB3 LEU 40 3HB LEU 40 -5.433 6.646 -21.228 314 HG LEU 40 HG LEU 40 -4.113 7.788 -18.768 315 HD11 LEU 40 1HD1 LEU 40 -5.136 5.054 -19.179 316 HD12 LEU 40 2HD1 LEU 40 -3.430 5.153 -18.680 317 HD13 LEU 40 3HD1 LEU 40 -4.695 5.911 -17.683 318 HD21 LEU 40 3HD2 LEU 40 -3.004 7.816 -21.057 319 HD22 LEU 40 1HD2 LEU 40 -2.087 7.065 -19.728 320 HD23 LEU 40 2HD2 LEU 40 -2.920 6.043 -20.924 321 H ILE 41 HN ILE 41 -8.057 9.573 -20.192 322 HA ILE 41 HA ILE 41 -9.459 8.649 -22.388 323 HB ILE 41 HB ILE 41 -10.036 11.063 -20.665 324 HG12 ILE 41 2HG1 ILE 41 -10.316 8.118 -20.194 325 HG13 ILE 41 3HG1 ILE 41 -9.800 9.383 -19.097 326 HG21 ILE 41 1HG2 ILE 41 -12.303 10.857 -21.307 327 HG22 ILE 41 2HG2 ILE 41 -11.355 10.804 -22.812 328 HG23 ILE 41 3HG2 ILE 41 -12.014 9.302 -22.122 329 HD11 ILE 41 3HD1 ILE 41 -12.114 10.270 -18.983 330 HD12 ILE 41 1HD1 ILE 41 -12.650 9.022 -20.134 331 HD13 ILE 41 2HD1 ILE 41 -12.069 8.552 -18.519 332 H SER 42 HN SER 42 -9.881 9.410 -24.441 333 HA SER 42 HA SER 42 -9.907 10.816 -26.141 334 HB2 SER 42 2HB SER 42 -9.772 12.695 -24.264 335 HB3 SER 42 3HB SER 42 -8.111 12.846 -24.801 336 HG SER 42 HG SER 42 -9.921 12.750 -26.927 337 H MET 43 HN MET 43 -7.231 9.536 -24.456 338 HA MET 43 HA MET 43 -5.414 10.125 -26.643 339 HB2 MET 43 2HB MET 43 -4.741 8.606 -24.083 340 HB3 MET 43 3HB MET 43 -3.652 9.527 -25.101 341 HG2 MET 43 2HG MET 43 -5.504 11.468 -24.368 342 HG3 MET 43 3HG MET 43 -5.456 10.467 -22.931 343 HE1 MET 43 3HE MET 43 -2.005 10.248 -21.820 344 HE2 MET 43 1HE MET 43 -3.188 9.208 -22.648 345 HE3 MET 43 2HE MET 43 -1.715 9.732 -23.499 346 H GLN 44 HN GLN 44 -4.683 8.545 -28.059 347 HA GLN 44 HA GLN 44 -6.019 6.001 -27.807 348 HB2 GLN 44 2HB GLN 44 -4.280 6.988 -30.105 349 HB3 GLN 44 3HB GLN 44 -5.425 5.661 -30.141 350 HG2 GLN 44 2HG GLN 44 -7.316 7.158 -29.906 351 HG3 GLN 44 3HG GLN 44 -6.284 8.512 -29.489 352 HE21 GLN 44 1HE2 GLN 44 -7.021 6.180 -32.047 353 HE22 GLN 44 2HE2 GLN 44 -6.642 7.194 -33.399 354 H VAL 45 HN VAL 45 -4.875 3.949 -27.922 355 HA VAL 45 HA VAL 45 -2.338 4.084 -26.577 356 HB VAL 45 HB VAL 45 -2.580 1.618 -26.545 357 HG11 VAL 45 1HG1 VAL 45 -3.495 3.038 -24.742 358 HG12 VAL 45 2HG1 VAL 45 -5.046 3.125 -25.610 359 HG13 VAL 45 3HG1 VAL 45 -4.461 1.563 -24.989 360 HG21 VAL 45 3HG2 VAL 45 -5.386 1.688 -27.465 361 HG22 VAL 45 1HG2 VAL 45 -4.173 1.921 -28.746 362 HG23 VAL 45 2HG2 VAL 45 -4.119 0.465 -27.724 363 H ASN 46 HN ASN 46 -0.385 2.983 -27.356 364 HA ASN 46 HA ASN 46 -0.247 3.213 -30.248 365 HB2 ASN 46 2HB ASN 46 2.198 3.465 -29.918 366 HB3 ASN 46 3HB ASN 46 1.341 4.618 -28.915 367 HD21 ASN 46 1HD2 ASN 46 2.514 4.878 -27.165 368 HD22 ASN 46 2HD2 ASN 46 3.114 3.634 -26.119 369 H GLN 47 HN GLN 47 -1.399 0.863 -28.852 370 HA GLN 47 HA GLN 47 -0.083 -1.146 -30.197 371 HB2 GLN 47 2HB GLN 47 1.733 -1.184 -28.695 372 HB3 GLN 47 3HB GLN 47 0.732 -0.810 -27.306 373 HG2 GLN 47 2HG GLN 47 -0.287 -3.054 -27.372 374 HG3 GLN 47 3HG GLN 47 0.558 -3.434 -28.859 375 HE21 GLN 47 1HE2 GLN 47 1.582 -1.802 -25.866 376 HE22 GLN 47 2HE2 GLN 47 2.894 -2.863 -25.473 377 H VAL 48 HN VAL 48 -1.135 -3.294 -29.822 378 HA VAL 48 HA VAL 48 -3.883 -2.909 -29.170 379 HB VAL 48 HB VAL 48 -2.155 -5.118 -30.205 380 HG11 VAL 48 1HG1 VAL 48 -4.861 -5.447 -28.918 381 HG12 VAL 48 2HG1 VAL 48 -4.361 -6.497 -30.266 382 HG13 VAL 48 3HG1 VAL 48 -3.405 -6.460 -28.765 383 HG21 VAL 48 3HG2 VAL 48 -3.780 -5.070 -32.054 384 HG22 VAL 48 1HG2 VAL 48 -4.716 -3.821 -31.198 385 HG23 VAL 48 2HG2 VAL 48 -3.066 -3.466 -31.765 386 H VAL 49 HN VAL 49 -4.208 -2.456 -26.998 387 HA VAL 49 HA VAL 49 -2.939 -4.228 -25.065 388 HB VAL 49 HB VAL 49 -4.528 -1.669 -24.810 389 HG11 VAL 49 1HG1 VAL 49 -4.254 -3.683 -22.877 390 HG12 VAL 49 2HG1 VAL 49 -3.049 -2.450 -22.435 391 HG13 VAL 49 3HG1 VAL 49 -4.761 -1.997 -22.612 392 HG21 VAL 49 3HG2 VAL 49 -2.044 -1.222 -23.731 393 HG22 VAL 49 1HG2 VAL 49 -1.666 -2.317 -25.083 394 HG23 VAL 49 2HG2 VAL 49 -2.536 -0.794 -25.388 395 HA PRO 50 HA PRO 50 -6.689 -6.489 -25.054 396 HB2 PRO 50 2HB PRO 50 -5.803 -8.585 -23.540 397 HB3 PRO 50 3HB PRO 50 -5.600 -8.505 -25.279 398 HG2 PRO 50 2HG PRO 50 -3.586 -8.085 -23.156 399 HG3 PRO 50 3HG PRO 50 -3.334 -8.428 -24.855 400 HD2 PRO 50 2HD PRO 50 -3.054 -5.885 -23.558 401 HD3 PRO 50 3HD PRO 50 -2.916 -6.207 -25.275 402 H MET 51 HN MET 51 -8.297 -7.372 -23.490 403 HA MET 51 HA MET 51 -8.603 -5.418 -21.505 404 HB2 MET 51 2HB MET 51 -10.527 -6.531 -22.595 405 HB3 MET 51 3HB MET 51 -9.986 -8.103 -22.042 406 HG2 MET 51 2HG MET 51 -10.187 -7.067 -19.623 407 HG3 MET 51 3HG MET 51 -11.164 -5.836 -20.398 408 HE1 MET 51 3HE MET 51 -13.547 -8.544 -22.373 409 HE2 MET 51 1HE MET 51 -12.784 -6.945 -22.549 410 HE3 MET 51 2HE MET 51 -11.818 -8.422 -22.779 411 H GLY 52 HN GLY 52 -7.618 -5.318 -19.538 412 HA2 GLY 52 1HA GLY 52 -7.342 -6.351 -17.396 413 HA3 GLY 52 2HA GLY 52 -6.987 -7.871 -18.193 414 H THR 53 HN THR 53 -5.451 -5.954 -20.276 415 HA THR 53 HA THR 53 -2.895 -6.396 -19.060 416 HB THR 53 HB THR 53 -3.979 -5.325 -21.689 417 HG1 THR 53 HG1 THR 53 -3.661 -7.657 -21.087 418 HG21 THR 53 3HG2 THR 53 -1.170 -5.691 -21.912 419 HG22 THR 53 1HG2 THR 53 -2.052 -4.153 -22.068 420 HG23 THR 53 2HG2 THR 53 -1.391 -4.645 -20.490 421 H THR 54 HN THR 54 -1.917 -5.137 -17.618 422 HA THR 54 HA THR 54 -2.905 -2.740 -16.714 423 HB THR 54 HB THR 54 0.062 -3.416 -16.749 424 HG1 THR 54 HG1 THR 54 -0.636 -4.955 -15.009 425 HG21 THR 54 3HG2 THR 54 -0.413 -2.962 -14.211 426 HG22 THR 54 1HG2 THR 54 -0.383 -1.557 -15.304 427 HG23 THR 54 2HG2 THR 54 -1.939 -2.239 -14.775 428 H LEU 55 HN LEU 55 -2.756 -0.603 -17.215 429 HA LEU 55 HA LEU 55 -1.887 -0.028 -19.886 430 HB2 LEU 55 2HB LEU 55 -3.864 0.907 -18.270 431 HB3 LEU 55 3HB LEU 55 -2.667 2.173 -18.085 432 HG LEU 55 HG LEU 55 -3.713 3.050 -19.874 433 HD11 LEU 55 1HD1 LEU 55 -2.279 0.994 -21.548 434 HD12 LEU 55 2HD1 LEU 55 -2.561 2.719 -21.883 435 HD13 LEU 55 3HD1 LEU 55 -1.400 2.235 -20.624 436 HD21 LEU 55 3HD2 LEU 55 -5.597 1.970 -20.382 437 HD22 LEU 55 1HD2 LEU 55 -4.650 1.157 -21.651 438 HD23 LEU 55 2HD2 LEU 55 -4.874 0.374 -20.068 439 H MET 56 HN MET 56 0.010 0.888 -20.535 440 HA MET 56 HA MET 56 1.823 1.608 -18.366 441 HB2 MET 56 2HB MET 56 2.213 0.435 -21.155 442 HB3 MET 56 3HB MET 56 3.550 1.233 -20.352 443 HG2 MET 56 2HG MET 56 1.997 -0.888 -18.847 444 HG3 MET 56 3HG MET 56 3.166 -1.389 -20.052 445 HE1 MET 56 3HE MET 56 3.974 -0.185 -15.847 446 HE2 MET 56 1HE MET 56 2.453 0.194 -16.690 447 HE3 MET 56 2HE MET 56 3.001 -1.494 -16.560 448 HA PRO 57 HA PRO 57 2.095 5.623 -19.989 449 HB2 PRO 57 2HB PRO 57 4.622 6.389 -19.285 450 HB3 PRO 57 3HB PRO 57 3.276 6.383 -18.164 451 HG2 PRO 57 2HG PRO 57 5.534 4.485 -18.359 452 HG3 PRO 57 3HG PRO 57 4.436 4.750 -17.019 453 HD2 PRO 57 2HD PRO 57 4.382 2.565 -18.876 454 HD3 PRO 57 3HD PRO 57 3.216 2.893 -17.610 455 H ASP 58 HN ASP 58 4.270 3.247 -21.108 456 HA ASP 58 HA ASP 58 5.029 4.992 -23.290 457 HB2 ASP 58 2HB ASP 58 6.250 2.535 -23.746 458 HB3 ASP 58 3HB ASP 58 6.992 3.900 -22.936 459 HD2 ASP 58 HD2 ASP 58 5.922 0.532 -21.890 460 H MET 59 HN MET 59 2.355 3.363 -22.618 461 HA MET 59 HA MET 59 2.243 1.984 -25.188 462 HB2 MET 59 2HB MET 59 1.078 1.438 -22.451 463 HB3 MET 59 3HB MET 59 0.096 0.982 -23.829 464 HG2 MET 59 2HG MET 59 2.383 -0.119 -24.693 465 HG3 MET 59 3HG MET 59 2.798 -0.086 -22.991 466 HE1 MET 59 3HE MET 59 -0.717 -1.761 -21.730 467 HE2 MET 59 1HE MET 59 0.715 -0.886 -21.137 468 HE3 MET 59 2HE MET 59 -0.458 -0.061 -22.192 469 H VAL 60 HN VAL 60 1.576 4.902 -23.959 470 HA VAL 60 HA VAL 60 -0.959 5.091 -25.427 471 HB VAL 60 HB VAL 60 -0.215 6.558 -22.888 472 HG11 VAL 60 1HG1 VAL 60 -1.618 7.914 -24.337 473 HG12 VAL 60 2HG1 VAL 60 -2.761 6.566 -24.543 474 HG13 VAL 60 3HG1 VAL 60 -2.570 7.335 -22.949 475 HG21 VAL 60 3HG2 VAL 60 -1.344 5.038 -21.651 476 HG22 VAL 60 1HG2 VAL 60 -2.561 4.750 -22.918 477 HG23 VAL 60 2HG2 VAL 60 -0.974 3.948 -23.009 478 H LYS 61 HN LYS 61 -1.066 6.737 -26.926 479 HA LYS 61 HA LYS 61 1.419 8.079 -27.466 480 HB2 LYS 61 2HB LYS 61 -1.253 8.048 -28.897 481 HB3 LYS 61 3HB LYS 61 0.158 8.915 -29.467 482 HG2 LYS 61 2HG LYS 61 1.417 6.638 -29.276 483 HG3 LYS 61 3HG LYS 61 -0.169 5.909 -29.123 484 HD2 LYS 61 2HD LYS 61 0.002 7.833 -31.369 485 HD3 LYS 61 3HD LYS 61 1.127 6.499 -31.527 486 HE2 LYS 61 2HE LYS 61 -0.563 5.135 -32.177 487 HE3 LYS 61 3HE LYS 61 -1.366 5.381 -30.639 488 HZ1 LYS 61 2HZ LYS 61 -2.619 6.102 -32.725 489 HZ3 LYS 61 1HZ LYS 61 -1.611 7.379 -32.808 490 H GLY 62 HN GLY 62 1.646 10.413 -27.665 491 HA2 GLY 62 1HA GLY 62 1.519 12.466 -26.752 492 HA3 GLY 62 2HA GLY 62 -0.205 12.325 -27.029 493 H TYR 63 HN TYR 63 1.297 9.948 -24.906 494 HA TYR 63 HA TYR 63 -0.270 10.956 -22.705 495 HB2 TYR 63 2HB TYR 63 -0.159 8.543 -23.099 496 HB3 TYR 63 3HB TYR 63 1.573 8.596 -23.362 497 HD1 TYR 63 HD1 TYR 63 3.130 8.813 -21.432 498 HD2 TYR 63 HD2 TYR 63 -1.087 8.360 -20.877 499 HE1 TYR 63 HE1 TYR 63 3.512 8.175 -19.001 500 HE2 TYR 63 HE2 TYR 63 -0.692 7.723 -18.448 501 HH TYR 63 HH TYR 63 2.287 8.213 -16.919 502 H ALA 64 HN ALA 64 0.890 10.801 -20.430 503 HA ALA 64 HA ALA 64 3.564 11.224 -20.096 504 HB1 ALA 64 1HB ALA 64 3.902 13.202 -21.154 505 HB2 ALA 64 2HB ALA 64 2.164 13.583 -21.202 506 HB3 ALA 64 3HB ALA 64 3.107 13.914 -19.730 507 HA PRO 65 HA PRO 65 1.978 11.220 -16.072 508 HB2 PRO 65 2HB PRO 65 4.192 11.892 -14.617 509 HB3 PRO 65 3HB PRO 65 3.905 10.277 -15.233 510 HG2 PRO 65 2HG PRO 65 5.790 12.329 -16.221 511 HG3 PRO 65 3HG PRO 65 5.782 10.605 -16.533 512 HD2 PRO 65 2HD PRO 65 4.918 12.675 -18.320 513 HD3 PRO 65 3HD PRO 65 4.803 10.947 -18.585 514 H ALA 66 HN ALA 66 1.645 12.475 -13.999 515 HA ALA 66 HA ALA 66 1.859 15.333 -14.545 516 HB1 ALA 66 1HB ALA 66 -0.587 13.746 -14.640 517 HB2 ALA 66 2HB ALA 66 -0.674 14.999 -13.378 518 HB3 ALA 66 3HB ALA 66 -0.328 15.455 -15.064
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