NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
5949 | 1i8g | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H GLU 1 1H GLU 1 -53.522 -7.615 42.301 2 2H GLU 1 2H GLU 1 -54.867 -7.272 41.523 3 3H GLU 1 3H GLU 1 -53.418 -6.975 40.773 4 HA GLU 1 HA GLU 1 -54.853 -9.519 41.315 5 1HB GLU 1 2HB GLU 1 -54.729 -8.056 39.002 6 2HB GLU 1 1HB GLU 1 -53.293 -8.999 38.727 7 1HG GLU 1 2HG GLU 1 -56.108 -10.252 39.229 8 2HG GLU 1 1HG GLU 1 -55.527 -9.766 37.661 9 H GLN 2 H GLN 2 -53.523 -11.527 40.342 10 HA GLN 2 HA GLN 2 -51.524 -12.080 42.458 11 1HB GLN 2 2HB GLN 2 -52.541 -13.759 40.105 12 2HB GLN 2 1HB GLN 2 -51.454 -14.384 41.324 13 1HG GLN 2 2HG GLN 2 -53.134 -14.247 43.086 14 2HG GLN 2 1HG GLN 2 -54.178 -13.187 42.159 15 1HE2 GLN 2 1HE2 GLN 2 -54.989 -14.149 40.046 16 2HE2 GLN 2 2HE2 GLN 2 -55.482 -15.921 40.174 17 HA PRO 3 HA PRO 3 -47.871 -12.181 39.342 18 1HB PRO 3 2HB PRO 3 -48.095 -11.700 36.681 19 2HB PRO 3 1HB PRO 3 -48.592 -13.248 37.388 20 1HG PRO 3 2HG PRO 3 -50.395 -10.865 36.659 21 2HG PRO 3 1HG PRO 3 -50.628 -12.568 36.203 22 1HD PRO 3 2HD PRO 3 -51.858 -11.383 38.395 23 2HD PRO 3 1HD PRO 3 -51.470 -13.124 38.344 24 H LEU 4 H LEU 4 -47.790 -10.424 40.772 25 HA LEU 4 HA LEU 4 -48.816 -7.856 40.241 26 1HB LEU 4 2HB LEU 4 -48.539 -9.071 42.440 27 2HB LEU 4 1HB LEU 4 -46.834 -8.645 42.425 28 HG LEU 4 HG LEU 4 -47.519 -6.163 42.441 29 1HD1 LEU 4 1HD1 LEU 4 -50.358 -7.323 42.927 30 2HD1 LEU 4 2HD1 LEU 4 -49.860 -6.316 41.545 31 3HD1 LEU 4 3HD1 LEU 4 -49.883 -5.628 43.172 32 1HD2 LEU 4 1HD2 LEU 4 -48.140 -6.176 44.868 33 2HD2 LEU 4 2HD2 LEU 4 -46.873 -7.376 44.543 34 3HD2 LEU 4 3HD2 LEU 4 -48.561 -7.901 44.780 35 1HN TPO 5 1HN THR 5 -47.698 -7.330 38.164 36 HA TPO 5 HA THR 5 -46.038 -4.881 38.569 37 HB TPO 5 HB THR 5 -47.680 -3.795 36.996 38 1HG2 TPO 5 1HG2 THR 5 -49.659 -5.210 37.050 39 2HG2 TPO 5 2HG2 THR 5 -48.721 -6.626 36.511 40 3HG2 TPO 5 3HG2 THR 5 -48.923 -5.241 35.415 41 HA PRO 6 HA PRO 6 -49.151 -3.633 41.826 42 1HB PRO 6 2HB PRO 6 -47.615 -2.105 43.456 43 2HB PRO 6 1HB PRO 6 -47.348 -3.845 43.264 44 1HG PRO 6 2HG PRO 6 -45.891 -1.573 41.800 45 2HG PRO 6 1HG PRO 6 -45.140 -2.892 42.730 46 1HD PRO 6 2HD PRO 6 -45.432 -3.055 39.978 47 2HD PRO 6 1HD PRO 6 -45.587 -4.498 41.015 48 H VAL 7 H VAL 7 -50.019 -2.584 39.747 49 HA VAL 7 HA VAL 7 -50.988 0.118 40.756 50 HB VAL 7 HB VAL 7 -51.399 0.907 38.311 51 1HG1 VAL 7 1HG1 VAL 7 -50.064 2.221 39.862 52 2HG1 VAL 7 2HG1 VAL 7 -49.233 2.203 38.300 53 3HG1 VAL 7 3HG1 VAL 7 -48.654 1.175 39.638 54 1HG2 VAL 7 1HG2 VAL 7 -49.662 0.437 36.625 55 2HG2 VAL 7 2HG2 VAL 7 -50.510 -1.072 37.034 56 3HG2 VAL 7 3HG2 VAL 7 -48.884 -0.758 37.682 57 H THR 8 H THR 8 -52.617 -0.905 41.609 58 HA THR 8 HA THR 8 -54.889 -1.757 41.716 59 HB THR 8 HB THR 8 -54.677 -3.248 39.078 60 HG1 THR 8 HG1 THR 8 -54.589 -1.058 38.727 61 1HG2 THR 8 1HG2 THR 8 -56.435 -4.092 40.697 62 2HG2 THR 8 2HG2 THR 8 -57.169 -3.331 39.268 63 3HG2 THR 8 3HG2 THR 8 -57.117 -2.452 40.813 64 H ASP 9 H ASP 9 -53.648 -2.573 43.454 65 HA ASP 9 HA ASP 9 -52.177 -5.101 43.121 66 1HB ASP 9 2HB ASP 9 -51.379 -4.730 45.405 67 2HB ASP 9 1HB ASP 9 -51.180 -3.289 44.427 68 H LEU 10 H LEU 10 -55.002 -4.413 44.312 69 HA LEU 10 HA LEU 10 -55.937 -7.168 45.157 70 1HB LEU 10 2HB LEU 10 -58.166 -6.456 45.238 71 2HB LEU 10 1HB LEU 10 -57.174 -5.336 46.116 72 HG LEU 10 HG LEU 10 -58.916 -4.101 45.174 73 1HD1 LEU 10 1HD1 LEU 10 -57.883 -2.368 43.757 74 2HD1 LEU 10 2HD1 LEU 10 -56.581 -3.480 43.275 75 3HD1 LEU 10 3HD1 LEU 10 -56.692 -2.921 44.960 76 1HD2 LEU 10 1HD2 LEU 10 -59.650 -5.721 43.387 77 2HD2 LEU 10 2HD2 LEU 10 -58.346 -5.139 42.337 78 3HD2 LEU 10 3HD2 LEU 10 -59.644 -4.030 42.827 79 1H LYS 1 1H LYS 1 -35.194 17.995 37.143 80 2H LYS 1 2H LYS 1 -36.156 16.945 36.370 81 3H LYS 1 3H LYS 1 -34.645 17.254 35.763 82 HA LYS 1 HA LYS 1 -34.491 15.107 36.829 83 1HB LYS 1 2HB LYS 1 -32.661 16.870 37.285 84 2HB LYS 1 1HB LYS 1 -33.399 17.205 38.827 85 1HG LYS 1 2HG LYS 1 -32.768 14.242 38.345 86 2HG LYS 1 1HG LYS 1 -31.399 15.293 38.190 87 1HD LYS 1 2HD LYS 1 -31.352 14.517 40.414 88 2HD LYS 1 1HD LYS 1 -31.740 16.225 40.511 89 1HE LYS 1 2HE LYS 1 -34.172 15.699 40.923 90 2HE LYS 1 1HE LYS 1 -33.906 13.988 40.623 91 1HZ LYS 1 1HZ LYS 1 -33.935 14.466 43.024 92 2HZ LYS 1 2HZ LYS 1 -32.677 15.518 42.934 93 3HZ LYS 1 3HZ LYS 1 -32.437 13.917 42.651 94 H LEU 2 H LEU 2 -35.833 13.698 37.956 95 HA LEU 2 HA LEU 2 -38.165 14.593 39.086 96 1HB LEU 2 2HB LEU 2 -38.782 12.324 39.570 97 2HB LEU 2 1HB LEU 2 -37.788 12.321 38.130 98 HG LEU 2 HG LEU 2 -35.987 11.956 40.413 99 1HD1 LEU 2 1HD1 LEU 2 -38.017 11.525 41.778 100 2HD1 LEU 2 2HD1 LEU 2 -36.980 10.093 41.664 101 3HD1 LEU 2 3HD1 LEU 2 -38.497 10.189 40.755 102 1HD2 LEU 2 1HD2 LEU 2 -37.112 9.809 38.457 103 2HD2 LEU 2 2HD2 LEU 2 -35.675 9.627 39.487 104 3HD2 LEU 2 3HD2 LEU 2 -35.671 10.815 38.170 105 HA PRO 3 HA PRO 3 -38.078 15.677 43.241 106 1HB PRO 3 2HB PRO 3 -40.504 13.867 43.732 107 2HB PRO 3 1HB PRO 3 -40.296 15.457 44.249 108 1HG PRO 3 2HG PRO 3 -41.691 15.047 42.055 109 2HG PRO 3 1HG PRO 3 -40.388 16.251 41.861 110 1HD PRO 3 2HD PRO 3 -40.183 13.202 41.321 111 2HD PRO 3 1HD PRO 3 -39.940 14.535 40.165 112 HA PRO 4 HA PRO 4 -35.458 13.625 45.997 113 1HB PRO 4 2HB PRO 4 -35.657 15.026 48.359 114 2HB PRO 4 1HB PRO 4 -35.112 15.770 46.845 115 1HG PRO 4 2HG PRO 4 -37.925 15.845 48.061 116 2HG PRO 4 1HG PRO 4 -36.974 17.224 47.463 117 1HD PRO 4 2HD PRO 4 -38.915 15.934 45.953 118 2HD PRO 4 1HD PRO 4 -37.493 16.686 45.175 119 H GLY 5 H GLY 5 -35.339 11.783 47.038 120 1HA GLY 5 2HA GLY 5 -35.992 9.827 48.384 121 2HA GLY 5 1HA GLY 5 -37.362 10.710 49.009 122 H TRP 6 H TRP 6 -37.067 10.394 45.336 123 HA TRP 6 HA TRP 6 -38.949 8.099 45.389 124 1HB TRP 6 2HB TRP 6 -38.084 10.576 43.733 125 2HB TRP 6 1HB TRP 6 -38.655 9.232 42.893 126 HD1 TRP 6 HD1 TRP 6 -39.879 12.213 44.566 127 HE1 TRP 6 HE1 TRP 6 -42.558 12.367 44.503 128 HE3 TRP 6 HE3 TRP 6 -40.485 7.680 42.632 129 HZ2 TRP 6 HZ2 TRP 6 -44.388 10.783 43.057 130 HZ3 TRP 6 HZ3 TRP 6 -42.804 6.980 41.887 131 HH2 TRP 6 HH2 TRP 6 -44.686 8.531 42.040 132 H GLU 7 H GLU 7 -38.500 6.255 44.074 133 HA GLU 7 HA GLU 7 -36.475 6.425 42.147 134 1HB GLU 7 2HB GLU 7 -35.969 4.422 44.495 135 2HB GLU 7 1HB GLU 7 -35.259 4.160 42.918 136 1HG GLU 7 2HG GLU 7 -33.897 6.286 43.105 137 2HG GLU 7 1HG GLU 7 -34.544 6.546 44.722 138 H LYS 8 H LYS 8 -36.444 4.861 40.767 139 HA LYS 8 HA LYS 8 -38.683 2.971 40.214 140 1HB LYS 8 2HB LYS 8 -35.878 3.172 38.975 141 2HB LYS 8 1HB LYS 8 -37.012 1.972 38.462 142 1HG LYS 8 2HG LYS 8 -37.458 5.006 38.241 143 2HG LYS 8 1HG LYS 8 -36.921 3.992 36.934 144 1HD LYS 8 2HD LYS 8 -39.540 3.150 38.250 145 2HD LYS 8 1HD LYS 8 -39.560 4.721 37.482 146 1HE LYS 8 2HE LYS 8 -38.969 3.812 35.304 147 2HE LYS 8 1HE LYS 8 -38.671 2.202 35.927 148 1HZ LYS 8 1HZ LYS 8 -41.390 3.576 36.125 149 2HZ LYS 8 2HZ LYS 8 -41.089 2.036 36.599 150 3HZ LYS 8 3HZ LYS 8 -41.040 2.419 35.019 151 H ARG 9 H ARG 9 -38.975 0.719 40.589 152 HA ARG 9 HA ARG 9 -36.845 -0.860 41.918 153 1HB ARG 9 2HB ARG 9 -39.558 -0.193 43.261 154 2HB ARG 9 1HB ARG 9 -38.592 -1.566 43.738 155 1HG ARG 9 2HG ARG 9 -37.703 1.384 43.957 156 2HG ARG 9 1HG ARG 9 -38.370 0.393 45.242 157 1HD ARG 9 2HD ARG 9 -36.425 -1.163 45.196 158 2HD ARG 9 1HD ARG 9 -35.735 -0.368 43.794 159 HE ARG 9 HE ARG 9 -35.974 0.899 46.603 160 1HH1 ARG 9 2HH1 ARG 9 -34.780 1.366 43.348 161 2HH1 ARG 9 1HH1 ARG 9 -33.594 2.615 43.991 162 1HH2 ARG 9 1HH2 ARG 9 -34.737 2.375 47.139 163 2HH2 ARG 9 2HH2 ARG 9 -33.637 3.184 45.930 164 H MET 10 H MET 10 -37.201 -2.895 41.504 165 HA MET 10 HA MET 10 -38.612 -3.632 39.060 166 1HB MET 10 2HB MET 10 -37.810 -5.906 39.312 167 2HB MET 10 1HB MET 10 -36.576 -4.700 39.522 168 1HG MET 10 2HG MET 10 -36.191 -6.543 41.078 169 2HG MET 10 1HG MET 10 -36.565 -5.118 42.041 170 1HE MET 10 1HE MET 10 -38.708 -4.575 43.028 171 2HE MET 10 2HE MET 10 -38.344 -5.784 44.293 172 3HE MET 10 3HE MET 10 -39.965 -5.726 43.500 173 H SER 11 H SER 11 -40.118 -5.328 38.609 174 HA SER 11 HA SER 11 -42.422 -5.553 40.650 175 1HB SER 11 2HB SER 11 -44.051 -5.354 39.008 176 2HB SER 11 1HB SER 11 -42.919 -4.063 38.629 177 HG SER 11 HG SER 11 -43.710 -6.243 37.125 178 H ARG 12 H ARG 12 -43.996 -7.485 39.966 179 HA ARG 12 HA ARG 12 -44.118 -9.749 40.771 180 1HB ARG 12 2HB ARG 12 -42.484 -9.926 38.179 181 2HB ARG 12 1HB ARG 12 -43.255 -11.315 38.904 182 1HG ARG 12 2HG ARG 12 -45.516 -10.301 38.658 183 2HG ARG 12 1HG ARG 12 -44.814 -8.829 38.017 184 1HD ARG 12 2HD ARG 12 -43.767 -10.259 36.111 185 2HD ARG 12 1HD ARG 12 -44.698 -11.644 36.739 186 HE ARG 12 HE ARG 12 -46.214 -9.027 36.118 187 1HH1 ARG 12 2HH1 ARG 12 -45.044 -11.772 34.634 188 2HH1 ARG 12 1HH1 ARG 12 -46.260 -11.603 33.250 189 1HH2 ARG 12 1HH2 ARG 12 -47.404 -8.868 34.695 190 2HH2 ARG 12 2HH2 ARG 12 -47.701 -10.103 33.351 191 H SER 13 H SER 13 -41.297 -8.611 41.611 192 HA SER 13 HA SER 13 -39.250 -9.333 42.525 193 1HB SER 13 2HB SER 13 -40.261 -11.302 43.685 194 2HB SER 13 1HB SER 13 -39.982 -12.285 42.249 195 HG SER 13 HG SER 13 -37.712 -11.636 42.422 196 H SER 14 H SER 14 -40.169 -11.410 39.767 197 HA SER 14 HA SER 14 -37.934 -10.031 38.134 198 1HB SER 14 2HB SER 14 -37.172 -12.300 38.745 199 2HB SER 14 1HB SER 14 -38.643 -13.031 38.087 200 HG SER 14 HG SER 14 -38.064 -12.191 36.034 201 H GLY 15 H GLY 15 -39.781 -8.566 37.514 202 1HA GLY 15 2HA GLY 15 -40.932 -9.623 34.857 203 2HA GLY 15 1HA GLY 15 -41.923 -8.721 35.998 204 H ARG 16 H ARG 16 -41.671 -6.563 36.064 205 HA ARG 16 HA ARG 16 -39.697 -5.034 34.326 206 1HB ARG 16 2HB ARG 16 -42.671 -5.124 33.830 207 2HB ARG 16 1HB ARG 16 -42.046 -3.523 33.983 208 1HG ARG 16 2HG ARG 16 -42.108 -4.170 31.638 209 2HG ARG 16 1HG ARG 16 -40.472 -3.752 32.145 210 1HD ARG 16 2HD ARG 16 -39.883 -6.135 32.388 211 2HD ARG 16 1HD ARG 16 -41.509 -6.668 31.962 212 HE ARG 16 HE ARG 16 -40.719 -5.111 29.697 213 1HH1 ARG 16 1HH2 ARG 16 -39.200 -7.757 31.370 214 2HH1 ARG 16 2HH2 ARG 16 -38.373 -8.342 29.849 215 1HH2 ARG 16 2HH1 ARG 16 -39.760 -5.793 28.002 216 2HH2 ARG 16 1HH1 ARG 16 -38.689 -7.265 28.044 217 H VAL 17 H VAL 17 -41.672 -2.922 35.525 218 HA VAL 17 HA VAL 17 -40.191 -2.479 38.128 219 HB VAL 17 HB VAL 17 -38.414 -1.923 36.706 220 1HG1 VAL 17 1HG1 VAL 17 -40.214 -0.058 35.026 221 2HG1 VAL 17 2HG1 VAL 17 -39.474 -1.584 34.503 222 3HG1 VAL 17 3HG1 VAL 17 -38.431 -0.203 34.866 223 1HG2 VAL 17 1HG2 VAL 17 -38.758 -0.252 38.580 224 2HG2 VAL 17 2HG2 VAL 17 -39.664 0.782 37.511 225 3HG2 VAL 17 3HG2 VAL 17 -37.939 0.490 37.183 226 H TYR 18 H TYR 18 -41.121 -1.300 39.547 227 HA TYR 18 HA TYR 18 -43.350 0.634 38.818 228 1HB TYR 18 2HB TYR 18 -44.458 0.289 40.787 229 2HB TYR 18 1HB TYR 18 -44.020 -1.290 40.313 230 HD1 TYR 18 HD1 TYR 18 -42.159 -2.502 41.556 231 HD2 TYR 18 HD2 TYR 18 -43.800 1.196 42.957 232 HE1 TYR 18 HE1 TYR 18 -41.320 -2.996 43.830 233 HE2 TYR 18 HE2 TYR 18 -43.037 0.665 45.239 234 HH TYR 18 HH TYR 18 -42.038 -0.825 46.552 235 H TYR 19 H TYR 19 -43.363 2.432 40.540 236 HA TYR 19 HA TYR 19 -40.592 3.678 40.902 237 1HB TYR 19 2HB TYR 19 -41.398 4.222 38.719 238 2HB TYR 19 1HB TYR 19 -42.957 4.733 39.290 239 HD1 TYR 19 HD1 TYR 19 -43.359 6.933 39.156 240 HD2 TYR 19 HD2 TYR 19 -39.193 5.921 39.787 241 HE1 TYR 19 HE1 TYR 19 -42.697 9.196 39.054 242 HE2 TYR 19 HE2 TYR 19 -38.576 8.167 39.486 243 HH TYR 19 HH TYR 19 -39.320 10.272 39.304 244 H PHE 20 H PHE 20 -40.464 4.315 42.739 245 HA PHE 20 HA PHE 20 -42.888 4.367 44.643 246 1HB PHE 20 2HB PHE 20 -41.446 2.294 44.494 247 2HB PHE 20 1HB PHE 20 -40.038 3.212 44.912 248 HD1 PHE 20 HD1 PHE 20 -43.535 2.967 46.436 249 HD2 PHE 20 HD2 PHE 20 -39.329 2.584 47.043 250 HE1 PHE 20 HE1 PHE 20 -43.978 2.480 48.605 251 HE2 PHE 20 HE2 PHE 20 -39.620 2.071 49.239 252 HZ PHE 20 HZ PHE 20 -42.039 1.964 50.435 253 H ASN 21 H ASN 21 -43.169 6.122 45.857 254 HA ASN 21 HA ASN 21 -40.925 8.058 46.482 255 1HB ASN 21 2HB ASN 21 -43.498 8.639 46.144 256 2HB ASN 21 1HB ASN 21 -43.669 8.144 47.812 257 1HD2 ASN 21 1HD2 ASN 21 -40.890 9.455 48.294 258 2HD2 ASN 21 2HD2 ASN 21 -41.378 11.219 48.344 259 H HIS 22 H HIS 22 -39.472 7.468 48.007 260 HA HIS 22 HA HIS 22 -39.925 5.038 49.722 261 1HB HIS 22 2HB HIS 22 -37.592 6.436 48.516 262 2HB HIS 22 1HB HIS 22 -37.324 6.383 50.218 263 HD1 HIS 22 HD1 HIS 22 -37.524 3.776 51.382 264 HD2 HIS 22 HD2 HIS 22 -37.036 4.273 47.168 265 HE1 HIS 22 HE1 HIS 22 -36.584 1.603 50.348 266 H ILE 23 H ILE 23 -39.350 8.432 50.369 267 HA ILE 23 HA ILE 23 -39.443 8.231 53.351 268 HB ILE 23 HB ILE 23 -39.580 10.753 53.282 269 1HG1 ILE 23 2HG1 ILE 23 -39.357 10.450 50.218 270 2HG1 ILE 23 1HG1 ILE 23 -40.729 11.088 51.096 271 1HG2 ILE 23 1HG2 ILE 23 -37.401 9.513 53.472 272 2HG2 ILE 23 2HG2 ILE 23 -37.213 11.076 52.666 273 3HG2 ILE 23 3HG2 ILE 23 -37.204 9.578 51.704 274 1HD1 ILE 23 1HD1 ILE 23 -39.290 13.037 51.895 275 2HD1 ILE 23 2HD1 ILE 23 -39.488 12.930 50.124 276 3HD1 ILE 23 3HD1 ILE 23 -37.965 12.411 50.863 277 H THR 24 H THR 24 -41.921 9.156 50.970 278 HA THR 24 HA THR 24 -44.117 9.338 53.009 279 HB THR 24 HB THR 24 -44.057 9.145 49.931 280 HG1 THR 24 HG1 THR 24 -44.888 11.295 51.547 281 1HG2 THR 24 1HG2 THR 24 -46.523 9.712 51.687 282 2HG2 THR 24 2HG2 THR 24 -46.284 8.321 50.608 283 3HG2 THR 24 3HG2 THR 24 -46.411 9.947 49.909 284 H ASN 25 H ASN 25 -43.117 6.849 50.764 285 HA ASN 25 HA ASN 25 -43.515 4.517 50.611 286 1HB ASN 25 2HB ASN 25 -43.618 4.340 53.113 287 2HB ASN 25 1HB ASN 25 -45.348 4.583 53.060 288 1HD2 ASN 25 1HD2 ASN 25 -46.581 2.911 51.841 289 2HD2 ASN 25 2HD2 ASN 25 -45.872 1.205 51.861 290 H ALA 26 H ALA 26 -44.299 5.588 48.696 291 HA ALA 26 HA ALA 26 -47.266 4.932 48.180 292 1HB ALA 26 1HB ALA 26 -47.493 7.020 46.845 293 2HB ALA 26 2HB ALA 26 -45.828 7.497 47.227 294 3HB ALA 26 3HB ALA 26 -47.050 7.394 48.522 295 H SER 27 H SER 27 -47.211 3.247 46.836 296 HA SER 27 HA SER 27 -45.083 2.968 44.701 297 1HB SER 27 2HB SER 27 -45.940 0.659 44.427 298 2HB SER 27 1HB SER 27 -45.392 1.061 46.040 299 HG SER 27 HG SER 27 -48.127 1.048 45.153 300 H GLN 28 H GLN 28 -45.364 3.647 42.835 301 HA GLN 28 HA GLN 28 -47.841 3.084 41.194 302 1HB GLN 28 2HB GLN 28 -48.170 5.341 40.357 303 2HB GLN 28 1HB GLN 28 -48.299 5.316 42.091 304 1HG GLN 28 2HG GLN 28 -45.889 6.282 42.181 305 2HG GLN 28 1HG GLN 28 -45.904 6.408 40.441 306 1HE2 GLN 28 1HE2 GLN 28 -47.020 8.117 39.550 307 2HE2 GLN 28 2HE2 GLN 28 -48.245 9.129 40.457 308 H TRP 29 H TRP 29 -47.067 4.251 38.806 309 HA TRP 29 HA TRP 29 -44.216 3.197 38.124 310 1HB TRP 29 2HB TRP 29 -46.911 2.823 36.633 311 2HB TRP 29 1HB TRP 29 -45.410 2.738 35.791 312 HD1 TRP 29 HD1 TRP 29 -46.604 0.931 39.025 313 HE1 TRP 29 HE1 TRP 29 -46.650 -1.496 38.429 314 HE3 TRP 29 HE3 TRP 29 -44.725 1.062 34.293 315 HZ2 TRP 29 HZ2 TRP 29 -45.049 -3.243 36.808 316 HZ3 TRP 29 HZ3 TRP 29 -44.196 -1.095 33.189 317 HH2 TRP 29 HH2 TRP 29 -44.429 -3.237 34.432 318 H GLU 30 H GLU 30 -46.214 5.861 38.278 319 HA GLU 30 HA GLU 30 -45.484 7.227 35.710 320 1HB GLU 30 2HB GLU 30 -47.763 7.725 37.762 321 2HB GLU 30 1HB GLU 30 -47.595 8.532 36.226 322 1HG GLU 30 2HG GLU 30 -49.324 6.975 35.951 323 2HG GLU 30 1HG GLU 30 -47.986 6.285 35.033 324 H ARG 31 H ARG 31 -45.004 9.234 35.527 325 HA ARG 31 HA ARG 31 -43.195 10.271 37.496 326 1HB ARG 31 2HB ARG 31 -43.346 10.134 34.696 327 2HB ARG 31 1HB ARG 31 -43.339 11.818 35.029 328 1HG ARG 31 2HG ARG 31 -41.140 11.693 36.102 329 2HG ARG 31 1HG ARG 31 -41.260 9.957 36.449 330 1HD ARG 31 2HD ARG 31 -39.656 10.385 34.649 331 2HD ARG 31 1HD ARG 31 -40.965 9.329 34.111 332 HE ARG 31 HE ARG 31 -41.920 11.850 33.238 333 1HH1 ARG 31 1HH2 ARG 31 -38.718 10.506 32.839 334 2HH1 ARG 31 2HH2 ARG 31 -38.497 11.651 31.417 335 1HH2 ARG 31 2HH1 ARG 31 -41.570 12.850 31.591 336 2HH2 ARG 31 1HH1 ARG 31 -39.922 12.822 30.789 337 HA PRO 32 HA PRO 32 -45.728 13.578 39.481 338 1HB PRO 32 2HB PRO 32 -43.774 14.491 41.312 339 2HB PRO 32 1HB PRO 32 -44.593 12.993 41.602 340 1HG PRO 32 2HG PRO 32 -41.986 13.312 40.188 341 2HG PRO 32 1HG PRO 32 -42.359 12.234 41.551 342 1HD PRO 32 2HD PRO 32 -42.281 11.325 39.068 343 2HD PRO 32 1HD PRO 32 -43.686 10.800 40.081 344 H SER 33 H SER 33 -44.250 14.213 36.983 345 HA SER 33 HA SER 33 -43.757 16.047 35.625 346 1HB SER 33 2HB SER 33 -44.841 17.871 37.819 347 2HB SER 33 1HB SER 33 -44.387 18.362 36.185 348 HG SER 33 HG SER 33 -46.273 16.310 36.809 349 H GLY 34 H GLY 34 -42.086 16.570 38.710 350 1HA GLY 34 2HA GLY 34 -39.870 18.188 37.828 351 2HA GLY 34 1HA GLY 34 -39.636 16.869 38.948 352 H ASN 35 H ASN 35 -40.468 15.122 36.732 353 HA ASN 35 HA ASN 35 -38.865 15.754 34.401 354 1HB ASN 35 2HB ASN 35 -38.659 12.897 35.549 355 2HB ASN 35 1HB ASN 35 -38.678 13.167 33.826 356 1HD2 ASN 35 1HD2 ASN 35 -37.020 14.311 32.813 357 2HD2 ASN 35 2HD2 ASN 35 -35.370 14.242 33.598 358 H SER 36 H SER 36 -40.137 15.517 32.618 359 HA SER 36 HA SER 36 -42.945 16.040 33.498 360 1HB SER 36 2HB SER 36 -42.967 17.421 31.477 361 2HB SER 36 1HB SER 36 -41.444 17.667 32.300 362 HG SER 36 HG SER 36 -40.418 16.261 30.812 363 H SER 37 H SER 37 -43.758 15.723 30.564 364 HA SER 37 HA SER 37 -44.895 12.882 30.683 365 1HB SER 37 2HB SER 37 -45.438 15.156 28.675 366 2HB SER 37 1HB SER 37 -46.123 13.536 28.579 367 HG SER 37 HG SER 37 -46.347 15.065 30.960 368 H SER 38 H SER 38 -42.704 14.780 28.562 369 HA SER 38 HA SER 38 -41.759 12.167 27.249 370 1HB SER 38 2HB SER 38 -42.684 13.838 25.636 371 2HB SER 38 1HB SER 38 -41.493 15.034 26.158 372 HG SER 38 HG SER 38 -39.885 13.294 25.613 373 H GLY 39 H GLY 39 -40.398 15.307 28.460 374 1HA GLY 39 2HA GLY 39 -37.669 13.966 28.835 375 2HA GLY 39 1HA GLY 39 -37.956 15.700 28.856 Start of MODEL 2 1 1H GLU 1 1H GLU 1 -53.012 -10.952 30.203 2 2H GLU 1 2H GLU 1 -52.066 -10.111 31.241 3 3H GLU 1 3H GLU 1 -53.692 -9.898 31.342 4 HA GLU 1 HA GLU 1 -53.637 -12.471 31.911 5 1HB GLU 1 2HB GLU 1 -51.526 -13.281 32.596 6 2HB GLU 1 1HB GLU 1 -51.218 -12.504 31.081 7 1HG GLU 1 2HG GLU 1 -50.403 -11.518 33.898 8 2HG GLU 1 1HG GLU 1 -49.366 -12.099 32.635 9 H GLN 2 H GLN 2 -52.785 -12.872 34.491 10 HA GLN 2 HA GLN 2 -53.652 -10.473 36.161 11 1HB GLN 2 2HB GLN 2 -54.903 -13.262 36.441 12 2HB GLN 2 1HB GLN 2 -54.970 -12.043 37.685 13 1HG GLN 2 2HG GLN 2 -56.203 -11.679 34.865 14 2HG GLN 2 1HG GLN 2 -57.065 -12.197 36.291 15 1HE2 GLN 2 1HE2 GLN 2 -55.482 -9.398 34.861 16 2HE2 GLN 2 2HE2 GLN 2 -56.375 -8.232 35.978 17 HA PRO 3 HA PRO 3 -49.778 -12.661 37.516 18 1HB PRO 3 2HB PRO 3 -48.059 -10.535 37.813 19 2HB PRO 3 1HB PRO 3 -48.566 -11.172 36.242 20 1HG PRO 3 2HG PRO 3 -49.711 -8.759 37.740 21 2HG PRO 3 1HG PRO 3 -49.182 -8.828 36.044 22 1HD PRO 3 2HD PRO 3 -51.841 -9.105 36.770 23 2HD PRO 3 1HD PRO 3 -51.161 -9.965 35.362 24 H LEU 4 H LEU 4 -50.989 -9.978 39.437 25 HA LEU 4 HA LEU 4 -51.054 -9.531 41.751 26 1HB LEU 4 2HB LEU 4 -51.681 -11.898 42.154 27 2HB LEU 4 1HB LEU 4 -49.992 -12.311 42.338 28 HG LEU 4 HG LEU 4 -49.812 -10.755 44.336 29 1HD1 LEU 4 1HD1 LEU 4 -52.891 -10.490 44.021 30 2HD1 LEU 4 2HD1 LEU 4 -51.707 -9.164 43.908 31 3HD1 LEU 4 3HD1 LEU 4 -51.958 -9.984 45.448 32 1HD2 LEU 4 1HD2 LEU 4 -51.997 -12.942 44.524 33 2HD2 LEU 4 2HD2 LEU 4 -51.057 -12.285 45.884 34 3HD2 LEU 4 3HD2 LEU 4 -50.240 -13.214 44.615 35 1HN TPO 5 1HN THR 5 -49.677 -7.926 41.146 36 HA TPO 5 HA THR 5 -46.710 -8.172 41.874 37 HB TPO 5 HB THR 5 -46.203 -6.725 39.917 38 1HG2 TPO 5 1HG2 THR 5 -47.843 -6.580 37.999 39 2HG2 TPO 5 2HG2 THR 5 -48.236 -5.516 39.373 40 3HG2 TPO 5 3HG2 THR 5 -49.152 -7.025 39.108 41 HA PRO 6 HA PRO 6 -47.282 -4.340 44.242 42 1HB PRO 6 2HB PRO 6 -44.760 -3.277 44.401 43 2HB PRO 6 1HB PRO 6 -45.182 -4.855 45.086 44 1HG PRO 6 2HG PRO 6 -43.911 -4.299 42.341 45 2HG PRO 6 1HG PRO 6 -43.279 -5.380 43.603 46 1HD PRO 6 2HD PRO 6 -44.777 -6.323 41.523 47 2HD PRO 6 1HD PRO 6 -44.976 -7.032 43.152 48 H VAL 7 H VAL 7 -48.637 -3.699 42.301 49 HA VAL 7 HA VAL 7 -47.716 -1.098 40.992 50 HB VAL 7 HB VAL 7 -48.609 -2.937 39.633 51 1HG1 VAL 7 1HG1 VAL 7 -51.043 -3.443 39.437 52 2HG1 VAL 7 2HG1 VAL 7 -51.421 -2.394 40.825 53 3HG1 VAL 7 3HG1 VAL 7 -50.458 -3.865 41.052 54 1HG2 VAL 7 1HG2 VAL 7 -48.712 -0.530 38.828 55 2HG2 VAL 7 2HG2 VAL 7 -50.435 -0.487 39.260 56 3HG2 VAL 7 3HG2 VAL 7 -49.845 -1.643 38.050 57 H THR 8 H THR 8 -50.745 -0.414 41.062 58 HA THR 8 HA THR 8 -50.675 1.224 43.668 59 HB THR 8 HB THR 8 -52.583 2.521 42.797 60 HG1 THR 8 HG1 THR 8 -53.285 0.848 41.371 61 1HG2 THR 8 1HG2 THR 8 -50.286 2.608 40.751 62 2HG2 THR 8 2HG2 THR 8 -50.295 3.443 42.330 63 3HG2 THR 8 3HG2 THR 8 -51.480 3.889 41.075 64 H ASP 9 H ASP 9 -51.758 0.290 45.299 65 HA ASP 9 HA ASP 9 -54.102 -1.630 44.791 66 1HB ASP 9 2HB ASP 9 -51.912 -2.418 45.975 67 2HB ASP 9 1HB ASP 9 -52.414 -1.425 47.334 68 H LEU 10 H LEU 10 -54.381 -0.677 47.755 69 HA LEU 10 HA LEU 10 -56.553 1.272 47.250 70 1HB LEU 10 2HB LEU 10 -57.299 0.976 49.402 71 2HB LEU 10 1HB LEU 10 -56.723 -0.572 48.866 72 HG LEU 10 HG LEU 10 -56.286 -0.445 51.161 73 1HD1 LEU 10 1HD1 LEU 10 -54.348 -1.434 49.918 74 2HD1 LEU 10 2HD1 LEU 10 -53.821 -0.676 51.438 75 3HD1 LEU 10 3HD1 LEU 10 -53.553 0.155 49.885 76 1HD2 LEU 10 1HD2 LEU 10 -54.784 2.223 50.880 77 2HD2 LEU 10 2HD2 LEU 10 -55.117 1.344 52.390 78 3HD2 LEU 10 3HD2 LEU 10 -56.452 2.064 51.451 79 1H LYS 1 1H LYS 1 -34.308 15.440 37.243 80 2H LYS 1 2H LYS 1 -32.821 16.110 37.445 81 3H LYS 1 3H LYS 1 -33.981 16.324 38.589 82 HA LYS 1 HA LYS 1 -32.660 13.716 37.916 83 1HB LYS 1 2HB LYS 1 -31.341 13.982 39.834 84 2HB LYS 1 1HB LYS 1 -31.227 15.515 39.071 85 1HG LYS 1 2HG LYS 1 -31.902 16.587 41.015 86 2HG LYS 1 1HG LYS 1 -33.449 15.776 40.983 87 1HD LYS 1 2HD LYS 1 -31.897 13.681 42.011 88 2HD LYS 1 1HD LYS 1 -30.891 15.026 42.457 89 1HE LYS 1 2HE LYS 1 -32.203 14.777 44.388 90 2HE LYS 1 1HE LYS 1 -33.054 16.093 43.599 91 1HZ LYS 1 1HZ LYS 1 -33.845 13.150 43.370 92 2HZ LYS 1 2HZ LYS 1 -34.669 14.333 42.644 93 3HZ LYS 1 3HZ LYS 1 -34.662 14.243 44.273 94 H LEU 2 H LEU 2 -35.482 13.255 37.856 95 HA LEU 2 HA LEU 2 -37.508 13.398 39.018 96 1HB LEU 2 2HB LEU 2 -37.955 11.245 39.800 97 2HB LEU 2 1HB LEU 2 -36.660 11.074 38.652 98 HG LEU 2 HG LEU 2 -35.352 11.343 41.229 99 1HD1 LEU 2 1HD1 LEU 2 -37.905 9.677 41.520 100 2HD1 LEU 2 2HD1 LEU 2 -37.494 11.174 42.359 101 3HD1 LEU 2 3HD1 LEU 2 -36.528 9.730 42.665 102 1HD2 LEU 2 1HD2 LEU 2 -34.672 9.692 39.404 103 2HD2 LEU 2 2HD2 LEU 2 -36.130 8.725 39.743 104 3HD2 LEU 2 3HD2 LEU 2 -34.857 8.887 40.974 105 HA PRO 3 HA PRO 3 -38.066 15.384 42.806 106 1HB PRO 3 2HB PRO 3 -40.450 13.804 43.733 107 2HB PRO 3 1HB PRO 3 -40.360 15.409 43.221 108 1HG PRO 3 2HG PRO 3 -41.463 13.612 41.588 109 2HG PRO 3 1HG PRO 3 -40.483 14.936 40.915 110 1HD PRO 3 2HD PRO 3 -39.569 12.058 41.520 111 2HD PRO 3 1HD PRO 3 -39.392 13.008 40.016 112 HA PRO 4 HA PRO 4 -36.054 13.897 46.530 113 1HB PRO 4 2HB PRO 4 -36.691 15.802 48.393 114 2HB PRO 4 1HB PRO 4 -35.751 16.186 46.941 115 1HG PRO 4 2HG PRO 4 -38.736 16.638 47.420 116 2HG PRO 4 1HG PRO 4 -37.566 17.781 46.725 117 1HD PRO 4 2HD PRO 4 -39.296 16.119 45.242 118 2HD PRO 4 1HD PRO 4 -37.780 16.763 44.563 119 H GLY 5 H GLY 5 -36.376 12.416 48.056 120 1HA GLY 5 2HA GLY 5 -37.602 10.888 49.552 121 2HA GLY 5 1HA GLY 5 -39.058 11.826 49.335 122 H TRP 6 H TRP 6 -37.754 10.713 46.130 123 HA TRP 6 HA TRP 6 -39.455 8.314 46.216 124 1HB TRP 6 2HB TRP 6 -37.931 10.279 44.347 125 2HB TRP 6 1HB TRP 6 -38.351 8.760 43.741 126 HD1 TRP 6 HD1 TRP 6 -39.795 12.064 44.508 127 HE1 TRP 6 HE1 TRP 6 -42.463 12.208 44.052 128 HE3 TRP 6 HE3 TRP 6 -40.309 7.253 43.307 129 HZ2 TRP 6 HZ2 TRP 6 -44.216 10.354 42.844 130 HZ3 TRP 6 HZ3 TRP 6 -42.583 6.419 42.505 131 HH2 TRP 6 HH2 TRP 6 -44.465 7.945 42.259 132 H GLU 7 H GLU 7 -38.775 6.319 45.037 133 HA GLU 7 HA GLU 7 -36.235 6.334 43.972 134 1HB GLU 7 2HB GLU 7 -35.962 5.396 46.566 135 2HB GLU 7 1HB GLU 7 -36.623 3.928 45.912 136 1HG GLU 7 2HG GLU 7 -34.070 5.289 44.759 137 2HG GLU 7 1HG GLU 7 -33.991 4.305 46.193 138 H LYS 8 H LYS 8 -36.091 3.736 43.234 139 HA LYS 8 HA LYS 8 -38.657 2.733 42.176 140 1HB LYS 8 2HB LYS 8 -38.237 3.013 39.784 141 2HB LYS 8 1HB LYS 8 -38.419 4.520 40.625 142 1HG LYS 8 2HG LYS 8 -36.724 5.052 39.114 143 2HG LYS 8 1HG LYS 8 -35.852 4.781 40.601 144 1HD LYS 8 2HD LYS 8 -35.843 2.166 39.385 145 2HD LYS 8 1HD LYS 8 -35.914 3.188 38.016 146 1HE LYS 8 2HE LYS 8 -33.536 2.831 38.410 147 2HE LYS 8 1HE LYS 8 -33.793 4.482 38.999 148 1HZ LYS 8 1HZ LYS 8 -34.121 2.109 40.893 149 2HZ LYS 8 2HZ LYS 8 -33.963 3.555 41.373 150 3HZ LYS 8 3HZ LYS 8 -32.649 2.830 40.758 151 H ARG 9 H ARG 9 -38.712 0.577 41.406 152 HA ARG 9 HA ARG 9 -36.239 -1.020 42.035 153 1HB ARG 9 2HB ARG 9 -38.955 -1.341 43.483 154 2HB ARG 9 1HB ARG 9 -37.502 -2.294 43.726 155 1HG ARG 9 2HG ARG 9 -36.512 0.234 44.351 156 2HG ARG 9 1HG ARG 9 -38.176 0.534 44.624 157 1HD ARG 9 2HD ARG 9 -38.389 -1.054 46.474 158 2HD ARG 9 1HD ARG 9 -36.979 -1.969 45.957 159 HE ARG 9 HE ARG 9 -35.467 -0.067 46.548 160 1HH1 ARG 9 1HH2 ARG 9 -38.589 0.489 47.869 161 2HH1 ARG 9 2HH2 ARG 9 -38.051 2.183 48.365 162 1HH2 ARG 9 2HH1 ARG 9 -35.123 1.837 46.761 163 2HH2 ARG 9 1HH1 ARG 9 -36.130 2.812 47.910 164 H MET 10 H MET 10 -36.532 -2.941 41.255 165 HA MET 10 HA MET 10 -38.253 -3.574 38.886 166 1HB MET 10 2HB MET 10 -37.314 -5.816 38.820 167 2HB MET 10 1HB MET 10 -36.119 -4.551 38.850 168 1HG MET 10 2HG MET 10 -35.288 -6.398 40.163 169 2HG MET 10 1HG MET 10 -35.603 -5.100 41.310 170 1HE MET 10 1HE MET 10 -37.504 -4.878 42.733 171 2HE MET 10 2HE MET 10 -36.997 -6.212 43.811 172 3HE MET 10 3HE MET 10 -38.682 -6.124 43.176 173 H SER 11 H SER 11 -39.924 -5.042 38.665 174 HA SER 11 HA SER 11 -41.938 -4.973 40.795 175 1HB SER 11 2HB SER 11 -42.492 -4.735 38.433 176 2HB SER 11 1HB SER 11 -42.089 -6.430 38.103 177 HG SER 11 HG SER 11 -43.871 -7.088 39.276 178 H ARG 12 H ARG 12 -42.228 -8.246 39.628 179 HA ARG 12 HA ARG 12 -40.804 -9.325 42.105 180 1HB ARG 12 2HB ARG 12 -42.633 -10.682 40.060 181 2HB ARG 12 1HB ARG 12 -41.935 -11.471 41.461 182 1HG ARG 12 2HG ARG 12 -43.151 -9.788 42.986 183 2HG ARG 12 1HG ARG 12 -43.913 -9.094 41.569 184 1HD ARG 12 2HD ARG 12 -44.262 -12.004 42.549 185 2HD ARG 12 1HD ARG 12 -45.425 -10.676 42.751 186 HE ARG 12 HE ARG 12 -44.893 -10.846 39.873 187 1HH1 ARG 12 2HH1 ARG 12 -46.744 -12.261 42.183 188 2HH1 ARG 12 1HH1 ARG 12 -47.727 -13.154 40.932 189 1HH2 ARG 12 1HH2 ARG 12 -45.970 -11.776 38.602 190 2HH2 ARG 12 2HH2 ARG 12 -47.224 -13.080 39.020 191 H SER 13 H SER 13 -38.672 -9.033 41.513 192 HA SER 13 HA SER 13 -36.560 -9.768 40.850 193 1HB SER 13 2HB SER 13 -37.298 -12.040 41.391 194 2HB SER 13 1HB SER 13 -37.874 -12.298 39.746 195 HG SER 13 HG SER 13 -35.746 -12.023 38.995 196 H SER 14 H SER 14 -38.401 -10.695 37.932 197 HA SER 14 HA SER 14 -36.690 -8.767 36.283 198 1HB SER 14 2HB SER 14 -35.861 -10.522 34.777 199 2HB SER 14 1HB SER 14 -35.332 -10.844 36.422 200 HG SER 14 HG SER 14 -37.730 -11.987 35.384 201 H GLY 15 H GLY 15 -38.168 -7.653 35.192 202 1HA GLY 15 2HA GLY 15 -39.632 -8.492 32.953 203 2HA GLY 15 1HA GLY 15 -40.788 -8.893 34.204 204 H ARG 16 H ARG 16 -40.668 -6.728 35.854 205 HA ARG 16 HA ARG 16 -41.201 -4.256 34.190 206 1HB ARG 16 2HB ARG 16 -43.398 -5.427 36.040 207 2HB ARG 16 1HB ARG 16 -43.427 -3.825 35.388 208 1HG ARG 16 2HG ARG 16 -44.724 -4.654 33.784 209 2HG ARG 16 1HG ARG 16 -43.211 -5.014 32.979 210 1HD ARG 16 2HD ARG 16 -43.316 -7.405 33.725 211 2HD ARG 16 1HD ARG 16 -44.630 -7.042 34.842 212 HE ARG 16 HE ARG 16 -45.041 -6.561 31.817 213 1HH1 ARG 16 2HH1 ARG 16 -46.038 -8.435 34.641 214 2HH1 ARG 16 1HH1 ARG 16 -47.572 -8.918 33.716 215 1HH2 ARG 16 1HH2 ARG 16 -46.865 -7.264 30.940 216 2HH2 ARG 16 2HH2 ARG 16 -47.952 -8.352 31.941 217 H VAL 17 H VAL 17 -42.055 -2.495 36.006 218 HA VAL 17 HA VAL 17 -40.079 -2.485 38.319 219 HB VAL 17 HB VAL 17 -38.832 -1.636 36.454 220 1HG1 VAL 17 1HG1 VAL 17 -39.352 0.477 35.203 221 2HG1 VAL 17 2HG1 VAL 17 -40.916 0.613 36.063 222 3HG1 VAL 17 3HG1 VAL 17 -40.619 -0.734 34.942 223 1HG2 VAL 17 1HG2 VAL 17 -38.096 0.639 37.262 224 2HG2 VAL 17 2HG2 VAL 17 -38.218 -0.556 38.553 225 3HG2 VAL 17 3HG2 VAL 17 -39.487 0.682 38.371 226 H TYR 18 H TYR 18 -40.720 -1.422 40.099 227 HA TYR 18 HA TYR 18 -43.277 0.206 39.948 228 1HB TYR 18 2HB TYR 18 -44.014 -0.296 42.051 229 2HB TYR 18 1HB TYR 18 -43.675 -1.820 41.312 230 HD1 TYR 18 HD1 TYR 18 -41.719 -3.185 42.086 231 HD2 TYR 18 HD2 TYR 18 -42.878 0.390 44.131 232 HE1 TYR 18 HE1 TYR 18 -40.578 -3.990 44.096 233 HE2 TYR 18 HE2 TYR 18 -41.710 -0.404 46.163 234 HH TYR 18 HH TYR 18 -40.342 -3.648 46.318 235 H TYR 19 H TYR 19 -43.047 2.241 40.355 236 HA TYR 19 HA TYR 19 -40.434 3.435 41.393 237 1HB TYR 19 2HB TYR 19 -42.789 4.887 40.156 238 2HB TYR 19 1HB TYR 19 -41.447 5.651 40.908 239 HD1 TYR 19 HD1 TYR 19 -41.934 3.145 38.081 240 HD2 TYR 19 HD2 TYR 19 -39.828 6.620 39.542 241 HE1 TYR 19 HE1 TYR 19 -40.817 3.389 35.923 242 HE2 TYR 19 HE2 TYR 19 -38.706 6.821 37.366 243 HH TYR 19 HH TYR 19 -39.702 4.889 34.639 244 H PHE 20 H PHE 20 -40.395 4.190 43.437 245 HA PHE 20 HA PHE 20 -42.932 3.781 45.153 246 1HB PHE 20 2HB PHE 20 -41.346 1.862 45.267 247 2HB PHE 20 1HB PHE 20 -40.045 2.892 45.763 248 HD1 PHE 20 HD1 PHE 20 -43.387 1.518 46.736 249 HD2 PHE 20 HD2 PHE 20 -40.035 3.756 48.115 250 HE1 PHE 20 HE1 PHE 20 -44.246 1.352 48.834 251 HE2 PHE 20 HE2 PHE 20 -40.762 3.661 50.277 252 HZ PHE 20 HZ PHE 20 -42.998 2.338 51.030 253 H ASN 21 H ASN 21 -43.545 5.599 46.067 254 HA ASN 21 HA ASN 21 -41.641 7.895 46.611 255 1HB ASN 21 2HB ASN 21 -44.174 8.024 45.777 256 2HB ASN 21 1HB ASN 21 -44.591 7.818 47.453 257 1HD2 ASN 21 1HD2 ASN 21 -42.158 9.596 48.200 258 2HD2 ASN 21 2HD2 ASN 21 -42.784 11.245 47.714 259 H HIS 22 H HIS 22 -40.590 8.096 48.567 260 HA HIS 22 HA HIS 22 -41.107 6.053 50.774 261 1HB HIS 22 2HB HIS 22 -38.754 7.909 50.045 262 2HB HIS 22 1HB HIS 22 -38.919 7.381 51.690 263 HD1 HIS 22 HD1 HIS 22 -38.491 4.865 52.331 264 HD2 HIS 22 HD2 HIS 22 -38.004 5.934 48.218 265 HE1 HIS 22 HE1 HIS 22 -37.187 3.023 51.093 266 H ILE 23 H ILE 23 -40.913 9.604 50.546 267 HA ILE 23 HA ILE 23 -41.740 10.113 53.335 268 HB ILE 23 HB ILE 23 -42.185 12.475 52.587 269 1HG1 ILE 23 2HG1 ILE 23 -41.302 11.508 49.797 270 2HG1 ILE 23 1HG1 ILE 23 -42.901 12.078 50.237 271 1HG2 ILE 23 1HG2 ILE 23 -39.800 13.057 52.300 272 2HG2 ILE 23 2HG2 ILE 23 -39.404 11.393 51.805 273 3HG2 ILE 23 3HG2 ILE 23 -39.956 11.733 53.461 274 1HD1 ILE 23 1HD1 ILE 23 -41.955 14.387 50.690 275 2HD1 ILE 23 2HD1 ILE 23 -41.703 13.822 49.014 276 3HD1 ILE 23 3HD1 ILE 23 -40.351 13.800 50.154 277 H THR 24 H THR 24 -43.782 10.004 50.434 278 HA THR 24 HA THR 24 -46.349 10.048 52.002 279 HB THR 24 HB THR 24 -45.641 9.234 49.111 280 HG1 THR 24 HG1 THR 24 -47.149 11.431 50.037 281 1HG2 THR 24 1HG2 THR 24 -48.461 9.576 50.306 282 2HG2 THR 24 2HG2 THR 24 -47.752 8.071 49.684 283 3HG2 THR 24 3HG2 THR 24 -48.058 9.413 48.564 284 H ASN 25 H ASN 25 -44.423 7.478 50.573 285 HA ASN 25 HA ASN 25 -44.199 5.159 51.038 286 1HB ASN 25 2HB ASN 25 -44.605 5.633 53.466 287 2HB ASN 25 1HB ASN 25 -46.310 5.317 53.239 288 1HD2 ASN 25 1HD2 ASN 25 -46.860 3.101 52.553 289 2HD2 ASN 25 2HD2 ASN 25 -45.701 1.754 53.053 290 H ALA 26 H ALA 26 -44.937 5.401 48.838 291 HA ALA 26 HA ALA 26 -47.501 3.818 48.309 292 1HB ALA 26 1HB ALA 26 -48.205 6.206 48.322 293 2HB ALA 26 2HB ALA 26 -48.300 5.564 46.672 294 3HB ALA 26 3HB ALA 26 -46.950 6.630 47.125 295 H SER 27 H SER 27 -47.128 2.276 46.869 296 HA SER 27 HA SER 27 -44.966 2.478 44.753 297 1HB SER 27 2HB SER 27 -45.581 0.137 44.191 298 2HB SER 27 1HB SER 27 -45.139 0.331 45.876 299 HG SER 27 HG SER 27 -47.769 0.030 44.778 300 H GLN 28 H GLN 28 -45.321 3.009 42.770 301 HA GLN 28 HA GLN 28 -47.873 2.173 41.405 302 1HB GLN 28 2HB GLN 28 -48.282 4.109 40.124 303 2HB GLN 28 1HB GLN 28 -48.225 4.625 41.785 304 1HG GLN 28 2HG GLN 28 -46.115 5.747 41.525 305 2HG GLN 28 1HG GLN 28 -45.678 4.953 40.054 306 1HE2 GLN 28 1HE2 GLN 28 -46.681 5.571 38.154 307 2HE2 GLN 28 2HE2 GLN 28 -47.413 7.190 37.955 308 H TRP 29 H TRP 29 -47.238 2.806 38.871 309 HA TRP 29 HA TRP 29 -44.603 1.327 38.261 310 1HB TRP 29 2HB TRP 29 -47.296 0.752 36.868 311 2HB TRP 29 1HB TRP 29 -45.726 0.377 36.188 312 HD1 TRP 29 HD1 TRP 29 -45.340 -0.665 39.744 313 HE1 TRP 29 HE1 TRP 29 -45.035 -3.256 39.732 314 HE3 TRP 29 HE3 TRP 29 -47.188 -1.467 35.057 315 HZ2 TRP 29 HZ2 TRP 29 -45.758 -5.313 37.912 316 HZ3 TRP 29 HZ3 TRP 29 -47.363 -3.801 34.228 317 HH2 TRP 29 HH2 TRP 29 -46.684 -5.698 35.647 318 H GLU 30 H GLU 30 -45.167 4.238 38.373 319 HA GLU 30 HA GLU 30 -43.718 4.799 35.858 320 1HB GLU 30 2HB GLU 30 -46.601 5.418 36.004 321 2HB GLU 30 1HB GLU 30 -45.766 6.949 35.984 322 1HG GLU 30 2HG GLU 30 -45.384 4.675 33.980 323 2HG GLU 30 1HG GLU 30 -46.424 6.051 33.753 324 H ARG 31 H ARG 31 -42.832 6.588 35.681 325 HA ARG 31 HA ARG 31 -41.493 8.372 37.476 326 1HB ARG 31 2HB ARG 31 -41.062 7.930 35.094 327 2HB ARG 31 1HB ARG 31 -42.721 8.364 34.700 328 1HG ARG 31 2HG ARG 31 -42.284 10.759 35.131 329 2HG ARG 31 1HG ARG 31 -40.587 10.387 35.459 330 1HD ARG 31 2HD ARG 31 -40.936 11.179 33.089 331 2HD ARG 31 1HD ARG 31 -40.305 9.536 33.101 332 HE ARG 31 HE ARG 31 -42.840 8.740 32.844 333 1HH1 ARG 31 1HH2 ARG 31 -41.910 11.818 31.536 334 2HH1 ARG 31 2HH2 ARG 31 -43.437 11.835 30.509 335 1HH2 ARG 31 2HH1 ARG 31 -44.421 8.829 31.805 336 2HH2 ARG 31 1HH1 ARG 31 -44.784 10.206 30.629 337 HA PRO 32 HA PRO 32 -45.131 10.862 39.146 338 1HB PRO 32 2HB PRO 32 -43.363 13.026 40.045 339 2HB PRO 32 1HB PRO 32 -44.043 11.766 41.036 340 1HG PRO 32 2HG PRO 32 -41.388 11.881 39.667 341 2HG PRO 32 1HG PRO 32 -41.746 11.136 41.211 342 1HD PRO 32 2HD PRO 32 -41.232 9.630 39.074 343 2HD PRO 32 1HD PRO 32 -42.580 9.108 40.126 344 H SER 33 H SER 33 -42.737 12.266 37.059 345 HA SER 33 HA SER 33 -44.728 13.560 35.396 346 1HB SER 33 2HB SER 33 -44.218 15.971 35.503 347 2HB SER 33 1HB SER 33 -44.878 15.374 37.006 348 HG SER 33 HG SER 33 -43.156 16.556 37.628 349 H GLY 34 H GLY 34 -41.550 15.008 35.663 350 1HA GLY 34 2HA GLY 34 -39.846 15.265 33.921 351 2HA GLY 34 1HA GLY 34 -39.827 13.522 33.948 352 H ASN 35 H ASN 35 -42.200 15.817 32.674 353 HA ASN 35 HA ASN 35 -42.082 14.370 29.963 354 1HB ASN 35 2HB ASN 35 -44.065 14.163 31.722 355 2HB ASN 35 1HB ASN 35 -44.540 15.760 31.201 356 1HD2 ASN 35 1HD2 ASN 35 -45.210 15.934 28.920 357 2HD2 ASN 35 2HD2 ASN 35 -45.769 14.404 28.064 358 H SER 36 H SER 36 -40.386 15.988 29.395 359 HA SER 36 HA SER 36 -40.832 18.691 28.833 360 1HB SER 36 2HB SER 36 -39.003 16.609 27.479 361 2HB SER 36 1HB SER 36 -38.947 18.315 27.068 362 HG SER 36 HG SER 36 -38.086 18.822 28.890 363 H SER 37 H SER 37 -40.965 16.401 26.084 364 HA SER 37 HA SER 37 -41.931 16.565 23.949 365 1HB SER 37 2HB SER 37 -44.110 16.620 25.116 366 2HB SER 37 1HB SER 37 -44.079 18.381 25.151 367 HG SER 37 HG SER 37 -43.928 18.321 22.824 368 H SER 38 H SER 38 -42.079 19.921 25.096 369 HA SER 38 HA SER 38 -40.537 20.855 22.616 370 1HB SER 38 2HB SER 38 -41.130 23.141 23.225 371 2HB SER 38 1HB SER 38 -42.585 22.163 23.101 372 HG SER 38 HG SER 38 -41.258 22.623 25.599 373 H GLY 39 H GLY 39 -40.183 20.745 26.212 374 1HA GLY 39 2HA GLY 39 -37.242 20.946 26.064 375 2HA GLY 39 1HA GLY 39 -37.930 22.493 26.577 Start of MODEL 3 1 1H GLU 1 1H GLU 1 -53.334 -10.129 40.904 2 2H GLU 1 2H GLU 1 -51.772 -9.995 41.495 3 3H GLU 1 3H GLU 1 -52.988 -9.033 42.067 4 HA GLU 1 HA GLU 1 -52.901 -10.665 43.721 5 1HB GLU 1 2HB GLU 1 -54.991 -11.679 43.731 6 2HB GLU 1 1HB GLU 1 -55.167 -10.187 42.860 7 1HG GLU 1 2HG GLU 1 -55.372 -13.053 41.794 8 2HG GLU 1 1HG GLU 1 -56.528 -11.755 41.661 9 H GLN 2 H GLN 2 -53.203 -12.594 41.224 10 HA GLN 2 HA GLN 2 -50.812 -14.436 41.793 11 1HB GLN 2 2HB GLN 2 -52.607 -15.492 40.548 12 2HB GLN 2 1HB GLN 2 -52.546 -14.335 39.255 13 1HG GLN 2 2HG GLN 2 -50.126 -16.143 40.003 14 2HG GLN 2 1HG GLN 2 -51.400 -16.699 38.955 15 1HE2 GLN 2 1HE2 GLN 2 -51.750 -15.451 36.939 16 2HE2 GLN 2 2HE2 GLN 2 -50.235 -14.801 36.125 17 HA PRO 3 HA PRO 3 -48.551 -11.109 39.021 18 1HB PRO 3 2HB PRO 3 -49.999 -8.729 38.536 19 2HB PRO 3 1HB PRO 3 -49.632 -10.020 37.397 20 1HG PRO 3 2HG PRO 3 -52.200 -9.632 38.999 21 2HG PRO 3 1HG PRO 3 -52.033 -10.089 37.299 22 1HD PRO 3 2HD PRO 3 -52.547 -11.998 39.168 23 2HD PRO 3 1HD PRO 3 -51.424 -12.360 37.845 24 H LEU 4 H LEU 4 -47.186 -10.312 40.363 25 HA LEU 4 HA LEU 4 -47.957 -8.374 42.581 26 1HB LEU 4 2HB LEU 4 -46.780 -10.461 43.459 27 2HB LEU 4 1HB LEU 4 -45.427 -10.105 42.401 28 HG LEU 4 HG LEU 4 -45.054 -7.906 43.644 29 1HD1 LEU 4 1HD1 LEU 4 -47.342 -7.506 44.607 30 2HD1 LEU 4 2HD1 LEU 4 -46.152 -7.621 45.908 31 3HD1 LEU 4 3HD1 LEU 4 -47.228 -8.998 45.573 32 1HD2 LEU 4 1HD2 LEU 4 -44.060 -8.994 45.666 33 2HD2 LEU 4 2HD2 LEU 4 -43.767 -9.973 44.219 34 3HD2 LEU 4 3HD2 LEU 4 -45.023 -10.466 45.381 35 1HN TPO 5 1HN THR 5 -48.298 -7.431 40.354 36 HA TPO 5 HA THR 5 -45.873 -5.832 39.389 37 HB TPO 5 HB THR 5 -45.730 -6.994 37.566 38 1HG2 TPO 5 1HG2 THR 5 -47.203 -5.343 36.410 39 2HG2 TPO 5 2HG2 THR 5 -48.564 -6.462 36.642 40 3HG2 TPO 5 3HG2 THR 5 -47.156 -6.960 35.669 41 HA PRO 6 HA PRO 6 -49.654 -3.732 40.866 42 1HB PRO 6 2HB PRO 6 -48.765 -2.121 42.878 43 2HB PRO 6 1HB PRO 6 -48.740 -3.886 42.955 44 1HG PRO 6 2HG PRO 6 -46.416 -2.036 42.144 45 2HG PRO 6 1HG PRO 6 -46.382 -3.303 43.396 46 1HD PRO 6 2HD PRO 6 -45.484 -3.831 40.842 47 2HD PRO 6 1HD PRO 6 -46.372 -5.056 41.780 48 H VAL 7 H VAL 7 -50.729 -2.400 39.664 49 HA VAL 7 HA VAL 7 -49.507 0.229 38.589 50 HB VAL 7 HB VAL 7 -51.747 -1.394 37.287 51 1HG1 VAL 7 1HG1 VAL 7 -51.519 0.220 35.360 52 2HG1 VAL 7 2HG1 VAL 7 -50.306 1.162 36.266 53 3HG1 VAL 7 3HG1 VAL 7 -51.992 1.076 36.831 54 1HG2 VAL 7 1HG2 VAL 7 -49.510 -2.509 36.894 55 2HG2 VAL 7 2HG2 VAL 7 -48.843 -0.994 36.263 56 3HG2 VAL 7 3HG2 VAL 7 -50.155 -1.833 35.393 57 H THR 8 H THR 8 -50.015 0.795 40.810 58 HA THR 8 HA THR 8 -51.162 1.844 42.504 59 HB THR 8 HB THR 8 -51.484 3.709 41.076 60 HG1 THR 8 HG1 THR 8 -53.676 3.014 42.722 61 1HG2 THR 8 1HG2 THR 8 -54.279 2.581 40.369 62 2HG2 THR 8 2HG2 THR 8 -52.969 2.928 39.220 63 3HG2 THR 8 3HG2 THR 8 -53.754 4.263 40.096 64 H ASP 9 H ASP 9 -51.619 -0.824 42.431 65 HA ASP 9 HA ASP 9 -54.225 -1.517 43.266 66 1HB ASP 9 2HB ASP 9 -51.493 -2.661 44.143 67 2HB ASP 9 1HB ASP 9 -53.029 -3.428 44.458 68 H LEU 10 H LEU 10 -55.429 -0.549 44.878 69 HA LEU 10 HA LEU 10 -54.564 -0.734 47.672 70 1HB LEU 10 2HB LEU 10 -54.618 1.461 48.426 71 2HB LEU 10 1HB LEU 10 -53.434 1.414 47.145 72 HG LEU 10 HG LEU 10 -56.287 2.558 46.826 73 1HD1 LEU 10 1HD1 LEU 10 -54.979 3.858 48.531 74 2HD1 LEU 10 2HD1 LEU 10 -55.214 4.825 47.061 75 3HD1 LEU 10 3HD1 LEU 10 -53.632 4.063 47.381 76 1HD2 LEU 10 1HD2 LEU 10 -55.294 3.761 44.800 77 2HD2 LEU 10 2HD2 LEU 10 -55.321 2.000 44.629 78 3HD2 LEU 10 3HD2 LEU 10 -53.788 2.816 45.013 79 1H LYS 1 1H LYS 1 -30.849 11.729 38.445 80 2H LYS 1 2H LYS 1 -31.047 10.637 37.244 81 3H LYS 1 3H LYS 1 -30.037 10.283 38.506 82 HA LYS 1 HA LYS 1 -32.199 9.086 38.700 83 1HB LYS 1 2HB LYS 1 -30.690 10.008 40.730 84 2HB LYS 1 1HB LYS 1 -31.943 11.222 40.903 85 1HG LYS 1 2HG LYS 1 -33.589 9.059 41.038 86 2HG LYS 1 1HG LYS 1 -32.119 8.160 41.330 87 1HD LYS 1 2HD LYS 1 -31.618 9.827 43.272 88 2HD LYS 1 1HD LYS 1 -33.176 10.577 42.980 89 1HE LYS 1 2HE LYS 1 -32.710 7.631 43.858 90 2HE LYS 1 1HE LYS 1 -33.195 8.952 44.915 91 1HZ LYS 1 1HZ LYS 1 -35.254 9.121 43.198 92 2HZ LYS 1 2HZ LYS 1 -35.264 7.886 44.306 93 3HZ LYS 1 3HZ LYS 1 -34.777 7.564 42.804 94 H LEU 2 H LEU 2 -34.472 9.179 38.721 95 HA LEU 2 HA LEU 2 -36.168 11.544 38.266 96 1HB LEU 2 2HB LEU 2 -37.957 9.946 39.088 97 2HB LEU 2 1HB LEU 2 -36.891 9.164 37.950 98 HG LEU 2 HG LEU 2 -35.703 8.743 40.555 99 1HD1 LEU 2 1HD1 LEU 2 -38.699 8.362 40.875 100 2HD1 LEU 2 2HD1 LEU 2 -37.728 9.652 41.592 101 3HD1 LEU 2 3HD1 LEU 2 -37.369 7.965 41.995 102 1HD2 LEU 2 1HD2 LEU 2 -36.509 6.328 40.243 103 2HD2 LEU 2 2HD2 LEU 2 -35.867 6.951 38.718 104 3HD2 LEU 2 3HD2 LEU 2 -37.628 6.852 38.967 105 HA PRO 3 HA PRO 3 -36.201 13.651 41.987 106 1HB PRO 3 2HB PRO 3 -39.226 13.164 42.466 107 2HB PRO 3 1HB PRO 3 -38.411 14.668 42.575 108 1HG PRO 3 2HG PRO 3 -39.652 14.153 40.304 109 2HG PRO 3 1HG PRO 3 -37.953 14.637 40.111 110 1HD PRO 3 2HD PRO 3 -39.001 11.721 40.292 111 2HD PRO 3 1HD PRO 3 -38.104 12.484 38.981 112 HA PRO 4 HA PRO 4 -35.379 11.799 45.935 113 1HB PRO 4 2HB PRO 4 -35.286 13.900 47.704 114 2HB PRO 4 1HB PRO 4 -34.166 13.751 46.338 115 1HG PRO 4 2HG PRO 4 -36.705 15.452 46.498 116 2HG PRO 4 1HG PRO 4 -35.097 15.955 45.930 117 1HD PRO 4 2HD PRO 4 -37.174 15.143 44.259 118 2HD PRO 4 1HD PRO 4 -35.467 14.950 43.778 119 H GLY 5 H GLY 5 -36.206 11.030 47.860 120 1HA GLY 5 2HA GLY 5 -38.125 10.276 49.305 121 2HA GLY 5 1HA GLY 5 -39.238 11.214 48.349 122 H TRP 6 H TRP 6 -38.043 9.862 45.648 123 HA TRP 6 HA TRP 6 -39.702 7.489 45.735 124 1HB TRP 6 2HB TRP 6 -38.023 9.246 43.781 125 2HB TRP 6 1HB TRP 6 -38.998 7.946 43.325 126 HD1 TRP 6 HD1 TRP 6 -39.335 11.612 43.715 127 HE1 TRP 6 HE1 TRP 6 -41.764 12.381 43.233 128 HE3 TRP 6 HE3 TRP 6 -41.188 7.042 42.967 129 HZ2 TRP 6 HZ2 TRP 6 -44.310 10.940 43.204 130 HZ3 TRP 6 HZ3 TRP 6 -43.647 6.756 42.648 131 HH2 TRP 6 HH2 TRP 6 -45.197 8.641 42.871 132 H GLU 7 H GLU 7 -39.055 5.546 44.582 133 HA GLU 7 HA GLU 7 -37.139 5.857 42.744 134 1HB GLU 7 2HB GLU 7 -35.408 5.199 44.672 135 2HB GLU 7 1HB GLU 7 -36.140 3.663 44.651 136 1HG GLU 7 2HG GLU 7 -33.886 3.793 43.442 137 2HG GLU 7 1HG GLU 7 -35.165 3.089 42.471 138 H LYS 8 H LYS 8 -36.980 4.295 41.246 139 HA LYS 8 HA LYS 8 -39.196 2.400 40.818 140 1HB LYS 8 2HB LYS 8 -38.307 1.729 38.742 141 2HB LYS 8 1HB LYS 8 -38.383 3.450 38.943 142 1HG LYS 8 2HG LYS 8 -36.387 3.263 37.811 143 2HG LYS 8 1HG LYS 8 -35.855 3.448 39.463 144 1HD LYS 8 2HD LYS 8 -35.730 0.782 39.539 145 2HD LYS 8 1HD LYS 8 -36.056 0.823 37.824 146 1HE LYS 8 2HE LYS 8 -33.639 0.645 38.002 147 2HE LYS 8 1HE LYS 8 -33.967 2.292 37.443 148 1HZ LYS 8 1HZ LYS 8 -33.555 1.608 40.387 149 2HZ LYS 8 2HZ LYS 8 -33.764 3.095 39.851 150 3HZ LYS 8 3HZ LYS 8 -32.392 2.330 39.456 151 H ARG 9 H ARG 9 -39.497 0.218 41.082 152 HA ARG 9 HA ARG 9 -37.514 -1.350 42.684 153 1HB ARG 9 2HB ARG 9 -40.523 -0.864 43.262 154 2HB ARG 9 1HB ARG 9 -39.623 -2.153 44.011 155 1HG ARG 9 2HG ARG 9 -38.951 0.847 44.343 156 2HG ARG 9 1HG ARG 9 -40.034 -0.050 45.389 157 1HD ARG 9 2HD ARG 9 -38.352 -1.441 46.315 158 2HD ARG 9 1HD ARG 9 -37.199 -1.174 45.037 159 HE ARG 9 HE ARG 9 -37.854 0.867 47.254 160 1HH1 ARG 9 2HH1 ARG 9 -36.201 0.444 44.228 161 2HH1 ARG 9 1HH1 ARG 9 -35.036 1.767 44.633 162 1HH2 ARG 9 1HH2 ARG 9 -36.554 2.368 47.622 163 2HH2 ARG 9 2HH2 ARG 9 -35.223 2.783 46.444 164 H MET 10 H MET 10 -37.846 -3.403 42.209 165 HA MET 10 HA MET 10 -38.729 -4.087 39.411 166 1HB MET 10 2HB MET 10 -37.546 -6.070 39.512 167 2HB MET 10 1HB MET 10 -36.549 -4.940 40.370 168 1HG MET 10 2HG MET 10 -38.264 -7.214 41.603 169 2HG MET 10 1HG MET 10 -36.522 -7.177 41.416 170 1HE MET 10 1HE MET 10 -39.529 -6.420 43.302 171 2HE MET 10 2HE MET 10 -39.319 -4.675 43.541 172 3HE MET 10 3HE MET 10 -38.969 -5.798 44.880 173 H SER 11 H SER 11 -39.976 -5.915 38.846 174 HA SER 11 HA SER 11 -42.124 -6.852 40.877 175 1HB SER 11 2HB SER 11 -43.187 -5.584 39.058 176 2HB SER 11 1HB SER 11 -42.356 -6.532 37.833 177 HG SER 11 HG SER 11 -44.226 -7.603 39.744 178 H ARG 12 H ARG 12 -41.908 -8.753 38.071 179 HA ARG 12 HA ARG 12 -40.819 -11.063 39.479 180 1HB ARG 12 2HB ARG 12 -41.225 -10.618 36.467 181 2HB ARG 12 1HB ARG 12 -40.852 -12.173 37.155 182 1HG ARG 12 2HG ARG 12 -43.327 -10.559 38.017 183 2HG ARG 12 1HG ARG 12 -43.362 -11.613 36.627 184 1HD ARG 12 2HD ARG 12 -42.930 -13.639 37.994 185 2HD ARG 12 1HD ARG 12 -42.583 -12.670 39.432 186 HE ARG 12 HE ARG 12 -45.030 -11.634 39.096 187 1HH1 ARG 12 2HH1 ARG 12 -44.498 -14.807 37.849 188 2HH1 ARG 12 1HH1 ARG 12 -46.334 -15.047 37.852 189 1HH2 ARG 12 1HH2 ARG 12 -46.819 -11.961 38.811 190 2HH2 ARG 12 2HH2 ARG 12 -47.590 -13.582 38.526 191 H SER 13 H SER 13 -38.854 -9.773 40.213 192 HA SER 13 HA SER 13 -36.544 -9.748 40.491 193 1HB SER 13 2HB SER 13 -36.482 -12.189 38.656 194 2HB SER 13 1HB SER 13 -35.128 -11.601 39.627 195 HG SER 13 HG SER 13 -36.304 -13.187 40.755 196 H SER 14 H SER 14 -36.477 -10.446 37.020 197 HA SER 14 HA SER 14 -35.399 -7.673 36.465 198 1HB SER 14 2HB SER 14 -33.328 -9.077 36.799 199 2HB SER 14 1HB SER 14 -33.845 -10.139 35.476 200 HG SER 14 HG SER 14 -32.515 -8.558 34.622 201 H GLY 15 H GLY 15 -37.320 -7.251 35.492 202 1HA GLY 15 2HA GLY 15 -37.894 -8.173 32.729 203 2HA GLY 15 1HA GLY 15 -38.873 -9.113 33.840 204 H ARG 16 H ARG 16 -39.967 -7.462 35.567 205 HA ARG 16 HA ARG 16 -40.969 -4.961 34.135 206 1HB ARG 16 2HB ARG 16 -42.768 -7.068 35.517 207 2HB ARG 16 1HB ARG 16 -43.237 -5.403 35.388 208 1HG ARG 16 2HG ARG 16 -44.307 -6.270 33.528 209 2HG ARG 16 1HG ARG 16 -42.892 -5.520 32.815 210 1HD ARG 16 2HD ARG 16 -41.796 -7.959 32.874 211 2HD ARG 16 1HD ARG 16 -43.326 -8.510 33.448 212 HE ARG 16 HE ARG 16 -44.292 -8.169 31.202 213 1HH1 ARG 16 1HH2 ARG 16 -41.078 -6.773 31.311 214 2HH1 ARG 16 2HH2 ARG 16 -41.020 -6.660 29.493 215 1HH2 ARG 16 2HH1 ARG 16 -44.157 -8.011 29.163 216 2HH2 ARG 16 1HH1 ARG 16 -42.677 -7.319 28.356 217 H VAL 17 H VAL 17 -42.173 -3.556 35.808 218 HA VAL 17 HA VAL 17 -40.527 -3.120 38.289 219 HB VAL 17 HB VAL 17 -38.837 -2.602 36.702 220 1HG1 VAL 17 1HG1 VAL 17 -38.966 -0.879 34.885 221 2HG1 VAL 17 2HG1 VAL 17 -40.711 -0.655 35.215 222 3HG1 VAL 17 3HG1 VAL 17 -40.099 -2.207 34.599 223 1HG2 VAL 17 1HG2 VAL 17 -38.267 -0.207 37.135 224 2HG2 VAL 17 2HG2 VAL 17 -38.948 -0.941 38.605 225 3HG2 VAL 17 3HG2 VAL 17 -39.943 0.136 37.610 226 H TYR 18 H TYR 18 -41.448 -1.781 39.689 227 HA TYR 18 HA TYR 18 -43.672 0.100 38.811 228 1HB TYR 18 2HB TYR 18 -44.883 -0.143 40.793 229 2HB TYR 18 1HB TYR 18 -44.633 -1.739 40.199 230 HD1 TYR 18 HD1 TYR 18 -44.094 0.526 43.014 231 HD2 TYR 18 HD2 TYR 18 -42.943 -3.296 41.419 232 HE1 TYR 18 HE1 TYR 18 -43.461 -0.239 45.272 233 HE2 TYR 18 HE2 TYR 18 -42.266 -4.024 43.671 234 HH TYR 18 HH TYR 18 -42.912 -2.060 46.512 235 H TYR 19 H TYR 19 -43.753 2.012 40.479 236 HA TYR 19 HA TYR 19 -41.019 2.709 41.526 237 1HB TYR 19 2HB TYR 19 -40.501 3.870 39.680 238 2HB TYR 19 1HB TYR 19 -42.052 3.602 38.991 239 HD1 TYR 19 HD1 TYR 19 -44.060 5.031 39.658 240 HD2 TYR 19 HD2 TYR 19 -39.924 6.250 39.845 241 HE1 TYR 19 HE1 TYR 19 -44.704 7.409 39.747 242 HE2 TYR 19 HE2 TYR 19 -40.637 8.575 39.962 243 HH TYR 19 HH TYR 19 -44.182 9.318 40.170 244 H PHE 20 H PHE 20 -40.877 3.725 43.277 245 HA PHE 20 HA PHE 20 -43.517 3.897 44.812 246 1HB PHE 20 2HB PHE 20 -42.257 1.718 44.809 247 2HB PHE 20 1HB PHE 20 -40.836 2.500 45.457 248 HD1 PHE 20 HD1 PHE 20 -44.535 1.974 46.138 249 HD2 PHE 20 HD2 PHE 20 -40.728 2.726 47.892 250 HE1 PHE 20 HE1 PHE 20 -45.532 1.787 48.170 251 HE2 PHE 20 HE2 PHE 20 -41.585 2.572 50.001 252 HZ PHE 20 HZ PHE 20 -44.177 2.015 50.513 253 H ASN 21 H ASN 21 -43.835 5.685 45.862 254 HA ASN 21 HA ASN 21 -41.626 7.540 46.769 255 1HB ASN 21 2HB ASN 21 -44.076 8.133 45.854 256 2HB ASN 21 1HB ASN 21 -44.582 7.777 47.484 257 1HD2 ASN 21 1HD2 ASN 21 -41.872 9.136 48.215 258 2HD2 ASN 21 2HD2 ASN 21 -42.344 10.918 48.068 259 H HIS 22 H HIS 22 -40.588 7.199 48.721 260 HA HIS 22 HA HIS 22 -41.599 5.057 50.639 261 1HB HIS 22 2HB HIS 22 -38.937 6.581 50.300 262 2HB HIS 22 1HB HIS 22 -39.288 5.825 51.822 263 HD1 HIS 22 HD1 HIS 22 -39.387 3.178 52.010 264 HD2 HIS 22 HD2 HIS 22 -38.440 4.816 48.177 265 HE1 HIS 22 HE1 HIS 22 -38.366 1.351 50.512 266 H ILE 23 H ILE 23 -40.994 8.520 50.842 267 HA ILE 23 HA ILE 23 -41.852 8.812 53.682 268 HB ILE 23 HB ILE 23 -41.960 11.292 53.160 269 1HG1 ILE 23 2HG1 ILE 23 -40.884 10.490 50.381 270 2HG1 ILE 23 1HG1 ILE 23 -42.450 11.214 50.716 271 1HG2 ILE 23 1HG2 ILE 23 -39.507 11.576 53.171 272 2HG2 ILE 23 2HG2 ILE 23 -39.263 9.937 52.519 273 3HG2 ILE 23 3HG2 ILE 23 -39.940 10.169 54.148 274 1HD1 ILE 23 1HD1 ILE 23 -40.947 12.917 49.825 275 2HD1 ILE 23 2HD1 ILE 23 -39.720 12.593 51.067 276 3HD1 ILE 23 3HD1 ILE 23 -41.287 13.323 51.528 277 H THR 24 H THR 24 -43.653 9.411 50.672 278 HA THR 24 HA THR 24 -46.308 9.697 52.008 279 HB THR 24 HB THR 24 -45.477 8.993 49.130 280 HG1 THR 24 HG1 THR 24 -45.944 11.146 48.753 281 1HG2 THR 24 1HG2 THR 24 -47.717 9.728 48.376 282 2HG2 THR 24 2HG2 THR 24 -48.247 9.902 50.082 283 3HG2 THR 24 3HG2 THR 24 -47.836 8.300 49.424 284 H ASN 25 H ASN 25 -44.749 6.928 50.370 285 HA ASN 25 HA ASN 25 -45.069 4.670 50.351 286 1HB ASN 25 2HB ASN 25 -47.163 4.837 52.551 287 2HB ASN 25 1HB ASN 25 -46.473 3.436 51.762 288 1HD2 ASN 25 1HD2 ASN 25 -45.620 6.060 53.862 289 2HD2 ASN 25 2HD2 ASN 25 -44.057 5.278 54.401 290 H ALA 26 H ALA 26 -45.556 5.256 48.246 291 HA ALA 26 HA ALA 26 -48.328 4.358 47.345 292 1HB ALA 26 1HB ALA 26 -47.138 7.123 46.605 293 2HB ALA 26 2HB ALA 26 -48.543 6.817 47.660 294 3HB ALA 26 3HB ALA 26 -48.632 6.425 45.934 295 H SER 27 H SER 27 -48.094 2.920 45.783 296 HA SER 27 HA SER 27 -45.718 2.962 43.841 297 1HB SER 27 2HB SER 27 -46.469 0.651 43.237 298 2HB SER 27 1HB SER 27 -45.999 0.845 44.909 299 HG SER 27 HG SER 27 -48.704 0.889 43.953 300 H GLN 28 H GLN 28 -45.977 3.794 42.043 301 HA GLN 28 HA GLN 28 -48.293 3.012 40.251 302 1HB GLN 28 2HB GLN 28 -48.409 5.163 39.009 303 2HB GLN 28 1HB GLN 28 -48.870 5.327 40.709 304 1HG GLN 28 2HG GLN 28 -46.470 6.305 41.050 305 2HG GLN 28 1HG GLN 28 -46.242 6.086 39.323 306 1HE2 GLN 28 1HE2 GLN 28 -46.886 7.737 38.062 307 2HE2 GLN 28 2HE2 GLN 28 -48.301 8.822 38.363 308 H TRP 29 H TRP 29 -47.245 3.844 37.857 309 HA TRP 29 HA TRP 29 -44.397 2.625 37.710 310 1HB TRP 29 2HB TRP 29 -46.518 2.353 35.477 311 2HB TRP 29 1HB TRP 29 -44.834 1.833 35.491 312 HD1 TRP 29 HD1 TRP 29 -46.748 0.637 38.585 313 HE1 TRP 29 HE1 TRP 29 -46.478 -1.886 38.650 314 HE3 TRP 29 HE3 TRP 29 -44.884 0.079 33.842 315 HZ2 TRP 29 HZ2 TRP 29 -45.675 -3.872 36.798 316 HZ3 TRP 29 HZ3 TRP 29 -44.380 -2.227 33.050 317 HH2 TRP 29 HH2 TRP 29 -44.842 -4.168 34.474 318 H GLU 30 H GLU 30 -46.294 5.436 37.002 319 HA GLU 30 HA GLU 30 -44.330 6.386 34.859 320 1HB GLU 30 2HB GLU 30 -46.788 6.288 34.184 321 2HB GLU 30 1HB GLU 30 -47.232 7.282 35.530 322 1HG GLU 30 2HG GLU 30 -47.266 8.546 33.375 323 2HG GLU 30 1HG GLU 30 -46.246 9.293 34.577 324 H ARG 31 H ARG 31 -43.393 8.167 34.931 325 HA ARG 31 HA ARG 31 -42.712 9.110 37.739 326 1HB ARG 31 2HB ARG 31 -40.602 8.987 37.256 327 2HB ARG 31 1HB ARG 31 -41.085 7.782 36.218 328 1HG ARG 31 2HG ARG 31 -40.843 10.641 35.071 329 2HG ARG 31 1HG ARG 31 -39.380 9.702 35.458 330 1HD ARG 31 2HD ARG 31 -39.635 8.944 33.238 331 2HD ARG 31 1HD ARG 31 -40.719 7.808 34.050 332 HE ARG 31 HE ARG 31 -42.675 8.942 33.186 333 1HH1 ARG 31 1HH2 ARG 31 -39.984 11.022 32.630 334 2HH1 ARG 31 2HH2 ARG 31 -41.000 12.141 31.589 335 1HH2 ARG 31 2HH1 ARG 31 -43.741 10.078 31.959 336 2HH2 ARG 31 1HH1 ARG 31 -43.052 11.583 31.197 337 HA PRO 32 HA PRO 32 -44.287 12.727 38.308 338 1HB PRO 32 2HB PRO 32 -41.525 14.044 38.931 339 2HB PRO 32 1HB PRO 32 -42.881 13.972 40.042 340 1HG PRO 32 2HG PRO 32 -40.974 12.333 40.520 341 2HG PRO 32 1HG PRO 32 -42.598 11.675 40.504 342 1HD PRO 32 2HD PRO 32 -40.562 11.365 38.165 343 2HD PRO 32 1HD PRO 32 -41.514 10.237 38.956 344 H SER 33 H SER 33 -43.208 12.655 35.655 345 HA SER 33 HA SER 33 -42.724 13.882 33.626 346 1HB SER 33 2HB SER 33 -43.231 16.543 35.044 347 2HB SER 33 1HB SER 33 -42.891 16.322 33.331 348 HG SER 33 HG SER 33 -45.037 15.057 34.717 349 H GLY 34 H GLY 34 -41.087 15.394 36.429 350 1HA GLY 34 2HA GLY 34 -38.649 15.851 36.653 351 2HA GLY 34 1HA GLY 34 -38.346 15.217 35.049 352 H ASN 35 H ASN 35 -39.235 16.571 33.282 353 HA ASN 35 HA ASN 35 -39.085 19.603 33.799 354 1HB ASN 35 2HB ASN 35 -37.502 18.673 32.072 355 2HB ASN 35 1HB ASN 35 -38.848 18.064 31.129 356 1HD2 ASN 35 1HD2 ASN 35 -40.277 19.743 30.151 357 2HD2 ASN 35 2HD2 ASN 35 -39.544 21.398 29.882 358 H SER 36 H SER 36 -41.166 19.864 34.651 359 HA SER 36 HA SER 36 -43.616 18.821 33.289 360 1HB SER 36 2HB SER 36 -44.836 19.885 35.089 361 2HB SER 36 1HB SER 36 -43.449 19.041 35.764 362 HG SER 36 HG SER 36 -43.415 21.820 35.083 363 H SER 37 H SER 37 -43.365 19.725 31.171 364 HA SER 37 HA SER 37 -43.173 22.495 30.556 365 1HB SER 37 2HB SER 37 -44.345 20.245 28.805 366 2HB SER 37 1HB SER 37 -43.838 21.816 28.223 367 HG SER 37 HG SER 37 -42.337 20.263 27.890 368 H SER 38 H SER 38 -46.129 20.681 30.051 369 HA SER 38 HA SER 38 -48.211 21.249 29.122 370 1HB SER 38 2HB SER 38 -49.315 23.349 29.106 371 2HB SER 38 1HB SER 38 -48.759 22.983 30.739 372 HG SER 38 HG SER 38 -46.802 24.306 29.979 373 H GLY 39 H GLY 39 -46.764 20.267 27.599 374 1HA GLY 39 2HA GLY 39 -46.367 20.858 24.953 375 2HA GLY 39 1HA GLY 39 -45.248 22.018 25.687 Start of MODEL 4 1 1H GLU 1 1H GLU 1 -54.500 -6.825 41.772 2 2H GLU 1 2H GLU 1 -52.894 -6.690 41.847 3 3H GLU 1 3H GLU 1 -53.791 -6.782 43.258 4 HA GLU 1 HA GLU 1 -54.581 -9.065 42.459 5 1HB GLU 1 2HB GLU 1 -54.184 -8.297 40.039 6 2HB GLU 1 1HB GLU 1 -52.487 -8.617 40.255 7 1HG GLU 1 2HG GLU 1 -53.991 -11.102 40.923 8 2HG GLU 1 1HG GLU 1 -54.666 -10.438 39.471 9 H GLN 2 H GLN 2 -51.826 -10.241 41.589 10 HA GLN 2 HA GLN 2 -51.064 -11.026 44.442 11 1HB GLN 2 2HB GLN 2 -50.791 -12.599 41.816 12 2HB GLN 2 1HB GLN 2 -50.295 -13.187 43.388 13 1HG GLN 2 2HG GLN 2 -52.638 -13.133 44.236 14 2HG GLN 2 1HG GLN 2 -53.218 -12.390 42.759 15 1HE2 GLN 2 1HE2 GLN 2 -52.731 -13.731 40.694 16 2HE2 GLN 2 2HE2 GLN 2 -52.997 -15.533 40.948 17 HA PRO 3 HA PRO 3 -46.544 -10.949 43.175 18 1HB PRO 3 2HB PRO 3 -45.577 -10.578 40.662 19 2HB PRO 3 1HB PRO 3 -46.600 -11.960 41.057 20 1HG PRO 3 2HG PRO 3 -47.481 -9.342 39.712 21 2HG PRO 3 1HG PRO 3 -47.803 -11.003 39.178 22 1HD PRO 3 2HD PRO 3 -49.556 -9.432 40.740 23 2HD PRO 3 1HD PRO 3 -49.602 -11.210 40.671 24 H LEU 4 H LEU 4 -44.654 -9.211 41.901 25 HA LEU 4 HA LEU 4 -44.810 -6.840 43.689 26 1HB LEU 4 2HB LEU 4 -42.761 -7.737 41.562 27 2HB LEU 4 1HB LEU 4 -42.633 -6.239 42.427 28 HG LEU 4 HG LEU 4 -42.641 -7.513 44.656 29 1HD1 LEU 4 1HD1 LEU 4 -41.829 -9.931 44.543 30 2HD1 LEU 4 2HD1 LEU 4 -42.170 -9.954 42.795 31 3HD1 LEU 4 3HD1 LEU 4 -43.490 -9.759 43.976 32 1HD2 LEU 4 1HD2 LEU 4 -40.202 -8.064 44.439 33 2HD2 LEU 4 2HD2 LEU 4 -40.578 -6.545 43.606 34 3HD2 LEU 4 3HD2 LEU 4 -40.333 -8.033 42.662 35 1HN TPO 5 1HN THR 5 -46.836 -6.183 42.740 36 HA TPO 5 HA THR 5 -46.758 -4.271 40.328 37 HB TPO 5 HB THR 5 -48.414 -6.846 40.647 38 1HG2 TPO 5 1HG2 THR 5 -47.439 -7.412 38.364 39 2HG2 TPO 5 2HG2 THR 5 -46.187 -7.308 39.603 40 3HG2 TPO 5 3HG2 THR 5 -46.410 -5.969 38.443 41 HA PRO 6 HA PRO 6 -49.862 -2.629 43.503 42 1HB PRO 6 2HB PRO 6 -48.630 -0.398 44.413 43 2HB PRO 6 1HB PRO 6 -48.081 -2.011 44.903 44 1HG PRO 6 2HG PRO 6 -46.904 -0.255 42.652 45 2HG PRO 6 1HG PRO 6 -46.022 -0.996 44.009 46 1HD PRO 6 2HD PRO 6 -46.196 -2.217 41.518 47 2HD PRO 6 1HD PRO 6 -46.104 -3.155 43.033 48 H VAL 7 H VAL 7 -50.803 -2.573 41.197 49 HA VAL 7 HA VAL 7 -50.886 0.034 39.782 50 HB VAL 7 HB VAL 7 -52.557 -1.047 38.295 51 1HG1 VAL 7 1HG1 VAL 7 -50.131 -2.881 38.733 52 2HG1 VAL 7 2HG1 VAL 7 -50.128 -1.351 37.814 53 3HG1 VAL 7 3HG1 VAL 7 -51.102 -2.728 37.258 54 1HG2 VAL 7 1HG2 VAL 7 -52.350 -3.624 39.994 55 2HG2 VAL 7 2HG2 VAL 7 -53.199 -3.439 38.455 56 3HG2 VAL 7 3HG2 VAL 7 -53.784 -2.585 39.888 57 H THR 8 H THR 8 -52.260 -0.200 42.554 58 HA THR 8 HA THR 8 -54.208 0.617 43.708 59 HB THR 8 HB THR 8 -55.638 1.334 41.108 60 HG1 THR 8 HG1 THR 8 -53.752 2.534 41.453 61 1HG2 THR 8 1HG2 THR 8 -57.047 2.771 42.593 62 2HG2 THR 8 2HG2 THR 8 -56.167 2.207 44.034 63 3HG2 THR 8 3HG2 THR 8 -57.175 1.069 43.098 64 H ASP 9 H ASP 9 -55.120 -1.149 44.586 65 HA ASP 9 HA ASP 9 -54.711 -3.559 43.108 66 1HB ASP 9 2HB ASP 9 -54.196 -2.971 45.566 67 2HB ASP 9 1HB ASP 9 -55.874 -3.353 45.932 68 H LEU 10 H LEU 10 -56.223 -3.372 41.476 69 HA LEU 10 HA LEU 10 -58.125 -5.681 42.009 70 1HB LEU 10 2HB LEU 10 -58.953 -3.850 40.359 71 2HB LEU 10 1HB LEU 10 -57.621 -4.273 39.314 72 HG LEU 10 HG LEU 10 -59.811 -5.144 38.596 73 1HD1 LEU 10 1HD1 LEU 10 -59.186 -7.448 37.993 74 2HD1 LEU 10 2HD1 LEU 10 -57.986 -7.518 39.305 75 3HD1 LEU 10 3HD1 LEU 10 -57.731 -6.420 37.939 76 1HD2 LEU 10 1HD2 LEU 10 -59.817 -6.983 41.071 77 2HD2 LEU 10 2HD2 LEU 10 -61.033 -6.951 39.773 78 3HD2 LEU 10 3HD2 LEU 10 -60.852 -5.553 40.861 79 1H LYS 1 1H LYS 1 -33.635 16.070 36.004 80 2H LYS 1 2H LYS 1 -35.003 16.691 36.701 81 3H LYS 1 3H LYS 1 -35.133 15.580 35.518 82 HA LYS 1 HA LYS 1 -34.239 13.818 36.885 83 1HB LYS 1 2HB LYS 1 -33.482 14.163 39.141 84 2HB LYS 1 1HB LYS 1 -32.542 15.173 38.085 85 1HG LYS 1 2HG LYS 1 -33.687 17.230 38.888 86 2HG LYS 1 1HG LYS 1 -34.916 16.325 39.745 87 1HD LYS 1 2HD LYS 1 -31.910 16.099 40.471 88 2HD LYS 1 1HD LYS 1 -32.936 17.384 41.083 89 1HE LYS 1 2HE LYS 1 -34.529 15.705 42.135 90 2HE LYS 1 1HE LYS 1 -33.563 14.370 41.542 91 1HZ LYS 1 1HZ LYS 1 -32.901 14.971 43.868 92 2HZ LYS 1 2HZ LYS 1 -32.529 16.507 43.442 93 3HZ LYS 1 3HZ LYS 1 -31.618 15.263 42.894 94 H LEU 2 H LEU 2 -35.479 12.552 38.451 95 HA LEU 2 HA LEU 2 -38.300 13.431 38.932 96 1HB LEU 2 2HB LEU 2 -38.644 11.130 39.704 97 2HB LEU 2 1HB LEU 2 -37.667 11.086 38.270 98 HG LEU 2 HG LEU 2 -35.685 11.194 40.330 99 1HD1 LEU 2 1HD1 LEU 2 -37.433 11.088 42.065 100 2HD1 LEU 2 2HD1 LEU 2 -36.457 9.629 42.104 101 3HD1 LEU 2 3HD1 LEU 2 -38.098 9.617 41.380 102 1HD2 LEU 2 1HD2 LEU 2 -37.020 8.618 39.190 103 2HD2 LEU 2 2HD2 LEU 2 -35.422 8.711 39.956 104 3HD2 LEU 2 3HD2 LEU 2 -35.696 9.511 38.395 105 HA PRO 3 HA PRO 3 -37.711 15.067 42.993 106 1HB PRO 3 2HB PRO 3 -40.130 13.605 44.123 107 2HB PRO 3 1HB PRO 3 -39.842 15.267 44.022 108 1HG PRO 3 2HG PRO 3 -41.513 14.179 42.265 109 2HG PRO 3 1HG PRO 3 -40.327 15.334 41.622 110 1HD PRO 3 2HD PRO 3 -39.984 12.252 41.727 111 2HD PRO 3 1HD PRO 3 -39.942 13.320 40.298 112 HA PRO 4 HA PRO 4 -35.209 13.001 45.955 113 1HB PRO 4 2HB PRO 4 -35.280 14.580 48.210 114 2HB PRO 4 1HB PRO 4 -34.665 15.161 46.655 115 1HG PRO 4 2HG PRO 4 -37.446 15.600 47.856 116 2HG PRO 4 1HG PRO 4 -36.381 16.827 47.137 117 1HD PRO 4 2HD PRO 4 -38.470 15.556 45.784 118 2HD PRO 4 1HD PRO 4 -37.044 16.186 44.911 119 H GLY 5 H GLY 5 -35.188 11.311 47.250 120 1HA GLY 5 2HA GLY 5 -35.971 9.706 48.979 121 2HA GLY 5 1HA GLY 5 -37.483 10.560 49.132 122 H TRP 6 H TRP 6 -37.205 10.053 45.683 123 HA TRP 6 HA TRP 6 -38.821 7.588 45.760 124 1HB TRP 6 2HB TRP 6 -37.857 9.915 43.933 125 2HB TRP 6 1HB TRP 6 -38.492 8.521 43.245 126 HD1 TRP 6 HD1 TRP 6 -39.587 11.768 44.594 127 HE1 TRP 6 HE1 TRP 6 -42.151 11.999 44.989 128 HE3 TRP 6 HE3 TRP 6 -40.667 7.010 43.293 129 HZ2 TRP 6 HZ2 TRP 6 -44.282 10.094 44.847 130 HZ3 TRP 6 HZ3 TRP 6 -43.042 6.276 43.456 131 HH2 TRP 6 HH2 TRP 6 -44.787 7.696 44.370 132 H GLU 7 H GLU 7 -38.283 5.693 44.525 133 HA GLU 7 HA GLU 7 -36.605 6.188 42.402 134 1HB GLU 7 2HB GLU 7 -34.934 5.304 44.466 135 2HB GLU 7 1HB GLU 7 -35.508 3.749 44.020 136 1HG GLU 7 2HG GLU 7 -34.247 5.587 41.861 137 2HG GLU 7 1HG GLU 7 -33.213 4.906 43.085 138 H LYS 8 H LYS 8 -36.192 3.494 41.717 139 HA LYS 8 HA LYS 8 -38.987 2.482 41.150 140 1HB LYS 8 2HB LYS 8 -38.909 2.733 38.737 141 2HB LYS 8 1HB LYS 8 -38.838 4.221 39.627 142 1HG LYS 8 2HG LYS 8 -37.319 4.775 38.010 143 2HG LYS 8 1HG LYS 8 -36.236 4.187 39.241 144 1HD LYS 8 2HD LYS 8 -36.530 1.804 37.927 145 2HD LYS 8 1HD LYS 8 -37.183 2.806 36.657 146 1HE LYS 8 2HE LYS 8 -34.861 2.648 36.032 147 2HE LYS 8 1HE LYS 8 -34.956 4.256 36.779 148 1HZ LYS 8 1HZ LYS 8 -34.301 3.118 39.015 149 2HZ LYS 8 2HZ LYS 8 -33.104 2.928 37.930 150 3HZ LYS 8 3HZ LYS 8 -34.172 1.722 38.310 151 H ARG 9 H ARG 9 -39.285 0.281 40.563 152 HA ARG 9 HA ARG 9 -36.973 -1.478 41.211 153 1HB ARG 9 2HB ARG 9 -39.798 -1.378 42.497 154 2HB ARG 9 1HB ARG 9 -38.699 -2.706 42.738 155 1HG ARG 9 2HG ARG 9 -38.141 0.213 43.604 156 2HG ARG 9 1HG ARG 9 -38.977 -0.944 44.602 157 1HD ARG 9 2HD ARG 9 -37.129 -2.209 45.113 158 2HD ARG 9 1HD ARG 9 -36.310 -1.997 43.597 159 HE ARG 9 HE ARG 9 -36.258 0.051 45.892 160 1HH1 ARG 9 2HH1 ARG 9 -35.504 -0.411 42.502 161 2HH1 ARG 9 1HH1 ARG 9 -34.336 0.991 42.583 162 1HH2 ARG 9 1HH2 ARG 9 -34.895 1.655 45.788 163 2HH2 ARG 9 2HH2 ARG 9 -34.037 1.960 44.181 164 H MET 10 H MET 10 -37.498 -3.449 40.401 165 HA MET 10 HA MET 10 -38.970 -3.475 37.784 166 1HB MET 10 2HB MET 10 -37.952 -5.420 37.129 167 2HB MET 10 1HB MET 10 -36.723 -4.493 37.930 168 1HG MET 10 2HG MET 10 -38.112 -7.044 38.995 169 2HG MET 10 1HG MET 10 -36.455 -6.875 38.434 170 1HE MET 10 1HE MET 10 -38.984 -6.624 40.994 171 2HE MET 10 2HE MET 10 -38.640 -5.015 41.652 172 3HE MET 10 3HE MET 10 -38.085 -6.468 42.527 173 H SER 11 H SER 11 -40.544 -4.870 37.132 174 HA SER 11 HA SER 11 -42.515 -5.803 39.302 175 1HB SER 11 2HB SER 11 -44.268 -4.725 38.298 176 2HB SER 11 1HB SER 11 -42.950 -3.637 37.927 177 HG SER 11 HG SER 11 -44.280 -4.044 36.153 178 H ARG 12 H ARG 12 -44.295 -7.217 38.689 179 HA ARG 12 HA ARG 12 -44.827 -9.496 38.565 180 1HB ARG 12 2HB ARG 12 -43.642 -9.148 35.779 181 2HB ARG 12 1HB ARG 12 -44.285 -10.678 36.286 182 1HG ARG 12 2HG ARG 12 -46.124 -8.294 36.763 183 2HG ARG 12 1HG ARG 12 -45.746 -8.597 35.101 184 1HD ARG 12 2HD ARG 12 -46.625 -10.945 35.220 185 2HD ARG 12 1HD ARG 12 -46.796 -10.815 36.981 186 HE ARG 12 HE ARG 12 -48.337 -8.622 35.678 187 1HH1 ARG 12 2HH1 ARG 12 -48.740 -11.914 36.845 188 2HH1 ARG 12 1HH1 ARG 12 -50.402 -11.354 37.442 189 1HH2 ARG 12 1HH2 ARG 12 -50.028 -8.255 36.608 190 2HH2 ARG 12 2HH2 ARG 12 -51.049 -9.601 37.242 191 H SER 13 H SER 13 -41.731 -9.935 36.994 192 HA SER 13 HA SER 13 -40.238 -10.636 39.346 193 1HB SER 13 2HB SER 13 -41.156 -13.159 37.828 194 2HB SER 13 1HB SER 13 -39.708 -13.125 38.829 195 HG SER 13 HG SER 13 -42.156 -12.153 39.870 196 H SER 14 H SER 14 -38.899 -9.179 38.349 197 HA SER 14 HA SER 14 -37.463 -8.144 36.779 198 1HB SER 14 2HB SER 14 -35.977 -10.024 37.376 199 2HB SER 14 1HB SER 14 -36.643 -11.001 36.062 200 HG SER 14 HG SER 14 -35.960 -9.352 34.600 201 H GLY 15 H GLY 15 -39.950 -7.951 35.978 202 1HA GLY 15 2HA GLY 15 -40.055 -8.578 32.972 203 2HA GLY 15 1HA GLY 15 -41.432 -8.371 34.023 204 H ARG 16 H ARG 16 -41.808 -6.098 34.843 205 HA ARG 16 HA ARG 16 -40.685 -3.919 32.997 206 1HB ARG 16 2HB ARG 16 -43.669 -4.390 33.623 207 2HB ARG 16 1HB ARG 16 -43.043 -2.811 33.223 208 1HG ARG 16 2HG ARG 16 -43.789 -3.511 31.151 209 2HG ARG 16 1HG ARG 16 -42.053 -3.707 31.060 210 1HD ARG 16 2HD ARG 16 -42.510 -6.292 31.642 211 2HD ARG 16 1HD ARG 16 -44.182 -5.919 31.494 212 HE ARG 16 HE ARG 16 -43.909 -5.671 29.051 213 1HH1 ARG 16 2HH1 ARG 16 -40.750 -6.034 30.551 214 2HH1 ARG 16 1HH1 ARG 16 -39.987 -6.383 28.936 215 1HH2 ARG 16 1HH2 ARG 16 -42.971 -6.074 27.275 216 2HH2 ARG 16 2HH2 ARG 16 -41.179 -6.393 27.198 217 H VAL 17 H VAL 17 -42.441 -2.123 34.825 218 HA VAL 17 HA VAL 17 -40.582 -2.058 37.222 219 HB VAL 17 HB VAL 17 -39.277 -1.011 35.547 220 1HG1 VAL 17 1HG1 VAL 17 -39.898 1.053 34.270 221 2HG1 VAL 17 2HG1 VAL 17 -41.560 0.970 34.931 222 3HG1 VAL 17 3HG1 VAL 17 -40.953 -0.306 33.853 223 1HG2 VAL 17 1HG2 VAL 17 -39.182 0.105 37.815 224 2HG2 VAL 17 2HG2 VAL 17 -40.422 1.263 37.301 225 3HG2 VAL 17 3HG2 VAL 17 -38.839 1.251 36.498 226 H TYR 18 H TYR 18 -41.423 -1.366 39.005 227 HA TYR 18 HA TYR 18 -43.837 0.486 39.001 228 1HB TYR 18 2HB TYR 18 -44.736 -0.401 40.917 229 2HB TYR 18 1HB TYR 18 -44.352 -1.790 39.994 230 HD1 TYR 18 HD1 TYR 18 -42.529 -3.358 40.780 231 HD2 TYR 18 HD2 TYR 18 -43.627 0.099 43.078 232 HE1 TYR 18 HE1 TYR 18 -41.405 -4.309 42.756 233 HE2 TYR 18 HE2 TYR 18 -42.539 -0.882 45.065 234 HH TYR 18 HH TYR 18 -41.784 -2.929 45.917 235 H TYR 19 H TYR 19 -43.734 1.942 40.972 236 HA TYR 19 HA TYR 19 -40.911 3.028 41.382 237 1HB TYR 19 2HB TYR 19 -41.162 4.448 39.725 238 2HB TYR 19 1HB TYR 19 -42.789 3.963 39.449 239 HD1 TYR 19 HD1 TYR 19 -44.752 4.914 40.349 240 HD2 TYR 19 HD2 TYR 19 -40.883 6.769 40.664 241 HE1 TYR 19 HE1 TYR 19 -45.799 7.117 40.633 242 HE2 TYR 19 HE2 TYR 19 -41.974 8.873 41.260 243 HH TYR 19 HH TYR 19 -45.570 8.972 41.627 244 H PHE 20 H PHE 20 -40.412 3.783 43.325 245 HA PHE 20 HA PHE 20 -42.612 3.648 45.459 246 1HB PHE 20 2HB PHE 20 -41.655 1.430 45.304 247 2HB PHE 20 1HB PHE 20 -40.020 2.039 45.295 248 HD1 PHE 20 HD1 PHE 20 -42.938 2.721 47.688 249 HD2 PHE 20 HD2 PHE 20 -38.931 1.307 47.214 250 HE1 PHE 20 HE1 PHE 20 -42.827 2.506 49.935 251 HE2 PHE 20 HE2 PHE 20 -38.675 1.084 49.459 252 HZ PHE 20 HZ PHE 20 -40.658 1.558 51.239 253 H ASN 21 H ASN 21 -42.642 5.308 46.733 254 HA ASN 21 HA ASN 21 -40.274 7.089 47.203 255 1HB ASN 21 2HB ASN 21 -42.873 7.699 47.090 256 2HB ASN 21 1HB ASN 21 -42.868 7.252 48.775 257 1HD2 ASN 21 1HD2 ASN 21 -40.042 8.557 48.840 258 2HD2 ASN 21 2HD2 ASN 21 -40.524 10.328 48.930 259 H HIS 22 H HIS 22 -38.677 6.068 48.294 260 HA HIS 22 HA HIS 22 -38.950 4.079 50.469 261 1HB HIS 22 2HB HIS 22 -36.646 5.764 49.289 262 2HB HIS 22 1HB HIS 22 -36.383 4.940 50.786 263 HD1 HIS 22 HD1 HIS 22 -35.963 2.392 50.824 264 HD2 HIS 22 HD2 HIS 22 -37.007 4.059 47.025 265 HE1 HIS 22 HE1 HIS 22 -35.441 0.702 48.951 266 H ILE 23 H ILE 23 -39.021 7.517 50.664 267 HA ILE 23 HA ILE 23 -38.442 7.518 53.678 268 HB ILE 23 HB ILE 23 -38.825 9.968 51.889 269 1HG1 ILE 23 2HG1 ILE 23 -36.826 8.964 51.030 270 2HG1 ILE 23 1HG1 ILE 23 -36.375 10.371 51.956 271 1HG2 ILE 23 1HG2 ILE 23 -37.757 11.260 53.759 272 2HG2 ILE 23 2HG2 ILE 23 -37.691 9.784 54.753 273 3HG2 ILE 23 3HG2 ILE 23 -39.255 10.477 54.284 274 1HD1 ILE 23 1HD1 ILE 23 -35.628 8.818 53.873 275 2HD1 ILE 23 2HD1 ILE 23 -34.774 8.486 52.346 276 3HD1 ILE 23 3HD1 ILE 23 -36.088 7.416 52.876 277 H THR 24 H THR 24 -41.004 8.781 51.475 278 HA THR 24 HA THR 24 -42.930 9.152 53.685 279 HB THR 24 HB THR 24 -43.384 9.149 50.646 280 HG1 THR 24 HG1 THR 24 -43.289 11.407 50.984 281 1HG2 THR 24 1HG2 THR 24 -45.142 10.380 52.858 282 2HG2 THR 24 2HG2 THR 24 -45.584 9.008 51.811 283 3HG2 THR 24 3HG2 THR 24 -45.356 10.614 51.099 284 H ASN 25 H ASN 25 -43.032 6.730 51.052 285 HA ASN 25 HA ASN 25 -43.889 4.439 52.012 286 1HB ASN 25 2HB ASN 25 -46.340 4.162 52.384 287 2HB ASN 25 1HB ASN 25 -45.537 5.060 53.622 288 1HD2 ASN 25 1HD2 ASN 25 -46.387 7.065 54.086 289 2HD2 ASN 25 2HD2 ASN 25 -47.809 7.778 53.154 290 H ALA 26 H ALA 26 -45.216 6.673 49.665 291 HA ALA 26 HA ALA 26 -46.943 4.928 48.353 292 1HB ALA 26 1HB ALA 26 -45.580 7.443 47.201 293 2HB ALA 26 2HB ALA 26 -47.017 7.399 48.265 294 3HB ALA 26 3HB ALA 26 -47.098 6.725 46.628 295 H SER 27 H SER 27 -46.092 2.916 47.781 296 HA SER 27 HA SER 27 -44.501 2.706 45.191 297 1HB SER 27 2HB SER 27 -44.801 0.304 45.357 298 2HB SER 27 1HB SER 27 -44.144 0.970 46.822 299 HG SER 27 HG SER 27 -46.949 0.539 46.477 300 H GLN 28 H GLN 28 -45.328 3.078 43.486 301 HA GLN 28 HA GLN 28 -48.019 2.076 42.501 302 1HB GLN 28 2HB GLN 28 -48.944 4.188 41.862 303 2HB GLN 28 1HB GLN 28 -48.627 4.187 43.574 304 1HG GLN 28 2HG GLN 28 -46.496 5.575 43.163 305 2HG GLN 28 1HG GLN 28 -46.868 5.496 41.446 306 1HE2 GLN 28 1HE2 GLN 28 -48.271 6.968 40.651 307 2HE2 GLN 28 2HE2 GLN 28 -49.342 7.987 41.677 308 H TRP 29 H TRP 29 -47.794 3.633 39.954 309 HA TRP 29 HA TRP 29 -45.159 2.495 38.773 310 1HB TRP 29 2HB TRP 29 -48.063 2.220 37.746 311 2HB TRP 29 1HB TRP 29 -46.716 1.982 36.697 312 HD1 TRP 29 HD1 TRP 29 -48.050 0.397 39.944 313 HE1 TRP 29 HE1 TRP 29 -48.318 -2.062 39.420 314 HE3 TRP 29 HE3 TRP 29 -45.780 0.258 35.405 315 HZ2 TRP 29 HZ2 TRP 29 -47.233 -3.953 37.668 316 HZ3 TRP 29 HZ3 TRP 29 -45.615 -1.920 34.243 317 HH2 TRP 29 HH2 TRP 29 -46.353 -4.003 35.356 318 H GLU 30 H GLU 30 -47.282 5.177 38.769 319 HA GLU 30 HA GLU 30 -46.872 5.844 36.067 320 1HB GLU 30 2HB GLU 30 -48.382 7.377 38.314 321 2HB GLU 30 1HB GLU 30 -48.726 7.572 36.625 322 1HG GLU 30 2HG GLU 30 -50.428 6.379 37.622 323 2HG GLU 30 1HG GLU 30 -49.688 5.226 36.508 324 H ARG 31 H ARG 31 -45.437 7.281 38.442 325 HA ARG 31 HA ARG 31 -43.817 8.978 38.693 326 1HB ARG 31 2HB ARG 31 -43.668 8.439 36.174 327 2HB ARG 31 1HB ARG 31 -44.303 10.053 35.900 328 1HG ARG 31 2HG ARG 31 -42.293 11.038 36.986 329 2HG ARG 31 1HG ARG 31 -41.819 9.477 37.663 330 1HD ARG 31 2HD ARG 31 -40.415 9.664 35.848 331 2HD ARG 31 1HD ARG 31 -41.616 8.516 35.302 332 HE ARG 31 HE ARG 31 -42.475 11.277 34.536 333 1HH1 ARG 31 2HH1 ARG 31 -40.279 8.799 33.514 334 2HH1 ARG 31 1HH1 ARG 31 -40.373 9.353 31.769 335 1HH2 ARG 31 1HH2 ARG 31 -42.574 11.855 32.573 336 2HH2 ARG 31 2HH2 ARG 31 -41.606 11.001 31.292 337 HA PRO 32 HA PRO 32 -46.187 12.189 40.549 338 1HB PRO 32 2HB PRO 32 -43.770 13.888 41.146 339 2HB PRO 32 1HB PRO 32 -44.609 12.874 42.309 340 1HG PRO 32 2HG PRO 32 -42.124 12.231 41.508 341 2HG PRO 32 1HG PRO 32 -43.291 11.052 42.003 342 1HD PRO 32 2HD PRO 32 -42.524 11.784 39.118 343 2HD PRO 32 1HD PRO 32 -42.707 10.237 39.824 344 H SER 33 H SER 33 -43.791 13.095 38.467 345 HA SER 33 HA SER 33 -45.316 14.129 36.439 346 1HB SER 33 2HB SER 33 -45.534 16.328 37.543 347 2HB SER 33 1HB SER 33 -43.784 16.538 37.628 348 HG SER 33 HG SER 33 -44.909 17.548 35.795 349 H GLY 34 H GLY 34 -41.987 15.128 37.300 350 1HA GLY 34 2HA GLY 34 -39.889 14.807 36.081 351 2HA GLY 34 1HA GLY 34 -40.423 13.147 35.947 352 H ASN 35 H ASN 35 -41.955 15.845 34.278 353 HA ASN 35 HA ASN 35 -41.464 14.413 31.636 354 1HB ASN 35 2HB ASN 35 -43.541 16.520 32.480 355 2HB ASN 35 1HB ASN 35 -43.472 15.752 30.911 356 1HD2 ASN 35 1HD2 ASN 35 -45.499 15.658 33.159 357 2HD2 ASN 35 2HD2 ASN 35 -45.806 13.849 33.276 358 H SER 36 H SER 36 -39.210 15.331 31.692 359 HA SER 36 HA SER 36 -38.938 18.175 30.692 360 1HB SER 36 2HB SER 36 -36.554 17.831 30.967 361 2HB SER 36 1HB SER 36 -37.399 17.298 32.416 362 HG SER 36 HG SER 36 -36.584 15.584 30.271 363 H SER 37 H SER 37 -40.177 17.790 28.739 364 HA SER 37 HA SER 37 -39.044 16.177 26.526 365 1HB SER 37 2HB SER 37 -41.501 16.554 26.958 366 2HB SER 37 1HB SER 37 -41.330 18.244 26.476 367 HG SER 37 HG SER 37 -41.700 17.463 24.550 368 H SER 38 H SER 38 -39.415 19.686 26.696 369 HA SER 38 HA SER 38 -38.481 21.489 25.491 370 1HB SER 38 2HB SER 38 -36.451 21.550 24.269 371 2HB SER 38 1HB SER 38 -36.185 20.732 25.809 372 HG SER 38 HG SER 38 -36.717 18.751 24.343 373 H GLY 39 H GLY 39 -40.609 21.120 24.835 374 1HA GLY 39 2HA GLY 39 -42.062 21.135 22.584 375 2HA GLY 39 1HA GLY 39 -41.163 19.640 22.278 Start of MODEL 5 1 1H GLU 1 1H GLU 1 -52.779 -14.849 36.996 2 2H GLU 1 2H GLU 1 -53.600 -14.924 38.426 3 3H GLU 1 3H GLU 1 -54.007 -15.917 37.122 4 HA GLU 1 HA GLU 1 -52.639 -17.364 38.458 5 1HB GLU 1 2HB GLU 1 -50.941 -17.892 36.982 6 2HB GLU 1 1HB GLU 1 -52.248 -17.283 36.029 7 1HG GLU 1 2HG GLU 1 -49.442 -16.175 36.363 8 2HG GLU 1 1HG GLU 1 -50.383 -16.387 34.923 9 H GLN 2 H GLN 2 -50.336 -15.248 37.976 10 HA GLN 2 HA GLN 2 -49.159 -15.445 40.753 11 1HB GLN 2 2HB GLN 2 -48.122 -14.030 38.221 12 2HB GLN 2 1HB GLN 2 -47.222 -14.102 39.713 13 1HG GLN 2 2HG GLN 2 -47.041 -16.572 39.621 14 2HG GLN 2 1HG GLN 2 -48.047 -16.643 38.178 15 1HE2 GLN 2 1HE2 GLN 2 -45.581 -17.767 38.171 16 2HE2 GLN 2 2HE2 GLN 2 -44.510 -16.777 37.046 17 HA PRO 3 HA PRO 3 -50.453 -11.019 41.786 18 1HB PRO 3 2HB PRO 3 -50.218 -11.110 44.494 19 2HB PRO 3 1HB PRO 3 -51.500 -11.984 43.638 20 1HG PRO 3 2HG PRO 3 -48.826 -13.106 44.653 21 2HG PRO 3 1HG PRO 3 -50.450 -13.772 44.950 22 1HD PRO 3 2HD PRO 3 -48.770 -14.686 42.913 23 2HD PRO 3 1HD PRO 3 -50.555 -14.728 42.747 24 H LEU 4 H LEU 4 -48.420 -10.723 40.462 25 HA LEU 4 HA LEU 4 -46.074 -9.613 42.140 26 1HB LEU 4 2HB LEU 4 -46.126 -10.974 39.385 27 2HB LEU 4 1HB LEU 4 -44.701 -10.253 40.079 28 HG LEU 4 HG LEU 4 -46.188 -12.615 41.364 29 1HD1 LEU 4 1HD1 LEU 4 -43.532 -12.603 39.767 30 2HD1 LEU 4 2HD1 LEU 4 -45.090 -13.211 39.166 31 3HD1 LEU 4 3HD1 LEU 4 -44.301 -14.012 40.533 32 1HD2 LEU 4 1HD2 LEU 4 -44.925 -11.330 43.091 33 2HD2 LEU 4 2HD2 LEU 4 -43.458 -11.326 42.083 34 3HD2 LEU 4 3HD2 LEU 4 -44.083 -12.848 42.767 35 1HN TPO 5 1HN THR 5 -48.416 -8.097 40.661 36 HA TPO 5 HA THR 5 -46.644 -5.845 39.532 37 HB TPO 5 HB THR 5 -48.942 -5.122 38.457 38 1HG2 TPO 5 1HG2 THR 5 -50.202 -6.916 37.371 39 2HG2 TPO 5 2HG2 THR 5 -50.434 -6.912 39.153 40 3HG2 TPO 5 3HG2 THR 5 -49.382 -8.133 38.376 41 HA PRO 6 HA PRO 6 -48.842 -4.267 43.344 42 1HB PRO 6 2HB PRO 6 -46.782 -3.254 44.791 43 2HB PRO 6 1HB PRO 6 -46.983 -4.997 44.512 44 1HG PRO 6 2HG PRO 6 -45.184 -3.055 42.967 45 2HG PRO 6 1HG PRO 6 -44.695 -4.599 43.701 46 1HD PRO 6 2HD PRO 6 -45.376 -4.361 41.003 47 2HD PRO 6 1HD PRO 6 -45.689 -5.856 41.929 48 H VAL 7 H VAL 7 -50.178 -2.725 42.549 49 HA VAL 7 HA VAL 7 -49.138 0.149 42.320 50 HB VAL 7 HB VAL 7 -50.267 -0.902 40.340 51 1HG1 VAL 7 1HG1 VAL 7 -52.950 -0.640 41.854 52 2HG1 VAL 7 2HG1 VAL 7 -52.162 -2.153 41.420 53 3HG1 VAL 7 3HG1 VAL 7 -52.719 -1.061 40.147 54 1HG2 VAL 7 1HG2 VAL 7 -50.048 1.570 40.502 55 2HG2 VAL 7 2HG2 VAL 7 -51.625 1.691 41.309 56 3HG2 VAL 7 3HG2 VAL 7 -51.512 1.095 39.644 57 H THR 8 H THR 8 -52.109 0.793 42.943 58 HA THR 8 HA THR 8 -52.023 0.578 45.980 59 HB THR 8 HB THR 8 -51.021 2.700 45.798 60 HG1 THR 8 HG1 THR 8 -53.798 2.969 46.264 61 1HG2 THR 8 1HG2 THR 8 -51.621 3.543 43.516 62 2HG2 THR 8 2HG2 THR 8 -52.052 4.732 44.760 63 3HG2 THR 8 3HG2 THR 8 -53.322 3.738 44.004 64 H ASP 9 H ASP 9 -53.502 -1.089 45.319 65 HA ASP 9 HA ASP 9 -56.014 -0.510 44.044 66 1HB ASP 9 2HB ASP 9 -55.076 -3.032 45.537 67 2HB ASP 9 1HB ASP 9 -56.410 -2.940 44.409 68 H LEU 10 H LEU 10 -57.222 1.023 45.253 69 HA LEU 10 HA LEU 10 -58.997 -0.119 47.363 70 1HB LEU 10 2HB LEU 10 -56.795 0.893 48.482 71 2HB LEU 10 1HB LEU 10 -57.440 2.448 48.039 72 HG LEU 10 HG LEU 10 -57.790 1.923 50.393 73 1HD1 LEU 10 1HD1 LEU 10 -60.544 1.867 49.014 74 2HD1 LEU 10 2HD1 LEU 10 -59.566 3.318 49.260 75 3HD1 LEU 10 3HD1 LEU 10 -60.200 2.429 50.672 76 1HD2 LEU 10 1HD2 LEU 10 -59.553 -0.471 49.574 77 2HD2 LEU 10 2HD2 LEU 10 -59.203 0.067 51.235 78 3HD2 LEU 10 3HD2 LEU 10 -57.902 -0.598 50.214 79 1H LYS 1 1H LYS 1 -33.807 15.518 38.056 80 2H LYS 1 2H LYS 1 -32.242 15.060 37.805 81 3H LYS 1 3H LYS 1 -32.840 15.228 39.334 82 HA LYS 1 HA LYS 1 -33.776 13.130 37.393 83 1HB LYS 1 2HB LYS 1 -31.382 12.813 38.262 84 2HB LYS 1 1HB LYS 1 -31.987 12.918 39.906 85 1HG LYS 1 2HG LYS 1 -33.543 10.788 39.127 86 2HG LYS 1 1HG LYS 1 -32.367 10.671 37.847 87 1HD LYS 1 2HD LYS 1 -31.473 9.225 39.462 88 2HD LYS 1 1HD LYS 1 -30.513 10.653 39.704 89 1HE LYS 1 2HE LYS 1 -31.044 9.901 41.914 90 2HE LYS 1 1HE LYS 1 -32.123 11.284 41.719 91 1HZ LYS 1 1HZ LYS 1 -33.232 9.027 42.528 92 2HZ LYS 1 2HZ LYS 1 -33.063 8.437 41.026 93 3HZ LYS 1 3HZ LYS 1 -34.002 9.710 41.260 94 H LEU 2 H LEU 2 -36.049 13.332 37.795 95 HA LEU 2 HA LEU 2 -38.059 13.594 39.011 96 1HB LEU 2 2HB LEU 2 -38.664 11.397 39.843 97 2HB LEU 2 1HB LEU 2 -37.594 11.256 38.485 98 HG LEU 2 HG LEU 2 -35.873 11.226 40.821 99 1HD1 LEU 2 1HD1 LEU 2 -37.773 11.088 42.246 100 2HD1 LEU 2 2HD1 LEU 2 -36.904 9.555 42.314 101 3HD1 LEU 2 3HD1 LEU 2 -38.436 9.690 41.391 102 1HD2 LEU 2 1HD2 LEU 2 -35.659 8.733 40.253 103 2HD2 LEU 2 2HD2 LEU 2 -35.646 9.678 38.749 104 3HD2 LEU 2 3HD2 LEU 2 -37.112 8.815 39.259 105 HA PRO 3 HA PRO 3 -38.129 15.209 43.125 106 1HB PRO 3 2HB PRO 3 -40.458 13.834 44.324 107 2HB PRO 3 1HB PRO 3 -40.351 15.388 43.630 108 1HG PRO 3 2HG PRO 3 -41.746 13.378 42.386 109 2HG PRO 3 1HG PRO 3 -41.076 14.798 41.545 110 1HD PRO 3 2HD PRO 3 -39.896 11.997 41.753 111 2HD PRO 3 1HD PRO 3 -39.984 13.105 40.343 112 HA PRO 4 HA PRO 4 -35.756 13.234 46.256 113 1HB PRO 4 2HB PRO 4 -36.135 14.741 48.540 114 2HB PRO 4 1HB PRO 4 -35.380 15.367 47.063 115 1HG PRO 4 2HG PRO 4 -38.314 15.662 47.921 116 2HG PRO 4 1HG PRO 4 -37.204 16.958 47.410 117 1HD PRO 4 2HD PRO 4 -38.994 15.787 45.667 118 2HD PRO 4 1HD PRO 4 -37.386 16.315 45.086 119 H GLY 5 H GLY 5 -35.778 11.470 47.415 120 1HA GLY 5 2HA GLY 5 -36.590 9.782 49.085 121 2HA GLY 5 1HA GLY 5 -38.139 10.572 49.147 122 H TRP 6 H TRP 6 -37.860 10.230 45.758 123 HA TRP 6 HA TRP 6 -39.328 7.714 45.761 124 1HB TRP 6 2HB TRP 6 -38.446 10.116 44.004 125 2HB TRP 6 1HB TRP 6 -39.137 8.765 43.280 126 HD1 TRP 6 HD1 TRP 6 -39.936 11.904 44.779 127 HE1 TRP 6 HE1 TRP 6 -42.579 12.418 44.829 128 HE3 TRP 6 HE3 TRP 6 -41.249 7.405 43.189 129 HZ2 TRP 6 HZ2 TRP 6 -44.690 10.971 43.686 130 HZ3 TRP 6 HZ3 TRP 6 -43.662 6.970 42.599 131 HH2 TRP 6 HH2 TRP 6 -45.324 8.753 42.786 132 H GLU 7 H GLU 7 -38.931 6.147 44.036 133 HA GLU 7 HA GLU 7 -37.315 6.790 42.014 134 1HB GLU 7 2HB GLU 7 -35.610 5.175 43.881 135 2HB GLU 7 1HB GLU 7 -35.776 4.381 42.319 136 1HG GLU 7 2HG GLU 7 -34.860 7.281 42.596 137 2HG GLU 7 1HG GLU 7 -33.759 5.917 42.619 138 H LYS 8 H LYS 8 -37.261 5.119 40.408 139 HA LYS 8 HA LYS 8 -39.698 3.357 40.361 140 1HB LYS 8 2HB LYS 8 -39.233 2.672 38.090 141 2HB LYS 8 1HB LYS 8 -39.460 4.365 38.361 142 1HG LYS 8 2HG LYS 8 -37.783 4.345 36.738 143 2HG LYS 8 1HG LYS 8 -36.949 4.740 38.216 144 1HD LYS 8 2HD LYS 8 -36.594 1.954 38.248 145 2HD LYS 8 1HD LYS 8 -36.915 2.155 36.554 146 1HE LYS 8 2HE LYS 8 -34.495 2.234 36.818 147 2HE LYS 8 1HE LYS 8 -34.990 3.887 36.423 148 1HZ LYS 8 1HZ LYS 8 -34.632 2.941 39.304 149 2HZ LYS 8 2HZ LYS 8 -34.930 4.451 38.903 150 3HZ LYS 8 3HZ LYS 8 -33.489 3.845 38.516 151 H ARG 9 H ARG 9 -39.891 1.213 40.554 152 HA ARG 9 HA ARG 9 -37.526 -0.410 41.625 153 1HB ARG 9 2HB ARG 9 -40.527 -0.553 42.311 154 2HB ARG 9 1HB ARG 9 -39.331 -1.647 42.960 155 1HG ARG 9 2HG ARG 9 -39.450 1.379 43.512 156 2HG ARG 9 1HG ARG 9 -40.255 0.186 44.495 157 1HD ARG 9 2HD ARG 9 -38.287 -0.712 45.448 158 2HD ARG 9 1HD ARG 9 -37.242 -0.235 44.129 159 HE ARG 9 HE ARG 9 -38.261 1.614 46.346 160 1HH1 ARG 9 2HH1 ARG 9 -36.727 1.532 43.217 161 2HH1 ARG 9 1HH1 ARG 9 -36.030 3.186 43.463 162 1HH2 ARG 9 1HH2 ARG 9 -37.365 3.467 46.594 163 2HH2 ARG 9 2HH2 ARG 9 -36.467 4.244 45.206 164 H MET 10 H MET 10 -39.325 -2.785 41.356 165 HA MET 10 HA MET 10 -39.443 -3.131 38.384 166 1HB MET 10 2HB MET 10 -37.925 -4.730 38.020 167 2HB MET 10 1HB MET 10 -37.073 -3.599 39.019 168 1HG MET 10 2HG MET 10 -38.155 -6.370 39.888 169 2HG MET 10 1HG MET 10 -36.492 -5.957 39.535 170 1HE MET 10 1HE MET 10 -38.680 -5.670 43.400 171 2HE MET 10 2HE MET 10 -39.296 -6.113 41.783 172 3HE MET 10 3HE MET 10 -39.339 -4.419 42.314 173 H SER 11 H SER 11 -40.496 -4.839 37.589 174 HA SER 11 HA SER 11 -42.592 -6.149 39.452 175 1HB SER 11 2HB SER 11 -43.323 -4.234 37.774 176 2HB SER 11 1HB SER 11 -43.281 -5.498 36.544 177 HG SER 11 HG SER 11 -44.903 -6.621 37.688 178 H ARG 12 H ARG 12 -43.564 -8.209 38.718 179 HA ARG 12 HA ARG 12 -42.787 -10.490 39.042 180 1HB ARG 12 2HB ARG 12 -42.424 -9.800 36.100 181 2HB ARG 12 1HB ARG 12 -42.240 -11.450 36.651 182 1HG ARG 12 2HG ARG 12 -44.547 -11.609 37.466 183 2HG ARG 12 1HG ARG 12 -44.763 -9.882 37.360 184 1HD ARG 12 2HD ARG 12 -44.352 -10.142 34.755 185 2HD ARG 12 1HD ARG 12 -44.583 -11.871 34.987 186 HE ARG 12 HE ARG 12 -46.636 -9.681 35.797 187 1HH1 ARG 12 2HH1 ARG 12 -46.185 -13.000 35.697 188 2HH1 ARG 12 1HH1 ARG 12 -48.034 -13.211 35.651 189 1HH2 ARG 12 1HH2 ARG 12 -48.482 -10.061 35.938 190 2HH2 ARG 12 2HH2 ARG 12 -49.221 -11.772 35.766 191 H SER 13 H SER 13 -40.769 -9.134 40.178 192 HA SER 13 HA SER 13 -38.735 -9.668 41.222 193 1HB SER 13 2HB SER 13 -38.559 -12.283 39.646 194 2HB SER 13 1HB SER 13 -37.534 -11.795 40.992 195 HG SER 13 HG SER 13 -40.368 -12.074 41.082 196 H SER 14 H SER 14 -38.173 -10.562 37.808 197 HA SER 14 HA SER 14 -36.359 -8.157 37.516 198 1HB SER 14 2HB SER 14 -34.413 -9.355 36.692 199 2HB SER 14 1HB SER 14 -34.779 -9.939 38.311 200 HG SER 14 HG SER 14 -35.767 -11.228 35.965 201 H GLY 15 H GLY 15 -38.043 -7.444 36.174 202 1HA GLY 15 2HA GLY 15 -37.949 -8.392 33.290 203 2HA GLY 15 1HA GLY 15 -39.433 -8.810 34.123 204 H ARG 16 H ARG 16 -40.439 -6.791 35.254 205 HA ARG 16 HA ARG 16 -40.289 -4.345 33.398 206 1HB ARG 16 2HB ARG 16 -42.623 -6.173 33.840 207 2HB ARG 16 1HB ARG 16 -43.033 -4.598 34.380 208 1HG ARG 16 2HG ARG 16 -43.688 -4.818 32.052 209 2HG ARG 16 1HG ARG 16 -42.420 -3.597 32.138 210 1HD ARG 16 2HD ARG 16 -40.689 -5.283 31.448 211 2HD ARG 16 1HD ARG 16 -41.888 -6.571 31.416 212 HE ARG 16 HE ARG 16 -42.990 -4.663 29.611 213 1HH1 ARG 16 2HH1 ARG 16 -39.829 -6.100 29.808 214 2HH1 ARG 16 1HH1 ARG 16 -39.582 -5.978 28.001 215 1HH2 ARG 16 1HH2 ARG 16 -42.672 -4.531 27.582 216 2HH2 ARG 16 2HH2 ARG 16 -41.129 -5.128 26.820 217 H VAL 17 H VAL 17 -42.307 -2.911 35.013 218 HA VAL 17 HA VAL 17 -40.387 -1.861 37.136 219 HB VAL 17 HB VAL 17 -39.624 -0.927 35.130 220 1HG1 VAL 17 1HG1 VAL 17 -42.442 0.206 34.553 221 2HG1 VAL 17 2HG1 VAL 17 -41.606 -1.047 33.609 222 3HG1 VAL 17 3HG1 VAL 17 -40.962 0.606 33.629 223 1HG2 VAL 17 1HG2 VAL 17 -39.609 0.598 37.113 224 2HG2 VAL 17 2HG2 VAL 17 -41.157 1.303 36.602 225 3HG2 VAL 17 3HG2 VAL 17 -39.713 1.506 35.585 226 H TYR 18 H TYR 18 -41.305 -0.987 38.881 227 HA TYR 18 HA TYR 18 -43.906 0.541 38.414 228 1HB TYR 18 2HB TYR 18 -45.019 -0.152 40.337 229 2HB TYR 18 1HB TYR 18 -44.475 -1.593 39.588 230 HD1 TYR 18 HD1 TYR 18 -42.687 -2.973 40.652 231 HD2 TYR 18 HD2 TYR 18 -44.244 0.510 42.597 232 HE1 TYR 18 HE1 TYR 18 -41.725 -3.739 42.782 233 HE2 TYR 18 HE2 TYR 18 -43.261 -0.232 44.721 234 HH TYR 18 HH TYR 18 -41.738 -3.394 45.039 235 H TYR 19 H TYR 19 -44.234 2.034 40.540 236 HA TYR 19 HA TYR 19 -41.622 3.550 41.031 237 1HB TYR 19 2HB TYR 19 -44.250 4.612 39.961 238 2HB TYR 19 1HB TYR 19 -43.506 5.598 41.086 239 HD1 TYR 19 HD1 TYR 19 -43.224 4.379 37.652 240 HD2 TYR 19 HD2 TYR 19 -41.270 6.692 40.708 241 HE1 TYR 19 HE1 TYR 19 -41.799 5.457 35.949 242 HE2 TYR 19 HE2 TYR 19 -39.844 7.729 39.018 243 HH TYR 19 HH TYR 19 -39.144 7.585 36.898 244 H PHE 20 H PHE 20 -41.424 4.615 42.964 245 HA PHE 20 HA PHE 20 -43.421 3.986 45.164 246 1HB PHE 20 2HB PHE 20 -41.950 1.920 44.857 247 2HB PHE 20 1HB PHE 20 -40.561 2.850 45.342 248 HD1 PHE 20 HD1 PHE 20 -43.638 1.168 46.449 249 HD2 PHE 20 HD2 PHE 20 -40.506 3.741 47.781 250 HE1 PHE 20 HE1 PHE 20 -44.335 0.785 48.576 251 HE2 PHE 20 HE2 PHE 20 -41.089 3.446 49.958 252 HZ PHE 20 HZ PHE 20 -43.115 1.843 50.753 253 H ASN 21 H ASN 21 -43.585 5.561 46.512 254 HA ASN 21 HA ASN 21 -41.401 7.690 46.861 255 1HB ASN 21 2HB ASN 21 -43.978 8.159 46.330 256 2HB ASN 21 1HB ASN 21 -44.264 7.733 47.985 257 1HD2 ASN 21 1HD2 ASN 21 -41.619 9.233 48.642 258 2HD2 ASN 21 2HD2 ASN 21 -42.165 10.991 48.493 259 H HIS 22 H HIS 22 -40.034 7.385 48.679 260 HA HIS 22 HA HIS 22 -40.889 5.602 50.951 261 1HB HIS 22 2HB HIS 22 -38.265 7.123 50.407 262 2HB HIS 22 1HB HIS 22 -38.559 6.252 51.884 263 HD1 HIS 22 HD1 HIS 22 -38.646 3.574 51.852 264 HD2 HIS 22 HD2 HIS 22 -37.965 5.540 48.121 265 HE1 HIS 22 HE1 HIS 22 -37.884 1.859 50.089 266 H ILE 23 H ILE 23 -40.306 9.151 50.818 267 HA ILE 23 HA ILE 23 -40.856 9.580 53.660 268 HB ILE 23 HB ILE 23 -41.373 11.636 51.456 269 1HG1 ILE 23 2HG1 ILE 23 -39.116 10.982 51.043 270 2HG1 ILE 23 1HG1 ILE 23 -39.090 12.548 51.790 271 1HG2 ILE 23 1HG2 ILE 23 -42.272 12.383 53.651 272 2HG2 ILE 23 2HG2 ILE 23 -40.870 13.366 53.208 273 3HG2 ILE 23 3HG2 ILE 23 -40.709 12.087 54.436 274 1HD1 ILE 23 1HD1 ILE 23 -37.250 11.115 52.693 275 2HD1 ILE 23 2HD1 ILE 23 -38.406 9.868 53.211 276 3HD1 ILE 23 3HD1 ILE 23 -38.391 11.458 54.013 277 H THR 24 H THR 24 -43.204 9.953 50.973 278 HA THR 24 HA THR 24 -45.652 9.898 52.636 279 HB THR 24 HB THR 24 -45.148 8.953 49.745 280 HG1 THR 24 HG1 THR 24 -45.750 10.983 49.166 281 1HG2 THR 24 1HG2 THR 24 -47.812 9.808 51.017 282 2HG2 THR 24 2HG2 THR 24 -47.377 8.150 50.538 283 3HG2 THR 24 3HG2 THR 24 -47.539 9.407 49.292 284 H ASN 25 H ASN 25 -43.956 7.296 50.992 285 HA ASN 25 HA ASN 25 -43.783 4.958 51.321 286 1HB ASN 25 2HB ASN 25 -43.817 5.349 53.794 287 2HB ASN 25 1HB ASN 25 -45.550 5.103 53.803 288 1HD2 ASN 25 1HD2 ASN 25 -46.280 2.940 53.278 289 2HD2 ASN 25 2HD2 ASN 25 -45.099 1.536 53.447 290 H ALA 26 H ALA 26 -44.837 5.403 49.254 291 HA ALA 26 HA ALA 26 -47.559 3.977 49.071 292 1HB ALA 26 1HB ALA 26 -48.298 5.732 47.436 293 2HB ALA 26 2HB ALA 26 -46.787 6.635 47.684 294 3HB ALA 26 3HB ALA 26 -47.946 6.431 49.027 295 H SER 27 H SER 27 -47.454 2.294 47.764 296 HA SER 27 HA SER 27 -45.502 2.090 45.465 297 1HB SER 27 2HB SER 27 -46.476 -0.173 45.090 298 2HB SER 27 1HB SER 27 -45.824 0.052 46.701 299 HG SER 27 HG SER 27 -48.585 0.026 45.912 300 H GLN 28 H GLN 28 -45.945 2.642 43.514 301 HA GLN 28 HA GLN 28 -48.685 2.468 42.304 302 1HB GLN 28 2HB GLN 28 -48.988 4.712 41.635 303 2HB GLN 28 1HB GLN 28 -48.717 4.705 43.348 304 1HG GLN 28 2HG GLN 28 -46.201 5.356 42.782 305 2HG GLN 28 1HG GLN 28 -46.755 5.674 41.153 306 1HE2 GLN 28 1HE2 GLN 28 -48.608 7.289 41.030 307 2HE2 GLN 28 2HE2 GLN 28 -48.620 8.572 42.318 308 H TRP 29 H TRP 29 -48.326 3.470 39.817 309 HA TRP 29 HA TRP 29 -45.715 2.205 38.729 310 1HB TRP 29 2HB TRP 29 -48.555 2.022 37.512 311 2HB TRP 29 1HB TRP 29 -47.063 1.684 36.653 312 HD1 TRP 29 HD1 TRP 29 -47.942 0.197 40.131 313 HE1 TRP 29 HE1 TRP 29 -47.001 -2.142 40.093 314 HE3 TRP 29 HE3 TRP 29 -46.739 -0.081 35.154 315 HZ2 TRP 29 HZ2 TRP 29 -46.541 -4.111 38.089 316 HZ3 TRP 29 HZ3 TRP 29 -46.085 -2.299 34.231 317 HH2 TRP 29 HH2 TRP 29 -46.051 -4.309 35.700 318 H GLU 30 H GLU 30 -47.075 5.115 39.207 319 HA GLU 30 HA GLU 30 -46.674 6.226 36.501 320 1HB GLU 30 2HB GLU 30 -47.851 7.630 38.973 321 2HB GLU 30 1HB GLU 30 -48.004 8.101 37.305 322 1HG GLU 30 2HG GLU 30 -50.115 7.160 37.650 323 2HG GLU 30 1HG GLU 30 -49.300 5.754 36.971 324 H ARG 31 H ARG 31 -45.590 7.996 35.976 325 HA ARG 31 HA ARG 31 -43.107 8.714 37.539 326 1HB ARG 31 2HB ARG 31 -43.115 8.182 35.061 327 2HB ARG 31 1HB ARG 31 -44.087 9.622 34.785 328 1HG ARG 31 2HG ARG 31 -42.056 10.960 35.899 329 2HG ARG 31 1HG ARG 31 -41.187 9.439 35.824 330 1HD ARG 31 2HD ARG 31 -40.548 10.628 33.808 331 2HD ARG 31 1HD ARG 31 -41.668 9.363 33.260 332 HE ARG 31 HE ARG 31 -42.998 12.003 33.979 333 1HH1 ARG 31 2HH1 ARG 31 -41.427 10.399 31.335 334 2HH1 ARG 31 1HH1 ARG 31 -42.224 11.542 30.140 335 1HH2 ARG 31 1HH2 ARG 31 -43.784 13.199 32.678 336 2HH2 ARG 31 2HH2 ARG 31 -43.478 13.102 30.879 337 HA PRO 32 HA PRO 32 -45.771 11.917 39.624 338 1HB PRO 32 2HB PRO 32 -43.444 13.329 40.759 339 2HB PRO 32 1HB PRO 32 -44.520 12.230 41.577 340 1HG PRO 32 2HG PRO 32 -41.911 11.675 40.190 341 2HG PRO 32 1HG PRO 32 -42.520 10.885 41.621 342 1HD PRO 32 2HD PRO 32 -42.527 9.533 39.340 343 2HD PRO 32 1HD PRO 32 -44.028 9.454 40.304 344 H SER 33 H SER 33 -43.188 12.833 37.616 345 HA SER 33 HA SER 33 -44.630 14.929 36.275 346 1HB SER 33 2HB SER 33 -44.229 16.405 38.191 347 2HB SER 33 1HB SER 33 -42.482 16.173 38.107 348 HG SER 33 HG SER 33 -43.469 18.099 37.015 349 H GLY 34 H GLY 34 -41.159 15.269 36.644 350 1HA GLY 34 2HA GLY 34 -39.326 14.890 35.089 351 2HA GLY 34 1HA GLY 34 -40.064 13.325 34.877 352 H ASN 35 H ASN 35 -40.905 16.608 33.677 353 HA ASN 35 HA ASN 35 -40.782 15.514 30.811 354 1HB ASN 35 2HB ASN 35 -43.137 15.515 32.126 355 2HB ASN 35 1HB ASN 35 -43.149 17.225 31.820 356 1HD2 ASN 35 1HD2 ASN 35 -43.498 17.869 29.616 357 2HD2 ASN 35 2HD2 ASN 35 -43.956 16.627 28.340 358 H SER 36 H SER 36 -39.220 16.738 29.852 359 HA SER 36 HA SER 36 -39.141 19.730 30.185 360 1HB SER 36 2HB SER 36 -37.092 19.585 28.838 361 2HB SER 36 1HB SER 36 -37.038 18.515 30.232 362 HG SER 36 HG SER 36 -36.624 17.889 27.713 363 H SER 37 H SER 37 -38.901 18.120 26.967 364 HA SER 37 HA SER 37 -40.143 18.227 25.085 365 1HB SER 37 2HB SER 37 -42.482 19.556 26.530 366 2HB SER 37 1HB SER 37 -42.426 18.801 24.927 367 HG SER 37 HG SER 37 -41.566 17.326 27.140 368 H SER 38 H SER 38 -39.538 21.170 26.621 369 HA SER 38 HA SER 38 -38.952 22.396 23.879 370 1HB SER 38 2HB SER 38 -38.916 24.617 24.749 371 2HB SER 38 1HB SER 38 -40.470 23.931 25.215 372 HG SER 38 HG SER 38 -38.185 23.839 26.917 373 H GLY 39 H GLY 39 -37.539 20.464 24.400 374 1HA GLY 39 2HA GLY 39 -34.926 20.160 24.654 375 2HA GLY 39 1HA GLY 39 -35.144 20.988 26.190 Start of MODEL 6 1 1H GLU 1 1H GLU 1 -51.141 -16.963 38.384 2 2H GLU 1 2H GLU 1 -50.825 -17.893 37.056 3 3H GLU 1 3H GLU 1 -52.393 -17.736 37.605 4 HA GLU 1 HA GLU 1 -52.016 -16.397 35.621 5 1HB GLU 1 2HB GLU 1 -53.736 -15.946 37.429 6 2HB GLU 1 1HB GLU 1 -52.599 -14.893 38.274 7 1HG GLU 1 2HG GLU 1 -54.397 -13.721 36.860 8 2HG GLU 1 1HG GLU 1 -52.766 -13.197 36.508 9 H GLN 2 H GLN 2 -51.112 -14.376 34.775 10 HA GLN 2 HA GLN 2 -48.141 -14.318 35.212 11 1HB GLN 2 2HB GLN 2 -49.116 -14.264 32.932 12 2HB GLN 2 1HB GLN 2 -49.812 -12.702 33.226 13 1HG GLN 2 2HG GLN 2 -47.272 -11.956 33.794 14 2HG GLN 2 1HG GLN 2 -46.816 -13.463 33.030 15 1HE2 GLN 2 1HE2 GLN 2 -48.394 -13.536 30.791 16 2HE2 GLN 2 2HE2 GLN 2 -48.041 -12.051 29.774 17 HA PRO 3 HA PRO 3 -48.454 -9.903 37.000 18 1HB PRO 3 2HB PRO 3 -50.807 -8.494 37.325 19 2HB PRO 3 1HB PRO 3 -49.890 -8.559 35.812 20 1HG PRO 3 2HG PRO 3 -52.291 -10.317 36.609 21 2HG PRO 3 1HG PRO 3 -52.114 -9.351 35.124 22 1HD PRO 3 2HD PRO 3 -51.514 -12.016 35.110 23 2HD PRO 3 1HD PRO 3 -50.490 -10.865 34.211 24 H LEU 4 H LEU 4 -47.990 -9.878 39.037 25 HA LEU 4 HA LEU 4 -50.062 -9.959 41.167 26 1HB LEU 4 2HB LEU 4 -47.700 -11.869 41.527 27 2HB LEU 4 1HB LEU 4 -48.757 -11.368 42.813 28 HG LEU 4 HG LEU 4 -49.717 -12.982 40.367 29 1HD1 LEU 4 1HD1 LEU 4 -49.031 -13.932 43.239 30 2HD1 LEU 4 2HD1 LEU 4 -48.093 -14.304 41.774 31 3HD1 LEU 4 3HD1 LEU 4 -49.738 -14.941 41.958 32 1HD2 LEU 4 1HD2 LEU 4 -51.130 -12.339 43.059 33 2HD2 LEU 4 2HD2 LEU 4 -51.755 -13.434 41.799 34 3HD2 LEU 4 3HD2 LEU 4 -51.584 -11.710 41.457 35 1HN TPO 5 1HN THR 5 -49.488 -7.797 40.826 36 HA TPO 5 HA THR 5 -46.929 -6.794 42.155 37 HB TPO 5 HB THR 5 -46.686 -5.162 40.220 38 1HG2 TPO 5 1HG2 THR 5 -47.531 -5.726 37.966 39 2HG2 TPO 5 2HG2 THR 5 -48.880 -5.345 39.066 40 3HG2 TPO 5 3HG2 THR 5 -48.517 -7.038 38.631 41 HA PRO 6 HA PRO 6 -49.530 -3.845 44.183 42 1HB PRO 6 2HB PRO 6 -47.902 -1.625 44.644 43 2HB PRO 6 1HB PRO 6 -47.713 -3.202 45.425 44 1HG PRO 6 2HG PRO 6 -46.238 -2.174 42.936 45 2HG PRO 6 1HG PRO 6 -45.513 -2.862 44.405 46 1HD PRO 6 2HD PRO 6 -45.899 -4.419 42.210 47 2HD PRO 6 1HD PRO 6 -46.236 -5.112 43.823 48 H VAL 7 H VAL 7 -48.855 -2.933 41.054 49 HA VAL 7 HA VAL 7 -49.544 -1.156 39.620 50 HB VAL 7 HB VAL 7 -51.061 -3.212 39.841 51 1HG1 VAL 7 1HG1 VAL 7 -53.420 -2.933 40.335 52 2HG1 VAL 7 2HG1 VAL 7 -53.245 -1.223 40.712 53 3HG1 VAL 7 3HG1 VAL 7 -52.512 -2.442 41.779 54 1HG2 VAL 7 1HG2 VAL 7 -52.576 -2.404 38.031 55 2HG2 VAL 7 2HG2 VAL 7 -50.877 -1.967 37.748 56 3HG2 VAL 7 3HG2 VAL 7 -52.039 -0.744 38.302 57 H THR 8 H THR 8 -52.222 0.358 40.011 58 HA THR 8 HA THR 8 -51.419 2.429 42.028 59 HB THR 8 HB THR 8 -49.973 3.044 40.135 60 HG1 THR 8 HG1 THR 8 -52.135 4.747 40.714 61 1HG2 THR 8 1HG2 THR 8 -51.356 2.408 38.118 62 2HG2 THR 8 2HG2 THR 8 -50.857 4.118 38.052 63 3HG2 THR 8 3HG2 THR 8 -52.526 3.681 38.509 64 H ASP 9 H ASP 9 -53.793 0.785 41.509 65 HA ASP 9 HA ASP 9 -55.994 2.863 41.441 66 1HB ASP 9 2HB ASP 9 -57.101 1.430 39.641 67 2HB ASP 9 1HB ASP 9 -55.747 2.431 39.190 68 H LEU 10 H LEU 10 -57.415 2.611 43.013 69 HA LEU 10 HA LEU 10 -58.622 0.036 43.736 70 1HB LEU 10 2HB LEU 10 -56.298 0.191 45.046 71 2HB LEU 10 1HB LEU 10 -57.062 1.435 45.996 72 HG LEU 10 HG LEU 10 -56.989 -0.717 47.142 73 1HD1 LEU 10 1HD1 LEU 10 -59.933 -0.136 46.446 74 2HD1 LEU 10 2HD1 LEU 10 -58.976 0.765 47.628 75 3HD1 LEU 10 3HD1 LEU 10 -59.334 -0.961 47.909 76 1HD2 LEU 10 1HD2 LEU 10 -57.046 -2.232 45.116 77 2HD2 LEU 10 2HD2 LEU 10 -58.785 -1.923 44.943 78 3HD2 LEU 10 3HD2 LEU 10 -58.174 -2.761 46.390 79 1H LYS 1 1H LYS 1 -34.662 14.468 35.317 80 2H LYS 1 2H LYS 1 -33.042 14.235 35.572 81 3H LYS 1 3H LYS 1 -33.882 15.405 36.395 82 HA LYS 1 HA LYS 1 -34.394 12.474 36.672 83 1HB LYS 1 2HB LYS 1 -32.179 13.462 37.683 84 2HB LYS 1 1HB LYS 1 -33.171 14.345 38.814 85 1HG LYS 1 2HG LYS 1 -33.049 11.238 38.574 86 2HG LYS 1 1HG LYS 1 -32.052 12.204 39.636 87 1HD LYS 1 2HD LYS 1 -34.178 13.083 40.801 88 2HD LYS 1 1HD LYS 1 -35.092 11.970 39.798 89 1HE LYS 1 2HE LYS 1 -33.688 10.013 40.843 90 2HE LYS 1 1HE LYS 1 -33.036 11.195 41.973 91 1HZ LYS 1 1HZ LYS 1 -35.983 10.507 41.645 92 2HZ LYS 1 2HZ LYS 1 -35.511 11.718 42.608 93 3HZ LYS 1 3HZ LYS 1 -35.111 10.153 42.946 94 H LEU 2 H LEU 2 -36.389 11.991 37.586 95 HA LEU 2 HA LEU 2 -38.505 13.901 38.131 96 1HB LEU 2 2HB LEU 2 -39.658 11.917 39.071 97 2HB LEU 2 1HB LEU 2 -38.822 11.442 37.625 98 HG LEU 2 HG LEU 2 -37.034 11.081 39.935 99 1HD1 LEU 2 1HD1 LEU 2 -38.282 9.564 41.316 100 2HD1 LEU 2 2HD1 LEU 2 -39.797 9.878 40.430 101 3HD1 LEU 2 3HD1 LEU 2 -39.020 11.193 41.331 102 1HD2 LEU 2 1HD2 LEU 2 -36.967 9.622 37.819 103 2HD2 LEU 2 2HD2 LEU 2 -38.543 8.928 38.266 104 3HD2 LEU 2 3HD2 LEU 2 -37.121 8.632 39.284 105 HA PRO 3 HA PRO 3 -38.169 15.607 42.056 106 1HB PRO 3 2HB PRO 3 -40.384 14.618 43.709 107 2HB PRO 3 1HB PRO 3 -40.331 15.977 42.647 108 1HG PRO 3 2HG PRO 3 -41.204 13.219 41.853 109 2HG PRO 3 1HG PRO 3 -41.976 14.783 41.507 110 1HD PRO 3 2HD PRO 3 -40.504 13.714 39.570 111 2HD PRO 3 1HD PRO 3 -40.168 15.413 39.948 112 HA PRO 4 HA PRO 4 -35.524 13.738 45.051 113 1HB PRO 4 2HB PRO 4 -35.382 15.608 47.051 114 2HB PRO 4 1HB PRO 4 -34.868 15.961 45.392 115 1HG PRO 4 2HG PRO 4 -37.550 16.656 46.703 116 2HG PRO 4 1HG PRO 4 -36.485 17.740 45.780 117 1HD PRO 4 2HD PRO 4 -38.687 16.412 44.681 118 2HD PRO 4 1HD PRO 4 -37.267 16.855 43.694 119 H GLY 5 H GLY 5 -35.447 12.403 46.818 120 1HA GLY 5 2HA GLY 5 -36.435 11.025 48.660 121 2HA GLY 5 1HA GLY 5 -37.930 11.905 48.513 122 H TRP 6 H TRP 6 -37.778 11.085 45.253 123 HA TRP 6 HA TRP 6 -39.171 8.550 45.617 124 1HB TRP 6 2HB TRP 6 -38.481 10.737 43.486 125 2HB TRP 6 1HB TRP 6 -39.219 9.276 43.105 126 HD1 TRP 6 HD1 TRP 6 -40.079 12.612 44.128 127 HE1 TRP 6 HE1 TRP 6 -42.702 12.992 44.181 128 HE3 TRP 6 HE3 TRP 6 -41.114 7.929 43.032 129 HZ2 TRP 6 HZ2 TRP 6 -44.859 11.215 43.577 130 HZ3 TRP 6 HZ3 TRP 6 -43.475 7.341 42.382 131 HH2 TRP 6 HH2 TRP 6 -45.308 8.943 42.715 132 H GLU 7 H GLU 7 -38.660 6.728 44.230 133 HA GLU 7 HA GLU 7 -37.078 7.118 42.093 134 1HB GLU 7 2HB GLU 7 -35.256 6.497 44.206 135 2HB GLU 7 1HB GLU 7 -35.609 4.913 43.614 136 1HG GLU 7 2HG GLU 7 -34.524 7.194 41.818 137 2HG GLU 7 1HG GLU 7 -33.485 6.086 42.693 138 H LYS 8 H LYS 8 -36.901 5.232 40.803 139 HA LYS 8 HA LYS 8 -39.350 3.452 40.995 140 1HB LYS 8 2HB LYS 8 -39.163 2.834 38.667 141 2HB LYS 8 1HB LYS 8 -39.325 4.521 39.001 142 1HG LYS 8 2HG LYS 8 -37.883 4.618 37.218 143 2HG LYS 8 1HG LYS 8 -36.816 4.835 38.577 144 1HD LYS 8 2HD LYS 8 -36.584 2.075 38.331 145 2HD LYS 8 1HD LYS 8 -37.190 2.406 36.731 146 1HE LYS 8 2HE LYS 8 -34.773 2.438 36.484 147 2HE LYS 8 1HE LYS 8 -35.229 4.154 36.430 148 1HZ LYS 8 1HZ LYS 8 -34.682 4.347 38.891 149 2HZ LYS 8 2HZ LYS 8 -33.381 3.632 38.240 150 3HZ LYS 8 3HZ LYS 8 -34.528 2.819 39.098 151 H ARG 9 H ARG 9 -39.435 1.234 41.160 152 HA ARG 9 HA ARG 9 -36.958 -0.177 42.107 153 1HB ARG 9 2HB ARG 9 -39.759 0.086 43.440 154 2HB ARG 9 1HB ARG 9 -38.625 -1.142 43.910 155 1HG ARG 9 2HG ARG 9 -38.070 1.891 44.097 156 2HG ARG 9 1HG ARG 9 -38.839 0.969 45.361 157 1HD ARG 9 2HD ARG 9 -36.914 -0.311 45.920 158 2HD ARG 9 1HD ARG 9 -36.128 -0.097 44.374 159 HE ARG 9 HE ARG 9 -36.225 1.996 46.598 160 1HH1 ARG 9 2HH1 ARG 9 -35.611 1.593 43.179 161 2HH1 ARG 9 1HH1 ARG 9 -34.529 3.019 43.100 162 1HH2 ARG 9 1HH2 ARG 9 -34.976 3.627 46.478 163 2HH2 ARG 9 2HH2 ARG 9 -34.164 4.061 44.892 164 H MET 10 H MET 10 -37.263 -2.241 41.708 165 HA MET 10 HA MET 10 -38.992 -3.184 39.415 166 1HB MET 10 2HB MET 10 -37.797 -5.140 39.237 167 2HB MET 10 1HB MET 10 -36.601 -3.911 39.527 168 1HG MET 10 2HG MET 10 -37.556 -6.089 41.516 169 2HG MET 10 1HG MET 10 -36.018 -5.995 40.679 170 1HE MET 10 1HE MET 10 -38.198 -5.095 43.430 171 2HE MET 10 2HE MET 10 -37.946 -3.342 43.484 172 3HE MET 10 3HE MET 10 -37.125 -4.387 44.669 173 H SER 11 H SER 11 -40.478 -4.877 39.559 174 HA SER 11 HA SER 11 -41.991 -5.082 42.196 175 1HB SER 11 2HB SER 11 -43.147 -4.532 40.030 176 2HB SER 11 1HB SER 11 -42.862 -6.198 39.487 177 HG SER 11 HG SER 11 -44.743 -6.428 40.599 178 H ARG 12 H ARG 12 -42.442 -8.060 40.520 179 HA ARG 12 HA ARG 12 -41.144 -9.569 42.764 180 1HB ARG 12 2HB ARG 12 -42.443 -10.536 40.170 181 2HB ARG 12 1HB ARG 12 -41.834 -11.615 41.400 182 1HG ARG 12 2HG ARG 12 -43.462 -10.753 43.097 183 2HG ARG 12 1HG ARG 12 -44.076 -9.559 41.971 184 1HD ARG 12 2HD ARG 12 -44.241 -12.629 41.510 185 2HD ARG 12 1HD ARG 12 -45.549 -11.607 42.165 186 HE ARG 12 HE ARG 12 -44.708 -10.267 39.729 187 1HH1 ARG 12 2HH1 ARG 12 -46.397 -13.175 40.396 188 2HH1 ARG 12 1HH1 ARG 12 -46.847 -13.302 38.617 189 1HH2 ARG 12 1HH2 ARG 12 -45.318 -10.428 38.008 190 2HH2 ARG 12 2HH2 ARG 12 -46.278 -11.838 37.350 191 H SER 13 H SER 13 -38.959 -8.835 42.540 192 HA SER 13 HA SER 13 -36.713 -9.413 42.279 193 1HB SER 13 2HB SER 13 -37.452 -11.776 42.457 194 2HB SER 13 1HB SER 13 -37.552 -11.897 40.701 195 HG SER 13 HG SER 13 -35.308 -11.412 40.603 196 H SER 14 H SER 14 -38.075 -9.942 39.011 197 HA SER 14 HA SER 14 -36.539 -7.648 37.905 198 1HB SER 14 2HB SER 14 -35.491 -10.464 37.196 199 2HB SER 14 1HB SER 14 -35.171 -9.049 36.198 200 HG SER 14 HG SER 14 -34.694 -8.800 38.958 201 H GLY 15 H GLY 15 -38.080 -6.833 36.629 202 1HA GLY 15 2HA GLY 15 -38.567 -7.683 34.000 203 2HA GLY 15 1HA GLY 15 -39.833 -8.573 34.818 204 H ARG 16 H ARG 16 -40.817 -6.827 36.547 205 HA ARG 16 HA ARG 16 -41.809 -4.412 34.941 206 1HB ARG 16 2HB ARG 16 -43.520 -6.492 36.443 207 2HB ARG 16 1HB ARG 16 -44.022 -4.840 36.401 208 1HG ARG 16 2HG ARG 16 -45.184 -6.041 34.654 209 2HG ARG 16 1HG ARG 16 -44.202 -4.770 33.951 210 1HD ARG 16 2HD ARG 16 -42.524 -6.378 33.137 211 2HD ARG 16 1HD ARG 16 -43.214 -7.707 34.027 212 HE ARG 16 HE ARG 16 -44.320 -6.418 31.477 213 1HH1 ARG 16 2HH1 ARG 16 -44.875 -8.848 33.919 214 2HH1 ARG 16 1HH1 ARG 16 -46.018 -9.753 32.794 215 1HH2 ARG 16 1HH2 ARG 16 -45.633 -7.509 30.290 216 2HH2 ARG 16 2HH2 ARG 16 -46.401 -9.042 30.936 217 H VAL 17 H VAL 17 -42.929 -2.821 36.611 218 HA VAL 17 HA VAL 17 -40.909 -2.248 38.803 219 HB VAL 17 HB VAL 17 -39.699 -1.643 36.873 220 1HG1 VAL 17 1HG1 VAL 17 -41.414 -1.554 35.097 221 2HG1 VAL 17 2HG1 VAL 17 -40.448 -0.074 35.055 222 3HG1 VAL 17 3HG1 VAL 17 -42.093 -0.051 35.767 223 1HG2 VAL 17 1HG2 VAL 17 -40.888 1.042 37.857 224 2HG2 VAL 17 2HG2 VAL 17 -39.341 0.837 37.010 225 3HG2 VAL 17 3HG2 VAL 17 -39.561 0.166 38.637 226 H TYR 18 H TYR 18 -41.533 -0.938 40.389 227 HA TYR 18 HA TYR 18 -44.112 0.662 40.070 228 1HB TYR 18 2HB TYR 18 -44.717 0.439 42.326 229 2HB TYR 18 1HB TYR 18 -44.530 -1.138 41.651 230 HD1 TYR 18 HD1 TYR 18 -42.719 -2.679 42.468 231 HD2 TYR 18 HD2 TYR 18 -43.272 1.218 44.185 232 HE1 TYR 18 HE1 TYR 18 -41.442 -3.368 44.452 233 HE2 TYR 18 HE2 TYR 18 -41.963 0.517 46.166 234 HH TYR 18 HH TYR 18 -40.774 -2.793 46.487 235 H TYR 19 H TYR 19 -44.092 2.709 40.897 236 HA TYR 19 HA TYR 19 -41.344 4.066 41.197 237 1HB TYR 19 2HB TYR 19 -43.977 5.212 40.231 238 2HB TYR 19 1HB TYR 19 -42.678 6.223 40.634 239 HD1 TYR 19 HD1 TYR 19 -43.503 3.477 38.175 240 HD2 TYR 19 HD2 TYR 19 -40.972 6.822 39.130 241 HE1 TYR 19 HE1 TYR 19 -42.590 3.436 35.905 242 HE2 TYR 19 HE2 TYR 19 -40.042 6.750 36.847 243 HH TYR 19 HH TYR 19 -41.345 4.542 34.422 244 H PHE 20 H PHE 20 -40.952 4.993 43.041 245 HA PHE 20 HA PHE 20 -43.038 4.770 45.307 246 1HB PHE 20 2HB PHE 20 -41.729 2.691 45.020 247 2HB PHE 20 1HB PHE 20 -40.219 3.550 45.177 248 HD1 PHE 20 HD1 PHE 20 -43.453 3.087 47.093 249 HD2 PHE 20 HD2 PHE 20 -39.216 3.474 47.326 250 HE1 PHE 20 HE1 PHE 20 -43.632 2.755 49.339 251 HE2 PHE 20 HE2 PHE 20 -39.233 3.127 49.575 252 HZ PHE 20 HZ PHE 20 -41.487 2.706 51.001 253 H ASN 21 H ASN 21 -43.159 6.400 46.625 254 HA ASN 21 HA ASN 21 -40.885 8.399 47.022 255 1HB ASN 21 2HB ASN 21 -43.473 8.977 46.795 256 2HB ASN 21 1HB ASN 21 -43.620 8.462 48.441 257 1HD2 ASN 21 1HD2 ASN 21 -41.232 9.689 49.515 258 2HD2 ASN 21 2HD2 ASN 21 -41.523 11.496 49.276 259 H HIS 22 H HIS 22 -39.461 8.144 48.727 260 HA HIS 22 HA HIS 22 -39.745 5.708 50.494 261 1HB HIS 22 2HB HIS 22 -37.470 7.646 49.790 262 2HB HIS 22 1HB HIS 22 -37.373 6.848 51.322 263 HD1 HIS 22 HD1 HIS 22 -36.857 4.283 51.451 264 HD2 HIS 22 HD2 HIS 22 -37.286 5.934 47.531 265 HE1 HIS 22 HE1 HIS 22 -35.930 2.634 49.706 266 H ILE 23 H ILE 23 -39.358 9.182 51.244 267 HA ILE 23 HA ILE 23 -39.770 8.772 54.149 268 HB ILE 23 HB ILE 23 -39.945 11.242 54.318 269 1HG1 ILE 23 2HG1 ILE 23 -40.852 11.786 52.019 270 2HG1 ILE 23 1HG1 ILE 23 -39.612 12.819 52.663 271 1HG2 ILE 23 1HG2 ILE 23 -37.548 11.718 53.940 272 2HG2 ILE 23 2HG2 ILE 23 -37.385 10.230 52.975 273 3HG2 ILE 23 3HG2 ILE 23 -37.803 10.135 54.700 274 1HD1 ILE 23 1HD1 ILE 23 -39.254 12.520 50.273 275 2HD1 ILE 23 2HD1 ILE 23 -39.118 10.758 50.425 276 3HD1 ILE 23 3HD1 ILE 23 -37.880 11.816 51.147 277 H THR 24 H THR 24 -42.104 9.773 51.652 278 HA THR 24 HA THR 24 -44.438 9.795 53.537 279 HB THR 24 HB THR 24 -44.164 9.529 50.475 280 HG1 THR 24 HG1 THR 24 -45.253 11.647 51.983 281 1HG2 THR 24 1HG2 THR 24 -46.570 10.096 50.289 282 2HG2 THR 24 2HG2 THR 24 -46.764 9.939 52.070 283 3HG2 THR 24 3HG2 THR 24 -46.337 8.525 51.084 284 H ASN 25 H ASN 25 -43.046 7.381 51.414 285 HA ASN 25 HA ASN 25 -43.160 5.017 51.307 286 1HB ASN 25 2HB ASN 25 -43.043 5.016 53.815 287 2HB ASN 25 1HB ASN 25 -44.788 4.962 53.899 288 1HD2 ASN 25 1HD2 ASN 25 -45.794 3.009 52.918 289 2HD2 ASN 25 2HD2 ASN 25 -44.795 1.456 52.990 290 H ALA 26 H ALA 26 -44.282 5.947 49.441 291 HA ALA 26 HA ALA 26 -47.116 4.768 49.163 292 1HB ALA 26 1HB ALA 26 -47.757 6.805 47.826 293 2HB ALA 26 2HB ALA 26 -46.187 7.556 48.189 294 3HB ALA 26 3HB ALA 26 -47.346 7.207 49.502 295 H SER 27 H SER 27 -47.192 3.345 47.571 296 HA SER 27 HA SER 27 -45.121 3.359 45.303 297 1HB SER 27 2HB SER 27 -46.984 1.069 46.099 298 2HB SER 27 1HB SER 27 -45.786 1.037 44.822 299 HG SER 27 HG SER 27 -45.155 1.558 47.553 300 H GLN 28 H GLN 28 -45.749 3.969 43.458 301 HA GLN 28 HA GLN 28 -48.526 3.383 42.373 302 1HB GLN 28 2HB GLN 28 -48.768 5.418 41.165 303 2HB GLN 28 1HB GLN 28 -48.554 5.835 42.829 304 1HG GLN 28 2HG GLN 28 -46.292 6.676 42.480 305 2HG GLN 28 1HG GLN 28 -46.153 5.990 40.886 306 1HE2 GLN 28 1HE2 GLN 28 -47.044 7.051 39.204 307 2HE2 GLN 28 2HE2 GLN 28 -47.975 8.603 39.259 308 H TRP 29 H TRP 29 -48.083 4.114 39.813 309 HA TRP 29 HA TRP 29 -45.689 2.511 38.748 310 1HB TRP 29 2HB TRP 29 -48.631 1.631 38.640 311 2HB TRP 29 1HB TRP 29 -47.817 1.535 37.140 312 HD1 TRP 29 HD1 TRP 29 -47.128 0.229 40.710 313 HE1 TRP 29 HE1 TRP 29 -46.851 -2.278 40.448 314 HE3 TRP 29 HE3 TRP 29 -46.997 -0.014 35.621 315 HZ2 TRP 29 HZ2 TRP 29 -45.929 -4.043 38.381 316 HZ3 TRP 29 HZ3 TRP 29 -46.581 -2.216 34.555 317 HH2 TRP 29 HH2 TRP 29 -46.140 -4.209 35.921 318 H GLU 30 H GLU 30 -46.035 5.290 38.784 319 HA GLU 30 HA GLU 30 -45.611 5.754 35.870 320 1HB GLU 30 2HB GLU 30 -48.082 6.652 37.182 321 2HB GLU 30 1HB GLU 30 -47.142 8.102 36.938 322 1HG GLU 30 2HG GLU 30 -47.940 6.076 34.803 323 2HG GLU 30 1HG GLU 30 -48.715 7.608 35.098 324 H ARG 31 H ARG 31 -44.625 7.565 35.306 325 HA ARG 31 HA ARG 31 -42.357 8.445 37.102 326 1HB ARG 31 2HB ARG 31 -41.606 7.820 35.001 327 2HB ARG 31 1HB ARG 31 -42.990 8.344 34.143 328 1HG ARG 31 2HG ARG 31 -41.568 10.765 35.087 329 2HG ARG 31 1HG ARG 31 -40.438 9.661 34.362 330 1HD ARG 31 2HD ARG 31 -41.192 11.087 32.580 331 2HD ARG 31 1HD ARG 31 -41.910 9.538 32.246 332 HE ARG 31 HE ARG 31 -43.360 12.011 33.415 333 1HH1 ARG 31 1HH2 ARG 31 -43.740 8.859 32.043 334 2HH1 ARG 31 2HH2 ARG 31 -45.507 8.882 32.495 335 1HH2 ARG 31 2HH1 ARG 31 -45.339 11.862 33.875 336 2HH2 ARG 31 1HH1 ARG 31 -46.321 10.435 33.284 337 HA PRO 32 HA PRO 32 -44.947 12.153 38.195 338 1HB PRO 32 2HB PRO 32 -42.735 13.321 39.741 339 2HB PRO 32 1HB PRO 32 -44.214 12.646 40.347 340 1HG PRO 32 2HG PRO 32 -41.596 11.437 40.481 341 2HG PRO 32 1HG PRO 32 -43.122 10.723 40.987 342 1HD PRO 32 2HD PRO 32 -41.517 9.989 38.662 343 2HD PRO 32 1HD PRO 32 -43.002 9.218 39.284 344 H SER 33 H SER 33 -41.650 12.484 37.163 345 HA SER 33 HA SER 33 -42.318 14.648 35.169 346 1HB SER 33 2HB SER 33 -41.640 16.096 37.024 347 2HB SER 33 1HB SER 33 -40.197 15.132 37.353 348 HG SER 33 HG SER 33 -40.705 16.788 35.102 349 H GLY 34 H GLY 34 -39.258 13.348 36.364 350 1HA GLY 34 2HA GLY 34 -37.613 11.840 35.154 351 2HA GLY 34 1HA GLY 34 -38.631 11.871 33.730 352 H ASN 35 H ASN 35 -38.799 13.851 32.611 353 HA ASN 35 HA ASN 35 -37.121 16.201 33.385 354 1HB ASN 35 2HB ASN 35 -36.079 14.762 31.387 355 2HB ASN 35 1HB ASN 35 -37.406 15.330 30.425 356 1HD2 ASN 35 1HD2 ASN 35 -36.995 17.212 29.372 357 2HD2 ASN 35 2HD2 ASN 35 -35.634 18.366 29.822 358 H SER 36 H SER 36 -38.234 18.136 32.899 359 HA SER 36 HA SER 36 -40.201 19.500 32.987 360 1HB SER 36 2HB SER 36 -39.349 19.272 30.617 361 2HB SER 36 1HB SER 36 -40.546 18.021 30.328 362 HG SER 36 HG SER 36 -41.208 20.111 29.685 363 H SER 37 H SER 37 -42.610 18.193 31.369 364 HA SER 37 HA SER 37 -43.955 16.730 33.730 365 1HB SER 37 2HB SER 37 -45.379 18.385 32.593 366 2HB SER 37 1HB SER 37 -45.124 17.624 31.020 367 HG SER 37 HG SER 37 -46.153 15.755 31.803 368 H SER 38 H SER 38 -43.003 16.135 30.366 369 HA SER 38 HA SER 38 -41.971 13.518 30.925 370 1HB SER 38 2HB SER 38 -43.429 11.955 29.754 371 2HB SER 38 1HB SER 38 -44.423 12.797 30.937 372 HG SER 38 HG SER 38 -44.175 13.630 28.226 373 H GLY 39 H GLY 39 -40.410 15.163 29.931 374 1HA GLY 39 2HA GLY 39 -39.522 14.422 27.248 375 2HA GLY 39 1HA GLY 39 -40.584 15.824 27.082 Start of MODEL 7 1 1H GLU 1 1H GLU 1 -53.236 -16.054 40.298 2 2H GLU 1 2H GLU 1 -54.524 -15.122 40.876 3 3H GLU 1 3H GLU 1 -53.262 -15.377 41.826 4 HA GLU 1 HA GLU 1 -53.326 -13.573 39.507 5 1HB GLU 1 2HB GLU 1 -52.516 -11.953 41.178 6 2HB GLU 1 1HB GLU 1 -54.105 -12.576 41.517 7 1HG GLU 1 2HG GLU 1 -51.546 -13.458 43.056 8 2HG GLU 1 1HG GLU 1 -52.686 -12.238 43.591 9 H GLN 2 H GLN 2 -51.875 -14.486 38.107 10 HA GLN 2 HA GLN 2 -49.124 -15.300 39.035 11 1HB GLN 2 2HB GLN 2 -50.355 -15.551 36.227 12 2HB GLN 2 1HB GLN 2 -48.784 -16.117 36.735 13 1HG GLN 2 2HG GLN 2 -49.970 -18.101 36.927 14 2HG GLN 2 1HG GLN 2 -50.041 -17.551 38.576 15 1HE2 GLN 2 1HE2 GLN 2 -51.894 -18.317 35.787 16 2HE2 GLN 2 2HE2 GLN 2 -53.518 -18.082 36.614 17 HA PRO 3 HA PRO 3 -47.783 -11.021 37.292 18 1HB PRO 3 2HB PRO 3 -49.540 -9.429 35.977 19 2HB PRO 3 1HB PRO 3 -48.521 -10.603 35.132 20 1HG PRO 3 2HG PRO 3 -51.462 -10.916 35.936 21 2HG PRO 3 1HG PRO 3 -50.731 -11.269 34.353 22 1HD PRO 3 2HD PRO 3 -51.212 -13.214 36.307 23 2HD PRO 3 1HD PRO 3 -49.889 -13.372 35.113 24 H LEU 4 H LEU 4 -47.806 -10.574 39.391 25 HA LEU 4 HA LEU 4 -50.277 -9.491 40.778 26 1HB LEU 4 2HB LEU 4 -49.729 -10.257 42.894 27 2HB LEU 4 1HB LEU 4 -49.951 -11.629 41.847 28 HG LEU 4 HG LEU 4 -47.167 -10.638 42.751 29 1HD1 LEU 4 1HD1 LEU 4 -48.947 -12.850 43.984 30 2HD1 LEU 4 2HD1 LEU 4 -48.563 -11.282 44.733 31 3HD1 LEU 4 3HD1 LEU 4 -47.275 -12.469 44.466 32 1HD2 LEU 4 1HD2 LEU 4 -47.045 -12.150 40.749 33 2HD2 LEU 4 2HD2 LEU 4 -48.075 -13.351 41.550 34 3HD2 LEU 4 3HD2 LEU 4 -46.444 -13.005 42.179 35 1HN TPO 5 1HN THR 5 -49.335 -7.885 39.397 36 HA TPO 5 HA THR 5 -46.694 -6.736 40.114 37 HB TPO 5 HB THR 5 -46.614 -5.853 37.942 38 1HG2 TPO 5 1HG2 THR 5 -49.556 -6.602 37.440 39 2HG2 TPO 5 2HG2 THR 5 -48.384 -6.125 36.192 40 3HG2 TPO 5 3HG2 THR 5 -48.872 -4.954 37.432 41 HA PRO 6 HA PRO 6 -49.365 -3.949 42.424 42 1HB PRO 6 2HB PRO 6 -47.744 -3.066 44.436 43 2HB PRO 6 1HB PRO 6 -48.232 -4.758 44.221 44 1HG PRO 6 2HG PRO 6 -45.637 -3.440 43.290 45 2HG PRO 6 1HG PRO 6 -45.789 -4.924 44.254 46 1HD PRO 6 2HD PRO 6 -45.447 -5.058 41.524 47 2HD PRO 6 1HD PRO 6 -46.511 -6.213 42.372 48 H VAL 7 H VAL 7 -50.003 -2.467 40.955 49 HA VAL 7 HA VAL 7 -48.848 0.339 41.109 50 HB VAL 7 HB VAL 7 -49.699 -0.693 38.927 51 1HG1 VAL 7 1HG1 VAL 7 -51.882 -1.722 39.738 52 2HG1 VAL 7 2HG1 VAL 7 -52.117 -0.628 38.364 53 3HG1 VAL 7 3HG1 VAL 7 -52.540 -0.107 40.003 54 1HG2 VAL 7 1HG2 VAL 7 -49.336 1.804 39.169 55 2HG2 VAL 7 2HG2 VAL 7 -51.066 1.992 39.542 56 3HG2 VAL 7 3HG2 VAL 7 -50.553 1.358 37.979 57 H THR 8 H THR 8 -50.792 2.037 41.402 58 HA THR 8 HA THR 8 -52.160 1.440 44.098 59 HB THR 8 HB THR 8 -52.463 3.857 44.422 60 HG1 THR 8 HG1 THR 8 -52.235 4.351 42.168 61 1HG2 THR 8 1HG2 THR 8 -50.161 4.521 45.038 62 2HG2 THR 8 2HG2 THR 8 -49.483 3.198 44.067 63 3HG2 THR 8 3HG2 THR 8 -50.451 2.822 45.510 64 H ASP 9 H ASP 9 -53.877 0.284 43.004 65 HA ASP 9 HA ASP 9 -55.701 1.646 41.163 66 1HB ASP 9 2HB ASP 9 -56.059 -0.927 42.815 67 2HB ASP 9 1HB ASP 9 -57.128 -0.390 41.538 68 H LEU 10 H LEU 10 -56.399 3.613 42.089 69 HA LEU 10 HA LEU 10 -58.634 3.548 44.045 70 1HB LEU 10 2HB LEU 10 -57.579 5.011 45.750 71 2HB LEU 10 1HB LEU 10 -56.951 3.387 45.659 72 HG LEU 10 HG LEU 10 -54.917 4.335 44.337 73 1HD1 LEU 10 1HD1 LEU 10 -54.369 6.770 44.772 74 2HD1 LEU 10 2HD1 LEU 10 -56.006 7.010 45.456 75 3HD1 LEU 10 3HD1 LEU 10 -55.802 6.584 43.749 76 1HD2 LEU 10 1HD2 LEU 10 -54.788 3.584 46.719 77 2HD2 LEU 10 2HD2 LEU 10 -55.332 5.185 47.284 78 3HD2 LEU 10 3HD2 LEU 10 -53.757 5.007 46.463 79 1H LYS 1 1H LYS 1 -35.537 17.264 37.054 80 2H LYS 1 2H LYS 1 -36.976 16.828 36.395 81 3H LYS 1 3H LYS 1 -35.592 16.488 35.572 82 HA LYS 1 HA LYS 1 -36.217 14.433 36.425 83 1HB LYS 1 2HB LYS 1 -33.808 15.057 36.816 84 2HB LYS 1 1HB LYS 1 -34.172 15.596 38.440 85 1HG LYS 1 2HG LYS 1 -34.773 12.688 37.534 86 2HG LYS 1 1HG LYS 1 -33.147 13.164 37.944 87 1HD LYS 1 2HD LYS 1 -33.638 13.633 40.253 88 2HD LYS 1 1HD LYS 1 -35.355 13.731 39.984 89 1HE LYS 1 2HE LYS 1 -35.306 11.158 39.355 90 2HE LYS 1 1HE LYS 1 -33.644 11.138 39.916 91 1HZ LYS 1 1HZ LYS 1 -35.346 10.590 41.753 92 2HZ LYS 1 2HZ LYS 1 -35.963 12.105 41.657 93 3HZ LYS 1 3HZ LYS 1 -34.435 11.870 42.177 94 H LEU 2 H LEU 2 -37.446 13.179 37.824 95 HA LEU 2 HA LEU 2 -39.570 14.487 39.210 96 1HB LEU 2 2HB LEU 2 -40.397 12.220 39.628 97 2HB LEU 2 1HB LEU 2 -39.600 12.204 38.088 98 HG LEU 2 HG LEU 2 -37.537 11.592 40.002 99 1HD1 LEU 2 1HD1 LEU 2 -39.210 11.421 41.780 100 2HD1 LEU 2 2HD1 LEU 2 -38.404 9.882 41.452 101 3HD1 LEU 2 3HD1 LEU 2 -40.087 10.165 40.911 102 1HD2 LEU 2 1HD2 LEU 2 -37.877 10.360 37.757 103 2HD2 LEU 2 2HD2 LEU 2 -39.308 9.546 38.444 104 3HD2 LEU 2 3HD2 LEU 2 -37.694 9.213 39.103 105 HA PRO 3 HA PRO 3 -38.638 15.444 43.218 106 1HB PRO 3 2HB PRO 3 -40.820 14.096 44.790 107 2HB PRO 3 1HB PRO 3 -40.736 15.707 44.220 108 1HG PRO 3 2HG PRO 3 -41.925 13.366 42.789 109 2HG PRO 3 1HG PRO 3 -42.500 15.045 42.829 110 1HD PRO 3 2HD PRO 3 -41.231 14.171 40.639 111 2HD PRO 3 1HD PRO 3 -40.756 15.762 41.277 112 HA PRO 4 HA PRO 4 -36.107 12.921 45.890 113 1HB PRO 4 2HB PRO 4 -35.786 14.478 48.120 114 2HB PRO 4 1HB PRO 4 -35.265 15.020 46.515 115 1HG PRO 4 2HG PRO 4 -37.842 15.757 47.994 116 2HG PRO 4 1HG PRO 4 -36.716 16.855 47.162 117 1HD PRO 4 2HD PRO 4 -39.076 15.803 46.032 118 2HD PRO 4 1HD PRO 4 -37.701 16.353 45.039 119 H GLY 5 H GLY 5 -36.087 11.438 47.498 120 1HA GLY 5 2HA GLY 5 -37.249 9.904 49.197 121 2HA GLY 5 1HA GLY 5 -38.779 10.647 48.809 122 H TRP 6 H TRP 6 -38.371 10.474 45.656 123 HA TRP 6 HA TRP 6 -39.351 7.779 45.386 124 1HB TRP 6 2HB TRP 6 -38.694 10.329 43.726 125 2HB TRP 6 1HB TRP 6 -39.363 8.929 43.082 126 HD1 TRP 6 HD1 TRP 6 -40.454 12.061 44.668 127 HE1 TRP 6 HE1 TRP 6 -43.024 12.302 44.624 128 HE3 TRP 6 HE3 TRP 6 -41.271 7.435 42.825 129 HZ2 TRP 6 HZ2 TRP 6 -45.095 10.464 43.875 130 HZ3 TRP 6 HZ3 TRP 6 -43.629 6.728 42.467 131 HH2 TRP 6 HH2 TRP 6 -45.513 8.131 43.106 132 H GLU 7 H GLU 7 -38.483 6.300 43.919 133 HA GLU 7 HA GLU 7 -37.187 7.411 41.743 134 1HB GLU 7 2HB GLU 7 -35.070 6.877 43.434 135 2HB GLU 7 1HB GLU 7 -35.335 5.271 42.908 136 1HG GLU 7 2HG GLU 7 -34.840 7.489 40.812 137 2HG GLU 7 1HG GLU 7 -33.502 6.943 41.801 138 H LYS 8 H LYS 8 -36.078 4.584 41.059 139 HA LYS 8 HA LYS 8 -38.679 3.084 40.716 140 1HB LYS 8 2HB LYS 8 -38.453 2.668 38.318 141 2HB LYS 8 1HB LYS 8 -38.652 4.342 38.745 142 1HG LYS 8 2HG LYS 8 -37.108 4.591 37.055 143 2HG LYS 8 1HG LYS 8 -36.087 4.637 38.461 144 1HD LYS 8 2HD LYS 8 -35.828 1.950 37.977 145 2HD LYS 8 1HD LYS 8 -36.483 2.361 36.417 146 1HE LYS 8 2HE LYS 8 -34.058 2.376 36.138 147 2HE LYS 8 1HE LYS 8 -34.538 4.089 36.095 148 1HZ LYS 8 1HZ LYS 8 -33.866 4.375 38.440 149 2HZ LYS 8 2HZ LYS 8 -32.639 3.468 37.879 150 3HZ LYS 8 3HZ LYS 8 -33.883 2.854 38.790 151 H ARG 9 H ARG 9 -38.670 0.888 40.736 152 HA ARG 9 HA ARG 9 -36.058 -0.445 41.577 153 1HB ARG 9 2HB ARG 9 -38.796 -0.763 42.946 154 2HB ARG 9 1HB ARG 9 -37.346 -1.596 43.424 155 1HG ARG 9 2HG ARG 9 -37.710 1.463 43.633 156 2HG ARG 9 1HG ARG 9 -38.239 0.384 44.888 157 1HD ARG 9 2HD ARG 9 -36.041 -0.288 45.539 158 2HD ARG 9 1HD ARG 9 -35.303 0.153 44.017 159 HE ARG 9 HE ARG 9 -36.141 2.134 46.215 160 1HH1 ARG 9 1HH2 ARG 9 -35.034 1.845 42.885 161 2HH1 ARG 9 2HH2 ARG 9 -34.374 3.511 42.862 162 1HH2 ARG 9 2HH1 ARG 9 -35.329 4.011 46.177 163 2HH2 ARG 9 1HH1 ARG 9 -34.546 4.673 44.654 164 H MET 10 H MET 10 -37.568 -2.892 41.930 165 HA MET 10 HA MET 10 -38.301 -3.640 39.070 166 1HB MET 10 2HB MET 10 -37.993 -5.942 39.521 167 2HB MET 10 1HB MET 10 -36.530 -5.056 39.853 168 1HG MET 10 2HG MET 10 -36.724 -6.791 41.527 169 2HG MET 10 1HG MET 10 -37.012 -5.280 42.384 170 1HE MET 10 1HE MET 10 -38.875 -5.881 44.419 171 2HE MET 10 2HE MET 10 -40.495 -5.565 43.707 172 3HE MET 10 3HE MET 10 -39.131 -4.508 43.299 173 H SER 11 H SER 11 -40.290 -4.811 38.780 174 HA SER 11 HA SER 11 -42.513 -3.905 40.507 175 1HB SER 11 2HB SER 11 -42.665 -4.023 38.023 176 2HB SER 11 1HB SER 11 -42.702 -5.782 38.111 177 HG SER 11 HG SER 11 -44.567 -3.851 39.061 178 H ARG 12 H ARG 12 -43.277 -7.336 39.855 179 HA ARG 12 HA ARG 12 -42.572 -8.201 42.494 180 1HB ARG 12 2HB ARG 12 -44.573 -8.646 41.163 181 2HB ARG 12 1HB ARG 12 -43.668 -9.329 39.838 182 1HG ARG 12 2HG ARG 12 -43.544 -10.747 42.521 183 2HG ARG 12 1HG ARG 12 -45.004 -10.697 41.543 184 1HD ARG 12 2HD ARG 12 -42.330 -11.599 40.230 185 2HD ARG 12 1HD ARG 12 -43.245 -12.708 41.220 186 HE ARG 12 HE ARG 12 -45.335 -12.043 39.675 187 1HH1 ARG 12 1HH2 ARG 12 -42.789 -10.606 38.463 188 2HH1 ARG 12 2HH2 ARG 12 -43.767 -10.508 36.943 189 1HH2 ARG 12 2HH1 ARG 12 -45.999 -12.606 37.921 190 2HH2 ARG 12 1HH1 ARG 12 -45.315 -11.454 36.688 191 H SER 13 H SER 13 -40.732 -8.525 39.535 192 HA SER 13 HA SER 13 -38.498 -9.737 40.953 193 1HB SER 13 2HB SER 13 -39.801 -11.855 40.402 194 2HB SER 13 1HB SER 13 -39.625 -11.501 38.669 195 HG SER 13 HG SER 13 -37.971 -12.913 39.589 196 H SER 14 H SER 14 -36.629 -10.125 39.322 197 HA SER 14 HA SER 14 -36.043 -7.473 38.135 198 1HB SER 14 2HB SER 14 -33.816 -8.364 37.732 199 2HB SER 14 1HB SER 14 -34.340 -8.817 39.348 200 HG SER 14 HG SER 14 -34.669 -10.513 37.069 201 H GLY 15 H GLY 15 -37.518 -7.233 36.550 202 1HA GLY 15 2HA GLY 15 -36.964 -7.972 33.709 203 2HA GLY 15 1HA GLY 15 -38.157 -9.057 34.410 204 H ARG 16 H ARG 16 -39.580 -7.186 35.987 205 HA ARG 16 HA ARG 16 -40.338 -4.888 34.124 206 1HB ARG 16 2HB ARG 16 -42.316 -6.642 35.736 207 2HB ARG 16 1HB ARG 16 -42.681 -4.989 35.373 208 1HG ARG 16 2HG ARG 16 -43.732 -6.005 33.580 209 2HG ARG 16 1HG ARG 16 -42.235 -5.475 32.847 210 1HD ARG 16 2HD ARG 16 -41.304 -7.934 33.328 211 2HD ARG 16 1HD ARG 16 -42.901 -8.325 33.856 212 HE ARG 16 HE ARG 16 -43.710 -8.216 31.531 213 1HH1 ARG 16 1HH2 ARG 16 -40.395 -7.078 31.674 214 2HH1 ARG 16 2HH2 ARG 16 -40.220 -7.239 29.867 215 1HH2 ARG 16 2HH1 ARG 16 -43.437 -8.373 29.506 216 2HH2 ARG 16 1HH1 ARG 16 -41.856 -7.926 28.720 217 H VAL 17 H VAL 17 -41.439 -3.139 35.391 218 HA VAL 17 HA VAL 17 -39.622 -2.360 37.738 219 HB VAL 17 HB VAL 17 -38.733 -1.460 35.720 220 1HG1 VAL 17 1HG1 VAL 17 -39.948 0.138 34.161 221 2HG1 VAL 17 2HG1 VAL 17 -41.471 -0.184 35.048 222 3HG1 VAL 17 3HG1 VAL 17 -40.666 -1.478 34.138 223 1HG2 VAL 17 1HG2 VAL 17 -38.653 0.169 37.629 224 2HG2 VAL 17 2HG2 VAL 17 -40.171 0.901 37.087 225 3HG2 VAL 17 3HG2 VAL 17 -38.713 0.998 36.069 226 H TYR 18 H TYR 18 -40.531 -1.217 39.406 227 HA TYR 18 HA TYR 18 -43.052 0.352 38.752 228 1HB TYR 18 2HB TYR 18 -44.013 0.220 40.932 229 2HB TYR 18 1HB TYR 18 -43.918 -1.325 40.165 230 HD1 TYR 18 HD1 TYR 18 -43.965 -2.872 41.900 231 HD2 TYR 18 HD2 TYR 18 -41.366 0.510 42.408 232 HE1 TYR 18 HE1 TYR 18 -43.138 -3.811 44.003 233 HE2 TYR 18 HE2 TYR 18 -40.576 -0.422 44.521 234 HH TYR 18 HH TYR 18 -40.953 -1.986 46.108 235 H TYR 19 H TYR 19 -43.300 2.258 40.175 236 HA TYR 19 HA TYR 19 -40.617 3.596 40.696 237 1HB TYR 19 2HB TYR 19 -40.873 4.952 39.022 238 2HB TYR 19 1HB TYR 19 -42.433 4.303 38.659 239 HD1 TYR 19 HD1 TYR 19 -44.521 5.158 39.313 240 HD2 TYR 19 HD2 TYR 19 -40.834 7.275 40.033 241 HE1 TYR 19 HE1 TYR 19 -45.713 7.303 39.415 242 HE2 TYR 19 HE2 TYR 19 -42.135 9.316 40.460 243 HH TYR 19 HH TYR 19 -45.727 9.142 40.471 244 H PHE 20 H PHE 20 -40.342 4.430 42.602 245 HA PHE 20 HA PHE 20 -42.556 3.679 44.619 246 1HB PHE 20 2HB PHE 20 -40.833 1.888 44.110 247 2HB PHE 20 1HB PHE 20 -39.561 2.938 44.669 248 HD1 PHE 20 HD1 PHE 20 -42.709 1.216 45.753 249 HD2 PHE 20 HD2 PHE 20 -39.135 3.125 47.071 250 HE1 PHE 20 HE1 PHE 20 -43.155 0.422 47.838 251 HE2 PHE 20 HE2 PHE 20 -39.455 2.410 49.211 252 HZ PHE 20 HZ PHE 20 -41.467 0.754 49.932 253 H ASN 21 H ASN 21 -43.023 5.320 45.905 254 HA ASN 21 HA ASN 21 -41.021 7.393 46.811 255 1HB ASN 21 2HB ASN 21 -43.859 7.370 46.784 256 2HB ASN 21 1HB ASN 21 -43.563 7.034 48.432 257 1HD2 ASN 21 1HD2 ASN 21 -41.539 8.798 49.180 258 2HD2 ASN 21 2HD2 ASN 21 -42.084 10.477 48.653 259 H HIS 22 H HIS 22 -39.570 6.974 48.434 260 HA HIS 22 HA HIS 22 -40.047 4.855 50.567 261 1HB HIS 22 2HB HIS 22 -37.730 6.858 50.050 262 2HB HIS 22 1HB HIS 22 -37.844 5.870 51.478 263 HD1 HIS 22 HD1 HIS 22 -37.202 3.265 51.303 264 HD2 HIS 22 HD2 HIS 22 -37.182 5.513 47.666 265 HE1 HIS 22 HE1 HIS 22 -36.053 1.909 49.446 266 H ILE 23 H ILE 23 -39.533 6.175 52.830 267 HA ILE 23 HA ILE 23 -40.531 7.397 54.497 268 HB ILE 23 HB ILE 23 -41.013 9.803 52.730 269 1HG1 ILE 23 2HG1 ILE 23 -38.230 8.584 53.102 270 2HG1 ILE 23 1HG1 ILE 23 -39.024 9.098 51.653 271 1HG2 ILE 23 1HG2 ILE 23 -41.376 9.878 55.245 272 2HG2 ILE 23 2HG2 ILE 23 -40.151 11.028 54.700 273 3HG2 ILE 23 3HG2 ILE 23 -39.651 9.515 55.491 274 1HD1 ILE 23 1HD1 ILE 23 -38.871 11.494 52.266 275 2HD1 ILE 23 2HD1 ILE 23 -37.294 10.672 52.103 276 3HD1 ILE 23 3HD1 ILE 23 -37.936 11.034 53.727 277 H THR 24 H THR 24 -42.638 8.008 51.713 278 HA THR 24 HA THR 24 -45.200 7.533 53.285 279 HB THR 24 HB THR 24 -44.535 7.890 50.292 280 HG1 THR 24 HG1 THR 24 -44.672 9.624 52.026 281 1HG2 THR 24 1HG2 THR 24 -46.967 8.058 49.855 282 2HG2 THR 24 2HG2 THR 24 -47.328 7.547 51.531 283 3HG2 THR 24 3HG2 THR 24 -46.537 6.420 50.399 284 H ASN 25 H ASN 25 -43.168 5.751 50.966 285 HA ASN 25 HA ASN 25 -42.788 3.432 50.626 286 1HB ASN 25 2HB ASN 25 -42.880 3.261 53.170 287 2HB ASN 25 1HB ASN 25 -44.543 2.748 53.037 288 1HD2 ASN 25 1HD2 ASN 25 -44.878 0.724 51.758 289 2HD2 ASN 25 2HD2 ASN 25 -43.516 -0.521 51.847 290 H ALA 26 H ALA 26 -43.948 4.156 48.700 291 HA ALA 26 HA ALA 26 -46.465 2.475 48.194 292 1HB ALA 26 1HB ALA 26 -47.255 4.708 48.940 293 2HB ALA 26 2HB ALA 26 -47.632 4.484 47.222 294 3HB ALA 26 3HB ALA 26 -46.270 5.525 47.695 295 H SER 27 H SER 27 -46.281 1.340 46.394 296 HA SER 27 HA SER 27 -44.583 2.260 44.012 297 1HB SER 27 2HB SER 27 -44.929 0.000 43.148 298 2HB SER 27 1HB SER 27 -44.188 -0.006 44.726 299 HG SER 27 HG SER 27 -46.819 -0.725 43.950 300 H GLN 28 H GLN 28 -45.475 3.293 42.626 301 HA GLN 28 HA GLN 28 -48.024 2.382 41.269 302 1HB GLN 28 2HB GLN 28 -48.762 4.546 40.519 303 2HB GLN 28 1HB GLN 28 -48.678 4.508 42.273 304 1HG GLN 28 2HG GLN 28 -46.337 5.712 41.948 305 2HG GLN 28 1HG GLN 28 -46.805 5.780 40.258 306 1HE2 GLN 28 1HE2 GLN 28 -48.074 7.466 39.662 307 2HE2 GLN 28 2HE2 GLN 28 -49.134 8.373 40.825 308 H TRP 29 H TRP 29 -47.729 3.406 38.842 309 HA TRP 29 HA TRP 29 -44.941 2.477 37.856 310 1HB TRP 29 2HB TRP 29 -47.740 1.788 36.779 311 2HB TRP 29 1HB TRP 29 -46.378 1.738 35.736 312 HD1 TRP 29 HD1 TRP 29 -47.329 0.069 39.100 313 HE1 TRP 29 HE1 TRP 29 -47.252 -2.423 38.617 314 HE3 TRP 29 HE3 TRP 29 -45.087 0.191 34.525 315 HZ2 TRP 29 HZ2 TRP 29 -45.768 -4.153 36.894 316 HZ3 TRP 29 HZ3 TRP 29 -44.460 -1.966 33.454 317 HH2 TRP 29 HH2 TRP 29 -44.830 -4.099 34.620 318 H GLU 30 H GLU 30 -47.234 4.968 37.738 319 HA GLU 30 HA GLU 30 -46.450 6.186 35.224 320 1HB GLU 30 2HB GLU 30 -48.270 7.207 37.511 321 2HB GLU 30 1HB GLU 30 -48.249 7.845 35.879 322 1HG GLU 30 2HG GLU 30 -50.225 6.410 36.241 323 2HG GLU 30 1HG GLU 30 -49.221 5.745 34.953 324 H ARG 31 H ARG 31 -46.743 9.014 36.477 325 HA ARG 31 HA ARG 31 -43.999 9.447 37.665 326 1HB ARG 31 2HB ARG 31 -44.349 9.190 34.857 327 2HB ARG 31 1HB ARG 31 -44.476 10.894 35.039 328 1HG ARG 31 2HG ARG 31 -42.214 10.161 34.435 329 2HG ARG 31 1HG ARG 31 -42.136 10.945 36.003 330 1HD ARG 31 2HD ARG 31 -40.657 8.989 35.878 331 2HD ARG 31 1HD ARG 31 -41.856 8.742 37.138 332 HE ARG 31 HE ARG 31 -43.194 7.371 35.404 333 1HH1 ARG 31 1HH2 ARG 31 -39.771 7.153 35.641 334 2HH1 ARG 31 2HH2 ARG 31 -39.860 5.321 35.741 335 1HH2 ARG 31 2HH1 ARG 31 -43.276 5.389 35.545 336 2HH2 ARG 31 1HH1 ARG 31 -41.773 4.382 35.637 337 HA PRO 32 HA PRO 32 -46.260 12.794 39.472 338 1HB PRO 32 2HB PRO 32 -43.732 14.211 40.337 339 2HB PRO 32 1HB PRO 32 -44.824 13.285 41.354 340 1HG PRO 32 2HG PRO 32 -42.335 12.336 40.827 341 2HG PRO 32 1HG PRO 32 -43.692 11.315 41.057 342 1HD PRO 32 2HD PRO 32 -42.566 12.161 38.276 343 2HD PRO 32 1HD PRO 32 -42.896 10.594 38.874 344 H SER 33 H SER 33 -45.571 13.148 36.749 345 HA SER 33 HA SER 33 -44.942 14.451 34.873 346 1HB SER 33 2HB SER 33 -46.323 16.377 35.569 347 2HB SER 33 1HB SER 33 -45.008 16.991 36.572 348 HG SER 33 HG SER 33 -43.720 17.194 34.708 349 H GLY 34 H GLY 34 -43.055 16.049 37.396 350 1HA GLY 34 2HA GLY 34 -40.747 15.924 37.951 351 2HA GLY 34 1HA GLY 34 -40.786 14.319 37.251 352 H ASN 35 H ASN 35 -40.851 14.796 34.582 353 HA ASN 35 HA ASN 35 -38.464 16.595 33.942 354 1HB ASN 35 2HB ASN 35 -37.854 13.995 34.523 355 2HB ASN 35 1HB ASN 35 -38.374 13.707 32.889 356 1HD2 ASN 35 1HD2 ASN 35 -37.093 14.773 31.197 357 2HD2 ASN 35 2HD2 ASN 35 -35.377 15.297 31.598 358 H SER 36 H SER 36 -40.639 17.603 33.229 359 HA SER 36 HA SER 36 -41.452 16.886 30.419 360 1HB SER 36 2HB SER 36 -43.011 18.779 30.704 361 2HB SER 36 1HB SER 36 -43.173 17.600 31.979 362 HG SER 36 HG SER 36 -43.008 20.026 32.415 363 H SER 37 H SER 37 -41.426 18.442 28.700 364 HA SER 37 HA SER 37 -39.481 20.717 28.698 365 1HB SER 37 2HB SER 37 -38.657 18.130 27.234 366 2HB SER 37 1HB SER 37 -37.996 19.712 26.830 367 HG SER 37 HG SER 37 -38.059 18.987 29.542 368 H SER 38 H SER 38 -40.963 18.563 26.265 369 HA SER 38 HA SER 38 -42.401 20.980 25.086 370 1HB SER 38 2HB SER 38 -42.030 20.376 22.795 371 2HB SER 38 1HB SER 38 -40.444 20.509 23.551 372 HG SER 38 HG SER 38 -41.837 18.030 23.393 373 H GLY 39 H GLY 39 -43.761 20.014 26.677 374 1HA GLY 39 2HA GLY 39 -45.912 18.419 26.916 375 2HA GLY 39 1HA GLY 39 -44.805 17.210 26.256 Start of MODEL 8 1 1H GLU 1 1H GLU 1 -54.086 -12.340 38.770 2 2H GLU 1 2H GLU 1 -52.878 -11.719 39.730 3 3H GLU 1 3H GLU 1 -54.484 -11.234 39.900 4 HA GLU 1 HA GLU 1 -54.042 -12.834 41.626 5 1HB GLU 1 2HB GLU 1 -55.860 -14.347 41.262 6 2HB GLU 1 1HB GLU 1 -56.281 -12.782 40.631 7 1HG GLU 1 2HG GLU 1 -55.607 -15.318 38.982 8 2HG GLU 1 1HG GLU 1 -57.138 -14.483 39.092 9 H GLN 2 H GLN 2 -53.516 -14.368 38.893 10 HA GLN 2 HA GLN 2 -51.472 -16.390 40.040 11 1HB GLN 2 2HB GLN 2 -52.608 -16.239 37.195 12 2HB GLN 2 1HB GLN 2 -51.295 -17.312 37.652 13 1HG GLN 2 2HG GLN 2 -52.740 -18.491 39.310 14 2HG GLN 2 1HG GLN 2 -54.064 -17.377 39.041 15 1HE2 GLN 2 1HE2 GLN 2 -55.055 -17.417 36.843 16 2HE2 GLN 2 2HE2 GLN 2 -54.979 -19.030 35.954 17 HA PRO 3 HA PRO 3 -48.095 -13.825 37.788 18 1HB PRO 3 2HB PRO 3 -48.686 -11.708 36.090 19 2HB PRO 3 1HB PRO 3 -48.545 -13.398 35.576 20 1HG PRO 3 2HG PRO 3 -51.124 -11.859 36.210 21 2HG PRO 3 1HG PRO 3 -50.779 -12.866 34.791 22 1HD PRO 3 2HD PRO 3 -52.187 -13.850 36.940 23 2HD PRO 3 1HD PRO 3 -51.076 -14.898 36.019 24 H LEU 4 H LEU 4 -50.513 -11.232 38.091 25 HA LEU 4 HA LEU 4 -50.863 -9.541 39.709 26 1HB LEU 4 2HB LEU 4 -51.070 -11.634 41.186 27 2HB LEU 4 1HB LEU 4 -49.420 -11.365 41.671 28 HG LEU 4 HG LEU 4 -50.074 -9.086 42.621 29 1HD1 LEU 4 1HD1 LEU 4 -52.497 -8.619 43.055 30 2HD1 LEU 4 2HD1 LEU 4 -52.984 -10.008 42.055 31 3HD1 LEU 4 3HD1 LEU 4 -52.158 -8.593 41.330 32 1HD2 LEU 4 1HD2 LEU 4 -51.598 -11.535 43.756 33 2HD2 LEU 4 2HD2 LEU 4 -51.181 -10.047 44.645 34 3HD2 LEU 4 3HD2 LEU 4 -49.895 -11.116 44.066 35 1HN TPO 5 1HN THR 5 -49.315 -8.352 38.253 36 HA TPO 5 HA THR 5 -46.801 -7.514 39.417 37 HB TPO 5 HB THR 5 -46.472 -5.989 37.684 38 1HG2 TPO 5 1HG2 THR 5 -48.134 -5.269 36.002 39 2HG2 TPO 5 2HG2 THR 5 -48.593 -4.681 37.614 40 3HG2 TPO 5 3HG2 THR 5 -49.443 -6.082 36.910 41 HA PRO 6 HA PRO 6 -48.476 -4.743 42.552 42 1HB PRO 6 2HB PRO 6 -46.199 -3.560 43.574 43 2HB PRO 6 1HB PRO 6 -46.598 -5.278 43.757 44 1HG PRO 6 2HG PRO 6 -44.807 -4.008 41.603 45 2HG PRO 6 1HG PRO 6 -44.359 -5.337 42.707 46 1HD PRO 6 2HD PRO 6 -45.246 -5.858 40.172 47 2HD PRO 6 1HD PRO 6 -45.818 -6.898 41.521 48 H VAL 7 H VAL 7 -49.756 -3.121 42.059 49 HA VAL 7 HA VAL 7 -48.797 -0.684 40.544 50 HB VAL 7 HB VAL 7 -51.638 -1.433 41.208 51 1HG1 VAL 7 1HG1 VAL 7 -51.380 1.051 40.811 52 2HG1 VAL 7 2HG1 VAL 7 -52.283 0.288 39.494 53 3HG1 VAL 7 3HG1 VAL 7 -50.571 0.732 39.256 54 1HG2 VAL 7 1HG2 VAL 7 -50.140 -1.769 38.519 55 2HG2 VAL 7 2HG2 VAL 7 -51.887 -2.043 38.786 56 3HG2 VAL 7 3HG2 VAL 7 -50.696 -3.072 39.588 57 H THR 8 H THR 8 -50.747 -0.809 43.039 58 HA THR 8 HA THR 8 -49.125 0.903 44.849 59 HB THR 8 HB THR 8 -50.127 2.725 43.423 60 HG1 THR 8 HG1 THR 8 -50.637 2.592 46.187 61 1HG2 THR 8 1HG2 THR 8 -52.497 1.883 43.133 62 2HG2 THR 8 2HG2 THR 8 -52.456 3.523 43.832 63 3HG2 THR 8 3HG2 THR 8 -52.796 2.115 44.870 64 H ASP 9 H ASP 9 -51.294 -1.344 44.880 65 HA ASP 9 HA ASP 9 -51.502 -1.438 47.856 66 1HB ASP 9 2HB ASP 9 -53.432 0.081 47.265 67 2HB ASP 9 1HB ASP 9 -54.137 -1.197 46.292 68 H LEU 10 H LEU 10 -53.211 -2.757 45.569 69 HA LEU 10 HA LEU 10 -51.456 -5.180 45.117 70 1HB LEU 10 2HB LEU 10 -52.944 -6.273 43.645 71 2HB LEU 10 1HB LEU 10 -53.664 -6.105 45.220 72 HG LEU 10 HG LEU 10 -55.315 -6.021 43.467 73 1HD1 LEU 10 1HD1 LEU 10 -55.199 -3.194 44.673 74 2HD1 LEU 10 2HD1 LEU 10 -55.759 -4.627 45.545 75 3HD1 LEU 10 3HD1 LEU 10 -56.644 -4.058 44.108 76 1HD2 LEU 10 1HD2 LEU 10 -53.905 -5.024 41.614 77 2HD2 LEU 10 2HD2 LEU 10 -54.076 -3.432 42.364 78 3HD2 LEU 10 3HD2 LEU 10 -55.519 -4.271 41.742 79 1H LYS 1 1H LYS 1 -32.675 14.102 39.377 80 2H LYS 1 2H LYS 1 -31.110 13.765 39.788 81 3H LYS 1 3H LYS 1 -32.286 13.908 40.942 82 HA LYS 1 HA LYS 1 -32.229 11.707 38.888 83 1HB LYS 1 2HB LYS 1 -30.365 11.792 40.709 84 2HB LYS 1 1HB LYS 1 -31.607 11.625 41.927 85 1HG LYS 1 2HG LYS 1 -30.884 9.573 39.718 86 2HG LYS 1 1HG LYS 1 -30.313 9.527 41.361 87 1HD LYS 1 2HD LYS 1 -33.235 9.144 40.473 88 2HD LYS 1 1HD LYS 1 -32.113 7.883 40.898 89 1HE LYS 1 2HE LYS 1 -31.998 8.594 43.287 90 2HE LYS 1 1HE LYS 1 -33.005 10.028 42.991 91 1HZ LYS 1 1HZ LYS 1 -34.854 8.545 42.260 92 2HZ LYS 1 2HZ LYS 1 -34.351 7.897 43.685 93 3HZ LYS 1 3HZ LYS 1 -33.930 7.216 42.258 94 H LEU 2 H LEU 2 -34.624 12.220 38.375 95 HA LEU 2 HA LEU 2 -36.577 13.440 39.007 96 1HB LEU 2 2HB LEU 2 -38.222 11.827 39.447 97 2HB LEU 2 1HB LEU 2 -37.025 11.104 38.450 98 HG LEU 2 HG LEU 2 -36.610 10.561 41.398 99 1HD1 LEU 2 1HD1 LEU 2 -38.930 10.745 41.657 100 2HD1 LEU 2 2HD1 LEU 2 -38.770 9.010 41.345 101 3HD1 LEU 2 3HD1 LEU 2 -39.335 10.104 40.076 102 1HD2 LEU 2 1HD2 LEU 2 -35.507 9.169 39.557 103 2HD2 LEU 2 2HD2 LEU 2 -37.111 8.663 38.982 104 3HD2 LEU 2 3HD2 LEU 2 -36.551 8.166 40.588 105 HA PRO 3 HA PRO 3 -37.269 15.370 42.979 106 1HB PRO 3 2HB PRO 3 -39.745 13.688 43.623 107 2HB PRO 3 1HB PRO 3 -39.558 15.358 43.874 108 1HG PRO 3 2HG PRO 3 -40.824 14.689 41.701 109 2HG PRO 3 1HG PRO 3 -39.455 15.802 41.425 110 1HD PRO 3 2HD PRO 3 -39.422 12.729 41.241 111 2HD PRO 3 1HD PRO 3 -38.979 13.883 39.982 112 HA PRO 4 HA PRO 4 -34.967 13.555 46.200 113 1HB PRO 4 2HB PRO 4 -35.347 15.162 48.401 114 2HB PRO 4 1HB PRO 4 -34.630 15.735 46.885 115 1HG PRO 4 2HG PRO 4 -37.542 16.020 47.797 116 2HG PRO 4 1HG PRO 4 -36.476 17.300 47.167 117 1HD PRO 4 2HD PRO 4 -38.309 15.946 45.598 118 2HD PRO 4 1HD PRO 4 -36.776 16.542 44.899 119 H GLY 5 H GLY 5 -34.985 11.831 47.385 120 1HA GLY 5 2HA GLY 5 -35.791 9.988 48.817 121 2HA GLY 5 1HA GLY 5 -37.209 10.926 49.223 122 H TRP 6 H TRP 6 -36.695 10.257 45.621 123 HA TRP 6 HA TRP 6 -38.522 7.960 45.806 124 1HB TRP 6 2HB TRP 6 -37.279 10.045 43.835 125 2HB TRP 6 1HB TRP 6 -37.901 8.603 43.241 126 HD1 TRP 6 HD1 TRP 6 -39.010 11.967 44.495 127 HE1 TRP 6 HE1 TRP 6 -41.609 12.348 44.278 128 HE3 TRP 6 HE3 TRP 6 -40.041 7.366 42.742 129 HZ2 TRP 6 HZ2 TRP 6 -43.525 10.875 42.917 130 HZ3 TRP 6 HZ3 TRP 6 -42.430 6.786 42.268 131 HH2 TRP 6 HH2 TRP 6 -44.149 8.519 42.312 132 H GLU 7 H GLU 7 -38.144 6.035 44.489 133 HA GLU 7 HA GLU 7 -36.045 6.030 42.808 134 1HB GLU 7 2HB GLU 7 -35.015 4.831 45.254 135 2HB GLU 7 1HB GLU 7 -35.323 3.463 44.244 136 1HG GLU 7 2HG GLU 7 -33.282 5.696 43.857 137 2HG GLU 7 1HG GLU 7 -33.040 3.980 43.835 138 H LYS 8 H LYS 8 -35.966 4.451 41.363 139 HA LYS 8 HA LYS 8 -38.393 2.720 40.869 140 1HB LYS 8 2HB LYS 8 -37.722 2.281 38.681 141 2HB LYS 8 1HB LYS 8 -37.466 3.973 38.991 142 1HG LYS 8 2HG LYS 8 -35.552 3.478 37.759 143 2HG LYS 8 1HG LYS 8 -34.953 3.430 39.390 144 1HD LYS 8 2HD LYS 8 -35.739 0.694 38.979 145 2HD LYS 8 1HD LYS 8 -35.392 1.186 37.357 146 1HE LYS 8 2HE LYS 8 -33.397 0.119 38.356 147 2HE LYS 8 1HE LYS 8 -33.026 1.814 38.001 148 1HZ LYS 8 1HZ LYS 8 -34.072 1.094 40.750 149 2HZ LYS 8 2HZ LYS 8 -33.317 2.415 40.385 150 3HZ LYS 8 3HZ LYS 8 -32.432 1.050 40.464 151 H ARG 9 H ARG 9 -38.670 0.533 41.063 152 HA ARG 9 HA ARG 9 -36.238 -1.170 41.765 153 1HB ARG 9 2HB ARG 9 -38.997 -1.415 43.112 154 2HB ARG 9 1HB ARG 9 -37.557 -2.378 43.422 155 1HG ARG 9 2HG ARG 9 -36.431 -0.016 44.090 156 2HG ARG 9 1HG ARG 9 -38.090 0.547 44.199 157 1HD ARG 9 2HD ARG 9 -38.491 -1.561 45.798 158 2HD ARG 9 1HD ARG 9 -36.743 -1.731 45.798 159 HE ARG 9 HE ARG 9 -36.534 0.682 46.664 160 1HH1 ARG 9 2HH1 ARG 9 -39.715 -0.705 46.957 161 2HH1 ARG 9 1HH1 ARG 9 -40.191 0.561 48.193 162 1HH2 ARG 9 1HH2 ARG 9 -37.133 2.072 48.008 163 2HH2 ARG 9 2HH2 ARG 9 -38.789 2.017 48.744 164 H MET 10 H MET 10 -37.941 -3.451 41.820 165 HA MET 10 HA MET 10 -38.542 -3.820 38.864 166 1HB MET 10 2HB MET 10 -37.766 -5.947 38.700 167 2HB MET 10 1HB MET 10 -36.497 -5.119 39.551 168 1HG MET 10 2HG MET 10 -38.522 -7.132 40.744 169 2HG MET 10 1HG MET 10 -36.822 -7.409 40.413 170 1HE MET 10 1HE MET 10 -39.447 -6.486 42.649 171 2HE MET 10 2HE MET 10 -38.997 -4.843 43.141 172 3HE MET 10 3HE MET 10 -38.629 -6.229 44.213 173 H SER 11 H SER 11 -40.321 -5.223 38.424 174 HA SER 11 HA SER 11 -42.696 -4.826 39.933 175 1HB SER 11 2HB SER 11 -43.815 -6.286 38.277 176 2HB SER 11 1HB SER 11 -42.620 -5.273 37.507 177 HG SER 11 HG SER 11 -41.298 -7.435 38.200 178 H ARG 12 H ARG 12 -43.522 -8.040 39.692 179 HA ARG 12 HA ARG 12 -42.892 -8.601 42.622 180 1HB ARG 12 2HB ARG 12 -44.127 -10.713 42.419 181 2HB ARG 12 1HB ARG 12 -45.022 -9.235 42.252 182 1HG ARG 12 2HG ARG 12 -45.939 -10.935 40.810 183 2HG ARG 12 1HG ARG 12 -45.410 -9.564 39.881 184 1HD ARG 12 2HD ARG 12 -43.294 -10.853 39.221 185 2HD ARG 12 1HD ARG 12 -43.889 -12.264 40.138 186 HE ARG 12 HE ARG 12 -46.089 -11.497 38.438 187 1HH1 ARG 12 2HH1 ARG 12 -42.804 -12.300 37.715 188 2HH1 ARG 12 1HH1 ARG 12 -43.203 -12.535 35.944 189 1HH2 ARG 12 1HH2 ARG 12 -46.332 -11.423 36.569 190 2HH2 ARG 12 2HH2 ARG 12 -45.151 -11.980 35.316 191 H SER 13 H SER 13 -40.627 -8.372 42.258 192 HA SER 13 HA SER 13 -38.459 -9.212 42.285 193 1HB SER 13 2HB SER 13 -39.438 -11.042 43.709 194 2HB SER 13 1HB SER 13 -39.544 -12.070 42.280 195 HG SER 13 HG SER 13 -37.176 -11.470 42.028 196 H SER 14 H SER 14 -40.249 -10.653 39.616 197 HA SER 14 HA SER 14 -37.763 -10.276 37.847 198 1HB SER 14 2HB SER 14 -37.769 -12.608 38.719 199 2HB SER 14 1HB SER 14 -39.373 -12.897 38.029 200 HG SER 14 HG SER 14 -37.448 -13.504 36.719 201 H GLY 15 H GLY 15 -38.431 -8.834 36.417 202 1HA GLY 15 2HA GLY 15 -39.324 -9.612 33.978 203 2HA GLY 15 1HA GLY 15 -40.915 -9.352 34.657 204 H ARG 16 H ARG 16 -40.925 -7.078 35.836 205 HA ARG 16 HA ARG 16 -39.675 -4.902 34.121 206 1HB ARG 16 2HB ARG 16 -41.870 -3.788 33.665 207 2HB ARG 16 1HB ARG 16 -41.507 -5.179 32.726 208 1HG ARG 16 2HG ARG 16 -43.308 -5.534 35.192 209 2HG ARG 16 1HG ARG 16 -43.959 -4.774 33.743 210 1HD ARG 16 2HD ARG 16 -43.175 -6.888 32.402 211 2HD ARG 16 1HD ARG 16 -42.748 -7.602 33.921 212 HE ARG 16 HE ARG 16 -45.046 -8.109 34.415 213 1HH1 ARG 16 1HH2 ARG 16 -45.055 -5.742 31.881 214 2HH1 ARG 16 2HH2 ARG 16 -46.841 -6.050 31.583 215 1HH2 ARG 16 2HH1 ARG 16 -46.837 -8.382 34.115 216 2HH2 ARG 16 1HH1 ARG 16 -47.860 -7.509 32.851 217 H VAL 17 H VAL 17 -41.856 -3.196 35.539 218 HA VAL 17 HA VAL 17 -39.961 -2.472 37.834 219 HB VAL 17 HB VAL 17 -39.391 -1.451 35.694 220 1HG1 VAL 17 1HG1 VAL 17 -41.619 -1.289 34.540 221 2HG1 VAL 17 2HG1 VAL 17 -40.810 0.288 34.556 222 3HG1 VAL 17 3HG1 VAL 17 -42.147 -0.047 35.694 223 1HG2 VAL 17 1HG2 VAL 17 -39.208 0.929 36.297 224 2HG2 VAL 17 2HG2 VAL 17 -38.894 -0.075 37.719 225 3HG2 VAL 17 3HG2 VAL 17 -40.453 0.758 37.551 226 H TYR 18 H TYR 18 -40.682 -1.331 39.590 227 HA TYR 18 HA TYR 18 -43.174 0.276 39.208 228 1HB TYR 18 2HB TYR 18 -44.101 0.076 41.364 229 2HB TYR 18 1HB TYR 18 -43.982 -1.520 40.721 230 HD1 TYR 18 HD1 TYR 18 -42.767 -3.234 41.948 231 HD2 TYR 18 HD2 TYR 18 -42.345 0.853 43.175 232 HE1 TYR 18 HE1 TYR 18 -41.678 -3.977 43.990 233 HE2 TYR 18 HE2 TYR 18 -41.215 0.110 45.227 234 HH TYR 18 HH TYR 18 -40.960 -3.339 46.013 235 H TYR 19 H TYR 19 -43.040 2.399 40.470 236 HA TYR 19 HA TYR 19 -40.274 2.873 41.614 237 1HB TYR 19 2HB TYR 19 -39.564 4.358 40.055 238 2HB TYR 19 1HB TYR 19 -40.795 3.630 39.027 239 HD1 TYR 19 HD1 TYR 19 -43.187 4.474 39.134 240 HD2 TYR 19 HD2 TYR 19 -39.604 6.807 39.758 241 HE1 TYR 19 HE1 TYR 19 -44.375 6.572 38.823 242 HE2 TYR 19 HE2 TYR 19 -40.923 8.825 39.588 243 HH TYR 19 HH TYR 19 -44.438 8.698 39.055 244 H PHE 20 H PHE 20 -40.067 4.081 43.318 245 HA PHE 20 HA PHE 20 -42.726 4.467 44.812 246 1HB PHE 20 2HB PHE 20 -41.816 2.258 45.039 247 2HB PHE 20 1HB PHE 20 -40.198 2.801 45.380 248 HD1 PHE 20 HD1 PHE 20 -43.487 2.038 46.820 249 HD2 PHE 20 HD2 PHE 20 -39.757 3.948 47.624 250 HE1 PHE 20 HE1 PHE 20 -43.990 1.905 49.030 251 HE2 PHE 20 HE2 PHE 20 -40.121 3.878 49.877 252 HZ PHE 20 HZ PHE 20 -42.318 2.735 50.988 253 H ASN 21 H ASN 21 -42.962 6.242 45.946 254 HA ASN 21 HA ASN 21 -40.646 8.076 46.590 255 1HB ASN 21 2HB ASN 21 -43.141 8.745 45.905 256 2HB ASN 21 1HB ASN 21 -43.504 8.465 47.591 257 1HD2 ASN 21 1HD2 ASN 21 -40.687 9.692 48.102 258 2HD2 ASN 21 2HD2 ASN 21 -41.051 11.475 47.895 259 H HIS 22 H HIS 22 -39.455 7.777 48.412 260 HA HIS 22 HA HIS 22 -40.214 6.037 50.726 261 1HB HIS 22 2HB HIS 22 -37.885 7.989 50.194 262 2HB HIS 22 1HB HIS 22 -38.122 7.270 51.757 263 HD1 HIS 22 HD1 HIS 22 -37.176 4.937 52.188 264 HD2 HIS 22 HD2 HIS 22 -37.399 6.056 48.069 265 HE1 HIS 22 HE1 HIS 22 -35.973 3.195 50.741 266 H ILE 23 H ILE 23 -40.214 9.605 50.360 267 HA ILE 23 HA ILE 23 -41.198 10.121 53.093 268 HB ILE 23 HB ILE 23 -41.545 11.986 50.691 269 1HG1 ILE 23 2HG1 ILE 23 -39.194 11.564 50.626 270 2HG1 ILE 23 1HG1 ILE 23 -39.437 13.155 51.281 271 1HG2 ILE 23 1HG2 ILE 23 -41.362 12.668 53.696 272 2HG2 ILE 23 2HG2 ILE 23 -42.821 12.748 52.691 273 3HG2 ILE 23 3HG2 ILE 23 -41.475 13.850 52.370 274 1HD1 ILE 23 1HD1 ILE 23 -38.708 10.638 52.952 275 2HD1 ILE 23 2HD1 ILE 23 -38.964 12.261 53.638 276 3HD1 ILE 23 3HD1 ILE 23 -37.616 11.972 52.516 277 H THR 24 H THR 24 -43.048 9.993 50.035 278 HA THR 24 HA THR 24 -45.696 10.044 51.502 279 HB THR 24 HB THR 24 -44.794 10.573 48.732 280 HG1 THR 24 HG1 THR 24 -45.937 11.926 50.165 281 1HG2 THR 24 1HG2 THR 24 -46.765 9.911 47.479 282 2HG2 THR 24 2HG2 THR 24 -47.374 8.941 48.845 283 3HG2 THR 24 3HG2 THR 24 -45.871 8.471 48.010 284 H ASN 25 H ASN 25 -43.682 7.467 50.405 285 HA ASN 25 HA ASN 25 -43.790 5.213 50.540 286 1HB ASN 25 2HB ASN 25 -44.395 4.170 52.351 287 2HB ASN 25 1HB ASN 25 -44.599 5.777 52.969 288 1HD2 ASN 25 1HD2 ASN 25 -47.136 6.460 52.435 289 2HD2 ASN 25 2HD2 ASN 25 -48.246 5.148 53.094 290 H ALA 26 H ALA 26 -45.454 6.533 48.469 291 HA ALA 26 HA ALA 26 -47.140 4.128 47.618 292 1HB ALA 26 1HB ALA 26 -48.219 6.378 47.734 293 2HB ALA 26 2HB ALA 26 -48.245 5.710 46.091 294 3HB ALA 26 3HB ALA 26 -47.092 6.998 46.495 295 H SER 27 H SER 27 -46.461 2.766 46.172 296 HA SER 27 HA SER 27 -44.428 3.297 43.955 297 1HB SER 27 2HB SER 27 -44.932 0.999 43.286 298 2HB SER 27 1HB SER 27 -44.508 1.046 44.984 299 HG SER 27 HG SER 27 -47.112 0.771 43.816 300 H GLN 28 H GLN 28 -44.968 3.778 41.957 301 HA GLN 28 HA GLN 28 -47.579 2.825 40.843 302 1HB GLN 28 2HB GLN 28 -48.374 4.778 39.739 303 2HB GLN 28 1HB GLN 28 -48.248 5.123 41.455 304 1HG GLN 28 2HG GLN 28 -46.132 6.448 41.017 305 2HG GLN 28 1HG GLN 28 -46.171 5.913 39.369 306 1HE2 GLN 28 1HE2 GLN 28 -47.125 7.051 38.009 307 2HE2 GLN 28 2HE2 GLN 28 -48.433 8.235 38.123 308 H TRP 29 H TRP 29 -47.392 3.696 38.271 309 HA TRP 29 HA TRP 29 -44.764 2.419 37.276 310 1HB TRP 29 2HB TRP 29 -47.543 2.432 35.926 311 2HB TRP 29 1HB TRP 29 -46.066 1.791 35.252 312 HD1 TRP 29 HD1 TRP 29 -47.978 0.967 38.528 313 HE1 TRP 29 HE1 TRP 29 -47.136 -1.356 39.179 314 HE3 TRP 29 HE3 TRP 29 -45.032 -0.188 34.507 315 HZ2 TRP 29 HZ2 TRP 29 -46.351 -3.679 37.832 316 HZ3 TRP 29 HZ3 TRP 29 -44.247 -2.529 34.256 317 HH2 TRP 29 HH2 TRP 29 -44.940 -4.265 35.904 318 H GLU 30 H GLU 30 -46.073 5.548 37.394 319 HA GLU 30 HA GLU 30 -44.076 6.350 35.341 320 1HB GLU 30 2HB GLU 30 -46.179 6.217 34.001 321 2HB GLU 30 1HB GLU 30 -47.084 7.107 35.187 322 1HG GLU 30 2HG GLU 30 -46.767 8.519 33.294 323 2HG GLU 30 1HG GLU 30 -45.962 9.242 34.630 324 H ARG 31 H ARG 31 -43.322 8.124 35.455 325 HA ARG 31 HA ARG 31 -42.176 9.552 37.573 326 1HB ARG 31 2HB ARG 31 -41.669 9.075 35.257 327 2HB ARG 31 1HB ARG 31 -42.976 10.192 34.751 328 1HG ARG 31 2HG ARG 31 -41.696 12.096 35.326 329 2HG ARG 31 1HG ARG 31 -40.504 11.131 36.287 330 1HD ARG 31 2HD ARG 31 -39.562 11.683 33.969 331 2HD ARG 31 1HD ARG 31 -39.817 9.950 34.260 332 HE ARG 31 HE ARG 31 -41.991 10.051 32.984 333 1HH1 ARG 31 2HH1 ARG 31 -40.299 13.017 32.587 334 2HH1 ARG 31 1HH1 ARG 31 -41.687 13.666 31.584 335 1HH2 ARG 31 1HH2 ARG 31 -43.428 10.731 31.817 336 2HH2 ARG 31 2HH2 ARG 31 -43.260 12.414 31.098 337 HA PRO 32 HA PRO 32 -45.229 12.123 39.514 338 1HB PRO 32 2HB PRO 32 -43.558 14.091 40.786 339 2HB PRO 32 1HB PRO 32 -43.691 12.466 41.420 340 1HG PRO 32 2HG PRO 32 -41.498 13.483 39.811 341 2HG PRO 32 1HG PRO 32 -41.516 12.320 41.146 342 1HD PRO 32 2HD PRO 32 -41.244 11.478 38.535 343 2HD PRO 32 1HD PRO 32 -42.083 10.556 39.813 344 H SER 33 H SER 33 -43.098 13.564 37.368 345 HA SER 33 HA SER 33 -44.889 14.861 35.798 346 1HB SER 33 2HB SER 33 -44.718 17.364 35.987 347 2HB SER 33 1HB SER 33 -45.542 16.622 37.342 348 HG SER 33 HG SER 33 -43.620 16.758 38.546 349 H GLY 34 H GLY 34 -42.182 17.003 36.182 350 1HA GLY 34 2HA GLY 34 -40.329 17.466 34.652 351 2HA GLY 34 1HA GLY 34 -40.128 15.736 34.529 352 H ASN 35 H ASN 35 -42.670 17.958 33.343 353 HA ASN 35 HA ASN 35 -42.176 16.957 30.458 354 1HB ASN 35 2HB ASN 35 -44.902 17.313 31.851 355 2HB ASN 35 1HB ASN 35 -44.672 16.921 30.163 356 1HD2 ASN 35 1HD2 ASN 35 -45.820 15.451 32.606 357 2HD2 ASN 35 2HD2 ASN 35 -45.089 13.781 32.395 358 H SER 36 H SER 36 -41.275 18.739 29.588 359 HA SER 36 HA SER 36 -42.958 21.266 29.289 360 1HB SER 36 2HB SER 36 -41.545 21.673 31.299 361 2HB SER 36 1HB SER 36 -40.073 21.241 30.417 362 HG SER 36 HG SER 36 -41.860 23.435 29.809 363 H SER 37 H SER 37 -42.605 22.373 27.415 364 HA SER 37 HA SER 37 -40.186 21.811 25.634 365 1HB SER 37 2HB SER 37 -43.021 21.270 24.724 366 2HB SER 37 1HB SER 37 -41.639 21.352 23.619 367 HG SER 37 HG SER 37 -41.399 19.678 25.859 368 H SER 38 H SER 38 -40.416 23.809 26.680 369 HA SER 38 HA SER 38 -39.806 26.183 26.348 370 1HB SER 38 2HB SER 38 -40.499 27.641 24.613 371 2HB SER 38 1HB SER 38 -39.832 26.173 23.898 372 HG SER 38 HG SER 38 -42.157 25.458 23.858 373 H GLY 39 H GLY 39 -43.131 25.173 26.115 374 1HA GLY 39 2HA GLY 39 -43.607 26.468 28.844 375 2HA GLY 39 1HA GLY 39 -44.932 25.879 27.838 Start of MODEL 9 1 1H GLU 1 1H GLU 1 -52.181 -19.704 38.830 2 2H GLU 1 2H GLU 1 -52.985 -18.480 39.564 3 3H GLU 1 3H GLU 1 -51.793 -19.294 40.416 4 HA GLU 1 HA GLU 1 -50.058 -18.495 38.988 5 1HB GLU 1 2HB GLU 1 -52.443 -17.594 37.265 6 2HB GLU 1 1HB GLU 1 -50.845 -16.945 37.012 7 1HG GLU 1 2HG GLU 1 -51.460 -18.938 35.491 8 2HG GLU 1 1HG GLU 1 -49.902 -19.044 36.278 9 H GLN 2 H GLN 2 -49.080 -17.029 40.218 10 HA GLN 2 HA GLN 2 -50.770 -15.036 41.768 11 1HB GLN 2 2HB GLN 2 -48.078 -16.355 42.428 12 2HB GLN 2 1HB GLN 2 -48.893 -15.171 43.410 13 1HG GLN 2 2HG GLN 2 -49.498 -17.167 44.477 14 2HG GLN 2 1HG GLN 2 -50.937 -16.741 43.594 15 1HE2 GLN 2 1HE2 GLN 2 -48.144 -18.920 43.574 16 2HE2 GLN 2 2HE2 GLN 2 -49.027 -20.213 42.605 17 HA PRO 3 HA PRO 3 -48.035 -11.793 39.730 18 1HB PRO 3 2HB PRO 3 -49.831 -9.732 39.602 19 2HB PRO 3 1HB PRO 3 -49.969 -11.140 38.540 20 1HG PRO 3 2HG PRO 3 -51.485 -10.637 41.161 21 2HG PRO 3 1HG PRO 3 -52.180 -11.080 39.584 22 1HD PRO 3 2HD PRO 3 -51.600 -12.938 41.587 23 2HD PRO 3 1HD PRO 3 -51.536 -13.373 39.849 24 H LEU 4 H LEU 4 -47.151 -9.750 40.460 25 HA LEU 4 HA LEU 4 -47.778 -8.754 43.198 26 1HB LEU 4 2HB LEU 4 -46.068 -10.656 43.522 27 2HB LEU 4 1HB LEU 4 -44.883 -9.660 42.719 28 HG LEU 4 HG LEU 4 -46.401 -8.895 45.305 29 1HD1 LEU 4 1HD1 LEU 4 -44.278 -9.510 46.497 30 2HD1 LEU 4 2HD1 LEU 4 -43.536 -10.026 44.962 31 3HD1 LEU 4 3HD1 LEU 4 -44.933 -10.906 45.627 32 1HD2 LEU 4 1HD2 LEU 4 -44.519 -7.198 45.635 33 2HD2 LEU 4 2HD2 LEU 4 -45.518 -6.825 44.227 34 3HD2 LEU 4 3HD2 LEU 4 -43.920 -7.567 43.996 35 1HN TPO 5 1HN THR 5 -48.561 -7.334 41.501 36 HA TPO 5 HA THR 5 -46.487 -5.247 40.641 37 HB TPO 5 HB THR 5 -47.862 -4.783 38.633 38 1HG2 TPO 5 1HG2 THR 5 -49.960 -6.039 38.973 39 2HG2 TPO 5 2HG2 THR 5 -49.052 -7.579 38.942 40 3HG2 TPO 5 3HG2 THR 5 -49.104 -6.549 37.496 41 HA PRO 6 HA PRO 6 -49.704 -2.615 42.797 42 1HB PRO 6 2HB PRO 6 -48.016 -0.807 43.972 43 2HB PRO 6 1HB PRO 6 -48.270 -2.441 44.613 44 1HG PRO 6 2HG PRO 6 -45.964 -1.485 42.826 45 2HG PRO 6 1HG PRO 6 -45.824 -2.385 44.351 46 1HD PRO 6 2HD PRO 6 -45.738 -3.597 41.862 47 2HD PRO 6 1HD PRO 6 -46.445 -4.453 43.265 48 H VAL 7 H VAL 7 -50.598 -1.976 40.879 49 HA VAL 7 HA VAL 7 -49.104 -0.327 38.859 50 HB VAL 7 HB VAL 7 -50.999 -0.800 37.351 51 1HG1 VAL 7 1HG1 VAL 7 -49.000 -2.225 37.264 52 2HG1 VAL 7 2HG1 VAL 7 -50.443 -3.199 36.948 53 3HG1 VAL 7 3HG1 VAL 7 -49.647 -3.283 38.535 54 1HG2 VAL 7 1HG2 VAL 7 -52.047 -2.758 39.499 55 2HG2 VAL 7 2HG2 VAL 7 -52.670 -2.567 37.848 56 3HG2 VAL 7 3HG2 VAL 7 -52.867 -1.269 39.044 57 H THR 8 H THR 8 -52.121 0.453 38.540 58 HA THR 8 HA THR 8 -52.073 3.013 40.187 59 HB THR 8 HB THR 8 -52.883 4.543 38.455 60 HG1 THR 8 HG1 THR 8 -53.656 2.820 37.104 61 1HG2 THR 8 1HG2 THR 8 -50.831 4.959 37.129 62 2HG2 THR 8 2HG2 THR 8 -50.193 3.353 37.540 63 3HG2 THR 8 3HG2 THR 8 -50.402 4.581 38.817 64 H ASP 9 H ASP 9 -53.502 1.548 41.302 65 HA ASP 9 HA ASP 9 -56.091 0.800 40.135 66 1HB ASP 9 2HB ASP 9 -54.923 0.393 42.954 67 2HB ASP 9 1HB ASP 9 -56.348 -0.393 42.312 68 H LEU 10 H LEU 10 -57.385 2.639 39.781 69 HA LEU 10 HA LEU 10 -58.877 3.678 42.092 70 1HB LEU 10 2HB LEU 10 -58.504 6.024 41.891 71 2HB LEU 10 1HB LEU 10 -57.049 5.193 42.348 72 HG LEU 10 HG LEU 10 -56.578 7.128 40.997 73 1HD1 LEU 10 1HD1 LEU 10 -54.995 6.221 39.346 74 2HD1 LEU 10 2HD1 LEU 10 -55.871 4.674 39.289 75 3HD1 LEU 10 3HD1 LEU 10 -55.015 5.144 40.769 76 1HD2 LEU 10 1HD2 LEU 10 -58.048 5.865 38.611 77 2HD2 LEU 10 2HD2 LEU 10 -57.207 7.435 38.630 78 3HD2 LEU 10 3HD2 LEU 10 -58.687 7.184 39.598 79 1H LYS 1 1H LYS 1 -33.670 15.080 35.039 80 2H LYS 1 2H LYS 1 -33.383 13.924 36.201 81 3H LYS 1 3H LYS 1 -33.840 15.412 36.652 82 HA LYS 1 HA LYS 1 -36.059 15.152 35.719 83 1HB LYS 1 2HB LYS 1 -34.970 12.377 34.845 84 2HB LYS 1 1HB LYS 1 -36.654 12.748 34.966 85 1HG LYS 1 2HG LYS 1 -35.898 14.858 33.291 86 2HG LYS 1 1HG LYS 1 -34.693 13.662 32.844 87 1HD LYS 1 2HD LYS 1 -36.561 11.971 32.399 88 2HD LYS 1 1HD LYS 1 -37.755 13.153 32.922 89 1HE LYS 1 2HE LYS 1 -36.886 14.735 30.996 90 2HE LYS 1 1HE LYS 1 -35.908 13.379 30.429 91 1HZ LYS 1 1HZ LYS 1 -38.147 12.041 30.377 92 2HZ LYS 1 2HZ LYS 1 -38.093 13.268 29.286 93 3HZ LYS 1 3HZ LYS 1 -38.933 13.453 30.673 94 H LEU 2 H LEU 2 -37.799 13.760 36.702 95 HA LEU 2 HA LEU 2 -38.925 13.450 38.510 96 1HB LEU 2 2HB LEU 2 -38.925 11.230 39.101 97 2HB LEU 2 1HB LEU 2 -37.974 11.265 37.652 98 HG LEU 2 HG LEU 2 -35.949 11.574 39.605 99 1HD1 LEU 2 1HD1 LEU 2 -37.597 11.446 41.422 100 2HD1 LEU 2 2HD1 LEU 2 -36.554 10.036 41.477 101 3HD1 LEU 2 3HD1 LEU 2 -38.229 9.918 40.825 102 1HD2 LEU 2 1HD2 LEU 2 -37.161 8.877 38.629 103 2HD2 LEU 2 2HD2 LEU 2 -35.535 9.105 39.322 104 3HD2 LEU 2 3HD2 LEU 2 -35.936 9.832 37.753 105 HA PRO 3 HA PRO 3 -37.972 15.442 42.269 106 1HB PRO 3 2HB PRO 3 -40.119 13.998 43.850 107 2HB PRO 3 1HB PRO 3 -40.053 15.589 43.398 108 1HG PRO 3 2HG PRO 3 -41.772 13.955 42.119 109 2HG PRO 3 1HG PRO 3 -40.977 15.283 41.238 110 1HD PRO 3 2HD PRO 3 -40.088 12.325 41.300 111 2HD PRO 3 1HD PRO 3 -40.371 13.405 39.921 112 HA PRO 4 HA PRO 4 -35.301 13.427 45.183 113 1HB PRO 4 2HB PRO 4 -35.023 15.278 47.175 114 2HB PRO 4 1HB PRO 4 -34.618 15.626 45.485 115 1HG PRO 4 2HG PRO 4 -37.140 16.426 47.007 116 2HG PRO 4 1HG PRO 4 -36.168 17.424 45.899 117 1HD PRO 4 2HD PRO 4 -38.529 15.974 45.225 118 2HD PRO 4 1HD PRO 4 -37.362 16.540 44.011 119 H GLY 5 H GLY 5 -35.504 11.736 46.397 120 1HA GLY 5 2HA GLY 5 -36.325 10.321 48.350 121 2HA GLY 5 1HA GLY 5 -37.689 11.388 48.548 122 H TRP 6 H TRP 6 -37.248 10.424 45.073 123 HA TRP 6 HA TRP 6 -39.219 8.239 45.390 124 1HB TRP 6 2HB TRP 6 -37.986 10.249 43.361 125 2HB TRP 6 1HB TRP 6 -38.512 8.769 42.727 126 HD1 TRP 6 HD1 TRP 6 -39.851 12.075 43.665 127 HE1 TRP 6 HE1 TRP 6 -42.401 12.247 43.991 128 HE3 TRP 6 HE3 TRP 6 -40.571 7.161 42.925 129 HZ2 TRP 6 HZ2 TRP 6 -44.477 10.144 44.065 130 HZ3 TRP 6 HZ3 TRP 6 -42.945 6.318 42.989 131 HH2 TRP 6 HH2 TRP 6 -44.808 7.708 43.709 132 H GLU 7 H GLU 7 -38.951 6.178 44.361 133 HA GLU 7 HA GLU 7 -36.526 5.851 42.869 134 1HB GLU 7 2HB GLU 7 -35.934 5.142 45.362 135 2HB GLU 7 1HB GLU 7 -37.130 3.882 45.224 136 1HG GLU 7 2HG GLU 7 -35.522 2.969 43.219 137 2HG GLU 7 1HG GLU 7 -34.330 4.044 43.949 138 H LYS 8 H LYS 8 -36.760 4.801 41.162 139 HA LYS 8 HA LYS 8 -39.004 2.879 40.553 140 1HB LYS 8 2HB LYS 8 -38.435 2.863 38.315 141 2HB LYS 8 1HB LYS 8 -38.218 4.500 38.847 142 1HG LYS 8 2HG LYS 8 -36.269 4.316 37.589 143 2HG LYS 8 1HG LYS 8 -35.632 3.798 39.145 144 1HD LYS 8 2HD LYS 8 -36.486 1.328 38.194 145 2HD LYS 8 1HD LYS 8 -36.323 2.094 36.660 146 1HE LYS 8 2HE LYS 8 -34.162 1.751 38.879 147 2HE LYS 8 1HE LYS 8 -34.294 0.744 37.448 148 1HZ LYS 8 1HZ LYS 8 -32.577 2.543 37.116 149 2HZ LYS 8 2HZ LYS 8 -33.698 3.711 37.385 150 3HZ LYS 8 3HZ LYS 8 -33.806 2.782 36.038 151 H ARG 9 H ARG 9 -39.051 0.675 40.739 152 HA ARG 9 HA ARG 9 -36.460 -0.812 41.395 153 1HB ARG 9 2HB ARG 9 -39.297 -1.016 42.614 154 2HB ARG 9 1HB ARG 9 -38.030 -2.200 42.858 155 1HG ARG 9 2HG ARG 9 -36.495 -0.221 43.615 156 2HG ARG 9 1HG ARG 9 -37.941 0.751 43.742 157 1HD ARG 9 2HD ARG 9 -38.915 -0.807 45.463 158 2HD ARG 9 1HD ARG 9 -37.544 -1.942 45.199 159 HE ARG 9 HE ARG 9 -36.143 0.441 45.662 160 1HH1 ARG 9 2HH1 ARG 9 -38.669 -0.941 47.595 161 2HH1 ARG 9 1HH1 ARG 9 -38.058 -0.037 49.078 162 1HH2 ARG 9 1HH2 ARG 9 -35.589 1.447 47.218 163 2HH2 ARG 9 2HH2 ARG 9 -36.351 1.284 48.860 164 H MET 10 H MET 10 -37.605 -3.146 41.321 165 HA MET 10 HA MET 10 -38.413 -3.767 38.438 166 1HB MET 10 2HB MET 10 -37.711 -6.055 38.708 167 2HB MET 10 1HB MET 10 -36.381 -4.969 38.999 168 1HG MET 10 2HG MET 10 -36.226 -6.822 40.576 169 2HG MET 10 1HG MET 10 -36.612 -5.394 41.532 170 1HE MET 10 1HE MET 10 -39.940 -6.149 43.081 171 2HE MET 10 2HE MET 10 -38.681 -4.953 42.708 172 3HE MET 10 3HE MET 10 -38.262 -6.388 43.693 173 H SER 11 H SER 11 -40.189 -5.333 38.225 174 HA SER 11 HA SER 11 -41.999 -5.596 40.707 175 1HB SER 11 2HB SER 11 -42.901 -4.327 38.649 176 2HB SER 11 1HB SER 11 -42.988 -5.892 37.821 177 HG SER 11 HG SER 11 -44.929 -5.723 38.878 178 H ARG 12 H ARG 12 -43.355 -7.625 40.767 179 HA ARG 12 HA ARG 12 -42.757 -9.614 42.054 180 1HB ARG 12 2HB ARG 12 -43.582 -11.353 40.672 181 2HB ARG 12 1HB ARG 12 -44.437 -9.871 40.302 182 1HG ARG 12 2HG ARG 12 -43.173 -9.595 38.165 183 2HG ARG 12 1HG ARG 12 -42.072 -10.857 38.584 184 1HD ARG 12 2HD ARG 12 -43.554 -11.723 36.946 185 2HD ARG 12 1HD ARG 12 -43.897 -12.599 38.448 186 HE ARG 12 HE ARG 12 -45.799 -10.445 38.529 187 1HH1 ARG 12 2HH1 ARG 12 -45.060 -12.472 35.868 188 2HH1 ARG 12 1HH1 ARG 12 -46.745 -12.192 35.174 189 1HH2 ARG 12 1HH2 ARG 12 -47.441 -10.118 37.695 190 2HH2 ARG 12 2HH2 ARG 12 -48.039 -10.920 36.188 191 H SER 13 H SER 13 -40.253 -8.761 42.175 192 HA SER 13 HA SER 13 -38.098 -9.546 42.703 193 1HB SER 13 2HB SER 13 -39.158 -11.664 43.556 194 2HB SER 13 1HB SER 13 -38.867 -12.410 41.979 195 HG SER 13 HG SER 13 -37.108 -12.833 43.298 196 H SER 14 H SER 14 -39.117 -11.057 39.659 197 HA SER 14 HA SER 14 -37.236 -9.241 38.209 198 1HB SER 14 2HB SER 14 -36.823 -12.289 37.948 199 2HB SER 14 1HB SER 14 -36.207 -11.119 36.780 200 HG SER 14 HG SER 14 -35.707 -10.636 39.509 201 H GLY 15 H GLY 15 -38.373 -8.432 36.597 202 1HA GLY 15 2HA GLY 15 -39.765 -9.872 34.518 203 2HA GLY 15 1HA GLY 15 -41.012 -9.555 35.708 204 H ARG 16 H ARG 16 -41.214 -7.223 36.309 205 HA ARG 16 HA ARG 16 -40.730 -5.286 33.991 206 1HB ARG 16 2HB ARG 16 -43.441 -6.299 34.882 207 2HB ARG 16 1HB ARG 16 -43.364 -4.584 34.900 208 1HG ARG 16 2HG ARG 16 -44.244 -5.306 32.775 209 2HG ARG 16 1HG ARG 16 -42.735 -4.434 32.519 210 1HD ARG 16 2HD ARG 16 -41.492 -6.569 32.265 211 2HD ARG 16 1HD ARG 16 -42.935 -7.530 32.596 212 HE ARG 16 HE ARG 16 -43.760 -5.958 30.380 213 1HH1 ARG 16 2HH1 ARG 16 -40.930 -7.918 30.876 214 2HH1 ARG 16 1HH1 ARG 16 -40.801 -8.311 29.096 215 1HH2 ARG 16 1HH2 ARG 16 -43.577 -6.414 28.380 216 2HH2 ARG 16 2HH2 ARG 16 -42.239 -7.488 27.768 217 H VAL 17 H VAL 17 -42.411 -3.355 35.747 218 HA VAL 17 HA VAL 17 -40.184 -2.498 37.636 219 HB VAL 17 HB VAL 17 -39.425 -1.666 35.564 220 1HG1 VAL 17 1HG1 VAL 17 -41.449 -1.759 34.103 221 2HG1 VAL 17 2HG1 VAL 17 -40.704 -0.156 33.989 222 3HG1 VAL 17 3HG1 VAL 17 -42.178 -0.391 34.975 223 1HG2 VAL 17 1HG2 VAL 17 -40.783 0.777 36.874 224 2HG2 VAL 17 2HG2 VAL 17 -39.382 0.812 35.778 225 3HG2 VAL 17 3HG2 VAL 17 -39.239 0.077 37.378 226 H TYR 18 H TYR 18 -40.908 -1.440 39.387 227 HA TYR 18 HA TYR 18 -43.494 0.108 39.209 228 1HB TYR 18 2HB TYR 18 -44.317 -0.416 41.373 229 2HB TYR 18 1HB TYR 18 -44.200 -1.854 40.423 230 HD1 TYR 18 HD1 TYR 18 -42.241 0.036 43.102 231 HD2 TYR 18 HD2 TYR 18 -43.348 -3.788 41.476 232 HE1 TYR 18 HE1 TYR 18 -41.178 -1.081 44.997 233 HE2 TYR 18 HE2 TYR 18 -42.295 -4.900 43.373 234 HH TYR 18 HH TYR 18 -41.275 -4.625 45.324 235 H TYR 19 H TYR 19 -43.560 1.842 40.993 236 HA TYR 19 HA TYR 19 -40.778 2.816 41.648 237 1HB TYR 19 2HB TYR 19 -40.656 4.136 39.865 238 2HB TYR 19 1HB TYR 19 -42.191 3.597 39.310 239 HD1 TYR 19 HD1 TYR 19 -44.371 4.630 40.216 240 HD2 TYR 19 HD2 TYR 19 -40.506 6.570 39.964 241 HE1 TYR 19 HE1 TYR 19 -45.404 6.856 40.329 242 HE2 TYR 19 HE2 TYR 19 -41.576 8.698 40.145 243 HH TYR 19 HH TYR 19 -45.200 8.857 40.579 244 H PHE 20 H PHE 20 -40.534 3.658 43.486 245 HA PHE 20 HA PHE 20 -42.972 3.810 45.339 246 1HB PHE 20 2HB PHE 20 -41.923 1.656 45.434 247 2HB PHE 20 1HB PHE 20 -40.302 2.285 45.433 248 HD1 PHE 20 HD1 PHE 20 -43.480 2.266 47.510 249 HD2 PHE 20 HD2 PHE 20 -39.237 2.733 47.566 250 HE1 PHE 20 HE1 PHE 20 -43.599 2.296 49.773 251 HE2 PHE 20 HE2 PHE 20 -39.208 2.788 49.846 252 HZ PHE 20 HZ PHE 20 -41.420 2.527 51.372 253 H ASN 21 H ASN 21 -43.183 5.597 46.466 254 HA ASN 21 HA ASN 21 -41.044 7.667 46.656 255 1HB ASN 21 2HB ASN 21 -43.716 7.898 46.529 256 2HB ASN 21 1HB ASN 21 -43.642 7.729 48.261 257 1HD2 ASN 21 1HD2 ASN 21 -41.024 9.411 48.112 258 2HD2 ASN 21 2HD2 ASN 21 -41.725 11.091 47.876 259 H HIS 22 H HIS 22 -39.326 7.333 48.033 260 HA HIS 22 HA HIS 22 -39.462 5.565 50.378 261 1HB HIS 22 2HB HIS 22 -37.473 6.439 48.523 262 2HB HIS 22 1HB HIS 22 -37.026 7.352 49.928 263 HD1 HIS 22 HD1 HIS 22 -36.687 5.673 52.269 264 HD2 HIS 22 HD2 HIS 22 -37.038 3.937 48.409 265 HE1 HIS 22 HE1 HIS 22 -35.927 3.195 52.367 266 H ILE 23 H ILE 23 -40.968 8.089 50.711 267 HA ILE 23 HA ILE 23 -40.109 8.878 53.505 268 HB ILE 23 HB ILE 23 -40.384 11.389 52.937 269 1HG1 ILE 23 2HG1 ILE 23 -39.658 10.479 50.080 270 2HG1 ILE 23 1HG1 ILE 23 -41.210 11.142 50.564 271 1HG2 ILE 23 1HG2 ILE 23 -37.806 10.027 51.938 272 2HG2 ILE 23 2HG2 ILE 23 -38.222 10.293 53.644 273 3HG2 ILE 23 3HG2 ILE 23 -37.966 11.680 52.577 274 1HD1 ILE 23 1HD1 ILE 23 -38.551 12.690 50.563 275 2HD1 ILE 23 2HD1 ILE 23 -40.110 13.349 51.139 276 3HD1 ILE 23 3HD1 ILE 23 -39.901 12.873 49.432 277 H THR 24 H THR 24 -42.553 9.922 51.063 278 HA THR 24 HA THR 24 -44.888 9.781 52.805 279 HB THR 24 HB THR 24 -44.534 9.190 49.799 280 HG1 THR 24 HG1 THR 24 -45.365 11.332 49.669 281 1HG2 THR 24 1HG2 THR 24 -47.151 9.883 51.251 282 2HG2 THR 24 2HG2 THR 24 -46.768 8.333 50.466 283 3HG2 THR 24 3HG2 THR 24 -46.920 9.796 49.475 284 H ASN 25 H ASN 25 -43.479 7.177 50.896 285 HA ASN 25 HA ASN 25 -43.497 4.816 51.110 286 1HB ASN 25 2HB ASN 25 -43.626 5.063 53.605 287 2HB ASN 25 1HB ASN 25 -45.369 4.984 53.524 288 1HD2 ASN 25 1HD2 ASN 25 -46.284 2.935 52.759 289 2HD2 ASN 25 2HD2 ASN 25 -45.268 1.412 53.002 290 H ALA 26 H ALA 26 -44.394 5.301 49.039 291 HA ALA 26 HA ALA 26 -47.140 4.036 48.620 292 1HB ALA 26 1HB ALA 26 -47.604 6.468 48.955 293 2HB ALA 26 2HB ALA 26 -47.937 6.010 47.273 294 3HB ALA 26 3HB ALA 26 -46.451 6.905 47.667 295 H SER 27 H SER 27 -46.916 2.564 47.066 296 HA SER 27 HA SER 27 -44.910 2.962 44.757 297 1HB SER 27 2HB SER 27 -44.526 0.932 46.134 298 2HB SER 27 1HB SER 27 -46.131 0.319 45.719 299 HG SER 27 HG SER 27 -45.467 0.461 43.489 300 H GLN 28 H GLN 28 -45.599 3.295 42.948 301 HA GLN 28 HA GLN 28 -48.103 2.060 41.792 302 1HB GLN 28 2HB GLN 28 -48.836 4.086 40.554 303 2HB GLN 28 1HB GLN 28 -48.959 4.274 42.303 304 1HG GLN 28 2HG GLN 28 -46.771 5.652 42.146 305 2HG GLN 28 1HG GLN 28 -46.777 5.331 40.433 306 1HE2 GLN 28 1HE2 GLN 28 -47.794 6.721 39.222 307 2HE2 GLN 28 2HE2 GLN 28 -49.326 7.623 39.581 308 H TRP 29 H TRP 29 -47.782 2.979 39.192 309 HA TRP 29 HA TRP 29 -44.866 2.271 38.416 310 1HB TRP 29 2HB TRP 29 -47.272 1.891 36.540 311 2HB TRP 29 1HB TRP 29 -45.568 1.581 36.223 312 HD1 TRP 29 HD1 TRP 29 -46.189 -0.061 39.495 313 HE1 TRP 29 HE1 TRP 29 -46.042 -2.595 39.178 314 HE3 TRP 29 HE3 TRP 29 -46.387 -0.047 34.397 315 HZ2 TRP 29 HZ2 TRP 29 -46.158 -4.349 36.941 316 HZ3 TRP 29 HZ3 TRP 29 -46.270 -2.230 33.210 317 HH2 TRP 29 HH2 TRP 29 -46.215 -4.359 34.486 318 H GLU 30 H GLU 30 -47.166 4.844 38.291 319 HA GLU 30 HA GLU 30 -45.838 6.040 35.819 320 1HB GLU 30 2HB GLU 30 -48.610 6.557 37.155 321 2HB GLU 30 1HB GLU 30 -47.993 7.671 35.971 322 1HG GLU 30 2HG GLU 30 -48.521 4.715 35.439 323 2HG GLU 30 1HG GLU 30 -49.603 6.022 34.996 324 H ARG 31 H ARG 31 -44.581 7.402 35.859 325 HA ARG 31 HA ARG 31 -43.827 8.923 38.191 326 1HB ARG 31 2HB ARG 31 -41.856 8.945 37.307 327 2HB ARG 31 1HB ARG 31 -42.399 7.642 36.435 328 1HG ARG 31 2HG ARG 31 -42.315 10.512 35.206 329 2HG ARG 31 1HG ARG 31 -41.054 9.305 35.104 330 1HD ARG 31 2HD ARG 31 -42.185 8.918 33.052 331 2HD ARG 31 1HD ARG 31 -42.802 7.655 34.155 332 HE ARG 31 HE ARG 31 -44.479 10.156 34.184 333 1HH1 ARG 31 2HH1 ARG 31 -44.197 7.022 32.666 334 2HH1 ARG 31 1HH1 ARG 31 -46.016 6.827 32.766 335 1HH2 ARG 31 1HH2 ARG 31 -46.492 9.856 34.163 336 2HH2 ARG 31 2HH2 ARG 31 -47.170 8.332 33.377 337 HA PRO 32 HA PRO 32 -45.863 12.006 39.122 338 1HB PRO 32 2HB PRO 32 -43.389 13.882 39.497 339 2HB PRO 32 1HB PRO 32 -44.503 13.414 40.780 340 1HG PRO 32 2HG PRO 32 -42.214 12.203 40.762 341 2HG PRO 32 1HG PRO 32 -43.656 11.261 40.979 342 1HD PRO 32 2HD PRO 32 -41.982 11.452 38.377 343 2HD PRO 32 1HD PRO 32 -42.648 10.151 39.191 344 H SER 33 H SER 33 -45.288 12.394 36.450 345 HA SER 33 HA SER 33 -44.996 13.803 34.455 346 1HB SER 33 2HB SER 33 -46.254 15.778 35.251 347 2HB SER 33 1HB SER 33 -44.868 16.308 36.202 348 HG SER 33 HG SER 33 -43.748 16.775 34.389 349 H GLY 34 H GLY 34 -42.975 15.400 36.856 350 1HA GLY 34 2HA GLY 34 -40.701 14.996 37.550 351 2HA GLY 34 1HA GLY 34 -40.900 13.341 37.015 352 H ASN 35 H ASN 35 -40.793 16.396 35.134 353 HA ASN 35 HA ASN 35 -38.367 15.323 33.619 354 1HB ASN 35 2HB ASN 35 -40.267 17.600 32.849 355 2HB ASN 35 1HB ASN 35 -38.955 16.994 31.882 356 1HD2 ASN 35 1HD2 ASN 35 -42.161 16.480 32.813 357 2HD2 ASN 35 2HD2 ASN 35 -42.453 14.995 31.770 358 H SER 36 H SER 36 -39.327 18.395 35.120 359 HA SER 36 HA SER 36 -38.133 20.333 35.699 360 1HB SER 36 2HB SER 36 -36.352 19.084 36.863 361 2HB SER 36 1HB SER 36 -35.487 18.832 35.341 362 HG SER 36 HG SER 36 -35.354 21.118 35.113 363 H SER 37 H SER 37 -39.426 20.373 33.662 364 HA SER 37 HA SER 37 -37.926 21.906 31.516 365 1HB SER 37 2HB SER 37 -39.351 19.251 30.804 366 2HB SER 37 1HB SER 37 -38.705 20.404 29.637 367 HG SER 37 HG SER 37 -36.847 19.785 31.539 368 H SER 38 H SER 38 -41.084 20.559 32.456 369 HA SER 38 HA SER 38 -42.330 23.215 32.138 370 1HB SER 38 2HB SER 38 -43.384 20.969 30.298 371 2HB SER 38 1HB SER 38 -44.302 22.418 30.713 372 HG SER 38 HG SER 38 -41.662 22.814 29.870 373 H GLY 39 H GLY 39 -43.333 19.834 32.485 374 1HA GLY 39 2HA GLY 39 -43.366 20.351 35.480 375 2HA GLY 39 1HA GLY 39 -44.369 19.050 34.838 Start of MODEL 10 1 1H GLU 1 1H GLU 1 -51.594 -11.833 40.658 2 2H GLU 1 2H GLU 1 -52.817 -11.945 41.810 3 3H GLU 1 3H GLU 1 -53.118 -12.367 40.263 4 HA GLU 1 HA GLU 1 -51.447 -13.877 42.093 5 1HB GLU 1 2HB GLU 1 -53.079 -15.631 41.933 6 2HB GLU 1 1HB GLU 1 -53.835 -14.158 42.468 7 1HG GLU 1 2HG GLU 1 -54.144 -15.465 39.671 8 2HG GLU 1 1HG GLU 1 -55.358 -15.302 40.920 9 H GLN 2 H GLN 2 -52.451 -14.045 39.087 10 HA GLN 2 HA GLN 2 -49.914 -15.388 37.952 11 1HB GLN 2 2HB GLN 2 -51.988 -16.084 36.877 12 2HB GLN 2 1HB GLN 2 -52.355 -14.476 36.325 13 1HG GLN 2 2HG GLN 2 -49.789 -16.030 35.503 14 2HG GLN 2 1HG GLN 2 -51.293 -16.180 34.642 15 1HE2 GLN 2 1HE2 GLN 2 -52.032 -14.390 33.396 16 2HE2 GLN 2 2HE2 GLN 2 -50.810 -13.140 32.837 17 HA PRO 3 HA PRO 3 -48.713 -10.762 37.136 18 1HB PRO 3 2HB PRO 3 -50.521 -8.745 37.651 19 2HB PRO 3 1HB PRO 3 -50.321 -9.508 36.073 20 1HG PRO 3 2HG PRO 3 -52.434 -10.177 38.208 21 2HG PRO 3 1HG PRO 3 -52.709 -9.853 36.483 22 1HD PRO 3 2HD PRO 3 -52.540 -12.420 37.441 23 2HD PRO 3 1HD PRO 3 -51.876 -12.018 35.841 24 H LEU 4 H LEU 4 -47.515 -10.120 38.726 25 HA LEU 4 HA LEU 4 -48.487 -9.929 41.620 26 1HB LEU 4 2HB LEU 4 -47.206 -12.121 41.173 27 2HB LEU 4 1HB LEU 4 -45.774 -11.173 40.867 28 HG LEU 4 HG LEU 4 -47.375 -11.177 43.519 29 1HD1 LEU 4 1HD1 LEU 4 -45.537 -12.652 44.385 30 2HD1 LEU 4 2HD1 LEU 4 -44.756 -12.663 42.789 31 3HD1 LEU 4 3HD1 LEU 4 -46.349 -13.424 43.012 32 1HD2 LEU 4 1HD2 LEU 4 -44.559 -10.025 42.910 33 2HD2 LEU 4 2HD2 LEU 4 -45.261 -10.192 44.535 34 3HD2 LEU 4 3HD2 LEU 4 -45.998 -9.090 43.370 35 1HN TPO 5 1HN THR 5 -48.814 -7.840 40.749 36 HA TPO 5 HA THR 5 -46.364 -6.158 40.050 37 HB TPO 5 HB THR 5 -47.304 -5.452 38.057 38 1HG2 TPO 5 1HG2 THR 5 -49.675 -5.040 38.453 39 2HG2 TPO 5 2HG2 THR 5 -49.980 -6.773 38.765 40 3HG2 TPO 5 3HG2 THR 5 -49.530 -6.209 37.129 41 HA PRO 6 HA PRO 6 -48.807 -3.775 43.178 42 1HB PRO 6 2HB PRO 6 -46.831 -2.425 44.475 43 2HB PRO 6 1HB PRO 6 -47.042 -4.183 44.580 44 1HG PRO 6 2HG PRO 6 -45.160 -2.643 42.733 45 2HG PRO 6 1HG PRO 6 -44.712 -3.971 43.829 46 1HD PRO 6 2HD PRO 6 -45.205 -4.394 41.140 47 2HD PRO 6 1HD PRO 6 -45.684 -5.621 42.353 48 H VAL 7 H VAL 7 -49.908 -2.783 41.460 49 HA VAL 7 HA VAL 7 -49.207 -0.009 40.573 50 HB VAL 7 HB VAL 7 -51.694 -1.758 40.095 51 1HG1 VAL 7 1HG1 VAL 7 -52.387 0.564 39.640 52 2HG1 VAL 7 2HG1 VAL 7 -52.240 -0.296 38.133 53 3HG1 VAL 7 3HG1 VAL 7 -50.959 0.857 38.605 54 1HG2 VAL 7 1HG2 VAL 7 -49.356 -1.178 38.129 55 2HG2 VAL 7 2HG2 VAL 7 -50.780 -2.205 37.821 56 3HG2 VAL 7 3HG2 VAL 7 -49.574 -2.699 39.013 57 H THR 8 H THR 8 -50.738 1.800 40.800 58 HA THR 8 HA THR 8 -51.689 2.145 43.683 59 HB THR 8 HB THR 8 -50.085 3.796 43.003 60 HG1 THR 8 HG1 THR 8 -52.709 4.838 43.057 61 1HG2 THR 8 1HG2 THR 8 -52.029 4.771 40.788 62 2HG2 THR 8 2HG2 THR 8 -50.422 4.070 40.508 63 3HG2 THR 8 3HG2 THR 8 -50.574 5.618 41.347 64 H ASP 9 H ASP 9 -53.418 0.503 42.731 65 HA ASP 9 HA ASP 9 -55.729 1.818 41.391 66 1HB ASP 9 2HB ASP 9 -55.409 -1.008 42.557 67 2HB ASP 9 1HB ASP 9 -56.767 -0.454 41.603 68 H LEU 10 H LEU 10 -56.328 3.505 42.879 69 HA LEU 10 HA LEU 10 -58.417 2.713 44.809 70 1HB LEU 10 2HB LEU 10 -57.632 3.622 46.807 71 2HB LEU 10 1HB LEU 10 -56.449 2.448 46.291 72 HG LEU 10 HG LEU 10 -56.096 5.502 45.999 73 1HD1 LEU 10 1HD1 LEU 10 -54.625 5.350 48.037 74 2HD1 LEU 10 2HD1 LEU 10 -55.008 3.615 48.206 75 3HD1 LEU 10 3HD1 LEU 10 -56.284 4.843 48.414 76 1HD2 LEU 10 1HD2 LEU 10 -53.611 4.932 45.790 77 2HD2 LEU 10 2HD2 LEU 10 -54.592 4.302 44.461 78 3HD2 LEU 10 3HD2 LEU 10 -54.040 3.196 45.735 79 1H LYS 1 1H LYS 1 -32.723 14.290 37.085 80 2H LYS 1 2H LYS 1 -34.157 13.775 36.439 81 3H LYS 1 3H LYS 1 -33.561 13.045 37.771 82 HA LYS 1 HA LYS 1 -33.901 15.069 39.133 83 1HB LYS 1 2HB LYS 1 -34.988 16.190 36.462 84 2HB LYS 1 1HB LYS 1 -35.308 16.896 38.018 85 1HG LYS 1 2HG LYS 1 -32.822 17.318 38.400 86 2HG LYS 1 1HG LYS 1 -32.477 16.695 36.782 87 1HD LYS 1 2HD LYS 1 -34.004 18.465 35.772 88 2HD LYS 1 1HD LYS 1 -34.378 19.070 37.383 89 1HE LYS 1 2HE LYS 1 -31.898 19.648 37.744 90 2HE LYS 1 1HE LYS 1 -31.529 19.062 36.121 91 1HZ LYS 1 1HZ LYS 1 -31.959 21.531 36.091 92 2HZ LYS 1 2HZ LYS 1 -33.459 21.343 36.711 93 3HZ LYS 1 3HZ LYS 1 -33.123 20.802 35.206 94 H LEU 2 H LEU 2 -35.230 13.739 40.346 95 HA LEU 2 HA LEU 2 -38.139 14.036 39.846 96 1HB LEU 2 2HB LEU 2 -38.787 11.711 40.272 97 2HB LEU 2 1HB LEU 2 -37.718 11.755 38.892 98 HG LEU 2 HG LEU 2 -36.018 11.320 41.224 99 1HD1 LEU 2 1HD1 LEU 2 -37.072 9.424 42.378 100 2HD1 LEU 2 2HD1 LEU 2 -38.574 9.605 41.450 101 3HD1 LEU 2 3HD1 LEU 2 -38.065 10.887 42.544 102 1HD2 LEU 2 1HD2 LEU 2 -35.668 10.208 38.971 103 2HD2 LEU 2 2HD2 LEU 2 -37.127 9.216 39.215 104 3HD2 LEU 2 3HD2 LEU 2 -35.715 9.006 40.273 105 HA PRO 3 HA PRO 3 -38.028 15.046 44.096 106 1HB PRO 3 2HB PRO 3 -40.173 13.567 45.389 107 2HB PRO 3 1HB PRO 3 -40.182 15.089 44.621 108 1HG PRO 3 2HG PRO 3 -40.815 12.457 43.299 109 2HG PRO 3 1HG PRO 3 -41.702 13.990 43.174 110 1HD PRO 3 2HD PRO 3 -40.041 13.117 41.223 111 2HD PRO 3 1HD PRO 3 -40.088 14.840 41.652 112 HA PRO 4 HA PRO 4 -35.431 12.601 46.706 113 1HB PRO 4 2HB PRO 4 -35.248 14.129 48.970 114 2HB PRO 4 1HB PRO 4 -34.761 14.740 47.379 115 1HG PRO 4 2HG PRO 4 -37.411 15.239 48.839 116 2HG PRO 4 1HG PRO 4 -36.357 16.447 48.063 117 1HD PRO 4 2HD PRO 4 -38.600 15.270 46.830 118 2HD PRO 4 1HD PRO 4 -37.221 15.903 45.895 119 H GLY 5 H GLY 5 -35.516 10.873 47.926 120 1HA GLY 5 2HA GLY 5 -36.419 9.179 49.533 121 2HA GLY 5 1HA GLY 5 -37.809 10.186 49.836 122 H TRP 6 H TRP 6 -37.486 9.844 46.265 123 HA TRP 6 HA TRP 6 -39.118 7.405 46.193 124 1HB TRP 6 2HB TRP 6 -37.989 9.753 44.469 125 2HB TRP 6 1HB TRP 6 -38.589 8.373 43.714 126 HD1 TRP 6 HD1 TRP 6 -39.833 11.547 45.275 127 HE1 TRP 6 HE1 TRP 6 -42.439 11.731 45.342 128 HE3 TRP 6 HE3 TRP 6 -40.593 7.040 43.239 129 HZ2 TRP 6 HZ2 TRP 6 -44.436 10.081 44.225 130 HZ3 TRP 6 HZ3 TRP 6 -42.964 6.332 42.767 131 HH2 TRP 6 HH2 TRP 6 -44.842 7.823 43.278 132 H GLU 7 H GLU 7 -38.531 5.638 44.753 133 HA GLU 7 HA GLU 7 -36.503 5.993 43.035 134 1HB GLU 7 2HB GLU 7 -35.204 5.002 45.352 135 2HB GLU 7 1HB GLU 7 -35.569 3.491 44.605 136 1HG GLU 7 2HG GLU 7 -33.968 5.813 43.293 137 2HG GLU 7 1HG GLU 7 -33.223 4.502 44.166 138 H LYS 8 H LYS 8 -36.256 4.288 41.581 139 HA LYS 8 HA LYS 8 -38.711 2.613 41.106 140 1HB LYS 8 2HB LYS 8 -38.001 1.959 38.922 141 2HB LYS 8 1HB LYS 8 -38.120 3.674 39.157 142 1HG LYS 8 2HG LYS 8 -36.243 3.434 37.774 143 2HG LYS 8 1HG LYS 8 -35.601 3.841 39.342 144 1HD LYS 8 2HD LYS 8 -35.262 1.176 39.648 145 2HD LYS 8 1HD LYS 8 -35.665 1.072 37.957 146 1HE LYS 8 2HE LYS 8 -33.254 1.092 38.059 147 2HE LYS 8 1HE LYS 8 -33.697 2.686 37.447 148 1HZ LYS 8 1HZ LYS 8 -32.086 2.964 39.395 149 2HZ LYS 8 2HZ LYS 8 -33.105 2.133 40.400 150 3HZ LYS 8 3HZ LYS 8 -33.552 3.508 39.901 151 H ARG 9 H ARG 9 -38.969 0.446 41.073 152 HA ARG 9 HA ARG 9 -36.822 -1.272 42.413 153 1HB ARG 9 2HB ARG 9 -39.821 -1.233 43.064 154 2HB ARG 9 1HB ARG 9 -38.637 -2.248 43.849 155 1HG ARG 9 2HG ARG 9 -38.867 0.828 44.168 156 2HG ARG 9 1HG ARG 9 -39.565 -0.367 45.220 157 1HD ARG 9 2HD ARG 9 -37.688 0.376 46.390 158 2HD ARG 9 1HD ARG 9 -37.209 -1.229 45.802 159 HE ARG 9 HE ARG 9 -36.313 0.646 43.760 160 1HH1 ARG 9 2HH1 ARG 9 -35.678 0.402 47.141 161 2HH1 ARG 9 1HH1 ARG 9 -33.940 0.921 46.905 162 1HH2 ARG 9 1HH2 ARG 9 -34.428 1.410 43.573 163 2HH2 ARG 9 2HH2 ARG 9 -33.297 1.445 44.976 164 H MET 10 H MET 10 -38.869 -3.504 42.228 165 HA MET 10 HA MET 10 -38.943 -3.922 39.256 166 1HB MET 10 2HB MET 10 -37.649 -5.691 38.972 167 2HB MET 10 1HB MET 10 -36.693 -4.689 40.012 168 1HG MET 10 2HG MET 10 -38.207 -7.266 40.820 169 2HG MET 10 1HG MET 10 -36.488 -7.118 40.521 170 1HE MET 10 1HE MET 10 -38.718 -6.484 44.322 171 2HE MET 10 2HE MET 10 -39.335 -6.867 42.692 172 3HE MET 10 3HE MET 10 -39.155 -5.173 43.193 173 H SER 11 H SER 11 -40.203 -5.457 38.445 174 HA SER 11 HA SER 11 -42.728 -6.054 40.101 175 1HB SER 11 2HB SER 11 -42.972 -4.751 37.910 176 2HB SER 11 1HB SER 11 -42.598 -6.245 37.040 177 HG SER 11 HG SER 11 -44.635 -6.862 37.442 178 H ARG 12 H ARG 12 -43.822 -8.124 39.867 179 HA ARG 12 HA ARG 12 -43.700 -10.381 40.602 180 1HB ARG 12 2HB ARG 12 -42.088 -10.592 38.003 181 2HB ARG 12 1HB ARG 12 -42.837 -11.949 38.813 182 1HG ARG 12 2HG ARG 12 -45.133 -11.026 38.434 183 2HG ARG 12 1HG ARG 12 -44.451 -9.570 37.721 184 1HD ARG 12 2HD ARG 12 -43.352 -10.919 35.892 185 2HD ARG 12 1HD ARG 12 -43.991 -12.413 36.561 186 HE ARG 12 HE ARG 12 -45.806 -10.054 35.667 187 1HH1 ARG 12 2HH1 ARG 12 -45.610 -13.352 36.262 188 2HH1 ARG 12 1HH1 ARG 12 -47.273 -13.592 35.507 189 1HH2 ARG 12 1HH2 ARG 12 -47.535 -10.404 35.018 190 2HH2 ARG 12 2HH2 ARG 12 -48.224 -12.093 34.655 191 H SER 13 H SER 13 -41.380 -8.913 41.732 192 HA SER 13 HA SER 13 -39.464 -9.301 43.026 193 1HB SER 13 2HB SER 13 -40.516 -11.405 43.916 194 2HB SER 13 1HB SER 13 -39.685 -12.327 42.662 195 HG SER 13 HG SER 13 -37.691 -11.284 43.487 196 H SER 14 H SER 14 -39.398 -11.037 39.938 197 HA SER 14 HA SER 14 -36.916 -9.440 39.242 198 1HB SER 14 2HB SER 14 -35.568 -11.347 38.505 199 2HB SER 14 1HB SER 14 -35.967 -11.547 40.206 200 HG SER 14 HG SER 14 -37.636 -12.682 38.207 201 H GLY 15 H GLY 15 -37.845 -8.355 37.530 202 1HA GLY 15 2HA GLY 15 -37.782 -9.637 34.919 203 2HA GLY 15 1HA GLY 15 -39.470 -9.644 35.384 204 H ARG 16 H ARG 16 -40.374 -7.503 35.940 205 HA ARG 16 HA ARG 16 -39.165 -5.203 34.272 206 1HB ARG 16 2HB ARG 16 -41.984 -6.337 34.327 207 2HB ARG 16 1HB ARG 16 -41.933 -4.621 34.428 208 1HG ARG 16 2HG ARG 16 -42.079 -5.056 32.118 209 2HG ARG 16 1HG ARG 16 -40.449 -4.461 32.388 210 1HD ARG 16 2HD ARG 16 -39.779 -7.083 32.582 211 2HD ARG 16 1HD ARG 16 -41.323 -7.395 31.932 212 HE ARG 16 HE ARG 16 -40.603 -6.220 29.767 213 1HH1 ARG 16 1HH2 ARG 16 -38.011 -6.542 32.116 214 2HH1 ARG 16 2HH2 ARG 16 -36.756 -6.243 30.831 215 1HH2 ARG 16 2HH1 ARG 16 -39.128 -5.909 28.376 216 2HH2 ARG 16 1HH1 ARG 16 -37.365 -5.907 28.837 217 H VAL 17 H VAL 17 -41.349 -3.464 35.625 218 HA VAL 17 HA VAL 17 -39.553 -2.567 37.910 219 HB VAL 17 HB VAL 17 -38.478 -1.766 36.013 220 1HG1 VAL 17 1HG1 VAL 17 -41.066 -0.352 35.076 221 2HG1 VAL 17 2HG1 VAL 17 -40.276 -1.718 34.260 222 3HG1 VAL 17 3HG1 VAL 17 -39.454 -0.148 34.329 223 1HG2 VAL 17 1HG2 VAL 17 -38.520 -0.188 37.946 224 2HG2 VAL 17 2HG2 VAL 17 -39.926 0.648 37.254 225 3HG2 VAL 17 3HG2 VAL 17 -38.365 0.676 36.402 226 H TYR 18 H TYR 18 -40.602 -1.698 39.534 227 HA TYR 18 HA TYR 18 -43.020 0.055 38.850 228 1HB TYR 18 2HB TYR 18 -44.251 -0.355 40.758 229 2HB TYR 18 1HB TYR 18 -43.845 -1.915 40.141 230 HD1 TYR 18 HD1 TYR 18 -42.162 -3.336 41.337 231 HD2 TYR 18 HD2 TYR 18 -43.536 0.358 43.015 232 HE1 TYR 18 HE1 TYR 18 -41.385 -4.065 43.559 233 HE2 TYR 18 HE2 TYR 18 -42.804 -0.382 45.237 234 HH TYR 18 HH TYR 18 -42.084 -2.162 46.458 235 H TYR 19 H TYR 19 -43.302 1.744 40.681 236 HA TYR 19 HA TYR 19 -40.619 3.031 41.334 237 1HB TYR 19 2HB TYR 19 -41.091 3.689 39.161 238 2HB TYR 19 1HB TYR 19 -42.782 4.009 39.467 239 HD1 TYR 19 HD1 TYR 19 -43.540 6.110 39.964 240 HD2 TYR 19 HD2 TYR 19 -39.264 5.482 40.061 241 HE1 TYR 19 HE1 TYR 19 -43.182 8.413 40.060 242 HE2 TYR 19 HE2 TYR 19 -38.901 7.821 40.070 243 HH TYR 19 HH TYR 19 -39.782 9.783 40.112 244 H PHE 20 H PHE 20 -40.468 3.750 43.229 245 HA PHE 20 HA PHE 20 -42.967 3.576 45.027 246 1HB PHE 20 2HB PHE 20 -41.510 1.509 44.835 247 2HB PHE 20 1HB PHE 20 -40.143 2.416 45.420 248 HD1 PHE 20 HD1 PHE 20 -43.707 1.633 46.473 249 HD2 PHE 20 HD2 PHE 20 -39.688 2.280 47.729 250 HE1 PHE 20 HE1 PHE 20 -44.378 1.141 48.590 251 HE2 PHE 20 HE2 PHE 20 -40.204 1.793 49.891 252 HZ PHE 20 HZ PHE 20 -42.681 1.076 50.702 253 H ASN 21 H ASN 21 -43.285 5.122 46.441 254 HA ASN 21 HA ASN 21 -41.126 7.131 47.174 255 1HB ASN 21 2HB ASN 21 -43.716 7.605 46.697 256 2HB ASN 21 1HB ASN 21 -43.948 7.087 48.349 257 1HD2 ASN 21 1HD2 ASN 21 -41.256 8.514 48.974 258 2HD2 ASN 21 2HD2 ASN 21 -41.822 10.264 48.991 259 H HIS 22 H HIS 22 -39.767 6.638 48.848 260 HA HIS 22 HA HIS 22 -40.297 4.249 50.653 261 1HB HIS 22 2HB HIS 22 -37.833 5.927 49.905 262 2HB HIS 22 1HB HIS 22 -37.839 5.235 51.490 263 HD1 HIS 22 HD1 HIS 22 -37.925 2.551 51.774 264 HD2 HIS 22 HD2 HIS 22 -37.335 4.152 47.852 265 HE1 HIS 22 HE1 HIS 22 -36.975 0.730 50.217 266 H ILE 23 H ILE 23 -39.855 7.715 51.084 267 HA ILE 23 HA ILE 23 -40.147 7.675 54.055 268 HB ILE 23 HB ILE 23 -40.347 10.180 53.866 269 1HG1 ILE 23 2HG1 ILE 23 -39.918 9.751 50.842 270 2HG1 ILE 23 1HG1 ILE 23 -41.371 10.377 51.601 271 1HG2 ILE 23 1HG2 ILE 23 -37.956 10.542 53.374 272 2HG2 ILE 23 2HG2 ILE 23 -37.852 9.006 52.481 273 3HG2 ILE 23 3HG2 ILE 23 -38.151 9.010 54.235 274 1HD1 ILE 23 1HD1 ILE 23 -40.083 12.418 52.381 275 2HD1 ILE 23 2HD1 ILE 23 -40.102 12.211 50.607 276 3HD1 ILE 23 3HD1 ILE 23 -38.642 11.798 51.519 277 H THR 24 H THR 24 -42.506 8.425 51.505 278 HA THR 24 HA THR 24 -44.823 8.538 53.413 279 HB THR 24 HB THR 24 -44.608 8.296 50.348 280 HG1 THR 24 HG1 THR 24 -45.604 10.436 51.878 281 1HG2 THR 24 1HG2 THR 24 -47.172 8.782 51.984 282 2HG2 THR 24 2HG2 THR 24 -46.826 7.387 50.939 283 3HG2 THR 24 3HG2 THR 24 -46.992 8.996 50.210 284 H ASN 25 H ASN 25 -43.610 6.057 51.235 285 HA ASN 25 HA ASN 25 -43.919 3.694 51.128 286 1HB ASN 25 2HB ASN 25 -44.194 3.560 53.617 287 2HB ASN 25 1HB ASN 25 -45.930 3.776 53.413 288 1HD2 ASN 25 1HD2 ASN 25 -45.725 1.718 54.649 289 2HD2 ASN 25 2HD2 ASN 25 -45.678 0.192 53.613 290 H ALA 26 H ALA 26 -44.573 4.392 49.096 291 HA ALA 26 HA ALA 26 -47.476 3.742 48.442 292 1HB ALA 26 1HB ALA 26 -47.491 6.207 48.859 293 2HB ALA 26 2HB ALA 26 -47.802 5.867 47.146 294 3HB ALA 26 3HB ALA 26 -46.203 6.455 47.652 295 H SER 27 H SER 27 -47.357 2.224 46.903 296 HA SER 27 HA SER 27 -45.153 2.250 44.806 297 1HB SER 27 2HB SER 27 -45.870 -0.008 44.212 298 2HB SER 27 1HB SER 27 -45.460 0.160 45.903 299 HG SER 27 HG SER 27 -48.116 0.249 44.818 300 H GLN 28 H GLN 28 -45.447 3.146 43.063 301 HA GLN 28 HA GLN 28 -47.977 2.840 41.408 302 1HB GLN 28 2HB GLN 28 -48.051 5.109 40.615 303 2HB GLN 28 1HB GLN 28 -48.102 5.136 42.355 304 1HG GLN 28 2HG GLN 28 -45.620 5.809 42.331 305 2HG GLN 28 1HG GLN 28 -45.650 5.792 40.584 306 1HE2 GLN 28 1HE2 GLN 28 -46.346 7.525 39.640 307 2HE2 GLN 28 2HE2 GLN 28 -47.672 8.526 40.202 308 H TRP 29 H TRP 29 -47.193 3.875 39.062 309 HA TRP 29 HA TRP 29 -44.566 2.470 38.289 310 1HB TRP 29 2HB TRP 29 -47.216 2.108 36.733 311 2HB TRP 29 1HB TRP 29 -45.612 1.660 36.183 312 HD1 TRP 29 HD1 TRP 29 -47.075 0.535 39.603 313 HE1 TRP 29 HE1 TRP 29 -46.278 -1.842 39.897 314 HE3 TRP 29 HE3 TRP 29 -45.215 -0.254 34.881 315 HZ2 TRP 29 HZ2 TRP 29 -45.661 -4.011 38.144 316 HZ3 TRP 29 HZ3 TRP 29 -44.577 -2.582 34.246 317 HH2 TRP 29 HH2 TRP 29 -44.849 -4.433 35.854 318 H GLU 30 H GLU 30 -46.178 5.322 38.257 319 HA GLU 30 HA GLU 30 -44.927 6.405 35.705 320 1HB GLU 30 2HB GLU 30 -46.837 7.695 35.402 321 2HB GLU 30 1HB GLU 30 -47.327 6.056 35.730 322 1HG GLU 30 2HG GLU 30 -47.725 8.315 37.772 323 2HG GLU 30 1HG GLU 30 -48.890 7.741 36.625 324 H ARG 31 H ARG 31 -45.961 8.854 37.326 325 HA ARG 31 HA ARG 31 -43.320 9.737 38.456 326 1HB ARG 31 2HB ARG 31 -43.963 9.794 35.647 327 2HB ARG 31 1HB ARG 31 -43.967 11.418 36.126 328 1HG ARG 31 2HG ARG 31 -41.611 11.279 36.965 329 2HG ARG 31 1HG ARG 31 -41.649 9.508 36.954 330 1HD ARG 31 2HD ARG 31 -40.434 10.067 35.004 331 2HD ARG 31 1HD ARG 31 -42.005 9.529 34.404 332 HE ARG 31 HE ARG 31 -42.069 12.472 34.886 333 1HH1 ARG 31 2HH1 ARG 31 -40.841 10.248 32.510 334 2HH1 ARG 31 1HH1 ARG 31 -40.791 11.608 31.269 335 1HH2 ARG 31 1HH2 ARG 31 -42.034 13.844 33.510 336 2HH2 ARG 31 2HH2 ARG 31 -41.462 13.524 31.802 337 HA PRO 32 HA PRO 32 -45.970 13.054 40.563 338 1HB PRO 32 2HB PRO 32 -43.677 14.051 41.984 339 2HB PRO 32 1HB PRO 32 -44.670 12.797 42.674 340 1HG PRO 32 2HG PRO 32 -42.222 12.400 41.039 341 2HG PRO 32 1HG PRO 32 -42.681 11.600 42.567 342 1HD PRO 32 2HD PRO 32 -42.894 10.391 40.303 343 2HD PRO 32 1HD PRO 32 -44.300 10.183 41.393 344 H SER 33 H SER 33 -42.640 13.355 39.286 345 HA SER 33 HA SER 33 -43.075 16.064 37.993 346 1HB SER 33 2HB SER 33 -40.789 14.073 37.662 347 2HB SER 33 1HB SER 33 -40.857 15.720 37.023 348 HG SER 33 HG SER 33 -41.091 16.425 39.283 349 H GLY 34 H GLY 34 -44.838 14.714 37.292 350 1HA GLY 34 2HA GLY 34 -45.424 12.972 35.382 351 2HA GLY 34 1HA GLY 34 -46.405 14.395 35.319 352 H ASN 35 H ASN 35 -44.931 16.237 33.993 353 HA ASN 35 HA ASN 35 -45.671 15.262 31.320 354 1HB ASN 35 2HB ASN 35 -46.170 17.555 32.238 355 2HB ASN 35 1HB ASN 35 -44.475 17.996 32.104 356 1HD2 ASN 35 1HD2 ASN 35 -44.015 19.033 30.167 357 2HD2 ASN 35 2HD2 ASN 35 -45.058 18.865 28.659 358 H SER 36 H SER 36 -44.538 14.430 29.753 359 HA SER 36 HA SER 36 -41.885 15.651 28.990 360 1HB SER 36 2HB SER 36 -42.236 12.593 29.129 361 2HB SER 36 1HB SER 36 -41.065 13.364 28.072 362 HG SER 36 HG SER 36 -40.137 14.406 29.878 363 H SER 37 H SER 37 -43.556 16.832 27.860 364 HA SER 37 HA SER 37 -44.901 15.525 25.522 365 1HB SER 37 2HB SER 37 -45.994 17.703 25.232 366 2HB SER 37 1HB SER 37 -46.060 17.212 26.915 367 HG SER 37 HG SER 37 -44.334 19.187 25.731 368 H SER 38 H SER 38 -42.300 17.883 25.782 369 HA SER 38 HA SER 38 -41.794 17.947 22.780 370 1HB SER 38 2HB SER 38 -42.510 20.375 22.683 371 2HB SER 38 1HB SER 38 -43.832 19.276 23.046 372 HG SER 38 HG SER 38 -42.511 21.146 24.764 373 H GLY 39 H GLY 39 -41.042 19.657 25.737 374 1HA GLY 39 2HA GLY 39 -38.628 20.891 25.957 375 2HA GLY 39 1HA GLY 39 -39.005 21.275 24.270
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